#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j0j n VAL 36 N 0.00 0.00 -3.65 5.15 3.14 -1.26 -2.72 118.33 118.98 2j0j n VAL 36 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2j0j n VAL 36 Cb 0.00 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 32.72 2j0j n VAL 36 CO 0.00 0.00 0.00 -0.22 -6.46 0.00 0.00 176.83 170.15 2j0j s LEU 37 N 0.00 -0.03 -0.28 6.55 2.96 -1.25 -5.05 118.68 121.58 2j0j s LEU 37 Ca 0.00 0.05 -0.09 0.00 -0.22 0.00 0.00 54.13 53.87 2j0j s LEU 37 Cb 0.00 1.05 -0.03 0.00 0.50 0.00 0.00 46.19 47.71 2j0j s LEU 37 CO 0.00 -0.01 0.14 -0.75 -1.32 0.00 0.00 176.35 174.41 2j0j s LYS 38 N 0.59 3.71 -0.37 1.98 2.20 -1.26 -2.70 119.74 123.88 2j0j s LYS 38 Ca -0.01 -0.47 -0.09 0.00 -0.36 0.00 0.00 55.97 55.04 2j0j s LYS 38 Cb -0.03 -3.52 0.04 0.00 -1.51 0.00 0.00 37.83 32.80 2j0j s LYS 38 CO -0.12 -0.24 0.19 0.08 -0.36 0.00 0.00 175.35 174.90 2j0j s VAL 39 N 1.68 4.31 0.44 4.02 1.01 -0.68 -4.20 120.40 126.97 2j0j s VAL 39 Ca 0.06 -1.04 -0.23 0.00 0.00 0.00 0.00 61.98 60.77 2j0j s VAL 39 Cb -0.16 -3.46 -0.08 0.00 0.00 0.00 0.00 36.38 32.68 2j0j s VAL 39 CO 0.07 -0.28 1.14 -0.36 0.00 0.00 0.00 175.10 175.68 2j0j s PHE 40 N 1.49 2.97 0.00 5.22 0.40 0.68 -1.86 117.98 126.89 2j0j s PHE 40 Ca 0.01 1.56 0.00 0.00 -0.60 0.00 0.00 56.93 57.90 2j0j s PHE 40 Cb -0.20 -3.33 0.00 0.00 0.51 0.00 0.00 43.02 40.00 2j0j s PHE 40 CO 0.05 -1.31 0.00 -2.39 0.70 0.00 0.00 175.22 172.27 2j0j n HIS 41 N -0.36 -0.42 -1.59 0.36 1.44 -0.30 -0.65 115.22 113.71 2j0j n HIS 41 Ca 0.07 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.84 2j0j n HIS 41 Cb 0.48 0.00 0.12 0.00 0.12 0.00 0.00 29.99 30.71 2j0j n HIS 41 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 2j0j n TYR 42 N 0.00 0.00 -2.58 -1.40 4.02 -1.26 -4.77 117.16 111.17 2j0j n TYR 42 Ca 0.00 -0.88 -0.42 0.00 -0.01 0.00 0.00 57.90 56.58 2j0j n TYR 42 Cb 0.00 -0.16 -0.02 0.00 -0.02 0.00 0.00 39.34 39.14 2j0j n TYR 42 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2j0j s PHE 43 N -2.04 2.66 0.32 -0.72 0.40 -1.26 -4.18 117.98 113.16 2j0j s PHE 43 Ca 0.28 0.51 -0.25 0.00 -0.60 0.00 0.00 56.93 56.86 2j0j s PHE 43 Cb 0.27 -4.50 -0.15 0.00 0.51 0.00 0.00 43.02 39.16 2j0j s PHE 43 CO -0.03 -1.50 0.62 0.39 0.70 0.00 0.00 175.22 175.39 2j0j n GLU 44 N 8.27 0.55 -3.57 0.44 1.02 -1.26 -4.99 120.64 121.10 2j0j n GLU 44 Ca 0.10 0.19 -0.15 0.00 -0.02 0.00 0.00 57.16 57.28 2j0j n GLU 44 Cb 0.49 -1.39 -0.06 0.00 -0.02 0.00 0.00 31.44 30.46 2j0j n GLU 44 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2j0j s ASN 45 N -0.87 -0.62 0.00 1.62 2.47 -1.26 -5.05 114.94 111.23 2j0j s ASN 45 Ca 0.62 0.87 0.00 0.00 0.42 0.00 0.00 52.86 54.77 2j0j s ASN 45 Cb -0.73 0.77 0.00 0.00 -1.45 0.00 0.00 41.25 39.84 2j0j s ASN 45 CO 0.58 -0.44 1.10 -1.54 -3.72 0.00 0.00 177.10 173.09 2j0j n SER 46 N 1.46 3.11 -4.90 -4.21 3.41 -1.26 -4.74 113.62 106.49 2j0j n SER 46 Ca -0.16 -1.80 -0.20 0.00 -0.26 0.00 0.00 58.87 56.45 2j0j n SER 46 Cb 0.57 -0.59 -0.02 0.00 -0.26 0.00 0.00 64.21 63.90 2j0j n SER 46 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2j0j s SER 47 N 1.38 5.42 0.01 4.04 1.04 -1.26 -5.07 113.70 119.26 2j0j s SER 47 Ca 0.00 -0.47 -0.37 0.00 0.48 0.00 0.00 55.95 55.59 2j0j s SER 47 Cb 0.00 -0.92 -0.15 0.00 0.10 0.00 0.00 66.02 65.04 2j0j s SER 47 CO 0.00 -0.46 1.52 1.21 0.98 0.00 0.00 173.24 176.48 2j0j n GLU 48 N -1.50 1.44 -0.00 4.02 4.07 -1.26 -4.86 120.64 122.55 2j0j n GLU 48 Ca 0.00 0.52 0.04 0.00 -0.06 0.00 0.00 57.16 57.67 2j0j n GLU 48 Cb 0.60 -2.22 0.43 0.00 -0.06 0.00 0.00 31.44 30.19 2j0j n GLU 48 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 2j0j h PRO 49 N 5.77 0.53 -1.02 5.31 0.11 -1.98 -1.63 132.00 139.10 2j0j h PRO 49 Ca -0.47 -0.03 0.26 0.00 0.11 0.00 0.00 66.00 65.86 2j0j h PRO 49 Cb 1.31 -0.12 -0.11 0.00 0.11 0.00 0.00 31.00 32.19 2j0j h PRO 49 CO 0.85 0.35 0.63 1.79 -0.21 0.00 0.00 178.00 181.41 2j0j h THR 50 N 0.55 0.53 -0.81 -1.15 1.35 -1.98 -2.47 112.91 108.93 2j0j h THR 50 Ca 0.15 -0.17 -0.52 0.00 -0.55 0.00 0.00 66.41 65.32 2j0j h THR 50 Cb -0.05 -0.03 -0.24 0.00 -1.73 0.00 0.00 68.15 66.10 2j0j h THR 50 CO -0.03 0.09 0.66 0.35 -0.25 0.00 0.00 175.52 176.34 2j0j n THR 51 N -4.79 3.18 -3.21 6.82 -2.24 -0.61 -4.87 114.28 108.56 2j0j n THR 51 Ca 0.27 -2.22 -0.45 0.00 -2.27 0.00 0.00 64.05 59.37 2j0j n THR 51 Cb 0.80 -1.05 -0.05 0.00 -2.10 0.00 0.00 70.33 67.93 2j0j n THR 51 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 2j0j s TRP 52 N -2.99 3.11 0.24 4.78 0.51 -0.93 -4.96 118.94 118.69 2j0j s TRP 52 Ca 0.51 -1.04 -0.01 0.00 -2.12 0.00 0.00 56.10 53.44 2j0j s TRP 52 Cb 0.41 -3.84 -0.03 0.00 -0.81 0.00 0.00 33.47 29.20 2j0j s TRP 52 CO 0.02 -1.14 0.22 0.00 -0.51 0.00 0.00 176.95 175.53 2j0j s ALA 53 N 2.22 1.10 0.11 0.98 0.00 -1.26 -1.14 121.76 123.76 2j0j s ALA 53 Ca 0.08 -1.66 0.08 0.00 0.00 0.00 0.00 51.96 50.47 2j0j s ALA 53 Cb -0.26 1.35 -0.04 0.00 0.00 0.00 0.00 23.12 24.18 2j0j s ALA 53 CO 0.06 -0.65 -0.21 -1.12 0.00 0.00 0.00 175.76 173.84 2j0j s SER 54 N -3.18 2.55 -0.30 0.00 0.01 -0.78 -4.95 113.70 107.05 2j0j s SER 54 Ca 0.37 -0.70 -0.04 0.00 1.31 0.00 0.00 55.95 56.89 2j0j s SER 54 Cb 0.05 -0.14 0.03 0.00 0.21 0.00 0.00 66.02 66.17 2j0j s SER 54 CO 0.15 0.05 0.02 -0.63 0.41 0.00 0.00 173.24 173.24 2j0j s ILE 55 N -1.25 3.30 -0.20 1.44 1.09 -1.26 -1.69 121.20 122.63 2j0j s ILE 55 Ca 0.07 -1.12 -0.01 0.00 -1.10 0.00 0.00 60.65 58.49 2j0j s ILE 55 Cb -0.10 -2.81 0.01 0.00 -1.06 0.00 0.00 42.46 38.50 2j0j s ILE 55 CO 0.04 -0.02 -0.13 -0.63 -0.10 0.00 0.00 174.94 174.11 2j0j s ILE 56 N 1.35 2.68 -0.26 2.92 1.09 -1.10 -1.56 121.20 126.31 2j0j s ILE 56 Ca -0.02 -0.73 -0.27 0.00 -1.10 0.00 0.00 60.65 58.53 2j0j s ILE 56 Cb -0.19 -2.18 0.01 0.00 -1.06 0.00 0.00 42.46 39.05 2j0j s ILE 56 CO -0.00 0.49 0.96 -0.60 -0.10 0.00 0.00 174.94 175.69 2j0j s ARG 57 N 1.35 4.16 -0.00 2.79 3.52 -0.95 -3.93 118.95 125.89 2j0j s ARG 57 Ca 0.05 1.10 0.02 0.00 -0.13 0.00 0.00 55.73 56.76 2j0j s ARG 57 Cb -0.14 -3.67 -0.04 0.00 -1.56 0.00 0.00 34.95 29.54 2j0j s ARG 57 CO -0.08 -0.67 -0.00 -3.38 -0.81 0.00 0.00 175.30 170.36 2j0j s HIS 58 N 3.18 3.07 0.58 5.12 -3.43 -1.10 -2.28 115.29 120.43 2j0j s HIS 58 Ca 0.41 0.07 -0.06 0.00 -0.80 0.00 0.00 55.06 54.68 2j0j s HIS 58 Cb -0.14 -1.67 -0.00 0.00 -1.43 0.00 0.00 32.58 29.34 2j0j s HIS 58 CO 0.09 0.46 0.90 0.20 -2.00 0.00 0.00 174.74 174.39 2j0j s GLY 59 N -1.55 1.59 0.00 -1.38 0.00 -0.65 -2.10 107.32 103.24 2j0j s GLY 59 Ca 0.19 -0.61 0.00 0.00 0.00 0.00 0.00 44.72 44.31 2j0j s GLY 59 CO 0.10 -0.34 0.21 1.34 0.00 0.00 0.00 173.10 174.42 2j0j n ASP 60 N -2.57 0.00 -1.05 1.64 -0.08 -1.26 -2.43 116.55 110.80 2j0j n ASP 60 Ca 0.04 0.21 0.00 0.00 -1.51 0.00 0.00 54.79 53.53 2j0j n ASP 60 Cb 0.57 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.03 2j0j n ASP 60 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2j0j n ALA 61 N -2.10 2.34 -1.90 -1.67 0.00 -1.25 -4.32 120.51 111.60 2j0j n ALA 61 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 2j0j n ALA 61 Cb 0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.40 2j0j n ALA 61 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2j0j s THR 62 N 0.28 3.12 0.42 0.00 2.01 -1.02 -4.87 115.64 115.58 2j0j s THR 62 Ca 0.00 1.01 0.08 0.00 0.31 0.00 0.00 61.69 63.09 2j0j s THR 62 Cb 0.00 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.86 2j0j s THR 62 CO 0.00 0.19 0.45 1.51 -0.69 0.00 0.00 174.62 176.08 2j0j s ASP 63 N -0.11 5.28 0.25 3.53 -4.77 -1.26 -0.77 116.67 118.82 2j0j s ASP 63 Ca 0.52 -0.63 -0.03 0.00 -3.30 0.00 0.00 52.55 49.12 2j0j s ASP 63 Cb -0.37 -0.59 0.45 0.00 -1.09 0.00 0.00 42.92 41.32 2j0j s ASP 63 CO 0.43 -0.70 1.79 0.58 0.70 0.00 0.00 175.17 177.97 2j0j h VAL 64 N 0.88 0.83 -0.21 2.11 2.07 -0.49 -0.79 116.25 120.63 2j0j h VAL 64 Ca -0.41 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 66.93 2j0j h VAL 64 Cb 1.27 0.06 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 2j0j h VAL 64 CO 0.53 0.13 -0.30 -0.09 0.02 0.00 0.00 177.57 177.86 2j0j h ARG 65 N 0.71 -0.31 -0.61 1.57 2.43 -1.52 -2.39 114.38 114.26 2j0j h ARG 65 Ca 0.42 0.02 0.12 0.00 -0.81 0.00 0.00 59.98 59.74 2j0j h ARG 65 Cb 0.49 0.07 -0.11 0.00 -0.42 0.00 0.00 29.97 30.00 2j0j h ARG 65 CO -0.30 -0.21 -0.08 0.78 -1.51 0.00 0.00 179.97 178.66 2j0j h GLY 66 N -0.33 0.54 0.20 2.80 0.00 -1.44 0.33 103.07 105.18 2j0j h GLY 66 Ca 0.12 0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.59 2j0j h GLY 66 CO -0.40 -0.22 -0.29 -2.22 0.00 0.00 0.00 176.54 173.42 2j0j h ILE 67 N 0.05 0.00 -0.68 2.60 1.08 -1.17 -2.33 117.51 117.06 2j0j h ILE 67 Ca 0.30 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.92 2j0j h ILE 67 Cb 0.48 0.00 -0.11 0.00 -3.07 0.00 0.00 36.82 34.13 2j0j h ILE 67 CO -0.57 0.00 0.10 0.40 -0.69 0.00 0.00 178.15 177.39 2j0j h ILE 68 N -0.51 0.51 -0.53 -0.67 2.04 -1.03 -1.65 117.51 115.67 2j0j h ILE 68 Ca -0.02 -0.07 0.09 0.00 1.00 0.00 0.00 64.86 65.86 2j0j h ILE 68 Cb 0.47 0.29 -0.07 0.00 -0.74 0.00 0.00 36.82 36.76 2j0j h ILE 68 CO -0.09 0.04 0.11 -0.61 0.00 0.00 0.00 178.15 177.61 2j0j h GLN 69 N 0.21 0.25 -0.03 2.37 4.15 -0.10 -1.95 115.11 120.00 2j0j h GLN 69 Ca 0.37 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.77 2j0j h GLN 69 Cb 0.62 -0.06 -0.00 0.00 0.21 0.00 0.00 27.48 28.25 2j0j h GLN 69 CO -0.51 0.16 0.01 0.87 -1.93 0.00 0.00 178.83 177.43 2j0j h LYS 70 N 0.25 0.05 -0.22 1.69 1.79 -0.77 -3.18 116.57 116.18 2j0j h LYS 70 Ca 0.27 -0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.78 2j0j h LYS 70 Cb 0.37 -0.01 -0.05 0.00 -1.58 0.00 0.00 32.23 30.96 2j0j h LYS 70 CO -0.34 0.24 -0.11 0.82 -1.08 0.00 0.00 179.45 178.98 2j0j h ILE 71 N -0.15 0.66 0.00 1.86 2.04 -0.84 -1.50 117.51 119.58 2j0j h ILE 71 Ca 0.01 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 2j0j h ILE 71 Cb 0.21 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 2j0j h ILE 71 CO -0.00 0.00 -0.17 -0.37 0.00 0.00 0.00 178.15 177.61 2j0j h VAL 72 N -0.08 0.54 0.00 1.67 -1.51 -1.60 -2.23 116.25 113.05 2j0j h VAL 72 Ca 0.12 -0.83 -0.01 0.00 -1.23 0.00 0.00 66.70 64.75 2j0j h VAL 72 Cb 0.26 1.56 -0.00 0.00 -2.13 0.00 0.00 31.29 30.98 2j0j h VAL 72 CO -0.28 0.17 -0.05 0.44 -1.23 0.00 0.00 177.57 176.62 2j0j h ASP 73 N 0.00 0.00 0.01 4.19 3.45 -1.27 -1.76 116.42 121.04 2j0j h ASP 73 Ca -0.00 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.46 2j0j h ASP 73 Cb 0.54 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.31 2j0j h ASP 73 CO 0.02 0.05 -0.00 0.00 -1.57 0.00 0.00 179.24 177.74 2j0j n HIS 75 N -4.17 0.41 -2.23 0.00 8.25 -0.92 -4.98 115.22 111.58 2j0j n HIS 75 Ca -0.03 -0.75 -0.20 0.00 -0.26 0.00 0.00 57.72 56.47 2j0j n HIS 75 Cb 0.09 -0.16 -0.03 0.00 1.12 0.00 0.00 29.99 31.02 2j0j n HIS 75 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2j0j n LYS 76 N -0.53 -1.59 -1.83 -0.41 4.76 -1.08 -4.75 118.16 112.72 2j0j n LYS 76 Ca 0.14 1.04 -0.42 0.00 -2.87 0.00 0.00 58.31 56.20 2j0j n LYS 76 Cb 0.60 -5.62 -0.02 0.00 -1.84 0.00 0.00 35.03 28.14 2j0j n LYS 76 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2j0j s VAL 77 N -2.97 2.25 -0.04 -0.18 1.01 -0.71 -4.91 120.40 114.85 2j0j s VAL 77 Ca 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 61.98 62.16 2j0j s VAL 77 Cb 0.00 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 33.25 2j0j s VAL 77 CO 0.00 0.03 -0.03 0.11 0.00 0.00 0.00 175.10 175.20 2j0j h LYS 78 N 5.49 0.00 -4.92 2.72 1.57 -1.91 -3.43 116.57 116.09 2j0j h LYS 78 Ca -0.45 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 57.85 2j0j h LYS 78 Cb 1.21 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.57 2j0j h LYS 78 CO 0.84 0.00 1.46 0.09 -0.57 0.00 0.00 179.45 181.26 2j0j n ASN 79 N -2.99 2.09 0.10 0.86 3.02 -1.26 -4.71 115.26 112.37 2j0j n ASN 79 Ca -0.01 -2.61 -0.05 0.00 -0.03 0.00 0.00 54.58 51.88 2j0j n ASN 79 Cb 0.05 -1.19 0.09 0.00 -0.61 0.00 0.00 39.78 38.12 2j0j n ASN 79 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2j0j h VAL 80 N 5.31 1.44 0.00 2.41 2.07 -2.00 -3.24 116.25 122.24 2j0j h VAL 80 Ca 0.28 -2.23 -0.00 0.00 0.82 0.00 0.00 66.70 65.56 2j0j h VAL 80 Cb 0.78 2.19 -0.00 0.00 -1.52 0.00 0.00 31.29 32.74 2j0j h VAL 80 CO 1.68 0.65 -0.01 0.00 0.02 0.00 0.00 177.57 179.92 2j0j h ALA 81 N 1.18 1.70 0.00 1.67 0.00 -1.97 -2.83 119.26 119.01 2j0j h ALA 81 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2j0j h ALA 81 Cb 1.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2j0j h ALA 81 CO 0.10 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.36 2j0j s TYR 83 N -3.13 3.45 0.27 0.00 1.51 -1.07 -1.91 117.35 116.47 2j0j s TYR 83 Ca 0.06 0.74 0.01 0.00 -1.01 0.00 0.00 57.07 56.87 2j0j s TYR 83 Cb 0.10 -2.17 -0.03 0.00 -0.11 0.00 0.00 41.96 39.75 2j0j s TYR 83 CO 0.33 0.24 0.26 0.20 -1.11 0.00 0.00 175.55 175.47 2j0j s GLY 84 N -2.74 1.71 -0.17 0.71 0.00 0.61 -4.85 107.32 102.59 2j0j s GLY 84 Ca 0.45 -1.75 0.01 0.00 0.00 0.00 0.00 44.72 43.42 2j0j s GLY 84 CO 0.26 -1.31 -0.12 -2.27 0.00 0.00 0.00 173.10 169.65 2j0j s LEU 85 N -3.24 1.97 0.02 0.66 2.96 -1.26 -1.20 118.68 118.59 2j0j s LEU 85 Ca 0.37 -0.69 0.02 0.00 -0.22 0.00 0.00 54.13 53.61 2j0j s LEU 85 Cb 0.04 -1.19 -0.04 0.00 0.50 0.00 0.00 46.19 45.50 2j0j s LEU 85 CO 0.19 -0.11 0.02 -0.60 -1.32 0.00 0.00 176.35 174.53 2j0j s ARG 86 N 1.45 2.80 -0.06 1.98 3.52 -0.29 -1.26 118.95 127.08 2j0j s ARG 86 Ca 0.02 -0.64 0.03 0.00 -0.13 0.00 0.00 55.73 55.01 2j0j s ARG 86 Cb -0.15 -2.68 0.01 0.00 -1.56 0.00 0.00 34.95 30.57 2j0j s ARG 86 CO -0.09 0.61 -0.13 -1.17 -0.81 0.00 0.00 175.30 173.70 2j0j s LEU 87 N -1.80 1.71 0.01 -0.88 2.96 0.11 -0.82 118.68 119.98 2j0j s LEU 87 Ca 0.22 -0.31 0.01 0.00 -0.22 0.00 0.00 54.13 53.83 2j0j s LEU 87 Cb -0.12 -0.86 -0.01 0.00 0.50 0.00 0.00 46.19 45.70 2j0j s LEU 87 CO 0.13 0.06 -0.04 -0.55 -1.32 0.00 0.00 176.35 174.63 2j0j s SER 88 N 0.54 0.49 0.83 3.68 0.15 0.04 -0.24 113.70 119.19 2j0j s SER 88 Ca -0.13 -0.25 -0.12 0.00 0.70 0.00 0.00 55.95 56.15 2j0j s SER 88 Cb -0.15 -0.00 0.09 0.00 -1.71 0.00 0.00 66.02 64.25 2j0j s SER 88 CO 0.04 -0.07 1.11 -2.28 1.20 0.00 0.00 173.24 173.23 2j0j s HIS 89 N -0.62 2.74 -0.25 3.44 2.46 -1.25 -1.03 115.29 120.77 2j0j s HIS 89 Ca -0.04 1.06 -0.01 0.00 0.47 0.00 0.00 55.06 56.54 2j0j s HIS 89 Cb -0.05 -3.21 -0.17 0.00 -0.13 0.00 0.00 32.58 29.03 2j0j s HIS 89 CO -0.00 -1.95 -0.21 1.28 -2.47 0.00 0.00 174.74 171.39 2j0j n LEU 90 N -3.53 2.82 0.09 8.88 4.77 -0.90 -4.50 117.00 124.63 2j0j n LEU 90 Ca 0.07 -0.06 -0.06 0.00 -0.03 0.00 0.00 56.01 55.93 2j0j n LEU 90 Cb 0.57 -0.91 0.07 0.00 -2.33 0.00 0.00 43.42 40.83 2j0j n LEU 90 CO 0.57 0.88 0.39 1.56 -1.33 0.00 0.00 177.39 179.47 2j0j h GLN 91 N -0.13 0.21 -6.65 3.23 4.20 -1.96 -3.44 115.11 110.58 2j0j h GLN 91 Ca -0.59 -0.18 -0.67 0.00 0.06 0.00 0.00 58.65 57.28 2j0j h GLN 91 Cb 1.87 0.04 -0.17 0.00 0.30 0.00 0.00 27.48 29.51 2j0j h GLN 91 CO -0.12 0.83 -0.78 0.45 -0.67 0.00 0.00 178.83 178.54 2j0j s SER 92 N -6.90 4.09 -0.03 1.46 0.15 -1.26 -5.05 113.70 106.15 2j0j s SER 92 Ca -0.03 -0.50 0.17 0.00 0.70 0.00 0.00 55.95 56.29 2j0j s SER 92 Cb 0.11 -0.66 0.52 0.00 -1.71 0.00 0.00 66.02 64.28 2j0j s SER 92 CO 0.81 0.18 1.44 -0.62 1.20 0.00 0.00 173.24 176.24 2j0j n GLU 93 N 0.73 2.99 -1.74 5.44 1.02 -1.26 -4.00 120.64 123.82 2j0j n GLU 93 Ca -0.15 -2.48 -0.34 0.00 -0.02 0.00 0.00 57.16 54.17 2j0j n GLU 93 Cb 0.53 -1.53 0.06 0.00 -0.02 0.00 0.00 31.44 30.47 2j0j n GLU 93 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2j0j s GLU 94 N -1.29 2.64 0.01 3.49 -1.05 -1.26 -5.00 118.70 116.24 2j0j s GLU 94 Ca 0.39 1.67 0.00 0.00 -0.15 0.00 0.00 54.97 56.88 2j0j s GLU 94 Cb 0.22 -1.90 -0.01 0.00 -0.44 0.00 0.00 34.13 32.00 2j0j s GLU 94 CO 0.23 -1.43 -0.03 0.54 0.95 0.00 0.00 175.26 175.52 2j0j s VAL 95 N -1.96 0.15 -0.10 1.83 0.11 -1.26 -3.92 120.40 115.26 2j0j s VAL 95 Ca 0.73 -0.53 0.02 0.00 -2.93 0.00 0.00 61.98 59.27 2j0j s VAL 95 Cb -0.27 -0.22 0.01 0.00 -1.53 0.00 0.00 36.38 34.37 2j0j s VAL 95 CO 0.39 -0.24 -0.17 -1.00 -3.33 0.00 0.00 175.10 170.76 2j0j s HIS 96 N -0.78 2.04 -0.25 1.54 3.76 0.66 -4.91 115.29 117.35 2j0j s HIS 96 Ca -0.08 -0.92 -0.16 0.00 -0.15 0.00 0.00 55.06 53.75 2j0j s HIS 96 Cb -0.06 -1.44 -0.03 0.00 1.11 0.00 0.00 32.58 32.16 2j0j s HIS 96 CO -0.00 -0.45 0.43 -1.58 -0.85 0.00 0.00 174.74 172.29 2j0j s TRP 97 N 0.81 3.29 -0.22 1.40 0.52 -1.26 0.06 118.94 123.53 2j0j s TRP 97 Ca -0.10 0.55 -0.19 0.00 0.02 0.00 0.00 56.10 56.38 2j0j s TRP 97 Cb -0.16 -2.61 -0.03 0.00 -1.15 0.00 0.00 33.47 29.53 2j0j s TRP 97 CO 0.01 -0.18 0.56 -0.51 0.02 0.00 0.00 176.95 176.85 2j0j s LEU 98 N 1.93 4.11 0.16 2.99 1.43 -0.39 -4.91 118.68 124.00 2j0j s LEU 98 Ca 0.18 0.68 -0.30 0.00 -1.03 0.00 0.00 54.13 53.66 2j0j s LEU 98 Cb -0.15 -2.76 -0.08 0.00 0.03 0.00 0.00 46.19 43.23 2j0j s LEU 98 CO 0.09 -0.26 1.21 -2.28 0.23 0.00 0.00 176.35 175.34 2j0j s HIS 99 N 2.01 3.42 0.05 0.29 2.46 -1.26 -4.46 115.29 117.80 2j0j s HIS 99 Ca 0.25 1.38 -0.08 0.00 0.47 0.00 0.00 55.06 57.08 2j0j s HIS 99 Cb -0.16 -3.44 0.00 0.00 -0.13 0.00 0.00 32.58 28.86 2j0j s HIS 99 CO 0.09 -1.26 0.44 1.28 -2.47 0.00 0.00 174.74 172.82 2j0j n LEU 100 N 2.83 -0.27 -0.12 8.88 4.77 -1.26 -1.30 117.00 130.52 2j0j n LEU 100 Ca 0.05 0.50 -0.13 0.00 -0.03 0.00 0.00 56.01 56.41 2j0j n LEU 100 Cb 0.45 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.44 2j0j n LEU 100 CO 0.56 -0.42 0.58 0.44 -1.33 0.00 0.00 177.39 177.21 2j0j h ASP 101 N 0.00 0.94 -1.40 -1.43 3.32 -1.96 -0.99 116.42 114.90 2j0j h ASP 101 Ca 0.06 -0.45 -0.76 0.00 0.02 0.00 0.00 57.03 55.89 2j0j h ASP 101 Cb 0.13 -0.26 0.02 0.00 0.22 0.00 0.00 39.33 39.44 2j0j h ASP 101 CO -0.27 1.20 0.70 0.23 -1.72 0.00 0.00 179.24 179.37 2j0j n MET 102 N -4.13 0.80 -2.45 3.56 2.81 -0.42 -4.54 117.12 112.74 2j0j n MET 102 Ca -0.02 0.29 -0.40 0.00 -1.81 0.00 0.00 57.70 55.76 2j0j n MET 102 Cb 0.51 -1.91 -0.04 0.00 -0.71 0.00 0.00 33.22 31.07 2j0j n MET 102 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2j0j s GLY 103 N 2.54 3.04 0.21 3.03 0.00 -1.26 -1.82 107.32 113.06 2j0j s GLY 103 Ca 0.97 0.91 -0.10 0.00 0.00 0.00 0.00 44.72 46.50 2j0j s GLY 103 CO 0.65 1.54 1.70 -2.08 0.00 0.00 0.00 173.10 174.92 2j0j h VAL 104 N 3.15 0.64 -0.12 1.40 2.07 -1.23 -1.51 116.25 120.66 2j0j h VAL 104 Ca -0.47 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 66.99 2j0j h VAL 104 Cb 1.21 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 2j0j h VAL 104 CO 0.67 0.05 -0.32 0.28 0.02 0.00 0.00 177.57 178.27 2j0j h SER 105 N 0.26 -1.04 0.31 0.57 0.02 -1.75 0.22 113.55 112.14 2j0j h SER 105 Ca 0.31 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.39 2j0j h SER 105 Cb 0.47 0.41 0.00 0.00 0.14 0.00 0.00 62.40 63.42 2j0j h SER 105 CO -0.40 -0.28 0.00 0.78 -1.14 0.00 0.00 176.83 175.79 2j0j h ASN 106 N -0.32 0.00 0.06 3.07 4.21 -1.85 -1.61 115.58 119.14 2j0j h ASN 106 Ca 0.02 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.53 2j0j h ASN 106 Cb 0.39 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.59 2j0j h ASN 106 CO -0.28 0.00 -0.03 0.58 -1.29 0.00 0.00 177.43 176.41 2j0j h VAL 107 N 0.00 1.15 0.23 2.81 2.07 -0.00 -2.34 116.25 120.17 2j0j h VAL 107 Ca 0.00 -1.59 0.00 0.00 0.82 0.00 0.00 66.70 65.94 2j0j h VAL 107 Cb 0.16 2.