#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ptt h MET 3 N 0.00 1.13 -0.03 3.49 1.85 -1.91 0.15 114.93 119.61 1ptt h MET 3 Ca 0.00 -0.16 0.01 0.00 -0.61 0.00 0.00 59.70 58.94 1ptt h MET 3 Cb 0.00 -0.21 -0.00 0.00 0.43 0.00 0.00 31.60 31.82 1ptt h MET 3 CO 0.00 0.87 0.10 1.49 -0.40 0.00 0.00 176.91 178.97 1ptt h GLU 4 N 1.12 0.00 0.02 0.39 4.81 -1.98 0.38 114.58 119.32 1ptt h GLU 4 Ca 0.27 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1ptt h GLU 4 Cb 0.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.49 1ptt h GLU 4 CO -0.03 0.00 -0.01 0.87 -0.73 0.00 0.00 179.01 179.11 1ptt h LYS 5 N 0.00 -0.03 -0.93 1.92 1.57 -1.16 -2.42 116.57 115.53 1ptt h LYS 5 Ca 0.02 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 59.07 1ptt h LYS 5 Cb 0.21 0.01 -0.16 0.00 0.08 0.00 0.00 32.23 32.37 1ptt h LYS 5 CO -0.00 -0.02 0.22 1.49 -0.57 0.00 0.00 179.45 180.58 1ptt h GLU 6 N -0.06 0.12 0.29 3.15 4.81 -0.89 -0.65 114.58 121.36 1ptt h GLU 6 Ca -0.00 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1ptt h GLU 6 Cb 0.02 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1ptt h GLU 6 CO 0.00 0.08 -0.19 0.35 -0.73 0.00 0.00 179.01 178.53 1ptt h PHE 7 N 0.13 -0.50 0.00 0.92 3.04 -0.34 0.43 116.94 120.63 1ptt h PHE 7 Ca 0.61 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.51 1ptt h PHE 7 Cb 1.31 0.18 -0.01 0.00 2.56 0.00 0.00 35.95 39.99 1ptt h PHE 7 CO -0.29 -0.29 -0.21 0.93 -2.02 0.00 0.00 178.31 176.42 1ptt h GLU 8 N -0.47 0.00 -0.12 1.11 5.08 -0.65 -0.91 114.58 118.62 1ptt h GLU 8 Ca -0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1ptt h GLU 8 Cb 0.40 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 1ptt h GLU 8 CO 0.02 0.21 -0.04 0.37 -1.00 0.00 0.00 179.01 178.57 1ptt h GLN 9 N 0.00 0.25 -0.14 2.33 -0.00 -0.49 -2.16 115.11 114.89 1ptt h GLN 9 Ca -0.00 -0.10 -0.03 0.00 -0.00 0.00 0.00 58.65 58.51 1ptt h GLN 9 Cb 0.42 -0.01 -0.00 0.00 0.00 0.00 0.00 27.48 27.88 1ptt h GLN 9 CO 0.03 0.56 -0.04 0.82 0.00 0.00 0.00 178.83 180.20 1ptt h ILE 10 N -0.08 1.29 -0.35 2.39 2.04 0.12 -2.78 117.51 120.13 1ptt h ILE 10 Ca 0.03 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 64.89 1ptt h ILE 10 Cb 0.48 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 1ptt h ILE 10 CO 0.01 0.29 0.23 -0.78 0.00 0.00 0.00 178.15 177.91 1ptt h ASP 11 N -0.03 0.39 -0.93 1.72 1.82 -1.23 -0.15 116.42 118.02 1ptt h ASP 11 Ca 0.04 -0.01 0.14 0.00 -0.39 0.00 0.00 57.03 56.81 1ptt h ASP 11 Cb 0.47 -0.09 -0.09 0.00 0.68 0.00 0.00 39.33 40.30 1ptt h ASP 11 CO 0.02 0.28 0.54 0.07 -1.61 0.00 0.00 179.24 178.54 1ptt h LYS 12 N 0.47 0.77 -0.01 0.28 2.10 -1.35 0.16 116.57 118.98 1ptt h LYS 12 Ca 0.13 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.74 1ptt h LYS 12 Cb -0.04 -0.17 0.00 0.00 -0.90 0.00 0.00 32.23 31.12 1ptt h LYS 12 CO -0.04 0.51 -0.17 -1.13 -2.00 0.00 0.00 179.45 176.62 1ptt n SER 13 N -4.76 1.38 -2.54 7.07 3.41 -1.04 -4.96 113.62 112.18 1ptt n SER 13 Ca 0.19 -1.22 -0.18 0.00 -0.26 0.00 0.00 58.87 57.40 1ptt n SER 13 Cb 0.42 0.10 0.04 0.00 -0.26 0.00 0.00 64.21 64.51 1ptt n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ptt n GLY 14 N 1.29 -0.24 0.38 5.00 0.00 0.57 -4.94 105.19 107.25 1ptt n GLY 14 Ca 0.15 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.26 1ptt n GLY 14 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ptt n SER 15 N -1.70 1.17 -0.25 1.61 7.64 -0.40 -4.38 113.62 117.31 1ptt n SER 15 Ca -0.06 -1.47 0.00 0.00 1.01 0.00 0.00 58.87 58.35 1ptt n SER 15 Cb 0.58 -0.03 0.13 0.00 -1.01 0.00 0.00 64.21 63.88 1ptt n SER 15 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 1ptt h TRP 16 N 1.72 0.72 -0.28 1.43 4.06 -1.93 0.31 115.95 121.99 1ptt h TRP 16 Ca 0.00 0.03 -0.15 0.00 2.06 0.00 0.00 58.89 60.83 1ptt h TRP 16 Cb 0.37 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 1ptt h TRP 16 CO 0.03 0.31 -0.42 0.00 -3.56 0.00 0.00 178.44 174.80 1ptt h ALA 17 N 1.40 0.74 0.47 1.49 0.00 -1.91 -0.97 119.26 120.48 1ptt h ALA 17 Ca 0.34 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1ptt h ALA 17 Cb 0.28 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1ptt h ALA 17 CO -0.22 0.66 -0.23 0.00 0.00 0.00 0.00 179.25 179.46 1ptt h ALA 18 N 0.97 -0.64 -0.57 0.00 0.00 -1.59 -0.69 119.26 116.75 1ptt h ALA 18 Ca 0.04 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1ptt h ALA 18 Cb 0.96 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.93 1ptt h ALA 18 CO 0.09 -0.75 0.25 0.82 0.00 0.00 0.00 179.25 179.66 1ptt h ILE 19 N -0.86 0.86 -0.72 0.00 2.04 -0.47 0.15 117.51 118.51 1ptt h ILE 19 Ca -0.06 -0.16 0.06 0.00 1.00 0.00 0.00 64.86 65.70 1ptt h ILE 19 Cb 0.58 0.36 -0.06 0.00 -0.74 0.00 0.00 36.82 36.95 1ptt h ILE 19 CO 0.11 0.08 0.41 0.22 0.00 0.00 0.00 178.15 178.98 1ptt h TYR 20 N 0.46 0.76 -0.64 1.37 3.20 -1.07 0.32 116.97 121.37 1ptt h TYR 20 Ca 0.27 0.03 0.08 0.00 3.14 0.00 0.00 58.73 62.24 1ptt h TYR 20 Cb 0.27 -0.24 -0.06 0.00 1.54 0.00 0.00 36.73 38.24 1ptt h TYR 20 CO -0.14 0.37 0.31 0.37 -1.64 0.00 0.00 178.16 177.43 1ptt h GLN 21 N 0.76 0.54 -0.53 1.82 4.15 0.80 -0.19 115.11 122.45 1ptt h GLN 21 Ca 0.32 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.67 1ptt h GLN 21 Cb 0.19 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.73 1ptt h GLN 21 CO -0.18 0.36 0.17 -0.44 -1.93 0.00 0.00 178.83 176.81 1ptt h ASP 22 N 0.56 0.73 -0.36 -0.69 3.32 0.15 0.42 116.42 120.54 1ptt h ASP 22 Ca 0.30 -0.11 -0.13 0.00 0.02 0.00 0.00 57.03 57.12 1ptt h ASP 22 Cb 0.28 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1ptt h ASP 22 CO -0.24 0.69 -0.27 0.40 -1.72 0.00 0.00 179.24 178.10 1ptt h ILE 23 N 0.77 1.28 -0.17 0.35 2.04 -0.09 0.51 117.51 122.21 1ptt h ILE 23 Ca 0.18 -1.42 0.00 0.00 1.00 0.00 0.00 64.86 64.62 1ptt h ILE 23 Cb 0.22 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1ptt h ILE 23 CO -0.01 0.47 0.10 0.03 0.00 0.00 0.00 178.15 178.74 1ptt h ARG 24 N 0.61 0.20 -0.99 2.37 3.08 -0.70 -2.67 114.38 116.29 1ptt h ARG 24 Ca 0.07 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.13 1ptt h ARG 24 Cb 0.84 -0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.79 1ptt h ARG 24 CO 0.07 0.13 0.65 1.25 -1.07 0.00 0.00 179.97 181.00 1ptt h HIS 25 N 0.21 1.23 -0.65 3.04 2.76 -0.63 -1.64 115.15 119.47 1ptt h HIS 25 Ca 0.06 0.03 -0.34 0.00 -2.20 0.00 0.00 60.37 57.92 1ptt h HIS 25 Cb -0.01 -0.41 -0.20 0.00 1.55 0.00 0.00 27.41 28.34 1ptt h HIS 25 CO -0.08 0.75 0.44 0.39 -1.30 0.00 0.00 177.93 178.13 1ptt n GLU 26 N -4.42 1.83 -3.96 5.26 1.02 0.15 -4.91 120.64 115.61 1ptt n GLU 26 Ca 0.12 -1.96 -0.35 0.00 -0.02 0.00 0.00 57.16 54.96 1ptt n GLU 26 Cb 0.05 -1.77 -0.09 0.00 -0.02 0.00 0.00 31.44 29.60 1ptt n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ptt s ALA 27 N -2.16 3.45 0.97 0.62 0.00 -0.62 -4.99 121.76 119.02 1ptt s ALA 27 Ca 0.37 -0.74 -0.17 0.00 0.00 0.00 0.00 51.96 51.42 1ptt s ALA 27 Cb 0.31 -1.96 -0.14 0.00 0.00 0.00 0.00 23.12 21.33 1ptt s ALA 27 CO 0.07 0.17 -0.71 0.43 0.00 0.00 0.00 175.76 175.72 1ptt n SER 28 N 3.54 -5.71 -3.25 0.00 7.64 -1.26 -5.01 113.62 109.57 1ptt n SER 28 Ca -0.16 0.22 -0.04 0.00 1.01 0.00 0.00 58.87 59.89 1ptt n SER 28 Cb 0.52 -0.79 -0.03 0.00 -1.01 0.00 0.00 64.21 62.90 1ptt n SER 28 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ptt s ASP 29 N -1.05 -0.51 0.22 6.43 2.15 -1.26 -4.94 116.67 117.72 1ptt s ASP 29 Ca 0.42 -0.58 0.06 0.00 0.43 0.00 0.00 52.55 52.88 1ptt s ASP 29 Cb -0.20 1.48 -0.03 0.00 -0.30 0.00 0.00 42.92 43.86 1ptt s ASP 29 CO 0.81 -0.27 0.23 -0.36 -0.17 0.00 0.00 175.17 175.41 1ptt s PHE 30 N 2.21 3.23 0.70 -5.34 0.08 -1.26 -5.08 117.98 112.51 1ptt s PHE 30 Ca 0.13 -0.05 -0.15 0.00 0.12 0.00 0.00 56.93 56.98 1ptt s PHE 30 Cb -0.10 -1.49 0.02 0.00 -0.57 0.00 0.00 43.02 40.89 1ptt s PHE 30 CO -0.18 0.50 1.16 -1.25 -0.10 0.00 0.00 175.22 175.36 1ptt s PRO 31 N -3.66 2.43 -0.38 0.24 0.04 -1.26 -4.83 135.00 127.57 1ptt s PRO 31 Ca 0.33 1.59 0.10 0.00 0.04 0.00 0.00 61.00 63.06 1ptt s PRO 31 Cb -0.09 -1.89 0.44 0.00 0.04 0.00 0.00 34.50 33.01 1ptt s PRO 31 CO 0.26 -1.58 1.07 0.00 0.04 0.00 0.00 177.00 176.80 1ptt h ARG 33 N 2.66 -0.73 -0.99 0.00 -0.00 -1.94 -2.74 114.38 110.63 1ptt h ARG 33 Ca 0.17 0.05 0.20 0.00 -0.50 0.00 0.00 59.98 59.90 1ptt h ARG 33 Cb 1.08 0.17 -0.10 0.00 0.00 0.00 0.00 29.97 31.12 1ptt h ARG 33 CO 0.70 -0.49 0.61 0.28 0.00 0.00 0.00 179.97 181.08 1ptt h VAL 34 N -0.76 0.68 -0.48 2.04 2.07 -1.92 -2.08 116.25 115.81 1ptt h VAL 34 Ca -0.03 -0.24 0.04 0.00 0.82 0.00 0.00 66.70 67.30 1ptt h VAL 34 Cb 0.71 -0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 30.38 1ptt h VAL 34 CO -0.17 0.13 0.24 0.00 0.02 0.00 0.00 177.57 177.79 1ptt h ALA 35 N 1.64 0.60 0.00 1.67 0.00 -1.80 -2.29 119.26 119.09 1ptt h ALA 35 Ca 0.57 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1ptt h ALA 35 Cb 0.99 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1ptt h ALA 35 CO -0.35 -0.10 0.00 1.63 0.00 0.00 0.00 179.25 180.43 1ptt n LYS 36 N -4.89 0.53 -1.70 0.00 4.76 -0.81 -4.52 118.16 111.53 1ptt n LYS 36 Ca 0.04 0.02 -0.43 0.00 -2.87 0.00 0.00 58.31 55.06 1ptt n LYS 36 Cb 0.12 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.79 1ptt n LYS 36 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1ptt n LEU 37 N -1.20 3.65 -0.25 -0.35 4.32 -0.86 -4.85 117.00 117.46 1ptt n LEU 37 Ca 0.15 1.14 0.05 0.00 -0.02 0.00 0.00 56.01 57.33 1ptt n LEU 37 Cb 0.18 -1.50 0.15 0.00 -1.62 0.00 0.00 43.42 40.63 1ptt n LEU 37 CO 0.19 -0.20 0.84 1.55 -1.22 0.00 0.00 177.39 178.54 1ptt h PRO 38 N 4.54 0.12 -0.82 3.23 0.13 -1.90 -1.02 132.00 136.28 1ptt h PRO 38 Ca -0.46 -0.01 0.09 0.00 -0.87 0.00 0.00 66.00 64.76 1ptt h PRO 38 Cb 1.25 -0.03 -0.07 0.00 0.13 0.00 0.00 31.00 32.28 1ptt h PRO 38 CO 0.78 0.08 0.47 1.57 -0.23 0.00 0.00 178.00 180.66 1ptt h LYS 39 N 0.12 0.76 0.00 0.86 2.10 -1.95 -1.26 116.57 117.20 1ptt h LYS 39 Ca 0.40 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 59.01 1ptt h LYS 39 Cb 0.70 -0.17 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 1ptt h LYS 39 CO -0.63 0.50 0.00 0.09 -2.00 0.00 0.00 179.45 177.41 1ptt n ASN 40 N -4.75 0.00 -0.23 7.07 3.02 -0.40 -4.08 115.26 115.89 1ptt n ASN 40 Ca 0.13 -1.57 0.03 0.00 -0.03 0.00 0.00 54.58 53.14 1ptt n ASN 40 Cb 0.28 0.00 0.15 0.00 -0.61 0.00 0.00 39.78 39.59 1ptt n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1ptt h LYS 41 N 0.00 0.39 -0.04 3.52 3.64 -1.13 0.22 116.57 123.17 1ptt h LYS 41 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1ptt h LYS 41 Cb 0.00 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 1ptt h LYS 41 CO 0.00 0.26 0.00 0.27 -2.27 0.00 0.00 179.45 177.71 1ptt n ASN 42 N -5.02 0.75 -1.13 4.20 0.23 -1.26 -3.09 115.26 109.93 1ptt n ASN 42 Ca 0.12 -1.38 0.07 0.00 -0.53 0.00 0.00 54.58 52.86 1ptt n ASN 42 Cb 0.35 -0.02 0.25 0.00 -2.08 0.00 0.00 39.78 38.28 1ptt n ASN 42 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1ptt n ARG 43 N -0.36 2.72 -4.08 -3.83 1.74 0.77 -4.88 116.66 108.74 1ptt n ARG 43 Ca 0.19 -1.98 -0.21 0.00 -0.77 0.00 0.00 57.85 55.07 1ptt n ARG 43 Cb 0.21 -1.62 -0.17 0.00 -1.02 0.00 0.00 32.46 29.87 1ptt n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1ptt s ASN 44 N -0.85 1.19 -0.04 0.55 0.01 -1.18 -4.33 114.94 110.30 1ptt s ASN 44 Ca 0.36 -0.14 -0.25 0.00 -0.71 0.00 0.00 52.86 52.12 1ptt s ASN 44 Cb 0.22 -0.48 -0.21 0.00 0.41 0.00 0.00 41.25 41.19 1ptt s ASN 44 CO 0.19 -0.08 1.16 -0.09 -1.51 0.00 0.00 177.10 176.77 1ptt h ARG 45 N 7.47 0.08 -5.30 -0.60 2.43 -1.90 -3.44 114.38 113.13 1ptt h ARG 45 Ca -0.33 -0.06 -0.65 0.00 -0.81 0.00 0.00 59.98 58.13 1ptt h ARG 45 Cb 1.15 0.01 -0.26 0.00 -0.42 0.00 0.00 29.97 30.45 1ptt h ARG 45 CO 0.42 0.68 -0.74 0.71 -1.51 0.00 0.00 179.97 179.52 1ptt s TYR 46 N -3.77 2.86 -0.73 2.20 2.02 -1.26 -5.00 117.35 113.67 1ptt s TYR 46 Ca -0.16 -0.58 0.20 0.00 -0.37 0.00 0.00 57.07 56.16 1ptt s TYR 46 Cb 0.01 -1.88 0.83 0.00 -0.40 0.00 0.00 41.96 40.52 1ptt s TYR 46 CO 0.70 -0.19 1.61 2.89 -1.57 0.00 0.00 175.55 179.00 1ptt n ARG 47 N 3.57 0.11 -0.45 -0.62 1.85 -1.26 -2.52 116.66 117.34 1ptt n ARG 47 Ca -0.18 0.33 0.08 0.00 -1.00 0.00 0.00 57.85 57.08 1ptt n ARG 47 Cb 0.53 -1.70 0.26 0.00 -1.05 0.00 0.00 32.46 30.49 1ptt n ARG 47 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1ptt n ASP 48 N -1.90 3.92 -3.63 2.89 5.75 -1.26 -4.87 116.55 117.44 1ptt n ASP 48 Ca 0.03 -2.89 -0.26 0.00 -0.01 0.00 0.00 54.79 51.66 1ptt n ASP 48 Cb 0.21 -0.52 -0.17 0.00 -1.03 0.00 0.00 41.12 39.61 1ptt n ASP 48 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ptt s VAL 49 N -2.60 0.01 0.05 2.12 1.01 -1.05 -5.08 120.40 114.85 1ptt s VAL 49 Ca 0.41 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 62.12 1ptt s VAL 49 Cb 0.32 -0.66 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 1ptt s VAL 49 CO 0.10 -0.28 0.02 -0.44 0.00 0.00 0.00 175.10 174.50 1ptt s SER 50 N 2.09 0.38 -0.12 3.32 0.01 -1.26 -4.68 113.70 113.44 1ptt s SER 50 Ca 0.02 -0.85 -0.24 0.00 1.31 0.00 0.00 55.95 56.18 1ptt s SER 50 Cb -0.16 0.22 -0.03 0.00 0.21 0.00 0.00 66.02 66.26 1ptt s SER 50 CO -0.10 -0.58 0.77 -2.16 0.41 0.00 0.00 173.24 171.58 1ptt s PRO 51 N -3.54 4.36 0.27 12.44 0.04 -1.26 -4.42 135.00 142.89 1ptt s PRO 51 Ca 0.03 0.96 -0.31 0.00 0.04 0.00 0.00 61.00 61.72 1ptt s PRO 51 Cb 0.05 -3.52 -0.12 0.00 0.04 0.00 0.00 34.50 30.95 1ptt s PRO 51 CO -0.09 -0.15 1.53 1.19 0.04 0.00 0.00 177.00 179.52 1ptt n PHE 52 N 4.56 2.57 0.21 0.56 3.72 -1.26 -4.60 117.46 123.22 1ptt n PHE 52 Ca 0.02 0.31 0.12 0.00 -0.05 0.00 0.00 57.45 57.85 1ptt n PHE 52 Cb 0.50 -2.55 0.61 0.00 -0.94 0.00 0.00 39.48 37.11 1ptt n PHE 52 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1ptt h ASP 53 N 4.69 0.00 0.89 4.37 3.32 -1.71 0.12 116.42 128.10 1ptt h ASP 53 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1ptt h ASP 53 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1ptt h ASP 53 CO 0.79 0.00 -0.20 0.00 -1.72 0.00 0.00 179.24 178.11 1ptt n HIS 54 N -2.32 0.15 0.00 4.55 1.44 -1.26 -3.85 115.22 113.93 1ptt n HIS 54 Ca -0.01 0.04 0.00 0.00 -2.01 0.00 0.00 57.72 55.74 1ptt n HIS 54 Cb 0.07 -0.49 0.00 0.00 0.12 0.00 0.00 29.99 29.69 1ptt n HIS 54 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 1ptt n SER 55 N -1.63 0.34 -4.52 4.39 3.41 -0.51 -5.07 113.62 110.04 1ptt n SER 55 Ca 0.06 -0.30 -0.36 0.00 -0.26 0.00 0.00 58.87 58.01 1ptt n SER 55 Cb 0.36 0.66 0.07 0.00 -0.26 0.00 0.00 64.21 65.04 1ptt n SER 55 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1ptt n ARG 56 N -0.70 0.37 -3.91 4.33 1.85 0.30 -1.06 116.66 117.84 1ptt n ARG 56 Ca 0.00 0.17 -0.36 0.00 -1.00 0.00 0.00 57.85 56.66 1ptt n ARG 56 Cb 0.00 -1.96 -0.07 0.00 -1.05 0.00 0.00 32.46 29.38 1ptt n ARG 56 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 1ptt s ILE 57 N -1.88 5.32 -0.17 8.89 -1.09 -0.27 -4.65 121.20 127.35 1ptt s ILE 57 Ca 0.68 0.14 -0.04 0.00 -2.23 0.00 0.00 60.65 59.21 1ptt s ILE 57 Cb -0.35 -3.34 -0.03 0.00 -1.58 0.00 0.00 42.46 37.17 1ptt s ILE 57 CO 0.55 0.57 -0.03 -0.54 -1.23 0.00 0.00 174.94 174.27 1ptt s LYS 58 N -0.66 3.64 0.24 2.79 1.02 -1.26 -4.07 119.74 121.43 1ptt s LYS 58 Ca 0.13 -0.53 -0.30 0.00 0.02 0.00 0.00 55.97 55.29 1ptt s LYS 58 Cb -0.12 -2.94 -0.09 0.00 -0.52 0.00 0.00 37.83 34.16 1ptt s LYS 58 CO 0.02 0.18 1.34 -0.51 -0.92 0.00 0.00 175.35 175.46 1ptt s LEU 59 N 0.53 4.42 0.00 3.17 1.43 0.30 -4.83 118.68 123.70 1ptt s LEU 59 Ca -0.03 2.51 -0.04 0.00 -1.03 0.00 0.00 54.13 55.55 1ptt s LEU 59 Cb -0.14 -3.62 -0.17 0.00 0.03 0.00 0.00 46.19 42.29 1ptt s LEU 59 CO 0.03 -0.56 2.50 1.41 0.23 0.00 0.00 176.35 179.96 1ptt n HIS 60 N 2.20 0.00 -5.05 0.29 8.25 -1.26 -4.46 115.22 115.19 1ptt n HIS 60 Ca 0.05 -0.97 -0.29 0.00 -0.26 0.00 0.00 57.72 56.25 1ptt n HIS 60 Cb 0.42 -1.16 -0.17 0.00 1.12 0.00 0.00 29.99 30.20 1ptt n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1ptt s GLN 61 N 1.67 2.38 0.13 -0.41 -2.07 -1.26 -5.00 119.66 115.10 1ptt s GLN 61 Ca 0.42 -0.76 0.19 0.00 -1.82 0.00 0.00 55.36 53.40 1ptt s GLN 61 Cb 0.20 -1.94 0.80 0.00 -1.09 0.00 0.00 33.01 30.98 1ptt s GLN 61 CO 0.00 0.24 1.59 0.39 -1.32 0.00 0.00 175.29 176.19 1ptt n GLU 62 N 3.28 0.10 0.00 9.60 4.71 -1.26 -3.78 120.64 133.28 1ptt n GLU 62 Ca -0.19 0.33 0.00 0.00 -0.01 0.00 0.00 57.16 57.29 1ptt n GLU 62 Cb 0.52 -1.68 0.00 0.00 -1.01 0.00 0.00 31.44 29.27 1ptt n GLU 62 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1ptt n ASP 63 N -1.86 0.00 -3.52 1.62 2.03 -1.26 -4.89 116.55 108.67 1ptt n ASP 63 Ca 0.03 0.61 -0.06 0.00 0.52 0.00 0.00 54.79 55.89 1ptt n ASP 63 Cb 0.20 -0.20 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 1ptt n ASP 63 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1ptt s ASN 64 N -1.97 -0.42 -0.08 1.67 3.84 -1.25 -5.06 114.94 111.67 1ptt s ASN 64 Ca 0.00 0.89 0.14 0.00 0.21 0.00 0.00 52.86 54.10 1ptt s ASN 64 Cb 0.00 1.56 0.54 0.00 -0.55 0.00 0.00 41.25 42.79 1ptt s ASN 64 CO 0.00 -0.25 1.41 -0.90 -2.79 0.00 0.00 177.10 174.57 1ptt n ASP 65 N 5.40 3.61 -4.71 -4.21 5.75 -1.25 -4.76 116.55 116.38 1ptt n ASP 65 Ca -0.07 -2.29 -0.40 0.00 -0.01 0.00 0.00 54.79 52.02 1ptt n ASP 65 Cb 0.50 -0.48 -0.05 0.00 -1.03 0.00 0.00 41.12 40.06 1ptt n ASP 65 CO 0.00 0.00 0.00 -0.47 -0.11 0.00 0.00 177.20 176.62 1ptt s TYR 66 N -1.71 3.54 -0.09 2.11 5.04 -1.26 -0.54 117.35 124.45 1ptt s TYR 66 Ca 0.38 1.22 -0.04 0.00 -2.44 0.00 0.00 57.07 56.20 1ptt s TYR 66 Cb 0.24 -2.82 0.05 0.00 0.35 0.00 0.00 41.96 39.78 1ptt s TYR 66 CO 0.19 0.03 0.19 -1.50 -1.34 0.00 0.00 175.55 173.12 1ptt s ILE 67 N 1.03 -0.18 -0.76 3.14 2.07 -1.26 -4.89 121.20 120.35 1ptt s ILE 67 Ca 0.37 0.25 -0.26 0.00 -1.41 0.00 0.00 60.65 59.60 1ptt s ILE 67 Cb -0.17 -0.31 -0.08 0.00 0.13 0.00 0.00 42.46 42.02 1ptt s ILE 67 CO 0.17 0.10 2.15 0.21 -1.91 0.00 0.00 174.94 175.67 1ptt s ASN 68 N 1.77 4.64 -0.28 4.50 3.84 -1.26 -4.54 114.94 123.60 1ptt s ASN 68 Ca -0.03 -0.03 -0.24 0.00 0.21 0.00 0.00 52.86 52.76 1ptt s ASN 68 Cb -0.12 -2.54 0.13 0.00 -0.55 0.00 0.00 41.25 38.17 1ptt s ASN 68 CO -0.07 -3.09 1.06 0.00 -2.79 0.00 0.00 177.10 172.21 1ptt s ALA 69 N 11.83 -2.02 -0.06 1.71 0.00 -1.26 -3.47 121.76 128.49 1ptt s ALA 69 Ca 0.81 1.89 -0.00 0.00 0.00 0.00 0.00 51.96 54.66 1ptt s ALA 69 Cb -0.11 -1.49 0.02 0.00 0.00 0.00 0.00 23.12 21.54 1ptt s ALA 69 CO 0.09 -0.23 -0.02 -1.54 0.00 0.00 0.00 175.76 174.05 1ptt s SER 70 N 0.30 1.31 -0.05 0.00 1.04 -0.56 -1.12 113.70 114.62 1ptt s SER 70 Ca 0.03 -0.12 -0.30 0.00 0.48 0.00 0.00 55.95 56.04 1ptt s SER 70 Cb -0.05 -0.47 -0.06 0.00 0.10 0.00 0.00 66.02 65.55 1ptt s SER 70 CO -0.08 -0.12 1.68 -0.22 0.98 0.00 0.00 173.24 175.48 1ptt s LEU 71 N 1.46 4.31 -0.15 2.42 2.96 -0.22 -3.57 118.68 125.89 1ptt s LEU 71 Ca -0.03 2.24 -0.17 0.00 -0.22 0.00 0.00 54.13 55.96 1ptt s LEU 71 Cb -0.13 -3.53 -0.04 0.00 0.50 0.00 0.00 46.19 42.98 1ptt s LEU 71 CO -0.03 -0.96 0.44 -0.63 -1.32 0.00 0.00 176.35 173.85 1ptt s ILE 72 N 4.16 5.20 -0.20 6.68 1.09 -0.04 -4.87 121.20 133.21 1ptt s ILE 72 Ca 0.75 0.85 0.01 0.00 -1.10 0.00 0.00 60.65 61.15 1ptt s ILE 72 Cb -0.34 -3.78 0.04 0.00 -1.06 0.00 0.00 42.46 37.33 1ptt s ILE 72 CO 0.31 0.30 -0.09 -0.75 -0.10 0.00 0.00 174.94 174.61 1ptt s LYS 73 N 0.87 1.88 -0.27 2.79 2.36 -1.26 -1.95 119.74 124.16 1ptt s LYS 73 Ca 0.23 -0.81 -0.12 0.00 -2.55 0.00 0.00 55.97 52.73 1ptt s LYS 73 Cb -0.15 -2.37 -0.05 0.00 -1.05 0.00 0.00 37.83 34.22 1ptt s LYS 73 CO 0.09 -0.45 0.21 -1.64 1.55 0.00 0.00 175.35 175.11 1ptt s MET 74 N 1.44 3.99 -0.08 4.03 -1.94 0.34 -5.00 119.30 122.09 1ptt s MET 74 Ca -0.01 -0.24 -0.04 0.00 -1.71 0.00 0.00 55.69 53.68 1ptt s MET 74 Cb -0.16 -3.63 -0.02 0.00 2.01 0.00 0.00 34.83 33.03 1ptt s MET 74 CO -0.08 -0.13 0.16 1.49 -0.01 0.00 0.00 175.02 176.45 1ptt h GLU 75 N 8.11 -0.13 0.23 2.03 4.81 -1.96 -1.48 114.58 126.19 1ptt h GLU 75 Ca -0.35 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 58.88 1ptt h GLU 75 Cb 1.18 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1ptt h GLU 75 CO 0.59 -0.08 -0.11 1.49 -0.73 0.00 0.00 179.01 180.17 1ptt h GLU 76 N -1.04 -0.29 0.00 1.92 4.81 -1.97 -2.11 114.58 115.90 1ptt h GLU 76 Ca -0.01 0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1ptt h GLU 76 Cb 0.11 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.55 