#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gfy h GLU 4 N 0.00 0.30 -0.05 3.17 4.81 -1.97 0.86 114.58 121.70 1gfy h GLU 4 Ca 0.00 -0.52 -0.03 0.00 -0.13 0.00 0.00 59.36 58.68 1gfy h GLU 4 Cb 0.00 0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 1gfy h GLU 4 CO 0.00 1.21 -0.08 0.87 -0.73 0.00 0.00 179.01 180.28 1gfy h LYS 5 N 0.08 0.15 -0.85 1.92 1.57 -2.05 -2.61 116.57 114.78 1gfy h LYS 5 Ca -0.19 -0.09 0.21 0.00 -1.87 0.00 0.00 60.65 58.71 1gfy h LYS 5 Cb 2.02 0.01 -0.13 0.00 0.08 0.00 0.00 32.23 34.21 1gfy h LYS 5 CO 0.20 0.65 0.27 1.49 -0.57 0.00 0.00 179.45 181.49 1gfy h GLU 6 N -0.34 0.28 -0.09 3.15 4.81 -1.99 -0.13 114.58 120.28 1gfy h GLU 6 Ca 0.00 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1gfy h GLU 6 Cb 0.63 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.95 1gfy h GLU 6 CO 0.02 0.18 0.04 0.35 -0.73 0.00 0.00 179.01 178.88 1gfy h PHE 7 N 0.29 0.12 -0.02 0.92 3.57 0.83 -1.21 116.94 121.43 1gfy h PHE 7 Ca 0.52 -0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.86 1gfy h PHE 7 Cb 0.99 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.68 1gfy h PHE 7 CO -0.22 0.18 -0.68 0.93 -2.23 0.00 0.00 178.31 176.29 1gfy h GLU 8 N 0.03 0.12 -0.63 1.11 5.08 -1.03 -0.71 114.58 118.55 1gfy h GLU 8 Ca 0.03 -0.10 0.07 0.00 -1.00 0.00 0.00 59.36 58.37 1gfy h GLU 8 Cb 0.10 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.34 1gfy h GLU 8 CO -0.00 0.75 0.42 0.37 -1.00 0.00 0.00 179.01 179.55 1gfy h GLN 9 N 0.08 0.55 0.00 2.33 4.15 -0.89 0.26 115.11 121.60 1gfy h GLN 9 Ca -0.01 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 1gfy h GLN 9 Cb 1.21 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.78 1gfy h GLN 9 CO 0.10 0.36 -0.00 0.82 -1.93 0.00 0.00 178.83 178.18 1gfy h ILE 10 N 0.57 1.50 -0.64 2.39 2.04 -0.47 -2.82 117.51 120.07 1gfy h ILE 10 Ca 0.28 -1.50 -0.09 0.00 1.00 0.00 0.00 64.86 64.55 1gfy h ILE 10 Cb 0.36 2.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.93 1gfy h ILE 10 CO -0.08 0.39 0.05 -0.78 0.00 0.00 0.00 178.15 177.72 1gfy h ASP 11 N -0.65 1.06 -0.56 1.72 3.58 -1.16 -0.69 116.42 119.72 1gfy h ASP 11 Ca -0.00 -0.28 -0.05 0.00 0.42 0.00 0.00 57.03 57.12 1gfy h ASP 11 Cb 0.64 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 41.38 1gfy h ASP 11 CO 0.00 1.08 0.16 0.07 -2.88 0.00 0.00 179.24 177.67 1gfy h LYS 12 N 1.00 0.88 -0.93 0.28 2.10 -0.55 -1.45 116.57 117.90 1gfy h LYS 12 Ca 0.19 -0.20 -0.51 0.00 -2.00 0.00 0.00 60.65 58.13 1gfy h LYS 12 Cb 0.51 -0.12 -0.29 0.00 -0.90 0.00 0.00 32.23 31.43 1gfy h LYS 12 CO 0.02 0.81 0.60 -1.13 -2.00 0.00 0.00 179.45 177.75 1gfy n SER 13 N -4.42 