#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pnk n SER 5 N 0.00 0.00 0.10 6.41 2.88 -1.26 -4.82 113.62 116.93 2pnk n SER 5 Ca 0.00 0.00 0.02 0.00 -1.33 0.00 0.00 58.87 57.56 2pnk n SER 5 Cb 0.00 0.00 0.38 0.00 -0.75 0.00 0.00 64.21 63.84 2pnk n SER 5 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 2pnk h ARG 6 N 0.00 0.30 -0.02 -1.46 2.43 -2.02 0.32 114.38 113.92 2pnk h ARG 6 Ca 0.00 -0.06 -0.15 0.00 -0.81 0.00 0.00 59.98 58.96 2pnk h ARG 6 Cb 0.00 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 2pnk h ARG 6 CO 0.00 0.40 -0.67 0.93 -1.51 0.00 0.00 179.97 179.12 2pnk h GLU 7 N 0.28 0.12 0.10 0.20 3.07 -1.98 0.34 114.58 116.70 2pnk h GLU 7 Ca 0.06 -0.09 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2pnk h GLU 7 Cb 0.34 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.27 2pnk h GLU 7 CO 0.02 0.74 -0.05 0.28 -1.40 0.00 0.00 179.01 178.60 2pnk h VAL 8 N 0.08 1.11 -0.55 3.13 2.07 -1.59 -2.14 116.25 118.35 2pnk h VAL 8 Ca -0.01 -0.86 0.11 0.00 0.82 0.00 0.00 66.70 66.75 2pnk h VAL 8 Cb 1.19 1.65 -0.11 0.00 -1.52 0.00 0.00 31.29 32.50 2pnk h VAL 8 CO 0.10 0.21 -0.24 0.25 0.02 0.00 0.00 177.57 177.90 2pnk h LEU 9 N -0.54 -0.83 -0.58 2.57 5.85 -0.34 0.30 115.31 121.74 2pnk h LEU 9 Ca -0.01 0.20 0.09 0.00 0.84 0.00 0.00 57.88 58.99 2pnk h LEU 9 Cb 0.44 0.46 -0.07 0.00 0.37 0.00 0.00 40.66 41.86 2pnk h LEU 9 CO 0.02 -0.26 0.20 0.00 -0.34 0.00 0.00 178.44 178.07 2pnk h ALA 10 N 1.25 0.73 0.01 1.25 0.00 -0.28 0.15 119.26 122.37 2pnk h ALA 10 Ca 0.25 0.09 -0.20 0.00 0.00 0.00 0.00 54.91 55.05 2pnk h ALA 10 Cb 0.50 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2pnk h ALA 10 CO -0.62 -0.21 -0.89 1.49 0.00 0.00 0.00 179.25 179.02 2pnk h GLU 11 N 0.37 0.20 -0.34 0.00 4.57 -0.61 -0.58 114.58 118.19 2pnk h GLU 11 Ca 0.29 -0.22 -0.03 0.00 -1.18 0.00 0.00 59.36 58.22 2pnk h GLU 11 Cb 0.36 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.00 2pnk h GLU 11 CO -0.31 0.96 0.09 0.87 -1.18 0.00 0.00 179.01 179.44 2pnk h LYS 12 N 0.11 0.55 -0.02 1.92 1.57 -0.36 -1.51 116.57 118.83 2pnk h LYS 12 Ca -0.05 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.60 2pnk h LYS 12 Cb 1.52 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.76 2pnk h LYS 12 CO 0.14 0.60 0.01 0.28 -0.57 0.00 0.00 179.45 179.90 2pnk h VAL 13 N 0.40 1.16 -1.00 0.50 2.07 -0.99 -1.00 116.25 117.40 2pnk h VAL 13 Ca 0.11 -0.48 0.09 0.00 0.82 0.00 0.00 66.70 67.23 2pnk h VAL 13 Cb 0.29 1.44 -0.07 0.00 -1.52 0.00 0.00 31.29 31.43 2pnk h VAL 13 CO 0.00 0.13 0.64 0.11 0.02 0.00 0.00 177.57 178.47 2pnk h LYS 14 N -0.16 1.06 -0.05 1.57 1.57 -1.06 -0.48 116.57 119.02 2pnk h LYS 14 Ca 0.01 -0.06 -0.25 0.00 -1.87 0.00 0.00 60.65 58.48 2pnk h LYS 14 Cb 0.20 -0.24 0.02 0.00 0.08 0.00 0.00 32.23 32.29 2pnk h LYS 14 CO -0.00 0.70 -0.94 -0.91 -0.57 0.00 0.00 179.45 177.73 2pnk h ASN 15 N 1.09 0.89 -0.54 0.86 2.35 -1.16 -1.56 115.58 117.51 2pnk h ASN 15 Ca 0.46 -0.66 0.07 0.00 -0.55 0.00 0.00 56.30 55.62 2pnk h ASN 15 Cb 0.30 -0.27 -0.06 0.00 0.05 0.00 0.00 38.32 38.34 2pnk h ASN 15 CO -0.21 1.46 0.21 0.00 -1.65 0.00 0.00 177.43 177.24 2pnk h ALA 16 N 0.50 0.67 -0.46 -0.83 0.00 -0.59 0.83 119.26 119.38 2pnk h ALA 16 Ca -0.10 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2pnk h ALA 16 Cb 1.58 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 2pnk h ALA 16 CO 0.19 -0.18 0.04 0.28 0.00 0.00 0.00 179.25 179.57 2pnk h VAL 17 N 0.40 1.26 -0.61 0.00 2.07 -1.07 -1.42 116.25 116.88 2pnk h VAL 17 Ca 0.26 -0.99 -0.10 0.00 0.82 0.00 0.00 66.70 66.69 2pnk h VAL 17 Cb 0.27 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2pnk h VAL 17 CO -0.25 0.35 -0.01 0.78 0.02 0.00 0.00 177.57 178.46 2pnk h ASN 18 N 0.65 1.05 1.57 0.57 2.35 -0.94 -3.05 115.58 117.79 2pnk h ASN 18 Ca 0.14 -0.30 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2pnk h ASN 18 Cb 0.45 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2pnk h ASN 18 CO 0.02 1.10 -0.08 0.78 -1.65 0.00 0.00 177.43 177.60 2pnk h ASN 19 N 0.98 0.00 -2.78 5.81 2.35 -0.68 -3.45 115.58 117.81 2pnk h ASN 19 Ca 0.17 -0.02 -0.56 0.00 -0.55 0.00 0.00 56.30 55.35 2pnk h ASN 19 Cb 0.57 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.92 2pnk h ASN 19 CO 0.03 0.01 0.98 -1.58 -1.65 0.00 0.00 177.43 175.22 2pnk s GLN 20 N -3.15 4.22 0.25 0.81 2.00 -0.55 -4.99 119.66 118.26 2pnk s GLN 20 Ca 0.09 1.93 -0.30 0.00 -2.00 0.00 0.00 55.36 55.08 2pnk s GLN 20 Cb 0.10 -3.84 -0.10 0.00 0.80 0.00 0.00 33.01 29.97 2pnk s GLN 20 CO 0.63 -0.75 1.40 -2.14 -0.50 0.00 0.00 175.29 173.94 2pnk s PRO 21 N 3.61 4.29 -0.05 1.67 0.02 -1.26 -4.92 135.00 138.36 2pnk s PRO 21 Ca 0.64 2.26 -0.14 0.00 0.02 0.00 0.00 61.00 63.78 2pnk s PRO 21 Cb -0.28 -3.12 -0.05 0.00 0.02 0.00 0.00 34.50 31.07 2pnk s PRO 21 CO 0.22 -0.37 0.36 0.08 -0.33 0.00 0.00 177.00 176.96 2pnk s VAL 22 N -0.13 5.15 -0.30 3.83 1.01 0.33 -4.70 120.40 125.59 2pnk s VAL 22 Ca 0.58 0.72 -0.18 0.00 0.00 0.00 0.00 61.98 63.10 2pnk s VAL 22 Cb -0.41 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.29 2pnk s VAL 22 CO 0.44 0.53 0.50 -0.89 0.00 0.00 0.00 175.10 175.68 2pnk s THR 23 N -0.67 5.06 0.44 3.92 2.01 -0.31 -0.96 115.64 125.13 2pnk s THR 23 Ca 0.22 0.64 0.05 0.00 0.31 0.00 0.00 61.69 62.91 2pnk s THR 23 Cb -0.15 -3.86 0.01 0.00 0.01 0.00 0.00 72.50 68.51 2pnk s THR 23 CO 0.10 -0.02 0.62 -0.62 -0.69 0.00 0.00 174.62 174.01 2pnk s ASP 24 N 1.64 5.61 -0.42 3.53 -1.08 -0.04 -4.73 116.67 121.19 2pnk s ASP 24 Ca 0.20 -0.23 -0.37 0.00 -0.52 0.00 0.00 52.55 51.63 2pnk s ASP 24 Cb -0.16 -0.86 -0.16 0.00 -1.46 0.00 0.00 42.92 40.28 2pnk s ASP 24 CO 0.11 -0.81 1.79 1.57 0.52 0.00 0.00 175.17 178.34 2pnk n HIS 26 N -1.97 0.98 -4.34 -5.34 -0.00 -1.26 -1.35 115.22 101.93 2pnk n HIS 26 Ca 0.06 0.65 -0.18 0.00 -0.00 0.00 0.00 57.72 58.25 2pnk n HIS 26 Cb 0.59 -1.92 -0.10 0.00 -0.00 0.00 0.00 29.99 28.57 2pnk n HIS 26 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 2pnk s THR 27 N 4.99 0.50 -0.33 3.57 -4.23 -0.56 -1.34 115.64 118.24 2pnk s THR 27 Ca 1.00 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.58 2pnk s THR 27 Cb -1.26 -2.58 0.46 0.00 1.34 0.00 0.00 72.50 70.47 2pnk s THR 27 CO 0.55 0.00 1.34 1.41 -0.54 0.00 0.00 174.62 177.39 2pnk n HIS 28 N -0.55 2.23 -3.67 3.99 8.25 0.45 -2.27 115.22 123.66 2pnk n HIS 28 Ca -0.00 -2.15 -0.21 0.00 -0.26 0.00 0.00 57.72 55.10 2pnk n HIS 28 Cb 0.66 -0.50 -0.01 0.00 1.12 0.00 0.00 29.99 31.26 2pnk n HIS 28 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2pnk s LEU 29 N -3.54 4.13 0.04 2.41 1.43 -1.18 -4.57 118.68 117.40 2pnk s LEU 29 Ca 0.50 0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.71 2pnk s LEU 29 Cb 0.42 -2.93 -0.02 0.00 0.03 0.00 0.00 46.19 43.69 2pnk s LEU 29 CO 0.01 -0.25 -0.08 -0.36 0.23 0.00 0.00 176.35 175.90 2pnk s PHE 30 N -2.13 0.72 0.31 0.29 0.08 -1.26 -4.43 117.98 111.55 2pnk s PHE 30 Ca 0.39 -0.44 -0.27 0.00 0.12 0.00 0.00 56.93 56.73 2pnk s PHE 30 Cb -0.09 -0.43 -0.14 0.00 -0.57 0.00 0.00 43.02 41.79 2pnk s PHE 30 CO 0.31 -0.06 0.95 0.45 -0.10 0.00 0.00 175.22 176.78 2pnk n SER 31 N 1.64 1.00 0.16 1.36 2.88 -1.26 -4.74 113.62 114.66 2pnk n SER 31 Ca -0.21 1.14 0.03 0.00 -1.33 0.00 0.00 58.87 58.50 2pnk n SER 31 Cb 0.55 -1.26 0.41 0.00 -0.75 0.00 0.00 64.21 63.16 2pnk n SER 31 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2pnk h PRO 32 N 1.80 0.11 0.00 -1.46 0.11 -1.93 -1.64 132.00 128.99 2pnk h PRO 32 Ca -0.39 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2pnk h PRO 32 Cb 1.35 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2pnk h PRO 32 CO 0.59 0.33 0.00 0.27 -0.21 0.00 0.00 178.00 178.98 2pnk n ASN 33 N -4.24 0.00 0.00 -2.05 6.94 -1.26 -1.18 115.26 113.47 2pnk n ASN 33 Ca -0.02 0.49 0.12 0.00 -0.02 0.00 0.00 54.58 55.16 2pnk n ASN 33 Cb 0.30 -0.50 0.55 0.00 -2.36 0.00 0.00 39.78 37.78 2pnk n ASN 33 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2pnk n PHE 34 N -1.50 0.00 -1.19 -2.53 3.01 -0.62 -5.02 117.46 109.62 2pnk n PHE 34 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 2pnk n PHE 34 Cb 0.09 -0.48 0.00 0.00 -0.01 0.00 0.00 39.48 39.08 2pnk n PHE 34 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2pnk n GLY 35 N 1.11 0.33 0.00 1.37 0.00 -0.32 -4.46 105.19 103.22 2pnk n GLY 35 Ca 0.07 -1.53 0.14 0.00 0.00 0.00 0.00 46.02 44.70 2pnk n GLY 35 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2pnk n GLU 36 N 1.64 0.61 0.24 1.61 -0.58 -1.26 -2.27 120.64 120.63 2pnk n GLU 36 Ca 0.00 0.02 0.09 0.00 -0.42 0.00 0.00 57.16 56.85 2pnk n GLU 36 Cb 0.00 -1.50 0.60 0.00 -0.57 0.00 0.00 31.44 29.97 2pnk n GLU 36 CO 0.00 0.00 0.00 -0.84 -0.48 0.00 0.00 177.13 175.81 2pnk h ILE 37 N 0.00 0.82 -2.59 -3.67 3.07 -1.97 -3.38 117.51 109.80 2pnk h ILE 37 Ca 0.00 -0.71 -0.56 0.00 1.55 0.00 0.00 64.86 65.14 2pnk h ILE 37 Cb 0.14 1.42 -0.03 0.00 -0.27 0.00 0.00 36.82 38.08 2pnk h ILE 37 CO 0.00 0.18 1.27 -0.22 -1.05 0.00 0.00 178.15 178.33 2pnk s LEU 38 N -7.73 3.47 0.03 0.16 2.96 -0.96 -4.81 118.68 111.79 2pnk s LEU 38 Ca -0.03 1.06 -0.22 0.00 -0.22 0.00 0.00 54.13 54.71 2pnk s LEU 38 Cb 0.14 -3.31 -0.06 0.00 0.50 0.00 0.00 46.19 43.46 2pnk s LEU 38 CO 0.64 -1.82 0.67 -0.76 -1.32 0.00 0.00 176.35 173.76 2pnk s LEU 39 N 7.21 4.45 0.03 -0.68 1.43 -1.26 -5.02 118.68 124.84 2pnk s LEU 39 Ca 0.75 1.31 -0.25 0.00 -1.03 0.00 0.00 54.13 54.91 2pnk s LEU 39 Cb -0.19 -3.06 0.06 0.00 0.03 0.00 0.00 46.19 43.02 2pnk s LEU 39 CO 0.31 0.08 0.57 -1.66 0.23 0.00 0.00 176.35 175.89 2pnk s TRP 40 N -0.24 -0.51 0.00 0.29 1.48 -1.26 -0.94 118.94 117.77 2pnk s TRP 40 Ca 0.34 0.66 0.00 0.00 -1.06 0.00 0.00 56.10 56.04 2pnk s TRP 40 Cb -0.19 0.39 0.00 0.00 -1.16 0.00 0.00 33.47 32.50 2pnk s TRP 40 CO 0.20 -0.65 0.00 -0.40 -4.06 0.00 0.00 176.95 172.04 2pnk n ASP 41 N 0.50 0.00 0.13 -2.66 5.68 -1.26 -4.64 116.55 114.30 2pnk n ASP 41 Ca -0.18 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.13 2pnk n ASP 41 Cb 0.60 0.00 0.41 0.00 -1.14 0.00 0.00 41.12 40.98 2pnk n ASP 41 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2pnk h ILE 42 N 0.00 1.17 -0.53 2.12 6.09 -1.95 -0.83 117.51 123.57 2pnk h ILE 42 Ca 0.00 -0.76 -0.10 0.00 -1.37 0.00 0.00 64.86 62.63 2pnk h ILE 42 Cb 0.00 1.23 -0.02 0.00 0.47 0.00 0.00 36.82 38.50 2pnk h ILE 42 CO 0.00 0.23 -0.04 0.44 -3.07 0.00 0.00 178.15 175.71 2pnk h ASP 43 N 0.19 0.96 -0.44 2.19 3.32 -1.95 -1.17 116.42 119.53 2pnk h ASP 43 Ca 0.04 -0.33 -0.09 0.00 0.02 0.00 0.00 57.03 56.67 2pnk h ASP 43 Cb 0.37 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 2pnk h ASP 43 CO 0.02 1.06 -0.05 -0.33 -1.72 0.00 0.00 179.24 178.22 2pnk h GLU 44 N 0.85 0.88 -0.46 3.56 4.39 -1.66 -1.48 114.58 120.66 2pnk h GLU 44 Ca 0.15 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 2pnk h GLU 44 Cb 0.59 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.14 2pnk h GLU 44 CO 0.04 0.91 0.23 -0.07 -1.16 0.00 0.00 179.01 178.96 2pnk h LEU 45 N 0.80 0.59 -0.87 1.33 3.38 -1.04 -2.19 115.31 117.32 2pnk h LEU 45 Ca 0.14 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 2pnk h LEU 45 Cb 0.56 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2pnk h LEU 45 CO 0.03 0.54 -0.29 -0.07 0.09 0.00 0.00 178.44 178.74 2pnk h LEU 46 N 0.60 0.00 -2.26 1.67 3.38 -1.00 -3.05 115.31 114.65 2pnk h LEU 46 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2pnk h LEU 46 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2pnk h LEU 46 CO -0.02 0.29 0.00 0.35 0.09 0.00 0.00 178.44 179.15 2pnk n THR 47 N -3.39 0.45 -1.44 0.22 -2.24 -0.58 -4.68 114.28 102.63 2pnk n THR 47 Ca 0.00 -0.71 -0.49 0.00 -2.27 0.00 0.00 64.05 60.58 2pnk n THR 47 Cb 0.50 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.70 2pnk n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2pnk n TYR 48 N 1.45 -0.10 0.26 4.78 9.36 -0.84 -4.62 117.16 127.46 2pnk n TYR 48 Ca 0.19 0.94 0.16 0.00 3.32 0.00 0.00 57.90 62.51 2pnk n TYR 48 Cb 0.60 -2.02 0.88 0.00 -0.63 0.00 0.00 39.34 38.17 2pnk n TYR 48 CO 0.00 0.00 0.00 1.12 0.22 0.00 0.00 176.86 178.20 2pnk h HIS 49 N 1.42 0.00 -0.82 2.98 2.07 -1.92 0.53 115.15 119.41 2pnk h HIS 49 Ca -0.32 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.20 2pnk h HIS 49 Cb 1.42 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.36 2pnk h HIS 49 CO 0.45 0.00 0.51 1.88 -3.07 0.00 0.00 177.93 177.70 2pnk h TYR 50 N 0.00 1.05 0.00 6.12 -1.99 -1.96 -2.15 116.97 118.05 2pnk h TYR 50 Ca 0.03 0.01 -0.11 0.00 2.00 0.00 0.00 58.73 60.66 2pnk h TYR 50 Cb 0.19 -0.35 -0.02 0.00 2.00 0.00 0.00 36.73 38.56 2pnk h TYR 50 CO 0.00 0.69 -0.73 -0.07 -0.00 0.00 0.00 178.16 178.04 2pnk h LEU 51 N 1.12 0.00 -0.49 3.88 3.38 -1.21 -2.99 115.31 119.00 2pnk h LEU 51 Ca 0.30 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.27 2pnk h LEU 51 Cb -0.08 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2pnk h LEU 51 CO -0.06 0.47 0.30 0.58 0.09 0.00 0.00 178.44 179.82 2pnk h VAL 52 N 0.00 1.15 -0.32 1.22 2.07 -1.01 -0.29 116.25 119.06 2pnk h VAL 52 Ca -0.04 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.16 2pnk h VAL 52 Cb 1.40 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 2pnk h VAL 52 CO 0.05 0.15 0.21 0.00 0.02 0.00 0.00 177.57 178.00 2pnk h ALA 53 N 1.15 0.41 -0.48 1.67 0.00 -1.42 -3.06 119.26 117.53 2pnk h ALA 53 Ca 0.18 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 2pnk h ALA 53 Cb -0.02 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2pnk h ALA 53 CO -0.03 -0.13 -0.18 0.93 0.00 0.00 0.00 179.25 179.84 2pnk h GLU 54 N 0.43 0.95 -2.00 0.00 5.08 -1.37 -3.20 114.58 114.47 2pnk h GLU 54 Ca 0.12 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 2pnk h GLU 54 Cb -0.05 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2pnk h GLU 54 CO -0.03 1.04 0.00 1.55 -1.00 0.00 0.00 179.01 180.58 2pnk n VAL 55 N -4.12 0.51 0.00 3.13 3.14 -0.13 -3.90 118.33 116.95 2pnk n VAL 55 Ca 0.01 -0.13 0.00 0.00 -2.96 0.00 0.00 64.34 61.26 2pnk n VAL 55 Cb 0.43 -1.12 0.00 0.00 -1.06 0.00 0.00 33.84 32.09 2pnk n VAL 55 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2pnk n ARG 57 N 1.87 0.00 0.00 1.45 1.74 -1.21 -1.13 116.66 119.38 