1ptt h GLU 76 CO 0.02 -0.17 -0.12 0.00 -0.73 0.00 0.00 179.01 178.02 1ptt h ALA 77 N 0.43 1.51 -4.63 2.92 0.00 -1.92 -3.47 119.26 114.09 1ptt h ALA 77 Ca -0.03 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.59 1ptt h ALA 77 Cb 0.26 -0.02 0.13 0.00 0.00 0.00 0.00 17.79 18.17 1ptt h ALA 77 CO 0.05 0.15 -0.57 1.04 0.00 0.00 0.00 179.25 179.92 1ptt n GLN 78 N -3.97 -1.99 -3.70 0.00 6.02 -0.80 -4.90 117.38 108.05 1ptt n GLN 78 Ca -0.02 0.59 -0.13 0.00 -0.01 0.00 0.00 57.00 57.43 1ptt n GLN 78 Cb 0.21 -4.50 -0.09 0.00 1.02 0.00 0.00 30.24 26.88 1ptt n GLN 78 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1ptt s ARG 79 N -4.10 0.57 0.08 -1.09 3.52 -0.59 -5.01 118.95 112.33 1ptt s ARG 79 Ca 0.26 0.73 0.08 0.00 -0.13 0.00 0.00 55.73 56.67 1ptt s ARG 79 Cb -0.03 0.24 -0.04 0.00 -1.56 0.00 0.00 34.95 33.56 1ptt s ARG 79 CO 0.50 -0.08 -0.16 -1.12 -0.81 0.00 0.00 175.30 173.62 1ptt s SER 80 N 0.47 3.96 0.04 -2.12 0.01 -1.26 -0.50 113.70 114.30 1ptt s SER 80 Ca -0.02 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.78 1ptt s SER 80 Cb -0.04 -0.64 -0.03 0.00 0.21 0.00 0.00 66.02 65.53 1ptt s SER 80 CO -0.02 0.21 -0.04 -0.31 0.41 0.00 0.00 173.24 173.49 1ptt s TYR 81 N -1.07 0.47 -0.41 2.43 2.02 -0.82 -4.27 117.35 115.71 1ptt s TYR 81 Ca 0.17 -0.68 0.03 0.00 -0.37 0.00 0.00 57.07 56.22 1ptt s TYR 81 Cb -0.11 -0.31 0.11 0.00 -0.40 0.00 0.00 41.96 41.25 1ptt s TYR 81 CO 0.09 -0.21 0.14 0.42 -1.57 0.00 0.00 175.55 174.42 1ptt s ILE 82 N -2.22 2.55 0.11 2.71 1.01 0.02 -0.86 121.20 124.52 1ptt s ILE 82 Ca -0.07 -2.58 -0.27 0.00 0.00 0.00 0.00 60.65 57.73 1ptt s ILE 82 Cb -0.04 -2.82 -0.06 0.00 0.01 0.00 0.00 42.46 39.54 1ptt s ILE 82 CO -0.03 -0.67 0.83 -0.76 0.00 0.00 0.00 174.94 174.31 1ptt s LEU 83 N 0.59 4.51 0.07 2.97 1.43 -1.23 -0.91 118.68 126.10 1ptt s LEU 83 Ca 0.12 1.62 -0.05 0.00 -1.03 0.00 0.00 54.13 54.80 1ptt s LEU 83 Cb -0.21 -3.36 -0.02 0.00 0.03 0.00 0.00 46.19 42.62 1ptt s LEU 83 CO -0.05 0.05 0.08 0.28 0.23 0.00 0.00 176.35 176.94 1ptt s THR 84 N -0.40 0.18 0.83 5.49 -1.32 -0.58 -1.50 115.64 118.33 1ptt s THR 84 Ca 0.40 -1.47 -0.10 0.00 -1.21 0.00 0.00 61.69 59.32 1ptt s THR 84 Cb -0.22 -1.38 0.14 0.00 -1.51 0.00 0.00 72.50 69.53 1ptt s THR 84 CO 0.26 -0.81 1.16 0.00 -2.21 0.00 0.00 174.62 173.02 1ptt s GLN 85 N -3.76 1.41 -0.23 7.08 -2.07 -1.23 -3.84 119.66 117.01 1ptt s GLN 85 Ca 0.05 -0.47 -0.29 0.00 -1.82 0.00 0.00 55.36 52.83 1ptt s GLN 85 Cb 0.06 -2.05 -0.01 0.00 -1.09 0.00 0.00 33.01 29.92 1ptt s GLN 85 CO -0.10 -1.82 1.32 0.20 -1.32 0.00 0.00 175.29 173.58 1ptt s GLY 86 N -4.73 1.47 0.31 2.60 0.00 0.03 -4.84 107.32 102.17 1ptt s GLY 86 Ca 0.67 0.29 -0.25 0.00 0.00 0.00 0.00 44.72 45.44 1ptt s GLY 86 CO 0.49 2.60 0.45 -1.05 0.00 0.00 0.00 173.10 175.58 1ptt n PRO 87 N 7.07 0.25 -2.67 2.90 -0.02 -1.26 -4.52 135.00 136.75 1ptt n PRO 87 Ca 0.15 0.09 -0.21 0.00 -2.02 0.00 0.00 63.50 61.51 1ptt n PRO 87 Cb 0.46 -1.19 0.03 0.00 -0.02 0.00 0.00 33.50 32.78 1ptt n PRO 87 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1ptt s LEU 88 N 2.89 3.30 0.23 2.45 1.43 -1.26 -1.95 118.68 125.77 1ptt s LEU 88 Ca 0.62 -0.00 -0.08 0.00 -1.03 0.00 0.00 54.13 53.64 1ptt s LEU 88 Cb -0.76 -2.88 0.37 0.00 0.03 0.00 0.00 46.19 42.95 1ptt s LEU 88 CO 0.59 -1.11 1.70 -0.65 0.23 0.00 0.00 176.35 177.11 1ptt h PRO 89 N 0.10 0.28 0.00 1.29 0.11 -1.97 -0.27 132.00 131.53 1ptt h PRO 89 Ca -0.42 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1ptt h PRO 89 Cb 1.29 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1ptt h PRO 89 CO 0.52 0.18 0.00 0.27 -0.21 0.00 0.00 178.00 178.77 1ptt n ASN 90 N -5.12 0.80 -0.57 -2.05 6.94 -1.26 -4.06 115.26 109.93 1ptt n ASN 90 Ca 0.11 0.62 0.05 0.00 -0.02 0.00 0.00 54.58 55.34 1ptt n ASN 90 Cb 0.38 -0.82 0.14 0.00 -2.36 0.00 0.00 39.78 37.12 1ptt n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1ptt n THR 91 N -2.29 1.09 0.31 5.53 -2.24 -0.15 -4.50 114.28 112.02 1ptt n THR 91 Ca 0.04 -1.06 0.15 0.00 -2.27 0.00 0.00 64.05 60.91 1ptt n THR 91 Cb 0.36 0.45 0.69 0.00 -2.10 0.00 0.00 70.33 69.73 1ptt n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ptt h GLY 93 N 1.39 0.23 1.00 0.00 0.00 -1.88 -2.91 103.07 100.90 1ptt h GLY 93 Ca 0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 1ptt h GLY 93 CO 0.00 0.34 0.30 0.45 0.00 0.00 0.00 176.54 177.63 1ptt h HIS 94 N -0.43 0.91 -0.74 5.60 3.86 -1.68 0.18 115.15 122.85 1ptt h HIS 94 Ca -0.03 -0.04 0.11 0.00 -1.16 0.00 0.00 60.37 59.24 1ptt h HIS 94 Cb 1.01 -0.28 -0.08 0.00 1.06 0.00 0.00 27.41 29.12 1ptt h HIS 94 CO 0.17 0.69 0.36 0.35 0.86 0.00 0.00 177.93 180.36 1ptt h PHE 95 N 0.87 0.64 0.00 2.45 3.04 -0.96 0.93 116.94 123.91 1ptt h PHE 95 Ca 0.22 0.03 -0.12 0.00 3.98 0.00 0.00 57.97 62.08 1ptt h PHE 95 Cb 0.12 -0.18 -0.02 0.00 2.56 0.00 0.00 35.95 38.44 1ptt h PHE 95 CO 0.00 0.20 -0.63 -1.49 -2.02 0.00 0.00 178.31 174.38 1ptt h TRP 96 N 0.59 0.00 0.87 0.41 4.06 -1.05 -2.00 115.95 118.82 1ptt h TRP 96 Ca 0.38 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.29 1ptt h TRP 96 Cb 0.45 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.62 1ptt h TRP 96 CO -0.11 0.55 -0.42 1.49 -3.56 0.00 0.00 178.44 176.40 1ptt h GLU 97 N 0.00 -1.12 -0.31 0.49 4.81 0.56 0.57 114.58 119.58 1ptt h GLU 97 Ca -0.02 0.08 0.07 0.00 -0.13 0.00 0.00 59.36 59.35 1ptt h GLU 97 Cb 1.44 0.26 -0.07 0.00 0.63 0.00 0.00 28.75 31.01 1ptt h GLU 97 CO 0.07 -0.74 -0.12 1.98 -0.73 0.00 0.00 179.01 179.46 1ptt h MET 98 N -1.21 -0.06 -0.49 1.92 4.05 -0.87 0.13 114.93 118.39 1ptt h MET 98 Ca -0.12 0.00 0.10 0.00 -0.28 0.00 0.00 59.70 59.40 1ptt h MET 98 Cb 0.90 0.01 -0.08 0.00 -0.80 0.00 0.00 31.60 31.63 1ptt h MET 98 CO 0.20 -0.04 -0.03 0.28 0.23 0.00 0.00 176.91 177.55 1ptt h VAL 99 N -0.07 0.59 -0.08 -5.77 2.07 -1.21 0.27 116.25 112.05 1ptt h VAL 99 Ca 0.16 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.65 1ptt h VAL 99 Cb 0.30 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1ptt h VAL 99 CO -0.35 0.02 0.05 -0.25 0.02 0.00 0.00 177.57 177.05 1ptt h TRP 100 N 0.09 0.11 -0.56 1.57 2.91 0.11 -2.83 115.95 117.34 1ptt h TRP 100 Ca 0.25 -0.00 -0.08 0.00 1.13 0.00 0.00 58.89 60.19 1ptt h TRP 100 Cb 0.38 -0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 28.97 1ptt h TRP 100 CO -0.33 0.12 0.02 0.93 -1.03 0.00 0.00 178.44 178.15 1ptt h GLU 101 N 0.06 0.94 0.00 2.65 5.08 0.39 -2.54 114.58 121.16 1ptt h GLU 101 Ca 0.03 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1ptt h GLU 101 Cb 0.04 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1ptt h GLU 101 CO -0.01 0.92 0.00 1.04 -1.00 0.00 0.00 179.01 179.96 1ptt n GLN 102 N -4.20 0.05 -2.66 2.33 1.13 0.83 -4.91 117.38 109.95 1ptt n GLN 102 Ca 0.03 0.17 -0.13 0.00 -1.94 0.00 0.00 57.00 55.13 1ptt n GLN 102 Cb 0.31 -1.58 0.02 0.00 0.11 0.00 0.00 30.24 29.10 1ptt n GLN 102 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1ptt n LYS 103 N -1.67 -2.69 -1.32 -1.09 5.02 -0.96 -3.80 118.16 111.65 1ptt n LYS 103 Ca 0.05 0.53 -0.31 0.00 -2.02 0.00 0.00 58.31 56.56 1ptt n LYS 103 Cb 0.27 -4.59 0.10 0.00 -0.02 0.00 0.00 35.03 30.79 1ptt n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ptt s SER 104 N -2.81 4.34 -0.01 4.39 0.01 -1.13 0.12 113.70 118.61 1ptt s SER 104 Ca 0.16 1.64 0.01 0.00 1.31 0.00 0.00 55.95 59.08 1ptt s SER 104 Cb -0.07 -2.37 0.02 0.00 0.21 0.00 0.00 66.02 63.82 1ptt s SER 104 CO 0.20 -2.11 0.80 -1.14 0.41 0.00 0.00 173.24 171.40 1ptt n ARG 105 N -3.56 0.32 -3.60 12.44 3.00 -1.26 -4.78 116.66 119.22 1ptt n ARG 105 Ca 0.08 -0.95 -0.12 0.00 -0.00 0.00 0.00 57.85 56.86 1ptt n ARG 105 Cb 0.54 -0.62 -0.06 0.00 0.00 0.00 0.00 32.46 32.32 1ptt n ARG 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1ptt s GLY 106 N -0.73 -0.31 0.05 5.14 0.00 -1.26 -3.46 107.32 106.74 1ptt s GLY 106 Ca 0.02 2.15 0.05 0.00 0.00 0.00 0.00 44.72 46.95 1ptt s GLY 106 CO 0.00 1.42 -0.15 0.14 0.00 0.00 0.00 173.10 174.51 1ptt s VAL 107 N -0.42 1.15 -0.16 1.40 1.01 -0.99 -2.51 120.40 119.89 1ptt s VAL 107 Ca -0.01 -1.09 -0.01 0.00 0.00 0.00 0.00 61.98 60.87 1ptt s VAL 107 Cb -0.03 -1.06 0.04 0.00 0.00 0.00 0.00 36.38 35.34 1ptt s VAL 107 CO -0.00 -0.04 -0.02 -0.69 0.00 0.00 0.00 175.10 174.35 1ptt s VAL 108 N -0.95 0.87 -0.32 2.92 1.01 -0.20 -1.18 120.40 122.55 1ptt s VAL 108 Ca 0.01 -0.51 -0.10 0.00 0.00 0.00 0.00 61.98 61.38 1ptt s VAL 108 Cb -0.08 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.17 1ptt s VAL 108 CO 0.02 0.07 0.16 -0.32 0.00 0.00 0.00 175.10 175.02 1ptt s MET 109 N 1.73 3.21 -0.28 2.72 0.00 0.13 -1.92 119.30 124.90 1ptt s MET 109 Ca 0.01 -0.81 0.12 0.00 0.00 0.00 0.00 55.69 55.01 1ptt s MET 109 Cb -0.15 -3.59 0.78 0.00 0.00 0.00 0.00 34.83 31.87 1ptt s MET 109 CO -0.07 -0.48 1.77 1.28 0.00 0.00 0.00 175.02 177.51 1ptt n LEU 110 N 4.98 5.83 -4.23 4.11 4.77 0.07 -0.75 117.00 131.78 1ptt n LEU 110 Ca -0.13 -3.08 -0.15 0.00 -0.03 0.00 0.00 56.01 52.61 1ptt n LEU 110 Cb 0.48 -0.71 -0.09 0.00 -2.33 0.00 0.00 43.42 40.78 1ptt n LEU 110 CO 0.34 0.72 -0.15 0.54 -1.33 0.00 0.00 177.39 177.51 1ptt s ASN 111 N -0.97 0.87 -0.06 -1.43 2.20 -1.24 -4.65 114.94 109.67 1ptt s ASN 111 Ca 0.54 -1.55 0.03 0.00 -0.94 0.00 0.00 52.86 50.94 1ptt s ASN 111 Cb 0.43 0.48 -0.03 0.00 -2.00 0.00 0.00 41.25 40.13 1ptt s ASN 111 CO 0.14 -0.97 -0.12 -0.13 -2.94 0.00 0.00 177.10 173.09 1ptt s ARG 112 N -3.78 2.59 0.59 3.55 0.52 -1.26 -4.84 118.95 116.32 1ptt s ARG 112 Ca 0.39 -0.64 0.29 0.00 -0.52 0.00 0.00 55.73 55.24 1ptt s ARG 112 Cb 0.04 -2.46 1.57 0.00 0.52 0.00 0.00 34.95 34.62 1ptt s ARG 112 CO 0.19 0.64 2.00 0.28 0.02 0.00 0.00 175.30 178.44 1ptt h VAL 113 N 4.30 0.42 -3.19 3.52 2.07 -1.93 -3.39 116.25 118.04 1ptt h VAL 113 Ca -0.47 0.00 -0.43 0.00 0.82 0.00 0.00 66.70 66.62 1ptt h VAL 113 Cb 1.16 0.73 -0.40 0.00 -1.52 0.00 0.00 31.29 31.26 1ptt h VAL 113 CO 0.51 0.00 -0.75 -0.32 0.02 0.00 0.00 177.57 177.03 1ptt s MET 114 N -4.63 0.12 -0.11 1.57 -2.45 -1.25 -1.04 119.30 111.51 1ptt s MET 114 Ca -0.04 0.09 0.01 0.00 -1.25 0.00 0.00 55.69 54.49 1ptt s MET 114 Cb 0.15 -1.25 0.02 0.00 1.25 0.00 0.00 34.83 35.00 1ptt s MET 114 