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 2j0j h VAL 107 CO 0.00 0.35 -0.51 0.03 0.02 0.00 0.00 177.57 177.46 2j0j h ARG 108 N -0.89 -0.79 -0.85 1.57 2.47 -0.27 -2.24 114.38 113.38 2j0j h ARG 108 Ca -0.01 0.05 0.13 0.00 -1.26 0.00 0.00 59.98 58.90 2j0j h ARG 108 Cb 0.63 0.18 -0.14 0.00 -1.65 0.00 0.00 29.97 28.98 2j0j h ARG 108 CO 0.01 -0.52 -0.40 0.93 0.56 0.00 0.00 179.97 180.55 2j0j h GLU 109 N -0.81 -0.06 0.00 0.04 4.39 -1.44 0.34 114.58 117.03 2j0j h GLU 109 Ca -0.02 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.61 2j0j h GLU 109 Cb 0.78 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.43 2j0j h GLU 109 CO -0.21 -0.04 -0.33 1.57 -1.16 0.00 0.00 179.01 178.84 2j0j h LYS 110 N -0.06 0.00 0.00 2.33 2.10 -1.04 -1.44 116.57 118.46 2j0j h LYS 110 Ca 0.29 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.87 2j0j h LYS 110 Cb 0.57 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.89 2j0j h LYS 110 CO -0.88 0.33 -0.95 1.19 -2.00 0.00 0.00 179.45 177.14 2j0j n PHE 111 N -3.42 0.54 0.28 0.07 3.72 -0.88 -4.26 117.46 113.52 2j0j n PHE 111 Ca 0.00 0.24 0.00 0.00 -0.05 0.00 0.00 57.45 57.64 2j0j n PHE 111 Cb 0.51 -0.74 0.00 0.00 -0.94 0.00 0.00 39.48 38.31 2j0j n PHE 111 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 2j0j n GLU 112 N -4.51 0.28 0.00 -1.08 2.13 0.12 -0.20 120.64 117.38 2j0j n GLU 112 Ca -0.17 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.78 2j0j n GLU 112 Cb 0.46 -1.14 0.34 0.00 0.27 0.00 0.00 31.44 31.37 2j0j n GLU 112 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2j0j n LEU 113 N 0.36 2.10 0.02 4.31 0.00 -0.54 -4.59 117.00 118.65 2j0j n LEU 113 Ca 0.00 -0.70 -0.02 0.00 0.00 0.00 0.00 56.01 55.29 2j0j n LEU 113 Cb 0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 43.42 43.48 2j0j n LEU 113 CO 0.00 0.35 -0.20 0.00 0.00 0.00 0.00 177.39 177.54 2j0j n ALA 114 N 0.62 2.58 -2.37 1.96 0.00 0.72 -5.09 120.51 118.93 2j0j n ALA 114 Ca 0.17 -0.17 -0.29 0.00 0.00 0.00 0.00 53.44 53.14 2j0j n ALA 114 Cb 0.46 0.23 -0.15 0.00 0.00 0.00 0.00 19.45 19.99 2j0j n ALA 114 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2j0j s HIS 115 N -2.17 2.19 0.54 0.00 3.76 -1.25 -5.13 115.29 113.24 2j0j s HIS 115 Ca -0.06 -0.41 -0.19 0.00 -0.15 0.00 0.00 55.06 54.25 2j0j s HIS 115 Cb 0.01 -1.34 -0.09 0.00 1.11 0.00 0.00 32.58 32.27 2j0j s HIS 115 CO 0.09 0.07 0.65 -2.30 -0.85 0.00 0.00 174.74 172.40 2j0j n PRO 116 N 2.02 0.66 0.00 8.40 -0.02 -1.26 -4.48 135.00 140.32 2j0j n PRO 116 Ca -0.17 0.25 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 2j0j n PRO 116 Cb 0.52 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 2j0j n PRO 116 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2j0j n PRO 117 N -0.14 0.00 0.01 0.52 -0.04 -1.26 -1.42 135.00 132.67 2j0j n PRO 117 Ca 0.12 0.21 -0.01 0.00 -0.04 0.00 0.00 63.50 63.78 2j0j n PRO 117 Cb 0.46 -1.52 -0.10 0.00 -0.04 0.00 0.00 33.50 32.31 2j0j n PRO 117 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2j0j n GLU 118 N -1.19 0.63 -0.23 0.54 1.02 -1.26 -3.75 120.64 116.40 2j0j n GLU 118 Ca 0.00 0.18 0.12 0.00 -0.02 0.00 0.00 57.16 57.44 2j0j n GLU 118 Cb 0.02 -1.76 0.24 0.00 -0.02 0.00 0.00 31.44 29.91 2j0j n GLU 118 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 2j0j n GLU 119 N -2.85 2.56 -4.38 3.49 0.28 -0.51 -4.89 120.64 114.35 2j0j n GLU 119 Ca -0.12 -2.37 -0.34 0.00 -0.16 0.00 0.00 57.16 54.17 2j0j n GLU 119 Cb 0.86 -1.53 -0.11 0.00 1.43 0.00 0.00 31.44 32.10 2j0j n GLU 119 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 2j0j s TRP 120 N -1.38 3.10 -0.08 -1.84 0.52 -1.20 -2.11 118.94 115.94 2j0j s TRP 120 Ca 0.41 0.01 0.03 0.00 0.02 0.00 0.00 56.10 56.56 2j0j s TRP 120 Cb 0.23 -1.86 0.01 0.00 -1.15 0.00 0.00 33.47 30.70 2j0j s TRP 120 CO 0.32 0.26 -0.16 0.21 0.02 0.00 0.00 176.95 177.60 2j0j s LYS 121 N -0.35 2.16 -0.22 4.98 2.20 -0.19 -4.94 119.74 123.37 2j0j s LYS 121 Ca 0.07 -0.57 -0.06 0.00 -0.36 0.00 0.00 55.97 55.05 2j0j s LYS 121 Cb -0.12 -1.73 -0.03 0.00 -1.51 0.00 0.00 37.83 34.44 2j0j s LYS 121 CO 0.02 0.06 0.03 0.71 -0.36 0.00 0.00 175.35 175.80 2j0j s TYR 122 N 0.63 3.07 -0.05 4.03 1.51 -1.26 -0.78 117.35 124.49 2j0j s TYR 122 Ca -0.15 -0.43 0.03 0.00 -1.01 0.00 0.00 57.07 55.51 2j0j s TYR 122 Cb -0.16 -2.13 0.01 0.00 -0.11 0.00 0.00 41.96 39.56 2j0j s TYR 122 CO 0.04 -0.26 -0.14 -1.83 -1.11 0.00 0.00 175.55 172.25 2j0j s GLU 123 N 1.18 1.66 0.26 -0.62 -1.05 0.00 -0.23 118.70 119.90 2j0j s GLU 123 Ca 0.03 -0.47 -0.29 0.00 -0.15 0.00 0.00 54.97 54.09 2j0j s GLU 123 Cb -0.14 -1.40 -0.09 0.00 -0.44 0.00 0.00 34.13 32.05 2j0j s GLU 123 CO 0.02 0.11 1.22 -1.17 0.95 0.00 0.00 175.26 176.39 2j0j s LEU 124 N 0.39 4.47 0.22 1.83 2.96 0.18 -1.14 118.68 127.59 2j0j s LEU 124 Ca -0.10 2.42 -0.10 0.00 -0.22 0.00 0.00 54.13 56.13 2j0j s LEU 124 Cb -0.13 -3.63 -0.01 0.00 0.50 0.00 0.00 46.19 42.92 2j0j s LEU 124 CO 0.03 -0.38 0.38 -0.13 -1.32 0.00 0.00 176.35 174.93 2j0j s ARG 125 N -1.07 1.39 -0.34 1.98 0.52 -0.34 -4.62 118.95 116.48 2j0j s ARG 125 Ca 0.50 -1.27 -0.17 0.00 -0.52 0.00 0.00 55.73 54.26 2j0j s ARG 125 Cb -0.35 0.42 -0.01 0.00 0.52 0.00 0.00 34.95 35.53 2j0j s ARG 125 CO 0.43 -0.55 0.47 0.42 0.02 0.00 0.00 175.30 176.09 2j0j s ILE 126 N -4.02 5.06 -0.08 1.52 1.01 -1.26 -0.28 121.20 123.14 2j0j s ILE 126 Ca 0.23 0.31 0.03 0.00 0.00 0.00 0.00 60.65 61.22 2j0j s ILE 126 Cb 0.01 -3.91 -0.07 0.00 0.01 0.00 0.00 42.46 38.51 2j0j s ILE 126 CO 0.07 -0.15 -0.05 -1.14 0.00 0.00 0.00 174.94 173.67 2j0j n ARG 127 N 5.63 1.09 -3.67 2.79 0.63 -0.80 -4.96 116.66 117.37 2j0j n ARG 127 Ca -0.06 0.03 -0.39 0.00 -0.92 0.00 0.00 57.85 56.52 2j0j n ARG 127 Cb 0.49 -1.18 -0.11 0.00 0.45 0.00 0.00 32.46 32.11 2j0j n ARG 127 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2j0j s TYR 128 N -2.18 3.37 -0.06 -0.14 1.51 -1.17 -5.05 117.35 113.62 2j0j s TYR 128 Ca -0.09 -1.70 -0.18 0.00 -1.01 0.00 0.00 57.07 54.09 2j0j s TYR 128 Cb 0.03 -2.87 -0.05 0.00 -0.11 0.00 0.00 41.96 38.96 2j0j s TYR 128 CO 0.24 -0.85 0.48 -0.51 -1.11 0.00 0.00 175.55 173.79 2j0j s LEU 129 N 1.36 4.36 0.99 -1.29 1.43 -1.26 -4.42 118.68 119.85 2j0j s LEU 129 Ca 0.03 0.93 -0.13 0.00 -1.03 0.00 0.00 54.13 53.93 2j0j s LEU 129 Cb -0.22 -2.71 0.19 0.00 0.03 0.00 0.00 46.19 43.47 2j0j s LEU 129 CO 0.01 0.11 1.10 -2.84 0.23 0.00 0.00 176.35 174.96 2j0j s PRO 130 N -0.01 0.47 0.45 1.29 0.02 -1.26 -4.54 135.00 131.42 2j0j s PRO 130 Ca 0.26 0.42 0.24 0.00 0.02 0.00 0.00 61.00 61.95 2j0j s PRO 130 Cb -0.16 -1.75 1.00 0.00 0.02 0.00 0.00 34.50 33.61 2j0j s PRO 130 CO 0.12 -2.68 1.86 -0.22 -0.33 0.00 0.00 177.00 175.76 2j0j h LYS 131 N -1.85 0.00 -0.77 5.54 1.63 -1.98 -2.68 116.57 116.46 2j0j h LYS 131 Ca -0.54 0.00 -0.51 0.00 -0.85 0.00 0.00 60.65 58.75 2j0j h LYS 131 Cb 1.33 0.00 -0.43 0.00 -0.60 0.00 0.00 32.23 32.54 2j0j h LYS 131 CO 0.58 0.22 -0.86 0.41 -3.45 0.00 0.00 179.45 176.36 2j0j n GLY 132 N 0.00 5.74 0.37 5.01 0.00 -1.26 -4.79 105.19 110.27 2j0j n GLY 132 Ca -0.00 -2.46 0.23 0.00 0.00 0.00 0.00 46.02 43.79 2j0j n GLY 132 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2j0j h PHE 133 N 2.27 0.83 0.19 1.61 -5.15 -1.84 -0.52 116.94 114.33 2j0j h PHE 133 Ca 0.30 0.03 -0.01 0.00 -0.20 0.00 0.00 57.97 58.09 2j0j h PHE 133 Cb 1.46 -0.23 0.00 0.00 0.22 0.00 0.00 35.95 37.40 2j0j h PHE 133 CO 0.80 -0.04 -0.09 -0.07 -2.00 0.00 0.00 178.31 176.91 2j0j h LEU 134 N 0.39 -0.22 -0.09 2.10 3.38 -1.94 -0.62 115.31 118.31 2j0j h LEU 134 Ca 0.68 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.55 2j0j h LEU 134 Cb 1.60 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 42.35 2j0j h LEU 134 CO -0.45 0.02 -0.28 0.78 0.09 0.00 0.00 178.44 178.59 2j0j h ASN 135 N -0.46 -0.85 -0.68 -0.43 -0.26 -1.55 -1.37 115.58 109.98 2j0j h ASN 135 Ca -0.03 0.13 0.12 0.00 -0.56 0.00 0.00 56.30 55.96 2j0j h ASN 135 Cb 0.35 0.36 -0.13 0.00 -1.06 0.00 0.00 38.32 37.85 2j0j h ASN 135 CO 0.04 -0.33 -0.32 -0.61 -1.06 0.00 0.00 177.43 175.16 2j0j h GLN 136 N -0.37 -0.11 0.00 0.81 5.75 -1.41 -1.70 115.11 118.09 2j0j h GLN 136 Ca 0.09 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.57 2j0j h GLN 136 Cb 0.50 0.02 -0.00 0.00 1.07 0.00 0.00 27.48 29.07 2j0j h GLN 136 CO -0.30 -0.07 -0.10 0.74 -2.65 0.00 0.00 178.83 176.44 2j0j h PHE 137 N -0.11 0.00 -0.41 3.99 0.05 -0.63 -1.73 116.94 118.11 2j0j h PHE 137 Ca 0.27 0.00 0.12 0.00 3.82 0.00 0.00 57.97 62.18 2j0j h PHE 137 Cb 0.56 0.00 -0.02 0.00 2.00 0.00 0.00 35.95 38.49 2j0j h PHE 137 CO -0.67 0.10 0.38 1.15 -0.18 0.00 0.00 178.31 179.09 2j0j h THR 138 N 0.00 0.50 -0.55 -1.55 2.02 -0.28 0.14 112.91 113.19 2j0j h THR 138 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2j0j h THR 138 Cb 0.53 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2j0j h THR 138 CO 0.01 0.00 0.00 -0.62 0.37 0.00 0.00 175.52 175.28 2j0j n GLU 139 N -3.93 2.69 -3.20 6.66 1.02 -0.65 -4.41 120.64 118.82 2j0j n GLU 139 Ca 0.07 -2.38 -0.23 0.00 -0.02 0.00 0.00 57.16 54.60 2j0j n GLU 139 Cb 0.56 -1.46 -0.06 0.00 -0.02 0.00 0.00 31.44 30.47 2j0j n GLU 139 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2j0j n ASP 140 N 1.23 1.14 -0.32 1.62 4.64 0.48 -4.99 116.55 120.36 2j0j n ASP 140 Ca 0.19 -2.96 0.10 0.00 -1.38 0.00 0.00 54.79 50.75 2j0j n ASP 140 Cb 0.55 -0.63 0.21 0.00 -1.04 0.00 0.00 41.12 40.21 2j0j n ASP 140 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2j0j n LYS 141 N 0.86 -0.08 -0.22 -0.67 4.01 -1.22 -0.98 118.16 119.86 2j0j n LYS 141 Ca 0.24 1.38 -0.06 0.00 -0.51 0.00 0.00 58.31 59.37 2j0j n LYS 141 Cb 0.54 -2.14 0.10 0.00 -0.51 0.00 0.00 35.03 33.02 2j0j n LYS 141 CO 0.00 0.00 0.00 -1.35 -1.11 0.00 0.00 177.40 174.94 2j0j h PRO 142 N 0.00 1.05 -0.14 1.97 0.11 -1.89 -1.35 132.00 131.76 2j0j h PRO 142 Ca 0.51 -0.23 -0.02 0.00 0.11 0.00 0.00 66.00 66.36 2j0j h PRO 142 Cb 0.95 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.90 2j0j h PRO 142 CO -0.89 0.92 -0.01 1.15 -0.21 0.00 0.00 178.00 178.96 2j0j h THR 143 N 1.01 1.27 -0.62 -1.15 2.02 -1.39 0.27 112.91 114.31 2j0j h THR 143 Ca 0.22 -0.88 0.05 0.00 0.77 0.00 0.00 66.41 66.57 2j0j h THR 143 Cb 0.32 1.58 -0.05 0.00 -1.74 0.00 0.00 68.15 68.26 2j0j h THR 143 CO -0.00 0.26 0.34 0.25 0.37 0.00 0.00 175.52 176.74 2j0j h LEU 144 N -0.03 0.52 0.51 2.58 5.85 -1.08 0.64 115.31 124.30 2j0j h LEU 144 Ca 0.04 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2j0j h LEU 144 Cb 0.40 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 2j0j h LEU 144 CO 0.01 0.35 -0.30 0.78 -0.34 0.00 0.00 178.44 178.94 2j0j h ASN 145 N 0.65 -0.74 -0.67 1.25 4.21 -1.18 -0.32 115.58 118.77 2j0j h ASN 145 Ca 0.27 0.04 0.14 0.00 1.21 0.00 0.00 56.30 57.97 2j0j h ASN 145 Cb 0.14 0.22 -0.11 0.00 -1.12 0.00 0.00 38.32 37.44 2j0j h ASN 145 CO -0.16 -0.48 0.01 0.15 -1.29 0.00 0.00 177.43 175.67 2j0j h PHE 146 N -0.76 -0.03 -0.62 1.19 3.57 0.37 -0.73 116.94 119.93 2j0j h PHE 146 Ca -0.06 0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.40 2j0j h PHE 146 Cb 0.62 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 2j0j h PHE 146 CO -0.09 -0.19 0.06 0.35 -2.23 0.00 0.00 178.31 176.22 2j0j h PHE 147 N 0.12 1.14 0.55 0.41 -0.00 0.42 0.33 116.94 119.90 2j0j h PHE 147 Ca 0.36 -0.17 -0.02 0.00 -0.00 0.00 0.00 57.97 58.13 2j0j h PHE 147 Cb 0.60 -0.31 -0.00 0.00 -0.00 0.00 0.00 35.95 36.24 2j0j h PHE 147 CO -0.38 0.98 -0.34 -0.92 -0.00 0.00 0.00 178.31 177.66 2j0j h TYR 148 N 0.97 -0.89 -0.74 0.41 3.20 -0.21 -1.10 116.97 118.61 2j0j h TYR 148 Ca 0.18 -0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.20 2j0j h TYR 148 Cb 0.49 0.32 -0.11 0.00 1.54 0.00 0.00 36.73 38.96 2j0j h TYR 148 CO 0.04 -0.51 0.19 1.96 -1.64 0.00 0.00 178.16 178.19 2j0j h GLN 149 N -0.84 0.27 -0.01 1.82 1.08 -0.92 -1.22 115.11 115.29 2j0j h GLN 149 Ca -0.07 -0.02 0.03 0.00 -1.45 0.00 0.00 58.65 57.14 2j0j h GLN 149 Cb 0.68 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 28.02 2j0j h GLN 149 CO 0.07 0.18 -0.16 0.37 -0.95 0.00 0.00 178.83 178.33 2j0j h GLN 150 N 0.28 -0.26 -0.29 1.46 4.15 -0.66 -2.92 115.11 116.88 2j0j h GLN 150 Ca 0.42 0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.82 2j0j h GLN 150 Cb 0.71 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 2j0j h GLN 150 CO -0.50 -0.17 0.04 0.28 -1.93 0.00 0.00 178.83 176.55 2j0j h VAL 151 N -0.26 1.23 -0.63 2.39 2.07 -0.48 -2.92 116.25 117.66 2j0j h VAL 151 Ca 0.06 -0.81 0.13 0.00 0.82 0.00 0.00 66.70 66.90 2j0j h VAL 151 Cb 0.34 1.21 -0.11 0.00 -1.52 0.00 0.00 31.29 31.22 2j0j h VAL 151 CO -0.17 0.26 -0.02 0.50 0.02 0.00 0.00 177.57 178.17 2j0j h LYS 152 N 0.29 0.10 -0.87 1.57 3.64 -1.27 0.35 116.57 120.37 2j0j h LYS 152 Ca 0.09 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2j0j h LYS 152 Cb 0.35 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.10 2j0j h LYS 152 CO 0.01 0.06 0.57 -0.97 -2.27 0.00 0.00 179.45 176.85 2j0j h ASN 153 N 0.10 0.97 0.21 4.20 -1.24 -1.34 0.50 115.58 118.99 2j0j h ASN 153 Ca 0.33 -0.02 -0.22 0.00 0.71 0.00 0.00 56.30 57.10 2j0j h ASN 153 Cb 0.53 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 39.36 2j0j h ASN 153 CO -0.55 0.69 -0.90 0.44 -1.29 0.00 0.00 177.43 175.82 2j0j h ASP 154 N 1.14 0.63 -0.07 1.15 3.32 -0.83 -1.09 116.42 120.68 2j0j h ASP 154 Ca 0.33 -0.48 0.04 0.00 0.02 0.00 0.00 57.03 56.95 2j0j h ASP 154 Cb -0.07 -0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.24 2j0j h ASP 154 CO -0.09 1.26 -0.24 0.22 -1.72 0.00 0.00 179.24 178.68 2j0j h TYR 155 N 0.30 -0.63 -0.36 4.55 3.20 0.25 0.21 116.97 124.50 2j0j h TYR 155 Ca -0.07 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.86 2j0j h TYR 155 Cb 1.52 0.29 -0.02 0.00 1.54 0.00 0.00 36.73 40.06 2j0j h TYR 155 CO 0.07 -0.32 0.24 0.52 -1.64 0.00 0.00 178.16 177.03 2j0j h MET 156 N -0.33 0.31 0.02 1.82 2.86 0.18 0.16 114.93 119.95 2j0j h MET 156 Ca 0.08 -0.02 -0.32 0.00 -2.06 0.00 0.00 59.70 57.38 2j0j h MET 156 Cb 0.45 -0.07 -0.05 0.00 0.06 0.00 0.00 31.60 31.99 2j0j h MET 156 CO -0.26 0.21 -1.91 1.28 1.06 0.00 0.00 176.91 177.29 2j0j n LEU 157 N -4.48 1.06 -0.11 1.22 4.32 -0.43 -4.59 117.00 113.99 2j0j n LEU 157 Ca 0.04 0.29 -0.20 0.00 -0.02 0.00 0.00 56.01 56.11 2j0j n LEU 157 Cb 0.19 -0.00 -0.09 0.00 -1.62 0.00 0.00 43.42 41.91 2j0j n LEU 157 CO 0.35 0.50 -1.23 -0.62 -1.22 0.00 0.00 177.39 175.17 2j0j n GLU 158 N -3.06 0.48 0.00 3.23 1.02 0.71 -4.89 120.64 118.13 2j0j n GLU 158 Ca -0.23 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 2j0j n GLU 158 Cb 1.07 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 31.16 2j0j n GLU 158 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2j0j n ILE 159 N -3.66 0.00 -0.27 -3.67 -5.35 -1.04 -4.81 119.36 100.56 2j0j n ILE 159 Ca -0.41 -0.11 0.08 0.00 -0.27 0.00 0.00 62.75 62.04 2j0j n ILE 159 Cb 0.84 0.57 0.21 0.00 -1.74 0.00 0.00 39.64 39.52 2j0j n ILE 159 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2j0j h ALA 160 N 0.00 1.01 0.00 -1.28 0.00 -1.22 0.12 119.26 117.89 2j0j h ALA 160 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2j0j h ALA 160 Cb 0.00 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2j0j h ALA 160 CO 0.00 -0.41 0.00 -3.47 0.00 0.00 0.00 179.25 175.37 2j0j n ASP 161 N -5.24 0.02 -0.91 0.00 4.64 -1.26 -1.94 116.55 111.86 2j0j n ASP 161 Ca 0.16 0.51 0.03 0.00 -1.38 0.00 0.00 54.79 54.11 2j0j n ASP 161 Cb 0.54 -0.51 0.04 0.00 -1.04 0.00 0.00 41.12 40.15 2j0j n ASP 161 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2j0j n GLN 162 N -1.53 0.23 -1.64 -0.67 0.00 0.13 -4.78 117.38 109.12 2j0j n GLN 162 Ca 0.02 -1.74 -0.31 0.00 0.00 0.00 0.00 57.00 54.97 2j0j n GLN 162 Cb 0.12 -0.45 0.04 0.00 0.00 0.00 0.00 30.24 29.95 2j0j n GLN 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 2j0j s VAL 163 N -0.49 4.17 0.65 -0.39 0.11 0.19 -5.02 120.40 119.63 2j0j s VAL 163 Ca 0.20 0.71 -0.18 0.00 -2.93 0.00 0.00 61.98 59.78 2j0j s VAL 163 Cb 0.22 -3.51 -0.01 0.00 -1.53 0.00 0.00 36.38 31.56 2j0j s VAL 163 CO -0.08 -0.92 1.27 -0.62 -3.33 0.00 0.00 175.10 171.42 2j0j s ASP 164 N -3.89 4.61 0.06 3.54 -1.08 -1.26 -4.80 116.67 113.85 2j0j s ASP 164 Ca 0.57 2.56 0.02 0.00 -0.52 0.00 0.00 52.55 55.18 2j0j s ASP 164 Cb -0.13 -2.61 -0.25 0.00 -1.46 0.00 0.00 42.92 38.47 2j0j s ASP 164 CO 0.55 -2.00 1.08 -0.61 0.52 0.00 0.00 175.17 174.71 2j0j h GLN 165 N 0.46 0.13 0.00 4.34 4.15 -1.97 -1.48 115.11 120.74 2j0j h GLN 165 Ca -0.50 -0.22 -0.01 0.00 0.77 0.00 0.00 58.65 58.69 2j0j h GLN 165 Cb 1.33 0.08 -0.00 0.00 0.21 0.00 0.00 27.48 29.10 2j0j h GLN 165 CO 0.53 1.03 -0.05 0.93 -1.93 0.00 0.00 178.83 179.33 2j0j h GLU 166 N 0.03 0.00 0.27 1.69 3.07 -1.99 -2.74 114.58 114.91 2j0j h GLU 166 Ca -0.12 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.72 2j0j h GLU 166 Cb 1.90 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.82 2j0j h GLU 166 CO 0.15 0.05 -0.13 0.82 -1.40 0.00 0.00 179.01 178.50 2j0j h ILE 167 N 0.00 0.00 -0.93 3.13 1.08 -1.65 -0.69 117.51 118.45 2j0j h ILE 167 Ca -0.00 -0.51 0.23 0.00 -0.39 0.00 0.00 64.86 64.19 2j0j h ILE 167 Cb 0.17 0.00 -0.17 0.00 -3.07 0.00 0.00 36.82 33.75 2j0j h ILE 167 CO 0.01 0.00 -0.03 0.00 -0.69 0.00 0.00 178.15 177.44 2j0j h ALA 168 N -1.32 0.98 0.27 1.87 0.00 -1.47 0.15 119.26 119.74 2j0j h ALA 168 Ca -0.04 0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2j0j h ALA 168 Cb 0.28 0.58 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2j0j h ALA 168 CO 0.06 -0.50 -0.48 -0.07 0.00 0.00 0.00 179.25 178.26 2j0j h LEU 169 N 0.03 -1.39 0.08 0.00 3.38 -1.47 0.71 115.31 116.64 2j0j h LEU 169 Ca 0.53 0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.65 2j0j h LEU 169 Cb 1.02 0.49 -0.03 0.00 0.09 0.00 0.00 40.66 42.22 2j0j h LEU 169 CO -0.88 -0.56 -0.23 0.11 0.09 0.00 0.00 178.44 176.97 2j0j h LYS 170 N -0.80 -0.39 -0.30 1.13 1.57 0.69 0.22 116.57 118.69 2j0j h LYS 170 Ca -0.03 0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2j0j h LYS 170 Cb 0.75 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.12 2j0j h LYS 170 CO -0.17 -0.26 0.14 -0.07 -0.57 0.00 0.00 179.45 178.52 2j0j h LEU 171 N -0.41 0.20 -0.37 2.94 3.38 -0.77 0.17 115.31 120.46 2j0j h LEU 171 Ca 0.04 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.10 2j0j h LEU 171 Cb 0.45 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 2j0j h LEU 171 CO -0.15 0.15 -0.13 1.23 0.09 0.00 0.00 178.44 179.63 2j0j h GLY 172 N 0.30 0.20 0.67 0.83 0.00 -0.60 -1.47 103.07 103.01 2j0j h GLY 172 Ca 0.13 0.16 0.06 0.00 0.00 0.00 0.00 47.33 47.68 2j0j h GLY 172 CO -0.10 -0.16 0.39 0.00 0.00 0.00 0.00 176.54 176.67 2j0j h LEU 174 N 0.72 0.13 -0.51 0.00 3.38 0.24 0.31 115.31 119.58 2j0j h LEU 174 Ca 0.31 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.32 2j0j h LEU 174 Cb 0.20 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2j0j h LEU 174 CO -0.19 0.11 0.34 -0.08 0.09 0.00 0.00 178.44 178.71 2j0j h GLU 175 N 0.24 0.67 -0.23 1.13 4.57 -0.94 0.51 114.58 120.52 2j0j h GLU 175 Ca 0.13 -0.04 0.06 0.00 -1.18 0.00 0.00 59.36 58.32 2j0j h GLU 175 Cb 0.09 -0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 28.47 2j0j h GLU 175 CO -0.12 0.44 -0.16 0.82 -1.18 0.00 0.00 179.01 178.81 2j0j h ILE 176 N 0.69 0.55 -0.80 2.32 2.04 -0.32 0.44 117.51 122.43 2j0j h ILE 176 Ca 0.19 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.06 2j0j h ILE 176 Cb -0.08 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.52 2j0j h ILE 176 CO -0.04 0.00 0.53 -0.09 0.00 0.00 0.00 178.15 178.55 2j0j h ARG 177 N -0.15 1.04 0.13 2.37 9.65 0.44 -2.27 114.38 125.59 2j0j h ARG 177 Ca 0.13 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.94 2j0j h ARG 177 Cb 0.34 -0.23 0.00 0.00 -1.39 0.00 0.00 29.97 28.69 2j0j h ARG 177 CO -0.32 0.69 -0.06 -0.09 2.80 0.00 0.00 179.97 182.99 2j0j h ARG 178 N 1.07 -0.17 -0.10 0.20 2.43 0.12 -3.32 114.38 114.62 2j0j h ARG 178 Ca 0.30 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.45 2j0j h ARG 178 Cb -0.10 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 2j0j h ARG 178 CO -0.07 0.31 -0.05 1.03 -1.51 0.00 0.00 179.97 179.68 2j0j h SER 179 N -0.78 0.12 -1.90 -3.80 0.87 -0.07 -3.05 113.55 104.94 2j0j h SER 179 Ca -0.02 -0.01 -0.68 0.00 -1.23 0.00 0.00 61.79 59.85 2j0j h SER 179 Cb 0.55 -0.03 -0.35 0.00 -0.44 0.00 0.00 62.40 62.12 2j0j h SER 179 CO 0.03 0.20 0.12 -1.22 -0.53 0.00 0.00 176.83 175.43 2j0j n TYR 180 N -4.40 3.29 0.10 2.24 4.02 -0.87 -4.85 117.16 116.70 2j0j n TYR 180 Ca -0.01 -2.92 0.01 0.00 -0.01 0.00 0.00 57.90 54.97 2j0j n TYR 180 Cb 0.18 -0.67 0.04 0.00 -0.02 0.00 0.00 39.34 38.87 2j0j n TYR 180 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2j0j n GLY 181 N -0.41 -0.05 0.09 2.72 0.00 -1.16 -1.03 105.19 105.36 2j0j n GLY 181 Ca 0.44 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.51 2j0j n GLY 181 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2j0j n GLU 182 N -0.89 2.80 -3.11 1.61 4.07 -1.26 -4.99 120.64 118.87 2j0j n GLU 182 Ca 0.01 -0.21 -0.40 0.00 -0.06 0.00 0.00 57.16 56.50 2j0j n GLU 182 Cb 0.00 -1.08 -0.05 0.00 -0.06 0.00 0.00 31.44 30.25 2j0j n GLU 182 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2j0j s MET 183 N -1.92 4.33 0.33 5.31 0.23 -0.19 -4.82 119.30 122.57 2j0j s MET 183 Ca 0.06 0.72 -0.26 0.00 -1.03 0.00 0.00 55.69 55.18 2j0j s MET 183 Cb 0.09 -3.50 -0.14 0.00 -1.53 0.00 0.00 34.83 29.76 2j0j s MET 183 CO 0.42 -0.05 0.80 0.54 -2.03 0.00 0.00 175.02 174.71 2j0j n ARG 184 N 4.28 0.93 0.08 3.16 5.12 -1.26 -4.86 116.66 124.11 2j0j n ARG 184 Ca -0.02 0.33 0.09 0.00 -1.93 0.00 0.00 57.85 56.32 2j0j n ARG 184 Cb 0.51 -1.65 0.55 0.00 -1.16 0.00 0.00 32.46 30.71 2j0j n ARG 184 CO 0.00 0.00 0.00 0.78 -1.93 0.00 0.00 177.63 176.48 2j0j h GLY 185 N 1.44 0.29 -1.00 -0.13 0.00 -1.96 -1.07 103.07 100.64 2j0j h GLY 185 Ca -0.39 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2j0j h GLY 185 CO 0.57 0.09 0.00 1.16 0.00 0.00 0.00 176.54 178.35 2j0j n ASN 186 N -4.49 1.86 -0.32 0.19 0.23 -1.26 -4.56 115.26 106.91 2j0j n ASN 186 Ca 0.03 -1.76 0.16 0.00 -0.53 0.00 0.00 54.58 52.48 2j0j n ASN 186 Cb 0.19 -0.13 0.36 0.00 -2.08 0.00 0.00 39.78 38.12 2j0j n ASN 186 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2j0j h ALA 187 N 4.07 1.59 0.00 -2.53 0.00 -1.53 -0.63 119.26 120.22 2j0j h ALA 187 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2j0j h ALA 187 Cb 0.53 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2j0j h ALA 187 CO 0.00 -0.41 0.00 1.28 0.00 0.00 0.00 179.25 180.12 2j0j n LEU 188 N -5.06 0.00 -0.13 0.00 4.77 -1.26 -2.24 117.00 113.08 2j0j n LEU 188 Ca 0.25 