2pnk n ARG 57 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2pnk n ARG 57 Cb 0.13 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.57 2pnk n ARG 57 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2pnk n TRP 58 N 0.00 0.00 -2.67 -1.55 7.02 -1.25 -5.09 117.44 113.90 2pnk n TRP 58 Ca 0.00 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.15 2pnk n TRP 58 Cb 0.00 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 28.84 2pnk n TRP 58 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 2pnk s THR 59 N -1.95 4.31 -0.53 -0.99 -1.32 -0.28 -4.97 115.64 109.91 2pnk s THR 59 Ca 0.00 1.36 0.24 0.00 -1.21 0.00 0.00 61.69 62.08 2pnk s THR 59 Cb 0.00 -3.60 0.32 0.00 -1.51 0.00 0.00 72.50 67.72 2pnk s THR 59 CO 0.00 -0.39 1.67 0.44 -2.21 0.00 0.00 174.62 174.14 2pnk h ASP 60 N 1.61 0.00 -3.40 8.08 3.32 -1.98 -3.46 116.42 120.59 2pnk h ASP 60 Ca -0.49 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.04 2pnk h ASP 60 Cb 1.19 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.79 2pnk h ASP 60 CO 0.61 0.00 0.73 -0.69 -1.72 0.00 0.00 179.24 178.16 2pnk s VAL 61 N -3.18 2.80 0.64 -1.35 1.01 -1.26 -4.99 120.40 114.07 2pnk s VAL 61 Ca 0.08 0.68 -0.15 0.00 0.00 0.00 0.00 61.98 62.59 2pnk s VAL 61 Cb 0.08 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 33.01 2pnk s VAL 61 CO 0.64 0.11 1.08 -0.94 0.00 0.00 0.00 175.10 175.99 2pnk s SER 62 N 0.32 5.41 0.41 3.32 1.04 -1.26 -4.88 113.70 118.06 2pnk s SER 62 Ca 0.58 1.86 0.11 0.00 0.48 0.00 0.00 55.95 58.97 2pnk s SER 62 Cb -0.40 -2.53 0.85 0.00 0.10 0.00 0.00 66.02 64.03 2pnk s SER 62 CO 0.42 -1.42 1.95 -0.29 0.98 0.00 0.00 173.24 174.88 2pnk h ILE 63 N 0.06 1.15 -0.08 -1.02 6.09 -1.97 0.71 117.51 122.45 2pnk h ILE 63 Ca -0.46 -0.67 -0.03 0.00 -1.37 0.00 0.00 64.86 62.32 2pnk h ILE 63 Cb 1.23 1.17 -0.00 0.00 0.47 0.00 0.00 36.82 39.69 2pnk h ILE 63 CO 0.56 0.21 -0.07 -0.33 -3.07 0.00 0.00 178.15 175.44 2pnk h GLU 64 N 0.20 0.19 -0.98 2.19 3.07 -1.94 -1.80 114.58 115.50 2pnk h GLU 64 Ca 0.04 -0.10 0.04 0.00 -0.50 0.00 0.00 59.36 58.84 2pnk h GLU 64 Cb 0.32 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.17 2pnk h GLU 64 CO 0.02 0.62 0.65 0.00 -1.40 0.00 0.00 179.01 178.89 2pnk h ALA 65 N 0.57 1.36 -0.32 3.43 0.00 -1.84 -1.95 119.26 120.50 2pnk h ALA 65 Ca 0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2pnk h ALA 65 Cb 0.58 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2pnk h ALA 65 CO 0.02 0.54 0.10 0.35 0.00 0.00 0.00 179.25 180.26 2pnk h PHE 66 N 1.24 0.52 0.00 0.00 3.57 -0.69 -2.03 116.94 119.56 2pnk h PHE 66 Ca 0.39 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.80 2pnk h PHE 66 Cb 0.00 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 2pnk h PHE 66 CO -0.00 0.53 -0.19 -1.49 -2.23 0.00 0.00 178.31 174.93 2pnk h TRP 67 N 0.36 0.00 0.00 0.41 -0.00 -1.12 -3.45 115.95 112.15 2pnk h TRP 67 Ca 0.10 0.00 -0.15 0.00 -0.00 0.00 0.00 58.89 58.84 2pnk h TRP 67 Cb 0.26 0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 29.38 2pnk h TRP 67 CO 0.01 0.19 0.34 0.00 -0.00 0.00 0.00 178.44 178.98 2pnk n ALA 68 N -2.27 4.33 -2.93 1.49 0.00 -0.75 -5.05 120.51 115.32 2pnk n ALA 68 Ca -0.01 -1.24 -0.22 0.00 0.00 0.00 0.00 53.44 51.97 2pnk n ALA 68 Cb 0.33 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 17.36 2pnk n ALA 68 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2pnk s SER 70 N 2.52 6.13 0.25 0.00 1.04 -1.26 -5.10 113.70 117.29 2pnk s SER 70 Ca 0.40 0.00 -0.03 0.00 0.48 0.00 0.00 55.95 56.81 2pnk s SER 70 Cb 0.18 -1.76 0.44 0.00 0.10 0.00 0.00 66.02 64.99 2pnk s SER 70 CO -0.00 -0.05 1.80 0.50 0.98 0.00 0.00 173.24 176.47 2pnk h LYS 71 N 1.34 0.77 -0.47 4.02 1.63 -1.97 -1.24 116.57 120.65 2pnk h LYS 71 Ca -0.51 -0.05 -0.11 0.00 -0.85 0.00 0.00 60.65 59.14 2pnk h LYS 71 Cb 1.23 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 32.67 2pnk h LYS 71 CO 0.62 0.51 -0.14 -0.09 -3.45 0.00 0.00 179.45 176.90 2pnk h ARG 72 N 0.79 0.88 -0.54 1.90 2.43 -1.99 -0.94 114.38 116.91 2pnk h ARG 72 Ca 0.42 -0.32 -0.10 0.00 -0.81 0.00 0.00 59.98 59.18 2pnk h ARG 72 Cb 0.43 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 2pnk h ARG 72 CO -0.27 0.96 -0.04 0.93 -1.51 0.00 0.00 179.97 180.04 2pnk h GLU 73 N 0.78 0.98 -0.05 0.20 5.08 -1.85 -1.48 114.58 118.25 2pnk h GLU 73 Ca 0.12 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2pnk h GLU 73 Cb 0.66 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.83 2pnk h GLU 73 CO 0.05 1.00 0.03 1.96 -1.00 0.00 0.00 179.01 181.05 2pnk h GLN 74 N 0.86 0.06 -0.62 2.33 4.20 -1.03 -1.07 115.11 119.85 2pnk h GLN 74 Ca 0.15 -0.01 0.10 0.00 0.06 0.00 0.00 58.65 58.95 2pnk h GLN 74 Cb 0.58 -0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.28 2pnk h GLN 74 CO 0.03 0.10 0.21 0.00 -0.67 0.00 0.00 178.83 178.51 2pnk h ALA 75 N 0.96 0.79 -0.76 3.87 0.00 -1.15 -0.19 119.26 122.79 2pnk h ALA 75 Ca 0.02 0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2pnk h ALA 75 Cb 0.05 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2pnk h ALA 75 CO -0.00 -0.21 0.25 -0.44 0.00 0.00 0.00 179.25 178.85 2pnk h ASP 76 N 0.38 1.09 -0.01 0.00 3.32 -0.97 -1.51 116.42 118.72 2pnk h ASP 76 Ca 0.32 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 2pnk h ASP 76 Cb 0.41 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.68 2pnk h ASP 76 CO -0.33 1.00 0.00 0.25 -1.72 0.00 0.00 179.24 178.44 2pnk h LEU 77 N 1.12 0.01 -0.86 1.55 5.85 -0.77 -1.59 115.31 120.63 2pnk h LEU 77 Ca 0.25 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.78 2pnk h LEU 77 Cb 0.29 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 2pnk h LEU 77 CO -0.01 0.20 0.55 0.40 -0.34 0.00 0.00 178.44 179.23 2pnk h ILE 78 N -0.17 1.23 -0.08 4.05 2.04 -0.92 -0.16 117.51 123.49 2pnk h ILE 78 Ca 0.00 -0.45 0.01 0.00 1.00 0.00 0.00 64.86 65.43 2pnk h ILE 78 Cb 0.19 -0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.24 2pnk h ILE 78 CO -0.00 0.23 -0.01 -0.25 0.00 0.00 0.00 178.15 178.12 2pnk h TRP 79 N 1.17 -0.02 -0.41 1.37 2.91 -1.21 0.11 115.95 119.88 2pnk h TRP 79 Ca 0.31 0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.32 2pnk h TRP 79 Cb -0.10 0.02 -0.02 0.00 -0.51 0.00 0.00 29.16 28.55 2pnk h TRP 79 CO -0.01 -0.02 0.18 1.49 -1.03 0.00 0.00 178.44 179.05 2pnk h GLU 80 N 0.02 0.60 0.13 2.65 4.57 -0.85 -1.74 114.58 119.96 2pnk h GLU 80 Ca 0.04 -0.10 -0.28 0.00 -1.18 0.00 0.00 59.36 57.84 2pnk h GLU 80 Cb 0.05 -0.10 0.01 0.00 -0.16 0.00 0.00 28.75 28.55 2pnk h GLU 80 CO -0.07 0.54 -1.24 0.93 -1.18 0.00 0.00 179.01 177.99 2pnk h GLU 81 N 0.51 0.37 0.00 1.92 4.39 -0.92 0.19 114.58 121.04 2pnk h GLU 81 Ca 0.14 -0.57 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2pnk h GLU 81 Cb 0.15 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 2pnk h GLU 81 CO -0.01 1.26 -1.66 1.28 -1.16 0.00 0.00 179.01 178.72 2pnk n LEU 82 N -3.62 0.23 -0.01 1.33 4.77 0.02 -3.68 117.00 116.04 2pnk n LEU 82 Ca -0.10 -0.13 -0.01 0.00 -0.03 0.00 0.00 56.01 55.74 2pnk n LEU 82 Cb 1.01 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 42.09 2pnk n LEU 82 CO 0.55 0.06 -0.55 0.49 -1.33 0.00 0.00 177.39 176.60 2pnk n PHE 83 N -2.00 0.00 -0.11 -1.77 3.01 -0.70 -3.45 117.46 112.44 2pnk n PHE 83 Ca -0.02 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.24 2pnk n PHE 83 Cb 0.46 -0.07 -0.09 0.00 -0.01 0.00 0.00 39.48 39.77 2pnk n PHE 83 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2pnk n ILE 84 N -2.27 1.51 0.19 4.37 2.08 -0.92 -4.45 119.36 119.87 2pnk n ILE 84 Ca -0.03 -0.07 0.08 0.00 0.56 0.00 0.00 62.75 63.29 2pnk n ILE 84 Cb 0.54 -2.08 0.16 0.00 -0.75 0.00 0.00 39.64 37.51 2pnk n ILE 84 CO 0.00 0.00 0.00 0.11 0.56 0.00 0.00 176.55 177.22 2pnk h LYS 85 N -1.00 0.00 -4.33 0.38 1.57 -1.14 -3.44 116.57 108.61 2pnk h LYS 85 Ca -0.36 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.22 2pnk h LYS 85 Cb 1.23 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.36 2pnk h LYS 85 CO -0.22 0.23 -0.70 1.03 -0.57 0.00 0.00 179.45 179.22 2pnk s ARG 86 N -3.17 0.54 0.34 3.15 3.00 -1.24 -5.04 118.95 116.52 2pnk s ARG 86 Ca 0.05 -0.92 -0.28 0.00 0.00 0.00 0.00 55.73 54.58 2pnk s ARG 86 Cb 0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 34.95 34.88 2pnk s ARG 86 CO 0.69 -0.03 1.21 -1.12 0.00 0.00 0.00 175.30 176.06 2pnk s SER 87 N -2.10 6.80 -1.47 0.23 0.01 -1.26 -3.20 113.70 112.70 2pnk s SER 87 Ca -0.04 2.48 -0.09 0.00 1.31 0.00 0.00 55.95 59.62 2pnk s SER 87 Cb -0.03 -2.63 0.02 0.00 0.21 0.00 0.00 66.02 63.59 2pnk s SER 87 CO -0.03 -0.49 2.59 -0.81 0.41 0.00 0.00 173.24 174.90 2pnk n PRO 88 N 0.65 3.94 0.04 12.44 -0.04 -1.22 -4.64 135.00 146.17 2pnk n PRO 88 Ca 0.01 -2.81 0.12 0.00 -0.04 0.00 0.00 63.50 60.78 2pnk n PRO 88 Cb 0.44 -2.80 0.25 0.00 -0.04 0.00 0.00 33.50 31.36 2pnk n PRO 88 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2pnk n VAL 89 N 3.04 0.25 -1.62 0.52 0.24 -1.26 -3.13 118.33 116.36 2pnk n VAL 89 Ca 0.67 -0.18 -0.34 0.00 -2.04 0.00 0.00 64.34 62.45 2pnk n VAL 89 Cb 0.26 -0.10 0.07 0.00 -1.47 0.00 0.00 33.84 32.60 2pnk n VAL 89 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2pnk s SER 90 N -3.81 4.62 0.22 -1.34 1.04 -1.26 -4.81 113.70 108.36 2pnk s SER 90 Ca 0.09 2.25 -0.09 0.00 0.48 0.00 0.00 55.95 58.68 2pnk s SER 90 Cb 0.15 -2.58 0.22 0.00 0.10 0.00 0.00 66.02 63.91 2pnk s SER 90 CO 0.69 -1.97 1.87 -0.08 0.98 0.00 0.00 173.24 174.73 2pnk h GLU 91 N -0.02 0.99 -0.74 4.02 4.57 -1.98 -0.96 114.58 120.47 2pnk h GLU 91 Ca -0.48 -0.06 -0.05 0.00 -1.18 0.00 0.00 59.36 57.59 2pnk h GLU 91 Cb 1.28 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 29.62 2pnk h GLU 91 CO 0.52 0.66 0.25 0.00 -1.18 0.00 0.00 179.01 179.26 2pnk h ALA 92 N 1.32 0.96 -0.13 2.92 0.00 -1.95 -0.18 119.26 122.20 2pnk h ALA 92 Ca 0.31 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2pnk h ALA 92 Cb -0.03 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 2pnk h ALA 92 CO -0.10 0.63 -0.09 0.00 0.00 0.00 0.00 179.25 179.69 2pnk h ARG 94 N -0.06 0.69 -0.60 0.00 2.43 -1.13 -2.27 114.38 113.43 2pnk h ARG 94 Ca 0.03 -0.04 0.12 0.00 -0.81 0.00 0.00 59.98 59.28 2pnk h ARG 94 Cb 0.58 -0.15 -0.10 0.00 -0.42 0.00 0.00 29.97 29.88 2pnk h ARG 94 CO 0.02 0.45 0.02 0.78 -1.51 0.00 0.00 179.97 179.73 2pnk h GLY 95 N 0.71 0.65 0.80 2.80 0.00 -0.79 0.31 103.07 107.55 2pnk h GLY 95 Ca 0.39 0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.82 2pnk h GLY 95 CO -0.27 -0.18 0.33 -2.08 0.00 0.00 0.00 176.54 174.34 2pnk h VAL 96 N 0.13 1.02 -0.44 4.60 2.07 -1.14 -1.88 116.25 120.61 2pnk h VAL 96 Ca 0.31 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.56 2pnk h VAL 96 Cb 0.50 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 2pnk h VAL 96 CO -0.50 0.12 0.06 -0.07 0.02 0.00 0.00 177.57 177.20 2pnk h LEU 97 N 0.64 0.71 -0.71 2.57 3.38 -1.09 -1.41 115.31 119.41 2pnk h LEU 97 Ca 0.24 -0.27 0.07 0.00 0.09 0.00 0.00 57.88 58.02 2pnk h LEU 97 Cb 0.08 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.58 2pnk h LEU 97 CO -0.13 0.80 0.39 0.74 0.09 0.00 0.00 178.44 180.34 2pnk h THR 98 N 0.60 0.94 -0.34 0.22 2.02 -0.71 -0.65 112.91 115.00 2pnk h THR 98 Ca 0.13 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.07 2pnk h THR 98 Cb 0.40 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 2pnk h THR 98 CO 0.01 0.13 0.21 0.00 0.37 0.00 0.00 175.52 176.24 2pnk h LEU 100 N 0.44 -0.04 -0.55 0.00 3.38 -0.82 -2.11 115.31 115.60 2pnk h LEU 100 Ca 0.12 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.09 2pnk h LEU 100 Cb -0.02 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 2pnk h LEU 100 CO -0.02 0.03 0.27 -0.61 0.09 0.00 0.00 178.44 178.20 2pnk h GLN 101 N -0.11 0.50 -0.16 1.13 4.15 -0.95 -1.00 115.11 118.66 2pnk h GLN 101 Ca -0.01 -0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.40 2pnk h GLN 101 Cb 0.10 -0.11 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 2pnk h GLN 101 CO 0.01 0.33 0.11 0.78 -1.93 0.00 0.00 178.83 178.13 2pnk h GLY 102 N 0.51 0.19 0.14 2.39 0.00 -0.59 -0.35 103.07 105.36 2pnk h GLY 102 Ca 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.51 2pnk h GLY 102 CO -0.19 0.07 0.00 1.04 0.00 0.00 0.00 176.54 177.46 2pnk n LEU 103 N -4.51 0.59 0.00 3.11 4.77 -0.80 -4.89 117.00 115.27 2pnk n LEU 103 Ca -0.00 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 2pnk n LEU 103 Cb 0.11 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2pnk n LEU 103 CO 0.34 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2pnk n GLY 104 N 0.94 0.76 3.87 -0.72 0.00 -0.14 -5.05 105.19 104.85 2pnk n GLY 104 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2pnk n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pnk s LEU 105 N 0.00 3.79 -0.38 0.99 1.43 -0.44 -4.99 118.68 119.07 2pnk s LEU 105 Ca 0.00 1.17 -0.05 0.00 -1.03 0.00 0.00 54.13 54.23 2pnk s LEU 105 Cb 0.00 -4.07 0.08 0.00 0.03 0.00 0.00 46.19 42.23 2pnk s LEU 105 CO 0.00 -0.44 0.17 -0.62 0.23 0.00 0.00 176.35 175.69 2pnk s ASP 106 N -3.22 5.29 0.64 2.29 2.15 -1.26 -3.47 116.67 119.10 2pnk s ASP 106 Ca 0.52 -1.65 0.35 0.00 0.43 0.00 0.00 52.55 52.19 2pnk s ASP 106 Cb -0.10 -1.85 1.93 0.00 -0.30 0.00 0.00 42.92 42.59 2pnk s ASP 106 CO 0.32 -0.47 2.15 -0.65 -0.17 0.00 0.00 175.17 176.36 2pnk h PRO 107 N 8.15 0.00 -0.30 4.34 0.11 -1.91 -2.92 132.00 139.47 2pnk h PRO 107 Ca -0.18 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.91 2pnk h PRO 107 Cb 1.06 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2pnk h PRO 107 CO 0.67 0.00 0.10 0.00 -0.21 0.00 0.00 178.00 178.56 2pnk h ALA 108 N 1.74 1.61 0.00 -0.75 0.00 -2.01 -1.92 119.26 117.93 2pnk h ALA 108 Ca 0.03 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2pnk h ALA 108 Cb 0.35 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2pnk h ALA 108 CO -0.00 0.30 -0.31 1.79 0.00 0.00 0.00 179.25 181.03 2pnk h THR 109 N 0.43 0.58 -4.25 0.00 1.35 -1.96 -3.47 112.91 105.58 2pnk h THR 109 Ca 0.11 -1.61 -0.33 0.00 -0.55 0.00 0.00 66.41 64.03 2pnk h THR 109 Cb 0.12 2.12 -0.02 0.00 -1.73 0.00 0.00 68.15 68.65 2pnk h THR 109 CO -0.01 0.30 -0.46 0.54 -0.25 0.00 0.00 175.52 