4.24 -4.19 7.07 3.41 -1.07 -4.97 113.62 113.70 1gfy n SER 13 Ca 0.03 -3.66 -0.34 0.00 -0.26 0.00 0.00 58.87 54.64 1gfy n SER 13 Cb 0.22 -0.84 -0.06 0.00 -0.26 0.00 0.00 64.21 63.27 1gfy n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gfy n GLY 14 N -1.11 -0.32 0.02 5.00 0.00 -0.40 -4.87 105.19 103.51 1gfy n GLY 14 Ca 0.58 0.22 0.01 0.00 0.00 0.00 0.00 46.02 46.83 1gfy n GLY 14 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gfy n SER 15 N -2.74 1.74 -0.29 1.61 7.64 -0.43 -4.78 113.62 116.38 1gfy n SER 15 Ca -0.27 -2.00 0.10 0.00 1.01 0.00 0.00 58.87 57.70 1gfy n SER 15 Cb 0.66 -0.06 0.25 0.00 -1.01 0.00 0.00 64.21 64.06 1gfy n SER 15 CO 0.00 0.00 0.00 -0.50 -3.01 0.00 0.00 175.04 171.53 1gfy h TRP 16 N 0.00 0.60 -0.03 1.43 4.06 -1.90 -1.18 115.95 118.93 1gfy h TRP 16 Ca 0.00 0.04 -0.13 0.00 2.06 0.00 0.00 58.89 60.86 1gfy h TRP 16 Cb 0.64 -0.14 -0.01 0.00 -1.00 0.00 0.00 29.16 28.65 1gfy h TRP 16 CO 0.00 0.02 -0.57 0.00 -3.56 0.00 0.00 178.44 174.32 1gfy h ALA 17 N 1.64 0.98 -0.06 1.49 0.00 -1.92 -0.57 119.26 120.81 1gfy h ALA 17 Ca 0.50 -0.52 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1gfy h ALA 17 Cb 0.85 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1gfy h ALA 17 CO -0.47 0.71 -0.27 0.00 0.00 0.00 0.00 179.25 179.23 1gfy h ALA 18 N 1.34 0.12 -0.26 0.00 0.00 -1.88 0.52 119.26 119.10 1gfy h ALA 18 Ca -0.00 -0.42 0.06 0.00 0.00 0.00 0.00 54.91 54.54 1gfy h ALA 18 Cb 1.04 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 1gfy h ALA 18 CO 0.08 0.14 -0.11 0.82 0.00 0.00 0.00 179.25 180.17 1gfy h ILE 19 N -0.21 0.63 0.57 0.00 1.08 -1.20 0.26 117.51 118.64 1gfy h ILE 19 Ca -0.02 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.44 1gfy h ILE 19 Cb 0.91 0.63 -0.01 0.00 -3.07 0.00 0.00 36.82 35.28 1gfy h ILE 19 CO 0.06 0.00 -0.45 0.22 -0.69 0.00 0.00 178.15 177.29 1gfy h TYR 20 N -0.08 -1.21 -0.77 1.37 3.20 -1.00 0.74 116.97 119.23 1gfy h TYR 20 Ca 0.14 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.16 1gfy h TYR 20 Cb 0.28 0.45 -0.15 0.00 1.54 0.00 0.00 36.73 38.86 1gfy h TYR 20 CO -0.30 -0.63 -0.19 1.04 -1.64 0.00 0.00 178.16 176.43 1gfy n GLN 21 N -5.55 -0.07 -0.07 1.82 6.02 0.18 -1.23 117.38 118.48 1gfy n GLN 21 Ca -0.12 1.20 -0.10 0.00 -0.01 0.00 0.00 57.00 57.96 1gfy n GLN 21 Cb 0.44 -1.79 -0.04 0.00 1.02 0.00 0.00 30.24 29.88 1gfy n GLN 21 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 1gfy h ASP 22 N 0.00 0.32 -0.65 1.08 3.32 0.32 -0.75 116.42 120.06 1gfy h ASP 22 Ca 0.37 -0.15 0.12 0.00 0.02 0.00 0.00 57.03 57.39 1gfy h ASP 22 Cb 0.56 -0.08 -0.09 0.00 0.22 0.00 0.00 39.33 39.93 1gfy h ASP 22 