CO 0.55 -0.49 -0.11 -1.21 1.05 0.00 0.00 175.02 174.81 1ptt s GLU 115 N 2.11 1.79 -1.32 4.11 2.02 0.13 -4.71 118.70 122.83 1ptt s GLU 115 Ca 0.03 -0.39 -0.10 0.00 0.02 0.00 0.00 54.97 54.54 1ptt s GLU 115 Cb -0.14 -1.67 0.00 0.00 0.10 0.00 0.00 34.13 32.42 1ptt s GLU 115 CO -0.06 -0.16 0.53 1.63 0.02 0.00 0.00 175.26 177.22 1ptt n LYS 116 N 4.52 -2.22 -1.47 1.61 5.02 -1.26 -0.78 118.16 123.58 1ptt n LYS 116 Ca -0.17 0.37 -0.15 0.00 -2.02 0.00 0.00 58.31 56.34 1ptt n LYS 116 Cb 0.51 -4.14 -0.06 0.00 -0.02 0.00 0.00 35.03 31.31 1ptt n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ptt n GLY 117 N -1.94 1.47 3.25 0.72 0.00 -1.26 -4.99 105.19 102.43 1ptt n GLY 117 Ca -0.23 -0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.26 1ptt n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ptt s SER 118 N -2.82 2.27 -0.16 1.61 0.01 0.04 -5.11 113.70 109.55 1ptt s SER 118 Ca 0.00 -0.64 -0.29 0.00 1.31 0.00 0.00 55.95 56.33 1ptt s SER 118 Cb 0.00 -0.12 -0.01 0.00 0.21 0.00 0.00 66.02 66.10 1ptt s SER 118 CO 0.00 0.03 1.15 -0.76 0.41 0.00 0.00 173.24 174.08 1ptt s LEU 119 N -1.75 4.18 -0.01 2.44 2.01 -1.26 0.18 118.68 124.48 1ptt s LEU 119 Ca 0.04 1.60 0.06 0.00 0.01 0.00 0.00 54.13 55.84 1ptt s LEU 119 Cb -0.10 -3.54 -0.10 0.00 0.01 0.00 0.00 46.19 42.46 1ptt s LEU 119 CO 0.03 -0.66 0.14 0.29 1.01 0.00 0.00 176.35 177.16 1ptt n LYS 120 N 6.06 0.22 -3.50 1.70 4.76 -0.21 -4.94 118.16 122.26 1ptt n LYS 120 Ca 0.12 -0.06 -0.16 0.00 -2.87 0.00 0.00 58.31 55.34 1ptt n LYS 120 Cb 0.46 -1.14 -0.05 0.00 -1.84 0.00 0.00 35.03 32.46 1ptt n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ptt s ALA 122 N -1.76 3.23 -1.18 0.00 0.00 -0.82 -4.54 121.76 116.68 1ptt s ALA 122 Ca -0.08 0.17 -0.21 0.00 0.00 0.00 0.00 51.96 51.85 1ptt s ALA 122 Cb -0.00 -2.90 0.01 0.00 0.00 0.00 0.00 23.12 20.23 1ptt s ALA 122 CO 0.05 0.26 1.76 -1.14 0.00 0.00 0.00 175.76 176.69 1ptt s GLN 123 N -2.98 3.39 0.00 0.00 2.00 -1.26 -4.71 119.66 116.09 1ptt s GLN 123 Ca 0.56 -1.47 0.21 0.00 -2.00 0.00 0.00 55.36 52.66 1ptt s GLN 123 Cb -0.10 -5.39 1.01 0.00 0.80 0.00 0.00 33.01 29.33 1ptt s GLN 123 CO 0.16 -2.82 1.68 2.48 -0.50 0.00 0.00 175.29 176.29 1ptt n TYR 124 N 10.60 0.09 -3.93 1.67 4.11 -1.26 -4.84 117.16 123.60 1ptt n TYR 124 Ca 0.44 -0.04 -0.10 0.00 -0.00 0.00 0.00 57.90 58.20 1ptt n TYR 124 Cb 0.47 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.70 1ptt n TYR 124 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.86 178.53 1ptt s TRP 125 N -1.91 0.14 0.45 -3.48 -2.14 -1.26 -5.06 118.94 105.68 1ptt s TRP 125 Ca 0.32 -0.29 -0.25 0.00 2.66 0.00 0.00 56.10 58.54 1ptt s TRP 125 Cb 0.16 -0.11 -0.08 0.00 -3.10 0.00 0.00 33.47 30.34 1ptt s TRP 125 CO 0.25 -0.17 1.43 -1.25 -2.66 0.00 0.00 176.95 174.55 1ptt s PRO 126 N -1.09 3.66 -0.03 3.25 0.04 -1.26 -4.96 135.00 134.61 1ptt s PRO 126 Ca -0.12 2.42 0.20 0.00 0.04 0.00 0.00 61.00 63.54 1ptt s PRO 126 Cb -0.07 -2.64 -0.31 0.00 0.04 0.00 0.00 34.50 31.52 1ptt s PRO 126 CO -0.00 -0.84 0.47 1.04 0.04 0.00 0.00 177.00 177.71 1ptt n GLN 127 N -0.23 0.60 -5.23 4.56 6.02 -1.26 -4.77 117.38 117.07 1ptt n GLN 127 Ca 0.05 -0.17 -0.31 0.00 -0.01 0.00 0.00 57.00 56.56 1ptt n GLN 127 Cb 0.42 -1.47 -0.17 0.00 1.02 0.00 0.00 30.24 30.04 1ptt n GLN 127 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1ptt s LYS 128 N -3.36 2.62 0.67 -1.09 1.02 -1.26 -5.04 119.74 113.29 1ptt s LYS 128 Ca -0.06 -0.88 0.44 0.00 0.02 0.00 0.00 55.97 55.49 1ptt s LYS 128 Cb 0.13 -2.16 2.42 0.00 -0.52 0.00 0.00 37.83 37.70 1ptt s LYS 128 CO 0.84 0.33 2.36 1.05 -0.92 0.00 0.00 175.35 179.01 1ptt h GLU 129 N 6.22 0.00 -0.00 1.68 9.09 -1.93 -1.63 114.58 128.01 1ptt h GLU 129 Ca -0.29 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.12 1ptt h GLU 129 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.29 1ptt h GLU 129 CO 0.47 0.00 -0.18 0.39 0.05 0.00 0.00 179.01 179.74 1ptt n GLU 130 N -3.07 0.44 -3.87 1.06 4.71 -1.26 -4.54 120.64 114.11 1ptt n GLU 130 Ca -0.03 -0.17 -0.30 0.00 -0.01 0.00 0.00 57.16 56.65 1ptt n GLU 130 Cb 0.08 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 28.87 1ptt n GLU 130 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 1ptt s LYS 131 N -2.67 1.66 0.85 3.49 -0.14 -0.61 -5.11 119.74 117.20 1ptt s LYS 131 Ca 0.22 -2.30 -0.13 0.00 -1.36 0.00 0.00 55.97 52.41 1ptt s LYS 131 Cb 0.19 -2.93 0.11 0.00 -1.68 0.00 0.00 37.83 33.52 1ptt s LYS 131 CO 0.53 -1.11 1.21 -1.21 -0.76 0.00 0.00 175.35 174.01 1ptt s GLU 132 N 0.09 1.64 0.02 1.68 8.01 -1.26 -4.69 118.70 124.20 1ptt s GLU 132 Ca 0.16 0.01 0.08 0.00 0.01 0.00 0.00 54.97 55.24 1ptt s GLU 132 Cb -0.25 -1.92 -0.02 0.00 -4.31 0.00 0.00 34.13 27.63 1ptt s GLU 132 CO -0.01 -1.80 -0.25 -1.64 0.01 0.00 0.00 175.26 171.57 1ptt s MET 133 N -5.63 1.77 -0.21 1.61 -1.94 -0.41 -4.99 119.30 109.50 1ptt s MET 133 Ca 0.65 -1.00 -0.02 0.00 -1.71 0.00 0.00 55.69 53.61 1ptt s MET 133 Cb -0.10 -1.86 0.06 0.00 2.01 0.00 0.00 34.83 34.94 1ptt s MET 133 CO 0.50 0.49 0.01 0.42 -0.01 0.00 0.00 175.02 176.43 1ptt s ILE 134 N -0.73 0.87 -0.81 2.53 1.01 -1.26 -1.46 121.20 121.34 1ptt s ILE 134 Ca 0.10 -0.81 -0.24 0.00 0.00 0.00 0.00 60.65 59.70 1ptt s ILE 134 Cb -0.10 -1.31 0.06 0.00 0.01 0.00 0.00 42.46 41.12 1ptt s ILE 134 CO 0.01 -0.20 1.23 -0.36 0.00 0.00 0.00 174.94 175.62 1ptt s PHE 135 N 1.70 2.54 0.09 3.97 0.08 0.06 -4.92 117.98 121.49 1ptt s PHE 135 Ca -0.02 -0.53 -0.36 0.00 0.12 0.00 0.00 56.93 56.14 1ptt s PHE 135 Cb -0.18 -4.53 -0.17 0.00 -0.57 0.00 0.00 43.02 37.58 1ptt s PHE 135 CO -0.08 -1.87 1.57 0.93 -0.10 0.00 0.00 175.22 175.66 1ptt h GLU 136 N 9.72 -0.96 -0.64 0.44 5.08 -1.97 0.43 114.58 126.69 1ptt h GLU 136 Ca -0.11 0.07 0.13 0.00 -1.00 0.00 0.00 59.36 58.45 1ptt h GLU 136 Cb 1.04 0.22 -0.11 0.00 0.50 0.00 0.00 28.75 30.40 1ptt h GLU 136 CO 1.27 -0.64 -0.00 0.38 -1.00 0.00 0.00 179.01 179.02 1ptt h ASP 137 N -1.00 -0.29 -0.66 1.42 2.03 -1.98 -1.18 116.42 114.77 1ptt h ASP 137 Ca -0.06 0.16 0.00 0.00 -0.73 0.00 0.00 57.03 56.40 1ptt h ASP 137 Cb 0.87 0.28 0.00 0.00 -0.83 0.00 0.00 39.33 39.65 1ptt h ASP 137 CO -0.07 -0.12 0.00 0.35 -1.03 0.00 0.00 179.24 178.37 1ptt n THR 138 N -5.29 0.87 -3.71 1.15 -2.24 -1.18 -4.99 114.28 98.89 1ptt n THR 138 Ca 0.10 -0.93 -0.29 0.00 -2.27 0.00 0.00 64.05 60.66 1ptt n THR 138 Cb 0.37 0.62 0.03 0.00 -2.10 0.00 0.00 70.33 69.25 1ptt n THR 138 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ptt n ASN 139 N 1.64 -4.09 -4.18 3.42 2.85 0.15 -4.94 115.26 110.10 1ptt n ASN 139 Ca 0.24 -0.98 -0.14 0.00 -0.11 0.00 0.00 54.58 53.58 1ptt n ASN 139 Cb 0.62 -3.49 -0.11 0.00 1.24 0.00 0.00 39.78 38.04 1ptt n ASN 139 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1ptt s LEU 140 N -6.52 2.41 -0.07 1.20 1.43 -0.92 -2.83 118.68 113.38 1ptt s LEU 140 Ca 0.34 -0.83 0.03 0.00 -1.03 0.00 0.00 54.13 52.65 1ptt s LEU 140 Cb -0.12 -0.30 0.01 0.00 0.03 0.00 0.00 46.19 45.81 1ptt s LEU 140 CO 0.85 -0.27 -0.16 -0.75 0.23 0.00 0.00 176.35 176.25 1ptt s LYS 141 N -2.87 2.03 -0.02 1.70 2.20 -0.48 -0.76 119.74 121.54 1ptt s LYS 141 Ca 0.06 -0.56 0.05 0.00 -0.36 0.00 0.00 55.97 55.16 1ptt s LYS 141 Cb -0.02 -1.64 -0.01 0.00 -1.51 0.00 0.00 37.83 34.64 1ptt s LYS 141 CO -0.00 0.11 -0.18 -1.17 -0.36 0.00 0.00 175.35 173.75 1ptt s LEU 142 N 0.45 2.00 -0.05 5.43 2.96 -0.54 -0.47 118.68 128.46 1ptt s LEU 142 Ca -0.13 -0.34 -0.04 0.00 -0.22 0.00 0.00 54.13 53.39 1ptt s LEU 142 Cb -0.15 -0.96 0.01 0.00 0.50 0.00 0.00 46.19 45.59 1ptt s LEU 142 CO 0.05 0.20 0.13 -0.89 -1.32 0.00 0.00 176.35 174.52 1ptt s THR 143 N -0.28 0.00 0.21 3.68 2.01 -0.86 -1.29 115.64 119.11 1ptt s THR 143 Ca 0.04 -0.02 -0.30 0.00 0.31 0.00 0.00 61.69 61.72 1ptt s THR 143 Cb -0.09 -0.19 -0.08 0.00 0.01 0.00 0.00 72.50 72.15 1ptt s THR 143 CO 0.00 -0.01 1.06 -0.22 -0.69 0.00 0.00 174.62 174.76 1ptt s LEU 144 N 0.03 4.53 -0.08 4.42 2.96 -1.26 -1.42 118.68 127.85 1ptt s LEU 144 Ca -0.00 2.08 0.03 0.00 -0.22 0.00 0.00 54.13 56.01 1ptt s LEU 144 Cb -0.01 -3.61 -0.07 0.00 0.50 0.00 0.00 46.19 43.00 1ptt s LEU 144 CO 0.00 -0.12 -0.04 -0.38 -1.32 0.00 0.00 176.35 174.49 1ptt n ILE 145 N 1.96 0.51 -3.70 6.68 -0.00 -0.07 -4.71 119.36 120.04 1ptt n ILE 145 Ca 0.01 -0.23 -0.08 0.00 -0.00 0.00 0.00 62.75 62.44 1ptt n ILE 145 Cb 0.46 -0.82 0.01 0.00 -0.00 0.00 0.00 39.64 39.30 1ptt n ILE 145 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 1ptt n SER 146 N -2.59 -1.73 -3.59 4.38 3.41 -1.19 -4.99 113.62 107.31 1ptt n SER 146 Ca -0.15 -2.34 -0.02 0.00 -0.26 0.00 0.00 58.87 56.10 1ptt n SER 146 Cb 0.69 2.93 -0.05 0.00 -0.26 0.00 0.00 64.21 67.52 1ptt n SER 146 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1ptt s GLU 147 N -2.18 0.52 -0.81 4.33 2.12 -1.26 -3.11 118.70 118.31 1ptt s GLU 147 Ca 0.15 1.12 -0.01 0.00 0.36 0.00 0.00 54.97 56.60 1ptt s GLU 147 Cb -0.03 0.48 0.20 0.00 0.26 0.00 0.00 34.13 35.03 1ptt s GLU 147 CO 0.11 -0.15 0.66 0.34 -0.54 0.00 0.00 175.26 175.68 1ptt s ASP 148 N 2.24 5.62 0.03 -1.70 2.15 -0.30 -5.00 116.67 119.72 1ptt s ASP 148 Ca -0.07 -3.58 -0.30 0.00 0.43 0.00 0.00 52.55 49.03 1ptt s ASP 148 Cb -0.08 -1.84 -0.07 0.00 -0.30 0.00 0.00 42.92 40.63 1ptt s ASP 148 CO -0.18 -0.20 1.54 -0.63 -0.17 0.00 0.00 175.17 175.53 1ptt s ILE 149 N -1.12 3.36 0.00 4.11 1.01 -1.26 -3.01 121.20 124.28 1ptt s ILE 149 Ca 0.25 0.77 0.00 0.00 0.00 0.00 0.00 60.65 61.67 1ptt s ILE 149 Cb -0.09 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.88 1ptt s ILE 149 CO -0.11 -0.00 0.00 0.29 0.00 0.00 0.00 174.94 175.11 1ptt n LYS 150 N 5.54 2.33 0.05 2.79 4.01 -0.21 -5.01 118.16 127.65 1ptt n LYS 150 Ca 0.15 0.00 -0.13 0.00 -0.51 0.00 0.00 58.31 57.82 1ptt n LYS 150 Cb 0.42 0.00 -0.08 0.00 -0.51 0.00 0.00 35.03 34.86 1ptt n LYS 150 CO 0.00 0.00 0.00 1.15 -1.11 0.00 0.00 177.40 177.44 1ptt h THR 151 N 0.60 1.09 -0.00 -0.18 2.02 -1.80 -3.37 112.91 111.27 1ptt h THR 151 Ca 0.00 -0.55 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1ptt h THR 151 Cb 0.00 1.45 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1ptt h THR 151 CO 0.00 0.14 -0.00 0.00 0.37 0.00 0.00 175.52 176.03 1ptt n TYR 152 N -5.02 0.00 -4.17 3.16 4.11 -1.26 -5.03 117.16 108.96 1ptt n TYR 152 Ca -0.08 0.00 -0.14 0.00 -0.00 0.00 0.00 57.90 57.67 1ptt n TYR 152 Cb 0.17 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.43 1ptt n TYR 152 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.86 178.38 1ptt s TYR 153 N -0.62 1.19 -0.20 -3.48 1.13 -1.26 -1.57 117.35 112.55 1ptt s TYR 153 Ca 0.00 -1.35 -0.15 0.00 -1.41 0.00 0.00 57.07 54.17 1ptt s TYR 153 Cb 0.00 -0.38 0.06 0.00 -1.10 0.00 0.00 41.96 40.54 1ptt s TYR 153 CO 0.00 -0.88 0.51 0.99 -2.51 0.00 0.00 175.55 173.66 1ptt s THR 154 N -3.67 -0.01 0.11 -3.49 2.01 -0.51 -1.05 115.64 109.03 1ptt s THR 154 Ca 0.35 0.03 0.02 0.00 0.31 0.00 0.00 61.69 62.41 1ptt s THR 154 Cb 0.03 -0.72 -0.04 0.00 0.01 0.00 0.00 72.50 71.78 1ptt s THR 154 CO 0.18 0.01 0.18 -0.69 -0.69 0.00 0.00 174.62 173.61 1ptt s VAL 155 N 0.83 4.96 0.04 3.82 1.01 -1.17 0.45 120.40 130.35 1ptt s VAL 155 Ca -0.05 -0.71 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1ptt s VAL 155 Cb -0.05 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1ptt s VAL 155 CO -0.07 0.02 -0.01 -0.13 0.00 0.00 0.00 175.10 174.92 1ptt s ARG 156 N -2.79 0.55 -0.26 2.72 0.52 -0.34 -1.15 118.95 118.20 1ptt s ARG 156 Ca 0.33 -1.04 0.02 0.00 -0.52 0.00 0.00 55.73 54.51 1ptt s ARG 156 Cb -0.12 0.20 0.07 0.00 0.52 0.00 0.00 34.95 35.62 1ptt s ARG 156 CO 0.26 -0.11 -0.04 -1.14 0.02 0.00 0.00 175.30 174.29 1ptt s GLN 157 N -3.28 1.68 0.30 3.54 0.74 -1.18 -0.90 119.66 120.56 1ptt s GLN 157 Ca 0.01 -1.21 0.07 0.00 0.05 0.00 0.00 55.36 54.27 1ptt s GLN 157 Cb 0.03 -2.71 -0.03 0.00 1.10 0.00 0.00 33.01 31.41 1ptt s GLN 157 CO -0.08 -0.67 0.32 -0.51 -0.55 0.00 0.00 175.29 173.81 1ptt s LEU 158 N 1.27 3.85 -0.22 3.68 1.43 0.57 -0.89 118.68 128.38 1ptt s LEU 158 Ca -0.03 -0.27 -0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1ptt s LEU 158 Cb -0.19 -2.48 0.06 0.00 0.03 0.00 0.00 46.19 43.61 1ptt s LEU 158 CO -0.08 -0.26 -0.03 -0.70 0.23 0.00 0.00 176.35 175.51 1ptt s GLU 159 N -4.00 1.38 -0.23 1.70 2.12 -0.51 0.22 118.70 119.38 1ptt s GLU 159 Ca 0.39 -0.80 -0.13 0.00 0.36 0.00 0.00 54.97 54.80 1ptt s GLU 159 Cb -0.08 -2.41 -0.05 0.00 0.26 0.00 0.00 34.13 31.86 1ptt s GLU 159 CO 0.28 -0.58 0.25 -1.17 -0.54 0.00 0.00 175.26 173.50 1ptt s LEU 160 N 1.53 4.13 -0.09 2.70 2.96 0.23 -2.02 118.68 128.13 1ptt s LEU 160 Ca -0.04 0.27 0.04 0.00 -0.22 0.00 0.00 54.13 54.18 1ptt s LEU 160 Cb -0.18 -2.27 0.00 0.00 0.50 0.00 0.00 46.19 44.25 1ptt s LEU 160 CO -0.07 0.01 -0.21 -0.70 -1.32 0.00 0.00 176.35 174.06 1ptt s GLU 161 N 1.17 2.66 -0.75 1.98 2.12 0.37 0.20 118.70 126.45 1ptt s GLU 161 Ca 0.12 -0.75 -0.25 0.00 0.36 0.00 0.00 54.97 54.45 1ptt s GLU 161 Cb -0.14 -2.05 0.05 0.00 0.26 0.00 0.00 34.13 32.25 1ptt s GLU 161 CO 0.06 0.15 1.17 1.21 -0.54 0.00 0.00 175.26 177.31 1ptt s ASN 162 N 0.41 6.22 0.56 -1.70 2.47 0.88 -1.38 114.94 122.39 1ptt s ASN 162 Ca -0.17 -0.84 0.27 0.00 0.42 0.00 0.00 52.86 52.54 1ptt s ASN 162 Cb -0.17 -2.50 1.45 0.00 -1.45 0.00 0.00 41.25 38.57 1ptt s ASN 162 CO 0.07 -1.62 1.79 -0.07 -3.72 0.00 0.00 177.10 173.55 1ptt h LEU 163 N 12.25 0.00 0.09 3.21 3.38 -1.82 1.47 115.31 133.89 1ptt h LEU 163 Ca -0.21 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.61 1ptt h LEU 163 Cb 1.05 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.81 1ptt h LEU 163 CO 1.25 0.00 -0.72 0.74 0.09 0.00 0.00 178.44 179.80 1ptt h THR 164 N 0.00 1.47 -0.29 0.22 2.02 -1.89 -3.32 112.91 111.12 1ptt h THR 164 Ca 0.00 -2.44 0.00 0.00 0.77 0.00 0.00 66.41 64.74 1ptt h THR 164 Cb 0.55 3.11 0.00 0.00 -1.74 0.00 0.00 68.15 70.07 1ptt h THR 164 CO 0.00 0.66 0.00 0.35 0.37 0.00 0.00 175.52 176.90 1ptt n THR 165 N -4.24 0.41 -3.51 3.16 -2.24 -0.59 -4.94 114.28 102.34 1ptt n THR 165 Ca -0.16 -0.70 -0.26 0.00 -2.27 0.00 0.00 64.05 60.66 1ptt n THR 165 Cb 0.74 1.06 0.01 0.00 -2.10 0.00 0.00 70.33 70.03 1ptt n THR 165 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 1ptt n GLN 166 N 1.30 -4.36 -3.94 -0.78 7.27 0.49 -4.94 117.38 112.43 1ptt n GLN 166 Ca 0.16 0.59 -0.32 0.00 0.07 0.00 0.00 57.00 57.51 1ptt n GLN 166 Cb 0.55 -5.39 -0.05 0.00 2.41 0.00 0.00 30.24 27.77 1ptt n GLN 166 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 1ptt s GLU 167 N -6.18 3.36 0.12 3.69 -6.30 -1.14 -4.89 118.70 107.35 1ptt s GLU 167 Ca 0.48 -0.42 0.08 0.00 -2.50 0.00 0.00 54.97 52.60 1ptt s GLU 167 Cb -0.24 -3.02 -0.04 0.00 0.00 0.00 0.00 34.13 30.83 1ptt s GLU 167 CO 0.59 0.63 -0.18 0.99 0.02 0.00 0.00 175.26 177.31 1ptt s THR 168 N -1.41 1.60 -0.06 -1.70 2.01 -1.26 -0.09 115.64 114.74 1ptt s THR 168 Ca 0.31 -1.65 -0.13 0.00 0.31 0.00 0.00 61.69 60.53 1ptt s THR 168 Cb -0.13 -1.58 0.03 0.00 0.01 0.00 0.00 72.50 70.83 1ptt s THR 168 CO 0.23 -0.22 0.30 -0.13 -0.69 0.00 0.00 174.62 174.12 1ptt s ARG 169 N -2.28 0.53 -0.31 4.92 0.52 0.13 -4.98 118.95 117.49 1ptt s ARG 169 Ca 0.08 0.06 -0.14 0.00 -0.52 0.00 0.00 55.73 55.22 1ptt s ARG 169 Cb -0.08 0.24 -0.03 0.00 0.52 0.00 0.00 34.95 35.61 1ptt s ARG 169 CO 0.04 -0.12 0.30 -2.00 0.02 0.00 0.00 175.30 173.54 1ptt s GLU 170 N -0.70 3.77 -0.31 3.54 2.12 -1.26 0.77 118.70 126.62 1ptt s GLU 170 Ca -0.08 -0.31 -0.11 0.00 0.36 0.00 0.00 54.97 54.82 1ptt s GLU 170 Cb -0.04 -3.73 -0.02 0.00 0.26 0.00 0.00 34.13 30.60 1ptt s GLU 170 CO 0.02 -0.36 0.20 0.42 -0.54 0.00 0.00 175.26 175.00 1ptt s ILE 171 N 1.92 5.08 0.43 -3.70 -1.09 0.13 -4.90 121.20 119.06 1ptt s ILE 171 Ca 0.10 -0.17 -0.21 0.00 -2.23 0.00 0.00 60.65 58.14 1ptt s ILE 171 Cb -0.16 -3.54 -0.11 0.00 -1.58 0.00 0.00 42.46 37.07 1ptt s ILE 171 CO 0.11 0.09 0.96 -0.76 -1.23 0.00 0.00 174.94 174.11 1ptt s LEU 172 N 1.70 3.96 -0.12 2.97 1.43 -1.22 -0.31 118.68 127.08 1ptt s LEU 172 Ca 0.06 1.74 -0.01 0.00 -1.03 0.00 0.00 54.13 54.89 1ptt s LEU 172 Cb -0.17 -4.50 0.04 0.00 0.03 0.00 0.00 46.19 41.59 1ptt s LEU 172 CO 0.09 -0.39 -0.01 -2.28 0.23 0.00 0.00 176.35 173.99 1ptt s HIS 173 N -2.10 1.03 -0.24 0.29 2.46 -0.08 -2.34 115.29 114.31 1ptt s HIS 173 Ca 0.62 -0.55 -0.10 0.00 0.47 0.00 0.00 55.06 55.50 1ptt s HIS 173 Cb -0.11 -1.00 -0.04 0.00 -0.13 0.00 0.00 32.58 31.30 1ptt s HIS 173 CO 0.15 -0.47 0.14 -0.06 -2.47 0.00 0.00 174.74 172.03 1ptt s PHE 174 N 1.85 3.24 -0.27 3.88 0.08 -0.33 -1.20 117.98 125.24 1ptt s PHE 174 Ca 0.03 0.06 0.02 0.00 0.12 0.00 0.00 56.93 57.17 1ptt s PHE 174 Cb -0.14 -2.26 0.07 0.00 -0.57 0.00 0.00 43.02 40.12 1ptt s PHE 174 CO -0.07 -0.06 -0.04 -1.58 -0.10 0.00 0.00 175.22 173.37 1ptt s HIS 175 N 1.24 3.05 -0.11 0.36 2.46 0.17 -0.69 115.29 121.77 1ptt s HIS 175 Ca 0.06 -2.29 -0.28 0.00 0.47 0.00 0.00 55.06 53.02 1ptt s HIS 175 Cb -0.14 -2.05 -0.02 0.00 -0.13 0.00 0.00 32.58 30.24 1ptt s HIS 175 CO 0.05 -0.87 0.94 -0.47 -2.47 0.00 0.00 174.74 171.93 1ptt s TYR 176 N 1.17 3.51 -0.21 3.88 6.14 0.07 -1.42 117.35 130.48 1ptt s TYR 176 Ca -0.02 1.50 0.02 0.00 0.64 0.00 0.00 57.07 59.21 1ptt s TYR 176 Cb -0.19 -3.11 0.06 0.00 0.42 0.00 0.00 41.96 39.14 1ptt s TYR 176 CO -0.07 -0.18 0.98 0.25 0.64 0.00 0.00 175.55 177.17 1ptt n THR 177 N 4.46 0.85 -2.10 4.34 -2.24 -0.61 -3.70 114.28 115.28 1ptt n THR 177 Ca 0.07 -0.92 0.01 0.00 -2.27 0.00 0.00 64.05 60.93 1ptt n THR 177 Cb 0.49 0.58 0.10 0.00 -2.10 0.00 0.00 70.33 69.41 1ptt n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ptt n THR 178 N -0.22 1.36 -3.79 4.28 -2.24 -1.21 -4.94 114.28 107.52 1ptt n THR 178 Ca 0.02 -2.53 -0.36 0.00 -2.27 0.00 0.00 64.05 58.92 1ptt n THR 178 Cb 0.25 0.26 -0.12 0.00 -2.10 0.00 0.00 70.33 68.62 1ptt n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1ptt s TRP 179 N -2.18 3.60 0.50 4.78 -0.11 -1.26 -4.54 118.94 119.72 1ptt s TRP 179 Ca 0.37 -2.45 -0.23 0.00 1.22 0.00 0.00 56.10 55.01 1ptt s TRP 179 Cb 0.38 -3.21 -0.06 0.00 -1.50 0.00 0.00 33.47 29.07 1ptt s TRP 179 CO -0.09 -0.97 1.32 -2.14 -4.62 0.00 0.00 176.95 170.45 1ptt s PRO 180 N 1.11 3.45 0.23 5.86 0.02 -1.26 -4.79 135.00 139.61 1ptt s PRO 180 Ca 0.09 2.16 -0.32 0.00 0.02 0.00 0.00 61.00 62.95 1ptt s PRO 180 Cb -0.23 -2.41 -0.13 0.00 0.02 0.00 0.00 34.50 31.76 1ptt s PRO 180 CO -0.04 -0.92 1.61 -3.47 -0.33 0.00 0.00 177.00 173.84 1ptt n ASP 181 N -0.66 3.58 -2.78 2.53 2.03 -1.26 0.46 116.55 120.45 1ptt n ASP 181 Ca 0.08 1.10 -0.22 0.00 0.52 0.00 0.00 54.79 56.28 1ptt n ASP 181 Cb 0.45 -1.53 0.02 0.00 -0.72 0.00 0.00 41.12 39.35 1ptt n ASP 181 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1ptt n PHE 182 N 3.01 -1.67 -4.54 -0.67 3.01 -1.26 -4.98 117.46 110.36 1ptt n PHE 182 Ca 0.13 0.37 -0.25 0.00 1.01 0.00 0.00 57.45 58.71 1ptt n PHE 182 Cb 0.34 -4.31 -0.06 0.00 -0.01 0.00 0.00 39.48 35.43 1ptt n PHE 182 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ptt n GLY 183 N -1.38 3.44 3.34 1.37 0.00 0.17 -5.02 105.19 107.13 1ptt n GLY 183 Ca -0.15 -2.20 -0.21 0.00 0.00 0.00 0.00 46.02 43.46 1ptt n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ptt s VAL 184 N -2.82 1.84 0.41 1.61 -7.23 -1.26 -4.81 120.40 108.14 1ptt s VAL 184 Ca 0.11 -2.02 -0.26 0.00 -1.81 0.00 0.00 61.98 58.00 1ptt s VAL 184 Cb 0.01 -1.92 -0.09 0.00 0.56 0.00 0.00 36.38 34.93 1ptt s VAL 184 CO 0.08 -0.39 1.37 -2.84 -0.31 0.00 0.00 175.10 173.01 1ptt s PRO 185 N -3.05 3.93 0.52 4.82 0.02 -1.26 -4.66 135.00 135.32 1ptt s PRO 185 Ca 0.18 2.32 0.41 0.00 0.02 0.00 0.00 61.00 63.93 1ptt s PRO 185 Cb -0.04 -2.79 1.61 0.00 0.02 0.00 0.00 34.50 33.30 1ptt s PRO 185 CO 0.07 -0.58 1.63 1.05 -0.33 0.00 0.00 177.00 178.84 1ptt h GLU 186 N 2.67 0.03 -1.66 5.54 9.09 -1.99 -3.42 114.58 124.84 1ptt h GLU 186 Ca -0.50 -0.00 0.16 0.00 0.05 0.00 0.00 59.36 59.07 1ptt h GLU 186 Cb 1.25 -0.01 -0.20 0.00 -1.65 0.00 0.00 28.75 28.14 1ptt h GLU 186 CO 0.63 0.02 0.67 -1.54 0.05 0.00 0.00 179.01 178.83 1ptt s SER 187 N -4.31 -0.25 0.39 3.06 1.04 -1.26 -4.98 113.70 107.39 1ptt s SER 187 Ca -0.06 0.12 0.13 0.00 0.48 0.00 0.00 55.95 56.63 1ptt s SER 187 Cb 0.27 0.24 0.96 0.00 0.10 0.00 0.00 66.02 67.59 1ptt s SER 187 CO 0.86 -0.34 1.87 -0.65 0.98 0.00 0.00 173.24 175.95 1ptt h PRO 188 N 2.17 0.52 0.28 4.02 0.11 -1.96 -1.48 132.00 135.66 1ptt h PRO 188 Ca -0.15 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.92 