175.64 2pnk n ARG 110 N -3.25 -2.94 -3.18 4.72 1.74 -0.73 -4.88 116.66 108.14 2pnk n ARG 110 Ca 0.02 0.68 -0.45 0.00 -0.77 0.00 0.00 57.85 57.33 2pnk n ARG 110 Cb 0.59 -5.36 -0.00 0.00 -1.02 0.00 0.00 32.46 26.67 2pnk n ARG 110 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2pnk s ASP 111 N -2.33 7.18 0.44 0.55 -1.08 -1.26 -4.85 116.67 115.32 2pnk s ASP 111 Ca 0.16 -3.28 0.11 0.00 -0.52 0.00 0.00 52.55 49.02 2pnk s ASP 111 Cb -0.08 -2.29 1.00 0.00 -1.46 0.00 0.00 42.92 40.09 2pnk s ASP 111 CO 0.19 -0.50 2.04 0.25 0.52 0.00 0.00 175.17 177.68 2pnk h LEU 112 N 8.01 0.35 -0.34 -1.34 5.85 -1.98 -1.81 115.31 124.04 2pnk h LEU 112 Ca 0.23 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.93 2pnk h LEU 112 Cb 0.89 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.82 2pnk h LEU 112 CO 1.09 0.24 0.15 1.56 -0.34 0.00 0.00 178.44 181.14 2pnk h GLN 113 N 0.41 0.51 -0.69 1.25 7.50 -2.00 -1.58 115.11 120.51 2pnk h GLN 113 Ca 0.18 -0.08 -0.04 0.00 0.50 0.00 0.00 58.65 59.20 2pnk h GLN 113 Cb 0.19 -0.09 -0.03 0.00 0.05 0.00 0.00 27.48 27.61 2pnk h GLN 113 CO -0.04 0.48 0.26 0.28 -1.50 0.00 0.00 178.83 178.31 2pnk h VAL 114 N 0.41 1.25 -0.75 -0.54 2.07 -1.79 -2.48 116.25 114.42 2pnk h VAL 114 Ca 0.12 -0.79 0.04 0.00 0.82 0.00 0.00 66.70 66.88 2pnk h VAL 114 Cb 0.15 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 2pnk h VAL 114 CO -0.01 0.31 0.47 1.88 0.02 0.00 0.00 177.57 180.24 2pnk h TYR 115 N 0.99 0.87 -0.38 1.57 0.05 -1.16 -1.18 116.97 117.72 2pnk h TYR 115 Ca 0.23 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 59.03 2pnk h TYR 115 Cb 0.23 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 37.67 2pnk h TYR 115 CO 0.02 0.49 0.22 0.00 -1.05 0.00 0.00 178.16 177.83 2pnk h ARG 116 N 0.90 0.52 -0.05 4.88 3.08 -1.05 -2.48 114.38 120.18 2pnk h ARG 116 Ca 0.30 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.27 2pnk h ARG 116 Cb 0.05 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.98 2pnk h ARG 116 CO -0.12 0.37 -0.16 0.93 -1.07 0.00 0.00 179.97 179.92 2pnk h GLU 117 N 0.53 0.08 -0.64 0.04 5.08 -0.76 -2.42 114.58 116.49 2pnk h GLU 117 Ca 0.14 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 2pnk h GLU 117 Cb -0.00 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2pnk h GLU 117 CO -0.03 0.25 0.30 -0.92 -1.00 0.00 0.00 179.01 177.61 2pnk h TYR 118 N 0.08 0.93 0.00 4.33 5.03 -1.27 -3.17 116.97 122.89 2pnk h TYR 118 Ca 0.02 -0.05 -0.19 0.00 2.58 0.00 0.00 58.73 61.09 2pnk h TYR 118 Cb 0.34 -0.29 -0.03 0.00 1.55 0.00 0.00 36.73 38.30 2pnk h TYR 118 CO 0.00 0.70 -0.90 0.74 -1.32 0.00 0.00 178.16 177.39 2pnk h PHE 119 N 0.88 0.00 0.00 -3.82 0.04 -1.52 -3.17 116.94 109.36 2pnk h PHE 119 Ca 0.22 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.98 2pnk h PHE 119 Cb 0.13 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.27 2pnk h PHE 119 CO 0.00 0.90 -0.06 0.00 -0.60 0.00 0.00 178.31 178.55 2pnk h ALA 120 N 1.10 1.16 0.00 2.45 0.00 -1.48 -2.83 119.26 119.67 2pnk h ALA 120 Ca -0.01 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 2pnk h ALA 120 Cb 1.68 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 2pnk h ALA 120 CO 0.12 0.08 -0.28 0.87 0.00 0.00 0.00 179.25 180.03 2pnk h LYS 121 N 0.00 0.00 -6.21 0.00 1.57 -1.59 -3.47 116.57 106.87 2pnk h LYS 121 Ca -0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2pnk h LYS 121 Cb 0.28 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.52 2pnk h LYS 121 CO 0.01 0.28 -0.59 0.15 -0.57 0.00 0.00 179.45 178.73 2pnk s LYS 122 N -3.24 2.63 0.59 3.15 1.02 -1.07 -5.13 119.74 117.69 2pnk s LYS 122 Ca 0.04 -1.21 -0.01 0.00 0.02 0.00 0.00 55.97 54.81 2pnk s LYS 122 Cb 0.08 -2.38 0.04 0.00 -0.52 0.00 0.00 37.83 35.04 2pnk s LYS 122 CO 0.69 0.39 0.83 0.95 -0.92 0.00 0.00 175.35 177.29 2pnk s THR 123 N -2.19 2.60 0.18 2.17 -4.23 -1.26 -4.97 115.64 107.96 2pnk s THR 123 Ca 0.32 -0.56 -0.11 0.00 -1.18 0.00 0.00 61.69 60.16 2pnk s THR 123 Cb -0.07 -3.01 0.10 0.00 1.34 0.00 0.00 72.50 70.85 2pnk s THR 123 CO 0.22 -0.01 1.78 0.28 -0.54 0.00 0.00 174.62 176.36 2pnk h SER 124 N -0.09 0.82 -0.24 3.99 0.02 -1.97 -1.46 113.55 114.63 2pnk h SER 124 Ca -0.43 -0.11 -0.12 0.00 -0.84 0.00 0.00 61.79 60.29 2pnk h SER 124 Cb 1.30 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.62 2pnk h SER 124 CO 0.54 0.70 -0.27 -0.33 -1.14 0.00 0.00 176.83 176.34 2pnk h GLU 125 N 0.88 0.72 -0.28 3.45 3.07 -1.95 -1.27 114.58 119.21 2pnk h GLU 125 Ca 0.22 -0.31 -0.02 0.00 -0.50 0.00 0.00 59.36 58.76 2pnk h GLU 125 Cb 0.08 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.96 2pnk h GLU 125 CO -0.03 0.91 0.10 0.93 -1.40 0.00 0.00 179.01 179.52 2pnk h GLU 126 N 0.62 0.42 -0.22 2.33 5.08 -1.94 -2.57 114.58 118.31 2pnk h GLU 126 Ca 0.08 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.27 2pnk h GLU 126 Cb 0.78 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 2pnk h GLU 126 CO 0.06 0.46 -0.24 0.37 -1.00 0.00 0.00 179.01 178.67 2pnk h GLN 127 N 0.29 0.40 -0.34 2.33 5.75 -0.98 -1.50 115.11 121.07 2pnk h GLN 127 Ca 0.09 -0.14 -0.02 0.00 -0.15 0.00 0.00 58.65 58.43 2pnk h GLN 127 Cb 0.21 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.71 2pnk h GLN 127 CO -0.01 0.62 0.12 0.28 -2.65 0.00 0.00 178.83 177.19 2pnk h VAL 128 N 0.36 1.20 -0.49 2.39 2.07 -1.17 -0.29 116.25 120.32 2pnk h VAL 128 Ca 0.06 -0.63 0.05 0.00 0.82 0.00 0.00 66.70 67.00 2pnk h VAL 128 Cb 0.62 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 2pnk h VAL 128 CO 0.04 0.22 0.23 0.44 0.02 0.00 0.00 177.57 178.52 2pnk h ASP 129 N 0.41 0.30 -0.01 0.57 3.32 -1.08 -0.52 116.42 119.41 2pnk h ASP 129 Ca 0.11 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 2pnk h ASP 129 Cb 0.22 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 2pnk h ASP 129 CO -0.01 0.21 0.00 0.74 -1.72 0.00 0.00 179.24 178.47 2pnk h THR 130 N 0.45 1.18 -0.32 0.35 2.02 -1.06 -2.51 112.91 113.03 2pnk h THR 130 Ca 0.22 -0.54 -0.08 0.00 0.77 0.00 0.00 66.41 66.78 2pnk h THR 130 Cb 0.16 1.53 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 2pnk h THR 130 CO -0.18 0.14 -0.12 0.58 0.37 0.00 0.00 175.52 176.32 2pnk h VAL 131 N -0.21 1.29 -0.81 3.16 2.07 -0.91 -1.22 116.25 119.62 2pnk h VAL 131 Ca 0.00 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 2pnk h VAL 131 Cb 0.23 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 2pnk h VAL 131 CO 0.00 0.39 0.44 -0.07 0.02 0.00 0.00 177.57 178.35 2pnk h LEU 132 N 0.42 1.00 -0.12 2.57 3.38 -1.12 0.91 115.31 122.35 2pnk h LEU 132 Ca 0.08 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2pnk h LEU 132 Cb 0.63 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 2pnk h LEU 132 CO 0.04 0.80 0.01 -0.61 0.09 0.00 0.00 178.44 178.77 2pnk h GLN 133 N 1.13 0.21 -0.55 1.13 5.75 -1.28 -0.00 115.11 121.49 2pnk h GLN 133 Ca 0.28 -0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.67 2pnk h GLN 133 Cb 0.03 -0.02 -0.03 0.00 1.07 0.00 0.00 27.48 28.53 2pnk h GLN 133 CO -0.05 0.43 0.13 -0.07 -2.65 0.00 0.00 178.83 176.63 2pnk h LEU 134 N -0.05 0.79 -0.35 -2.39 3.38 -0.88 -2.41 115.31 113.41 2pnk h LEU 134 Ca 0.04 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2pnk h LEU 134 Cb 0.33 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2pnk h LEU 134 CO 0.00 0.77 -0.20 0.00 0.09 0.00 0.00 178.44 179.10 2pnk n ALA 135 N -2.46 2.95 -3.73 1.53 0.00 0.29 -4.95 120.51 114.13 2pnk n ALA 135 Ca 0.04 -0.34 -0.23 0.00 0.00 0.00 0.00 53.44 52.91 2pnk n ALA 135 Cb 0.23 -1.23 0.03 0.00 0.00 0.00 0.00 19.45 18.48 2pnk n ALA 135 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2pnk n ASN 136 N -0.84 -1.74 -4.32 0.00 5.15 -0.14 -4.81 115.26 108.56 2pnk n ASN 136 Ca 0.13 -0.88 -0.36 0.00 -0.60 0.00 0.00 54.58 52.87 2pnk n ASN 136 Cb 0.32 -3.83 -0.14 0.00 -0.53 0.00 0.00 39.78 35.60 2pnk n ASN 136 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2pnk s VAL 137 N -3.69 3.54 -0.04 3.44 1.01 -0.45 -0.52 120.40 123.70 2pnk s VAL 137 Ca 0.08 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.51 2pnk s VAL 137 Cb -0.02 -2.68 -0.26 0.00 0.00 0.00 0.00 36.38 33.41 2pnk s VAL 137 CO 0.83 0.32 0.69 0.77 0.00 0.00 0.00 175.10 177.71 2pnk h SER 138 N 8.14 0.28 -3.60 3.32 4.64 -1.35 -3.43 113.55 121.55 2pnk h SER 138 Ca -0.38 -0.49 -0.31 0.00 -0.47 0.00 0.00 61.79 60.14 2pnk h SER 138 Cb 1.15 -0.09 -0.32 0.00 -0.31 0.00 0.00 62.40 62.83 2pnk h SER 138 CO 0.60 1.42 -0.74 -1.81 -0.87 0.00 0.00 176.83 175.43 2pnk s ASP 139 N -6.75 0.27 -0.09 4.97 1.01 -1.10 -4.72 116.67 110.26 2pnk s ASP 139 Ca -0.11 -0.01 0.04 0.00 0.71 0.00 0.00 52.55 53.18 2pnk s ASP 139 Cb 0.07 -0.12 -0.00 0.00 1.01 0.00 0.00 42.92 43.88 2pnk s ASP 139 CO 0.82 -0.07 -0.23 -0.69 0.21 0.00 0.00 175.17 175.22 2pnk s VAL 140 N 0.67 1.94 0.54 -1.27 1.01 0.33 -0.86 120.40 122.76 2pnk s VAL 140 Ca -0.06 -0.96 0.08 0.00 0.00 0.00 0.00 61.98 61.04 2pnk s VAL 140 Cb -0.09 -1.68 0.07 0.00 0.00 0.00 0.00 36.38 34.68 2pnk s VAL 140 CO -0.01 0.53 0.75 -0.69 0.00 0.00 0.00 175.10 175.68 2pnk s VAL 141 N 0.29 2.38 -0.23 2.92 1.01 -0.46 -0.11 120.40 126.21 2pnk s VAL 141 Ca -0.16 -0.97 -0.04 0.00 0.00 0.00 0.00 61.98 60.82 2pnk s VAL 141 Cb -0.17 -2.41 0.08 0.00 0.00 0.00 0.00 36.38 33.88 2pnk s VAL 141 CO 0.07 0.00 0.10 -0.89 0.00 0.00 0.00 175.10 174.38 2pnk s THR 143 N -2.61 0.13 -0.30 3.92 2.01 -0.96 -1.50 115.64 116.33 2pnk s THR 143 Ca 0.60 -0.59 -0.08 0.00 0.31 0.00 0.00 61.69 61.94 2pnk s THR 143 Cb -0.07 -0.92 0.00 0.00 0.01 0.00 0.00 72.50 71.52 2pnk s THR 143 CO 0.38 -0.48 0.11 0.20 -0.69 0.00 0.00 174.62 174.14 2pnk s ASN 144 N 2.02 5.27 -0.44 3.53 -0.87 0.17 -4.93 114.94 119.69 2pnk s ASN 144 Ca 0.05 -0.63 -0.13 0.00 -1.57 0.00 0.00 52.86 50.58 2pnk s ASN 144 Cb -0.16 -1.92 0.07 0.00 -0.02 0.00 0.00 41.25 39.21 2pnk s ASN 144 CO -0.21 -0.19 0.33 -0.62 -2.57 0.00 0.00 177.10 173.84 2pnk s ASP 145 N 1.54 5.93 0.00 -1.22 -1.08 -1.26 -0.79 116.67 119.80 2pnk s ASP 145 Ca 0.03 -1.33 0.18 0.00 -0.52 0.00 0.00 52.55 50.91 2pnk s ASP 145 Cb -0.17 -2.10 1.09 0.00 -1.46 0.00 0.00 42.92 40.28 2pnk s ASP 145 CO 0.04 -0.57 1.49 -0.81 0.52 0.00 0.00 175.17 175.84 2pnk n PRO 146 N 5.08 0.61 0.00 4.34 -0.04 -1.26 -2.23 135.00 141.49 2pnk n PRO 146 Ca -0.11 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.46 2pnk n PRO 146 Cb 0.44 -1.47 0.02 0.00 -0.04 0.00 0.00 33.50 32.44 2pnk n PRO 146 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2pnk n PHE 147 N -0.97 0.00 -2.99 0.54 3.72 -1.26 -4.83 117.46 111.67 2pnk n PHE 147 Ca 0.14 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 57.12 2pnk n PHE 147 Cb 0.06 -0.03 -0.05 0.00 -0.94 0.00 0.00 39.48 38.52 2pnk n PHE 147 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2pnk s ASP 148 N -2.66 6.56 0.37 4.37 -1.08 -0.95 -4.95 116.67 118.34 2pnk s ASP 148 Ca 0.16 0.42 0.05 0.00 -0.52 0.00 0.00 52.55 52.65 2pnk s ASP 148 Cb 0.18 -2.38 0.74 0.00 -1.46 0.00 0.00 42.92 40.00 2pnk s ASP 148 CO 0.66 -0.65 2.01 0.44 0.52 0.00 0.00 175.17 178.15 2pnk h ASP 149 N 8.35 0.62 -0.00 -0.34 3.32 -1.89 0.25 116.42 126.73 2pnk h ASP 149 Ca -0.25 -0.01 -0.17 0.00 0.02 0.00 0.00 57.03 56.62 2pnk h ASP 149 Cb 1.10 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.50 2pnk h ASP 149 CO 0.88 0.44 -0.58 -1.13 -1.72 0.00 0.00 179.24 177.13 2pnk h ASN 150 N 0.73 0.68 0.81 6.45 -1.24 -1.95 -3.13 115.58 117.92 2pnk h ASN 150 Ca 0.23 -0.37 -0.22 0.00 0.71 0.00 0.00 56.30 56.64 2pnk h ASN 150 Cb 0.02 -0.19 -0.02 0.00 0.73 0.00 0.00 38.32 38.86 2pnk h ASN 150 CO -0.06 1.11 -1.04 -0.08 -1.29 0.00 0.00 177.43 176.07 2pnk h GLU 151 N 0.45 0.11 -0.77 6.67 4.81 -1.71 -3.31 114.58 120.83 2pnk h GLU 151 Ca 0.00 -0.17 0.13 0.00 -0.13 0.00 0.00 59.36 59.19 2pnk h GLU 151 Cb 1.15 0.06 -0.05 0.00 0.63 0.00 0.00 28.75 30.53 2pnk h GLU 151 CO 0.11 1.04 0.51 0.00 -0.73 0.00 0.00 179.01 179.94 2pnk h ARG 152 N 0.04 0.54 -0.31 1.92 3.08 -0.47 -3.08 114.38 116.10 2pnk h ARG 152 Ca -0.05 -0.03 0.07 0.00 0.07 0.00 0.00 59.98 60.04 2pnk h ARG 152 Cb 1.76 -0.12 -0.08 0.00 0.08 0.00 0.00 29.97 31.61 2pnk h ARG 152 CO 0.15 0.36 -0.30 0.82 -1.07 0.00 0.00 179.97 179.93 2pnk h ILE 153 N 0.56 0.28 -0.71 2.04 2.04 -1.64 -1.00 117.51 119.09 2pnk h ILE 153 Ca 0.37 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.24 2pnk h ILE 153 Cb 0.68 0.