CO -0.79 0.39 0.16 0.40 -1.72 0.00 0.00 179.24 177.68 1gfy h ILE 23 N 0.24 0.62 -0.69 0.35 2.04 0.01 -0.61 117.51 119.48 1gfy h ILE 23 Ca 0.08 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 65.89 1gfy h ILE 23 Cb 0.16 0.30 -0.04 0.00 -0.74 0.00 0.00 36.82 36.50 1gfy h ILE 23 CO -0.01 0.05 0.45 -0.09 0.00 0.00 0.00 178.15 178.56 1gfy h ARG 24 N 0.29 0.75 0.01 2.37 2.43 -0.63 0.99 114.38 120.60 1gfy h ARG 24 Ca 0.35 -0.05 -0.20 0.00 -0.81 0.00 0.00 59.98 59.27 1gfy h ARG 24 Cb 0.53 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.89 1gfy h ARG 24 CO -0.42 0.50 -0.96 0.45 -1.51 0.00 0.00 179.97 178.02 1gfy h HIS 25 N 0.77 0.07 0.00 2.20 3.86 0.32 -3.27 115.15 119.10 1gfy h HIS 25 Ca 0.29 -0.04 -0.13 0.00 -1.16 0.00 0.00 60.37 59.32 1gfy h HIS 25 Cb 0.16 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 1gfy h HIS 25 CO -0.00 0.97 -0.61 0.93 0.86 0.00 0.00 177.93 180.08 1gfy h GLU 26 N 0.02 0.00 -6.82 2.45 5.08 -0.90 -3.48 114.58 110.93 1gfy h GLU 26 Ca -0.02 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.77 1gfy h GLU 26 Cb 1.68 0.00 0.14 0.00 0.50 0.00 0.00 28.75 31.07 1gfy h GLU 26 CO 0.13 0.61 0.30 0.00 -1.00 0.00 0.00 179.01 179.05 1gfy n ALA 27 N -2.39 0.69 -0.69 3.43 0.00 0.31 -4.96 120.51 116.91 1gfy n ALA 27 Ca -0.01 0.14 -0.31 0.00 0.00 0.00 0.00 53.44 53.26 1gfy n ALA 27 Cb 0.63 -2.18 0.17 0.00 0.00 0.00 0.00 19.45 18.07 1gfy n ALA 27 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1gfy s SER 28 N -0.90 2.88 -0.12 0.00 0.01 -1.26 -5.06 113.70 109.25 1gfy s SER 28 Ca 0.68 2.20 -0.04 0.00 1.31 0.00 0.00 55.95 60.10 1gfy s SER 28 Cb -0.47 -2.57 0.06 0.00 0.21 0.00 0.00 66.02 63.25 1gfy s SER 28 CO 0.52 -3.13 0.24 -0.62 0.41 0.00 0.00 173.24 170.66 1gfy s ASP 29 N -2.66 0.46 0.25 2.44 2.15 -1.26 -4.94 116.67 113.11 1gfy s ASP 29 Ca 0.67 0.52 0.12 0.00 0.43 0.00 0.00 52.55 54.29 1gfy s ASP 29 Cb -0.23 0.60 -0.05 0.00 -0.30 0.00 0.00 42.92 42.94 1gfy s ASP 29 CO 0.58 -0.24 -0.21 -0.36 -0.17 0.00 0.00 175.17 174.77 1gfy s PHE 30 N 2.39 2.26 0.65 -5.34 0.08 -1.26 -5.12 117.98 111.64 1gfy s PHE 30 Ca 0.02 -0.35 -0.18 0.00 0.12 0.00 0.00 56.93 56.54 1gfy s PHE 30 Cb -0.12 -1.02 -0.01 0.00 -0.57 0.00 0.00 43.02 41.31 1gfy s PHE 30 CO -0.08 0.65 1.26 -1.25 -0.10 0.00 0.00 175.22 175.70 1gfy s PRO 31 N -3.30 2.55 -0.43 0.24 0.04 -1.26 -4.83 135.00 128.01 1gfy s PRO 31 Ca 0.27 1.95 0.09 0.00 0.04 0.00 0.00 61.00 63.36 1gfy s PRO 31 Cb -0.06 -1.86 0.41 0.00 0.04 0.00 0.00 34.50 33.03 1gfy s PRO 31 CO 0.13 -1.57 0.99 0.00 0.04 0.00 0.00 177.00 176.59 1gfy h ARG 33 N 2.82 0.78 -0.62 0.00 3.08 -1.94 -2.82 114.38 115.68 1gfy h ARG 