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.37 2j0j n LEU 188 Cb 0.75 0.00 0.57 0.00 -2.33 0.00 0.00 43.42 42.41 2j0j n LEU 188 CO 0.11 0.00 0.83 -0.62 -1.33 0.00 0.00 177.39 176.39 2j0j n GLU 189 N -0.70 0.68 -3.41 3.23 -0.58 -0.24 -4.77 120.64 114.84 2j0j n GLU 189 Ca 0.07 -0.26 -0.39 0.00 -0.42 0.00 0.00 57.16 56.16 2j0j n GLU 189 Cb 0.03 -1.49 -0.09 0.00 -0.57 0.00 0.00 31.44 29.32 2j0j n GLU 189 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2j0j s LYS 190 N -2.50 4.04 0.19 3.49 3.01 -0.95 -4.98 119.74 122.03 2j0j s LYS 190 Ca 0.27 0.04 -0.22 0.00 -1.01 0.00 0.00 55.97 55.05 2j0j s LYS 190 Cb 0.20 -3.64 0.10 0.00 -1.01 0.00 0.00 37.83 33.48 2j0j s LYS 190 CO 0.49 -0.23 1.44 1.63 0.51 0.00 0.00 175.35 179.19 2j0j n LYS 191 N 5.17 -0.30 0.22 1.68 5.02 -1.26 -1.70 118.16 127.00 2j0j n LYS 191 Ca -0.09 1.42 0.10 0.00 -2.02 0.00 0.00 58.31 57.72 2j0j n LYS 191 Cb 0.51 -2.10 0.49 0.00 -0.02 0.00 0.00 35.03 33.91 2j0j n LYS 191 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2j0j h SER 192 N 0.00 0.00 -0.17 4.39 4.64 -1.95 -1.27 113.55 119.19 2j0j h SER 192 Ca 0.25 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.52 2j0j h SER 192 Cb 0.48 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2j0j h SER 192 CO -0.90 0.23 -0.09 0.78 -0.87 0.00 0.00 176.83 175.98 2j0j h ASN 193 N 0.00 0.37 -0.93 4.97 2.35 -1.62 -2.59 115.58 118.12 2j0j h ASN 193 Ca -0.00 -0.43 -0.00 0.00 -0.55 0.00 0.00 56.30 55.32 2j0j h ASN 193 Cb 0.68 -0.10 -0.05 0.00 0.05 0.00 0.00 38.32 38.91 2j0j h ASN 193 CO 0.03 0.72 0.57 0.22 -1.65 0.00 0.00 177.43 177.32 2j0j h TYR 194 N 0.03 1.22 0.00 1.19 3.20 -1.16 -1.30 116.97 120.15 2j0j h TYR 194 Ca 0.04 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2j0j h TYR 194 Cb 0.58 -0.40 0.00 0.00 1.54 0.00 0.00 36.73 38.45 2j0j h TYR 194 CO 0.07 0.80 0.00 0.93 -1.64 0.00 0.00 178.16 178.32 2j0j h GLU 195 N 1.28 0.00 -0.00 1.82 5.08 -1.13 0.13 114.58 121.76 2j0j h GLU 195 Ca 0.34 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.62 2j0j h GLU 195 Cb -0.07 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.18 2j0j h GLU 195 CO -0.06 0.00 -0.30 0.28 -1.00 0.00 0.00 179.01 177.93 2j0j h VAL 196 N 0.00 1.53 0.72 3.13 2.07 -0.84 -1.90 116.25 120.97 2j0j h VAL 196 Ca 0.00 -1.97 -0.03 0.00 0.82 0.00 0.00 66.70 65.52 2j0j h VAL 196 Cb 0.19 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.71 2j0j h VAL 196 CO 0.00 0.54 -0.48 -0.07 0.02 0.00 0.00 177.57 177.58 2j0j h LEU 197 N -0.45 -1.24 0.72 2.57 3.38 -1.11 0.14 115.31 119.32 2j0j h LEU 197 Ca -0.04 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2j0j h LEU 197 Cb 1.05 0.37 -0.00 0.00 0.09 0.00 0.00 40.66 42.18 2j0j h LEU 197 CO 0.06 -0.72 -0.41 -0.08 0.09 0.00 0.00 178.44 177.38 2j0j h GLU 198 N -1.14 -1.01 -0.00 1.13 4.81 -0.91 0.99 114.58 118.44 2j0j h GLU 198 Ca -0.09 0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2j0j h GLU 198 Cb 0.93 0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.54 2j0j h GLU 198 CO 0.07 -0.68 -0.59 1.17 -0.73 0.00 0.00 179.01 178.25 2j0j n LYS 199 N -5.56 0.15 0.00 1.92 4.81 -0.71 -3.89 118.16 114.88 2j0j n LYS 199 Ca -0.14 -0.10 0.00 0.00 -0.87 0.00 0.00 58.31 57.20 2j0j n LYS 199 Cb 0.44 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.99 2j0j n LYS 199 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2j0j n ASP 200 N -1.34 0.51 0.01 3.14 8.00 -0.41 -4.88 116.55 121.58 2j0j n ASP 200 Ca 0.06 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.36 2j0j n ASP 200 Cb 0.34 0.00 -0.14 0.00 -0.02 0.00 0.00 41.12 41.30 2j0j n ASP 200 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2j0j h VAL 201 N 0.00 1.36 0.00 2.53 2.07 -0.39 -3.49 116.25 118.33 2j0j h VAL 201 Ca 0.00 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 65.08 2j0j h VAL 201 Cb 0.65 3.01 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 2j0j h VAL 201 CO 0.00 0.67 0.00 0.61 0.02 0.00 0.00 177.57 178.87 2j0j n GLY 202 N 1.67 1.60 0.26 2.17 0.00 0.34 -4.83 105.19 106.40 2j0j n GLY 202 Ca -0.18 -1.07 0.14 0.00 0.00 0.00 0.00 46.02 44.91 2j0j n GLY 202 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2j0j h LEU 203 N 0.00 0.00 -2.09 0.99 3.38 -1.72 -1.89 115.31 113.98 2j0j h LEU 203 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 2j0j h LEU 203 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2j0j h LEU 203 CO 0.00 0.11 0.33 0.08 0.09 0.00 0.00 178.44 179.05 2j0j h ARG 204 N 0.00 0.00 0.00 1.13 0.11 -1.92 0.26 114.38 113.96 2j0j h ARG 204 Ca -0.00 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.06 2j0j h ARG 204 Cb 0.42 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.50 2j0j h ARG 204 CO 0.01 0.00 -0.10 0.00 0.10 0.00 0.00 179.97 179.98 2j0j h ARG 205 N 0.00 0.00 0.00 0.08 -0.00 -1.66 -3.34 114.38 109.46 2j0j h ARG 205 Ca 0.15 0.00 -0.00 0.00 -0.50 0.00 0.00 59.98 59.63 2j0j h ARG 205 Cb 0.80 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.77 2j0j h ARG 205 CO -0.00 0.10 -1.01 1.19 0.00 0.00 0.00 179.97 180.25 2j0j n PHE 206 N -3.64 0.00 -4.21 3.04 3.01 0.74 -5.06 117.46 111.33 2j0j n PHE 206 Ca -0.02 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.24 2j0j n PHE 206 Cb 0.22 -0.01 -0.12 0.00 -0.01 0.00 0.00 39.48 39.56 2j0j n PHE 206 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2j0j s PHE 207 N -2.02 1.35 0.48 1.38 0.40 -0.09 -4.07 117.98 115.40 2j0j s PHE 207 Ca -0.00 -0.44 -0.22 0.00 -0.60 0.00 0.00 56.93 55.67 2j0j s PHE 207 Cb 0.00 -0.76 -0.07 0.00 0.51 0.00 0.00 43.02 42.71 2j0j s PHE 207 CO 0.01 0.09 1.15 -1.25 0.70 0.00 0.00 175.22 175.92 2j0j s PRO 208 N -1.72 3.68 0.26 0.24 0.04 -1.26 -4.33 135.00 131.90 2j0j s PRO 208 Ca 0.00 1.71 -0.11 0.00 0.04 0.00 0.00 61.00 62.64 2j0j s PRO 208 Cb -0.10 -2.31 0.38 0.00 0.04 0.00 0.00 34.50 32.51 2j0j s PRO 208 CO 0.03 -0.60 1.57 -0.22 0.04 0.00 0.00 177.00 177.81 2j0j h LYS 209 N 1.85 -0.01 -0.38 4.56 3.64 -1.95 -2.25 116.57 122.04 2j0j h LYS 209 Ca -0.49 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 58.91 2j0j h LYS 209 Cb 1.25 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 2j0j h LYS 209 CO 0.59 -0.00 0.21 0.66 -2.27 0.00 0.00 179.45 178.64 2j0j h SER 210 N -0.01 0.33 -0.15 4.20 4.64 -1.92 -2.82 113.55 117.83 2j0j h SER 210 Ca 0.42 0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.80 2j0j h SER 210 Cb 0.67 -0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.63 2j0j h SER 210 CO -0.97 0.24 -0.34 0.25 -0.87 0.00 0.00 176.83 175.15 2j0j h LEU 211 N 0.43 -1.05 -0.66 5.97 6.46 -1.74 -0.32 115.31 124.39 2j0j h LEU 211 Ca 0.15 0.15 0.04 0.00 -0.12 0.00 0.00 57.88 58.11 2j0j h LEU 211 Cb 0.03 0.45 -0.05 0.00 -0.73 0.00 0.00 40.66 40.35 2j0j h LEU 211 CO -0.08 -0.37 0.39 -0.07 -0.62 0.00 0.00 178.44 177.69 2j0j h LEU 212 N -0.40 0.62 0.00 2.25 3.38 -1.46 -2.80 115.31 116.90 2j0j h LEU 212 Ca 0.10 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2j0j h LEU 212 Cb 0.56 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2j0j h LEU 212 CO -0.37 0.42 -0.77 -0.90 0.09 0.00 0.00 178.44 176.91 2j0j n ASP 213 N -4.73 0.63 0.16 -0.43 5.68 -1.11 -3.70 116.55 113.04 2j0j n ASP 213 Ca 0.07 -0.12 0.13 0.00 -0.50 0.00 0.00 54.79 54.37 2j0j n ASP 213 Cb 0.12 0.45 0.39 0.00 -1.14 0.00 0.00 41.12 40.95 2j0j n ASP 213 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2j0j h SER 214 N 0.00 0.00 -4.34 -1.12 4.64 -0.79 -3.46 113.55 108.47 2j0j h SER 214 Ca 0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 2j0j h SER 214 Cb 0.68 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.52 2j0j h SER 214 CO 0.00 0.00 -0.77 0.54 -0.87 0.00 0.00 176.83 175.73 2j0j s VAL 215 N -3.22 0.77 0.22 0.95 0.11 -1.13 -5.08 120.40 113.02 2j0j s VAL 215 Ca 0.08 -0.82 -0.32 0.00 -2.93 0.00 0.00 61.98 57.99 2j0j s VAL 215 Cb 0.10 -0.73 -0.12 0.00 -1.53 0.00 0.00 36.38 34.10 2j0j s VAL 215 CO 0.57 -0.07 1.71 0.29 -3.33 0.00 0.00 175.10 174.27 2j0j n LYS 216 N 2.06 2.76 -0.23 1.54 5.02 -1.26 -4.80 118.16 123.25 2j0j n LYS 216 Ca -0.18 1.00 -0.04 0.00 -2.02 0.00 0.00 58.31 57.07 2j0j n LYS 216 Cb 0.56 -2.84 0.02 0.00 -0.02 0.00 0.00 35.03 32.75 2j0j n LYS 216 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j0j h ALA 217 N 6.56 0.06 -0.59 7.82 0.00 -1.99 0.23 119.26 131.34 2j0j h ALA 217 Ca -0.43 0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.71 2j0j h ALA 217 Cb 1.20 0.78 -0.05 0.00 0.00 0.00 0.00 17.79 19.73 2j0j h ALA 217 CO 0.94 -0.63 0.33 0.87 0.00 0.00 0.00 179.25 180.76 2j0j h LYS 218 N -0.12 0.62 -0.15 0.00 1.57 -2.00 -1.03 116.57 115.46 2j0j h LYS 218 Ca 0.26 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 2j0j h LYS 218 Cb 0.56 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 2j0j h LYS 218 CO -0.73 0.41 0.07 1.15 -0.57 0.00 0.00 179.45 179.78 2j0j h THR 219 N 0.64 1.13 -0.70 -0.16 2.02 -1.57 -3.00 112.91 111.27 2j0j h THR 219 Ca 0.25 -0.39 0.08 0.00 0.77 0.00 0.00 66.41 67.12 2j0j h THR 219 Cb 0.11 1.11 -0.07 0.00 -1.74 0.00 0.00 68.15 67.57 2j0j h THR 219 CO -0.14 0.13 0.37 0.25 0.37 0.00 0.00 175.52 176.49 2j0j h LEU 220 N 0.11 0.50 -0.41 2.58 5.85 -0.12 -1.21 115.31 122.63 2j0j h LEU 220 Ca 0.05 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.87 2j0j h LEU 220 Cb 0.14 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.04 2j0j h LEU 220 CO -0.01 0.30 -0.55 -0.09 -0.34 0.00 0.00 178.44 177.75 2j0j h ARG 221 N 0.64 -0.38 -0.43 1.25 2.43 -1.07 -1.74 114.38 115.08 2j0j h ARG 221 Ca 0.33 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.58 2j0j h ARG 221 Cb 0.30 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.89 2j0j h ARG 221 CO -0.24 -0.26 0.18 -0.22 -1.51 0.00 0.00 179.97 177.93 2j0j h LYS 222 N -0.40 0.35 0.38 0.20 3.64 -1.19 -0.47 116.57 119.08 2j0j h LYS 222 Ca 0.08 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2j0j h LYS 222 Cb 0.60 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 2j0j h LYS 222 CO -0.60 0.23 -0.49 -0.07 -2.27 0.00 0.00 179.45 176.26 2j0j h LEU 223 N 0.36 -1.38 -0.85 5.20 3.38 -0.87 0.11 115.31 121.25 2j0j h LEU 223 Ca 0.20 0.12 0.20 0.00 0.09 0.00 0.00 57.88 58.49 2j0j h LEU 223 Cb 0.16 0.47 -0.15 0.00 0.09 0.00 0.00 40.66 41.22 2j0j h LEU 223 CO -0.18 -0.61 -0.04 0.40 0.09 0.00 0.00 178.44 178.10 2j0j h ILE 224 N -0.90 0.20 -0.01 1.22 2.04 -1.12 0.76 117.51 119.70 2j0j h ILE 224 Ca -0.05 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 65.83 2j0j h ILE 224 Cb 0.81 0.14 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 2j0j h ILE 224 CO -0.12 0.01 -0.25 1.56 0.00 0.00 0.00 178.15 179.36 2j0j h GLN 225 N 0.05 -0.36 -0.32 2.37 4.20 0.14 -2.00 115.11 119.19 2j0j h GLN 225 Ca 0.47 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 59.19 2j0j h GLN 225 Cb 0.85 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.70 2j0j h GLN 225 CO -0.80 -0.24 0.14 1.96 -0.67 0.00 0.00 178.83 179.23 2j0j h GLN 226 N -0.38 0.48 0.00 1.46 4.20 0.84 -3.02 115.11 118.68 2j0j h GLN 226 Ca 0.06 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2j0j h GLN 226 Cb 0.46 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2j0j h GLN 226 CO -0.23 0.46 0.00 -2.37 -0.67 0.00 0.00 178.83 176.02 2j0j n THR 227 N -4.74 0.10 0.04 -0.54 5.66 0.09 -2.08 114.28 112.82 2j0j n THR 227 Ca -0.01 0.02 -0.05 0.00 -3.05 0.00 0.00 64.05 60.96 2j0j n THR 227 Cb 0.12 -0.56 -0.10 0.00 -1.55 0.00 0.00 70.33 68.24 2j0j n THR 227 CO 0.00 0.00 0.00 0.15 -3.05 0.00 0.00 175.07 172.17 2j0j h PHE 228 N 0.00 0.00 -0.90 1.09 3.57 -1.24 -3.38 116.94 116.07 2j0j h PHE 228 Ca 0.00 0.00 0.17 0.00 3.53 0.00 0.00 57.97 61.67 2j0j h PHE 228 Cb 0.31 0.00 -0.17 0.00 2.79 0.00 0.00 35.95 38.88 2j0j h PHE 228 CO 0.00 0.84 -0.24 0.54 -2.23 0.00 0.00 178.31 177.21 2j0j n ARG 229 N -3.14 -0.10 0.14 1.11 5.12 -0.88 -0.50 116.66 118.41 2j0j n ARG 229 Ca -0.07 1.41 0.01 0.00 -1.93 0.00 0.00 57.85 57.26 2j0j n ARG 229 Cb 0.92 -2.10 0.18 0.00 -1.16 0.00 0.00 32.46 30.30 2j0j n ARG 229 CO 0.00 0.00 0.00 -0.56 -1.93 0.00 0.00 177.63 175.14 2j0j h GLN 230 N 0.00 0.00 -0.45 5.56 3.07 -1.76 -2.85 115.11 118.68 2j0j h GLN 230 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.16 2j0j h GLN 230 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.20 2j0j h GLN 230 CO -0.93 0.58 0.00 1.19 0.09 0.00 0.00 178.83 179.76 2j0j n PHE 231 N -3.62 0.60 0.12 0.06 0.99 0.34 -4.55 117.46 111.40 2j0j n PHE 231 Ca -0.00 -0.30 0.05 0.00 -0.00 0.00 0.00 57.45 57.19 2j0j n PHE 231 Cb 0.63 0.00 0.48 0.00 -1.00 0.00 0.00 39.48 39.58 2j0j n PHE 231 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2j0j h ALA 232 N 4.00 1.72 -0.33 4.37 0.00 -1.11 -3.18 119.26 124.73 2j0j h ALA 232 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2j0j h ALA 232 Cb 0.68 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2j0j h ALA 232 CO 0.00 0.22 0.00 0.09 0.00 0.00 0.00 179.25 179.56 2j0j n ASN 233 N -4.42 3.16 -4.71 0.00 3.02 -1.26 -4.39 115.26 106.67 2j0j n ASN 233 Ca -0.00 -2.23 -0.41 0.00 -0.03 0.00 0.00 54.58 51.91 2j0j n ASN 233 Cb 0.15 -0.30 -0.04 0.00 -0.61 0.00 0.00 39.78 38.97 2j0j n ASN 233 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2j0j s LEU 234 N -1.41 4.31 1.01 3.41 1.02 -1.20 -5.06 118.68 120.77 2j0j s LEU 234 Ca 0.28 1.36 -0.14 0.00 0.02 0.00 0.00 54.13 55.65 2j0j s LEU 234 Cb 0.17 -3.29 0.19 0.00 0.02 0.00 0.00 46.19 43.29 2j0j s LEU 234 CO 0.14 -0.22 1.13 0.54 0.02 0.00 0.00 176.35 177.96 2j0j s ASN 235 N 0.93 2.57 0.10 2.29 2.20 -1.26 -4.80 114.94 116.98 2j0j s ASN 235 Ca 0.43 0.91 -0.34 0.00 -0.94 0.00 0.00 52.86 52.92 2j0j s ASN 235 Cb -0.19 -1.40 -0.14 0.00 -2.00 0.00 0.00 41.25 37.52 2j0j s ASN 235 CO 0.21 -3.13 1.57 0.03 -2.94 0.00 0.00 177.10 172.84 2j0j h ARG 236 N -1.90 -0.75 -0.87 3.55 3.08 -1.89 -2.09 114.38 113.51 2j0j h ARG 236 Ca -0.50 0.05 0.17 0.00 0.07 0.00 0.00 59.98 59.76 2j0j h ARG 236 Cb 1.32 0.17 -0.10 0.00 0.08 0.00 0.00 29.97 31.44 2j0j h ARG 236 CO 0.53 -0.50 0.43 1.49 -1.07 0.00 0.00 179.97 180.85 2j0j h GLU 237 N -0.78 0.56 -0.06 0.04 4.81 -1.98 -1.22 114.58 115.94 2j0j h GLU 237 Ca -0.01 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.10 2j0j h GLU 237 Cb 0.76 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 2j0j h GLU 237 CO -0.22 0.37 -0.35 0.93 -0.73 0.00 0.00 179.01 179.01 2j0j h GLU 238 N 0.57 0.12 -0.26 1.92 5.08 -1.82 -2.17 114.58 118.03 2j0j h GLU 238 Ca 0.49 -0.05 -0.12 0.00 -1.00 0.00 0.00 59.36 58.68 2j0j h GLU 238 Cb 0.77 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 2j0j h GLU 238 CO -0.40 0.46 -0.31 0.77 -1.00 0.00 0.00 179.01 178.53 2j0j h SER 239 N 0.11 0.72 -0.00 1.42 0.02 -0.57 -1.64 113.55 113.61 2j0j h SER 239 Ca 0.01 -0.49 0.01 0.00 -0.84 0.00 0.00 61.79 60.48 2j0j h SER 239 Cb 0.67 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2j0j h SER 239 CO 0.05 1.07 -0.05 0.40 -1.14 0.00 0.00 176.83 177.15 2j0j h ILE 240 N 0.39 0.86 -0.84 3.27 2.04 -1.22 0.04 117.51 122.05 2j0j h ILE 240 Ca 0.04 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 2j0j h ILE 240 Cb 0.88 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 2j0j h ILE 240 CO 0.07 0.00 0.41 -0.07 0.00 0.00 0.00 178.15 178.56 2j0j h LEU 241 N -0.10 1.10 -1.07 1.44 3.38 -1.37 -1.03 115.31 117.66 2j0j h LEU 241 Ca 0.02 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 2j0j h LEU 241 Cb 0.13 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2j0j h LEU 241 CO -0.06 0.92 -0.14 0.50 0.09 0.00 0.00 178.44 179.76 2j0j h LYS 242 N 1.20 0.50 0.47 1.13 1.63 -1.11 -0.45 116.57 119.93 2j0j h LYS 242 Ca 0.29 -0.15 -0.02 0.00 -0.85 0.00 0.00 60.65 59.92 2j0j h LYS 242 Cb 0.11 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.70 2j0j h LYS 242 CO -0.04 0.63 -0.23 0.35 -3.45 0.00 0.00 179.45 176.71 2j0j h PHE 243 N 0.46 -0.59 -0.41 1.91 3.57 0.23 0.79 116.94 122.91 2j0j h PHE 243 Ca 0.08 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.61 2j0j h PHE 243 Cb 0.51 0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.41 2j0j h PHE 243 CO 0.02 -0.35 0.17 0.74 -2.23 0.00 0.00 178.31 176.66 2j0j h PHE 244 N -0.66 0.31 -0.66 0.41 0.05 -1.13 0.16 116.94 115.42 2j0j h PHE 244 Ca -0.06 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 61.74 2j0j h PHE 244 Cb 0.50 -0.08 -0.03 0.00 2.00 0.00 0.00 35.95 38.34 2j0j h PHE 244 CO -0.04 0.14 0.38 1.49 -0.18 0.00 0.00 178.31 180.10 2j0j h GLU 245 N 0.35 0.89 0.20 1.51 4.81 -0.85 0.29 114.58 121.78 2j0j h GLU 245 Ca 0.18 -0.08 -0.31 0.00 -0.13 0.00 0.00 59.36 59.02 2j0j h GLU 245 Cb 0.14 -0.19 0.03 0.00 0.63 0.00 0.00 28.75 29.36 2j0j h GLU 245 CO -0.16 0.64 -1.37 0.82 -0.73 0.00 0.00 179.01 178.21 2j0j h ILE 246 N 0.91 1.35 -0.02 2.32 2.04 -0.40 -3.38 117.51 120.32 2j0j h ILE 246 Ca 0.23 -2.78 -0.11 0.00 1.00 0.00 0.00 64.86 63.21 2j0j h ILE 246 Cb -0.01 2.96 0.01 0.00 -0.74 0.00 0.00 36.82 39.05 2j0j h ILE 246 CO -0.04 0.83 -0.41 0.25 0.00 0.00 0.00 178.15 178.78 2j0j h LEU 247 N 0.14 0.40 -0.74 1.44 5.85 -0.24 -3.36 115.31 118.80 2j0j h LEU 247 Ca -0.21 -0.73 0.14 0.00 0.84 0.00 0.00 57.88 57.93 2j0j h LEU 247 Cb 2.07 -0.12 -0.10 0.00 0.37 0.00 0.00 40.66 42.88 2j0j h LEU 247 CO 0.25 1.07 0.26 0.77 -0.34 0.00 0.00 178.44 180.45 2j0j h SER 248 N -0.23 0.19 0.00 1.25 4.64 -1.06 -1.07 113.55 117.27 2j0j h SER 248 Ca -0.04 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2j0j h SER 248 Cb 1.12 0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2j0j h SER 248 CO 0.08 0.06 0.08 -2.65 -0.87 0.00 0.00 176.83 173.53 2j0j n PRO 249 N -5.05 0.00 0.00 4.77 -0.02 -1.26 -1.27 135.00 132.17 2j0j n PRO 249 Ca 0.14 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2j0j n PRO 249 Cb 0.42 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 2j0j n PRO 249 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2j0j n VAL 250 N -1.19 0.00 -3.69 -1.45 3.14 -0.51 -5.02 118.33 109.61 2j0j n VAL 250 Ca 0.00 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.27 2j0j n VAL 250 Cb 0.08 1.63 -0.12 0.00 -1.06 0.00 0.00 33.84 34.38 2j0j n VAL 250 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 2j0j s TYR 251 N 0.00 -0.53 -1.05 1.45 5.04 -0.40 -5.10 117.35 116.77 2j0j s TYR 251 Ca 0.00 1.12 -0.04 0.00 -2.44 0.00 0.00 57.07 55.71 2j0j s TYR 251 Cb 0.00 0.13 0.30 0.00 0.35 0.00 0.00 41.96 42.74 2j0j s TYR 251 CO 0.00 -0.35 1.35 0.54 -1.34 0.00 0.00 175.55 175.75 2j0j n ARG 252 N 4.80 4.12 0.00 4.97 1.74 -1.26 -3.89 116.66 127.14 2j0j n ARG 252 Ca -0.16 -4.55 0.10 0.00 -0.77 0.00 0.00 57.85 52.47 2j0j n ARG 252 Cb 0.52 -2.49 0.60 0.00 -1.02 0.00 0.00 32.46 30.06 2j0j n ARG 252 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 2j0j n PHE 253 N 1.54 0.00 0.11 -1.55 1.16 -1.26 -3.15 117.46 114.31 2j0j n PHE 253 Ca 0.26 0.00 0.08 0.00 -1.87 0.00 0.00 57.45 55.92 2j0j n PHE 253 Cb 0.35 0.00 0.01 0.00 -1.61 0.00 0.00 39.48 38.23 2j0j n PHE 253 CO 0.00 0.00 0.00 0.38 -1.87 0.00 0.00 176.76 175.27 2j0j h ASP 254 N 0.00 0.00 -4.36 5.98 3.04 -1.97 -3.47 116.42 115.64 2j0j h ASP 254 Ca 0.00 0.00 -0.28 0.00 -3.24 0.00 0.00 57.03 53.51 2j0j h ASP 254 Cb 0.00 0.00 -0.15 0.00 -1.04 0.00 0.00 39.33 38.14 2j0j h ASP 254 CO 0.00 0.20 -0.71 -1.59 -2.04 0.00 0.00 179.24 175.10 2j0j s LYS 255 N -3.19 0.90 -0.18 4.15 -2.85 -1.19 -4.31 119.74 113.08 2j0j s LYS 255 Ca 0.01 -1.32 -0.02 0.00 -1.00 0.00 0.00 55.97 53.63 2j0j s LYS 255 Cb 0.08 -0.41 -0.01 0.00 -2.06 0.00 0.00 37.83 35.44 2j0j s LYS 255 CO 0.77 0.03 -0.08 -1.21 0.10 0.00 0.00 175.35 174.96 2j0j s GLU 256 N -3.54 3.38 -0.03 1.78 2.02 0.15 -4.94 118.70 117.52 2j0j s GLU 256 Ca 0.12 -0.65 -0.03 0.00 0.02 0.00 0.00 54.97 54.42 2j0j s GLU 256 Cb 0.02 -2.84 -0.04 0.00 0.10 0.00 0.00 34.13 31.38 2j0j s GLU 256 CO -0.02 -0.02 0.15 0.00 0.02 0.00 0.00 175.26 175.39 2j0j s PHE 258 N -1.23 1.16 -0.47 0.00 0.40 0.38 -4.95 117.98 113.28 2j0j s PHE 258 Ca 0.24 -0.22 -0.21 0.00 -0.60 0.00 0.00 56.93 56.14 2j0j s PHE 258 Cb -0.12 -0.75 0.04 0.00 0.51 0.00 0.00 43.02 42.69 2j0j s PHE 258 CO 0.14 -0.02 0.68 0.15 0.70 0.00 0.00 175.22 176.87 2j0j s LYS 259 N -0.30 3.24 0.03 0.44 1.02 -1.26 0.50 119.74 123.42 2j0j s LYS 259 Ca 0.05 -0.50 -0.21 0.00 0.02 0.00 0.00 55.97 55.33 2j0j s LYS 259 Cb -0.05 -4.00 0.04 0.00 -0.52 0.00 0.00 37.83 33.30 2j0j s LYS 259 CO -0.00 -1.13 0.47 0.00 -0.92 0.00 0.00 175.35 173.77 2j0j s ALA 261 N -2.27 3.64 0.38 0.00 0.00 -0.66 -1.82 121.76 121.04 2j0j s ALA 261 Ca -0.06 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 51.76 2j0j s ALA 261 Cb -0.01 -2.47 -0.01 0.00 0.00 0.00 0.00 23.12 20.63 2j0j s ALA 261 CO -0.01 0.39 0.56 -0.51 0.00 0.00 0.00 175.76 176.19 2j0j s LEU 262 N -0.80 3.86 0.00 0.00 1.43 0.22 0.40 118.68 123.80 2j0j s LEU 262 Ca 0.25 0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.45 2j0j s LEU 262 Cb -0.17 -2.99 0.00 0.00 0.03 0.00 0.00 46.19 43.06 2j0j s LEU 262 CO 0.14 -0.51 0.00 0.61 0.23 0.00 0.00 176.35 176.82 2j0j n GLY 263 N -1.83 2.97 0.00 -3.19 0.00 -1.04 -1.45 105.19 