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 2pnk h ILE 153 CO -0.14 0.00 0.47 0.77 0.00 0.00 0.00 178.15 179.25 2pnk h SER 154 N -0.27 0.81 -0.27 1.72 4.64 -1.76 -0.14 113.55 118.28 2pnk h SER 154 Ca 0.15 -0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.34 2pnk h SER 154 Cb 0.52 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2pnk h SER 154 CO -0.47 0.59 -0.27 -0.50 -0.87 0.00 0.00 176.83 175.32 2pnk h TRP 155 N 0.96 0.79 -0.49 4.77 4.06 -1.60 0.29 115.95 124.73 2pnk h TRP 155 Ca 0.26 -0.24 -0.08 0.00 2.06 0.00 0.00 58.89 60.90 2pnk h TRP 155 Cb -0.11 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 27.86 2pnk h TRP 155 CO -0.02 0.96 -0.00 -0.07 -3.56 0.00 0.00 178.44 175.75 2pnk h LEU 156 N 0.38 0.78 0.00 -4.49 3.38 -0.91 -2.13 115.31 112.33 2pnk h LEU 156 Ca 0.04 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2pnk h LEU 156 Cb 0.83 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2pnk h LEU 156 CO 0.07 0.85 0.00 -0.62 0.09 0.00 0.00 178.44 178.82 2pnk n GLU 157 N -4.21 0.78 -1.04 1.13 1.02 -0.09 -4.88 120.64 113.34 2pnk n GLU 157 Ca 0.02 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.15 2pnk n GLU 157 Cb 0.30 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.22 2pnk n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2pnk n GLY 158 N 0.59 0.52 3.76 0.62 0.00 -0.80 -5.00 105.19 104.89 2pnk n GLY 158 Ca 0.19 -0.54 -0.41 0.00 0.00 0.00 0.00 46.02 45.25 2pnk n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pnk s LYS 159 N -1.37 4.18 -0.21 1.61 1.02 0.05 -4.99 119.74 120.04 2pnk s LYS 159 Ca 0.00 2.48 -0.08 0.00 0.02 0.00 0.00 55.97 58.39 2pnk s LYS 159 Cb 0.00 -3.02 -0.04 0.00 -0.52 0.00 0.00 37.83 34.25 2pnk s LYS 159 CO 0.00 -0.49 0.08 -1.14 -0.92 0.00 0.00 175.35 172.88 2pnk s GLN 160 N -1.34 3.92 0.39 1.68 2.00 -1.26 -4.66 119.66 120.38 2pnk s GLN 160 Ca 0.56 -0.36 -0.27 0.00 -2.00 0.00 0.00 55.36 53.29 2pnk s GLN 160 Cb -0.45 -3.29 -0.09 0.00 0.80 0.00 0.00 33.01 29.98 2pnk s GLN 160 CO 0.54 0.14 1.32 -1.25 -0.50 0.00 0.00 175.29 175.55 2pnk s PRO 161 N 0.75 4.04 0.07 1.67 0.04 -1.26 -4.95 135.00 135.36 2pnk s PRO 161 Ca 0.04 2.22 -0.32 0.00 0.04 0.00 0.00 61.00 62.98 2pnk s PRO 161 Cb -0.13 -2.83 -0.17 0.00 0.04 0.00 0.00 34.50 31.41 2pnk s PRO 161 CO 0.02 -0.45 0.77 -3.47 0.04 0.00 0.00 177.00 173.91 2pnk n ASP 162 N 0.28 -0.42 0.14 6.66 -0.08 -1.26 -4.80 116.55 117.06 2pnk n ASP 162 Ca 0.03 1.02 0.10 0.00 -1.51 0.00 0.00 54.79 54.43 2pnk n ASP 162 Cb 0.43 -0.83 0.52 0.00 2.34 0.00 0.00 41.12 43.58 2pnk n ASP 162 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2pnk n SER 163 N 1.50 0.55 0.10 1.67 3.41 -1.26 -0.33 113.62 119.25 2pnk n SER 163 Ca 0.17 0.71 0.13 0.00 -0.26 0.00 0.00 58.87 59.62 2pnk n SER 163 Cb 0.13 -0.80 0.44 0.00 -0.26 0.00 0.00 64.21 63.72 2pnk n SER 163 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2pnk n ARG 164 N -2.19 0.22 -4.06 4.33 1.74 -1.26 -4.65 116.66 110.79 2pnk n ARG 164 Ca -0.00 0.25 -0.35 0.00 -0.77 0.00 0.00 57.85 56.98 2pnk n ARG 164 Cb 0.09 -1.79 -0.13 0.00 -1.02 0.00 0.00 32.46 29.62 2pnk n ARG 164 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2pnk s PHE 165 N -3.14 2.99 0.10 -1.55 0.40 0.55 -0.52 117.98 116.81 2pnk s PHE 165 Ca 0.09 -0.65 0.07 0.00 -0.60 0.00 0.00 56.93 55.85 2pnk s PHE 165 Cb 0.12 -2.08 -0.04 0.00 0.51 0.00 0.00 43.02 41.53 2pnk s PHE 165 CO 0.53 -0.36 -0.11 -1.01 0.70 0.00 0.00 175.22 174.98 2pnk s HIS 166 N 1.15 2.72 0.20 0.36 3.76 0.85 -4.70 115.29 119.63 2pnk s HIS 166 Ca 0.02 -0.16 -0.13 0.00 -0.15 0.00 0.00 55.06 54.65 2pnk s HIS 166 Cb -0.15 -1.44 -0.07 0.00 1.11 0.00 0.00 32.58 32.03 2pnk s HIS 166 CO 0.00 0.41 0.57 0.00 -0.85 0.00 0.00 174.74 174.87 2pnk s ALA 167 N -1.18 3.55 -0.04 -1.40 0.00 -1.26 -4.32 121.76 117.10 2pnk s ALA 167 Ca 0.21 -0.17 -0.00 0.00 0.00 0.00 0.00 51.96 52.00 2pnk s ALA 167 Cb -0.11 -2.51 0.03 0.00 0.00 0.00 0.00 23.12 20.52 2pnk s ALA 167 CO 0.13 0.46 0.01 0.00 0.00 0.00 0.00 175.76 176.36 2pnk s ALA 168 N -1.65 0.33 -0.42 0.00 0.00 -1.26 -1.03 121.76 117.72 2pnk s ALA 168 Ca 0.43 0.15 -0.28 0.00 0.00 0.00 0.00 51.96 52.26 2pnk s ALA 168 Cb -0.13 -0.41 0.02 0.00 0.00 0.00 0.00 23.12 22.60 2pnk s ALA 168 CO 0.20 -0.19 1.04 -1.17 0.00 0.00 0.00 175.76 175.64 2pnk s LEU 169 N 1.32 3.83 -0.05 0.00 2.96 -0.60 -0.65 118.68 125.49 2pnk s LEU 169 Ca -0.06 0.53 -0.25 0.00 -0.22 0.00 0.00 54.13 54.14 2pnk s LEU 169 Cb -0.13 -3.42 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 2pnk s LEU 169 CO -0.02 -1.07 0.76 -0.60 -1.32 0.00 0.00 176.35 174.09 2pnk s ARG 170 N 3.98 4.46 -0.01 1.98 3.52 0.03 -0.85 118.95 132.07 2pnk s ARG 170 Ca 0.43 0.99 0.02 0.00 -0.13 0.00 0.00 55.73 57.04 2pnk s ARG 170 Cb -0.10 -3.45 0.05 0.00 -1.56 0.00 0.00 34.95 29.89 2pnk s ARG 170 CO 0.25 0.05 1.03 1.28 -0.81 0.00 0.00 175.30 177.10 2pnk n LEU 171 N 3.79 2.12 -0.13 -0.88 4.77 0.13 -4.47 117.00 122.32 2pnk n LEU 171 Ca 0.00 -2.06 -0.04 0.00 -0.03 0.00 0.00 56.01 53.88 2pnk n LEU 171 Cb 0.51 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 41.58 2pnk n LEU 171 CO 0.48 0.53 0.78 0.44 -1.33 0.00 0.00 177.39 178.30 2pnk h ASP 172 N 0.21 -0.39 0.19 -1.43 5.19 -1.94 -0.79 116.42 117.46 2pnk h ASP 172 Ca 0.00 0.13 -0.05 0.00 -0.62 0.00 0.00 57.03 56.49 2pnk h ASP 172 Cb 0.55 0.26 -0.01 0.00 0.18 0.00 0.00 39.33 40.32 2pnk h ASP 172 CO 0.00 -0.14 -0.21 -0.65 -3.12 0.00 0.00 179.24 175.13 2pnk h PRO 173 N 0.00 0.04 -0.03 3.56 0.11 -1.95 0.36 132.00 134.10 2pnk h PRO 173 Ca 0.21 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.28 2pnk h PRO 173 Cb 0.31 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.42 2pnk h PRO 173 CO -0.44 0.25 -0.07 1.25 -0.21 0.00 0.00 178.00 178.78 2pnk h LEU 174 N 0.04 0.11 0.16 2.35 5.85 -1.71 -2.85 115.31 119.26 2pnk h LEU 174 Ca 0.01 -0.60 -0.30 0.00 0.84 0.00 0.00 57.88 57.83 2pnk h LEU 174 Cb 0.39 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 41.40 2pnk h LEU 174 CO 0.03 0.69 -1.38 -0.07 -0.34 0.00 0.00 178.44 177.37 2pnk h LEU 175 N -0.46 0.53 0.00 2.25 3.38 -0.84 -3.25 115.31 116.91 2pnk h LEU 175 Ca -0.00 -0.60 -0.01 0.00 0.09 0.00 0.00 57.88 57.36 2pnk h LEU 175 Cb 0.68 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 2pnk h LEU 175 CO 0.02 1.48 -1.81 0.59 0.09 0.00 0.00 178.44 178.80 2pnk n ASN 176 N -3.56 0.17 -2.42 -0.43 3.02 0.12 -3.66 115.26 108.49 2pnk n ASN 176 Ca -0.13 0.07 -0.08 0.00 -0.03 0.00 0.00 54.58 54.41 2pnk n ASN 176 Cb 1.05 1.67 0.04 0.00 -0.61 0.00 0.00 39.78 41.94 2pnk n ASN 176 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2pnk n GLU 177 N -2.35 2.29 -0.36 3.52 1.02 -1.08 -4.92 120.64 118.76 2pnk n GLU 177 Ca -0.04 -3.66 0.03 0.00 -0.02 0.00 0.00 57.16 53.47 2pnk n GLU 177 Cb 0.58 -1.76 0.18 0.00 -0.02 0.00 0.00 31.44 30.41 2pnk n GLU 177 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2pnk h TYR 178 N 2.33 1.15 -0.67 -0.32 3.20 -1.59 0.61 116.97 121.69 2pnk h TYR 178 Ca 0.04 0.03 0.04 0.00 3.14 0.00 0.00 58.73 61.98 2pnk h TYR 178 Cb 1.39 -0.37 -0.04 0.00 1.54 0.00 0.00 36.73 39.25 2pnk h TYR 178 CO 0.61 0.57 0.44 1.49 -1.64 0.00 0.00 178.16 179.63 2pnk h GLU 179 N 1.10 0.75 0.06 1.82 4.57 -1.90 0.40 114.58 121.39 2pnk h GLU 179 Ca 0.43 -0.04 -0.16 0.00 -1.18 0.00 0.00 59.36 58.41 2pnk h GLU 179 Cb 0.21 -0.17 0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2pnk h GLU 179 CO -0.19 0.49 -0.65 1.96 -1.18 0.00 0.00 179.01 179.45 2pnk h GLN 180 N 0.77 0.33 0.00 1.92 7.50 -1.62 -3.37 115.11 120.64 2pnk h GLN 180 Ca 0.27 -0.44 -0.06 0.00 0.50 0.00 0.00 58.65 58.92 2pnk h GLN 180 Cb 0.11 0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.78 2pnk h GLN 180 CO -0.08 1.15 -0.28 1.15 -1.50 0.00 0.00 178.83 179.27 2pnk h THR 181 N -0.28 0.73 -0.93 -0.54 2.02 -0.09 -3.05 112.91 110.77 2pnk h THR 181 Ca -0.10 -1.23 0.19 0.00 0.77 0.00 0.00 66.41 66.04 2pnk h THR 181 Cb 1.42 1.78 -0.18 0.00 -1.74 0.00 0.00 68.15 69.44 2pnk h THR 181 CO 0.12 0.28 -0.22 0.29 0.37 0.00 0.00 175.52 176.36 2pnk n LYS 182 N -3.51 -0.08 0.10 6.66 5.02 0.13 -1.73 118.16 124.74 2pnk n LYS 182 Ca -0.00 1.46 -0.05 0.00 -2.02 0.00 0.00 58.31 57.70 2pnk n LYS 182 Cb 0.44 -2.18 0.11 0.00 -0.02 0.00 0.00 35.03 33.38 2pnk n LYS 182 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2pnk h HIS 183 N 0.00 0.23 -0.15 2.13 3.86 -1.78 -0.88 115.15 118.55 2pnk h HIS 183 Ca 0.45 -0.09 -0.03 0.00 -1.16 0.00 0.00 60.37 59.54 2pnk h HIS 183 Cb 0.71 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.13 2pnk h HIS 183 CO -0.71 0.77 -0.02 0.00 0.86 0.00 0.00 177.93 178.83 2pnk h ARG 184 N 0.12 0.29 -0.46 2.45 3.08 -1.52 -2.22 114.38 116.12 2pnk h ARG 184 Ca -0.01 -0.10 0.09 0.00 0.07 0.00 0.00 59.98 60.02 2pnk h ARG 184 Cb 1.16 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 31.12 2pnk h ARG 184 CO 0.10 0.55 0.02 -0.07 -1.07 0.00 0.00 179.97 179.50 2pnk h LEU 185 N -0.00 -0.15 -0.60 3.04 3.38 -1.02 -0.64 115.31 119.33 2pnk h LEU 185 Ca 0.04 0.10 0.05 0.00 0.09 0.00 0.00 57.88 58.16 2pnk h LEU 185 Cb 0.44 0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 2pnk h LEU 185 CO 0.01 -0.04 0.33 0.03 0.09 0.00 0.00 178.44 178.86 2pnk h ARG 186 N 0.14 0.61 0.00 1.13 3.08 -0.98 0.78 114.38 119.13 2pnk h ARG 186 Ca 0.23 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.25 2pnk h ARG 186 Cb 0.33 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2pnk h ARG 186 CO -0.37 0.40 0.00 -0.40 -1.07 0.00 0.00 179.97 178.54 2pnk n ASP 187 N -4.81 0.50 -0.37 7.04 5.75 -0.69 -1.30 116.55 122.67 2pnk n ASP 187 Ca 0.06 0.57 0.14 0.00 -0.01 0.00 0.00 54.79 55.56 2pnk n ASP 187 Cb 0.14 -0.70 0.60 0.00 -1.03 0.00 0.00 41.12 40.13 2pnk n ASP 187 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 2pnk n TRP 188 N -2.00 0.00 0.00 2.11 8.01 -0.33 -4.94 117.44 120.28 2pnk n TRP 188 Ca 0.05 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.24 2pnk n TRP 188 Cb 0.33 -0.01 0.00 0.00 -2.01 0.00 0.00 31.31 29.61 2pnk n TRP 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2pnk n GLY 189 N 1.16 0.87 3.51 6.99 0.00 -0.42 -5.07 105.19 112.24 2pnk n GLY 189 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2pnk n GLY 189 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pnk s TYR 190 N -2.00 3.18 -1.39 1.61 2.02 0.20 -4.97 117.35 116.00 2pnk s TYR 190 Ca 0.00 -0.19 -0.09 0.00 -0.37 0.00 0.00 57.07 56.43 2pnk s TYR 190 Cb 0.00 -2.84 0.08 0.00 -0.40 0.00 0.00 41.96 38.80 2pnk s TYR 190 CO 0.00 -0.60 2.33 1.63 -1.57 0.00 0.00 175.55 177.34 2pnk n LYS 191 N 5.58 3.93 -2.48 -0.62 4.76 -1.26 -2.78 118.16 125.28 2pnk n LYS 191 Ca -0.07 -3.13 -0.38 0.00 -2.87 0.00 0.00 58.31 51.85 2pnk n LYS 191 Cb 0.48 -2.83 -0.04 0.00 -1.84 0.00 0.00 35.03 30.80 2pnk n LYS 191 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2pnk s VAL 192 N 0.47 3.54 0.53 -0.18 -7.23 -1.26 -4.55 120.40 111.73 2pnk s VAL 192 Ca 0.52 1.35 0.03 0.00 -1.81 0.00 0.00 61.98 62.07 2pnk s VAL 192 Cb 0.15 -3.78 0.04 0.00 0.56 0.00 0.00 36.38 33.35 2pnk s VAL 192 CO -0.06 0.17 0.74 0.20 -0.31 0.00 0.00 175.10 175.84 2pnk s ASN 193 N -1.22 5.28 0.22 4.85 0.01 -1.26 -4.97 114.94 117.85 2pnk s ASN 193 Ca 0.52 -0.20 -0.02 0.00 -0.71 0.00 0.00 52.86 52.45 2pnk s ASN 193 Cb -0.27 -0.66 0.22 0.00 0.41 0.00 0.00 41.25 40.94 2pnk s ASN 193 CO 0.35 -1.12 1.60 0.44 -1.51 0.00 0.00 177.10 176.85 2pnk h ASP 194 N 0.17 0.62 -3.82 -1.22 3.32 -2.03 -3.44 116.42 110.02 2pnk h ASP 194 Ca -0.40 -0.26 -0.48 0.00 0.02 0.00 0.00 57.03 55.90 2pnk h ASP 194 Cb 1.29 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.64 2pnk h ASP 194 CO 0.48 0.93 0.18 -1.61 -1.72 0.00 0.00 179.24 177.51 2pnk s GLU 195 N -4.29 4.12 -1.11 3.56 0.41 -1.26 -4.99 118.70 115.13 2pnk s GLU 195 Ca -0.08 0.85 -0.18 0.00 -0.41 0.00 0.00 54.97 55.16 2pnk s GLU 195 Cb 0.12 -2.41 0.12 0.00 -1.78 0.00 0.00 34.13 30.18 2pnk s GLU 195 CO 0.82 0.13 1.40 -0.46 -0.49 0.00 0.00 175.26 176.67 2pnk s TRP 196 N -1.98 3.08 0.32 1.61 -0.11 -1.26 -4.69 118.94 115.90 2pnk s TRP 196 Ca 0.55 -1.59 0.00 0.00 1.22 0.00 0.00 56.10 56.28 2pnk s TRP 196 Cb -0.11 -4.46 0.00 0.00 -1.50 0.00 0.00 33.47 27.41 2pnk s TRP 196 CO 0.17 -1.60 0.01 0.27 -4.62 0.00 0.00 176.95 171.18 2pnk n ASN 197 N 7.01 2.83 -0.20 5.86 0.23 -1.26 -4.97 115.26 124.75 2pnk n ASN 197 Ca 0.35 -2.37 0.02 0.00 -0.53 0.00 0.00 54.58 52.05 2pnk n ASN 197 Cb 0.47 0.21 0.28 0.00 -2.08 0.00 0.00 39.78 38.65 2pnk n ASN 197 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 2pnk h GLU 198 N 0.00 0.91 -0.65 -3.83 -0.00 -1.99 -1.11 114.58 107.91 2pnk h GLU 198 Ca -0.26 -0.05 0.02 0.00 -0.00 0.00 0.00 59.36 59.07 2pnk h GLU 198 Cb 0.79 -0.20 -0.04 0.00 -0.00 0.00 0.00 28.75 29.30 2pnk h GLU 198 CO 0.43 0.60 0.41 0.78 -0.00 0.00 0.00 179.01 181.23 2pnk h GLY 199 N 0.94 0.93 0.89 1.06 0.00 -1.95 -0.07 103.07 104.87 2pnk h GLY 199 Ca 0.28 -0.32 -0.08 0.00 0.00 0.00 0.00 47.33 47.21 2pnk h GLY 199 CO -0.07 0.29 -0.15 1.76 0.00 0.00 0.00 176.54 178.36 2pnk h SER 200 N 0.82 0.61 -0.27 0.19 0.02 -1.60 -1.77 113.55 111.55 2pnk h SER 200 Ca 0.25 -0.42 0.04 0.00 -0.84 0.00 0.00 61.79 60.83 2pnk h SER 200 Cb -0.02 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.30 2pnk h SER 200 CO -0.08 0.90 0.01 0.40 -1.14 0.00 0.00 176.83 176.91 2pnk h ILE 201 N 0.32 0.82 -0.39 3.27 2.04 -1.06 -1.07 117.51 121.44 2pnk h ILE 201 Ca 0.06 -0.03 -0.11 0.00 1.00 0.00 0.00 64.86 65.77 2pnk h ILE 201 Cb 0.68 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 2pnk h ILE 201 CO 0.04 0.02 -0.22 1.56 0.00 0.00 0.00 178.15 179.55 2pnk h GLN 202 N 0.10 0.76 -0.27 2.37 1.08 -0.97 -0.87 115.11 117.31 2pnk h GLN 202 Ca 0.13 -0.31 -0.15 0.00 -1.45 0.00 0.00 58.65 56.87 2pnk h GLN 202 Cb 0.16 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.55 2pnk h GLN 202 CO -0.21 0.92 -0.45 0.93 -0.95 0.00 0.00 178.83 179.07 2pnk h GLU 203 N 0.67 0.69 -0.52 1.46 4.39 -1.11 -0.95 114.58 119.21 2pnk h GLU 203 Ca 0.09 -0.38 -0.12 0.00 0.34 0.00 0.00 59.36 59.29 2pnk h GLU 203 Cb 0.73 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.38 2pnk h GLU 203 CO 0.06 1.00 -0.15 0.28 -1.16 0.00 0.00 179.01 179.03 2pnk h VAL 204 N 0.55 1.27 -0.82 3.13 2.07 -1.06 -2.10 116.25 119.29 2pnk h VAL 204 Ca 0.03 -1.32 0.02 0.00 0.82 0.00 0.00 66.70 66.25 2pnk h VAL 204 Cb 1.00 1.