33 Ca 0.14 -0.50 -0.09 0.00 0.07 0.00 0.00 59.98 59.60 1gfy h ARG 33 Cb 0.91 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 1gfy h ARG 33 CO 0.71 1.13 0.04 -0.39 -1.07 0.00 0.00 179.97 180.39 1gfy h VAL 34 N 0.59 1.26 -0.85 2.04 -1.51 -1.93 -2.31 116.25 113.55 1gfy h VAL 34 Ca 0.01 -1.10 0.18 0.00 -1.23 0.00 0.00 66.70 64.56 1gfy h VAL 34 Cb 1.15 0.76 -0.11 0.00 -2.13 0.00 0.00 31.29 30.96 1gfy h VAL 34 CO 0.12 0.40 0.39 0.00 -1.23 0.00 0.00 177.57 177.25 1gfy h ALA 35 N 1.00 1.30 -0.20 5.19 0.00 -1.85 0.67 119.26 125.37 1gfy h ALA 35 Ca 0.18 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1gfy h ALA 35 Cb 0.51 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1gfy h ALA 35 CO 0.02 -0.23 0.00 1.63 0.00 0.00 0.00 179.25 180.67 1gfy n LYS 36 N -4.98 1.83 -1.89 0.00 4.76 -0.99 -4.61 118.16 112.28 1gfy n LYS 36 Ca 0.19 -1.25 -0.39 0.00 -2.87 0.00 0.00 58.31 53.99 1gfy n LYS 36 Cb 0.53 -1.40 0.02 0.00 -1.84 0.00 0.00 35.03 32.33 1gfy n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1gfy s LEU 37 N -1.52 4.06 0.26 -0.35 1.43 0.23 -4.90 118.68 117.88 1gfy s LEU 37 Ca 0.32 2.77 -0.02 0.00 -1.03 0.00 0.00 54.13 56.17 1gfy s LEU 37 Cb 0.18 -4.04 0.46 0.00 0.03 0.00 0.00 46.19 42.82 1gfy s LEU 37 CO 0.26 -1.19 1.81 -0.65 0.23 0.00 0.00 176.35 176.82 1gfy h PRO 38 N 2.15 0.82 0.00 1.29 0.11 -1.90 0.22 132.00 134.69 1gfy h PRO 38 Ca -0.50 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1gfy h PRO 38 Cb 1.27 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1gfy h PRO 38 CO 0.60 0.54 0.08 1.57 -0.21 0.00 0.00 178.00 180.58 1gfy h LYS 39 N 0.84 0.00 -0.41 1.05 2.10 -1.95 -2.21 116.57 115.99 1gfy h LYS 39 Ca 0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.09 1gfy h LYS 39 Cb 0.43 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.76 1gfy h LYS 39 CO -0.27 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.27 1gfy n ASN 40 N -2.95 3.25 -0.20 7.07 3.02 0.76 -4.48 115.26 121.74 1gfy n ASN 40 Ca -0.03 -1.96 -0.03 0.00 -0.03 0.00 0.00 54.58 52.53 1gfy n ASN 40 Cb 0.14 -0.27 0.07 0.00 -0.61 0.00 0.00 39.78 39.11 1gfy n ASN 40 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1gfy h LYS 41 N 4.08 0.56 -0.18 3.52 3.64 -1.38 0.14 116.57 126.95 1gfy h LYS 41 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1gfy h LYS 41 Cb 0.91 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 1gfy h LYS 41 CO 0.00 0.37 0.00 0.27 -2.27 0.00 0.00 179.45 177.82 1gfy n ASN 42 N -4.85 0.75 -0.63 4.20 0.23 -1.26 -2.43 115.26 111.27 1gfy n ASN 42 Ca 0.06 -2.01 0.11 0.00 -0.53 0.00 0.00 54.58 52.21 1gfy n ASN 42 Cb 0.16 -0.11 0.03 0.00 -2.08 