100.66 2j0j n GLY 263 Ca -0.01 -2.04 0.00 0.00 0.00 0.00 0.00 46.02 43.98 2j0j n GLY 263 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2j0j n SER 264 N 0.00 0.00 0.04 1.61 7.64 -1.26 -4.58 113.62 117.07 2j0j n SER 264 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.00 2j0j n SER 264 Cb 0.00 0.00 0.21 0.00 -1.01 0.00 0.00 64.21 63.41 2j0j n SER 264 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2j0j n SER 265 N 0.00 0.60 -4.45 6.43 7.64 -1.26 -4.76 113.62 117.82 2j0j n SER 265 Ca 0.00 -0.01 -0.35 0.00 1.01 0.00 0.00 58.87 59.52 2j0j n SER 265 Cb 0.00 0.20 -0.12 0.00 -1.01 0.00 0.00 64.21 63.28 2j0j n SER 265 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 2j0j s TRP 266 N -3.10 3.06 -0.11 1.43 1.48 -1.26 -5.11 118.94 115.33 2j0j s TRP 266 Ca 0.08 -0.45 0.03 0.00 -1.06 0.00 0.00 56.10 54.71 2j0j s TRP 266 Cb 0.15 -2.14 0.01 0.00 -1.16 0.00 0.00 33.47 30.33 2j0j s TRP 266 CO 0.71 -0.28 -0.21 0.42 -4.06 0.00 0.00 176.95 173.53 2j0j s ILE 267 N 1.21 1.91 0.45 0.66 1.01 -1.26 -4.22 121.20 120.96 2j0j s ILE 267 Ca 0.04 -0.92 0.05 0.00 0.00 0.00 0.00 60.65 59.82 2j0j s ILE 267 Cb -0.14 -1.68 -0.05 0.00 0.01 0.00 0.00 42.46 40.60 2j0j s ILE 267 CO 0.02 0.53 0.08 0.27 0.00 0.00 0.00 174.94 175.84 2j0j s ILE 268 N 0.55 1.83 -0.18 2.92 -5.25 -0.53 -4.98 121.20 115.56 2j0j s ILE 268 Ca -0.14 -1.88 0.01 0.00 -0.99 0.00 0.00 60.65 57.65 2j0j s ILE 268 Cb -0.17 -2.71 0.03 0.00 2.95 0.00 0.00 42.46 42.56 2j0j s ILE 268 CO 0.05 0.00 -0.16 -0.55 -1.79 0.00 0.00 174.94 172.48 2j0j s SER 269 N -3.85 3.18 0.24 4.36 0.15 -1.26 -0.61 113.70 115.91 2j0j s SER 269 Ca 0.29 -0.71 -0.03 0.00 0.70 0.00 0.00 55.95 56.20 2j0j s SER 269 Cb 0.05 -1.38 -0.03 0.00 -1.71 0.00 0.00 66.02 62.95 2j0j s SER 269 CO 0.15 -0.05 0.25 0.68 1.20 0.00 0.00 173.24 175.47 2j0j s VAL 270 N 1.33 0.00 -0.42 4.45 -7.23 -0.75 -4.79 120.40 112.99 2j0j s VAL 270 Ca 0.03 -1.84 -0.09 0.00 -1.81 0.00 0.00 61.98 58.27 2j0j s VAL 270 Cb -0.14 -2.45 0.08 0.00 0.56 0.00 0.00 36.38 34.43 2j0j s VAL 270 CO -0.11 0.00 0.26 -0.70 -0.31 0.00 0.00 175.10 174.24 2j0j s GLU 271 N -3.96 2.61 0.38 4.82 2.12 -0.96 -1.65 118.70 122.07 2j0j s GLU 271 Ca 0.35 -1.44 -0.27 0.00 0.36 0.00 0.00 54.97 53.97 2j0j s GLU 271 Cb 0.04 -3.78 -0.09 0.00 0.26 0.00 0.00 34.13 30.56 2j0j s GLU 271 CO 0.14 -0.94 1.26 -0.51 -0.54 0.00 0.00 175.26 174.66 2j0j s LEU 272 N 1.43 4.28 -0.11 2.70 1.43 0.18 -3.27 118.68 125.32 2j0j s LEU 272 Ca 0.03 2.56 -0.01 0.00 -1.03 0.00 0.00 54.13 55.68 2j0j s LEU 272 Cb -0.23 -3.85 0.03 0.00 0.03 0.00 0.00 46.19 42.16 2j0j s LEU 272 CO 0.02 -0.69 -0.06 0.00 0.23 0.00 0.00 176.35 175.86 2j0j s ALA 273 N -1.26 1.22 -0.18 4.21 0.00 -0.03 0.14 121.76 125.86 2j0j s ALA 273 Ca 0.54 -0.50 -0.00 0.00 0.00 0.00 0.00 51.96 52.00 2j0j s ALA 273 Cb -0.36 -0.91 0.00 0.00 0.00 0.00 0.00 23.12 21.85 2j0j s ALA 273 CO 0.47 -0.48 -0.14 0.42 0.00 0.00 0.00 175.76 176.03 2j0j s ILE 274 N 1.76 2.66 0.13 0.00 1.01 0.24 -1.85 121.20 125.14 2j0j s ILE 274 Ca 0.04 -0.75 -0.24 0.00 0.00 0.00 0.00 60.65 59.70 2j0j s ILE 274 Cb -0.13 -2.14 0.07 0.00 0.01 0.00 0.00 42.46 40.27 2j0j s ILE 274 CO -0.08 0.50 0.61 -0.83 0.00 0.00 0.00 174.94 175.15 2j0j s GLY 275 N 1.08 -0.61 0.45 6.18 0.00 -0.94 -0.68 107.32 112.80 2j0j s GLY 275 Ca -0.00 0.61 0.25 0.00 0.00 0.00 0.00 44.72 45.58 2j0j s GLY 275 CO -0.04 0.28 1.82 -0.56 0.00 0.00 0.00 173.10 174.60 2j0j h PRO 276 N 2.16 0.00 -0.02 2.90 0.13 -1.80 -0.23 132.00 135.14 2j0j h PRO 276 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2j0j h PRO 276 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2j0j h PRO 276 CO 0.38 0.20 -0.12 0.39 -0.23 0.00 0.00 178.00 178.63 2j0j n GLU 277 N -3.33 1.61 0.00 0.86 -0.58 -1.26 -4.45 120.64 113.49 2j0j n GLU 277 Ca 0.00 -1.13 0.00 0.00 -0.42 0.00 0.00 57.16 55.62 2j0j n GLU 277 Cb 0.43 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 2j0j n GLU 277 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 2j0j n GLU 278 N 0.29 3.53 0.00 3.49 0.00 -1.12 -5.11 120.64 121.71 2j0j n GLU 278 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.31 2j0j n GLU 278 Cb 0.43 -0.33 0.00 0.00 0.00 0.00 0.00 31.44 31.54 2j0j n GLU 278 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2j0j n GLY 279 N 0.02 1.59 2.80 -1.84 0.00 -0.11 -4.72 105.19 102.93 2j0j n GLY 279 Ca 0.00 -0.52 -0.29 0.00 0.00 0.00 0.00 46.02 45.21 2j0j n GLY 279 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j0j s ILE 280 N 0.00 0.92 0.30 -0.61 1.01 -0.41 -2.20 121.20 120.21 2j0j s ILE 280 Ca 0.00 -0.92 0.10 0.00 0.00 0.00 0.00 60.65 59.82 2j0j s ILE 280 Cb 0.00 -1.39 -0.05 0.00 0.01 0.00 0.00 42.46 41.03 2j0j s ILE 280 CO 0.00 -0.25 -0.04 -0.44 0.00 0.00 0.00 174.94 174.21 2j0j s SER 281 N 1.66 4.16 0.39 3.58 0.01 -0.77 0.41 113.70 123.14 2j0j s SER 281 Ca -0.01 -0.90 0.04 0.00 1.31 0.00 0.00 55.95 56.40 2j0j s SER 281 Cb -0.18 -0.58 -0.03 0.00 0.21 0.00 0.00 66.02 65.45 2j0j s SER 281 CO -0.10 -0.11 0.13 -0.72 0.41 0.00 0.00 173.24 172.86 2j0j s TYR 282 N -2.46 1.78 0.04 2.43 -0.85 0.21 -0.85 117.35 117.65 2j0j s TYR 282 Ca 0.33 -1.28 -0.28 0.00 -0.52 0.00 0.00 57.07 55.32 2j0j s TYR 282 Cb -0.03 -1.12 0.09 0.00 0.38 0.00 0.00 41.96 41.28 2j0j s TYR 282 CO 0.19 -0.32 0.95 -0.48 -1.52 0.00 0.00 175.55 174.37 2j0j s LEU 283 N -3.57 -0.27 0.14 -3.49 0.05 -1.20 -0.45 118.68 109.88 2j0j s LEU 283 Ca 0.26 -0.15 0.00 0.00 0.05 0.00 0.00 54.13 54.29 2j0j s LEU 283 Cb 0.03 2.00 0.00 0.00 -2.05 0.00 0.00 46.19 46.17 2j0j s LEU 283 CO 0.15 -0.68 0.00 0.41 -0.55 0.00 0.00 176.35 175.69 2j0j n THR 284 N -0.33 0.10 0.00 5.48 -1.04 -1.26 -2.26 114.28 114.97 2j0j n THR 284 Ca -0.07 0.03 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 2j0j n THR 284 Cb 0.61 -0.42 0.00 0.00 -1.82 0.00 0.00 70.33 68.70 2j0j n THR 284 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2j0j n ASP 285 N -3.02 0.00 0.00 8.00 8.00 -1.26 -4.86 116.55 123.41 2j0j n ASP 285 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2j0j n ASP 285 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2j0j n ASP 285 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 2j0j n LYS 286 N 12.63 0.00 -0.11 -1.24 2.85 -1.26 -5.01 118.16 126.03 2j0j n LYS 286 Ca 0.00 0.00 -0.16 0.00 -1.05 0.00 0.00 58.31 57.10 2j0j n LYS 286 Cb 0.00 0.00 -0.10 0.00 -0.65 0.00 0.00 35.03 34.28 2j0j n LYS 286 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2j0j n GLY 287 N 1.33 -0.31 3.20 2.58 0.00 -1.26 -5.08 105.19 105.65 2j0j n GLY 287 Ca 0.00 -0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 2j0j n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j0j n ALA 288 N -3.25 -4.44 -0.88 4.61 0.00 -1.26 -4.86 120.51 110.42 2j0j n ALA 288 Ca -0.39 -1.32 -0.28 0.00 0.00 0.00 0.00 53.44 51.44 2j0j n ALA 288 Cb 0.90 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 19.02 2j0j n ALA 288 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2j0j n ASN 289 N -0.55 -2.11 -2.89 0.00 6.94 -1.26 -4.93 115.26 110.47 2j0j n ASN 289 Ca 0.00 0.53 -0.10 0.00 -0.02 0.00 0.00 54.58 54.98 2j0j n ASN 289 Cb 0.65 -0.60 0.06 0.00 -2.36 0.00 0.00 39.78 37.53 2j0j n ASN 289 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 2j0j n PRO 290 N 0.94 -0.09 -4.05 -0.53 -0.04 -1.26 -4.91 135.00 125.06 2j0j n PRO 290 Ca 0.07 -0.95 -0.18 0.00 -0.04 0.00 0.00 63.50 62.40 2j0j n PRO 290 Cb 0.29 -0.40 -0.16 0.00 -0.04 0.00 0.00 33.50 33.18 2j0j n PRO 290 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2j0j s THR 291 N -1.62 0.34 0.62 0.52 2.01 0.40 -4.97 115.64 112.94 2j0j s THR 291 Ca 0.28 -0.03 -0.18 0.00 0.31 0.00 0.00 61.69 62.07 2j0j s THR 291 Cb -0.01 -0.39 -0.02 0.00 0.01 0.00 0.00 72.50 72.09 2j0j s THR 291 CO 0.19 0.17 1.19 -2.28 -0.69 0.00 0.00 174.62 173.20 2j0j s HIS 292 N 0.82 2.38 0.07 4.92 2.46 -1.26 -0.61 115.29 124.07 2j0j s HIS 292 Ca -0.09 1.54 0.00 0.00 0.47 0.00 0.00 55.06 56.98 2j0j s HIS 292 Cb -0.13 -3.42 0.00 0.00 -0.13 0.00 0.00 32.58 28.91 2j0j s HIS 292 CO -0.01 -2.15 0.00 1.28 -2.47 0.00 0.00 174.74 171.39 2j0j n LEU 293 N -1.90 0.31 -3.63 8.88 4.77 0.17 -4.79 117.00 120.80 2j0j n LEU 293 Ca 0.13 0.11 -0.11 0.00 -0.03 0.00 0.00 56.01 56.11 2j0j n LEU 293 Cb 0.50 -0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.48 2j0j n LEU 293 CO 0.45 -0.42 0.39 0.00 -1.33 0.00 0.00 177.39 176.48 2j0j s ALA 294 N -2.00 -1.82 0.20 -1.18 0.00 -1.10 -5.02 121.76 110.84 2j0j s ALA 294 Ca 0.00 2.19 -0.22 0.00 0.00 0.00 0.00 51.96 53.93 2j0j s ALA 294 Cb 0.00 -1.28 -0.08 0.00 0.00 0.00 0.00 23.12 21.76 2j0j s ALA 294 CO 0.00 -0.36 0.75 -0.51 0.00 0.00 0.00 175.76 175.64 2j0j s ASP 295 N 0.88 7.19 0.44 0.00 -0.00 -1.26 -1.29 116.67 122.62 2j0j s ASP 295 Ca -0.04 1.51 0.15 0.00 -0.00 0.00 0.00 52.55 54.17 2j0j s ASP 295 Cb -0.05 -2.45 1.05 0.00 -0.00 0.00 0.00 42.92 41.47 2j0j s ASP 295 CO -0.07 0.10 1.97 -0.26 -0.00 0.00 0.00 175.17 176.91 2j0j h PHE 296 N 3.79 0.43 0.00 4.23 -1.00 -1.92 0.67 116.94 123.12 2j0j h PHE 296 Ca -0.48 0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.32 2j0j h PHE 296 Cb 1.20 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 40.62 2j0j h PHE 296 CO 0.64 0.19 0.00 0.27 -1.61 0.00 0.00 178.31 177.80 2j0j n ASN 297 N -4.47 0.18 0.00 2.17 6.94 -1.26 -2.84 115.26 115.98 2j0j n ASN 297 Ca 0.11 -0.79 0.00 0.00 -0.02 0.00 0.00 54.58 53.88 2j0j n ASN 297 Cb 0.42 -0.09 0.00 0.00 -2.36 0.00 0.00 39.78 37.75 2j0j n ASN 297 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2j0j n GLN 298 N -0.13 4.83 -2.45 -3.83 6.02 0.23 -5.02 117.38 117.03 2j0j n GLN 298 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.56 2j0j n GLN 298 Cb 0.04 -0.43 -0.02 0.00 1.02 0.00 0.00 30.24 30.85 2j0j n GLN 298 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2j0j s VAL 299 N -0.83 4.15 -0.10 5.09 1.01 -1.13 -1.55 120.40 127.03 2j0j s VAL 299 Ca 0.00 1.27 -0.18 0.00 0.00 0.00 0.00 61.98 63.07 2j0j s VAL 299 Cb 0.00 -4.23 -0.15 0.00 0.00 0.00 0.00 36.38 32.00 2j0j s VAL 299 CO 0.00 -0.57 0.57 -0.61 0.00 0.00 0.00 175.10 174.48 2j0j h GLN 300 N 9.39 -0.07 -3.73 2.72 4.15 -0.50 -3.48 115.11 123.59 2j0j h GLN 300 Ca -0.25 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.07 2j0j h GLN 300 Cb 1.09 0.02 -0.16 0.00 0.21 0.00 0.00 27.48 28.64 2j0j h GLN 300 CO 1.05 0.45 -0.41 0.95 -1.93 0.00 0.00 178.83 178.94 2j0j s THR 301 N -2.39 0.13 -0.05 2.39 -4.23 -1.20 -4.97 115.64 105.31 2j0j s THR 301 Ca -0.11 -1.09 0.05 0.00 -1.18 0.00 0.00 61.69 59.36 2j0j s THR 301 Cb -0.01 -1.14 -0.01 0.00 1.34 0.00 0.00 72.50 72.69 2j0j s THR 301 CO 0.41 -0.60 -0.21 -0.63 -0.54 0.00 0.00 174.62 173.05 2j0j s ILE 302 N -3.23 1.75 -0.05 2.99 1.01 0.12 -1.57 121.20 122.22 2j0j s ILE 302 Ca 0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 60.65 59.71 2j0j s ILE 302 Cb 0.02 -1.49 0.01 0.00 0.01 0.00 0.00 42.46 41.01 2j0j s ILE 302 CO -0.08 0.49 0.14 -1.58 0.00 0.00 0.00 174.94 173.91 2j0j s GLN 303 N -0.03 0.17 -0.09 2.79 2.00 -1.13 -1.20 119.66 122.17 2j0j s GLN 303 Ca -0.05 0.17 -0.03 0.00 -2.00 0.00 0.00 55.36 53.45 2j0j s GLN 303 Cb -0.13 0.08 0.05 0.00 0.80 0.00 0.00 33.01 33.81 2j0j s GLN 303 CO 0.03 -0.02 0.14 1.52 -0.50 0.00 0.00 175.29 176.46 2j0j s TYR 304 N 0.03 -0.10 0.39 1.67 -0.00 -1.26 0.67 117.35 118.75 2j0j s TYR 304 Ca -0.00 0.43 0.08 0.00 -0.00 0.00 0.00 57.07 57.57 2j0j s TYR 304 Cb -0.01 -0.35 -0.07 0.00 -0.00 0.00 0.00 41.96 41.53 2j0j s TYR 304 CO 0.00 -0.30 0.06 -1.54 -0.00 0.00 0.00 175.55 173.77 2j0j s SER 305 N 2.26 4.09 0.88 -0.18 1.04 0.10 -4.99 113.70 116.90 2j0j s SER 305 Ca 0.04 -1.20 -0.11 0.00 0.48 0.00 0.00 55.95 55.15 2j0j s SER 305 Cb -0.13 -0.44 0.12 0.00 0.10 0.00 0.00 66.02 65.67 2j0j s SER 305 CO -0.06 -0.42 1.09 0.54 0.98 0.00 0.00 173.24 175.37 2j0j s ASN 306 N -3.76 3.61 -0.22 7.02 2.20 -1.26 -0.59 114.94 121.93 2j0j s ASN 306 Ca 0.37 1.49 -0.29 0.00 -0.94 0.00 0.00 52.86 53.49 2j0j s ASN 306 Cb 0.06 -2.18 -0.04 0.00 -2.00 0.00 0.00 41.25 37.09 2j0j s ASN 306 CO 0.20 -2.55 1.97 -0.55 -2.94 0.00 0.00 177.10 173.22 2j0j s SER 307 N -3.46 5.84 0.00 3.54 0.15 0.16 -4.61 113.70 115.32 2j0j s SER 307 Ca 0.63 1.76 0.01 0.00 0.70 0.00 0.00 55.95 59.05 2j0j s SER 307 Cb -0.18 -2.52 0.07 0.00 -1.71 0.00 0.00 66.02 61.68 2j0j s SER 307 CO 0.57 -1.67 0.29 -1.84 1.20 0.00 0.00 173.24 171.78 2j0j n GLU 308 N 8.35 0.11 0.00 5.44 0.00 -1.26 -4.59 120.64 128.70 2j0j n GLU 308 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.41 2j0j n GLU 308 Cb 0.45 -1.15 0.00 0.00 0.00 0.00 0.00 31.44 30.74 2j0j n GLU 308 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2j0j n ASP 309 N -0.65 0.24 -0.18 -1.84 5.75 -1.26 -5.08 116.55 113.53 2j0j n ASP 309 Ca 0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 54.79 54.76 2j0j n ASP 309 Cb 0.00 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.13 2j0j n ASP 309 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 2j0j h LYS 310 N 0.00 -0.07 -6.36 0.11 3.11 -2.03 -3.42 116.57 107.91 2j0j h LYS 310 Ca 0.00 0.00 -0.62 0.00 -2.81 0.00 0.00 60.65 57.22 2j0j h LYS 310 Cb 0.00 0.02 -0.12 0.00 -1.00 0.00 0.00 32.23 31.13 2j0j h LYS 310 CO 0.00 -0.05 -0.67 0.34 -2.81 0.00 0.00 179.45 176.27 2j0j s ASP 311 N -5.19 4.83 0.00 4.20 2.15 -1.26 -5.00 116.67 116.40 2j0j s ASP 311 Ca -0.14 -0.32 -0.04 0.00 0.43 0.00 0.00 52.55 52.48 2j0j s ASP 311 Cb 0.17 -1.06 -0.17 0.00 -0.30 0.00 0.00 42.92 41.56 2j0j s ASP 311 CO 0.72 0.12 2.72 0.54 -0.17 0.00 0.00 175.17 179.10 2j0j n ARG 312 N 0.18 1.44 -1.55 4.34 1.74 -1.26 -4.02 116.66 117.52 2j0j n ARG 312 Ca -0.10 -0.63 -0.34 0.00 -0.77 0.00 0.00 57.85 56.01 2j0j n ARG 312 Cb 0.54 -1.72 0.08 0.00 -1.02 0.00 0.00 32.46 30.33 2j0j n ARG 312 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2j0j s LYS 313 N 1.15 2.37 -0.24 5.56 1.02 -1.26 -3.72 119.74 124.61 2j0j s LYS 313 Ca 0.42 1.65 -0.29 0.00 0.02 0.00 0.00 55.97 57.77 2j0j s LYS 313 Cb 0.20 -1.87 0.01 0.00 -0.52 0.00 0.00 37.83 35.65 2j0j s LYS 313 CO 0.00 -1.64 1.05 0.20 -0.92 0.00 0.00 175.35 174.04 2j0j s GLY 314 N -2.17 1.68 -0.30 -3.33 0.00 0.32 0.38 107.32 103.89 2j0j s GLY 314 Ca 0.72 0.15 -0.06 0.00 0.00 0.00 0.00 44.72 45.54 2j0j s GLY 314 CO 0.43 2.21 0.07 -0.29 0.00 0.00 0.00 173.10 175.53 2j0j s MET 315 N 3.28 2.91 -0.14 2.90 1.75 0.24 0.10 119.30 130.34 2j0j s MET 315 Ca 0.45 -0.98 -0.01 0.00 -1.25 0.00 0.00 55.69 53.90 2j0j s MET 315 Cb -0.15 -3.35 -0.01 0.00 2.84 0.00 0.00 34.83 34.15 2j0j s MET 315 CO 0.08 -0.51 -0.12 -1.17 -0.65 0.00 0.00 175.02 172.65 2j0j s LEU 316 N 1.45 2.76 -0.59 4.11 2.96 -0.55 -0.72 118.68 128.10 2j0j s LEU 316 Ca 0.01 -0.33 0.04 0.00 -0.22 0.00 0.00 54.13 53.63 2j0j s LEU 316 Cb -0.18 -1.63 0.15 0.00 0.50 0.00 0.00 46.19 45.03 2j0j s LEU 316 CO 0.02 0.14 0.36 -1.10 -1.32 0.00 0.00 176.35 174.45 2j0j s GLN 317 N 0.49 2.10 -0.10 1.98 -1.52 0.21 -1.42 119.66 121.40 2j0j s GLN 317 Ca -0.08 -2.87 -0.25 0.00 -1.95 0.00 0.00 55.36 50.21 2j0j s GLN 317 Cb -0.16 -3.22 -0.03 0.00 -0.22 0.00 0.00 33.01 29.39 2j0j s GLN 317 CO 0.04 -1.20 0.78 -0.51 -0.25 0.00 0.00 175.29 174.15 2j0j s LEU 318 N -0.73 4.27 -0.17 2.90 1.43 -0.95 -2.85 118.68 122.58 2j0j s LEU 318 Ca 0.21 1.24 -0.12 0.00 -1.03 0.00 0.00 54.13 54.43 2j0j s LEU 318 Cb -0.16 -3.19 -0.05 0.00 0.03 0.00 0.00 46.19 42.82 2j0j s LEU 318 CO -0.08 -0.23 0.22 -0.75 0.23 0.00 0.00 176.35 175.74 2j0j s LYS 319 N 1.32 4.16 -0.11 1.70 2.20 -0.61 -0.16 119.74 128.23 2j0j s LYS 319 Ca 0.39 -0.04 0.02 0.00 -0.36 0.00 0.00 55.97 55.98 2j0j s LYS 319 Cb -0.18 -3.40 -0.01 0.00 -1.51 0.00 0.00 37.83 32.73 2j0j s LYS 319 CO 0.17 0.32 -0.17 0.42 -0.36 0.00 0.00 175.35 175.73 2j0j s ILE 320 N 0.26 2.69 -0.34 5.43 1.09 -1.26 0.30 121.20 129.37 2j0j s ILE 320 Ca 0.13 -0.80 -0.36 0.00 -1.10 0.00 0.00 60.65 58.52 2j0j s ILE 320 Cb -0.12 -2.09 -0.16 0.00 -1.06 0.00 0.00 42.46 39.03 2j0j s ILE 320 CO 0.02 0.54 1.19 0.00 -0.10 0.00 0.00 174.94 176.59 2j0j n ALA 321 N 3.39 -1.28 0.00 9.38 0.00 -0.60 -2.67 120.51 128.73 2j0j n ALA 321 Ca -0.18 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2j0j n ALA 321 Cb 0.53 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.50 2j0j n ALA 321 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j0j n GLY 322 N 2.87 2.02 3.66 0.00 0.00 -1.26 -4.97 105.19 107.50 2j0j n GLY 322 Ca 0.23 -0.37 -0.50 0.00 0.00 0.00 0.00 46.02 45.38 2j0j n GLY 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j0j n ALA 323 N 0.00 0.71 0.59 4.61 0.00 -1.09 -4.86 120.51 120.46 2j0j n ALA 323 Ca 0.00 0.24 0.11 0.00 0.00 0.00 0.00 53.44 53.79 2j0j n ALA 323 Cb 0.00 -2.46 0.45 0.00 0.00 0.00 0.00 19.45 17.43 2j0j n ALA 323 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2j0j n PRO 324 N 6.69 0.12 -2.64 0.00 -0.04 -1.26 -4.36 135.00 133.51 2j0j n PRO 324 Ca 0.26 0.25 -0.43 0.00 -0.04 0.00 0.00 63.50 63.54 2j0j n PRO 324 Cb 0.26 -1.69 -0.02 0.00 -0.04 0.00 0.00 33.50 32.01 2j0j n PRO 324 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2j0j s GLU 325 N -3.12 4.12 -0.31 0.54 8.01 -1.26 -4.99 118.70 121.68 2j0j s GLU 325 Ca 0.08 1.16 -0.29 0.00 0.01 0.00 0.00 54.97 55.93 2j0j s GLU 325 Cb 0.12 -3.71 -0.01 0.00 -4.31 0.00 0.00 34.13 26.22 2j0j s GLU 325 CO 0.43 -0.83 1.48 -1.25 0.01 0.00 0.00 175.26 175.10 2j0j s PRO 326 N 3.53 3.72 -0.25 0.39 0.04 -1.26 -4.57 135.00 136.61 2j0j s PRO 326 Ca 0.45 1.30 -0.28 0.00 0.04 0.00 0.00 61.00 62.51 2j0j s PRO 326 Cb -0.13 -4.00 -0.05 0.00 0.04 0.00 0.00 34.50 30.36 2j0j s PRO 326 CO 0.13 -1.38 2.24 -1.17 0.04 0.00 0.00 177.00 176.86 2j0j s LEU 327 N 5.19 3.43 0.06 -3.56 2.96 0.77 -4.81 118.68 122.73 2j0j s LEU 327 Ca 0.65 1.81 -0.21 0.00 -0.22 0.00 0.00 54.13 56.16 2j0j s LEU 327 Cb -0.19 -3.42 -0.06 0.00 0.50 0.00 0.00 46.19 43.02 2j0j s LEU 327 CO 0.29 -2.06 0.63 -0.89 -1.32 0.00 0.00 176.35 173.00 2j0j s THR 328 N 8.71 4.72 -0.02 3.68 2.01 -1.26 -2.24 115.64 131.24 2j0j s THR 328 Ca 1.00 1.34 0.05 0.00 0.31 0.00 0.00 61.69 64.39 2j0j s THR 328 Cb -0.31 -3.96 -0.01 0.00 0.01 0.00 0.00 72.50 68.22 2j0j s THR 328 CO 0.34 0.50 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.92 2j0j s VAL 329 N -0.78 1.29 -0.26 3.82 1.01 -0.51 -2.49 120.40 122.47 2j0j s VAL 329 Ca 0.31 -0.67 -0.06 0.00 0.00 0.00 0.00 61.98 61.56 2j0j s VAL 329 Cb -0.20 -1.09 -0.00 0.00 0.00 0.00 0.00 36.38 35.10 2j0j s VAL 329 CO 0.20 0.37 0.03 -0.89 0.00 0.00 0.00 175.10 174.81 2j0j s THR 330 N -0.22 3.77 0.07 3.92 2.01 0.16 -1.48 115.64 123.89 2j0j s THR 330 Ca 0.03 -0.59 -0.00 0.00 0.31 0.00 0.00 61.69 61.44 2j0j s THR 330 Cb -0.08 -2.86 -0.04 0.00 0.01 0.00 0.00 72.50 69.53 2j0j s THR 330 CO 0.00 0.22 0.23 0.00 -0.69 0.00 0.00 174.62 174.38 2j0j s ALA 331 N 1.50 3.98 -0.62 7.40 0.00 0.29 -1.65 121.76 132.66 2j0j s ALA 331 Ca 0.04 -0.82 0.14 0.00 0.00 0.00 0.00 51.96 51.31 2j0j s ALA 331 Cb -0.16 -1.86 0.68 0.00 0.00 0.00 0.00 23.12 21.78 2j0j s ALA 331 CO 0.01 0.79 1.42 -2.30 0.00 0.00 0.00 175.76 175.68 2j0j n PRO 332 N 0.21 0.08 -3.47 0.00 -0.02 -1.26 -0.52 135.00 130.02 2j0j n PRO 332 Ca -0.05 0.51 -0.13 0.00 -2.02 0.00 0.00 63.50 61.81 2j0j n PRO 332 Cb 0.51 -1.73 -0.03 0.00 -0.02 0.00 0.00 33.50 32.23 2j0j n PRO 332 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2j0j s SER 333 N -3.58 -0.57 0.18 2.55 1.04 -1.26 -4.72 113.70 107.34 2j0j s SER 333 Ca 0.01 0.26 -0.14 0.00 0.48 0.00 0.00 55.95 56.55 2j0j s SER 333 Cb 0.05 0.54 0.14 0.00 0.10 0.00 0.00 66.02 66.86 2j0j s SER 333 CO 0.17 -0.78 1.73 0.25 0.98 0.00 0.00 173.24 175.58 2j0j h LEU 334 N 2.35 0.05 -0.84 2.42 5.85 -1.80 -2.04 115.31 121.31 2j0j h LEU 334 Ca -0.30 0.07 0.21 0.00 0.84 0.00 0.00 57.88 58.71 2j0j h LEU 334 Cb 1.24 0.09 -0.14 0.00 0.37 0.00 0.00 40.66 42.22 2j0j h LEU 334 CO 0.37 0.06 0.16 0.74 -0.34 0.00 0.00 178.44 179.43 2j0j h THR 335 N 0.25 0.32 -0.36 1.05 2.02 -1.96 0.76 112.91 114.99 2j0j h THR 335 Ca 0.22 -0.06 -0.16 0.00 0.77 0.00 0.00 66.41 67.18 2j0j h THR 335 Cb 0.26 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 66.80 2j0j h THR 335 CO -0.27 0.03 -0.39 0.40 0.37 0.00 0.00 175.52 175.66 2j0j h ILE 336 N 0.18 1.28 0.06 3.11 2.04 -1.80 -1.36 117.51 121.01 2j0j h ILE 336 Ca 0.51 -1.57 0.01 0.00 1.00 0.00 0.00 64.86 64.81 2j0j h ILE 336 Cb 0.98 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 2j0j h ILE 336 CO -0.66 0.52 -0.11 0.00 0.00 0.00 0.00 178.15 177.90 2j0j h ALA 337 N 0.83 -0.18 -0.59 1.87 0.00 0.06 0.17 119.26 121.43 2j0j h ALA 337 Ca 0.06 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.07 2j0j h ALA 337 Cb 0.97 0.18 -0.11 0.00 0.00 0.00 0.00 17.79 18.83 2j0j h ALA 337 CO 0.09 -0.62 -0.18 0.93 0.00 0.00 0.00 179.25 179.47 2j0j h GLU 338 N -0.22 -0.03 -0.06 0.00 5.08 0.53 -0.33 114.58 119.55 2j0j h GLU 338 Ca 0.02 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2j0j h GLU 338 Cb 0.25 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2j0j h GLU 338 CO -0.07 -0.02 -0.01 -0.91 -1.00 0.00 0.00 179.01 176.99 2j0j h