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.75 2pnk h VAL 204 CO 0.09 0.46 0.54 0.11 0.02 0.00 0.00 177.57 178.80 2pnk h LYS 205 N 0.90 1.04 -0.30 1.57 1.57 -1.01 -2.11 116.57 118.23 2pnk h LYS 205 Ca 0.13 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.70 2pnk h LYS 205 Cb 0.73 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 2pnk h LYS 205 CO 0.06 0.69 -0.41 -0.09 -0.57 0.00 0.00 179.45 179.12 2pnk h ARG 206 N 1.07 0.74 -0.01 3.15 2.43 -1.02 -0.55 114.38 120.19 2pnk h ARG 206 Ca 0.31 -0.39 0.02 0.00 -0.81 0.00 0.00 59.98 59.11 2pnk h ARG 206 Cb -0.06 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2pnk h ARG 206 CO -0.08 1.01 -0.08 0.35 -1.51 0.00 0.00 179.97 179.66 2pnk h PHE 207 N 0.60 -0.20 -0.34 2.20 3.57 -1.16 0.37 116.94 121.98 2pnk h PHE 207 Ca 0.05 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.61 2pnk h PHE 207 Cb 0.96 0.09 -0.05 0.00 2.79 0.00 0.00 35.95 39.74 2pnk h PHE 207 CO 0.05 -0.12 0.06 -0.07 -2.23 0.00 0.00 178.31 175.99 2pnk h LEU 208 N -0.14 -0.01 -0.66 0.59 3.38 -1.22 -2.09 115.31 115.17 2pnk h LEU 208 Ca 0.03 0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.00 2pnk h LEU 208 Cb 0.18 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 2pnk h LEU 208 CO -0.09 0.03 0.18 0.74 0.09 0.00 0.00 178.44 179.39 2pnk h THR 209 N 0.17 1.26 -0.20 0.22 2.02 -0.90 0.47 112.91 115.96 2pnk h THR 209 Ca 0.16 -0.91 -0.09 0.00 0.77 0.00 0.00 66.41 66.34 2pnk h THR 209 Cb 0.19 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 2pnk h THR 209 CO -0.22 0.35 -0.26 0.44 0.37 0.00 0.00 175.52 176.20 2pnk h ASP 210 N 0.97 0.36 0.88 4.18 3.32 -0.72 -0.81 116.42 124.61 2pnk h ASP 210 Ca 0.21 -0.12 -0.23 0.00 0.02 0.00 0.00 57.03 56.91 2pnk h ASP 210 Cb 0.34 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 2pnk h ASP 210 CO -0.00 0.62 -1.11 -0.50 -1.72 0.00 0.00 179.24 176.54 2pnk h TRP 211 N 0.33 0.11 -0.35 4.55 4.06 -1.05 -2.09 115.95 121.50 2pnk h TRP 211 Ca 0.05 -0.08 0.02 0.00 2.06 0.00 0.00 58.89 60.94 2pnk h TRP 211 Cb 0.63 -0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.76 2pnk h TRP 211 CO 0.02 1.07 0.18 0.82 -3.56 0.00 0.00 178.44 176.97 2pnk h ILE 212 N 0.02 1.00 -0.64 1.49 2.04 -0.61 -2.90 117.51 117.90 2pnk h ILE 212 Ca -0.06 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 2pnk h ILE 212 Cb 1.83 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.47 2pnk h ILE 212 CO 0.14 0.07 0.30 -0.08 0.00 0.00 0.00 178.15 178.58 2pnk h GLU 213 N 0.38 0.93 0.00 2.37 4.81 -1.17 0.93 114.58 122.83 2pnk h GLU 213 Ca 0.15 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2pnk h GLU 213 Cb 0.04 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.26 2pnk h GLU 213 CO -0.09 0.75 0.00 -2.13 -0.73 0.00 0.00 179.01 176.81 2pnk n ARG 214 N -4.47 0.47 0.00 1.92 0.63 -0.79 -5.03 116.66 109.38 2pnk n ARG 214 Ca 0.05 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.98 2pnk n ARG 214 Cb 0.13 -1.38 0.00 0.00 0.45 0.00 0.00 32.46 31.66 2pnk n ARG 214 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2pnk n ASP 216 N -0.88 0.00 -4.78 6.15 2.03 0.32 -5.09 116.55 114.30 2pnk n ASP 216 Ca 0.09 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 55.04 2pnk n ASP 216 Cb 0.04 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.43 2pnk n ASP 216 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2pnk s PRO 217 N 0.00 3.53 0.22 -0.67 0.04 -1.26 -4.57 135.00 132.29 2pnk s PRO 217 Ca 0.00 1.58 0.16 0.00 0.04 0.00 0.00 61.00 62.78 2pnk s PRO 217 Cb 0.00 -2.10 0.01 0.00 0.04 0.00 0.00 34.50 32.46 2pnk s PRO 217 CO 0.00 -0.70 1.28 -0.39 0.04 0.00 0.00 177.00 177.23 2pnk h VAL 218 N 1.40 0.74 0.00 -0.36 -1.51 -1.46 -3.49 116.25 111.58 2pnk h VAL 218 Ca -0.50 -2.12 0.00 0.00 -1.23 0.00 0.00 66.70 62.85 2pnk h VAL 218 Cb 1.25 2.30 0.00 0.00 -2.13 0.00 0.00 31.29 32.71 2pnk h VAL 218 CO 0.58 0.42 0.00 0.00 -1.23 0.00 0.00 177.57 177.34 2pnk n TYR 219 N -3.12 0.00 0.00 5.19 0.18 -1.26 -4.33 117.16 113.81 2pnk n TYR 219 Ca -0.01 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.77 2pnk n TYR 219 Cb 0.75 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.71 2pnk n TYR 219 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2pnk n ALA 221 N -3.00 0.00 -2.99 -3.48 0.00 -0.03 -1.56 120.51 109.45 2pnk n ALA 221 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.32 2pnk n ALA 221 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 2pnk n ALA 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2pnk s VAL 222 N -1.65 -0.00 -0.07 0.00 0.11 -0.46 -0.70 120.40 117.62 2pnk s VAL 222 Ca 0.00 0.01 -0.15 0.00 -2.93 0.00 0.00 61.98 58.91 2pnk s VAL 222 Cb 0.00 -0.13 -0.05 0.00 -1.53 0.00 0.00 36.38 34.67 2pnk s VAL 222 CO 0.00 0.00 0.38 -0.44 -3.33 0.00 0.00 175.10 171.71 2pnk s SER 223 N 0.09 6.66 0.11 3.54 0.01 -1.26 -4.73 113.70 118.12 2pnk s SER 223 Ca -0.00 0.79 0.07 0.00 1.31 0.00 0.00 55.95 58.12 2pnk s SER 223 Cb -0.01 -2.23 -0.04 0.00 0.21 0.00 0.00 66.02 63.95 2pnk s SER 223 CO -0.00 0.20 -0.18 -0.76 0.41 0.00 0.00 173.24 172.91 2pnk s LEU 224 N -0.29 2.34 0.75 2.44 1.43 -1.26 -4.96 118.68 119.12 2pnk s LEU 224 Ca 0.22 -0.73 -0.12 0.00 -1.03 0.00 0.00 54.13 52.48 2pnk s LEU 224 Cb -0.15 -0.75 0.04 0.00 0.03 0.00 0.00 46.19 45.36 2pnk s LEU 224 CO 0.10 -0.02 1.11 -2.16 0.23 0.00 0.00 176.35 175.61 2pnk s PRO 225 N -2.18 2.46 0.55 1.29 0.04 -1.25 -0.88 135.00 135.03 2pnk s PRO 225 Ca 0.07 0.44 0.25 0.00 0.04 0.00 0.00 61.00 61.81 2pnk s PRO 225 Cb -0.08 -1.98 1.44 0.00 0.04 0.00 0.00 34.50 33.92 2pnk s PRO 225 CO 0.04 -1.31 2.03 -1.35 0.04 0.00 0.00 177.00 176.45 2pnk h PRO 226 N -0.86 0.00 -0.03 0.56 0.11 -1.76 -0.10 132.00 129.93 2pnk h PRO 226 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2pnk h PRO 226 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2pnk h PRO 226 CO 0.63 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.67 2pnk n THR 227 N -4.22 0.03 -1.66 -1.15 -2.24 -1.26 -3.72 114.28 100.06 2pnk n THR 227 Ca 0.07 -0.06 -0.47 0.00 -2.27 0.00 0.00 64.05 61.32 2pnk n THR 227 Cb 0.50 -0.18 -0.04 0.00 -2.10 0.00 0.00 70.33 68.51 2pnk n THR 227 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2pnk n PHE 228 N -0.60 2.21 -4.09 4.78 7.35 -0.05 -4.99 117.46 122.06 2pnk n PHE 228 Ca 0.14 0.29 -0.13 0.00 -0.76 0.00 0.00 57.45 56.99 2pnk n PHE 228 Cb 0.10 -2.53 -0.11 0.00 0.35 0.00 0.00 39.48 37.29 2pnk n PHE 228 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2pnk s SER 229 N 1.04 1.00 -0.26 -2.13 0.01 -1.26 -4.69 113.70 107.41 2pnk s SER 229 Ca 0.80 -0.63 -0.18 0.00 1.31 0.00 0.00 55.95 57.25 2pnk s SER 229 Cb -0.71 0.04 0.07 0.00 0.21 0.00 0.00 66.02 65.63 2pnk s SER 229 CO 0.39 -0.23 0.66 0.12 0.41 0.00 0.00 173.24 174.59 2pnk s PHE 230 N -1.74 -0.91 0.88 2.43 2.19 -1.26 -4.44 117.98 115.12 2pnk s PHE 230 Ca -0.05 1.94 -0.10 0.00 0.33 0.00 0.00 56.93 59.05 2pnk s PHE 230 Cb -0.07 0.47 0.12 0.00 -1.31 0.00 0.00 43.02 42.23 2pnk s PHE 230 CO -0.00 -0.45 1.12 -2.14 1.83 0.00 0.00 175.22 175.57 2pnk s PRO 231 N 1.17 1.34 -0.23 10.12 0.02 -1.26 -4.25 135.00 141.91 2pnk s PRO 231 Ca -0.06 1.33 -0.18 0.00 0.02 0.00 0.00 61.00 62.11 2pnk s PRO 231 Cb -0.05 -1.78 0.06 0.00 0.02 0.00 0.00 34.50 32.75 2pnk s PRO 231 CO -0.12 -2.34 0.59 -2.00 -0.33 0.00 0.00 177.00 172.80 2pnk s GLU 232 N -4.74 0.66 -1.24 5.54 2.12 -1.26 -5.07 118.70 114.70 2pnk s GLU 232 Ca 0.65 0.92 -0.14 0.00 0.36 0.00 0.00 54.97 56.76 2pnk s GLU 232 Cb -0.21 0.24 0.15 0.00 0.26 0.00 0.00 34.13 34.58 2pnk s GLU 232 CO 0.58 -0.11 1.57 0.39 -0.54 0.00 0.00 175.26 177.15 2pnk n GLU 233 N 3.33 3.36 -4.19 4.30 -0.58 -1.26 -3.98 120.64 121.62 2pnk n GLU 233 Ca -0.17 -3.68 -0.13 0.00 -0.42 0.00 0.00 57.16 52.77 2pnk n GLU 233 Cb 0.56 -3.11 -0.09 0.00 -0.57 0.00 0.00 31.44 28.24 2pnk n GLU 233 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2pnk s SER 234 N 2.80 0.47 0.21 1.62 1.04 -1.26 -5.00 113.70 113.58 2pnk s SER 234 Ca 0.44 -1.42 -0.10 0.00 0.48 0.00 0.00 55.95 55.35 2pnk s SER 234 Cb 0.01 0.46 0.17 0.00 0.10 0.00 0.00 66.02 66.75 2pnk s SER 234 CO 0.01 -0.95 1.87 0.78 0.98 0.00 0.00 173.24 175.93 2pnk h ASN 235 N 2.45 0.80 0.01 7.02 2.35 -1.90 -1.29 115.58 125.02 2pnk h ASN 235 Ca -0.32 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.42 2pnk h ASN 235 Cb 1.25 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.43 2pnk h ASN 235 CO 0.47 0.57 -0.01 -0.09 -1.65 0.00 0.00 177.43 176.72 2pnk h ARG 236 N 0.94 -0.01 -0.47 0.81 2.43 -1.91 -0.59 114.38 115.57 2pnk h ARG 236 Ca 0.28 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.42 2pnk h ARG 236 Cb -0.05 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2pnk h ARG 236 CO -0.08 0.12 0.19 0.78 -1.51 0.00 0.00 179.97 179.47 2pnk h GLY 237 N -0.15 0.72 1.14 2.80 0.00 -1.68 -1.85 103.07 104.06 2pnk h GLY 237 Ca -0.00 -0.35 -0.23 0.00 0.00 0.00 0.00 47.33 46.75 2pnk h GLY 237 CO 0.00 0.33 -0.83 3.21 0.00 0.00 0.00 176.54 179.25 2pnk h ARG 238 N 0.67 0.73 -0.56 4.80 3.08 -1.04 -2.39 114.38 119.66 2pnk h ARG 238 Ca 0.16 -0.66 -0.05 0.00 0.07 0.00 0.00 59.98 59.50 2pnk h ARG 238 Cb 0.13 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 2pnk h ARG 238 CO -0.02 1.26 0.14 0.82 -1.07 0.00 0.00 179.97 181.11 2pnk h ILE 239 N 0.43 1.25 -0.11 2.04 2.04 -0.92 0.01 117.51 122.25 2pnk h ILE 239 Ca -0.08 -0.88 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 2pnk h ILE 239 Cb 1.48 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2pnk h ILE 239 CO 0.17 0.32 0.06 0.40 0.00 0.00 0.00 178.15 179.10 2pnk h ILE 240 N 0.80 1.09 -0.06 -0.67 2.04 -1.39 0.76 117.51 120.08 2pnk h ILE 240 Ca 0.18 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 2pnk h ILE 240 Cb 0.34 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 2pnk h ILE 240 CO 0.00 0.08 -0.03 -0.09 0.00 0.00 0.00 178.15 178.11 2pnk h ARG 241 N 0.07 0.13 0.00 2.37 2.43 -1.26 -0.54 114.38 117.59 2pnk h ARG 241 Ca 0.04 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.05 2pnk h ARG 241 Cb 0.08 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 2pnk h ARG 241 CO -0.01 0.52 -1.33 -0.25 -1.51 0.00 0.00 179.97 177.40 2pnk n ASP 242 N -4.78 0.77 0.03 -3.80 8.00 -0.02 -4.46 116.55 112.29 2pnk n ASP 242 Ca -0.07 0.32 -0.01 0.00 0.71 0.00 0.00 54.79 55.74 2pnk n ASP 242 Cb 0.26 0.42 -0.00 0.00 -0.02 0.00 0.00 41.12 41.77 2pnk n ASP 242 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pnk h LEU 244 N -0.08 -0.40 -0.14 0.00 6.46 -0.93 -2.70 115.31 117.51 2pnk h LEU 244 Ca -0.01 -0.15 0.01 0.00 -0.12 0.00 0.00 57.88 57.61 2pnk h LEU 244 Cb 0.23 0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.25 2pnk h LEU 244 CO -0.01 -0.04 0.08 -0.07 -0.62 0.00 0.00 178.44 177.78 2pnk h LEU 245 N -0.82 0.12 -0.87 2.25 3.38 -1.33 0.54 115.31 118.58 2pnk h LEU 245 Ca -0.05 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.95 2pnk h LEU 245 Cb 0.53 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 2pnk h LEU 245 CO 0.08 0.09 0.57 -0.65 0.09 0.00 0.00 178.44 178.62 2pnk h PRO 246 N 0.16 1.09 -0.50 1.13 0.11 -1.78 -0.12 132.00 132.09 2pnk h PRO 246 Ca 0.05 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 66.01 2pnk h PRO 246 Cb -0.00 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 30.85 2pnk h PRO 246 CO -0.03 0.72 -0.05 0.28 -0.21 0.00 0.00 178.00 178.71 2pnk h VAL 247 N 1.12 1.27 -0.65 3.15 2.07 -1.32 -1.53 116.25 120.37 2pnk h VAL 247 Ca 0.34 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 2pnk h VAL 247 Cb -0.04 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2pnk h VAL 247 CO -0.10 0.41 0.38 0.00 0.02 0.00 0.00 177.57 178.28 2pnk h ALA 248 N 0.92 0.82 -0.13 1.67 0.00 -0.59 -2.14 119.26 119.81 2pnk h ALA 248 Ca 0.14 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2pnk h ALA 248 Cb 0.59 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2pnk h ALA 248 CO 0.04 0.31 0.04 1.49 0.00 0.00 0.00 179.25 181.13 2pnk h GLU 249 N 0.88 0.20 -0.82 0.00 4.81 -0.95 0.12 114.58 118.82 2pnk h GLU 249 Ca 0.23 -0.04 0.10 0.00 -0.13 0.00 0.00 59.36 59.51 2pnk h GLU 249 Cb -0.01 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.27 2pnk h GLU 249 CO -0.04 0.33 0.46 -0.22 -0.73 0.00 0.00 179.01 178.81 2pnk h LYS 250 N 0.03 0.75 -0.02 1.92 3.64 -1.02 -1.96 116.57 119.92 2pnk h LYS 250 Ca 0.04 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2pnk h LYS 250 Cb 0.21 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2pnk h LYS 250 CO -0.00 0.50 -0.08 0.72 -2.27 0.00 0.00 179.45 178.31 2pnk n HIS 251 N -4.75 0.00 -3.74 1.91 8.25 -0.83 -4.96 115.22 111.10 2pnk n HIS 251 Ca 0.13 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.37 2pnk n HIS 251 Cb 0.28 -0.02 0.03 0.00 1.12 0.00 0.00 29.99 31.40 2pnk n HIS 251 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2pnk n ASN 252 N 0.35 -1.64 -4.47 0.41 5.15 -0.12 -4.99 115.26 109.95 2pnk n ASN 252 Ca 0.16 -0.82 -0.34 0.00 -0.60 0.00 0.00 54.58 52.98 2pnk n ASN 252 Cb 0.43 -4.00 -0.12 0.00 -0.53 0.00 0.00 39.78 35.55 2pnk n ASN 252 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2pnk s ILE 253 N -3.63 3.92 0.78 -1.44 1.01 -0.33 -4.86 121.20 116.65 2pnk s ILE 253 Ca 0.09 -0.34 -0.12 0.00 0.00 0.00 0.00 60.65 60.29 2pnk s ILE 253 Cb -0.05 -2.75 0.07 0.00 0.01 0.00 0.00 42.46 39.74 2pnk s ILE 253 CO 0.82 0.46 1.12 -2.84 0.00 0.00 0.00 174.94 174.50 2pnk s PRO 254 N 0.69 2.02 -0.29 2.79 0.02 -1.26 -4.58 135.00 134.38 2pnk s PRO 254 Ca -0.01 1.37 -0.05 0.00 0.02 0.00 0.00 61.00 62.33 2pnk s PRO 254 Cb -0.14 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.54 2pnk s PRO 254 CO 0.02 -1.85 0.04 0.12 -0.33 0.00 0.00 177.00 175.00 2pnk s PHE 255 N -2.63 3.15 0.48 6.54 5.36 -0.30 -4.57 117.98 126.00 2pnk s PHE 255 Ca 0.65 -1.27 0.02 0.00 -0.96 0.00 0.00 56.93 55.37 2pnk s PHE 255 Cb -0.21 -2.19 0.01 0.00 -0.34 0.00 0.00 43.02 40.29 2pnk s PHE 255 CO 0.53 -0.66 0.69 0.00 -1.46 0.00 0.00 175.22 174.31 2pnk s ALA 256 N 1.42 3.90 0.00 11.12 0.00 -1.26 -1.67 121.76 135.27 2pnk s ALA 256 Ca 0.01 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.73 2pnk s ALA 256 Cb -0.18 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 20.90 2pnk s ALA 256 CO 0.00 -0.48 0.00 -0.89 0.00 0.00 0.00 175.76 174.39 2pnk n ILE 259 N -2.12 0.00 0.00 0.00 5.41 -0.60 -1.35 119.36 120.69 2pnk n ILE 259 Ca 0.04 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.79 2pnk n ILE 259 Cb 0.59 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.52 2pnk n ILE 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2pnk n GLY 260 N -0.03 0.88 3.71 7.39 0.00 -0.06 -1.06 105.19 116.03 2pnk n GLY 260 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2pnk n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pnk s VAL 261 N -1.86 4.88 -0.44 1.61 0.11 -0.95 -1.75 120.40 122.00 2pnk s VAL 261 Ca 0.00 2.03 -0.15 0.00 -2.93 0.00 0.00 61.98 60.93 2pnk s VAL 261 Cb 0.00 -4.31 0.05 0.00 -1.53 0.00 0.00 36.38 30.59 2pnk s VAL 261 CO 0.00 0.16 0.34 -0.54 -3.33 0.00 0.00 175.10 171.73 2pnk s LYS 262 N 1.02 2.95 0.19 1.54 1.02 0.05 -3.88 119.74 122.62 2pnk s LYS 262 Ca 0.51 -1.19 -0.30 0.00 0.02 0.00 0.00 55.97 55.01 2pnk s LYS 262 Cb -0.21 -4.02 -0.08 0.00 -0.52 0.00 0.00 37.83 33.00 2pnk s LYS 262 CO 0.27 -0.88 1.22 0.15 -0.92 0.00 0.00 175.35 175.19 2pnk s LYS 263 N 1.64 4.47 -1.21 1.68 -0.14 -1.26 -0.49 119.74 124.43 2pnk s LYS 263 Ca 0.04 1.91 -0.09 0.00 -1.36 0.00 0.00 55.97 56.47 2pnk s LYS 263 Cb -0.22 -3.23 -0.01 0.00 -1.68 0.00 0.00 37.83 32.69 2pnk s LYS 263 CO 0.08 -0.12 0.75 0.54 -0.76 0.00 0.00 175.35 175.84 2pnk n ARG 264 N 2.53 -2.88 0.22 1.68 5.12 -1.24 -4.91 116.66 117.17 2pnk n ARG 264 Ca 0.05 0.58 0.10 0.00 -1.93 0.00 0.00 57.85 56.64 2pnk n ARG 264 Cb 0.44 -4.81 0.37 0.00 -1.16 0.00 0.00 32.46 27.30 2pnk n ARG 264 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 2pnk h VAL 265 N -1.75 0.43 -2.62 1.55 -1.51 -1.25 -3.34 116.25 107.76 2pnk h VAL 265 Ca -0.63 -1.21 -0.60 0.00 -1.23 0.00 0.00 66.70 63.03 2pnk h VAL 265 Cb 1.35 1.89 -0.40 0.00 -2.13 0.00 0.00 31.29 32.00 2pnk h VAL 265 CO 0.52 0.20 -0.77 1.57 -1.23 0.00 0.00 177.57 177.85 2pnk n HIS 266 N -3.26 1.42 -0.33 5.19 -0.00 -0.95 -5.02 115.22 112.27 2pnk n HIS 266 Ca 0.01 -3.86 0.13 0.00 -0.00 0.00 0.00 57.72 54.01 2pnk n HIS 266 Cb 0.48 -0.26 0.32 0.00 -0.00 0.00 0.00 29.99 30.53 2pnk n HIS 266 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 2pnk h PRO 267 N 5.21 0.59 -0.31 1.57 0.11 -1.85 -0.49 132.00 136.83 2pnk h PRO 267 Ca 0.19 -0.04 0.08 0.00 0.11 0.00 0.00 66.00 66.35 2pnk h PRO 267 Cb 0.81 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.78 2pnk h PRO 267 CO 0.58 0.39 0.22 0.00 -0.21 0.00 0.00 178.00 178.98 2pnk h ALA 268 N 1.67 2.26 0.00 -0.75 0.00 -1.95 -0.86 119.26 119.62 2pnk h ALA 268 Ca 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.47 2pnk h ALA 268 Cb 0.99 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2pnk h ALA 268 CO -0.44 -0.34 0.00 1.28 0.00 0.00 0.00 179.25 179.75 2pnk n LEU 269 N -4.45 0.00 0.00 0.00 4.77 -0.19 -4.99 117.00 112.14 2pnk n LEU 269 Ca 0.04 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 2pnk n LEU 269 Cb 0.37 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 2pnk n LEU 269 CO 0.36 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2pnk n GLY 270 N 0.50 3.15 0.44 -0.72 0.00 -0.33 -1.70 105.19 106.53 2pnk n GLY 270 Ca 0.14 -0.28 0.24 0.00 0.00 0.00 0.00 46.02 46.13 2pnk n GLY 270 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2pnk h ASP 271 N 5.80 0.00 -0.21 1.61 3.32 -1.94 0.12 116.42 125.11 2pnk h ASP 271 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2pnk h ASP 271 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2pnk h ASP 271 CO 0.00 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 2pnk n ALA 272 N -2.40 2.50 1.10 3.45 0.00 -0.69 -4.25 120.51 120.22 2pnk n ALA 272 Ca 0.14 -0.39 0.12 0.00 0.00 0.00 0.00 53.44 53.31 2pnk n ALA 272 Cb 0.91 -0.99 0.17 0.00 0.00 0.00 0.00 19.45 19.54 2pnk n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pnk n GLY 273 N 0.79 0.67 3.85 0.00 0.00 0.41 -4.89 105.19 106.03 2pnk n GLY 273 Ca 0.07 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 45.13 2pnk n GLY 273 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2pnk s ASP 274 N -2.07 6.76 0.07 1.61 1.01 -1.26 -0.95 116.67 121.84 2pnk s ASP 274 Ca 0.29 1.12 0.00 0.00 0.71 0.00 0.00 52.55 54.67 2pnk s ASP 274 Cb 0.20 -2.30 -0.00 0.00 1.01 0.00 0.00 42.92 41.82 2pnk s ASP 274 CO 0.34 -0.06 0.01 0.33 0.21 0.00 0.00 175.17 176.00 2pnk n PHE 275 N 0.12 0.11 -4.00 4.23 7.35 0.36 -4.92 117.46 120.70 2pnk n PHE 275 Ca -0.00 -0.38 -0.10 0.00 -0.76 0.00 0.00 57.45 56.20 2pnk n PHE 275 Cb 0.52 -0.03 -0.11 0.00 0.35 0.00 0.00 39.48 40.21 2pnk n PHE 275 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2pnk s VAL 276 N -1.47 0.23 0.08 -2.13 0.11 -1.26 -0.77 120.40 115.19 2pnk s VAL 276 Ca 0.01 -0.91 -0.14 0.00 -2.93 0.00 0.00 61.98 58.01 2pnk s VAL 276 Cb 0.00 -0.35 0.02 0.00 -1.53 0.00 0.00 36.38 34.52 2pnk s VAL 276 CO 0.01 -0.44 0.33 -0.83 -3.33 0.00 0.00 175.10 170.84 2pnk s GLY 277 N -1.42 -0.16 0.25 6.54 0.00 -0.71 -4.83 107.32 106.98 2pnk s GLY 277 Ca -0.13 -0.09 -0.30 0.00 0.00 0.00 0.00 44.72 44.20 2pnk s GLY 277 CO -0.01 -0.32 1.18 1.25 0.00 0.00 0.00 173.10 175.20 2pnk s LYS 278 N -3.26 4.53 0.22 2.90 2.20 -1.26 -4.49 119.74 120.58 2pnk s LYS 278 Ca -0.00 1.90 0.08 0.00 -0.36 0.00 0.00 55.97 57.59 2pnk s LYS 278 Cb 0.01 -3.19 -0.04 0.00 -1.51 0.00 0.00 37.83 33.10 2pnk s LYS 278 CO -0.08 0.02 0.04 0.00 -0.36 0.00 0.00 175.35 174.97 2pnk s ALA 279 N -0.67 3.27 1.00 3.13 0.00 -1.26 -4.77 121.76 122.46 2pnk s ALA 279 Ca 0.49 -1.48 0.00 0.00 0.00 0.00 0.00 51.96 50.97 2pnk s ALA 279 Cb -0.34 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 21.80 2pnk s ALA 279 CO 0.41 0.36 0.00 0.45 0.00 0.00 0.00 175.76 176.98 2pnk n SER 280 N -0.61 0.00 0.00 0.00 2.88 -1.24 -4.98 113.62 109.67 2pnk n SER 280 Ca -0.08 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.46 2pnk n SER 280 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 2pnk n SER 280 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2pnk n ASP 282 N 0.00 0.00 -0.19 -3.46 8.00 -1.26 -4.71 116.55 114.92 2pnk n ASP 282 Ca 0.00 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 2pnk n ASP 282 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.11 2pnk n ASP 282 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2pnk h GLY 283 N 0.00 1.09 0.88 0.44 0.00 -1.84 -1.28 103.07 102.35 2pnk h GLY 283 Ca 0.00 -0.84 -0.06 0.00 0.00 0.00 0.00 47.33 46.43 2pnk h GLY 283 CO 0.00 0.77 -0.07 -2.08 0.00 0.00 0.00 176.54 175.16 2pnk h VAL 284 N 0.89 1.28 -0.60 4.60 2.07 -1.88 -1.88 116.25 120.73 2pnk h VAL 284 Ca 0.15 -1.09 0.04 0.00 0.82 0.00 0.00 66.70 66.62 2pnk h VAL 284 Cb 0.60 1.41 -0.04 0.00 -1.52 0.00 0.00 31.29 31.74 2pnk h VAL 284 CO 0.04 0.35 0.34 -0.08 0.02 0.00 0.00 177.57 178.24 2pnk h GLU 285 N 0.31 0.64 -0.22 1.57 4.81 -1.93 -1.78 114.58 117.99 2pnk h GLU 285 Ca 0.07 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2pnk h GLU 285 Cb 0.54 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 2pnk h GLU 285 CO 0.03 0.42 0.08 1.25 -0.73 0.00 0.00 179.01 180.06 2pnk h HIS 286 N 0.66 0.34 -0.26 0.92 2.76 -1.12 -1.10 115.15 117.34 2pnk h HIS 286 Ca 0.25 -0.03 0.03 0.00 -2.20 0.00 0.00 60.37 58.42 2pnk h HIS 286 Cb 0.10 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 28.93 2pnk h HIS 286 CO -0.07 0.38 0.09 -0.07 -1.30 0.00 0.00 177.93 176.96 2pnk h LEU 287 N 0.19 0.11 -0.51 0.26 3.38 -1.04 0.26 115.31 117.96 2pnk h LEU 287 Ca 0.07 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2pnk h LEU 287 Cb 0.20 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2pnk h LEU 287 CO -0.00 0.10 0.21 -0.07 0.09 0.00 0.00 178.44 178.76 2pnk h LEU 288 N 0.22 0.71 -0.22 1.67 3.38 -1.24 -1.51 115.31 118.32 2pnk h LEU 288 Ca 0.11 -0.17 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 2pnk h LEU 288 Cb 0.08 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2pnk h LEU 288 CO -0.11 0.68 -0.39 -0.09 0.09 0.00 0.00 178.44 178.62 2pnk h ARG 289 N 0.69 0.65 0.00 1.13 2.43 -1.04 -3.33 114.38 114.91 2pnk h ARG 289 Ca 0.17 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 2pnk h ARG 289 Cb 0.20 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2pnk h ARG 289 CO -0.01 1.02 -0.45 0.39 -1.51 0.00 0.00 179.97 179.41 2pnk n GLU 290 N -4.23 0.04 -3.10 0.20 -0.58 0.07 -4.13 120.64 108.90 2pnk n GLU 290 Ca -0.05 0.01 -0.25 0.00 -0.42 0.00 0.00 57.16 56.45 2pnk n GLU 290 Cb 0.53 -1.52 -0.05 0.00 -0.57 0.00 0.00 31.44 29.83 2pnk n GLU 290 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2pnk n TYR 291 N -1.58 2.79 0.30 -0.32 4.02 -0.57 -4.93 117.16 116.87 2pnk n TYR 291 Ca 0.05 -3.95 0.19 0.00 -0.01 0.00 0.00 57.90 54.18 2pnk n TYR 291 Cb 0.35 -0.48 0.97 0.00 -0.02 0.00 0.00 39.34 40.17 2pnk n TYR 291 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2pnk h PRO 292 N 3.27 0.00 -0.42 -0.72 0.13 -1.72 -1.10 132.00 131.44 2pnk h PRO 292 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2pnk h PRO 292 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2pnk h PRO 292 CO 0.72 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.58 2pnk n ASN 293 N -2.86 2.87 -4.74 1.44 3.02 -1.26 -4.87 115.26 108.86 2pnk n ASN 293 Ca -0.02 -1.94 -0.30 0.00 -0.03 0.00 0.00 54.58 52.29 2pnk n ASN 293 Cb 0.11 -0.28 -0.07 0.00 -0.61 0.00 0.00 39.78 38.93 2pnk n ASN 293 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2pnk s ASN 294 N -1.28 5.31 -0.04 6.41 -0.87 -0.42 -4.76 114.94 119.29 2pnk s ASN 294 Ca 0.37 -0.08 0.00 0.00 -1.57 0.00 0.00 52.86 51.58 2pnk s ASN 294 Cb 0.20 -1.36 -0.03 0.00 -0.02 0.00 0.00 41.25 40.04 2pnk s ASN 294 CO 0.28 0.17 -0.01 -0.54 -2.57 0.00 0.00 177.10 174.43 2pnk s LYS 295 N -2.35 2.85 -0.08 -0.60 1.02 -1.26 -4.86 119.74 114.47 2pnk s LYS 295 Ca 0.28 -0.52 0.00 0.00 0.02 0.00 0.00 55.97 55.75 2pnk s LYS 295 Cb -0.12 -2.70 0.02 0.00 -0.52 0.00 0.00 37.83 34.51 2pnk s LYS 295 CO 0.20 0.66 -0.06 -0.06 -0.92 0.00 0.00 175.35 175.17 2pnk s PHE 296 N -0.97 1.16 -0.21 3.18 0.40 0.03 -1.15 117.98 120.41 2pnk s PHE 296 Ca 0.16 -0.47 -0.09 0.00 -0.60 0.00 0.00 56.93 55.93 2pnk s PHE 296 Cb -0.11 -0.99 -0.05 0.00 0.51 0.00 0.00 43.02 42.38 2pnk s PHE 296 CO 0.06 -0.36 0.11 -0.51 0.70 0.00 0.00 175.22 175.22 2pnk s LEU 297 N 1.39 4.01 -0.02 -0.37 1.43 -0.67 -4.25 118.68 120.19 2pnk s LEU 297 Ca -0.02 0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 2pnk s LEU 297 Cb -0.13 -2.04 0.02 0.00 0.03 0.00 0.00 46.19 44.06 2pnk s LEU 297 CO -0.03 0.14 -0.02 -0.69 0.23 0.00 0.00 176.35 175.97 2pnk s VAL 298 N 0.60 0.28 0.10 -1.59 1.01 -1.26 -4.17 120.40 115.37 2pnk s VAL 298 Ca 0.06 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.01 2pnk s VAL 298 Cb -0.12 -0.31 -0.00 0.00 0.00 0.00 0.00 36.38 35.94 2pnk s VAL 298 CO 0.01 0.13 0.04 1.07 0.00 0.00 0.00 175.10 176.35 2pnk n THR 299 N 3.68 0.00 0.00 3.92 5.66 -1.26 -1.74 114.28 124.54 2pnk n THR 299 Ca -0.21 -0.61 0.00 0.00 -3.05 0.00 0.00 64.05 60.17 2pnk n THR 299 Cb 0.53 0.23 0.00 0.00 -1.55 0.00 0.00 70.33 69.54 2pnk n THR 299 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 2pnk n LEU 301 N 0.00 0.00 -4.78 1.09 7.94 -0.22 -1.56 117.00 119.47 2pnk n LEU 301 Ca -0.01 0.00 -0.39 0.00 -1.11 0.00 0.00 56.01 54.50 2pnk n LEU 301 Cb 0.16 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.05 2pnk n LEU 301 CO 0.08 0.00 0.28 -0.55 -1.11 0.00 0.00 177.39 176.09 2pnk s SER 302 N -1.11 6.99 0.36 1.96 0.15 -1.26 -4.77 113.70 116.02 2pnk s SER 302 Ca 0.00 1.18 0.03 0.00 0.70 0.00 0.00 55.95 57.86 2pnk s SER 302 Cb 0.00 -2.36 0.68 0.00 -1.71 0.00 0.00 66.02 62.63 2pnk s SER 302 CO 0.00 0.16 2.01 -0.09 1.20 0.00 0.00 173.24 176.52 2pnk h ARG 303 N 5.28 0.75 0.00 5.44 2.43 -1.96 -2.31 114.38 124.02 2pnk h ARG 303 Ca -0.47 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 2pnk h ARG 303 Cb 1.20 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 2pnk h ARG 303 CO 0.67 0.51 0.00 0.39 -1.51 0.00 0.00 179.97 180.04 2pnk n GLU 304 N -4.43 0.50 0.00 0.20 4.71 -1.26 -2.63 120.64 117.72 2pnk n GLU 304 Ca 0.05 0.00 0.11 0.00 -0.01 0.00 0.00 57.16 57.31 2pnk n GLU 304 Cb 0.06 -1.50 0.02 0.00 -1.01 0.00 0.00 31.44 29.01 2pnk n GLU 304 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2pnk n ASN 305 N -1.25 0.85 -0.07 1.62 5.03 -0.87 -4.71 115.26 115.86 2pnk n ASN 305 Ca 0.15 -0.75 -0.12 0.00 0.87 0.00 0.00 54.58 54.74 2pnk n ASN 305 Cb 0.22 0.72 -0.05 0.00 -1.02 0.00 0.00 39.78 39.65 2pnk n ASN 305 CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 2pnk h GLN 306 N 0.06 0.39 -0.34 3.52 1.08 -1.57 -1.64 115.11 116.62 2pnk h GLN 306 Ca 0.00 -0.13 -0.02 0.00 -1.45 0.00 0.00 58.65 57.04 2pnk h GLN 306 Cb 0.51 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.89 2pnk h GLN 306 CO 0.00 0.60 0.11 1.25 -0.95 0.00 0.00 178.83 179.85 2pnk h HIS 307 N 0.13 0.53 0.00 2.96 2.76 -1.84 -2.36 115.15 117.34 2pnk h HIS 307 Ca 0.06 -0.05 -0.07 0.00 -2.20 0.00 0.00 60.37 58.11 2pnk h HIS 307 Cb 0.44 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 2pnk h HIS 307 CO 0.04 0.52 -0.33 1.05 -1.30 0.00 0.00 177.93 177.92 2pnk h GLU 308 N 0.39 0.00 -0.88 5.26 4.11 -1.84 -1.91 114.58 119.71 2pnk h GLU 308 Ca 0.11 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.52 2pnk h GLU 308 Cb 0.23 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.44 2pnk h GLU 308 CO -0.00 0.33 0.46 1.25 0.07 0.00 0.00 179.01 181.11 2pnk h LEU 309 N 0.00 1.12 -0.27 3.06 5.85 -1.02 -0.55 115.31 123.50 2pnk h LEU 309 Ca -0.00 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 2pnk h LEU 309 Cb 0.62 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 2pnk h LEU 309 CO 0.04 0.91 0.09 0.58 -0.34 0.00 0.00 178.44 179.72 2pnk h VAL 310 N 1.24 1.20 -0.99 1.05 2.07 -0.84 -1.55 116.25 118.42 2pnk h VAL 310 Ca 0.31 -0.62 0.04 0.00 0.82 0.00 0.00 66.70 67.24 2pnk h VAL 310 Cb 0.06 1.10 -0.06 0.00 -1.52 0.00 0.00 31.29 30.88 2pnk h VAL 310 CO -0.05 0.21 0.65 0.58 0.02 0.00 0.00 177.57 178.98 2pnk h VAL 311 N 0.27 1.17 -0.41 2.57 2.07 -1.20 -1.79 116.25 118.93 2pnk h VAL 311 Ca 0.09 -0.43 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 2pnk h VAL 311 Cb 0.24 -0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.80 2pnk h VAL 311 CO -0.00 0.23 0.12 0.25 0.02 0.00 0.00 177.57 178.18 2pnk h LEU 312 N 1.25 0.55 -1.13 2.57 5.85 -0.58 -0.76 115.31 123.07 2pnk h LEU 312 Ca 0.39 -0.08 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 2pnk h LEU 312 Cb 0.00 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 2pnk h LEU 312 CO -0.13 0.55 0.29 0.00 -0.34 0.00 0.00 178.44 178.81 2pnk h ALA 313 N 1.54 1.32 -0.02 1.25 0.00 -0.48 -2.13 119.26 120.74 2pnk h ALA 313 Ca 0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2pnk h ALA 313 Cb 0.20 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2pnk h ALA 313 CO -0.01 0.52 -0.14 0.00 0.00 0.00 0.00 179.25 179.62 2pnk h ARG 314 N 0.89 0.02 0.06 0.00 3.08 -0.46 -3.02 114.38 114.95 2pnk h ARG 314 Ca 0.22 -0.00 -0.25 0.00 0.07 0.00 0.00 59.98 60.02 2pnk h ARG 314 Cb 0.12 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 2pnk h ARG 314 CO -0.03 0.17 -1.15 0.87 -1.07 0.00 0.00 179.97 178.76 2pnk h LYS 315 N 0.02 0.13 -4.09 0.04 1.79 -1.05 -3.45 116.57 109.96 2pnk h LYS 315 Ca 0.00 -0.23 -0.52 0.00 -2.18 0.00 0.00 60.65 57.72 2pnk h LYS 315 Cb 0.27 0.09 -0.38 0.00 -1.58 0.00 0.00 32.23 30.63 2pnk h LYS 315 CO 0.02 1.09 -0.79 -0.06 -1.08 0.00 0.00 179.45 178.63 2pnk s PHE 316 N -2.68 1.41 -0.87 -1.35 0.08 -0.86 -4.99 117.98 108.73 2pnk s PHE 316 Ca -0.02 -0.78 0.26 0.00 0.12 0.00 0.00 56.93 56.51 2pnk s PHE 316 Cb 0.08 -1.19 1.01 0.00 -0.57 0.00 0.00 43.02 42.36 2pnk s PHE 316 CO 0.85 -0.53 1.81 -1.13 -0.10 0.00 0.00 175.22 176.13 2pnk n SER 317 N 4.96 0.33 -0.30 1.36 3.41 -1.26 -2.31 113.62 119.81 2pnk n SER 317 Ca -0.11 0.54 0.11 0.00 -0.26 0.00 0.00 58.87 59.15 2pnk n SER 317 Cb 0.49 -0.63 0.51 0.00 -0.26 0.00 0.00 64.21 64.33 2pnk n SER 317 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2pnk n ASN 318 N -1.82 0.91 -3.92 4.04 6.94 -1.26 -5.04 115.26 115.11 2pnk n ASN 318 Ca 0.06 -1.51 -0.13 0.00 -0.02 0.00 0.00 54.58 52.98 2pnk n ASN 318 Cb 0.35 -0.04 0.04 0.00 -2.36 0.00 0.00 39.78 37.76 2pnk n ASN 318 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 2pnk n LEU 319 N -0.21 0.00 -3.70 -4.53 7.94 -0.98 -0.79 117.00 114.73 2pnk n LEU 319 Ca 0.17 -1.68 -0.14 0.00 -1.11 0.00 0.00 56.01 53.26 2pnk n LEU 319 Cb 0.22 -0.25 -0.09 0.00 0.53 0.00 0.00 43.42 43.83 2pnk n LEU 319 CO 0.13 -0.62 0.20 0.27 -1.11 0.00 0.00 177.39 176.27 2pnk s ILE 321 N -1.42 0.00 0.01 1.96 -4.36 -1.26 -4.90 121.20 111.23 2pnk s ILE 321 Ca 0.38 -0.01 0.03 0.00 -0.26 0.00 0.00 60.65 60.78 2pnk s ILE 321 Cb -0.03 -0.73 -0.01 0.00 1.25 0.00 0.00 42.46 42.94 2pnk s ILE 321 CO 0.24 -0.00 -0.09 0.72 0.24 0.00 0.00 174.94 176.04 2pnk s PHE 322 N 0.22 0.80 0.00 1.37 -0.71 -0.71 -2.35 117.98 116.60 2pnk s PHE 322 Ca -0.00 -0.22 0.00 0.00 -1.04 0.00 0.00 56.93 55.66 2pnk s PHE 322 Cb -0.04 -0.50 0.00 0.00 -1.21 0.00 0.00 43.02 41.27 2pnk s PHE 322 CO 0.01 -0.01 0.00 0.41 -1.34 0.00 0.00 175.22 174.29 2pnk n GLY 323 N 2.52 -1.98 2.99 1.99 0.00 -0.05 -4.32 105.19 106.34 2pnk n GLY 323 Ca -0.15 -1.51 -0.31 0.00 0.00 0.00 0.00 46.02 44.05 2pnk n GLY 323 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pnk s TRP 325 N 0.38 3.04 0.00 0.00 -0.00 -1.26 -3.39 118.94 117.71 2pnk s TRP 325 Ca 0.14 1.18 0.00 0.00 -0.00 0.00 0.00 56.10 57.42 2pnk s TRP 325 Cb -0.22 -3.42 0.00 0.00 -0.00 0.00 0.00 33.47 29.83 2pnk s TRP 325 CO -0.04 -1.26 0.00 1.87 -0.00 0.00 0.00 176.95 177.51 2pnk n TRP 326 N 6.34 0.00 -0.22 5.86 -0.00 -1.26 -3.94 117.44 124.22 2pnk n TRP 326 Ca 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 57.50 57.62 2pnk n TRP 326 Cb 0.45 0.00 -0.02 0.00 -0.00 0.00 0.00 31.31 31.75 2pnk n TRP 326 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 177.69 178.88 2pnk n PHE 327 N 0.00 0.00 -4.13 5.87 3.72 -1.26 -4.65 117.46 117.02 2pnk n PHE 327 Ca 0.00 -0.38 -0.46 0.00 -0.05 0.00 0.00 57.45 56.56 2pnk n PHE 327 Cb 0.00 -0.48 0.01 0.00 -0.94 0.00 0.00 39.48 38.07 2pnk n PHE 327 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2pnk n ASN 329 N 2.14 -3.47 -4.00 4.37 5.15 -1.22 -5.04 115.26 113.19 2pnk n ASN 329 Ca 0.04 -1.31 -0.17 0.00 -0.60 0.00 0.00 54.58 52.54 2pnk n ASN 329 Cb 0.21 -1.58 -0.14 0.00 -0.53 0.00 0.00 39.78 37.74 2pnk n ASN 329 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2pnk s ASN 330 N -3.64 0.87 0.25 1.20 0.01 -1.26 -5.01 114.94 107.36 2pnk s ASN 330 Ca 0.44 -0.19 -0.04 0.00 -0.71 0.00 0.00 52.86 52.36 2pnk s ASN 330 Cb -0.25 -0.08 0.47 0.00 0.41 0.00 0.00 41.25 41.81 2pnk s ASN 330 CO 0.98 0.05 1.73 -0.65 -1.51 0.00 0.00 177.10 177.70 2pnk h PRO 331 N 5.76 0.43 -0.79 -0.60 0.11 -1.98 0.16 132.00 135.08 2pnk h PRO 331 Ca -0.30 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 65.88 2pnk h PRO 331 Cb 1.19 -0.10 -0.07 0.00 0.11 0.00 0.00 31.00 32.13 2pnk h PRO 331 CO 0.49 0.28 0.43 1.49 -0.21 0.00 0.00 178.00 180.48 2pnk h GLU 332 N 0.44 0.70 0.14 1.05 4.57 -2.00 -1.21 114.58 118.28 2pnk h GLU 332 Ca 0.42 -0.04 -0.19 0.00 -1.18 0.00 0.00 59.36 58.37 2pnk h GLU 332 Cb 0.65 -0.16 0.02 0.00 -0.16 0.00 0.00 28.75 29.10 2pnk h GLU 332 CO -0.41 0.46 -0.82 0.82 -1.18 0.00 0.00 179.01 177.88 2pnk h ILE 333 N 0.72 1.51 -0.81 2.32 2.04 -1.65 -2.94 117.51 118.70 2pnk h ILE 333 Ca 0.39 -2.53 0.15 0.00 1.00 0.00 0.00 64.86 63.87 2pnk h ILE 333 Cb 0.38 3.20 -0.10 0.00 -0.74 0.00 0.00 36.82 39.56 2pnk h ILE 333 CO -0.26 0.72 0.37 0.40 0.00 0.00 0.00 178.15 179.37 2pnk h ILE 334 N -0.38 0.67 -0.12 -0.67 2.04 -0.66 -2.54 117.51 115.85 2pnk h ILE 334 Ca -0.14 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 2pnk h ILE 334 Cb 1.64 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 37.82 2pnk h ILE 334 CO 0.15 0.09 0.03 -1.13 0.00 0.00 0.00 178.15 177.29 2pnk h ASN 335 N 0.51 0.17 0.00 1.72 -1.24 -1.25 -1.43 115.58 114.07 2pnk h ASN 335 Ca 0.45 -0.21 0.00 0.00 0.71 0.00 0.00 56.30 57.25 2pnk h ASN 335 Cb 0.68 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.69 2pnk h ASN 335 CO -0.40 0.33 0.00 -1.84 -1.29 0.00 0.00 177.43 174.23 2pnk n GLU 336 N -4.88 0.51 0.00 6.67 0.28 -0.96 -1.75 120.64 120.52 2pnk n GLU 336 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.94 2pnk n GLU 336 Cb 0.14 -1.25 0.00 0.00 1.43 0.00 0.00 31.44 31.76 2pnk n GLU 336 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 2pnk n THR 338 N 0.57 0.00 0.43 3.84 -1.04 -0.54 -4.57 114.28 112.97 2pnk n THR 338 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2pnk n THR 338 Cb 0.21 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 2pnk n THR 338 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2pnk n ARG 339 N 0.00 0.43 -0.41 -2.82 1.74 -0.72 -4.62 116.66 110.27 2pnk n ARG 339 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2pnk n ARG 339 Cb 0.00 -1.27 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2pnk n ARG 339 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2pnk n ARG 341 N 0.65 -0.49 -0.03 5.56 1.74 -1.26 -5.02 116.66 117.80 2pnk n ARG 341 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2pnk n ARG 341 Cb 0.19 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 29.90 2pnk n ARG 341 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2pnk n GLU 343 N -0.41 -0.45 0.00 5.56 1.02 -1.26 -3.83 120.64 121.27 2pnk n GLU 343 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2pnk n GLU 343 Cb 0.00 -0.65 0.00 0.00 -0.02 0.00 0.00 31.44 30.77 2pnk n GLU 343 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2pnk n LEU 345 N -0.03 0.00 0.00 -4.62 4.77 -1.26 -5.16 117.00 110.70 2pnk n LEU 345 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2pnk n LEU 345 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2pnk n LEU 345 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 2pnk n GLY 346 N 0.00 3.27 1.44 -0.72 0.00 -1.25 -1.37 105.19 106.56 2pnk n GLY 346 Ca 0.00 -0.15 0.10 0.00 0.00 0.00 0.00 46.02 45.97 2pnk n GLY 346 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2pnk n THR 347 N 0.00 1.62 -1.36 2.61 -2.24 -1.26 -4.75 114.28 108.89 2pnk n THR 347 Ca 0.00 -1.17 -0.23 0.00 -2.27 0.00 0.00 64.05 60.38 2pnk n THR 347 Cb 0.00 0.22 -0.09 0.00 -2.10 0.00 0.00 70.33 68.36 2pnk n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2pnk n SER 348 N 1.13 6.16 -3.96 3.42 3.41 -0.47 -4.74 113.62 118.57 2pnk n SER 348 Ca 0.24 -3.01 -0.09 0.00 -0.26 0.00 0.00 58.87 55.76 2pnk n SER 348 Cb 0.80 -1.29 -0.05 0.00 -0.26 0.00 0.00 64.21 63.41 2pnk n SER 348 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2pnk s PHE 349 N -0.96 0.28 -0.42 7.33 -0.71 -1.26 -4.83 117.98 117.42 2pnk s PHE 349 Ca 0.61 -0.65 -0.09 0.00 -1.04 0.00 0.00 56.93 55.77 2pnk s PHE 349 Cb 0.36 0.22 0.08 0.00 -1.21 0.00 0.00 43.02 42.47 2pnk s PHE 349 CO -0.16 -0.97 0.26 0.42 -1.34 0.00 0.00 175.22 173.42 2pnk s ILE 350 N -3.99 4.16 0.40 -4.49 1.01 -0.99 -4.70 121.20 112.60 2pnk s ILE 350 Ca 0.20 -1.45 0.08 0.00 0.00 0.00 0.00 60.65 59.49 2pnk s ILE 350 Cb -0.01 -3.57 0.22 0.00 0.01 0.00 0.00 42.46 39.12 2pnk s ILE 350 CO 0.07 -0.52 2.00 1.55 0.00 0.00 0.00 174.94 178.04 2pnk h PRO 351 N 8.38 0.39 -3.07 2.79 0.13 -1.86 -0.11 132.00 138.65 2pnk h PRO 351 Ca -0.22 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 64.78 2pnk h PRO 351 Cb 1.08 -0.08 -0.16 0.00 0.13 0.00 0.00 31.00 31.97 2pnk h PRO 351 CO 0.75 0.35 -0.10 -1.14 -0.23 0.00 0.00 178.00 177.63 2pnk s GLN 352 N -5.16 0.94 0.14 0.86 2.00 -1.26 -3.47 119.66 113.71 2pnk s GLN 352 Ca -0.07 -0.40 -0.01 0.00 -2.00 0.00 0.00 55.36 52.87 2pnk s GLN 352 Cb 0.16 0.42 -0.04 0.00 0.80 0.00 0.00 33.01 34.35 2pnk s GLN 352 CO 0.73 -0.33 0.08 -3.38 -0.50 0.00 0.00 175.29 171.89 2pnk s HIS 353 N -2.63 0.89 -0.13 1.67 -3.43 -1.26 -4.64 115.29 105.75 2pnk s HIS 353 Ca -0.04 -1.24 0.08 0.00 -0.80 0.00 0.00 55.06 53.06 2pnk s HIS 353 Cb -0.00 -0.48 -0.23 0.00 -1.43 0.00 0.00 32.58 30.44 2pnk s HIS 353 CO -0.03 -0.54 0.30 -1.13 -2.00 0.00 0.00 174.74 171.33 2pnk n SER 354 N -0.12 1.09 -1.99 7.38 3.41 -1.24 -4.74 113.62 117.40 2pnk n SER 354 Ca -0.04 0.18 -0.16 0.00 -0.26 0.00 0.00 58.87 58.58 2pnk n SER 354 Cb 0.64 -0.01 -0.04 0.00 -0.26 0.00 0.00 64.21 64.54 2pnk n SER 354 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2pnk n ASP 355 N -3.10 -4.61 -4.68 4.04 8.00 -0.45 -4.91 116.55 110.85 2pnk n ASP 355 Ca -0.29 0.24 -0.45 0.00 0.71 0.00 0.00 54.79 55.00 2pnk n ASP 355 Cb 1.07 -4.01 -0.04 0.00 -0.02 0.00 0.00 41.12 38.13 2pnk n ASP 355 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pnk n ALA 356 N -0.75 1.72 -0.04 2.24 0.00 -1.26 -4.29 120.51 118.13 2pnk n ALA 356 Ca -0.18 0.43 0.01 0.00 0.00 0.00 0.00 53.44 53.70 2pnk n ALA 356 Cb 0.60 -2.39 -0.13 0.00 0.00 0.00 0.00 19.45 17.53 2pnk n ALA 356 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2pnk n ARG 357 N 3.36 0.93 -4.92 0.00 1.74 -1.26 -0.41 116.66 116.10 2pnk n ARG 357 Ca 0.16 -0.09 -0.32 0.00 -0.77 0.00 0.00 57.85 56.83 2pnk n ARG 357 Cb 0.31 -1.40 -0.16 0.00 -1.02 0.00 0.00 32.46 30.18 2pnk n ARG 357 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2pnk s VAL 358 N -2.81 2.34 0.22 1.55 1.01 -1.26 -4.27 120.40 117.18 2pnk s VAL 358 Ca -0.07 -0.91 -0.17 0.00 0.00 0.00 0.00 61.98 60.84 2pnk s VAL 358 Cb 0.08 -1.94 0.24 0.00 0.00 0.00 0.00 36.38 34.76 2pnk s VAL 358 CO 0.67 0.54 1.57 0.25 0.00 0.00 0.00 175.10 178.14 2pnk h LEU 359 N 6.92 -1.20 -2.76 3.92 5.85 -1.39 0.04 115.31 126.69 2pnk h LEU 359 Ca -0.25 0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2pnk h LEU 359 Cb 1.22 0.65 -0.00 0.00 0.37 0.00 0.00 40.66 42.90 2pnk h LEU 359 CO 0.52 -0.29 -0.00 -0.33 -0.34 0.00 0.00 178.44 177.99 2pnk h GLU 360 N -0.05 0.00 0.00 1.25 3.07 -1.95 -2.39 114.58 114.51 2pnk h GLU 360 Ca 0.33 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.19 2pnk h GLU 360 Cb 0.59 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.50 2pnk h GLU 360 CO -0.87 0.00 -0.00 1.96 -1.40 0.00 0.00 179.01 178.70 2pnk h GLN 361 N 0.00 0.00 -0.90 2.33 4.20 -1.38 -0.58 115.11 118.78 2pnk h GLN 361 Ca -0.00 0.00 0.18 0.00 0.06 0.00 0.00 58.65 58.89 2pnk h GLN 361 Cb 0.04 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.75 2pnk h GLN 361 CO 0.00 0.00 0.59 -0.07 -0.67 0.00 0.00 178.83 178.68 2pnk h LEU 362 N 0.00 0.52 0.44 1.46 3.38 -1.60 0.57 115.31 120.08 2pnk h LEU 362 Ca -0.00 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2pnk h LEU 362 Cb 0.01 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2pnk h LEU 362 CO 0.00 0.22 -0.21 0.40 0.09 0.00 0.00 178.44 178.94 2pnk h ILE 363 N 0.52 0.57 0.00 1.22 2.04 -1.35 -2.47 117.51 118.05 2pnk h ILE 363 Ca 0.47 -0.12 -0.25 0.00 1.00 0.00 0.00 64.86 65.96 2pnk h ILE 363 Cb 1.00 0.62 0.01 0.00 -0.74 0.00 0.00 36.82 37.71 2pnk h ILE 363 CO -0.20 0.02 -1.01 0.10 0.00 0.00 0.00 178.15 177.06 2pnk h TYR 364 N -0.66 0.87 -0.35 1.37 -0.00 -1.59 -0.07 116.97 116.55 2pnk h TYR 364 Ca -0.06 -0.47 0.03 0.00 0.00 0.00 0.00 58.73 58.22 2pnk h TYR 364 Cb 0.49 -0.10 -0.03 0.00 0.00 0.00 0.00 36.73 37.09 2pnk h TYR 364 CO -0.03 1.30 0.17 0.87 -0.00 0.00 0.00 178.16 180.47 2pnk h LYS 365 N 0.33 0.33 0.15 0.10 1.79 -0.96 -0.12 116.57 118.19 2pnk h LYS 365 Ca -0.11 -0.02 -0.29 0.00 -2.18 0.00 0.00 60.65 58.05 2pnk h LYS 365 Cb 1.65 -0.08 0.02 0.00 -1.58 0.00 0.00 32.23 32.25 2pnk h LYS 365 CO 0.19 0.22 -1.27 -1.49 -1.08 0.00 0.00 179.45 176.02 2pnk h TRP 366 N 0.34 0.76 -0.26 -1.35 4.06 -1.45 -2.54 115.95 115.52 2pnk h TRP 366 Ca 0.15 -0.52 -0.01 0.00 2.06 0.00 0.00 58.89 60.56 2pnk h TRP 366 Cb 0.07 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.17 2pnk h TRP 366 CO -0.10 1.39 0.12 1.25 -3.56 0.00 0.00 178.44 177.53 2pnk h HIS 367 N 0.16 0.38 -0.62 0.49 2.76 -0.88 -1.32 115.15 116.12 2pnk h HIS 367 Ca -0.17 -0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 57.91 2pnk h HIS 367 Cb 1.97 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 30.78 2pnk h HIS 367 CO 0.09 0.37 0.12 0.45 -1.30 0.00 0.00 177.93 177.66 2pnk h HIS 368 N 0.29 1.07 -0.09 5.26 3.86 -1.09 -2.63 115.15 121.82 2pnk h HIS 368 Ca 0.09 -0.14 -0.15 0.00 -1.16 0.00 0.00 60.37 59.01 2pnk h HIS 368 Cb 0.14 -0.30 0.01 0.00 1.06 0.00 0.00 27.41 28.32 2pnk h HIS 368 CO -0.02 0.91 -0.51 0.77 0.86 0.00 0.00 177.93 179.94 2pnk h SER 369 N 0.92 0.60 -0.98 2.45 0.02 -1.40 -3.12 113.55 112.05 2pnk h SER 369 Ca 0.19 -0.66 0.05 0.00 -0.84 0.00 0.00 61.79 60.53 2pnk h SER 369 Cb 0.40 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 62.70 2pnk h SER 369 CO 0.01 1.16 0.63 0.11 -1.14 0.00 0.00 176.83 177.61 2pnk h LYS 370 N 0.09 1.17 -0.55 3.45 1.57 -1.26 0.75 116.57 121.78 2pnk h LYS 370 Ca -0.04 -0.07 -0.05 0.00 -1.87 0.00 0.00 60.65 58.62 2pnk h LYS 370 Cb 1.16 -0.26 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 2pnk h LYS 370 CO 0.11 0.77 0.14 0.66 -0.57 0.00 0.00 179.45 180.56 2pnk h SER 371 N 1.20 0.79 -0.06 0.86 4.64 -1.49 0.63 113.55 120.12 2pnk h SER 371 Ca 0.40 -0.14 -0.03 0.00 -0.47 0.00 0.00 61.79 61.55 2pnk h SER 371 Cb 0.06 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 61.94 2pnk h SER 371 CO -0.14 0.77 -0.09 0.40 -0.87 0.00 0.00 176.83 176.90 2pnk h ILE 372 N 0.82 1.40 -0.61 0.95 2.04 -1.33 -2.67 117.51 118.11 2pnk h ILE 372 Ca 0.18 -1.34 0.01 0.00 1.00 0.00 0.00 64.86 64.71 2pnk h ILE 372 Cb 0.29 2.