0.00 0.00 39.78 37.77 1gfy n ASN 42 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1gfy n ARG 43 N -0.11 1.54 -4.95 -3.83 1.74 0.47 -4.90 116.66 106.61 1gfy n ARG 43 Ca 0.04 -1.26 -0.32 0.00 -0.77 0.00 0.00 57.85 55.54 1gfy n ARG 43 Cb 0.13 -1.46 -0.14 0.00 -1.02 0.00 0.00 32.46 29.96 1gfy n ARG 43 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1gfy s ASN 44 N -2.31 3.79 0.07 0.55 0.01 -1.02 -4.50 114.94 111.53 1gfy s ASN 44 Ca 0.21 -0.31 -0.13 0.00 -0.71 0.00 0.00 52.86 51.92 1gfy s ASN 44 Cb 0.18 -1.06 -0.25 0.00 0.41 0.00 0.00 41.25 40.54 1gfy s ASN 44 CO 0.49 0.27 1.16 -0.09 -1.51 0.00 0.00 177.10 177.42 1gfy h ARG 45 N 5.91 0.63 -4.66 -0.60 2.43 -1.87 -3.44 114.38 112.78 1gfy h ARG 45 Ca -0.37 -0.76 -0.54 0.00 -0.81 0.00 0.00 59.98 57.50 1gfy h ARG 45 Cb 1.17 0.23 -0.33 0.00 -0.42 0.00 0.00 29.97 30.62 1gfy h ARG 45 CO 0.51 1.33 -0.82 0.71 -1.51 0.00 0.00 179.97 180.19 1gfy s TYR 46 N -3.15 1.64 0.41 2.20 2.02 -1.26 -5.01 117.35 114.19 1gfy s TYR 46 Ca -0.09 -0.63 0.11 0.00 -0.37 0.00 0.00 57.07 56.09 1gfy s TYR 46 Cb 0.07 -1.18 0.93 0.00 -0.40 0.00 0.00 41.96 41.38 1gfy s TYR 46 CO 0.92 -0.31 1.97 -0.24 -1.57 0.00 0.00 175.55 176.32 1gfy h VAL 47 N 5.93 0.94 -0.61 0.71 3.04 -1.97 -0.96 116.25 123.33 1gfy h VAL 47 Ca -0.29 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.22 1gfy h VAL 47 Cb 1.19 0.37 0.00 0.00 -2.01 0.00 0.00 31.29 30.84 1gfy h VAL 47 CO 0.47 0.10 0.00 -0.46 -1.01 0.00 0.00 177.57 176.67 1gfy n ASN 48 N -4.48 5.34 -3.78 3.17 6.94 -1.26 -4.76 115.26 116.42 1gfy n ASN 48 Ca 0.10 -2.72 -0.29 0.00 -0.02 0.00 0.00 54.58 51.65 1gfy n ASN 48 Cb 0.32 -0.65 -0.16 0.00 -2.36 0.00 0.00 39.78 36.94 1gfy n ASN 48 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1gfy s VAL 49 N -2.38 0.83 0.07 3.53 -7.23 -0.36 -5.11 120.40 109.76 1gfy s VAL 49 Ca 0.53 -0.89 0.04 0.00 -1.81 0.00 0.00 61.98 59.85 1gfy s VAL 49 Cb 0.38 -1.35 -0.03 0.00 0.56 0.00 0.00 36.38 35.94 1gfy s VAL 49 CO 0.20 -0.28 -0.12 -0.44 -0.31 0.00 0.00 175.10 174.14 1gfy s SER 50 N 1.70 1.47 0.14 4.85 0.01 -1.26 -4.58 113.70 116.03 1gfy s SER 50 Ca 0.00 -0.66 -0.30 0.00 1.31 0.00 0.00 55.95 56.30 1gfy s SER 50 Cb -0.18 -0.02 -0.07 0.00 0.21 0.00 0.00 66.02 65.96 1gfy s SER 50 CO -0.11 -0.15 1.15 -2.16 0.41 0.00 0.00 173.24 172.38 1gfy s PRO 51 N -1.99 4.52 0.64 12.44 0.04 -1.26 -4.57 135.00 144.82 1gfy s PRO 51 Ca -0.01 1.77 -0.18 0.00 0.04 0.00 0.00 61.00 62.61 1gfy s PRO 51 Cb -0.08 -3.29 -0.02 0.00 0.04 0.00 0.00 34.50 31.15 1gfy s PRO 51 CO 0.01 -0.07 1.25 1.19 0.04 0.00 0.00 177.00 179.42 1gfy n PHE 52 N 2.92 1.79 0.07 0.56 3.72 -1.26 -4.49 117.46 