1ptt h PRO 188 Cb 1.19 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1ptt h PRO 188 CO 0.27 0.34 -0.13 0.00 -0.21 0.00 0.00 178.00 178.27 1ptt h ALA 189 N 1.62 -0.37 -0.65 -0.75 0.00 -1.94 0.22 119.26 117.37 1ptt h ALA 189 Ca 0.45 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 55.28 1ptt h ALA 189 Cb 0.92 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.81 1ptt h ALA 189 CO -0.19 -0.66 0.39 0.77 0.00 0.00 0.00 179.25 179.56 1ptt h SER 190 N -0.47 0.60 0.62 0.00 0.02 -1.63 0.77 113.55 113.47 1ptt h SER 190 Ca -0.04 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.90 1ptt h SER 190 Cb 0.35 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 62.79 1ptt h SER 190 CO 0.06 0.41 -0.30 0.15 -1.14 0.00 0.00 176.83 176.01 1ptt h PHE 191 N 0.74 -0.77 -0.18 3.45 3.57 -1.12 -1.58 116.94 121.04 1ptt h PHE 191 Ca 0.28 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.75 1ptt h PHE 191 Cb 0.10 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1ptt h PHE 191 CO -0.06 -0.43 0.09 -0.07 -2.23 0.00 0.00 178.31 175.60 1ptt h LEU 192 N -1.08 0.21 -0.15 0.59 3.38 -0.49 0.55 115.31 118.33 1ptt h LEU 192 Ca -0.09 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1ptt h LEU 192 Cb 0.69 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1ptt h LEU 192 CO 0.14 0.18 0.04 -1.13 0.09 0.00 0.00 178.44 177.76 1ptt h ASN 193 N 0.24 0.22 -0.51 -0.43 -1.24 -0.74 0.13 115.58 113.26 1ptt h ASN 193 Ca 0.06 -0.22 -0.05 0.00 0.71 0.00 0.00 56.30 56.81 1ptt h ASN 193 Cb 0.02 -0.06 -0.03 0.00 0.73 0.00 0.00 38.32 38.99 1ptt h ASN 193 CO -0.01 0.38 0.16 0.15 -1.29 0.00 0.00 177.43 176.82 1ptt h PHE 194 N 0.04 0.87 0.23 0.67 3.57 -0.13 -1.91 116.94 120.29 1ptt h PHE 194 Ca 0.05 -0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 1ptt h PHE 194 Cb 0.25 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1ptt h PHE 194 CO 0.00 0.71 -0.11 1.25 -2.23 0.00 0.00 178.31 177.93 1ptt h LEU 195 N 0.82 -0.27 -1.70 0.59 6.46 0.39 -2.81 115.31 118.79 1ptt h LEU 195 Ca 0.18 -0.14 0.01 0.00 -0.12 0.00 0.00 57.88 57.81 1ptt h LEU 195 Cb 0.26 0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.25 1ptt h LEU 195 CO -0.01 -0.01 0.21 -0.26 -0.62 0.00 0.00 178.44 177.76 1ptt h PHE 196 N -0.53 0.39 0.49 1.25 -1.00 -0.78 -1.22 116.94 115.53 1ptt h PHE 196 Ca -0.03 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.74 1ptt h PHE 196 Cb 0.39 -0.13 -0.00 0.00 3.61 0.00 0.00 35.95 39.82 1ptt h PHE 196 CO -0.00 0.24 -0.27 -0.22 -1.61 0.00 0.00 178.31 176.45 1ptt h LYS 197 N 0.42 -0.68 -0.97 1.51 1.63 -1.22 0.24 116.57 117.50 1ptt h LYS 197 Ca 0.12 0.05 0.11 0.00 -0.85 0.00 0.00 60.65 60.07 1ptt h LYS 197 Cb -0.03 0.15 -0.08 0.00 -0.60 0.00 0.00 32.23 31.68 1ptt h LYS 197 CO -0.03 -0.45 0.62 0.28 -3.45 0.00 0.00 179.45 176.42 1ptt h VAL 198 N -0.70 0.96 0.34 2.00 2.07 -1.07 -1.76 116.25 118.08 1ptt h VAL 198 Ca -0.06 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 1ptt h VAL 198 Cb 0.56 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1ptt h VAL 198 CO 0.08 0.18 -0.16 0.03 0.02 0.00 0.00 177.57 177.72 1ptt h ARG 199 N 0.99 -0.44 -0.45 1.57 3.08 -0.05 -3.00 114.38 116.08 1ptt h ARG 199 Ca 0.46 0.03 0.08 0.00 0.07 0.00 0.00 59.98 60.62 1ptt h ARG 199 Cb 0.42 0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 1ptt h ARG 199 CO -0.22 -0.21 0.31 0.93 -1.07 0.00 0.00 179.97 179.71 1ptt h GLU 200 N -0.60 0.26 0.00 0.04 5.08 0.06 -1.74 114.58 117.68 1ptt h GLU 200 Ca -0.05 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1ptt h GLU 200 Cb 0.44 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1ptt h GLU 200 CO 0.08 0.17 0.00 -1.13 -1.00 0.00 0.00 179.01 177.13 1ptt n SER 201 N -4.46 0.00 0.00 1.42 3.41 -0.72 -4.78 113.62 108.48 1ptt n SER 201 Ca 0.07 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1ptt n SER 201 Cb 0.33 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 1ptt n SER 201 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ptt n GLY 202 N -0.58 1.74 0.18 5.00 0.00 -0.65 -4.89 105.19 106.00 1ptt n GLY 202 Ca 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.00 1ptt n GLY 202 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ptt h SER 203 N 0.00 0.34 0.00 1.61 0.02 -1.73 -0.27 113.55 113.51 1ptt h SER 203 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1ptt h SER 203 Cb 0.00 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1ptt h SER 203 CO 0.00 0.24 0.00 0.18 -1.14 0.00 0.00 176.83 176.11 1ptt n LEU 204 N -4.90 0.00 -4.76 5.07 4.77 -1.26 -4.69 117.00 111.24 1ptt n LEU 204 Ca 0.02 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.59 1ptt n LEU 204 Cb 0.10 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.16 1ptt n LEU 204 CO 0.30 0.00 1.04 -0.55 -1.33 0.00 0.00 177.39 176.86 1ptt s SER 205 N -1.43 6.71 0.54 -1.43 0.15 -0.11 -4.92 113.70 113.21 1ptt s SER 205 Ca 0.11 2.67 0.36 0.00 0.70 0.00 0.00 55.95 59.78 1ptt s SER 205 Cb 0.05 -2.63 1.70 0.00 -1.71 0.00 0.00 66.02 63.43 1ptt s SER 205 CO 0.08 -0.62 2.07 1.55 1.20 0.00 0.00 173.24 177.52 1ptt h PRO 206 N 4.30 0.00 0.00 5.44 0.13 -1.89 -1.70 132.00 138.28 1ptt h PRO 206 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1ptt h PRO 206 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1ptt h PRO 206 CO 0.72 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.64 1ptt n GLU 207 N -2.93 0.10 -4.25 0.86 0.28 -1.26 -4.79 120.64 108.64 1ptt n GLU 207 Ca -0.01 0.36 -0.28 0.00 -0.16 0.00 0.00 57.16 57.07 1ptt n GLU 207 Cb 0.19 -1.69 -0.05 0.00 1.43 0.00 0.00 31.44 31.32 1ptt n GLU 207 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 1ptt s HIS 208 N -3.17 2.03 0.00 -1.84 3.76 -0.64 -5.15 115.29 110.27 1ptt s HIS 208 Ca 0.05 -0.79 0.00 0.00 -0.15 0.00 0.00 55.06 54.17 1ptt s HIS 208 Cb 0.09 -1.83 0.00 0.00 1.11 0.00 0.00 32.58 31.95 1ptt s HIS 208 CO 0.31 -0.03 0.00 0.41 -0.85 0.00 0.00 174.74 174.58 1ptt n GLY 209 N -1.43 -3.09 3.83 -2.22 0.00 0.32 -4.95 105.19 97.66 1ptt n GLY 209 Ca -0.07 -1.33 -0.33 0.00 0.00 0.00 0.00 46.02 44.29 1ptt n GLY 209 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ptt s PRO 210 N -2.79 4.13 0.46 1.61 0.02 -1.25 -4.66 135.00 132.52 1ptt s PRO 210 Ca 0.00 0.89 -0.23 0.00 0.02 0.00 0.00 61.00 61.68 1ptt s PRO 210 Cb 0.00 -2.36 -0.07 0.00 0.02 0.00 0.00 34.50 32.09 1ptt s PRO 210 CO 0.00 0.09 1.20 0.54 -0.33 0.00 0.00 177.00 178.50 1ptt s VAL 211 N -2.03 2.96 -0.31 3.83 0.11 -1.26 -4.21 120.40 119.49 1ptt s VAL 211 Ca 0.57 0.74 -0.09 0.00 -2.93 0.00 0.00 61.98 60.26 1ptt s VAL 211 Cb -0.10 -3.38 -0.01 0.00 -1.53 0.00 0.00 36.38 31.35 1ptt s VAL 211 CO 0.16 0.01 0.15 -0.69 -3.33 0.00 0.00 175.10 171.39 1ptt s VAL 212 N -1.48 4.59 0.10 2.04 1.01 -1.04 -0.80 120.40 124.81 1ptt s VAL 212 Ca 0.63 -0.40 0.04 0.00 0.00 0.00 0.00 61.98 62.25 1ptt s VAL 212 Cb -0.31 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 1ptt s VAL 212 CO 0.37 0.08 0.08 -0.69 0.00 0.00 0.00 175.10 174.94 1ptt s VAL 213 N 1.61 4.43 0.06 2.92 1.01 -0.09 -1.03 120.40 129.31 1ptt s VAL 213 Ca 0.05 -0.87 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 1ptt s VAL 213 Cb -0.17 -3.16 0.09 0.00 0.00 0.00 0.00 36.38 33.15 1ptt s VAL 213 CO 0.06 0.08 1.10 -1.38 0.00 0.00 0.00 175.10 174.96 1ptt s HIS 214 N -1.45 -0.10 0.00 5.22 -3.43 -0.81 -1.53 115.29 113.18 1ptt s HIS 214 Ca 0.29 -0.10 0.00 0.00 -0.80 0.00 0.00 55.06 54.45 1ptt s HIS 214 Cb -0.12 0.59 0.00 0.00 -1.43 0.00 0.00 32.58 31.63 1ptt s HIS 214 CO 0.22 -0.56 0.00 -1.13 -2.00 0.00 0.00 174.74 171.26 1ptt n SER 215 N -0.45 1.04 -0.02 7.38 3.41 -1.26 -0.75 113.62 122.98 1ptt n SER 215 Ca -0.07 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.38 1ptt n SER 215 Cb 0.62 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.47 1ptt n SER 215 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1ptt h SER 216 N 0.00 0.57 0.00 4.04 0.87 -1.92 -2.96 113.55 114.15 1ptt h SER 216 Ca 0.00 -0.68 0.00 0.00 -1.23 0.00 0.00 61.79 59.88 1ptt h SER 216 Cb 0.00 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.79 1ptt h SER 216 CO 0.00 1.16 -1.28 0.00 -0.53 0.00 0.00 176.83 176.18 1ptt n ALA 217 N -2.56 2.94 -0.88 6.23 0.00 -1.26 -0.79 120.51 124.20 1ptt n ALA 217 Ca -0.09 -0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1ptt n ALA 217 Cb 0.61 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 19.58 1ptt n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ptt n GLY 218 N 1.58 0.52 0.25 0.00 0.00 -1.25 -4.06 105.19 102.23 1ptt n GLY 218 Ca -0.01 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1ptt n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ptt n ILE 219 N -2.88 0.00 0.00 -0.61 -5.35 -1.26 -4.58 119.36 104.68 1ptt n ILE 219 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1ptt n ILE 219 Cb 0.00 -0.70 0.00 0.00 -1.74 0.00 0.00 39.64 37.20 1ptt n ILE 219 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ptt n GLY 220 N 3.27 0.45 0.29 3.28 0.00 -1.26 -1.20 105.19 110.03 1ptt n GLY 220 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1ptt n GLY 220 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ptt h ARG 221 N 0.00 0.46 -0.43 1.61 3.08 -1.94 -1.94 114.38 115.22 1ptt h ARG 221 Ca 0.00 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 1ptt h ARG 221 Cb 0.00 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1ptt h ARG 221 CO 0.00 0.38 -0.06 0.77 -1.07 0.00 0.00 179.97 179.99 1ptt h SER 222 N 0.46 0.79 -0.59 7.04 0.02 -1.84 -1.53 113.55 117.91 1ptt h SER 222 Ca 0.12 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1ptt h SER 222 Cb 0.08 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1ptt h SER 222 CO -0.01 0.95 0.37 1.23 -1.14 0.00 0.00 176.83 178.22 1ptt h GLY 223 N 0.63 0.84 0.77 -3.77 0.00 -0.67 -2.22 103.07 98.65 1ptt h GLY 223 Ca 0.11 -0.34 0.04 0.00 0.00 0.00 0.00 47.33 47.14 1ptt h GLY 223 CO 0.03 0.33 0.26 -0.84 0.00 0.00 0.00 176.54 176.32 1ptt h THR 224 N 0.79 0.98 0.70 4.70 2.02 -1.11 0.54 112.91 121.54 1ptt h THR 224 Ca 0.21 -0.17 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 1ptt h THR 224 Cb -0.05 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 