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.50 2pnk h ILE 372 CO -0.00 0.37 0.40 0.40 0.00 0.00 0.00 178.15 179.31 2pnk h ILE 373 N -0.31 1.14 -0.66 -0.67 2.04 -0.73 -1.41 117.51 116.91 2pnk h ILE 373 Ca 0.01 -0.28 0.08 0.00 1.00 0.00 0.00 64.86 65.67 2pnk h ILE 373 Cb 0.64 0.26 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 2pnk h ILE 373 CO 0.02 0.15 0.31 0.00 0.00 0.00 0.00 178.15 178.63 2pnk h ALA 374 N 1.23 0.88 -0.79 1.87 0.00 -0.91 -0.35 119.26 121.20 2pnk h ALA 374 Ca 0.23 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2pnk h ALA 374 Cb -0.07 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 2pnk h ALA 374 CO -0.06 -0.08 0.47 0.93 0.00 0.00 0.00 179.25 180.50 2pnk h GLU 375 N 0.55 1.08 -0.31 0.00 5.08 -0.93 -0.92 114.58 119.13 2pnk h GLU 375 Ca 0.32 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 2pnk h GLU 375 Cb 0.33 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2pnk h GLU 375 CO -0.26 0.77 0.11 0.28 -1.00 0.00 0.00 179.01 178.91 2pnk h VAL 376 N 1.08 1.19 -0.54 3.13 2.07 -0.48 -2.55 116.25 120.15 2pnk h VAL 376 Ca 0.28 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 67.23 2pnk h VAL 376 Cb -0.02 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 2pnk h VAL 376 CO -0.05 0.21 0.31 -0.07 0.02 0.00 0.00 177.57 177.99 2pnk h LEU 377 N 0.35 0.49 -0.57 2.57 3.38 -0.81 -1.79 115.31 118.93 2pnk h LEU 377 Ca 0.10 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.13 2pnk h LEU 377 Cb 0.21 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.82 2pnk h LEU 377 CO -0.01 0.34 0.30 0.40 0.09 0.00 0.00 178.44 179.57 2pnk h ILE 378 N 0.61 0.96 -0.63 1.22 2.04 -1.11 0.11 117.51 120.71 2pnk h ILE 378 Ca 0.22 -0.20 -0.06 0.00 1.00 0.00 0.00 64.86 65.82 2pnk h ILE 378 Cb 0.05 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.44 2pnk h ILE 378 CO -0.11 0.11 0.15 0.44 0.00 0.00 0.00 178.15 178.73 2pnk h ASP 379 N 0.58 0.97 -0.19 1.72 3.32 -1.03 0.70 116.42 122.49 2pnk h ASP 379 Ca 0.25 -0.24 -0.20 0.00 0.02 0.00 0.00 57.03 56.87 2pnk h ASP 379 Cb 0.15 -0.26 0.01 0.00 0.22 0.00 0.00 39.33 39.45 2pnk h ASP 379 CO -0.17 0.96 -0.65 0.11 -1.72 0.00 0.00 179.24 177.77 2pnk h LYS 380 N 0.94 0.77 -0.23 3.56 6.56 -0.83 -1.94 116.57 125.40 2pnk h LYS 380 Ca 0.20 -0.58 -0.01 0.00 -1.06 0.00 0.00 60.65 59.20 2pnk h LYS 380 Cb 0.37 0.10 -0.01 0.00 -0.57 0.00 0.00 32.23 32.13 2pnk h LYS 380 CO 0.00 1.20 0.10 1.88 -2.06 0.00 0.00 179.45 180.57 2pnk h TYR 381 N 0.51 0.34 -0.75 -1.35 0.05 -0.72 -2.73 116.97 112.32 2pnk h TYR 381 Ca -0.03 -0.02 0.15 0.00 0.05 0.00 0.00 58.73 58.88 2pnk h TYR 381 Cb 1.27 -0.10 -0.10 0.00 1.01 0.00 0.00 36.73 38.81 2pnk h TYR 381 CO 0.09 0.36 0.25 0.22 -1.05 0.00 0.00 178.16 178.03 2pnk h ASP 382 N 0.23 0.17 -0.71 3.88 3.58 -0.82 0.16 116.42 122.90 2pnk h ASP 382 Ca 0.08 0.13 -0.05 0.00 0.42 0.00 0.00 57.03 57.61 2pnk h ASP 382 Cb 0.16 0.14 -0.03 0.00 1.72 0.00 0.00 39.33 41.31 2pnk h ASP 382 CO -0.01 0.04 0.27 0.44 -2.88 0.00 0.00 179.24 177.09 2pnk h ASP 383 N 0.36 1.00 0.93 2.28 3.32 -1.18 0.11 116.42 123.24 2pnk h ASP 383 Ca 0.42 -0.18 -0.15 0.00 0.02 0.00 0.00 57.03 57.13 2pnk h ASP 383 Cb 0.68 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 2pnk h ASP 383 CO -0.45 0.91 -0.74 0.16 -1.72 0.00 0.00 179.24 177.40 2pnk h ILE 384 N 1.03 1.42 -0.88 0.35 3.07 -1.10 -2.74 117.51 118.65 2pnk h ILE 384 Ca 0.23 -2.63 -0.03 0.00 1.55 0.00 0.00 64.86 63.99 2pnk h ILE 384 Cb 0.24 2.46 -0.04 0.00 -0.27 0.00 0.00 36.82 39.21 2pnk h ILE 384 CO -0.02 0.72 0.45 -0.07 -1.05 0.00 0.00 178.15 178.19 2pnk h LEU 385 N 0.00 1.12 -1.38 0.16 3.38 -0.13 -1.24 115.31 117.22 2pnk h LEU 385 Ca -0.01 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2pnk h LEU 385 Cb 1.40 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2pnk h LEU 385 CO 0.10 0.93 -0.31 1.56 0.09 0.00 0.00 178.44 180.80 2pnk h GLN 386 N 1.24 0.00 0.00 1.13 1.08 -0.91 -1.35 115.11 116.30 2pnk h GLN 386 Ca 0.30 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.50 2pnk h GLN 386 Cb 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 2pnk h GLN 386 CO -0.04 0.31 0.00 0.00 -0.95 0.00 0.00 178.83 178.14 2pnk n ALA 387 N -2.48 2.35 0.00 3.87 0.00 -0.82 -4.90 120.51 118.54 2pnk n ALA 387 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2pnk n ALA 387 Cb 0.35 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.35 2pnk n ALA 387 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pnk n GLY 388 N 1.10 0.71 3.79 0.00 0.00 -0.51 -5.08 105.19 105.20 2pnk n GLY 388 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 2pnk n GLY 388 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2pnk s TRP 389 N -2.00 3.47 -0.31 1.61 -0.11 -0.53 -4.99 118.94 116.08 2pnk s TRP 389 Ca 0.00 1.70 -0.09 0.00 1.22 0.00 0.00 56.10 58.94 2pnk s TRP 389 Cb 0.00 -2.99 -0.00 0.00 -1.50 0.00 0.00 33.47 28.98 2pnk s TRP 389 CO 0.00 -0.15 0.13 -1.21 -4.62 0.00 0.00 176.95 171.10 2pnk s GLU 390 N -2.40 3.23 -0.12 5.86 2.02 -1.26 -4.21 118.70 121.81 2pnk s GLU 390 Ca 0.55 -0.78 -0.17 0.00 0.02 0.00 0.00 54.97 54.58 2pnk s GLU 390 Cb -0.18 -3.50 -0.04 0.00 0.10 0.00 0.00 34.13 30.50 2pnk s GLU 390 CO 0.23 -0.44 0.45 0.08 0.02 0.00 0.00 175.26 175.61 2pnk s VAL 391 N 1.57 5.20 0.31 2.63 1.01 -1.26 -5.10 120.40 124.77 2pnk s VAL 391 Ca 0.04 0.89 -0.00 0.00 0.00 0.00 0.00 61.98 62.91 2pnk s VAL 391 Cb -0.17 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2pnk s VAL 391 CO 0.05 0.34 0.52 0.42 0.00 0.00 0.00 175.10 176.43 2pnk s THR 392 N 0.57 5.12 0.32 3.92 -4.23 -1.26 -5.01 115.64 115.07 2pnk s THR 392 Ca 0.24 -0.41 0.00 0.00 -1.18 0.00 0.00 61.69 60.35 2pnk s THR 392 Cb -0.15 -3.83 0.23 0.00 1.34 0.00 0.00 72.50 70.09 2pnk s THR 392 CO 0.09 -0.47 1.95 -0.08 -0.54 0.00 0.00 174.62 175.57 2pnk h GLU 393 N 1.06 0.88 -0.23 3.99 4.81 -2.00 -1.61 114.58 121.47 2pnk h GLU 393 Ca -0.49 -0.09 -0.06 0.00 -0.13 0.00 0.00 59.36 58.59 2pnk h GLU 393 Cb 1.21 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 2pnk h GLU 393 CO 0.63 0.64 -0.12 0.93 -0.73 0.00 0.00 179.01 180.36 2pnk h GLU 394 N 0.89 0.38 -0.27 1.92 4.39 -1.99 -1.40 114.58 118.50 2pnk h GLU 394 Ca 0.23 -0.10 -0.19 0.00 0.34 0.00 0.00 59.36 59.64 2pnk h GLU 394 Cb 0.02 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2pnk h GLU 394 CO -0.04 0.51 -0.56 0.93 -1.16 0.00 0.00 179.01 178.69 2pnk h GLU 395 N 0.36 0.83 -0.06 2.33 5.08 -1.71 -1.85 114.58 119.56 2pnk h GLU 395 Ca 0.07 -0.54 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2pnk h GLU 395 Cb 0.44 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 2pnk h GLU 395 CO 0.02 1.17 0.03 0.82 -1.00 0.00 0.00 179.01 180.05 2pnk h ILE 396 N 0.63 1.00 -0.74 3.13 2.04 -1.16 0.83 117.51 123.23 2pnk h ILE 396 Ca 0.01 -0.02 0.06 0.00 1.00 0.00 0.00 64.86 65.91 2pnk h ILE 396 Cb 1.17 0.93 -0.06 0.00 -0.74 0.00 0.00 36.82 38.12 2pnk h ILE 396 CO 0.12 0.01 0.44 0.11 0.00 0.00 0.00 178.15 178.83 2pnk h LYS 397 N 0.06 0.78 0.25 2.37 1.57 -1.25 0.12 116.57 120.47 2pnk h LYS 397 Ca 0.02 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2pnk h LYS 397 Cb 0.01 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 2pnk h LYS 397 CO -0.02 0.52 -0.17 -0.09 -0.57 0.00 0.00 179.45 179.12 2pnk h ARG 398 N 0.80 -0.40 -0.84 3.15 2.43 -1.11 0.38 114.38 118.79 2pnk h ARG 398 Ca 0.33 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.53 2pnk h ARG 398 Cb 0.17 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 2pnk h ARG 398 CO -0.17 -0.27 0.54 -0.44 -1.51 0.00 0.00 179.97 178.12 2pnk h ASP 399 N -0.41 0.99 -0.47 -3.80 3.32 -0.28 -0.34 116.42 115.42 2pnk h ASP 399 Ca -0.02 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.93 2pnk h ASP 399 Cb 0.35 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 2pnk h ASP 399 CO 0.01 0.74 0.06 0.58 -1.72 0.00 0.00 179.24 178.91 2pnk h VAL 400 N 1.15 1.25 -0.86 -1.35 2.07 -0.74 -1.74 116.25 116.02 2pnk h VAL 400 Ca 0.31 -0.94 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 2pnk h VAL 400 Cb -0.10 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 2pnk h VAL 400 CO -0.06 0.33 0.44 0.00 0.02 0.00 0.00 177.57 178.30 2pnk h ALA 401 N 0.95 1.14 -0.26 1.67 0.00 -0.38 -1.81 119.26 120.58 2pnk h ALA 401 Ca 0.14 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.96 2pnk h ALA 401 Cb 0.41 -0.34 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 2pnk h ALA 401 CO 0.01 0.66 -0.13 -0.44 0.00 0.00 0.00 179.25 179.35 2pnk h ASP 402 N 1.22 -0.44 -0.49 0.00 3.32 -0.75 0.21 116.42 119.50 2pnk h ASP 402 Ca 0.30 0.10 -0.11 0.00 0.02 0.00 0.00 57.03 57.35 2pnk h ASP 402 Cb 0.08 0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2pnk h ASP 402 CO -0.04 -0.17 -0.12 -0.07 -1.72 0.00 0.00 179.24 177.12 2pnk h LEU 403 N -0.10 0.95 -0.64 1.55 3.38 -0.85 -0.97 115.31 118.63 2pnk h LEU 403 Ca 0.14 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2pnk h LEU 403 Cb 0.31 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2pnk h LEU 403 CO -0.32 1.09 -0.39 0.49 0.09 0.00 0.00 178.44 179.40 2pnk n PHE 404 N -4.21 0.00 0.10 1.13 3.72 -0.72 -4.23 117.46 113.25 2pnk n PHE 404 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 2pnk n PHE 404 Cb 0.40 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.86 2pnk n PHE 404 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2pnk n SER 405 N -0.50 -1.72 -0.03 4.37 2.88 -0.63 -1.16 113.62 116.84 2pnk n SER 405 Ca 0.10 0.38 -0.10 0.00 -1.33 0.00 0.00 58.87 57.93 2pnk n SER 405 Cb 0.39 1.86 0.05 0.00 -0.75 0.00 0.00 64.21 65.76 2pnk n SER 405 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2pnk h ARG 406 N 0.00 0.64 -0.92 -1.46 3.08 -0.97 -2.91 114.38 111.85 2pnk h ARG 406 Ca 0.00 -0.37 0.07 0.00 0.07 0.00 0.00 59.98 59.75 2pnk h ARG 406 Cb 0.00 0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.02 2pnk h ARG 406 CO 0.00 0.98 0.60 -0.91 -1.07 0.00 0.00 179.97 179.57 2pnk h ASN 407 N 0.51 0.90 0.39 7.04 2.35 -1.39 0.06 115.58 125.44 2pnk h ASN 407 Ca 0.03 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2pnk h ASN 407 Cb 1.02 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.22 2pnk h ASN 407 CO 0.10 0.57 -0.19 0.15 -1.65 0.00 0.00 177.43 176.41 2pnk h PHE 408 N 1.02 -0.48 -0.60 1.19 3.57 -1.76 -1.75 116.94 118.13 2pnk h PHE 408 Ca 0.40 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.86 2pnk h PHE 408 Cb 0.25 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 2pnk h PHE 408 CO -0.00 -0.17 0.25 -1.49 -2.23 0.00 0.00 178.31 174.67 2pnk h TRP 409 N -0.79 0.87 -0.54 0.41 4.06 -1.30 -0.79 115.95 117.86 2pnk h TRP 409 Ca -0.05 -0.04 -0.00 0.00 2.06 0.00 0.00 58.89 60.85 2pnk h TRP 409 Cb 0.53 -0.27 -0.03 0.00 -1.00 0.00 0.00 29.16 28.39 2pnk h TRP 409 CO 0.01 0.66 0.33 -0.09 -3.56 0.00 0.00 178.44 175.79 2pnk h ARG 410 N 0.86 0.72 -0.20 0.49 2.43 -1.02 -0.64 114.38 117.01 2pnk h ARG 410 Ca 0.21 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 2pnk h ARG 410 Cb 0.15 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 2pnk h ARG 410 CO -0.02 0.51 -0.08 0.35 -1.51 0.00 0.00 179.97 179.21 2pnk h PHE 411 N 0.72 0.47 0.00 2.20 3.57 -0.50 -3.00 116.94 120.40 2pnk h PHE 411 Ca 0.19 -0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.58 2pnk h PHE 411 Cb -0.04 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 38.59 2pnk h PHE 411 CO -0.03 0.69 0.00 1.33 -2.23 0.00 0.00 178.31 178.07 2pnk n VAL 412 N -4.58 0.34 -2.31 1.41 0.24 -0.38 -4.92 118.33 108.12 2pnk n VAL 412 Ca -0.05 0.08 -0.04 0.00 -2.04 0.00 0.00 64.34 62.29 2pnk n VAL 412 Cb 0.31 -0.68 0.02 0.00 -1.47 0.00 0.00 33.84 32.03 2pnk n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2pnk n GLY 413 N 0.92 0.25 3.52 7.63 0.00 -0.34 -4.83 105.19 112.34 2pnk n GLY 413 Ca 0.07 -0.29 -0.09 0.00 0.00 0.00 0.00 46.02 45.70 2pnk n GLY 413 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2pnk s ARG 414 N -4.22 1.39 -0.14 1.61 6.06 -0.68 -5.06 118.95 117.91 2pnk s ARG 414 Ca 0.02 -0.98 -0.06 0.00 -2.50 0.00 0.00 55.73 52.20 2pnk s ARG 414 Cb -0.00 0.49 -0.04 0.00 0.06 0.00 0.00 34.95 35.46 2pnk s ARG 414 CO 0.19 -0.58 0.07 -0.80 -2.50 0.00 0.00 175.30 171.68 2pnk s ASN 415 N -2.91 5.73 1.13 -2.12 0.01 -1.26 -4.53 114.94 110.98 2pnk s ASN 415 Ca 0.13 0.20 -0.18 0.00 -0.71 0.00 0.00 52.86 52.30 2pnk s ASN 415 Cb -0.00 -1.87 0.26 0.00 0.41 0.00 0.00 41.25 40.04 2pnk s ASN 415 CO -0.00 0.29 1.16 1.51 -1.51 0.00 0.00 177.10 178.55 2pnk s ASP 416 N -0.30 1.62 0.17 -1.22 1.47 -1.26 -4.69 116.67 112.46 2pnk s ASP 416 Ca 0.09 0.57 -0.14 0.00 1.18 0.00 0.00 52.55 54.25 2pnk s ASP 416 Cb -0.12 -0.80 0.11 0.00 -0.34 0.00 0.00 42.92 41.77 2pnk s ASP 416 CO 0.02 -3.69 1.78 -0.74 0.68 0.00 0.00 175.17 173.22 2pnk h HIS 417 N -2.29 0.41 -0.34 2.11 -0.00 -1.88 0.04 115.15 113.20 2pnk h HIS 417 Ca -0.45 0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 59.84 2pnk h HIS 417 Cb 1.28 -0.12 -0.01 0.00 -0.00 0.00 0.00 27.41 28.57 2pnk h HIS 417 CO -1.71 0.20 -0.15 0.28 -0.00 0.00 0.00 177.93 176.56 2pnk h VAL 418 N 0.44 1.29 -0.75 5.26 2.07 -1.92 -1.25 116.25 121.39 2pnk h VAL 418 Ca 0.20 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.47 2pnk h VAL 418 Cb 0.12 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 2pnk h VAL 418 CO -0.15 0.41 0.49 0.74 0.02 0.00 0.00 177.57 179.08 2pnk h THR 419 N 0.47 1.20 -0.79 2.57 2.02 -1.89 -2.52 112.91 113.97 2pnk h THR 419 Ca 0.08 -0.38 -0.04 0.00 0.77 0.00 0.00 66.41 66.84 2pnk h THR 419 Cb 0.68 0.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.16 2pnk h THR 419 CO 0.05 0.19 0.35 0.28 0.37 0.00 0.00 175.52 176.76 2pnk h SER 420 N 1.02 1.07 -0.88 4.18 0.02 -0.71 -0.07 113.55 118.18 2pnk h SER 420 Ca 0.27 -0.15 0.01 0.00 -0.84 0.00 0.00 61.79 61.08 2pnk h SER 420 Cb -0.10 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.12 2pnk h SER 420 CO -0.06 0.92 0.58 -0.37 -1.14 0.00 0.00 176.83 176.77 2pnk h VAL 421 N 1.14 1.23 -0.24 2.27 -1.51 -1.06 -2.72 116.25 115.35 2pnk h VAL 421 Ca 0.27 -0.42 -0.05 0.00 -1.23 0.00 0.00 66.70 65.28 2pnk h VAL 421 Cb 0.17 -0.07 -0.01 0.00 -2.13 0.00 0.00 31.29 29.25 2pnk h VAL 421 CO -0.03 0.22 -0.04 0.07 -1.23 0.00 0.00 177.57 176.56 2pnk h LYS 422 N 1.20 0.45 0.00 5.19 2.10 -0.98 -3.52 116.57 121.01 2pnk h LYS 422 Ca 0.32 -0.16 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 2pnk h LYS 422 Cb -0.14 -0.03 0.00 0.00 -0.90 0.00 0.00 32.23 31.16 2pnk h LYS 422 CO -0.07 0.66 0.00 1.55 -2.00 0.00 0.00 179.45 179.59