120.77 1gfy n PHE 52 Ca 0.05 0.42 0.01 0.00 -0.05 0.00 0.00 57.45 57.88 1gfy n PHE 52 Cb 0.46 -2.25 0.33 0.00 -0.94 0.00 0.00 39.48 37.08 1gfy n PHE 52 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1gfy h ASP 53 N 0.58 0.32 1.16 4.37 3.32 -1.15 -2.55 116.42 122.47 1gfy h ASP 53 Ca -0.51 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.45 1gfy h ASP 53 Cb 1.34 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 40.80 1gfy h ASP 53 CO 0.53 0.48 -0.08 1.12 -1.72 0.00 0.00 179.24 179.57 1gfy h HIS 54 N 0.32 0.00 0.00 4.55 2.07 -1.91 -3.16 115.15 117.02 1gfy h HIS 54 Ca 0.06 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.58 1gfy h HIS 54 Cb 0.42 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.40 1gfy h HIS 54 CO 0.01 0.08 -0.02 -1.13 -3.07 0.00 0.00 177.93 173.80 1gfy n SER 55 N -3.18 1.76 -4.77 3.10 3.41 -1.14 -5.06 113.62 107.74 1gfy n SER 55 Ca 0.01 -2.12 -0.35 0.00 -0.26 0.00 0.00 58.87 56.15 1gfy n SER 55 Cb 0.39 -0.10 -0.00 0.00 -0.26 0.00 0.00 64.21 64.24 1gfy n SER 55 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gfy s ARG 56 N -1.25 3.45 -0.12 4.33 1.70 -0.97 -0.47 118.95 125.62 1gfy s ARG 56 Ca 0.07 1.65 -0.28 0.00 -0.47 0.00 0.00 55.73 56.69 1gfy s ARG 56 Cb 0.06 -2.09 -0.01 0.00 -0.57 0.00 0.00 34.95 32.34 1gfy s ARG 56 CO 0.01 -0.78 0.95 0.42 -1.08 0.00 0.00 175.30 174.82 1gfy s ILE 57 N -1.72 4.82 -0.07 4.99 -1.09 -0.22 -4.78 121.20 123.13 1gfy s ILE 57 Ca 0.71 1.92 -0.18 0.00 -2.23 0.00 0.00 60.65 60.88 1gfy s ILE 57 Cb -0.25 -4.26 -0.05 0.00 -1.58 0.00 0.00 42.46 36.32 1gfy s ILE 57 CO 0.28 0.02 0.48 -0.54 -1.23 0.00 0.00 174.94 173.95 1gfy s LYS 58 N 2.01 4.23 0.30 2.79 1.02 -1.26 -4.07 119.74 124.77 1gfy s LYS 58 Ca 0.45 0.49 -0.29 0.00 0.02 0.00 0.00 55.97 56.64 1gfy s LYS 58 Cb -0.18 -3.36 -0.10 0.00 -0.52 0.00 0.00 37.83 33.67 1gfy s LYS 58 CO 0.16 0.34 1.39 -0.51 -0.92 0.00 0.00 175.35 175.82 1gfy s LEU 59 N 0.02 4.39 -1.33 3.17 2.01 0.34 -4.91 118.68 122.37 1gfy s LEU 59 Ca 0.26 2.74 -0.15 0.00 0.01 0.00 0.00 54.13 56.99 1gfy s LEU 59 Cb -0.16 -3.64 0.09 0.00 0.01 0.00 0.00 46.19 42.48 1gfy s LEU 59 CO 0.12 -0.66 1.86 1.41 1.01 0.00 0.00 176.35 180.09 1gfy n HIS 60 N 1.38 4.19 -3.64 0.29 8.25 -1.26 -4.63 115.22 119.80 1gfy n HIS 60 Ca 0.03 -2.95 -0.15 0.00 -0.26 0.00 0.00 57.72 54.39 1gfy n HIS 60 Cb 0.41 -2.48 -0.08 0.00 1.12 0.00 0.00 29.99 28.96 1gfy n HIS 60 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 1gfy s GLN 61 N 3.12 0.80 0.05 -0.41 -2.07 -1.26 -5.07 119.66 114.82 1gfy s GLN 61 Ca 0.49 0.54 -0.15 0.00 -1.82 0.00 0.00 55.36 54.41 1gfy s GLN 61 Cb 0.07 0.38 -0.30 0.00 -1.09 0.00 