ASN 339 N -0.03 -0.05 -0.71 1.42 2.35 -0.77 -1.02 115.58 116.77 2j0j h ASN 339 Ca 0.28 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 56.02 2j0j h ASN 339 Cb 0.46 0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.83 2j0j h ASN 339 CO -0.62 -0.02 0.36 0.24 -1.65 0.00 0.00 177.43 175.74 2j0j h MET 340 N 0.01 1.03 0.24 0.81 2.86 -0.51 -2.09 114.93 117.28 2j0j h MET 340 Ca 0.03 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 2j0j h MET 340 Cb 0.04 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.50 2j0j h MET 340 CO -0.06 0.79 -0.15 0.00 1.06 0.00 0.00 176.91 178.55 2j0j h ALA 341 N 1.36 -0.37 -0.42 6.32 0.00 -0.67 -1.97 119.26 123.51 2j0j h ALA 341 Ca 0.25 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.15 2j0j h ALA 341 Cb 0.09 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 17.98 2j0j h ALA 341 CO -0.03 -0.72 -0.53 0.22 0.00 0.00 0.00 179.25 178.19 2j0j h ASP 342 N -0.38 -1.77 -0.08 0.00 3.58 -0.89 0.31 116.42 117.19 2j0j h ASP 342 Ca -0.02 0.24 0.01 0.00 0.42 0.00 0.00 57.03 57.68 2j0j h ASP 342 Cb 0.32 0.74 -0.02 0.00 1.72 0.00 0.00 39.33 42.09 2j0j h ASP 342 CO 0.03 -0.40 -0.10 0.25 -2.88 0.00 0.00 179.24 176.14 2j0j h LEU 343 N -0.38 -0.34 -0.39 2.28 5.85 -1.06 0.96 115.31 122.24 2j0j h LEU 343 Ca 0.09 0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.94 2j0j h LEU 343 Cb 0.59 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.68 2j0j h LEU 343 CO -0.60 -0.07 -0.26 0.40 -0.34 0.00 0.00 178.44 177.57 2j0j h ILE 344 N -0.07 0.33 -0.63 4.05 2.04 -1.13 0.51 117.51 122.61 2j0j h ILE 344 Ca 0.01 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.99 2j0j h ILE 344 Cb 0.11 0.33 -0.08 0.00 -0.74 0.00 0.00 36.82 36.43 2j0j h ILE 344 CO -0.11 0.00 0.19 -0.78 0.00 0.00 0.00 178.15 177.45 2j0j h ASP 345 N -0.19 0.12 -0.58 1.72 3.58 0.64 0.17 116.42 121.88 2j0j h ASP 345 Ca 0.18 0.10 0.09 0.00 0.42 0.00 0.00 57.03 57.82 2j0j h ASP 345 Cb 0.48 0.11 -0.07 0.00 1.72 0.00 0.00 39.33 41.58 2j0j h ASP 345 CO -0.50 0.06 0.21 1.23 -2.88 0.00 0.00 179.24 177.36 2j0j h GLY 346 N 0.34 0.79 1.30 -0.78 0.00 0.30 -1.26 103.07 103.76 2j0j h GLY 346 Ca 0.33 -0.11 -0.09 0.00 0.00 0.00 0.00 47.33 47.47 2j0j h GLY 346 CO -0.38 -0.02 -0.07 -0.97 0.00 0.00 0.00 176.54 175.11 2j0j h TYR 347 N 0.38 0.90 -0.27 5.60 -1.99 0.10 -2.53 116.97 119.17 2j0j h TYR 347 Ca 0.29 -0.15 -0.07 0.00 2.00 0.00 0.00 58.73 60.80 2j0j h TYR 347 Cb 0.35 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 38.83 2j0j h TYR 347 CO -0.17 0.86 -0.09 0.00 -0.00 0.00 0.00 178.16 178.76 2j0j n ARG 349 N -4.49 0.01 -0.06 0.00 0.00 -0.52 -1.68 116.66 109.93 2j0j n ARG 349 Ca -0.04 0.46 -0.07 0.00 -0.00 0.00 0.00 57.85 58.21 2j0j n ARG 349 Cb 0.33 -1.53 -0.02 0.00 0.00 0.00 0.00 32.46 31.24 2j0j n ARG 349 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2j0j n LEU 350 N -1.55 1.65 -0.11 6.15 7.94 -0.76 -3.46 117.00 126.86 2j0j n LEU 350 Ca 0.01 0.27 0.26 0.00 -1.11 0.00 0.00 56.01 55.44 2j0j n LEU 350 Cb 0.04 -0.64 0.72 0.00 0.53 0.00 0.00 43.42 44.06 2j0j n LEU 350 CO 0.03 -0.37 1.24 0.58 -1.11 0.00 0.00 177.39 177.76 2j0j h VAL 351 N -0.75 0.54 -3.72 1.96 2.07 -0.33 -3.36 116.25 112.67 2j0j h VAL 351 Ca 0.00 0.00 -0.68 0.00 0.82 0.00 0.00 66.70 66.84 2j0j h VAL 351 Cb 0.75 0.58 -0.19 0.00 -1.52 0.00 0.00 31.29 30.91 2j0j h VAL 351 CO 0.00 0.00 -0.72 0.20 0.02 0.00 0.00 177.57 177.07 2j0j s ASN 352 N -5.63 4.48 0.00 0.57 0.01 -0.67 -5.00 114.94 108.70 2j0j s ASN 352 Ca -0.05 -0.13 0.00 0.00 -0.71 0.00 0.00 52.86 51.97 2j0j s ASN 352 Cb 0.20 -1.04 0.00 0.00 0.41 0.00 0.00 41.25 40.82 2j0j s ASN 352 CO 0.73 0.31 0.00 0.61 -1.51 0.00 0.00 177.10 177.24 2j0j n GLY 353 N 1.87 0.00 3.73 0.66 0.00 -1.26 -4.50 105.19 105.70 2j0j n GLY 353 Ca -0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 2j0j n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j0j s ALA 354 N -1.87 2.23 -0.07 4.61 0.00 -1.22 -4.99 121.76 120.45 2j0j s ALA 354 Ca 0.00 0.84 0.14 0.00 0.00 0.00 0.00 51.96 52.94 2j0j s ALA 354 Cb 0.00 -3.44 -0.21 0.00 0.00 0.00 0.00 23.12 19.47 2j0j s ALA 354 CO 0.00 -1.68 0.33 0.25 0.00 0.00 0.00 175.76 174.65 2j0j n THR 355 N -2.53 0.00 -4.34 0.00 -2.24 -1.26 -4.63 114.28 99.28 2j0j n THR 355 Ca 0.13 -0.31 -0.21 0.00 -2.27 0.00 0.00 64.05 61.40 2j0j n THR 355 Cb 0.50 0.25 -0.11 0.00 -2.10 0.00 0.00 70.33 68.88 2j0j n THR 355 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j0j s GLN 356 N -2.91 1.31 0.57 -0.78 1.03 -1.26 -5.10 119.66 112.53 2j0j s GLN 356 Ca -0.04 -1.49 -0.18 0.00 0.04 0.00 0.00 55.36 53.69 2j0j s GLN 356 Cb 0.09 -1.28 -0.10 0.00 0.03 0.00 0.00 33.01 31.76 2j0j s GLN 356 CO 0.58 0.24 0.37 0.45 -2.54 0.00 0.00 175.29 174.39 2j0j n SER 357 N 0.02 -1.68 -0.86 12.60 2.88 -1.26 -4.89 113.62 120.43 2j0j n SER 357 Ca -0.11 0.70 0.07 0.00 -1.33 0.00 0.00 58.87 58.20 2j0j n SER 357 Cb 0.58 -1.10 0.22 0.00 -0.75 0.00 0.00 64.21 63.16 2j0j n SER 357 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2j0j n PHE 358 N -1.72 0.78 -4.05 0.66 3.01 -1.26 -4.99 117.46 109.89 2j0j n PHE 358 Ca 0.11 -0.66 -0.35 0.00 1.01 0.00 0.00 57.45 57.55 2j0j n PHE 358 Cb 0.48 -0.17 -0.09 0.00 -0.01 0.00 0.00 39.48 39.69 2j0j n PHE 358 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2j0j s ILE 359 N -1.82 4.83 0.61 4.37 1.01 -1.26 0.13 121.20 129.08 2j0j s ILE 359 Ca 0.34 -0.03 -0.18 0.00 0.00 0.00 0.00 60.65 60.78 2j0j s ILE 359 Cb 0.23 -3.14 -0.03 0.00 0.01 0.00 0.00 42.46 39.54 2j0j s ILE 359 CO 0.14 0.52 1.24 0.27 0.00 0.00 0.00 174.94 177.11 2j0j s ILE 360 N -0.13 2.43 -0.45 2.92 -5.25 -0.35 -4.94 121.20 115.43 2j0j s ILE 360 Ca 0.07 0.26 -0.03 0.00 -0.99 0.00 0.00 60.65 59.97 2j0j s ILE 360 Cb -0.12 -3.10 0.12 0.00 2.95 0.00 0.00 42.46 42.31 2j0j s ILE 360 CO 0.01 -0.06 0.25 -0.13 -1.79 0.00 0.00 174.94 173.22 2j0j s ARG 361 N -3.36 2.11 0.35 0.37 0.52 -1.26 -4.94 118.95 112.74 2j0j s ARG 361 Ca 0.79 -1.96 0.27 0.00 -0.52 0.00 0.00 55.73 54.31 2j0j s ARG 361 Cb -0.33 -3.61 0.92 0.00 0.52 0.00 0.00 34.95 32.45 2j0j s ARG 361 CO 0.35 -1.09 0.91 -2.30 0.02 0.00 0.00 175.30 173.19 2j0j n PRO 362 N 4.38 0.00 -1.26 3.54 -0.01 -1.26 -5.27 135.00 135.12 2j0j n PRO 362 Ca -0.00 0.66 0.00 0.00 -0.01 0.00 0.00 63.50 64.14 2j0j n PRO 362 Cb 0.41 -1.55 0.00 0.00 -0.01 0.00 0.00 33.50 32.34 2j0j n PRO 362 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 175.50 177.90 2j0j n THR 394 N -2.98 0.00 0.00 3.45 -1.04 -1.26 -5.32 114.28 107.14 2j0j n THR 394 Ca 0.24 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.25 2j0j n THR 394 Cb 1.16 -0.79 0.00 0.00 -1.82 0.00 0.00 70.33 68.88 2j0j n THR 394 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2j0j n ASP 395 N 1.62 0.00 -1.85 8.00 8.00 -1.26 -4.97 116.55 126.08 2j0j n ASP 395 Ca 0.00 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.36 2j0j n ASP 395 Cb 0.00 0.00 0.22 0.00 -0.02 0.00 0.00 41.12 41.32 2j0j n ASP 395 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2j0j n ASP 396 N 0.00 3.68 -4.59 -2.24 3.85 -1.26 -3.33 116.55 112.67 2j0j n ASP 396 Ca 0.00 -3.54 -0.61 0.00 -0.71 0.00 0.00 54.79 49.93 2j0j n ASP 396 Cb 0.00 -0.76 -0.08 0.00 -1.35 0.00 0.00 41.12 38.93 2j0j n ASP 396 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2j0j n TYR 397 N -0.89 1.07 -2.90 2.11 4.19 -1.26 -4.85 117.16 114.62 2j0j n TYR 397 Ca 0.47 1.05 -0.13 0.00 3.31 0.00 0.00 57.90 62.60 2j0j n TYR 397 Cb 1.42 -2.16 0.01 0.00 0.49 0.00 0.00 39.34 39.10 2j0j n TYR 397 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2j0j n ALA 398 N 2.42 -0.26 -2.41 2.98 0.00 -1.25 -1.63 120.51 120.35 2j0j n ALA 398 Ca 0.23 -1.96 -0.41 0.00 0.00 0.00 0.00 53.44 51.31 2j0j n ALA 398 Cb 0.05 -1.19 -0.04 0.00 0.00 0.00 0.00 19.45 18.26 2j0j n ALA 398 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2j0j s GLU 399 N 0.21 4.62 -0.31 0.00 2.12 -0.96 -4.91 118.70 119.46 2j0j s GLU 399 Ca 0.33 1.36 -0.27 0.00 0.36 0.00 0.00 54.97 56.75 2j0j s GLU 399 Cb 0.18 -3.40 0.01 0.00 0.26 0.00 0.00 34.13 31.18 2j0j s GLU 399 CO -0.19 0.16 0.97 0.96 -0.54 0.00 0.00 175.26 176.62 2j0j s ILE 400 N 0.26 4.61 0.00 -3.70 -5.25 -1.26 -2.24 121.20 113.61 2j0j s ILE 400 Ca 0.46 1.54 0.00 0.00 -0.99 0.00 0.00 60.65 61.67 2j0j s ILE 400 Cb -0.22 -4.32 0.00 0.00 2.95 0.00 0.00 42.46 40.87 2j0j s ILE 400 CO 0.28 -0.39 0.00 2.30 -1.79 0.00 0.00 174.94 175.33 2j0j n ILE 401 N 5.74 0.00 0.00 8.37 -5.35 -0.60 -5.03 119.36 122.49 2j0j n ILE 401 Ca 0.09 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.57 2j0j n ILE 401 Cb 0.47 -0.21 0.00 0.00 -1.74 0.00 0.00 39.64 38.16 2j0j n ILE 401 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 2j0j n ASP 402 N 0.00 0.00 -4.79 7.28 5.68 -1.26 -4.36 116.55 119.10 2j0j n ASP 402 Ca 0.00 0.00 -0.34 0.00 -0.50 0.00 0.00 54.79 53.95 2j0j n ASP 402 Cb 0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 39.95 2j0j n ASP 402 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 2j0j s GLU 403 N 3.45 3.81 -0.62 0.11 2.02 -1.26 -4.88 118.70 121.33 2j0j s GLU 403 Ca 0.00 1.40 0.06 0.00 0.02 0.00 0.00 54.97 56.45 2j0j s GLU 403 Cb 0.00 -2.15 0.25 0.00 0.10 0.00 0.00 34.13 32.33 2j0j s GLU 403 CO 0.00 -0.43 0.72 0.39 0.02 0.00 0.00 175.26 175.96 2j0j n GLU 404 N -0.87 2.34 -2.56 1.61 1.02 -1.26 -5.03 120.64 115.89 2j0j n GLU 404 Ca 0.09 -4.54 -0.30 0.00 -0.02 0.00 0.00 57.16 52.39 2j0j n GLU 404 Cb 0.52 -2.17 -0.02 0.00 -0.02 0.00 0.00 31.44 29.75 2j0j n GLU 404 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2j0j s ASP 405 N -2.32 6.45 0.09 1.62 1.01 -1.26 -5.01 116.67 117.25 2j0j s ASP 405 Ca 0.39 1.23 -0.31 0.00 0.71 0.00 0.00 52.55 54.57 2j0j s ASP 405 Cb 0.14 -2.37 -0.17 0.00 1.01 0.00 0.00 42.92 41.53 2j0j s ASP 405 CO -0.03 -0.55 0.73 1.07 0.21 0.00 0.00 175.17 176.60 2j0j n THR 406 N -1.77 0.94 -0.91 -1.27 5.66 -1.26 -4.91 114.28 110.76 2j0j n THR 406 Ca 0.04 -0.24 -0.30 0.00 -3.05 0.00 0.00 64.05 60.50 2j0j n THR 406 Cb 0.54 0.00 0.17 0.00 -1.55 0.00 0.00 70.33 69.49 2j0j n THR 406 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 2j0j s TYR 407 N -0.47 1.92 0.20 1.09 1.51 -1.26 -4.94 117.35 115.41 2j0j s TYR 407 Ca 0.71 1.43 -0.32 0.00 -1.01 0.00 0.00 57.07 57.88 2j0j s TYR 407 Cb -1.01 -3.19 -0.13 0.00 -0.11 0.00 0.00 41.96 37.52 2j0j s TYR 407 CO 0.52 -2.78 1.58 -2.37 -1.11 0.00 0.00 175.55 171.39 2j0j n THR 408 N -4.18 0.31 -1.11 -0.71 5.66 -1.26 -4.94 114.28 108.05 2j0j n THR 408 Ca 0.08 -0.08 -0.35 0.00 -3.05 0.00 0.00 64.05 60.65 2j0j n THR 408 Cb 0.54 -1.68 0.08 0.00 -1.55 0.00 0.00 70.33 67.72 2j0j n THR 408 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 2j0j n MET 409 N 3.11 0.09 -2.74 1.09 2.81 -1.26 -4.93 117.12 115.29 2j0j n MET 409 Ca 0.15 0.07 -0.42 0.00 -1.81 0.00 0.00 57.70 55.68 2j0j n MET 409 Cb 0.32 -1.70 -0.03 0.00 -0.71 0.00 0.00 33.22 31.10 2j0j n MET 409 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2j0j s PRO 410 N -2.80 4.38 0.00 0.03 0.04 -1.26 -4.70 135.00 130.68 2j0j s PRO 410 Ca 0.60 1.29 0.00 0.00 0.04 0.00 0.00 61.00 62.93 2j0j s PRO 410 Cb -0.30 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.68 2j0j s PRO 410 CO 0.64 -0.33 0.00 -1.13 0.04 0.00 0.00 177.00 176.22 2j0j n SER 411 N 5.12 0.00 0.14 6.66 3.41 -1.26 -5.14 113.62 122.55 2j0j n SER 411 Ca 0.08 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.68 2j0j n SER 411 Cb 0.49 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.64 2j0j n SER 411 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2j0j h THR 412 N 1.90 1.41 -0.89 6.66 1.35 -1.97 -3.36 112.91 118.01 2j0j h THR 412 Ca 0.00 -1.95 0.26 0.00 -0.55 0.00 0.00 66.41 64.17 2j0j h THR 412 Cb 0.00 2.05 -0.04 0.00 -1.73 0.00 0.00 68.15 68.43 2j0j h THR 412 CO 0.00 0.56 0.69 0.54 -0.25 0.00 0.00 175.52 177.06 2j0j n ARG 413 N -3.86 0.00 -0.04 4.72 1.74 -1.26 0.67 116.66 118.63 2j0j n ARG 413 Ca -0.01 0.53 -0.13 0.00 -0.77 0.00 0.00 57.85 57.47 2j0j n ARG 413 Cb 0.58 -1.25 -0.14 0.00 -1.02 0.00 0.00 32.46 30.62 2j0j n ARG 413 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2j0j n ASP 414 N -2.81 1.13 -1.49 0.55 8.00 -1.26 -4.31 116.55 116.35 2j0j n ASP 414 Ca 0.20 0.22 -0.13 0.00 0.71 0.00 0.00 54.79 55.79 2j0j n ASP 414 Cb 0.96 -0.08 0.12 0.00 -0.02 0.00 0.00 41.12 42.09 2j0j n ASP 414 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j0j n TYR 415 N -3.12 1.71 -2.80 1.24 0.18 0.21 -5.01 117.16 109.58 2j0j n TYR 415 Ca -0.27 -1.97 -0.41 0.00 1.88 0.00 0.00 57.90 57.13 2j0j n TYR 415 Cb 1.07 -0.47 -0.04 0.00 -0.38 0.00 0.00 39.34 39.52 2j0j n TYR 415 CO 0.00 0.00 0.00 -1.21 -2.08 0.00 0.00 176.86 173.57 2j0j s GLU 416 N -3.45 4.56 -0.09 -3.48 0.41 -0.89 -0.29 118.70 115.48 2j0j s GLU 416 Ca 0.48 1.30 0.04 0.00 -0.41 0.00 0.00 54.97 56.38 2j0j s GLU 416 Cb 0.41 -3.43 -0.01 0.00 -1.78 0.00 0.00 34.13 29.33 2j0j s GLU 416 CO -0.00 0.07 -0.23 0.42 -0.49 0.00 0.00 175.26 175.03 2j0j s ILE 417 N 0.60 2.17 0.13 -1.63 1.01 -0.09 -4.87 121.20 118.53 2j0j s ILE 417 Ca 0.47 -1.00 -0.30 0.00 0.00 0.00 0.00 60.65 59.82 2j0j s ILE 417 Cb -0.21 -1.82 -0.06 0.00 0.01 0.00 0.00 42.46 40.38 2j0j s ILE 417 CO 0.26 0.56 0.96 -1.10 0.00 0.00 0.00 174.94 175.62 2j0j s GLN 418 N 0.14 4.72 0.59 2.79 1.11 -1.26 -4.46 119.66 123.28 2j0j s GLN 418 Ca -0.12 1.46 0.29 0.00 0.01 0.00 0.00 55.36 57.00 2j0j s GLN 418 Cb -0.16 -3.36 1.72 0.00 -1.01 0.00 0.00 33.01 30.20 2j0j s GLN 418 CO 0.07 0.26 2.17 -0.09 0.01 0.00 0.00 175.29 177.71 2j0j h ARG 419 N 5.34 0.00 0.00 2.91 2.43 -1.96 0.13 114.38 123.23 2j0j h ARG 419 Ca -0.43 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 2j0j h ARG 419 Cb 1.21 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2j0j h ARG 419 CO 0.71 0.00 0.00 0.39 -1.51 0.00 0.00 179.97 179.56 2j0j n GLU 420 N -3.85 0.14 -0.26 0.20 4.71 -1.26 -2.49 120.64 117.82 2j0j n GLU 420 Ca -0.01 0.15 0.11 0.00 -0.01 0.00 0.00 57.16 57.40 2j0j n GLU 420 Cb 0.20 -1.50 0.25 0.00 -1.01 0.00 0.00 31.44 29.38 2j0j n GLU 420 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 2j0j n ARG 421 N -1.38 2.58 -4.41 3.49 1.74 0.44 -4.85 116.66 114.26 2j0j n ARG 421 Ca 0.07 -2.38 -0.32 0.00 -0.77 0.00 0.00 57.85 54.45 2j0j n ARG 421 Cb 0.18 -1.50 -0.16 0.00 -1.02 0.00 0.00 32.46 29.96 2j0j n ARG 421 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2j0j s ILE 422 N -1.19 1.89 -0.28 0.55 -1.09 -1.04 -0.79 121.20 119.26 2j0j s ILE 422 Ca 0.40 -0.86 -0.18 0.00 -2.23 0.00 0.00 60.65 57.78 2j0j s ILE 422 Cb 0.22 -1.70 -0.02 0.00 -1.58 0.00 0.00 42.46 39.38 2j0j s ILE 422 CO 0.30 0.52 0.53 -1.61 -1.23 0.00 0.00 174.94 173.45 2j0j s GLU 423 N 1.05 4.00 -0.64 2.79 2.02 -0.14 -4.97 118.70 122.82 2j0j s GLU 423 Ca -0.02 0.28 -0.23 0.00 0.02 0.00 0.00 54.97 55.02 2j0j s GLU 423 Cb -0.14 -3.68 0.06 0.00 0.10 0.00 0.00 34.13 30.47 2j0j s GLU 423 CO -0.06 -0.41 0.96 -1.17 0.02 0.00 0.00 175.26 174.60 2j0j s LEU 424 N 2.37 4.29 0.00 1.80 2.96 -1.26 -0.95 118.68 127.89 2j0j s LEU 424 Ca 0.22 -0.84 0.00 0.00 -0.22 0.00 0.00 54.13 53.29 2j0j s LEU 424 Cb -0.15 -2.50 0.00 0.00 0.50 0.00 0.00 46.19 44.03 2j0j s LEU 424 CO 0.10 -1.40 0.00 0.61 -1.32 0.00 0.00 176.35 174.34 2j0j n GLY 425 N 5.28 0.87 3.72 7.98 0.00 -0.68 -5.00 105.19 117.36 2j0j n GLY 425 Ca -0.03 -1.55 -0.33 0.00 0.00 0.00 0.00 46.02 44.12 2j0j n GLY 425 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2j0j s ARG 426 N 0.44 1.90 0.12 1.61 3.52 -1.21 -4.48 118.95 120.85 2j0j s ARG 426 Ca 0.00 1.54 -0.30 0.00 -0.13 0.00 0.00 55.73 56.85 2j0j s ARG 426 Cb 0.00 -1.83 -0.06 0.00 -1.56 0.00 0.00 34.95 31.50 2j0j s ARG 426 CO 0.00 -1.97 0.94 0.00 -0.81 0.00 0.00 175.30 173.46 2j0j n ILE 428 N 2.65 0.00 -3.77 0.00 -5.35 0.29 -4.88 119.36 108.29 2j0j n ILE 428 Ca 0.01 -0.08 -0.11 0.00 -0.27 0.00 0.00 62.75 62.31 2j0j n ILE 428 Cb 0.49 0.49 -0.07 0.00 -1.74 0.00 0.00 39.64 38.80 2j0j n ILE 428 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2j0j s GLY 429 N -1.21 -0.08 -0.32 3.28 0.00 -0.27 -5.00 107.32 103.71 2j0j s GLY 429 Ca 0.00 -0.09 0.02 0.00 0.00 0.00 0.00 44.72 44.66 2j0j s GLY 429 CO 0.00 -0.29 0.06 -0.54 0.00 0.00 0.00 173.10 172.32 2j0j s GLU 430 N -2.66 1.26 0.91 2.90 2.02 -1.26 -1.49 118.70 120.38 2j0j s GLU 430 Ca -0.04 -1.58 -0.14 0.00 0.02 0.00 0.00 54.97 53.23 2j0j s GLU 430 Cb -0.00 -2.80 0.17 0.00 0.10 0.00 0.00 34.13 31.60 2j0j s GLU 430 CO -0.04 -0.93 1.26 0.20 0.02 0.00 0.00 175.26 175.77 2j0j s GLY 431 N 1.15 1.76 -0.14 -1.39 0.00 -1.11 -4.98 107.32 102.59 2j0j s GLY 431 Ca 0.10 -1.19 -0.25 0.00 0.00 0.00 0.00 44.72 43.37 2j0j s GLY 431 CO -0.13 -0.49 0.62 1.46 0.00 0.00 0.00 173.10 174.56 2j0j h GLN 432 N -1.43 0.00 0.00 2.90 4.20 -1.99 -3.37 115.11 115.43 2j0j h GLN 432 Ca -0.44 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.27 2j0j h GLN 432 Cb 1.25 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.03 2j0j h GLN 432 CO 0.42 0.87 -0.70 0.74 -0.67 0.00 0.00 178.83 179.48 2j0j h PHE 433 N -1.00 0.00 0.00 2.96 0.05 -1.94 -3.49 116.94 113.52 2j0j h PHE 433 Ca -0.03 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.76 2j0j h PHE 433 Cb 0.90 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.85 2j0j h PHE 433 CO 0.23 0.00 0.00 0.41 -0.18 0.00 0.00 178.31 178.77 2j0j n GLY 434 N 1.33 1.28 3.78 -1.45 0.00 -1.25 0.09 105.19 108.96 2j0j n GLY 434 Ca 0.03 -0.35 -0.32 0.00 0.00 0.00 0.00 46.02 45.37 2j0j n GLY 434 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j0j s ASP 435 N 0.00 4.98 -0.21 1.61 1.01 -0.99 -2.77 116.67 120.30 2j0j s ASP 435 Ca 0.00 1.88 -0.03 0.00 0.71 0.00 0.00 52.55 55.11 2j0j s ASP 435 Cb 0.00 -2.53 -0.01 0.00 1.01 0.00 0.00 42.92 41.39 2j0j s ASP 435 CO 0.00 -1.72 -0.05 -0.69 0.21 0.00 0.00 175.17 172.92 2j0j s VAL 436 N -2.62 3.30 0.36 -1.27 1.01 -0.55 0.79 120.40 121.42 2j0j s VAL 436 Ca 0.64 -0.52 0.08 0.00 0.00 0.00 0.00 61.98 62.18 2j0j s VAL 436 Cb -0.18 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.66 2j0j s VAL 436 CO 0.47 0.43 0.18 -1.00 0.00 0.00 0.00 175.10 175.19 2j0j s HIS 437 N 1.40 2.71 0.16 5.22 3.76 0.10 -0.55 115.29 128.09 2j0j s HIS 437 Ca 0.05 -0.42 0.05 0.00 -0.15 0.00 0.00 55.06 54.59 2j0j s HIS 437 Cb -0.14 -1.75 -0.04 0.00 1.11 0.00 0.00 32.58 31.76 2j0j s HIS 437 CO -0.03 0.26 0.15 -1.14 -0.85 0.00 0.00 174.74 173.13 2j0j s GLN 438 N -3.89 2.98 0.25 1.40 0.74 0.11 0.34 119.66 121.59 2j0j s GLN 438 Ca 0.39 -0.82 -0.16 0.00 0.05 0.00 0.00 55.36 54.82 2j0j s GLN 438 Cb -0.02 -2.70 0.06 0.00 1.10 0.00 0.00 33.01 31.45 2j0j s GLN 438 CO 0.23 0.49 0.80 0.41 -0.55 0.00 0.00 175.29 176.68 2j0j n GLY 439 N -0.33 0.89 3.57 2.59 0.00 0.41 -1.69 105.19 110.63 2j0j n GLY 439 Ca -0.08 -1.17 -0.34 0.00 0.00 0.00 0.00 46.02 44.43 2j0j n GLY 439 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j0j s ILE 440 N -2.16 3.67 -0.12 -0.61 -1.09 -0.12 -1.14 121.20 119.62 2j0j s ILE 440 Ca 0.17 -0.49 0.03 0.00 -2.23 0.00 0.00 60.65 58.13 2j0j s ILE 440 Cb -0.03 -2.50 0.00 0.00 -1.58 0.00 0.00 42.46 38.35 2j0j s ILE 440 CO 0.08 0.59 -0.22 -0.47 -1.23 0.00 0.00 174.94 173.69 2j0j s TYR 441 N -0.76 2.62 -0.63 3.97 5.04 0.88 -0.96 117.35 127.51 2j0j s TYR 441 Ca 0.12 -1.16 -0.00 0.00 -2.44 0.00 0.00 57.07 53.58 2j0j s TYR 441 Cb -0.11 -1.76 0.16 0.00 0.35 0.00 0.00 41.96 40.59 2j0j s TYR 441 CO 0.01 -0.49 0.43 -1.64 -1.34 0.00 0.00 175.55 172.52 2j0j s MET 442 N 0.55 2.47 -0.20 4.97 -1.94 0.03 -1.02 119.30 124.17 2j0j s MET 442 Ca -0.13 -2.68 -0.29 0.00 -1.71 0.00 0.00 55.69 50.88 2j0j s MET 442 Cb -0.17 -3.62 -0.00 0.00 2.01 0.00 0.00 34.83 33.05 2j0j s MET 442 CO 0.04 -1.17 1.15 -1.54 -0.01 0.00 0.00 175.02 173.49 2j0j s SER 443 N 0.20 7.02 0.34 3.03 1.04 -1.26 -4.83 113.70 119.24 2j0j s SER 443 Ca 0.18 1.53 0.09 0.00 0.48 0.00 0.00 55.95 58.24 2j0j s SER 443 Cb -0.20 -2.54 0.60 0.00 0.10 0.00 0.00 66.02 63.99 2j0j s SER 443 CO -0.04 -0.72 1.78 1.55 0.98 0.00 0.00 173.24 176.80 2j0j h PRO 444 N 7.82 0.14 -5.65 4.02 0.13 -1.96 -2.91 132.00 133.59 2j0j h PRO 444 Ca -0.23 -0.06 -0.65 0.00 -0.87 0.00 0.00 66.00 64.20 2j0j h PRO 444 Cb 1.08 -0.01 -0.13 0.00 0.13 0.00 0.00 31.00 32.08 2j0j h PRO 444 CO 0.98 0.49 1.39 -1.21 -0.23 0.00 0.00 178.00 179.41 2j0j s GLU 445 N -4.24 3.69 0.00 0.86 2.02 -1.26 -4.80 118.70 114.96 2j0j s GLU 445 Ca -0.04 -1.55 0.00 0.00 0.02 0.00 0.00 54.97 53.40 2j0j s GLU 445 Cb 0.14 -5.23 0.00 0.00 0.10 0.00 0.00 34.13 29.14 2j0j s GLU 445 CO 0.75 -2.05 0.00 0.09 0.02 0.00 0.00 175.26 174.07 2j0j n ASN 446 N 7.87 0.00 -4.95 -0.19 5.03 -1.10 -5.14 115.26 116.79 2j0j n ASN 446 Ca 0.33 0.00 -0.20 0.00 0.87 0.00 0.00 54.58 55.58 2j0j n ASN 446 Cb 0.49 0.00 0.04 0.00 -1.02 0.00 0.00 39.78 39.29 2j0j n ASN 446 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 2j0j s PRO 447 N -2.55 2.47 0.87 3.52 0.04 -1.26 -4.62 135.00 133.46 2j0j s PRO 447 Ca 0.00 -1.00 -0.15 0.00 0.04 0.00 0.00 61.00 59.89 2j0j s PRO 447 Cb 0.00 -2.54 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 2j0j s PRO 447 CO 0.00 -0.73 0.11 0.00 0.04 0.00 0.00 177.00 176.42 2j0j n ALA 448 N -2.30 -3.04 -3.37 8.56 0.00 -1.26 -4.56 120.51 114.55 2j0j n ALA 448 Ca 0.10 -0.49 -0.13 0.00 0.00 0.00 0.00 53.44 52.92 2j0j n ALA 448 Cb 0.60 -1.63 -0.13 0.00 0.00 0.00 0.00 19.45 18.30 2j0j n ALA 448 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2j0j s MET 449 N -2.82 0.22 -0.02 0.00 -1.94 -0.19 -4.95 119.30 109.60 2j0j s MET 449 Ca 0.55 0.38 -0.29 0.00 -1.71 0.00 0.00 55.69 54.62 2j0j s MET 449 Cb -0.26 0.01 -0.03 0.00 2.01 0.00 0.00 34.83 36.56 2j0j s MET 449 CO 0.68 -0.09 0.93 0.00 -0.01 0.00 0.00 175.02 176.54 2j0j s ALA 450 N 0.60 3.22 0.15 3.03 0.00 -1.26 -0.08 121.76 127.41 2j0j s ALA 450 Ca -0.04 0.45 0.03 0.00 0.00 0.00 0.00 51.96 52.40 2j0j s ALA 450 Cb -0.05 -3.28 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 2j0j s ALA 450 CO -0.03 -0.25 -0.07 0.14 0.00 0.00 0.00 175.76 175.55 2j0j s VAL 451 N 1.09 1.00 -0.10 0.00 -7.23 -0.29 -3.94 120.40 110.92 2j0j s VAL 451 Ca 0.49 -2.02 -0.13 0.00 -1.81 0.00 0.00 61.98 58.50 2j0j s VAL 451 Cb -0.20 -1.90 -0.05 0.00 0.56 0.00 0.00 36.38 34.79 2j0j s VAL 451 CO 0.25 -0.69 0.31 0.00 -0.31 0.00 0.00 175.10 174.66 2j0j s ALA 452 N -3.44 3.67 -0.13 1.32 0.00 0.82 -0.45 121.76 123.55 2j0j s ALA 452 Ca 0.18 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.75 2j0j s ALA 452 Cb 0.04 -2.33 0.01 0.00 0.00 0.00 0.00 23.12 20.84 2j0j s ALA 452 CO 0.01 0.29 -0.18 0.42 0.00 0.00 0.00 175.76 176.30 2j0j s ILE 453 N -0.23 1.76 -0.28 0.00 1.01 0.15 -1.04 121.20 122.56 2j0j s ILE 453 Ca 0.19 -0.79 -0.10 0.00 0.00 0.00 0.00 60.65 59.95 2j0j s ILE 453 Cb -0.14 -1.59 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 2j0j s ILE 453 CO 0.07 0.49 0.17 -0.75 0.00 0.00 0.00 174.94 174.92 2j0j s LYS 454 N 1.02 3.83 0.13 2.79 2.20 -0.29 0.03 119.74 129.45 2j0j s LYS 454 Ca -0.04 -0.39 0.06 0.00 -0.36 0.00 0.00 55.97 55.24 2j0j s LYS 454 Cb -0.15 -3.61 -0.04 0.00 -1.51 0.00 0.00 37.83 32.53 2j0j s LYS 454 CO -0.04 -0.21 -0.02 0.95 -0.36 0.00 0.00 175.35 175.67 2j0j s THR 455 N 1.72 3.80 -0.24 3.43 -4.23 0.24 -2.14 115.64 118.22 2j0j s THR 455 Ca 0.07 -1.21 -0.09 0.00 -1.18 0.00 0.00 61.69 59.28 2j0j s THR 455 Cb -0.16 -2.85 -0.04 0.00 1.34 0.00 0.00 72.50 70.79 2j0j s THR 455 CO 0.09 0.02 0.13 0.00 -0.54 0.00 0.00 174.62 174.33 2j0j n LYS 457 N 4.54 0.00 -1.55 0.00 4.81 0.11 -4.05 118.16 122.02 2j0j n LYS 457 Ca -0.15 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 56.87 2j0j n LYS 457 Cb 0.52 -0.48 -0.03 0.00 0.02 0.00 0.00 35.03 35.06 2j0j n LYS 457 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2j0j n ASN 458 N -0.15 3.24 -0.02 3.14 3.02 -1.26 -4.79 115.26 118.44 2j0j n ASN 458 Ca 0.00 -2.76 -0.10 0.00 -0.03 0.00 0.00 54.58 51.69 2j0j n ASN 458 Cb 0.00 -1.41 -0.04 0.00 -0.61 0.00 0.00 39.78 37.72 2j0j n ASN 458 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j0j n THR 460 N -5.01 4.45 -3.51 0.00 -2.24 -1.26 -4.21 114.28 102.50 2j0j n THR 460 Ca -0.04 -4.06 -0.42 0.00 -2.27 0.00 0.00 64.05 57.26 2j0j n THR 460 Cb 0.04 -1.72 -0.06 0.00 -2.10 0.00 0.00 70.33 66.49 2j0j n THR 460 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2j0j s SER 461 N -0.06 5.96 0.27 3.42 0.01 -1.19 -5.00 113.70 117.11 2j0j s SER 461 Ca 0.54 -2.42 0.10 0.00 1.31 0.00 0.00 55.95 55.48 2j0j s SER 461 Cb 0.29 -2.05 0.87 0.00 0.21 0.00 0.00 66.02 65.34 2j0j s SER 461 CO -0.19 -0.58 1.23 0.47 0.41 0.00 0.00 173.24 174.59 2j0j n ASP 462 N 4.24 0.12 0.07 2.44 8.00 -1.26 0.22 116.55 130.38 2j0j n ASP 462 Ca 0.03 1.31 0.12 0.00 0.71 0.00 0.00 54.79 56.96 2j0j n ASP 462 Cb 0.42 -0.57 0.18 0.00 -0.02 0.00 0.00 41.12 41.13 2j0j n ASP 462 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2j0j h SER 463 N 0.00 0.00 -0.30 -2.24 4.64 -1.94 -3.04 113.55 110.67 2j0j h SER 463 Ca 0.59 -0.17 -0.09 0.00 -0.47 0.00 0.00 61.79 61.65 2j0j h SER 463 Cb 1.44 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.52 2j0j h SER 463 CO -0.66 0.09 -0.15 0.58 -0.87 0.00 0.00 176.83 175.82 2j0j h VAL 464 N 0.00 1.29 -0.33 0.95 2.07 0.23 -1.93 116.25 118.54 2j0j h VAL 464 Ca 0.00 -1.25 0.05 0.00 0.82 0.00 0.00 66.70 66.31 2j0j h VAL 464 Cb 0.77 1.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 2j0j h VAL 464 CO 0.00 0.40 0.06 -0.09 0.02 0.00 0.00 177.57 177.96 2j0j h ARG 465 N 0.38 0.17 -0.74 1.57 2.43 -1.48 0.26 114.38 116.96 2j0j h ARG 465 Ca 0.07 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 2j0j h ARG 465 Cb 0.68 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.15 2j0j h ARG 465 CO 0.04 0.11 0.41 0.93 -1.51 0.00 0.00 179.97 179.96 2j0j h GLU 466 N 0.18 1.03 -0.22 0.20 5.08 -1.46 -1.26 114.58 118.13 2j0j h GLU 466 Ca 0.15 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 2j0j h GLU 466 Cb 0.17 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2j0j h GLU 466 CO -0.21 0.76 -0.35 0.87 -1.00 0.00 0.00 179.01 179.08 2j0j h LYS 467 N 1.02 0.48 0.00 2.33 1.57 -1.12 -1.40 116.57 119.46 2j0j h LYS 467 Ca 0.26 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2j0j h LYS 467 Cb 0.03 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.33 2j0j h LYS 467 CO -0.04 0.77 0.00 0.34 -0.57 0.00 0.00 179.45 179.94 2j0j n PHE 468 N -4.06 0.00 0.90 -1.35 7.35 0.06 -3.19 117.46 117.18 2j0j n PHE 468 Ca -0.01 0.00 0.03 0.00 -0.76 0.00 0.00 57.45 56.71 2j0j n PHE 468 Cb 0.47 -0.14 0.16 0.00 0.35 0.00 0.00 39.48 40.33 2j0j n PHE 468 CO 0.00 0.00 0.00 1.47 -0.76 0.00 0.00 176.76 177.47 2j0j n LEU 469 N -1.14 0.00 -0.02 -2.13 -0.00 -0.52 -0.21 117.00 112.97 2j0j n LEU 469 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 55.89 2j0j n LEU 469 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.35 2j0j n LEU 469 CO 0.00 0.00 0.76 -0.61 -0.00 0.00 0.00 177.39 177.54 2j0j h GLN 470 N 0.00 0.15 -0.71 1.47 5.75 -1.21 -2.77 115.11 117.80 2j0j h GLN 470 Ca 0.00 -0.04 0.15 0.00 -0.15 0.00 0.00 58.65 58.61 2j0j h GLN 470 Cb 0.00 -0.02 -0.13 0.00 1.07 0.00 0.00 27.48 28.41 2j0j h GLN 470 CO 0.00 0.37 -0.05 1.49 -2.65 0.00 0.00 178.83 177.99 2j0j h GLU 471 N -0.09 0.07 -0.93 1.69 4.81 -0.66 0.13 114.58 119.59 2j0j h GLU 471 Ca 0.03 -0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.31 2j0j h GLU 471 Cb 0.29 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.60 2j0j h GLU 471 CO 0.00 0.05 0.61 0.00 -0.73 0.00 0.00 179.01 178.93 2j0j h ALA 472 N 1.67 1.47 -0.35 2.92 0.00 -1.68 -1.53 119.26 121.76 2j0j h ALA 472 Ca 0.37 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.27 2j0j h ALA 472 Cb 0.62 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2j0j h ALA 472 CO -0.65 0.39 0.20 -0.07 0.00 0.00 0.00 179.25 179.12 2j0j h LEU 473 N 1.08 0.32 -0.11 0.00 3.38 -0.48 -1.74 115.31 117.77 2j0j h LEU 473 Ca 0.40 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.36 2j0j h LEU 473 Cb 0.17 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2j0j h LEU 473 CO -0.15 0.23 0.02 0.71 0.09 0.00 0.00 178.44 179.34 2j0j h THR 474 N 0.41 1.21 -0.37 0.22 1.35 -1.00 -2.38 112.91 112.35 2j0j h THR 474 Ca 0.14 -0.66 0.11 0.00 -0.55 0.00 0.00 66.41 65.45 2j0j h THR 474 Cb 0.01 1.45 -0.01 0.00 -1.73 0.00 0.00 68.15 67.87 2j0j h THR 474 CO -0.07 0.19 0.30 0.24 -0.25 0.00 0.00 175.52 175.93 2j0j h MET 475 N -0.05 0.00 -0.92 4.72 2.86 -1.20 0.32 114.93 120.66 2j0j h MET 475 Ca 0.03 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2j0j h MET 475 Cb 0.28 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.90 2j0j h MET 475 CO 0.00 0.00 0.55 -0.09 1.06 0.00 0.00 176.91 178.43 2j0j h ARG 476 N 0.00 1.25 0.00 1.72 1.12 -0.76 -2.81 114.38 114.90 2j0j h ARG 476 Ca 0.18 -0.12 0.00 0.00 -1.11 0.00 0.00 59.98 58.93 2j0j h ARG 476 Cb 0.78 -0.26 0.00 0.00 -0.01 0.00 0.00 29.97 30.48 2j0j h ARG 476 CO -0.00 0.88 0.00 1.96 -3.11 0.00 0.00 179.97 179.70 2j0j h GLN 477 N 1.27 0.00 -5.65 0.20 1.08 -0.91 -3.44 115.11 107.65 2j0j h GLN 477 Ca 0.33 0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 56.94 2j0j h GLN 477 Cb -0.05 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.29 2j0j h GLN 477 CO -0.06 0.00 -0.23 -0.06 -0.95 0.00 0.00 178.83 177.53 2j0j s PHE 478 N -3.56 3.51 -0.20 2.96 2.99 -1.06 -5.05 117.98 117.57 2j0j s PHE 478 Ca 0.02 0.76 -0.04 0.00 0.00 0.00 0.00 56.93 57.67 2j0j s PHE 478 Cb 0.09 -2.42 0.08 0.00 0.00 0.00 0.00 43.02 40.77 2j0j s PHE 478 CO 0.44 0.25 0.16 0.34 -0.00 0.00 0.00 175.22 176.41 2j0j s ASP 479 N 0.37 2.03 -0.25 1.36 2.15 -1.26 -4.87 116.67 116.19 2j0j s ASP 479 Ca 0.21 -0.53 -0.19 0.00 0.43 0.00 0.00 52.55 52.48 2j0j s ASP 479 Cb -0.14 0.04 0.07 0.00 -0.30 0.00 0.00 42.92 42.59 2j0j s ASP 479 CO 0.08 -0.35 0.64 -2.28 -0.17 0.00 0.00 175.17 173.09 2j0j s HIS 480 N 2.22 -0.84 0.59 -5.34 2.46 -1.26 -5.05 115.29 108.08 2j0j s HIS 480 Ca 0.05 1.86 0.29 0.00 0.47 0.00 0.00 55.06 57.73 2j0j s HIS 480 Cb -0.16 0.40 1.41 0.00 -0.13 0.00 0.00 32.58 34.10 2j0j s HIS 480 CO -0.14 -0.42 1.81 -1.35 -2.47 0.00 0.00 174.74 172.18 2j0j h PRO 481 N 6.02 0.00 -0.30 2.88 0.11 -2.00 -2.30 132.00 136.42 2j0j h PRO 481 Ca -0.30 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.58 2j0j h PRO 481 Cb 1.19 0.00 -0.22 0.00 0.11 0.00 0.00 31.00 32.08 2j0j h PRO 481 CO 0.14 0.00 -0.71 0.72 -0.21 0.00 0.00 178.00 177.94 2j0j n HIS 482 N -3.63 1.06 -4.08 0.65 8.25 -1.26 -4.91 115.22 111.31 2j0j n HIS 482 Ca 0.10 -1.70 -0.17 0.00 -0.26 0.00 0.00 57.72 55.69 2j0j n HIS 482 Cb 0.79 -0.27 -0.15 0.00 1.12 0.00 0.00 29.99 31.48 2j0j n HIS 482 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2j0j s ILE 483 N -3.44 0.35 -0.05 1.59 1.01 -0.87 -0.49 121.20 119.30 2j0j s ILE 483 Ca 0.41 -0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.68 2j0j s ILE 483 Cb 0.38 -0.36 -0.06 0.00 0.01 0.00 0.00 42.46 42.43 2j0j s ILE 483 CO -0.04 0.15 1.71 0.54 0.00 0.00 0.00 174.94 177.30 2j0j s VAL 484 N 0.50 3.48 0.40 2.92 0.11 -0.90 -4.62 120.40 122.30 2j0j s VAL 484 Ca -0.06 0.58 -0.26 0.00 -2.93 0.00 0.00 61.98 59.32 2j0j s VAL 484 Cb -0.09 -3.39 -0.10 0.00 -1.53 0.00 0.00 36.38 31.27 2j0j s VAL 484 CO -0.01 -0.06 1.23 0.29 -3.33 0.00 0.00 175.10 173.23 2j0j n LYS 485 N 7.25 1.88 -3.05 1.54 4.01 -1.26 -4.85 118.16 123.68 2j0j n LYS 485 Ca 0.18 0.67 -0.41 0.00 -0.51 0.00 0.00 58.31 58.24 2j0j n LYS 485 Cb 0.43 -2.32 -0.06 0.00 -0.51 0.00 0.00 35.03 32.57 2j0j n LYS 485 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 2j0j s LEU 486 N -1.36 4.07 -0.16 -0.35 2.96 -1.26 -1.93 118.68 120.64 2j0j s LEU 486 Ca 0.60 0.80 -0.27 0.00 -0.22 0.00 0.00 54.13 55.04 2j0j s LEU 486 Cb -0.53 -2.94 -0.24 0.00 0.50 0.00 0.00 46.19 42.97 2j0j s LEU 486 CO 0.59 -0.41 0.61 0.40 -1.32 0.00 0.00 176.35 176.22 2j0j h ILE 487 N 5.42 1.55 -2.10 6.68 2.04 -0.55 -3.48 117.51 127.07 2j0j h ILE 487 Ca -0.26 -2.30 0.18 0.00 1.00 0.00 0.00 64.86 63.48 2j0j h ILE 487 Cb 1.11 3.06 -0.03 0.00 -0.74 0.00 0.00 36.82 40.23 2j0j h ILE 487 CO 0.80 0.53 0.53 0.61 0.00 0.00 0.00 178.15 180.62 2j0j n GLY 488 N 1.56 0.58 3.20 5.37 0.00 -0.85 -4.94 105.19 110.11 2j0j n GLY 488 Ca -0.16 -1.04 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 2j0j n GLY 488 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2j0j s VAL 489 N -2.13 1.04 -0.32 1.61 -7.23 0.60 -0.03 120.40 113.95 2j0j s VAL 489 Ca 0.19 -1.72 0.03 0.00 -1.81 0.00 0.00 61.98 58.67 2j0j s VAL 489 Cb -0.01 -1.46 0.09 0.00 0.56 0.00 0.00 36.38 35.56 2j0j s VAL 489 CO 0.02 -0.56 0.04 -0.63 -0.31 0.00 0.00 175.10 173.66 2j0j s ILE 490 N -2.52 1.93 -1.59 -0.62 1.01 0.18 -0.91 121.20 118.67 2j0j s ILE 490 Ca 0.08 -2.02 0.09 0.00 0.00 0.00 0.00 60.65 58.79 2j0j s ILE 490 Cb -0.02 -2.39 0.31 0.00 0.01 0.00 0.00 42.46 40.37 2j0j s ILE 490 CO 0.01 -0.54 1.18 0.35 0.00 0.00 0.00 174.94 175.94 2j0j n THR 491 N 4.42 0.67 -4.71 2.92 -2.24 -1.26 -1.23 114.28 112.85 2j0j n THR 491 Ca 0.00 -0.49 -0.33 0.00 -2.27 0.00 0.00 64.05 60.96 2j0j n THR 491 Cb 0.42 0.03 -0.13 0.00 -2.10 0.00 0.00 70.33 68.55 2j0j n THR 491 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2j0j s GLU 492 N -1.63 3.09 -0.03 -0.78 2.02 -1.26 -4.81 118.70 115.30 2j0j s GLU 492 Ca 0.22 -0.63 -0.36 0.00 0.02 0.00 0.00 54.97 54.23 2j0j s GLU 492 Cb 0.13 -2.61 -0.14 0.00 0.10 0.00 0.00 34.13 31.61 2j0j s GLU 492 CO 0.12 0.41 1.68 0.09 0.02 0.00 0.00 175.26 177.59 2j0j n ASN 493 N 2.96 2.82 -4.57 -0.19 3.02 -1.26 -1.77 115.26 116.27 2j0j n ASN 493 Ca -0.18 1.05 -0.43 0.00 -0.03 0.00 0.00 54.58 55.00 2j0j n ASN 493 Cb 0.53 -1.31 -0.05 0.00 -0.61 0.00 0.00 39.78 38.34 2j0j n ASN 493 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2j0j s PRO 494 N 2.49 3.63 0.09 3.52 0.04 -1.26 -5.12 135.00 138.39 2j0j s PRO 494 Ca 0.89 0.20 -0.37 0.00 0.04 0.00 0.00 61.00 61.76 2j0j s PRO 494 Cb -0.81 -3.86 -0.17 0.00 0.04 0.00 0.00 34.50 29.70 2j0j s PRO 494 CO 0.50 -0.99 1.28 0.28 0.04 0.00 0.00 177.00 178.11 2j0j n VAL 495 N 6.01 0.12 -4.37 -0.36 0.31 -0.73 -4.83 118.33 114.48 2j0j n VAL 495 Ca 0.04 -0.03 -0.23 0.00 -0.01 0.00 0.00 64.34 64.11 2j0j n VAL 495 Cb 0.48 -0.73 -0.11 0.00 -0.91 0.00 0.00 33.84 32.57 2j0j n VAL 495 CO 0.00 0.00 0.00 0.26 -1.32 0.00 0.00 176.83 175.77 2j0j s TRP 496 N 0.34 1.96 -0.06 3.52 0.51 -0.37 -3.20 118.94 121.63 2j0j s TRP 496 Ca 0.84 -0.44 0.04 0.00 -2.12 0.00 0.00 56.10 54.42 2j0j s TRP 496 Cb -0.98 -0.95 -0.00 0.00 -0.81 0.00 0.00 33.47 30.73 2j0j s TRP 496 CO 0.49 0.41 -0.19 0.42 -0.51 0.00 0.00 176.95 177.57 2j0j s ILE 497 N -2.10 1.60 -0.16 2.03 1.01 -0.91 -0.65 121.20 122.03 2j0j s ILE 497 Ca 0.19 -0.79 -0.04 0.00 0.00 0.00 0.00 60.65 60.02 2j0j s ILE 497 Cb -0.06 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.00 2j0j s ILE 497 CO 0.08 0.46 -0.04 -0.63 0.00 0.00 0.00 174.94 174.81 2j0j s ILE 498 N 0.20 3.87 0.13 2.92 -1.09 0.96 -1.14 121.20 127.05 2j0j s ILE 498 Ca -0.09 -0.37 0.01 0.00 -2.23 0.00 0.00 60.65 57.97 2j0j s ILE 498 Cb -0.14 -2.70 -0.04 0.00 -1.58 0.00 0.00 42.46 38.00 2j0j s ILE 498 CO 0.04 0.49 -0.01 0.00 -1.23 0.00 0.00 174.94 174.23 2j0j s MET 499 N 0.40 0.93 0.74 2.79 0.23 -0.21 0.21 119.30 124.39 2j0j s MET 499 Ca -0.04 -1.42 -0.15 0.00 -1.03 0.00 0.00 55.69 53.06 2j0j s MET 499 Cb -0.14 -0.08 0.05 0.00 -1.53 0.00 0.00 34.83 33.12 2j0j s MET 499 CO 0.03 -0.12 1.22 -1.83 -2.03 0.00 0.00 175.02 172.29 2j0j s GLU 500 N -3.92 2.03 -0.32 3.16 -1.05 -0.81 -0.13 118.70 117.66 2j0j s GLU 500 Ca 0.18 1.80 -0.09 0.00 -0.15 0.00 0.00 54.97 56.71 2j0j s GLU 500 Cb 0.06 -1.82 0.01 0.00 -0.44 0.00 0.00 34.13 31.94 2j0j s GLU 500 CO -0.01 -1.93 0.13 -1.17 0.95 0.00 0.00 175.26 173.23 2j0j s LEU 501 N -5.24 4.13 -0.67 1.83 2.96 -1.25 -4.04 118.68 116.39 2j0j s LEU 501 Ca 0.75 -0.69 -0.27 0.00 -0.22 0.00 0.00 54.13 53.70 2j0j s LEU 501 Cb -0.30 -1.96 0.04 0.00 0.50 0.00 0.00 46.19 44.47 2j0j s LEU 501 CO 0.46 -0.23 1.19 0.00 -1.32 0.00 0.00 176.35 176.46 2j0j h THR 503 N 6.06 1.27 0.00 0.00 2.02 -1.75 -1.70 112.91 118.80 2j0j h THR 503 Ca -0.27 -1.00 0.00 0.00 0.77 0.00 0.00 66.41 65.90 2j0j h THR 503 Cb 1.06 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.82 2j0j h THR 503 CO 1.23 0.32 0.00 0.18 0.37 0.00 0.00 175.52 177.62 2j0j n LEU 504 N -4.55 0.00 0.00 2.58 4.77 -0.98 -4.97 117.00 113.85 2j0j n LEU 504 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2j0j n LEU 504 Cb 0.28 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 2j0j n LEU 504 CO 0.39 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2j0j n GLY 505 N 0.20 0.63 3.76 -0.72 0.00 -0.64 -4.67 105.19 103.75 2j0j n GLY 505 Ca 0.10 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.96 2j0j n GLY 505 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2j0j s GLU 506 N 0.00 4.46 0.08 1.61 -1.05 -1.26 0.26 118.70 122.80 2j0j s GLU 506 Ca 0.00 2.05 -0.23 0.00 -0.15 0.00 0.00 54.97 56.64 2j0j s GLU 506 Cb 0.00 -3.12 -0.15 0.00 -0.44 0.00 0.00 34.13 30.41 2j0j s GLU 506 CO 0.00 -0.05 1.68 1.25 0.95 0.00 0.00 175.26 179.09 2j0j h LEU 507 N 3.71 0.01 -0.15 1.83 5.85 -1.17 -2.58 115.31 122.82 2j0j h LEU 507 Ca -0.48 -0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.22 2j0j h LEU 507 Cb 1.22 -0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.18 2j0j h LEU 507 CO 0.67 0.07 -0.38 0.03 -0.34 0.00 0.00 178.44 178.49 2j0j h ARG 508 N -0.05 -0.43 -0.81 1.25 3.08 -1.84 0.83 114.38 116.40 2j0j h ARG 508 Ca 0.00 0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.10 2j0j h ARG 508 Cb 0.06 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 2j0j h ARG 508 CO -0.00 -0.29 0.53 1.03 -1.07 0.00 0.00 179.97 180.17 2j0j h SER 509 N -0.45 0.90 -0.39 7.04 0.87 -1.92 -0.19 113.55 119.42 2j0j h SER 509 Ca 0.09 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2j0j h SER 509 Cb 0.60 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.33 2j0j h SER 509 CO -0.39 0.63 0.24 0.15 -0.53 0.00 0.00 176.83 176.94 2j0j h PHE 510 N 1.06 0.50 0.11 2.24 3.57 -0.82 -0.70 116.94 122.90 2j0j h PHE 510 Ca 0.31 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.81 2j0j h PHE 510 Cb -0.06 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 38.52 2j0j h PHE 510 CO -0.02 0.34 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.28 2j0j h LEU 511 N 0.51 -0.13 -0.84 0.59 3.38 -0.26 -2.07 115.31 116.49 2j0j h LEU 511 Ca 0.14 -0.13 0.18 0.00 0.09 0.00 0.00 57.88 58.16 2j0j h LEU 511 Cb -0.02 0.03 -0.11 0.00 0.09 0.00 0.00 40.66 40.65 2j0j h LEU 511 CO -0.03 0.06 0.35 1.56 0.09 0.00 0.00 178.44 180.47 2j0j h GLN 512 N -0.31 0.42 -0.08 1.13 4.20 -0.63 0.35 115.11 120.19 2j0j h GLN 512 Ca -0.02 -0.03 -0.18 0.00 0.06 0.00 0.00 58.65 58.49 2j0j h GLN 512 Cb 0.25 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2j0j h GLN 512 CO 0.02 0.28 -0.70 0.28 -0.67 0.00 0.00 178.83 178.04 2j0j h VAL 513 N 0.43 1.38 -0.74 -0.54 2.07 -1.07 -3.21 116.25 114.57 2j0j h VAL 513 Ca 0.50 -2.11 -0.25 0.00 0.82 0.00 0.00 66.70 65.66 2j0j h VAL 513 Cb 0.86 2.08 -0.15 0.00 -1.52 0.00 0.00 31.29 32.56 2j0j h VAL 513 CO -0.48 0.63 0.30 0.54 0.02 0.00 0.00 177.57 178.59 2j0j n ARG 514 N -3.85 3.37 0.32 1.57 1.74 -0.07 -4.67 116.66 115.08 2j0j n ARG 514 Ca -0.04 -3.08 0.15 0.00 -0.77 0.00 0.00 57.85 54.11 2j0j n ARG 514 Cb 0.69 -2.18 0.75 0.00 -1.02 0.00 0.00 32.46 30.71 2j0j n ARG 514 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2j0j h LYS 515 N 2.29 0.00 0.00 5.56 3.64 -1.07 -0.86 116.57 126.14 2j0j h LYS 515 Ca 0.31 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.65 2j0j h LYS 515 Cb 2.35 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 34.08 2j0j h LYS 515 CO 0.76 0.00 -0.52 1.19 -2.27 0.00 0.00 179.45 178.61 2j0j n PHE 516 N -2.92 0.00 -1.77 1.91 3.72 -1.26 -4.61 117.46 112.53 2j0j n PHE 516 Ca -0.01 -1.01 0.00 0.00 -0.05 0.00 0.00 57.45 56.37 2j0j n PHE 516 Cb 0.45 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 2j0j n PHE 516 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2j0j n SER 517 N -0.70 0.00 -4.22 4.37 3.41 -0.85 -5.02 113.62 110.61 2j0j n SER 517 Ca 0.13 -1.00 -0.39 0.00 -0.26 0.00 0.00 58.87 57.36 2j0j n SER 517 Cb 0.79 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.63 2j0j n SER 517 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2j0j s LEU 518 N 0.00 5.17 0.93 1.04 1.43 -0.39 -5.08 118.68 121.78 2j0j s LEU 518 Ca 0.00 -1.68 -0.12 0.00 -1.03 0.00 0.00 54.13 51.30 2j0j s LEU 518 Cb 0.00 -1.93 0.07 0.00 0.03 0.00 0.00 46.19 44.36 2j0j s LEU 518 CO 0.00 -0.54 0.66 -0.90 0.23 0.00 0.00 176.35 175.79 2j0j n ASP 519 N 4.82 -1.25 0.11 2.29 5.75 -1.26 -4.90 116.55 122.10 2j0j n ASP 519 Ca -0.08 0.37 0.03 0.00 -0.01 0.00 0.00 54.79 55.10 2j0j n ASP 519 Cb 0.42 -1.30 0.43 0.00 -1.03 0.00 0.00 41.12 39.64 2j0j n ASP 519 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2j0j h LEU 520 N -1.62 0.26 -0.47 -2.12 5.85 -1.98 -3.06 115.31 112.16 2j0j h LEU 520 Ca -0.43 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 2j0j h LEU 520 Cb 1.28 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.22 2j0j h LEU 520 CO 0.37 0.33 0.25 0.00 -0.34 0.00 0.00 178.44 179.05 2j0j h ALA 521 N 1.71 0.60 -0.49 1.25 0.00 -1.92 -2.49 119.26 117.92 2j0j h ALA 521 Ca 0.06 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2j0j h ALA 521 Cb 0.23 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2j0j h ALA 521 CO 0.01 0.13 0.04 0.77 0.00 0.00 0.00 179.25 180.19 2j0j h SER 522 N 0.62 0.75 -0.28 0.00 0.02 -1.91 -1.80 113.55 110.95 2j0j h SER 522 Ca 0.16 -0.17 0.05 0.00 -0.84 0.00 0.00 61.79 61.00 2j0j h SER 522 Cb 0.06 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.35 2j0j h SER 522 CO -0.03 0.80 -0.06 -0.07 -1.14 0.00 0.00 176.83 176.33 2j0j h LEU 523 N 0.75 -0.23 -0.94 5.07 3.38 -1.44 -1.68 115.31 120.21 2j0j h LEU 523 Ca 0.15 0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.13 2j0j h LEU 523 Cb 0.40 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2j0j h LEU 523 CO 0.01 -0.08 -0.34 0.16 0.09 0.00 0.00 178.44 178.28 2j0j h ILE 524 N 0.02 0.80 0.26 1.22 3.07 -1.17 -3.00 