1ptt h THR 224 CO -0.04 0.09 -0.46 0.15 0.37 0.00 0.00 175.52 175.63 1ptt h PHE 225 N 0.51 -1.23 -0.83 3.16 3.57 -1.11 -3.01 116.94 118.00 1ptt h PHE 225 Ca 0.21 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.76 1ptt h PHE 225 Cb 0.10 0.44 -0.05 0.00 2.79 0.00 0.00 35.95 39.23 1ptt h PHE 225 CO -0.09 -0.68 0.55 0.00 -2.23 0.00 0.00 178.31 175.85 1ptt h LEU 227 N 0.96 -1.11 -0.51 0.00 5.85 -0.92 0.63 115.31 120.22 1ptt h LEU 227 Ca 0.35 0.04 0.09 0.00 0.84 0.00 0.00 57.88 59.20 1ptt h LEU 227 Cb 0.16 0.29 -0.07 0.00 0.37 0.00 0.00 40.66 41.40 1ptt h LEU 227 CO -0.12 -0.78 0.08 0.00 -0.34 0.00 0.00 178.44 177.28 1ptt h ALA 228 N -1.32 0.55 -0.29 1.25 0.00 -1.42 0.16 119.26 118.19 1ptt h ALA 228 Ca -0.13 0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ptt h ALA 228 Cb 1.00 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1ptt h ALA 228 CO 0.22 -0.33 0.17 0.22 0.00 0.00 0.00 179.25 179.53 1ptt h ASP 229 N 0.21 0.27 0.09 0.00 3.58 -1.37 -2.62 116.42 116.57 1ptt h ASP 229 Ca 0.26 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.71 1ptt h ASP 229 Cb 0.36 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.36 1ptt h ASP 229 CO -0.36 0.20 -0.04 0.74 -2.88 0.00 0.00 179.24 176.90 1ptt h THR 230 N 0.34 1.04 -0.06 2.25 2.02 0.89 -1.75 112.91 117.66 1ptt h THR 230 Ca 0.11 -0.48 0.04 0.00 0.77 0.00 0.00 66.41 66.85 1ptt h THR 230 Cb 0.00 1.36 -0.06 0.00 -1.74 0.00 0.00 68.15 67.71 1ptt h THR 230 CO -0.06 0.12 -0.35 0.00 0.37 0.00 0.00 175.52 175.61 1ptt h LEU 232 N -0.47 0.77 -0.32 0.00 3.38 -1.44 0.10 115.31 117.33 1ptt h LEU 232 Ca 0.07 0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.18 1ptt h LEU 232 Cb 0.58 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 1ptt h LEU 232 CO -0.32 0.30 0.05 0.25 0.09 0.00 0.00 178.44 178.82 1ptt h LEU 233 N 0.78 -0.01 0.55 1.67 5.85 -0.29 -1.47 115.31 122.39 1ptt h LEU 233 Ca 0.55 0.06 -0.03 0.00 0.84 0.00 0.00 57.88 59.30 1ptt h LEU 233 Cb 0.80 0.08 0.01 0.00 0.37 0.00 0.00 40.66 41.92 1ptt h LEU 233 CO -0.36 0.03 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.43 1ptt h LEU 234 N 0.16 -0.63 -1.43 2.25 3.38 -0.12 -2.15 115.31 116.77 1ptt h LEU 234 Ca 0.15 -0.05 0.37 0.00 0.09 0.00 0.00 57.88 58.45 1ptt h LEU 234 Cb 0.18 0.16 -0.11 0.00 0.09 0.00 0.00 40.66 40.98 1ptt h LEU 234 CO -0.21 -0.30 0.79 0.24 0.09 0.00 0.00 178.44 179.05 1ptt h MET 235 N -0.97 0.19 0.38 1.13 2.86 -0.96 -0.41 114.93 117.15 1ptt h MET 235 Ca -0.08 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1ptt h MET 235 Cb 0.64 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.26 1ptt h MET 235 CO 0.12 0.12 -0.18 0.22 1.06 0.00 0.00 176.91 178.26 1ptt h ASP 236 N 0.19 -0.43 0.06 1.22 3.58 -0.66 -0.97 116.42 119.41 1ptt h ASP 236 Ca 0.72 0.01 0.03 0.00 0.42 0.00 0.00 57.03 58.21 1ptt h ASP 236 Cb 2.18 0.11 -0.05 0.00 1.72 0.00 0.00 39.33 43.29 1ptt h ASP 236 CO -0.34 -0.03 -0.34 0.07 -2.88 0.00 0.00 179.24 175.72 1ptt h LYS 237 N -1.06 -0.51 -0.79 0.28 2.10 -0.57 0.23 116.57 116.25 1ptt h LYS 237 Ca -0.05 0.03 0.08 0.00 -2.00 0.00 0.00 60.65 58.71 1ptt h LYS 237 Cb 0.39 0.11 -0.05 0.00 -0.90 0.00 0.00 32.23 31.78 1ptt h LYS 237 CO 0.08 -0.34 0.52 0.00 -2.00 0.00 0.00 179.45 177.72 1ptt h ARG 238 N -0.53 0.79 -0.08 0.07 3.08 -1.28 -3.44 114.38 113.00 1ptt h ARG 238 Ca 0.05 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 1ptt h ARG 238 Cb 0.58 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1ptt h ARG 238 CO -0.24 0.52 -0.03 1.17 -1.07 0.00 0.00 179.97 180.32 1ptt n LYS 239 N -4.49 -1.43 -3.79 0.04 3.00 0.07 -4.88 118.16 106.67 1ptt n LYS 239 Ca 0.12 0.44 -0.29 0.00 -0.00 0.00 0.00 58.31 58.58 1ptt n LYS 239 Cb 0.26 -4.55 -0.13 0.00 0.00 0.00 0.00 35.03 30.62 1ptt n LYS 239 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 1ptt s ASP 240 N -2.09 3.94 0.39 3.14 2.15 -1.24 -4.98 116.67 117.97 1ptt s ASP 240 Ca 0.00 -3.19 0.06 0.00 0.43 0.00 0.00 52.55 49.85 1ptt s ASP 240 Cb 0.00 -1.31 0.78 0.00 -0.30 0.00 0.00 42.92 42.10 1ptt s ASP 240 CO 0.00 -0.18 2.02 1.55 -0.17 0.00 0.00 175.17 178.38 1ptt h PRO 241 N 6.09 0.65 0.00 4.34 0.13 -1.90 -2.93 132.00 138.38 1ptt h PRO 241 Ca 0.06 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 1ptt h PRO 241 Cb 0.86 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.84 1ptt h PRO 241 CO 0.60 0.43 0.00 -1.13 -0.23 0.00 0.00 178.00 177.67 1ptt n SER 242 N -4.46 0.00 0.02 1.44 3.41 -1.26 -1.90 113.62 110.87 1ptt n SER 242 Ca 0.06 0.36 0.11 0.00 -0.26 0.00 0.00 58.87 59.15 1ptt n SER 242 Cb 0.11 -0.38 -0.04 0.00 -0.26 0.00 0.00 64.21 63.64 1ptt n SER 242 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ptt n SER 243 N -1.38 0.54 -4.59 4.04 3.41 -1.11 -4.85 113.62 109.68 1ptt n SER 243 Ca 0.01 -0.20 -0.42 0.00 -0.26 0.00 0.00 58.87 58.00 1ptt n SER 243 Cb 0.02 1.06 -0.03 0.00 -0.26 0.00 0.00 64.21 65.00 1ptt n SER 243 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ptt s VAL 244 N -3.27 3.55 -0.47 -3.33 1.01 -0.80 -4.98 120.40 112.12 1ptt s VAL 244 Ca 0.01 0.53 -0.18 0.00 0.00 0.00 0.00 61.98 62.34 1ptt s VAL 244 Cb 0.14 -3.83 0.05 0.00 0.00 0.00 0.00 36.38 32.74 1ptt s VAL 244 CO 0.83 -0.58 0.52 -0.62 0.00 0.00 0.00 175.10 175.25 1ptt s ASP 245 N 5.92 6.21 0.11 3.32 -1.08 -1.26 -4.94 116.67 124.95 1ptt s ASP 245 Ca 0.73 -0.88 -0.29 0.00 -0.52 0.00 0.00 52.55 51.60 1ptt s ASP 245 Cb -0.19 -2.25 -0.09 0.00 -1.46 0.00 0.00 42.92 38.93 1ptt s ASP 245 CO 0.31 -0.74 1.62 0.40 0.52 0.00 0.00 175.17 177.28 1ptt h ILE 246 N 5.80 0.33 -0.88 4.11 2.04 -1.99 -0.55 117.51 126.37 1ptt h ILE 246 Ca -0.27 0.00 0.21 0.00 1.00 0.00 0.00 64.86 65.80 1ptt h ILE 246 Cb 1.10 0.33 -0.12 0.00 -0.74 0.00 0.00 36.82 37.40 1ptt h ILE 246 CO 0.89 0.00 0.38 0.11 0.00 0.00 0.00 178.15 179.53 1ptt h LYS 247 N -0.56 0.39 0.00 2.37 1.57 -1.99 0.49 116.57 118.85 1ptt h LYS 247 Ca 0.02 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ptt h LYS 247 Cb 0.57 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.79 1ptt h LYS 247 CO -0.16 0.26 -0.00 0.87 -0.57 0.00 0.00 179.45 179.85 1ptt h LYS 248 N 0.40 -0.01 -0.52 3.15 1.57 -1.58 0.24 116.57 119.83 1ptt h LYS 248 Ca 0.54 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 59.30 1ptt h LYS 248 Cb 1.01 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.30 1ptt h LYS 248 CO -0.52 0.12 0.21 0.28 -0.57 0.00 0.00 179.45 178.97 1ptt h VAL 249 N -0.13 1.19 0.12 0.50 2.07 0.11 0.17 116.25 120.28 1ptt h VAL 249 Ca -0.00 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 1ptt h VAL 249 Cb 0.13 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1ptt h VAL 249 CO 0.00 0.23 -0.06 0.25 0.02 0.00 0.00 177.57 178.02 1ptt h LEU 250 N 0.74 -0.13 -1.26 2.57 5.85 -0.18 -1.80 115.31 121.10 1ptt h LEU 250 Ca 0.18 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.86 1ptt h LEU 250 Cb 0.14 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 1ptt h LEU 250 CO -0.02 0.02 0.54 -0.07 -0.34 0.00 0.00 178.44 178.57 1ptt h LEU 251 N -0.29 0.78 -1.03 2.25 3.38 -0.39 0.86 115.31 120.87 1ptt h LEU 251 Ca -0.02 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1ptt h LEU 251 Cb 0.23 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1ptt h LEU 251 CO 0.03 0.50 0.11 -0.08 0.09 0.00 0.00 178.44 179.08 1ptt h GLU 252 N 0.88 0.80 -0.11 1.13 4.57 -0.23 -2.89 114.58 118.73 1ptt h GLU 252 Ca 0.36 -0.17 -0.20 0.00 -1.18 0.00 0.00 59.36 58.17 1ptt h GLU 252 Cb 0.26 -0.12 0.01 0.00 -0.16 0.00 0.00 28.75 28.74 1ptt h GLU 252 CO -0.13 0.74 -0.70 0.52 -1.18 0.00 0.00 179.01 178.26 1ptt h MET 253 N 0.77 0.66 0.00 1.92 2.86 -0.06 -3.13 114.93 117.95 1ptt h MET 253 Ca 0.17 -0.57 0.00 0.00 -2.06 0.00 0.00 59.70 57.24 1ptt h MET 253 Cb 0.31 0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.10 1ptt h MET 253 CO 0.00 1.18 0.00 0.54 1.06 0.00 0.00 176.91 179.70 1ptt n ARG 254 N -4.05 0.01 -0.03 1.72 5.12 -0.15 0.15 116.66 119.43 1ptt n ARG 254 Ca -0.08 0.35 -0.17 0.00 -1.93 0.00 0.00 57.85 56.02 1ptt n ARG 254 Cb 0.71 -1.50 -0.08 0.00 -1.16 0.00 0.00 32.46 30.43 1ptt n ARG 254 CO 0.00 0.00 0.00 0.87 -1.93 0.00 0.00 177.63 176.57 1ptt h LYS 255 N 0.00 0.66 0.00 5.56 1.57 -1.47 -3.33 116.57 119.56 1ptt h LYS 255 Ca 0.00 -0.53 -0.17 0.00 -1.87 0.00 0.00 60.65 58.08 1ptt h LYS 255 Cb 0.02 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 1ptt h LYS 255 CO 0.00 1.15 -0.80 0.74 -0.57 0.00 0.00 179.45 179.96 1ptt h PHE 256 N 0.33 0.00 -2.28 -1.35 -1.00 -0.45 -3.47 116.94 108.72 1ptt h PHE 256 Ca -0.04 0.00 -0.07 0.00 2.81 0.00 0.00 57.97 60.67 1ptt h PHE 256 Cb 1.25 0.00 -0.21 0.00 3.61 0.00 0.00 35.95 40.60 1ptt h PHE 256 CO 0.10 0.80 0.02 0.50 -1.61 0.00 0.00 178.31 178.12 1ptt s ARG 257 N -2.82 0.79 1.01 1.51 3.52 -1.02 -4.46 118.95 117.47 1ptt s ARG 257 Ca 0.02 0.60 -0.12 0.00 -0.13 0.00 0.00 55.73 56.10 1ptt s ARG 257 Cb 0.09 0.38 0.19 0.00 -1.56 0.00 0.00 34.95 34.05 1ptt s ARG 257 CO 0.79 -0.15 1.08 0.00 -0.81 0.00 0.00 175.30 176.21 1ptt s MET 258 N -0.21 0.36 -0.58 5.12 0.00 -1.26 -4.12 119.30 118.61 1ptt s MET 258 Ca -0.04 0.62 0.00 0.00 0.00 0.00 0.00 55.69 56.27 1ptt s MET 258 Cb -0.03 -1.72 0.00 0.00 0.00 0.00 0.00 34.83 33.08 1ptt s MET 258 CO 0.03 -2.80 0.00 0.41 0.00 0.00 0.00 175.02 172.66 1ptt n GLY 259 N -0.81 0.52 3.59 3.16 0.00 -1.26 -4.80 105.19 105.60 1ptt n GLY 259 Ca 0.05 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.53 1ptt n GLY 259 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ptt n LEU 260 N -0.86 2.38 -0.48 0.99 4.77 -1.26 -3.96 117.00 118.58 1ptt n LEU 260 Ca -0.06 0.80 0.00 0.00 -0.03 0.00 0.00 56.01 56.72 1ptt n LEU 260 Cb 0.32 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 1ptt n LEU 260 CO 0.08 -0.49 -0.08 -0.38 -1.33 0.00 0.00 177.39 175.19 1ptt n ILE 261 N 5.73 -2.62 0.04 -0.08 5.41 -0.34 -4.93 119.36 122.58 1ptt n ILE 261 Ca 0.33 0.50 0.00 0.00 1.00 0.00 0.00 62.75 64.58 1ptt n ILE 261 Cb 0.18 -1.86 -0.00 0.00 -0.71 0.00 0.00 39.64 37.24 1ptt n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ptt n GLN 262 N -0.08 4.52 -4.09 0.38 1.13 -1.25 -4.85 117.38 113.13 1ptt n GLN 262 Ca 0.00 -0.16 -0.14 