0.00 33.01 32.07 1gfy s GLN 61 CO 0.01 -0.17 1.09 0.93 -1.32 0.00 0.00 175.29 175.84 1gfy h GLU 62 N 4.39 0.63 0.00 9.60 5.08 -2.02 -3.33 114.58 128.93 1gfy h GLU 62 Ca -0.28 -0.84 0.00 0.00 -1.00 0.00 0.00 59.36 57.24 1gfy h GLU 62 Cb 1.16 0.28 0.00 0.00 0.50 0.00 0.00 28.75 30.69 1gfy h GLU 62 CO 0.24 1.39 0.00 -3.47 -1.00 0.00 0.00 179.01 176.16 1gfy n ASP 63 N -3.80 0.00 -3.59 1.42 2.03 -1.26 -4.58 116.55 106.77 1gfy n ASP 63 Ca -0.14 0.78 -0.20 0.00 0.52 0.00 0.00 54.79 55.75 1gfy n ASP 63 Cb 0.99 -0.28 -0.15 0.00 -0.72 0.00 0.00 41.12 40.95 1gfy n ASP 63 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1gfy s ASN 64 N -2.61 1.43 0.00 1.67 3.84 -1.26 -5.03 114.94 112.98 1gfy s ASN 64 Ca 0.00 -0.13 0.16 0.00 0.21 0.00 0.00 52.86 53.10 1gfy s ASN 64 Cb 0.00 0.14 0.92 0.00 -0.55 0.00 0.00 41.25 41.76 1gfy s ASN 64 CO 0.00 -0.30 1.60 -0.90 -2.79 0.00 0.00 177.10 174.71 1gfy n ASP 65 N 5.31 0.22 -4.72 -4.21 5.68 -1.25 -4.87 116.55 112.71 1gfy n ASP 65 Ca -0.05 -1.53 -0.39 0.00 -0.50 0.00 0.00 54.79 52.31 1gfy n ASP 65 Cb 0.50 -0.02 -0.05 0.00 -1.14 0.00 0.00 41.12 40.41 1gfy n ASP 65 CO 0.00 0.00 0.00 -0.47 -1.33 0.00 0.00 177.20 175.40 1gfy s TYR 66 N -1.97 3.58 0.04 2.11 5.04 -1.26 -0.50 117.35 124.39 1gfy s TYR 66 Ca 0.25 1.18 0.03 0.00 -2.44 0.00 0.00 57.07 56.09 1gfy s TYR 66 Cb 0.12 -2.73 -0.02 0.00 0.35 0.00 0.00 41.96 39.67 1gfy s TYR 66 CO 0.19 0.13 -0.10 -1.50 -1.34 0.00 0.00 175.55 172.93 1gfy s ILE 67 N 0.65 0.79 -1.06 3.14 2.07 -1.26 -4.88 121.20 120.65 1gfy s ILE 67 Ca 0.35 -0.99 -0.23 0.00 -1.41 0.00 0.00 60.65 58.37 1gfy s ILE 67 Cb -0.17 -0.77 -0.04 0.00 0.13 0.00 0.00 42.46 41.61 1gfy s ILE 67 CO 0.17 -0.18 1.86 0.21 -1.91 0.00 0.00 174.94 175.08 1gfy s ASN 68 N -1.30 5.46 -0.14 4.50 3.84 -1.26 -4.60 114.94 121.44 1gfy s ASN 68 Ca -0.04 -1.33 -0.25 0.00 0.21 0.00 0.00 52.86 51.46 1gfy s ASN 68 Cb -0.08 -2.57 0.06 0.00 -0.55 0.00 0.00 41.25 38.10 1gfy s ASN 68 CO 0.01 -2.54 0.61 0.00 -2.79 0.00 0.00 177.10 172.40 1gfy s ALA 69 N 9.13 -1.56 0.12 1.71 0.00 -1.26 -3.15 121.76 126.75 1gfy s ALA 69 Ca 0.65 1.44 0.07 0.00 0.00 0.00 0.00 51.96 54.11 1gfy s ALA 69 Cb -0.03 -0.51 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 1gfy s ALA 69 CO 0.04 -0.32 -0.16 -1.12 0.00 0.00 0.00 175.76 174.20 1gfy s SER 70 N -0.45 2.15 -0.31 0.00 0.01 -0.14 -1.05 113.70 113.90 1gfy s SER 70 Ca -0.06 -0.78 -0.15 0.00 1.31 0.00 0.00 55.95 56.26 1gfy s SER 70 Cb -0.03 -0.09 -0.02 0.00 0.21 0.00 0.00 66.02 66.09 1gfy s SER 70 CO 0.05 -0.09 0.39 -0.22 0.41 0.00 0.00 173.24 173.77 1gfy s LEU 71 N -2.34 4.25 -0.55 2.44 1.98 0.38 -0.90 118.68 123.95 