117.51 118.71 2j0j h ILE 524 Ca 0.14 -1.44 0.00 0.00 1.55 0.00 0.00 64.86 65.11 2j0j h ILE 524 Cb 0.20 1.90 -0.02 0.00 -0.27 0.00 0.00 36.82 38.63 2j0j h ILE 524 CO -0.28 0.33 -0.30 0.25 -1.05 0.00 0.00 178.15 177.11 2j0j h LEU 525 N 0.00 -0.81 -0.48 0.16 5.85 -0.56 0.24 115.31 119.70 2j0j h LEU 525 Ca -0.00 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.88 2j0j h LEU 525 Cb 0.88 0.28 -0.10 0.00 0.37 0.00 0.00 40.66 42.09 2j0j h LEU 525 CO 0.04 -0.42 -0.34 1.88 -0.34 0.00 0.00 178.44 179.27 2j0j h TYR 526 N -0.60 -0.94 -0.48 1.25 0.05 -1.24 0.28 116.97 115.29 2j0j h TYR 526 Ca -0.00 0.06 0.10 0.00 0.05 0.00 0.00 58.73 58.94 2j0j h TYR 526 Cb 0.57 0.48 -0.10 0.00 1.01 0.00 0.00 36.73 38.69 2j0j h TYR 526 CO -0.20 -0.38 -0.21 0.00 -1.05 0.00 0.00 178.16 176.31 2j0j h ALA 527 N 0.84 0.14 0.46 3.88 0.00 -1.33 -0.44 119.26 122.81 2j0j h ALA 527 Ca 0.20 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 2j0j h ALA 527 Cb 0.54 0.53 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2j0j h ALA 527 CO -0.60 -0.56 -0.36 -0.92 0.00 0.00 0.00 179.25 176.81 2j0j h TYR 528 N -0.11 -0.97 -0.65 0.00 3.20 0.29 -1.40 116.97 117.34 2j0j h TYR 528 Ca 0.23 -0.00 0.13 0.00 3.14 0.00 0.00 58.73 62.22 2j0j h TYR 528 Cb 0.46 0.36 -0.13 0.00 1.54 0.00 0.00 36.73 38.97 2j0j h TYR 528 CO -0.49 -0.53 -0.20 1.96 -1.64 0.00 0.00 178.16 177.27 2j0j h GLN 529 N -0.82 -0.03 -0.38 1.82 4.20 0.66 0.28 115.11 120.84 2j0j h GLN 529 Ca -0.05 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.74 2j0j h GLN 529 Cb 0.70 0.01 -0.09 0.00 0.30 0.00 0.00 27.48 28.39 2j0j h GLN 529 CO -0.00 -0.02 -0.37 -0.07 -0.67 0.00 0.00 178.83 177.70 2j0j h LEU 530 N -0.03 -1.23 -1.23 1.46 -0.00 -0.99 -2.87 115.31 110.42 2j0j h LEU 530 Ca 0.31 0.20 0.06 0.00 -0.00 0.00 0.00 57.88 58.45 2j0j h LEU 530 Cb 0.50 0.55 -0.05 0.00 -0.00 0.00 0.00 40.66 41.67 2j0j h LEU 530 CO -0.69 -0.35 0.55 0.77 -0.00 0.00 0.00 178.44 178.72 2j0j h SER 531 N -0.30 0.82 -0.62 -0.43 4.64 0.67 0.15 113.55 118.49 2j0j h SER 531 Ca 0.15 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.53 2j0j h SER 531 Cb 0.56 -0.17 -0.05 0.00 -0.31 0.00 0.00 62.40 62.43 2j0j h SER 531 CO -0.54 0.53 0.34 0.71 -0.87 0.00 0.00 176.83 177.00 2j0j h THR 532 N 0.94 0.98 -0.28 2.95 1.35 -1.13 0.38 112.91 118.10 2j0j h THR 532 Ca 0.36 -0.22 -0.01 0.00 -0.55 0.00 0.00 66.41 65.99 2j0j h THR 532 Cb 0.21 0.28 -0.01 0.00 -1.73 0.00 0.00 68.15 66.90 2j0j h THR 532 CO -0.13 0.12 0.14 0.00 -0.25 0.00 0.00 175.52 175.40 2j0j h ALA 533 N 1.32 0.36 -0.60 6.62 0.00 -0.61 -0.10 119.26 126.25 2j0j h ALA 533 Ca 0.27 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2j0j h ALA 533 Cb 0.15 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2j0j h ALA 533 CO -0.16 -0.10 0.27 -0.07 0.00 0.00 0.00 179.25 179.18 2j0j h LEU 534 N 0.32 0.80 -0.73 0.00 3.38 -0.74 -1.31 115.31 117.03 2j0j h LEU 534 Ca 0.10 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.94 2j0j h LEU 534 Cb 0.09 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 2j0j h LEU 534 CO -0.01 0.73 0.46 0.00 0.09 0.00 0.00 178.44 179.70 2j0j h ALA 535 N 1.10 0.95 -0.56 1.53 0.00 0.08 0.41 119.26 122.77 2j0j h ALA 535 Ca 0.20 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.11 2j0j h ALA 535 Cb 0.16 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2j0j h ALA 535 CO -0.02 0.26 0.34 -0.92 0.00 0.00 0.00 179.25 178.91 2j0j h TYR 536 N 0.91 0.63 -0.23 0.00 5.03 -0.62 0.37 116.97 123.07 2j0j h TYR 536 Ca 0.29 0.02 -0.19 0.00 2.58 0.00 0.00 58.73 61.42 2j0j h TYR 536 Cb -0.01 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 38.07 2j0j h TYR 536 CO -0.04 0.36 -0.62 -0.07 -1.32 0.00 0.00 178.16 176.48 2j0j h LEU 537 N 0.67 0.94 -1.09 2.82 3.38 -0.40 -2.73 115.31 118.90 2j0j h LEU 537 Ca 0.22 -0.57 0.11 0.00 0.09 0.00 0.00 57.88 57.73 2j0j h LEU 537 Cb 0.02 -0.27 -0.08 0.00 0.09 0.00 0.00 40.66 40.42 2j0j h LEU 537 CO -0.09 1.34 0.61 -0.08 0.09 0.00 0.00 178.44 180.31 2j0j h GLU 538 N 0.57 0.94 -0.30 1.13 4.81 0.41 -0.29 114.58 121.85 2j0j h GLU 538 Ca -0.01 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.06 2j0j h GLU 538 Cb 1.24 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 30.39 2j0j h GLU 538 CO 0.13 0.62 -0.21 0.66 -0.73 0.00 0.00 179.01 179.48 2j0j h SER 539 N 0.97 0.56 -0.29 1.04 4.64 -0.70 -1.86 113.55 117.91 2j0j h SER 539 Ca 0.46 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2j0j h SER 539 Cb 0.44 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 2j0j h SER 539 CO -0.22 0.78 0.00 0.29 -0.87 0.00 0.00 176.83 176.81 2j0j n LYS 540 N -4.13 2.80 -3.96 4.77 5.02 -0.19 -4.92 118.16 117.54 2j0j n LYS 540 Ca 0.00 -1.51 -0.36 0.00 -2.02 0.00 0.00 58.31 54.42 2j0j n LYS 540 Cb 0.39 -1.82 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 2j0j n LYS 540 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2j0j n ARG 541 N 0.33 -1.20 -4.58 1.97 1.74 -0.70 -4.98 116.66 109.24 2j0j n ARG 541 Ca 0.13 0.25 -0.29 0.00 -0.77 0.00 0.00 57.85 57.18 2j0j n ARG 541 Cb 0.67 -3.53 -0.17 0.00 -1.02 0.00 0.00 32.46 28.41 2j0j n ARG 541 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2j0j s PHE 542 N -3.70 2.08 -0.24 -1.55 2.19 -0.78 -5.03 117.98 110.94 2j0j s PHE 542 Ca 0.33 -0.96 -0.11 0.00 0.33 0.00 0.00 56.93 56.53 2j0j s PHE 542 Cb -0.15 -1.47 -0.05 0.00 -1.31 0.00 0.00 43.02 40.04 2j0j s PHE 542 CO 0.93 -0.47 0.16 0.08 1.83 0.00 0.00 175.22 177.75 2j0j s VAL 543 N 0.86 5.36 0.04 3.12 1.01 -1.26 -4.36 120.40 125.17 2j0j s VAL 543 Ca -0.09 0.19 -0.16 0.00 0.00 0.00 0.00 61.98 61.93 2j0j s VAL 543 Cb -0.15 -3.50 -0.31 0.00 0.00 0.00 0.00 36.38 32.42 2j0j s VAL 543 CO 0.00 0.35 1.07 -0.74 0.00 0.00 0.00 175.10 175.78 2j0j h HIS 544 N 7.48 0.98 0.00 5.22 2.76 -1.98 -3.48 115.15 126.13 2j0j h HIS 544 Ca -0.38 -0.64 0.00 0.00 -2.20 0.00 0.00 60.37 57.15 2j0j h HIS 544 Cb 1.17 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 30.06 2j0j h HIS 544 CO 0.67 1.48 0.00 0.54 -1.30 0.00 0.00 177.93 179.32 2j0j n ARG 545 N -3.81 0.00 -2.82 5.26 1.74 -1.26 -4.85 116.66 110.91 2j0j n ARG 545 Ca -0.14 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.83 2j0j n ARG 545 Cb 0.99 -1.76 0.05 0.00 -1.02 0.00 0.00 32.46 30.72 2j0j n ARG 545 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2j0j n ASP 546 N 0.00 -2.08 -4.54 0.55 4.64 -1.26 -5.07 116.55 108.79 2j0j n ASP 546 Ca 0.00 -3.37 -0.42 0.00 -1.38 0.00 0.00 54.79 49.62 2j0j n ASP 546 Cb 0.00 1.42 -0.07 0.00 -1.04 0.00 0.00 41.12 41.43 2j0j n ASP 546 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2j0j s ILE 547 N 0.09 4.95 0.09 5.18 1.01 -1.26 -4.82 121.20 126.43 2j0j s ILE 547 Ca 0.29 0.24 -0.25 0.00 0.00 0.00 0.00 60.65 60.93 2j0j s ILE 547 Cb 0.26 -4.06 0.08 0.00 0.01 0.00 0.00 42.46 38.74 2j0j s ILE 547 CO -0.15 -0.37 0.68 0.00 0.00 0.00 0.00 174.94 175.10 2j0j s ALA 548 N 2.55 -1.68 0.37 9.38 0.00 -1.26 -4.50 121.76 126.62 2j0j s ALA 548 Ca 0.20 0.74 0.05 0.00 0.00 0.00 0.00 51.96 52.95 2j0j s ALA 548 Cb -0.15 0.62 0.72 0.00 0.00 0.00 0.00 23.12 24.31 2j0j s ALA 548 CO 0.15 -0.68 2.00 0.00 0.00 0.00 0.00 175.76 177.23 2j0j h ALA 549 N 2.15 1.64 -0.71 0.00 0.00 -1.93 0.18 119.26 120.59 2j0j h ALA 549 Ca -0.30 -0.03 0.20 0.00 0.00 0.00 0.00 54.91 54.78 2j0j h ALA 549 Cb 1.27 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2j0j h ALA 549 CO 0.36 0.30 0.51 0.07 0.00 0.00 0.00 179.25 180.49 2j0j h ARG 550 N 0.76 0.01 -0.49 0.00 0.11 -1.97 -0.02 114.38 112.78 2j0j h ARG 550 Ca 0.25 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.33 2j0j h ARG 550 Cb 0.05 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.13 2j0j h ARG 550 CO -0.07 0.01 0.00 0.09 0.10 0.00 0.00 179.97 180.10 2j0j n ASN 551 N -4.33 2.87 -4.22 0.08 3.02 0.05 -4.84 115.26 107.90 2j0j n ASN 551 Ca 0.14 -1.97 -0.33 0.00 -0.03 0.00 0.00 54.58 52.40 2j0j n ASN 551 Cb 0.77 -0.33 -0.16 0.00 -0.61 0.00 0.00 39.78 39.46 2j0j n ASN 551 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2j0j s VAL 552 N -1.35 2.29 0.23 2.41 1.01 -0.02 -2.39 120.40 122.58 2j0j s VAL 552 Ca 0.37 -0.91 0.06 0.00 0.00 0.00 0.00 61.98 61.49 2j0j s VAL 552 Cb 0.19 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.61 2j0j s VAL 552 CO 0.26 0.54 0.29 -0.76 0.00 0.00 0.00 175.10 175.43 2j0j s LEU 553 N 0.70 4.12 -0.31 3.92 1.43 -0.75 -0.95 118.68 126.83 2j0j s LEU 553 Ca -0.09 -0.04 -0.01 0.00 -1.03 0.00 0.00 54.13 52.96 2j0j s LEU 553 Cb -0.16 -2.66 0.06 0.00 0.03 0.00 0.00 46.19 43.46 2j0j s LEU 553 CO 0.01 -0.04 0.02 -0.69 0.23 0.00 0.00 176.35 175.87 2j0j s VAL 554 N -2.00 2.87 -0.69 -1.59 1.01 0.14 -1.05 120.40 119.09 2j0j s VAL 554 Ca 0.33 -1.57 0.26 0.00 0.00 0.00 0.00 61.98 61.00 2j0j s VAL 554 Cb -0.09 -2.73 0.29 0.00 0.00 0.00 0.00 36.38 33.86 2j0j s VAL 554 CO 0.27 -0.21 1.75 0.77 0.00 0.00 0.00 175.10 177.69 2j0j h SER 555 N 7.95 0.00 -4.07 3.32 4.64 -1.51 -2.57 113.55 121.31 2j0j h SER 555 Ca -0.19 -0.00 0.10 0.00 -0.47 0.00 0.00 61.79 61.24 2j0j h SER 555 Cb 1.05 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.92 2j0j h SER 555 CO 0.54 0.00 0.59 -0.55 -0.87 0.00 0.00 176.83 176.54 2j0j s SER 556 N -4.78 -0.33 0.42 4.97 0.15 -0.59 -4.32 113.70 109.21 2j0j s SER 556 Ca 0.10 0.33 0.25 0.00 0.70 0.00 0.00 55.95 57.33 2j0j s SER 556 Cb 0.11 0.28 1.30 0.00 -1.71 0.00 0.00 66.02 66.00 2j0j s SER 556 CO 0.61 -0.33 1.67 -0.55 1.20 0.00 0.00 173.24 175.84 2j0j h ASN 557 N 2.45 0.33 -0.44 5.45 7.08 -2.01 0.67 115.58 129.11 2j0j h ASN 557 Ca -0.17 0.13 -0.18 0.00 -3.08 0.00 0.00 56.30 53.00 2j0j h ASN 557 Cb 1.17 0.09 -0.10 0.00 -2.08 0.00 0.00 38.32 37.40 2j0j h ASN 557 CO 0.30 -0.10 0.06 -0.90 -2.08 0.00 0.00 177.43 174.71 2j0j n ASP 558 N -4.71 3.21 -3.48 6.14 3.85 -1.26 -4.96 116.55 115.35 2j0j n ASP 558 Ca 0.33 -3.51 -0.00 0.00 -0.71 0.00 0.00 54.79 50.90 2j0j n ASP 558 Cb 1.22 -0.65 -0.04 0.00 -1.35 0.00 0.00 41.12 40.30 2j0j n ASP 558 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2j0j s VAL 560 N 2.84 3.82 -0.01 0.00 -7.23 -1.26 -1.38 120.40 117.19 2j0j s VAL 560 Ca 0.04 -1.61 0.02 0.00 -1.81 0.00 0.00 61.98 58.62 2j0j s VAL 560 Cb -0.13 -3.01 -0.00 0.00 0.56 0.00 0.00 36.38 33.79 2j0j s VAL 560 CO -0.19 -0.28 -0.07 -0.54 -0.31 0.00 0.00 175.10 173.71 2j0j s LYS 561 N -3.48 0.57 0.05 4.82 1.02 -0.22 -4.62 119.74 117.88 2j0j s LYS 561 Ca 0.31 -0.24 -0.30 0.00 0.02 0.00 0.00 55.97 55.76 2j0j s LYS 561 Cb -0.08 -0.55 -0.04 0.00 -0.52 0.00 0.00 37.83 36.64 2j0j s LYS 561 CO 0.21 0.14 1.01 -1.17 -0.92 0.00 0.00 175.35 174.62 2j0j s LEU 562 N -0.11 4.41 0.37 3.17 0.20 0.35 -1.81 118.68 125.26 2j0j s LEU 562 Ca 0.02 1.77 0.06 0.00 0.69 0.00 0.00 54.13 56.66 2j0j s LEU 562 Cb -0.03 -3.58 -0.07 0.00 -0.43 0.00 0.00 46.19 42.08 2j0j s LEU 562 CO -0.00 -0.24 0.02 -0.83 -0.29 0.00 0.00 176.35 175.01 2j0j s GLY 563 N 0.70 2.31 0.00 7.98 0.00 -1.01 -2.11 107.32 115.19 2j0j s GLY 563 Ca 0.51 -2.19 0.00 0.00 0.00 0.00 0.00 44.72 43.04 2j0j s GLY 563 CO 0.29 -1.98 0.00 1.34 0.00 0.00 0.00 173.10 172.75 2j0j n ASP 564 N -0.84 0.00 -1.54 1.64 -0.08 -1.26 -4.85 116.55 109.62 2j0j n ASP 564 Ca -0.04 0.00 -0.14 0.00 -1.51 0.00 0.00 54.79 53.10 2j0j n ASP 564 Cb 0.67 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 44.11 2j0j n ASP 564 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2j0j n PHE 565 N 0.00 -0.57 -2.50 -0.67 3.01 -1.26 -5.06 117.46 110.42 2j0j n PHE 565 Ca 0.00 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.22 2j0j n PHE 565 Cb 0.00 -2.95 0.12 0.00 -0.01 0.00 0.00 39.48 36.64 2j0j n PHE 565 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2j0j s GLY 566 N -2.44 1.76 0.01 1.37 0.00 -1.26 -4.73 107.32 102.03 2j0j s GLY 566 Ca 0.00 -1.64 0.02 0.00 0.00 0.00 0.00 44.72 43.10 2j0j s GLY 566 CO 0.00 -1.06 -0.00 1.08 0.00 0.00 0.00 173.10 173.12 2j0j s LEU 567 N -5.23 3.49 -0.28 0.66 1.02 -1.26 -5.06 118.68 112.02 2j0j s LEU 567 Ca 0.67 -0.03 0.09 0.00 0.02 0.00 0.00 54.13 54.88 2j0j s LEU 567 Cb -0.05 -2.02 0.46 0.00 0.02 0.00 0.00 46.19 44.59 2j0j s LEU 567 CO 0.45 0.27 1.18 -1.54 0.02 0.00 0.00 176.35 176.74 2j0j n SER 568 N 1.32 4.28 -4.87 2.29 3.41 -1.26 -5.00 113.62 113.78 2j0j n SER 568 Ca -0.14 -3.55 -0.34 0.00 -0.26 0.00 0.00 58.87 54.58 2j0j n SER 568 Cb 0.53 -0.37 -0.06 0.00 -0.26 0.00 0.00 64.21 64.05 2j0j n SER 568 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2j0j s ARG 569 N -3.56 3.36 -0.02 4.33 3.00 -1.26 -3.54 118.95 121.26 2j0j s ARG 569 Ca 0.47 -0.31 0.01 0.00 0.00 0.00 0.00 55.73 55.90 2j0j s ARG 569 Cb 0.40 -3.07 0.01 0.00 0.00 0.00 0.00 34.95 32.29 2j0j s ARG 569 CO 0.02 0.69 -0.05 -0.47 0.00 0.00 0.00 175.30 175.50 2j0j s TYR 570 N -1.23 0.59 -0.18 -0.53 5.04 -1.26 -4.99 117.35 114.78 2j0j s TYR 570 Ca 0.24 -0.13 -0.16 0.00 -2.44 0.00 0.00 57.07 54.58 2j0j s TYR 570 Cb -0.12 -0.48 -0.06 0.00 0.35 0.00 0.00 41.96 41.64 2j0j s TYR 570 CO 0.15 -0.10 -0.31 -1.33 -1.34 0.00 0.00 175.55 172.62 2j0j n MET 571 N 3.55 0.52 0.00 4.97 0.00 -1.26 -5.01 117.12 119.89 2j0j n MET 571 Ca -0.20 0.27 0.00 0.00 0.00 0.00 0.00 57.70 57.77 2j0j n MET 571 Cb 0.54 -1.49 0.00 0.00 0.00 0.00 0.00 33.22 32.27 2j0j n MET 571 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 2j0j n GLU 572 N -4.46 0.00 0.00 0.03 0.00 -1.23 -4.86 120.64 110.12 2j0j n GLU 572 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.16 56.98 2j0j n GLU 572 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.96 2j0j n GLU 572 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2j0j n ASP 573 N -1.66 0.00 0.00 -1.84 4.64 -1.26 -5.09 116.55 111.35 2j0j n ASP 573 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 2j0j n ASP 573 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 2j0j n ASP 573 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 2j0j n LEU 584 N 0.00 0.00 -3.02 -2.67 4.77 -1.26 -5.28 117.00 109.55 2j0j n LEU 584 Ca 0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 2j0j n LEU 584 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 2j0j n LEU 584 CO 0.00 0.00 2.94 -0.81 -1.33 0.00 0.00 177.39 178.19 2j0j n PRO 585 N 0.00 3.36 -0.35 3.23 -0.04 -1.26 -4.72 135.00 135.22 2j0j n PRO 585 Ca 0.00 -2.00 0.04 0.00 -0.04 0.00 0.00 63.50 61.50 2j0j n PRO 585 Cb 0.00 -2.60 0.11 0.00 -0.04 0.00 0.00 33.50 30.97 2j0j n PRO 585 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2j0j h ILE 586 N 2.74 0.03 0.00 0.52 1.08 -1.98 0.64 117.51 120.55 2j0j h ILE 586 Ca 0.71 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.18 2j0j h ILE 586 Cb 0.56 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 34.35 2j0j h ILE 586 CO 1.41 0.00 0.00 0.29 -0.69 0.00 0.00 178.15 179.16 2j0j n LYS 587 N -5.58 0.03 0.00 2.37 5.02 -1.26 0.81 118.16 119.54 2j0j n LYS 587 Ca 0.14 0.49 0.08 0.00 -2.02 0.00 0.00 58.31 57.00 2j0j n LYS 587 Cb 0.46 -1.58 0.01 0.00 -0.02 0.00 0.00 35.03 33.90 2j0j n LYS 587 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2j0j n TRP 588 N -1.64 0.00 -3.41 2.13 8.01 0.22 -4.92 117.44 117.83 2j0j n TRP 588 Ca 0.00 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.82 2j0j n TRP 588 Cb 0.03 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.27 2j0j n TRP 588 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 2j0j s MET 589 N -1.81 4.25 0.20 -0.99 -1.94 0.24 -4.31 119.30 114.95 2j0j s MET 589 Ca 0.14 0.34 -0.32 0.00 -1.71 0.00 0.00 55.69 54.14 2j0j s MET 589 Cb 0.13 -3.40 -0.14 0.00 2.01 0.00 0.00 34.83 33.43 2j0j s MET 589 CO 0.37 0.27 1.33 0.00 -0.01 0.00 0.00 175.02 176.98 2j0j n ALA 590 N 3.34 0.36 -0.36 3.03 0.00 -1.26 -4.80 120.51 120.82 2j0j n ALA 590 Ca -0.10 0.44 0.06 0.00 0.00 0.00 0.00 53.44 53.85 2j0j n ALA 590 Cb 0.52 -2.18 0.23 0.00 0.00 0.00 0.00 19.45 18.02 2j0j n ALA 590 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2j0j h PRO 591 N 4.04 0.99 0.00 0.00 0.11 -1.96 0.13 132.00 135.32 2j0j h PRO 591 Ca -0.44 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 2j0j h PRO 591 Cb 1.30 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2j0j h PRO 591 CO 0.75 0.66 -0.07 1.05 -0.21 0.00 0.00 178.00 180.17 2j0j h GLU 592 N 1.02 0.00 -0.12 1.05 9.09 -1.89 0.25 114.58 123.98 2j0j h GLU 592 Ca 0.48 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.88 2j0j h GLU 592 Cb 0.42 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.52 2j0j h GLU 592 CO -0.24 0.07 0.04 0.77 0.05 0.00 0.00 179.01 179.70 2j0j h SER 593 N 0.00 0.17 -0.59 3.06 0.02 -0.80 0.69 113.55 116.10 2j0j h SER 593 Ca -0.00 -0.20 -0.07 0.00 -0.84 0.00 0.00 61.79 60.68 2j0j h SER 593 Cb 0.15 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 2j0j h SER 593 CO 0.01 0.33 0.09 0.40 -1.14 0.00 0.00 176.83 176.51 2j0j h ILE 594 N 0.01 1.26 0.02 3.27 2.04 -0.85 -1.39 117.51 121.86 2j0j h ILE 594 Ca 0.04 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 2j0j h ILE 594 Cb 0.22 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.06 2j0j h ILE 594 CO -0.00 0.37 -0.01 0.78 0.00 0.00 0.00 178.15 179.29 2j0j h ASN 595 N 0.88 -0.02 -0.01 1.72 2.35 -0.54 -3.42 115.58 116.53 2j0j h ASN 595 Ca 0.18 -0.72 0.00 0.00 -0.55 0.00 0.00 56.30 55.21 2j0j h ASN 595 Cb 0.43 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.81 2j0j h ASN 595 CO 0.01 0.79 0.00 0.49 -1.65 0.00 0.00 177.43 177.07 2j0j n PHE 596 N -4.70 0.01 -2.34 1.19 3.72 0.18 -4.34 117.46 111.19 2j0j n PHE 596 Ca -0.08 -0.06 -0.20 0.00 -0.05 0.00 0.00 57.45 57.07 2j0j n PHE 596 Cb 0.36 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.88 2j0j n PHE 596 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2j0j n ARG 597 N 0.12 -1.56 -3.41 -1.08 1.74 -0.52 -4.97 116.66 106.98 2j0j n ARG 597 Ca 0.02 0.96 -0.38 0.00 -0.77 0.00 0.00 57.85 57.68 2j0j n ARG 597 Cb 0.10 -5.54 -0.06 0.00 -1.02 0.00 0.00 32.46 25.93 2j0j n ARG 597 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2j0j s ARG 598 N -4.92 4.03 -0.15 5.56 1.81 -1.20 -4.95 118.95 119.13 2j0j s ARG 598 Ca 0.00 0.54 -0.01 0.00 -1.72 0.00 0.00 55.73 54.54 2j0j s ARG 598 Cb 0.00 -3.22 0.04 0.00 -0.45 0.00 0.00 34.95 31.32 2j0j s ARG 598 CO 0.00 0.67 -0.02 -0.06 -0.68 0.00 0.00 175.30 175.21 2j0j s PHE 599 N -1.10 1.34 0.25 -0.53 0.40 -1.26 -3.59 117.98 113.49 2j0j s PHE 599 Ca 0.26 -0.85 0.02 0.00 -0.60 0.00 0.00 56.93 55.77 2j0j s PHE 599 Cb -0.18 -1.15 -0.01 0.00 0.51 0.00 0.00 43.02 42.20 2j0j s PHE 599 CO 0.16 -0.56 0.08 0.25 0.70 0.00 0.00 175.22 175.85 2j0j n THR 600 N 4.97 0.00 0.24 0.64 -2.24 -1.26 -5.01 114.28 111.61 2j0j n THR 600 Ca -0.10 -1.40 0.11 0.00 -2.27 0.00 0.00 64.05 60.39 2j0j n THR 600 Cb 0.48 0.48 0.71 0.00 -2.10 0.00 0.00 70.33 69.91 2j0j n THR 600 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2j0j h SER 601 N 0.94 0.00 -0.19 3.42 0.02 -1.99 -2.43 113.55 113.32 2j0j h SER 601 Ca -0.19 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.59 2j0j h SER 601 Cb 0.72 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2j0j h SER 601 CO 0.31 0.00 -0.54 0.00 -1.14 0.00 0.00 176.83 175.46 2j0j h ALA 602 N 1.96 0.33 -0.11 3.77 0.00 -1.94 -1.26 119.26 121.99 2j0j h ALA 602 Ca 0.03 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 2j0j h ALA 602 Cb 0.14 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2j0j h ALA 602 CO -0.00 0.53 -0.18 0.66 0.00 0.00 0.00 179.25 180.26 2j0j h SER 603 N 0.42 0.18 -0.58 0.00 4.64 -1.90 0.19 113.55 116.50 2j0j h SER 603 Ca -0.01 -0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 2j0j h SER 603 Cb 1.16 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 63.18 2j0j h SER 603 CO 0.12 0.38 0.23 0.44 -0.87 0.00 0.00 176.83 177.13 2j0j h ASP 604 N 0.18 0.80 -0.33 4.97 3.45 -1.02 -0.79 116.42 123.68 2j0j h ASP 604 Ca 0.03 -0.17 0.01 0.00 0.43 0.00 0.00 57.03 57.34 2j0j h ASP 604 Cb 0.44 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.98 2j0j h ASP 604 CO 0.03 0.75 0.19 0.58 -1.57 0.00 0.00 179.24 179.22 2j0j h VAL 605 N 0.79 1.03 -0.30 -1.35 2.07 -0.34 0.11 116.25 118.26 2j0j h VAL 605 Ca 0.19 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.63 2j0j h VAL 605 Cb 0.20 0.61 -0.08 0.00 -1.52 0.00 0.00 31.29 30.50 2j0j h VAL 605 CO -0.02 0.07 -0.48 -0.25 0.02 0.00 0.00 177.57 176.92 2j0j h TRP 606 N 0.39 -1.40 -0.10 1.57 2.91 -0.72 -0.32 115.95 118.28 2j0j h TRP 606 Ca 0.13 0.07 -0.05 0.00 1.13 0.00 0.00 58.89 60.17 2j0j h TRP 606 Cb 0.00 0.65 -0.01 0.00 -0.51 0.00 0.00 29.16 29.30 2j0j h TRP 606 CO -0.08 -0.48 -0.17 0.52 -1.03 0.00 0.00 178.44 177.21 2j0j h MET 607 N -0.42 0.15 -0.38 2.65 2.86 -0.76 0.16 114.93 119.18 2j0j h MET 607 Ca 0.09 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.64 2j0j h MET 607 Cb 0.62 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 2j0j h MET 607 CO -0.52 0.32 -0.01 0.35 1.06 0.00 0.00 176.91 178.11 2j0j h PHE 608 N 0.14 0.65 0.25 -0.22 3.04 -0.30 -0.59 116.94 119.91 2j0j h PHE 608 Ca 0.03 -0.08 0.01 0.00 3.98 0.00 0.00 57.97 61.91 2j0j h PHE 608 Cb 0.38 -0.18 -0.04 0.00 2.56 0.00 0.00 