0.00 -1.94 0.00 0.00 57.00 54.76 1ptt n GLN 262 Cb 0.00 -0.68 -0.11 0.00 0.11 0.00 0.00 30.24 29.55 1ptt n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1ptt s THR 263 N -0.80 0.65 0.20 5.09 -4.23 -1.26 -5.02 115.64 110.27 1ptt s THR 263 Ca 0.01 -1.20 -0.11 0.00 -1.18 0.00 0.00 61.69 59.20 1ptt s THR 263 Cb 0.01 -0.79 0.13 0.00 1.34 0.00 0.00 72.50 73.19 1ptt s THR 263 CO 0.03 -0.41 1.85 0.00 -0.54 0.00 0.00 174.62 175.55 1ptt h ALA 264 N 4.31 0.88 -0.18 3.99 0.00 -1.95 -1.35 119.26 124.96 1ptt h ALA 264 Ca -0.37 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 1ptt h ALA 264 Cb 1.20 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1ptt h ALA 264 CO 0.43 0.33 -0.01 0.22 0.00 0.00 0.00 179.25 180.23 1ptt h ASP 265 N 0.94 0.24 0.00 0.00 3.58 -1.95 0.43 116.42 119.66 1ptt h ASP 265 Ca 0.25 -0.03 -0.05 0.00 0.42 0.00 0.00 57.03 57.62 1ptt h ASP 265 Cb -0.06 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 1ptt h ASP 265 CO -0.05 0.30 -0.12 1.56 -2.88 0.00 0.00 179.24 178.05 1ptt h GLN 266 N 0.26 0.25 -0.08 0.28 4.20 -1.60 0.82 115.11 119.24 1ptt h GLN 266 Ca 0.06 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 1ptt h GLN 266 Cb 0.19 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 1ptt h GLN 266 CO 0.00 0.38 -0.13 1.25 -0.67 0.00 0.00 178.83 179.67 1ptt h LEU 267 N 0.24 0.25 -0.50 1.46 5.85 0.31 -1.14 115.31 121.79 1ptt h LEU 267 Ca 0.05 -0.54 0.03 0.00 0.84 0.00 0.00 57.88 58.26 1ptt h LEU 267 Cb 0.36 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1ptt h LEU 267 CO 0.02 0.74 0.28 -0.09 -0.34 0.00 0.00 178.44 179.05 1ptt h ARG 268 N -0.23 0.53 -0.69 1.25 2.43 -0.84 -1.02 114.38 115.81 1ptt h ARG 268 Ca 0.01 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1ptt h ARG 268 Cb 0.69 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.09 1ptt h ARG 268 CO 0.03 0.35 0.46 0.35 -1.51 0.00 0.00 179.97 179.65 1ptt h PHE 269 N 0.55 0.87 -0.40 2.20 3.04 -0.70 -0.88 116.94 121.62 1ptt h PHE 269 Ca 0.21 0.02 0.08 0.00 3.98 0.00 0.00 57.97 62.26 1ptt h PHE 269 Cb 0.07 -0.29 -0.02 0.00 2.56 0.00 0.00 35.95 38.26 1ptt h PHE 269 CO -0.08 0.55 0.28 0.77 -2.02 0.00 0.00 178.31 177.81 1ptt h SER 270 N 0.94 0.16 -0.13 0.41 0.02 0.11 0.07 113.55 115.13 1ptt h SER 270 Ca 0.25 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.15 1ptt h SER 270 Cb -0.11 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.40 1ptt h SER 270 CO -0.05 0.10 -0.13 1.88 -1.14 0.00 0.00 176.83 177.48 1ptt h TYR 271 N 0.17 0.38 0.37 3.45 -1.99 -0.60 -2.28 116.97 116.47 1ptt h TYR 271 Ca 0.19 -0.11 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 1ptt h TYR 271 Cb 0.51 -0.08 -0.02 0.00 2.00 0.00 0.00 36.73 39.15 1ptt h TYR 271 CO -0.00 0.72 -0.31 -0.07 -0.00 0.00 0.00 178.16 178.50 1ptt h LEU 272 N -0.07 -0.83 -0.51 3.88 3.38 -0.62 -1.20 115.31 119.34 1ptt h LEU 272 Ca 0.02 0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.16 1ptt h LEU 272 Cb 0.66 0.27 -0.10 0.00 0.09 0.00 0.00 40.66 41.58 1ptt h LEU 272 CO 0.03 -0.46 -0.13 0.00 0.09 0.00 0.00 178.44 177.97 1ptt h ALA 273 N -0.18 0.33 -0.54 1.53 0.00 -1.14 0.23 119.26 119.50 1ptt h ALA 273 Ca -0.03 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1ptt h ALA 273 Cb 0.61 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1ptt h ALA 273 CO -0.03 -0.44 0.25 0.28 0.00 0.00 0.00 179.25 179.31 1ptt h VAL 274 N -0.00 1.20 0.51 0.00 2.07 -1.14 0.03 116.25 118.93 1ptt h VAL 274 Ca 0.25 -0.59 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 1ptt h VAL 274 Cb 0.38 0.60 0.01 0.00 -1.52 0.00 0.00 31.29 30.76 1ptt h VAL 274 CO -0.53 0.23 -0.25 0.40 0.02 0.00 0.00 177.57 177.45 1ptt h ILE 275 N 0.72 0.00 -0.25 4.57 2.04 -0.76 0.13 117.51 123.96 1ptt h ILE 275 Ca 0.18 -0.07 0.03 0.00 1.00 0.00 0.00 64.86 66.00 1ptt h ILE 275 Cb 0.14 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.18 1ptt h ILE 275 CO -0.02 0.00 -0.22 -0.08 0.00 0.00 0.00 178.15 177.82 1ptt h GLU 276 N -0.76 -0.09 -0.63 2.37 4.57 -0.49 0.22 114.58 119.76 1ptt h GLU 276 Ca -0.07 0.01 0.18 0.00 -1.18 0.00 0.00 59.36 58.30 1ptt h GLU 276 Cb 0.53 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.12 1ptt h GLU 276 CO 0.12 -0.06 0.56 0.78 -1.18 0.00 0.00 179.01 179.23 1ptt h GLY 277 N -0.10 0.00 0.53 1.92 0.00 -1.06 -0.19 103.07 104.17 1ptt h GLY 277 Ca 0.04 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.46 1ptt h GLY 277 CO -0.29 0.00 0.38 0.00 0.00 0.00 0.00 176.54 176.63 1ptt h ALA 278 N 1.47 1.00 -1.06 3.60 0.00 0.16 -1.41 119.26 123.03 1ptt h ALA 278 Ca 0.30 0.04 0.31 0.00 0.00 0.00 0.00 54.91 55.56 1ptt h ALA 278 Cb 1.42 -0.08 -0.13 0.00 0.00 0.00 0.00 17.79 19.00 1ptt h ALA 278 CO -0.00 0.00 0.64 0.87 0.00 0.00 0.00 179.25 180.76 1ptt h LYS 279 N 0.66 0.34 -0.10 0.00 1.57 -0.96 0.67 116.57 118.75 1ptt h LYS 279 Ca 0.35 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.93 1ptt h LYS 279 Cb 0.33 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.55 1ptt h LYS 279 CO -0.24 0.23 -0.69 0.35 -0.57 0.00 0.00 179.45 178.52 1ptt h PHE 280 N 0.35 0.60 -0.47 -1.35 3.57 -1.40 -2.59 116.94 115.65 1ptt h PHE 280 Ca 0.70 -0.25 -0.13 0.00 3.53 0.00 0.00 57.97 61.82 1ptt h PHE 280 Cb 1.68 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 40.31 1ptt h PHE 280 CO -0.01 1.00 -0.20 0.82 -2.23 0.00 0.00 178.31 177.70 1ptt h ILE 281 N 0.32 1.27 -0.79 1.41 1.08 0.27 -3.25 117.51 117.82 1ptt h ILE 281 Ca -0.02 -1.36 -0.72 0.00 -0.39 0.00 0.00 64.86 62.37 1ptt h ILE 281 Cb 1.26 1.11 -0.08 0.00 -3.07 0.00 0.00 36.82 36.04 1ptt h ILE 281 CO 0.12 0.47 2.78 0.23 -0.69 0.00 0.00 178.15 181.05 1ptt n MET 282 N -4.11 3.96 0.00 2.37 2.81 0.11 -4.79 117.12 117.46 1ptt n MET 282 Ca 0.00 -3.07 0.00 0.00 -1.81 0.00 0.00 57.70 52.83 1ptt n MET 282 Cb 0.45 -2.81 0.00 0.00 -0.71 0.00 0.00 33.22 30.14 1ptt n MET 282 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ptt n GLY 283 N 2.69 0.18 3.08 3.03 0.00 -1.23 -4.82 105.19 108.13 1ptt n GLY 283 Ca 0.60 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.50 1ptt n GLY 283 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ptt n ASP 284 N 0.14 0.22 -0.30 1.61 -0.08 -0.99 -4.60 116.55 112.56 1ptt n ASP 284 Ca 0.00 -1.88 0.14 0.00 -1.51 0.00 0.00 54.79 51.54 1ptt n ASP 284 Cb 0.00 -0.42 0.39 0.00 2.34 0.00 0.00 41.12 43.44 1ptt n ASP 284 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1ptt h SER 285 N 8.15 0.64 0.00 1.67 4.64 -1.83 0.89 113.55 127.72 1ptt h SER 285 Ca 0.07 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1ptt h SER 285 Cb 0.22 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1ptt h SER 285 CO 1.15 0.27 0.03 -1.20 -0.87 0.00 0.00 176.83 176.21 1ptt n SER 286 N -4.62 0.00 0.07 4.97 7.64 -1.26 -1.44 113.62 118.98 1ptt n SER 286 Ca 0.20 0.47 -0.12 0.00 1.01 0.00 0.00 58.87 60.43 1ptt n SER 286 Cb 0.58 -0.47 -0.04 0.00 -1.01 0.00 0.00 64.21 63.27 1ptt n SER 286 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 1ptt h VAL 287 N 0.00 1.43 -0.40 0.44 3.04 -1.19 -3.26 116.25 116.31 1ptt h VAL 287 Ca 0.00 -2.52 0.08 0.00 -1.01 0.00 0.00 66.70 63.25 1ptt h VAL 287 Cb 0.06 2.45 -0.09 0.00 -2.01 0.00 0.00 31.29 31.70 1ptt h VAL 287 CO 0.00 0.75 -0.24 -0.61 -1.01 0.00 0.00 177.57 176.45 1ptt h GLN 288 N 0.19 -0.17 -0.24 4.17 4.15 -1.43 -0.88 115.11 120.89 1ptt h GLN 288 Ca -0.07 0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.30 1ptt h GLN 288 Cb 1.57 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 29.28 1ptt h GLN 288 CO 0.15 -0.11 -0.12 0.38 -1.93 0.00 0.00 178.83 177.20 1ptt h ASP 289 N -0.17 0.38 -0.92 -0.69 2.03 -1.76 -2.30 116.42 112.98 1ptt h ASP 289 Ca 0.19 -0.09 -0.01 0.00 -0.73 0.00 0.00 57.03 56.39 1ptt h ASP 289 Cb 0.47 -0.10 -0.04 0.00 -0.83 0.00 0.00 39.33 38.83 1ptt h ASP 289 CO -0.50 0.54 0.54 1.56 -1.03 0.00 0.00 179.24 180.35 1ptt h GLN 290 N 0.38 1.26 -0.26 4.15 4.20 -1.24 -1.87 115.11 121.73 1ptt h GLN 290 Ca 0.07 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1ptt h GLN 290 Cb 0.45 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 1ptt h GLN 290 CO 0.03 0.90 0.16 -1.49 -0.67 0.00 0.00 178.83 177.75 1ptt h TRP 291 N 1.28 0.33 -0.92 2.96 6.55 -0.72 -1.30 115.95 124.14 1ptt h TRP 291 Ca 0.33 0.00 0.09 0.00 0.95 0.00 0.00 58.89 60.26 1ptt h TRP 291 Cb -0.03 -0.11 -0.07 0.00 -0.86 0.00 0.00 29.16 28.09 1ptt h TRP 291 CO 0.01 0.24 0.59 -0.22 -1.05 0.00 0.00 178.44 178.01 1ptt h LYS 292 N 0.33 0.93 0.01 0.49 3.11 -1.23 0.48 116.57 120.67 1ptt h LYS 292 Ca 0.09 -0.06 -0.00 0.00 -2.81 0.00 0.00 60.65 57.88 1ptt h LYS 292 Cb 0.00 -0.21 0.00 0.00 -1.00 0.00 0.00 32.23 31.03 1ptt h LYS 292 CO -0.02 0.61 -0.00 0.93 -2.81 0.00 0.00 179.45 178.16 1ptt h GLU 293 N 0.95 -0.01 0.00 1.90 4.39 -0.85 -2.71 114.58 118.26 1ptt h GLU 293 Ca 0.42 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 60.08 1ptt h GLU 293 Cb 0.36 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 1ptt h GLU 293 CO -0.18 0.17 -0.22 -0.07 -1.16 0.00 0.00 179.01 177.56 1ptt h LEU 294 N -0.19 0.00 -0.80 1.33 3.38 -0.29 -2.14 115.31 116.60 1ptt h LEU 294 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1ptt h LEU 294 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 1ptt h LEU 294 CO 0.00 0.22 -0.13 0.77 0.09 0.00 0.00 178.44 179.39 1ptt h SER 295 N 0.00 0.00 -4.58 -0.43 4.64 0.14 -3.45 113.55 109.87 1ptt h SER 295 Ca -0.00 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.91 1ptt h SER 295 Cb 0.45 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.59 1ptt h SER 295 CO 0.03 0.13 -0.61 1.41 -0.87 0.00 0.00 176.83 176.92 1ptt n HIS 296 N -3.20 -1.98 -0.83 4.77 8.25 -0.81 -4.85 115.22 116.58 1ptt n HIS 296 Ca 0.01 0.53 -0.21 0.00 -0.26 0.00 0.00 57.72 57.79 1ptt n HIS 296 Cb 0.45 -4.39 -0.05 0.00 1.12 0.00 0.00 29.99 27.12 1ptt n HIS 296 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1ptt n GLU 297 N -4.03 2.18 0.00 -0.41 0.28 -1.25 -4.62 120.64 112.80 1ptt n GLU 297 Ca -0.10 -1.37 0.00 0.00 -0.16 0.00 0.00 57.16 55.53 1ptt n GLU 297 Cb 0.61 -2.33 0.00 0.00 1.43 0.00 0.00 31.44 31.15 1ptt n GLU 297 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72