35.95 38.67 2j0j h PHE 608 CO 0.00 0.63 -0.49 0.78 -2.02 0.00 0.00 178.31 177.21 2j0j h GLY 609 N 0.90 -1.10 0.75 2.40 0.00 0.11 0.22 103.07 106.35 2j0j h GLY 609 Ca 0.12 0.58 0.12 0.00 0.00 0.00 0.00 47.33 48.15 2j0j h GLY 609 CO 0.01 -0.30 0.52 -2.08 0.00 0.00 0.00 176.54 174.70 2j0j h VAL 610 N -0.81 0.89 -0.32 4.60 2.07 -1.28 -1.88 116.25 119.52 2j0j h VAL 610 Ca -0.02 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 2j0j h VAL 610 Cb 0.78 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2j0j h VAL 610 CO -0.20 0.12 0.01 0.00 0.02 0.00 0.00 177.57 177.52 2j0j h MET 612 N 0.37 0.12 0.11 0.00 2.86 0.11 -0.12 114.93 118.38 2j0j h MET 612 Ca 0.09 -0.01 0.02 0.00 -2.06 0.00 0.00 59.70 57.74 2j0j h MET 612 Cb 0.43 -0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.01 2j0j h MET 612 CO 0.01 0.08 -0.47 2.35 1.06 0.00 0.00 176.91 179.94 2j0j h TRP 613 N 0.13 -1.35 -0.90 -0.22 7.01 -0.90 0.34 115.95 120.07 2j0j h TRP 613 Ca 0.21 0.04 0.13 0.00 2.11 0.00 0.00 58.89 61.38 2j0j h TRP 613 Cb 0.30 0.57 -0.14 0.00 -2.10 0.00 0.00 29.16 27.79 2j0j h TRP 613 CO -0.27 -0.56 -0.40 0.93 -2.79 0.00 0.00 178.44 175.35 2j0j h GLU 614 N -0.70 -0.04 -0.49 2.65 5.08 -0.57 0.87 114.58 121.38 2j0j h GLU 614 Ca 0.01 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 2j0j h GLU 614 Cb 0.72 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.95 2j0j h GLU 614 CO -0.27 -0.03 0.28 0.82 -1.00 0.00 0.00 179.01 178.81 2j0j h ILE 615 N -0.05 1.02 0.00 3.13 2.04 -0.16 -0.83 117.51 122.66 2j0j h ILE 615 Ca 0.30 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 2j0j h ILE 615 Cb 0.57 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 2j0j h ILE 615 CO -0.91 0.10 -0.10 -0.07 0.00 0.00 0.00 178.15 177.17 2j0j h LEU 616 N 0.55 0.00 -2.94 1.44 -0.00 0.20 -1.76 115.31 112.80 2j0j h LEU 616 Ca 0.20 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 58.04 2j0j h LEU 616 Cb 0.05 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.69 2j0j h LEU 616 CO -0.11 0.10 0.05 0.23 -0.00 0.00 0.00 178.44 178.71 2j0j n MET 617 N -3.24 3.67 -3.90 1.13 2.81 0.28 -4.79 117.12 113.07 2j0j n MET 617 Ca 0.00 -2.31 -0.38 0.00 -1.81 0.00 0.00 57.70 53.20 2j0j n MET 617 Cb 0.36 -2.05 0.03 0.00 -0.71 0.00 0.00 33.22 30.85 2j0j n MET 617 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2j0j n HIS 618 N 0.33 -1.64 -1.75 2.03 8.25 -0.66 -2.35 115.22 119.43 2j0j n HIS 618 Ca 0.23 0.29 -0.15 0.00 -0.26 0.00 0.00 57.72 57.83 2j0j n HIS 618 Cb 0.99 -3.13 -0.04 0.00 1.12 0.00 0.00 29.99 28.93 2j0j n HIS 618 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j0j n GLY 619 N -1.91 0.86 3.79 -1.41 0.00 -0.41 -3.80 105.19 102.30 2j0j n GLY 619 Ca -0.12 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.24 2j0j n GLY 619 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j0j s VAL 620 N -2.62 4.11 0.13 1.61 1.01 -0.99 -4.89 120.40 118.74 2j0j s VAL 620 Ca 0.00 1.64 -0.30 0.00 0.00 0.00 0.00 61.98 63.32 2j0j s VAL 620 Cb 0.00 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.46 2j0j s VAL 620 CO 0.00 0.03 1.06 -0.54 0.00 0.00 0.00 175.10 175.66 2j0j s LYS 621 N -2.34 4.60 0.29 2.72 1.02 -1.26 -4.63 119.74 120.13 2j0j s LYS 621 Ca 0.54 1.62 -0.30 0.00 0.02 0.00 0.00 55.97 57.85 2j0j s LYS 621 Cb -0.18 -3.33 -0.12 0.00 -0.52 0.00 0.00 37.83 33.68 2j0j s LYS 621 CO 0.23 0.06 1.58 -0.35 -0.92 0.00 0.00 175.35 175.95 2j0j n PRO 622 N 2.85 2.65 -3.04 -1.68 -0.04 -1.26 -2.84 135.00 131.64 2j0j n PRO 622 Ca 0.04 0.94 -0.15 0.00 -0.04 0.00 0.00 63.50 64.29 2j0j n PRO 622 Cb 0.48 -2.71 0.04 0.00 -0.04 0.00 0.00 33.50 31.26 2j0j n PRO 622 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2j0j n PHE 623 N 2.12 -1.63 -1.58 0.54 3.01 -1.26 -4.95 117.46 113.70 2j0j n PHE 623 Ca 0.09 0.54 -0.45 0.00 1.01 0.00 0.00 57.45 58.63 2j0j n PHE 623 Cb 0.36 -3.45 -0.02 0.00 -0.01 0.00 0.00 39.48 36.36 2j0j n PHE 623 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 2j0j n GLN 624 N -3.18 1.28 -1.94 -1.08 6.02 -1.13 -1.02 117.38 116.33 2j0j n GLN 624 Ca -0.02 0.45 -0.16 0.00 -0.01 0.00 0.00 57.00 57.26 2j0j n GLN 624 Cb 0.55 -1.84 -0.04 0.00 1.02 0.00 0.00 30.24 29.93 2j0j n GLN 624 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2j0j n GLY 625 N 1.42 0.55 3.32 1.08 0.00 -1.26 -4.97 105.19 105.34 2j0j n GLY 625 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 2j0j n GLY 625 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j0j s VAL 626 N -2.61 3.02 0.66 1.61 1.01 -0.19 -5.11 120.40 118.79 2j0j s VAL 626 Ca 0.00 -0.65 -0.15 0.00 0.00 0.00 0.00 61.98 61.18 2j0j s VAL 626 Cb 0.00 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 34.08 2j0j s VAL 626 CO 0.00 0.50 1.12 -0.54 0.00 0.00 0.00 175.10 176.18 2j0j s LYS 627 N 0.77 2.76 0.39 2.72 1.02 -1.26 -4.83 119.74 121.30 2j0j s LYS 627 Ca -0.05 1.45 0.21 0.00 0.02 0.00 0.00 55.97 57.60 2j0j s LYS 627 Cb -0.15 -1.94 0.67 0.00 -0.52 0.00 0.00 37.83 35.88 2j0j s LYS 627 CO 0.01 -1.29 1.72 -0.91 -0.92 0.00 0.00 175.35 173.96 2j0j h ASN 628 N 0.07 0.00 0.32 2.83 4.21 -1.99 -1.38 115.58 119.65 2j0j h ASN 628 Ca -0.47 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.04 2j0j h ASN 628 Cb 1.25 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.45 2j0j h ASN 628 CO 0.54 0.32 -0.60 0.59 -1.29 0.00 0.00 177.43 176.99 2j0j n ASN 629 N -3.40 0.75 -0.03 5.81 4.13 -1.26 -3.17 115.26 118.09 2j0j n ASN 629 Ca 0.00 -0.57 -0.15 0.00 1.68 0.00 0.00 54.58 55.55 2j0j n ASN 629 Cb 0.52 0.44 -0.10 0.00 -1.54 0.00 0.00 39.78 39.10 2j0j n ASN 629 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 2j0j h ASP 630 N 0.24 0.32 -0.30 6.41 3.45 -1.67 -3.16 116.42 121.71 2j0j h ASP 630 Ca 0.00 -0.65 0.03 0.00 0.43 0.00 0.00 57.03 56.85 2j0j h ASP 630 Cb 0.51 -0.10 -0.03 0.00 -0.56 0.00 0.00 39.33 39.15 2j0j h ASP 630 CO 0.00 0.92 0.10 0.58 -1.57 0.00 0.00 179.24 179.26 2j0j h VAL 631 N -0.25 0.90 -0.79 -1.35 2.07 -1.40 -1.43 116.25 114.01 2j0j h VAL 631 Ca -0.02 -0.08 0.14 0.00 0.82 0.00 0.00 66.70 67.56 2j0j h VAL 631 Cb 0.91 0.66 -0.09 0.00 -1.52 0.00 0.00 31.29 31.25 2j0j h VAL 631 CO 0.05 0.04 0.37 0.16 0.02 0.00 0.00 177.57 178.21 2j0j h ILE 632 N 0.22 0.72 -0.01 4.57 3.07 -1.61 -2.02 117.51 122.45 2j0j h ILE 632 Ca 0.14 -0.19 -0.03 0.00 1.55 0.00 0.00 64.86 66.33 2j0j h ILE 632 Cb 0.11 0.12 0.00 0.00 -0.27 0.00 0.00 36.82 36.79 2j0j h ILE 632 CO -0.15 0.10 -0.13 1.23 -1.05 0.00 0.00 178.15 178.16 2j0j h GLY 633 N 0.55 0.11 -0.75 0.16 0.00 -1.49 0.95 103.07 102.60 2j0j h GLY 633 Ca 0.43 -0.18 0.09 0.00 0.00 0.00 0.00 47.33 47.67 2j0j h GLY 633 CO -0.37 0.16 -0.53 3.21 0.00 0.00 0.00 176.54 179.01 2j0j h ARG 634 N -0.60 -0.14 -0.51 4.80 3.08 -1.06 0.39 114.38 120.33 2j0j h ARG 634 Ca -0.01 0.01 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 2j0j h ARG 634 Cb 0.87 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.93 2j0j h ARG 634 CO 0.03 -0.09 -0.02 0.82 -1.07 0.00 0.00 179.97 179.63 2j0j h ILE 635 N -0.15 1.27 -0.59 2.04 2.04 -1.38 -1.41 117.51 119.33 2j0j h ILE 635 Ca 0.17 -1.13 0.09 0.00 1.00 0.00 0.00 64.86 64.98 2j0j h ILE 635 Cb 0.51 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 2j0j h ILE 635 CO -0.81 0.40 0.40 -0.08 0.00 0.00 0.00 178.15 178.05 2j0j h GLU 636 N 0.79 0.44 0.10 2.37 4.57 0.39 -2.99 114.58 120.25 2j0j h GLU 636 Ca 0.14 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.29 2j0j h GLU 636 Cb 0.56 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.05 2j0j h GLU 636 CO 0.03 0.29 -0.05 -0.91 -1.18 0.00 0.00 179.01 177.20 2j0j h ASN 637 N 0.46 -0.11 0.00 1.04 4.21 0.52 -3.48 115.58 118.21 2j0j h ASN 637 Ca 0.27 -0.40 0.00 0.00 1.21 0.00 0.00 56.30 57.37 2j0j h ASN 637 Cb 0.46 0.03 0.00 0.00 -1.12 0.00 0.00 38.32 37.69 2j0j h ASN 637 CO -0.08 0.53 0.00 0.61 -1.29 0.00 0.00 177.43 177.20 2j0j n GLY 638 N 1.09 0.00 3.56 2.83 0.00 -0.61 -5.11 105.19 106.95 2j0j n GLY 638 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 2j0j n GLY 638 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2j0j n GLU 639 N 0.00 0.77 -3.85 1.61 4.71 -0.94 -4.96 120.64 117.98 2j0j n GLU 639 Ca 0.00 0.30 -0.09 0.00 -0.01 0.00 0.00 57.16 57.36 2j0j n GLU 639 Cb 0.00 -1.97 -0.08 0.00 -1.01 0.00 0.00 31.44 28.38 2j0j n GLU 639 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2j0j s ARG 640 N -2.44 0.80 0.28 3.49 1.81 -1.26 -4.39 118.95 117.24 2j0j s ARG 640 Ca 0.72 -0.85 -0.30 0.00 -1.72 0.00 0.00 55.73 53.58 2j0j s ARG 640 Cb -0.44 0.33 -0.11 0.00 -0.45 0.00 0.00 34.95 34.28 2j0j s ARG 640 CO 0.51 -0.25 1.57 -0.51 -0.68 0.00 0.00 175.30 175.93 2j0j s LEU 641 N -2.62 4.35 0.71 2.53 1.43 -1.26 -4.94 118.68 118.89 2j0j s LEU 641 Ca 0.02 2.89 -0.16 0.00 -1.03 0.00 0.00 54.13 55.85 2j0j s LEU 641 Cb 0.03 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.62 2j0j s LEU 641 CO -0.09 -0.87 0.92 -0.81 0.23 0.00 0.00 176.35 175.73 2j0j n PRO 642 N 2.24 0.51 -1.93 1.29 -0.04 -1.26 -4.91 135.00 130.90 2j0j n PRO 642 Ca 0.08 0.23 -0.43 0.00 -0.04 0.00 0.00 63.50 63.34 2j0j n PRO 642 Cb 0.38 -2.18 -0.03 0.00 -0.04 0.00 0.00 33.50 31.63 2j0j n PRO 642 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 2j0j s MET 643 N -3.24 3.80 0.49 0.54 1.75 -1.26 -4.95 119.30 116.43 2j0j s MET 643 Ca 0.73 1.98 -0.23 0.00 -1.25 0.00 0.00 55.69 56.91 2j0j s MET 643 Cb -0.35 -4.11 -0.07 0.00 2.84 0.00 0.00 34.83 33.14 2j0j s MET 643 CO 0.51 -1.31 1.23 -0.35 -0.65 0.00 0.00 175.02 174.45 2j0j n PRO 644 N 7.75 1.65 -1.69 4.11 -0.04 -1.26 -4.90 135.00 140.62 2j0j n PRO 644 Ca 0.21 0.60 -0.53 0.00 -0.04 0.00 0.00 63.50 63.74 2j0j n PRO 644 Cb 0.44 -2.39 -0.06 0.00 -0.04 0.00 0.00 33.50 31.45 2j0j n PRO 644 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2j0j n PRO 645 N -0.46 1.58 -1.37 0.54 -0.02 -1.26 -1.67 135.00 132.34 2j0j n PRO 645 Ca 0.09 0.58 -0.13 0.00 -2.02 0.00 0.00 63.50 62.02 2j0j n PRO 645 Cb 0.42 -2.32 -0.06 0.00 -0.02 0.00 0.00 33.50 31.53 2j0j n PRO 645 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2j0j n ASN 646 N 5.36 -4.66 -4.69 2.55 3.02 -1.26 -5.01 115.26 110.57 2j0j n ASN 646 Ca 0.24 0.32 -0.41 0.00 -0.03 0.00 0.00 54.58 54.69 2j0j n ASN 646 Cb 0.20 -3.30 -0.04 0.00 -0.61 0.00 0.00 39.78 36.04 2j0j n ASN 646 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j0j n PRO 648 N 4.72 0.57 0.23 0.00 -0.02 -1.26 -4.87 135.00 134.38 2j0j n PRO 648 Ca 0.04 0.25 0.11 0.00 -2.02 0.00 0.00 63.50 61.89 2j0j n PRO 648 Cb 0.50 -2.21 0.46 0.00 -0.02 0.00 0.00 33.50 32.23 2j0j n PRO 648 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2j0j h PRO 649 N -0.12 0.00 -0.60 0.52 0.13 -1.99 -3.00 132.00 126.94 2j0j h PRO 649 Ca -0.48 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.59 2j0j h PRO 649 Cb 1.34 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.45 2j0j h PRO 649 CO 0.47 0.17 0.11 1.15 -0.23 0.00 0.00 178.00 179.67 2j0j h THR 650 N 0.00 1.26 -0.29 1.56 2.02 -1.98 -1.60 112.91 113.87 2j0j h THR 650 Ca -0.00 -0.97 -0.18 0.00 0.77 0.00 0.00 66.41 66.03 2j0j h THR 650 Cb 0.75 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 67.89 2j0j h THR 650 CO 0.02 0.36 -0.53 0.25 0.37 0.00 0.00 175.52 175.99 2j0j h LEU 651 N 0.89 0.96 -1.05 2.58 5.85 -1.90 0.42 115.31 123.06 2j0j h LEU 651 Ca 0.18 -0.53 -0.04 0.00 0.84 0.00 0.00 57.88 58.34 2j0j h LEU 651 Cb 0.40 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 2j0j h LEU 651 CO 0.01 1.31 0.24 0.22 -0.34 0.00 0.00 178.44 179.88 2j0j h TYR 652 N 0.65 0.93 -0.73 1.25 3.20 -1.55 0.24 116.97 120.95 2j0j h TYR 652 Ca 0.02 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 2j0j h TYR 652 Cb 1.14 -0.28 -0.04 0.00 1.54 0.00 0.00 36.73 39.09 2j0j h TYR 652 CO 0.07 0.72 0.45 1.03 -1.64 0.00 0.00 178.16 178.79 2j0j h SER 653 N 0.91 0.87 -0.48 -2.11 0.87 -0.17 -1.52 113.55 111.93 2j0j h SER 653 Ca 0.21 -0.05 -0.07 0.00 -1.23 0.00 0.00 61.79 60.65 2j0j h SER 653 Cb 0.19 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 2j0j h SER 653 CO -0.02 0.67 0.04 0.25 -0.53 0.00 0.00 176.83 177.24 2j0j h LEU 654 N 1.00 0.84 -0.68 2.23 5.85 0.10 -2.59 115.31 122.07 2j0j h LEU 654 Ca 0.26 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 2j0j h LEU 654 Cb -0.05 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.72 2j0j h LEU 654 CO -0.05 0.88 0.33 0.24 -0.34 0.00 0.00 178.44 179.50 2j0j h MET 655 N 0.82 0.97 0.00 1.25 2.86 -0.10 -3.16 114.93 117.58 2j0j h MET 655 Ca 0.16 -0.14 -0.09 0.00 -2.06 0.00 0.00 59.70 57.58 2j0j h MET 655 Cb 0.43 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 2j0j h MET 655 CO 0.02 0.76 -0.42 1.79 1.06 0.00 0.00 176.91 180.12 2j0j h THR 656 N 0.94 0.98 -0.44 2.22 1.35 -0.91 -1.40 112.91 115.65 2j0j h THR 656 Ca 0.23 -1.62 -0.01 0.00 -0.55 0.00 0.00 66.41 64.46 2j0j h THR 656 Cb 0.10 1.97 -0.02 0.00 -1.73 0.00 0.00 68.15 68.47 2j0j h THR 656 CO -0.03 0.41 0.24 0.11 -0.25 0.00 0.00 175.52 176.00 2j0j h LYS 657 N 0.00 0.61 -0.16 4.72 1.57 -1.48 -1.62 116.57 120.21 2j0j h LYS 657 Ca -0.00 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.75 2j0j h LYS 657 Cb 0.93 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.12 2j0j h LYS 657 CO 0.05 0.48 0.13 0.00 -0.57 0.00 0.00 179.45 179.55 2j0j n TRP 659 N -4.30 2.06 -1.67 0.00 8.01 -0.64 -3.90 117.44 117.00 2j0j n TRP 659 Ca 0.01 -0.81 -0.45 0.00 -1.31 0.00 0.00 57.50 54.94 2j0j n TRP 659 Cb 0.26 -0.54 -0.04 0.00 -2.01 0.00 0.00 31.31 28.98 2j0j n TRP 659 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2j0j n ALA 660 N 0.38 1.40 -0.08 6.99 0.00 -0.71 -4.88 120.51 123.61 2j0j n ALA 660 Ca 0.30 0.26 -0.10 0.00 0.00 0.00 0.00 53.44 53.89 2j0j n ALA 660 Cb 1.19 -2.60 -0.04 0.00 0.00 0.00 0.00 19.45 18.00 2j0j n ALA 660 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2j0j h TYR 661 N 9.72 -1.14 -3.04 0.00 5.03 -1.90 -3.38 116.97 122.25 2j0j h TYR 661 Ca -0.49 0.06 -0.57 0.00 2.58 0.00 0.00 58.73 60.31 2j0j h TYR 661 Cb 1.25 0.54 -0.04 0.00 1.55 0.00 0.00 36.73 40.03 2j0j h TYR 661 CO 0.90 -0.44 1.06 0.34 -1.32 0.00 0.00 178.16 178.70 2j0j s ASP 662 N -5.00 6.45 0.27 -2.11 3.68 -1.26 -4.88 116.67 113.82 2j0j s ASP 662 Ca -0.15 1.23 -0.09 0.00 2.13 0.00 0.00 52.55 55.66 2j0j s ASP 662 Cb 0.11 -2.54 0.42 0.00 -1.45 0.00 0.00 42.92 39.46 2j0j s ASP 662 CO 0.65 -1.27 1.57 1.55 0.13 0.00 0.00 175.17 177.81 2j0j h PRO 663 N 10.31 -0.00 0.00 4.34 0.13 -1.95 -1.53 132.00 143.30 2j0j h PRO 663 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2j0j h PRO 663 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2j0j h PRO 663 CO 1.04 -0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.68 2j0j n SER 664 N -5.60 0.10 -0.27 1.44 3.41 -1.26 -1.22 113.62 110.22 2j0j n SER 664 Ca 0.15 0.54 0.12 0.00 -0.26 0.00 0.00 58.87 59.41 2j0j n SER 664 Cb 0.47 -0.55 0.23 0.00 -0.26 0.00 0.00 64.21 64.10 2j0j n SER 664 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2j0j n ARG 665 N -1.62 0.81 -2.62 4.33 1.74 -0.58 -4.95 116.66 113.77 2j0j n ARG 665 Ca 0.01 -0.55 -0.31 0.00 -0.77 0.00 0.00 57.85 56.23 2j0j n ARG 665 Cb 0.09 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.01 2j0j n ARG 665 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2j0j s ARG 666 N -2.57 3.82 0.74 5.56 0.52 -0.36 -4.93 118.95 121.72 2j0j s ARG 666 Ca 0.20 0.65 -0.11 0.00 -0.52 0.00 0.00 55.73 55.95 2j0j s ARG 666 Cb 0.19 -2.28 0.03 0.00 0.52 0.00 0.00 34.95 33.41 2j0j s ARG 666 CO 0.57 -0.16 1.08 -1.25 0.02 0.00 0.00 175.30 175.56 2j0j s PRO 667 N -4.06 2.57 0.51 3.54 0.04 -1.26 -5.04 135.00 131.30 2j0j s PRO 667 Ca 0.54 0.70 -0.08 0.00 0.04 0.00 0.00 61.00 62.20 2j0j s PRO 667 Cb -0.10 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 2j0j s PRO 667 CO 0.33 -1.29 0.86 1.03 0.04 0.00 0.00 177.00 177.97 2j0j s ARG 668 N -5.16 3.60 0.30 4.56 1.81 -1.26 -4.92 118.95 117.88 2j0j s ARG 668 Ca 0.59 0.41 -0.00 0.00 -1.72 0.00 0.00 55.73 55.01 2j0j s ARG 668 Cb -0.13 -2.29 0.47 0.00 -0.45 0.00 0.00 34.95 32.55 2j0j s ARG 668 CO 0.54 -0.29 1.88 0.74 -0.68 0.00 0.00 175.30 177.49 2j0j h PHE 669 N 0.23 0.83 -0.70 -0.53 0.04 -1.94 0.12 116.94 115.00 2j0j h PHE 669 Ca -0.46 -0.05 0.10 0.00 2.80 0.00 0.00 57.97 60.36 2j0j h PHE 669 Cb 1.20 -0.25 -0.05 0.00 2.20 0.00 0.00 35.95 39.05 2j0j h PHE 669 CO 0.61 0.65 0.46 0.00 -0.60 0.00 0.00 178.31 179.43 2j0j h THR 670 N 0.81 0.90 0.05 -1.55 1.03 -1.91 0.35 112.91 112.59 2j0j h THR 670 Ca 0.19 -0.18 -0.25 0.00 -0.01 0.00 0.00 66.41 66.16 2j0j h THR 670 Cb 0.18 0.32 0.01 0.00 -1.07 0.00 0.00 68.15 67.59 2j0j h THR 670 CO -0.02 0.10 -1.07 -0.08 -0.01 0.00 0.00 175.52 174.45 2j0j h GLU 671 N 0.54 0.41 -0.42 0.00 4.57 -1.38 -2.96 114.58 115.33 2j0j h GLU 671 Ca 0.33 -0.52 -0.14 0.00 -1.18 0.00 0.00 59.36 57.85 2j0j h GLU 671 Cb 0.55 0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 29.29 2j0j h GLU 671 CO -0.11 1.18 -0.29 -0.07 -1.18 0.00 0.00 179.01 178.54 2j0j h LEU 672 N 0.20 0.97 -0.20 1.64 3.38 -0.27 -2.17 115.31 118.85 2j0j h LEU 672 Ca -0.11 -0.40 0.06 0.00 0.09 0.00 0.00 57.88 57.52 2j0j h LEU 672 Cb 1.73 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 42.14 2j0j h LEU 672 CO 0.19 1.18 -0.30 0.50 0.09 0.00 0.00 178.44 180.10 2j0j h LYS 673 N 0.78 -0.32 -0.51 1.13 3.64 -0.43 -0.18 116.57 120.68 2j0j h LYS 673 Ca 0.09 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2j0j h LYS 673 Cb 0.87 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.73 2j0j h LYS 673 CO 0.08 -0.21 0.33 0.00 -2.27 0.00 0.00 179.45 177.38 2j0j h ALA 674 N 0.58 0.64 0.05 5.00 0.00 -1.33 -0.34 119.26 123.86 2j0j h ALA 674 Ca 0.12 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2j0j h ALA 674 Cb 0.52 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2j0j h ALA 674 CO -0.39 0.09 -0.03 1.96 0.00 0.00 0.00 179.25 180.89 2j0j h GLN 675 N 0.69 -0.07 -0.71 0.00 1.08 -1.17 -2.83 115.11 112.10 2j0j h GLN 675 Ca 0.19 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.33 2j0j h GLN 675 Cb -0.08 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 2j0j h GLN 675 CO -0.04 -0.04 0.21 -0.07 -0.95 0.00 0.00 178.83 177.93 2j0j h LEU 676 N -0.07 1.05 -0.56 1.46 3.38 -0.41 0.25 115.31 120.40 2j0j h LEU 676 Ca -0.01 -0.22 0.09 0.00 0.09 0.00 0.00 57.88 57.84 2j0j h LEU 676 Cb 0.06 -0.27 -0.11 0.00 0.09 0.00 0.00 40.66 40.42 2j0j h LEU 676 CO 0.01 0.99 -0.38 -1.28 0.09 0.00 0.00 178.44 177.87 2j0j h SER 677 N 1.05 -1.30 0.62 -0.43 0.87 -1.09 0.33 113.55 113.60 2j0j h SER 677 Ca 0.23 0.23 -0.20 0.00 -1.23 0.00 0.00 61.79 60.81 2j0j h SER 677 Cb 0.33 0.61 -0.01 0.00 -0.44 0.00 0.00 62.40 62.89 2j0j h SER 677 CO -0.00 -0.32 -0.91 0.71 -0.53 0.00 0.00 176.83 175.77 2j0j h THR 678 N -0.21 1.51 0.00 2.23 1.35 -0.97 -1.86 112.91 114.97 2j0j h THR 678 Ca 0.20 -2.70 -0.02 0.00 -0.55 0.00 0.00 66.41 63.34 2j0j h THR 678 Cb 0.56 2.52 -0.00 0.00 -1.73 0.00 0.00 68.15 69.50 2j0j h THR 678 CO -0.67 0.79 -0.09 0.40 -0.25 0.00 0.00 175.52 175.70 2j0j h ILE 679 N 0.10 0.88 0.49 6.82 2.04 -0.16 -1.59 117.51 126.10 2j0j h ILE 679 Ca -0.05 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 2j0j h ILE 679 Cb 1.55 1.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 2j0j h ILE 679 CO 0.14 0.09 -0.24 0.25 0.00 0.00 0.00 178.15 178.39 2j0j h LEU 680 N 0.00 -0.56 0.00 1.44 5.85 0.24 -2.67 115.31 119.62 2j0j h LEU 680 Ca -0.00 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.77 2j0j h LEU 680 Cb 0.18 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 2j0j h LEU 680 CO 0.01 -0.24 -0.24 -0.33 -0.34 0.00 0.00 178.44 177.30 2j0j h GLU 681 N -0.98 -0.37 -0.59 1.25 4.39 -1.20 -1.10 114.58 115.97 2j0j h GLU 681 Ca -0.07 0.03 0.11 0.00 0.34 0.00 0.00 59.36 59.77 2j0j h GLU 681 Cb 0.51 0.08 -0.12 0.00 -0.10 0.00 0.00 28.75 29.13 2j0j h GLU 681 CO 0.11 -0.25 -0.28 1.49 -1.16 0.00 0.00 179.01 178.92 2j0j h GLU 682 N -0.38 -0.12 0.00 2.33 4.57 -1.42 0.13 114.58 119.69 2j0j h GLU 682 Ca 0.06 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.25 2j0j h GLU 682 Cb 0.46 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.08 2j0j h GLU 682 CO -0.21 -0.08 0.00 1.49 -1.18 0.00 0.00 179.01 179.02 2j0j h GLU 683 N -0.13 0.00 0.25 1.92 4.57 -0.98 1.35 114.58 121.57 2j0j h GLU 683 Ca 0.25 0.00 -0.34 0.00 -1.18 0.00 0.00 59.36 58.09 2j0j h GLU 683 Cb 0.53 0.00 0.04 0.00 -0.16 0.00 0.00 28.75 29.16 2j0j h GLU 683 CO -0.67 0.00 -1.51 0.87 -1.18 0.00 0.00 179.01 176.53 2j0j h LYS 684 N 0.00 0.53 0.00 1.92 1.57 0.47 -3.33 116.57 117.73 2j0j h LYS 684 Ca 0.00 -0.91 -0.23 0.00 -1.87 0.00 0.00 60.65 57.64 2j0j h LYS 684 Cb 0.33 0.34 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 2j0j h LYS 684 CO 0.00 1.44 -1.61 1.28 -0.57 0.00 0.00 179.45 179.99 2j0j n LEU 685 N -3.71 0.79 0.00 2.94 4.77 -0.90 -5.11 117.00 115.78 2j0j n LEU 685 Ca -0.18 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 2j0j n LEU 685 Cb 1.10 0.14 0.00 0.00 -2.33 0.00 0.00 43.42 42.33 2j0j n LEU 685 CO 0.60 0.26 0.00 0.00 -1.33 0.00 0.00 177.39 176.92