1gfy s LEU 71 Ca 0.09 0.01 -0.19 0.00 -2.89 0.00 0.00 54.13 51.15 1gfy s LEU 71 Cb -0.06 -2.41 0.08 0.00 0.66 0.00 0.00 46.19 44.46 1gfy s LEU 71 CO 0.04 -0.30 0.68 -0.63 -1.89 0.00 0.00 176.35 174.25 1gfy s ILE 72 N 2.10 4.82 -0.50 6.68 1.09 0.39 -4.86 121.20 130.92 1gfy s ILE 72 Ca 0.14 -0.72 -0.15 0.00 -1.10 0.00 0.00 60.65 58.83 1gfy s ILE 72 Cb -0.16 -4.41 0.11 0.00 -1.06 0.00 0.00 42.46 36.94 1gfy s ILE 72 CO 0.11 -0.98 0.43 -0.75 -0.10 0.00 0.00 174.94 173.65 1gfy s LYS 73 N 2.72 2.90 -0.77 2.79 2.20 -1.26 -0.99 119.74 127.33 1gfy s LYS 73 Ca 0.14 -1.58 -0.19 0.00 -0.36 0.00 0.00 55.97 53.98 1gfy s LYS 73 Cb -0.21 -4.17 0.12 0.00 -1.51 0.00 0.00 37.83 32.06 1gfy s LYS 73 CO 0.09 -1.19 0.93 -1.64 -0.36 0.00 0.00 175.35 173.18 1gfy s MET 74 N 1.58 3.35 0.02 4.03 -1.94 -0.77 -4.93 119.30 120.63 1gfy s MET 74 Ca 0.04 -1.56 -0.25 0.00 -1.71 0.00 0.00 55.69 52.21 1gfy s MET 74 Cb -0.27 -4.54 -0.18 0.00 2.01 0.00 0.00 34.83 31.85 1gfy s MET 74 CO 0.04 -1.65 1.42 1.49 -0.01 0.00 0.00 175.02 176.31 1gfy h GLU 75 N 8.93 -0.03 -0.26 2.03 4.81 -1.96 0.17 114.58 128.28 1gfy h GLU 75 Ca -0.06 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1gfy h GLU 75 Cb 1.05 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.39 1gfy h GLU 75 CO 1.07 0.29 -0.04 1.49 -0.73 0.00 0.00 179.01 181.10 1gfy h GLU 76 N -0.35 0.03 0.00 1.92 4.81 -1.96 -0.92 114.58 118.11 1gfy h GLU 76 Ca -0.00 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1gfy h GLU 76 Cb 0.33 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.70 1gfy h GLU 76 CO 0.00 0.02 -0.08 0.00 -0.73 0.00 0.00 179.01 178.22 1gfy h ALA 77 N 1.24 1.12 -4.86 2.92 0.00 -1.91 -3.47 119.26 114.30 1gfy h ALA 77 Ca 0.12 -0.07 -0.40 0.00 0.00 0.00 0.00 54.91 54.56 1gfy h ALA 77 Cb 0.18 -0.01 0.09 0.00 0.00 0.00 0.00 17.79 18.04 1gfy h ALA 77 CO -0.24 0.10 -0.63 1.04 0.00 0.00 0.00 179.25 179.52 1gfy n GLN 78 N -3.35 -5.84 -4.53 0.00 1.13 0.59 -4.88 117.38 100.49 1gfy n GLN 78 Ca -0.01 0.88 -0.22 0.00 -1.94 0.00 0.00 57.00 55.72 1gfy n GLN 78 Cb 0.26 -5.79 -0.16 0.00 0.11 0.00 0.00 30.24 24.66 1gfy n GLN 78 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1gfy s ARG 79 N -5.88 1.17 0.13 -1.09 3.52 -1.16 -4.98 118.95 110.65 1gfy s ARG 79 Ca 0.39 -0.41 0.09 0.00 -0.13 0.00 0.00 55.73 55.67 1gfy s ARG 79 Cb -0.17 -1.07 -0.04 0.00 -1.56 0.00 0.00 34.95 32.10 1gfy s ARG 79 CO 0.48 0.17 -0.16 -1.12 -0.81 0.00 0.00 175.30 173.86 1gfy s SER 80 N 0.07 3.96 0.07 -2.12 0.01 -1.26 -1.85 113.70 112.58 1gfy s SER 80 Ca -0.02 -0.56 0.04 0.00 1.31 0.00 0.00 55.95 56.72 1gfy s SER 80 Cb -0.09 -0.58 -0.03 0.00 0.21 0.00 0.00 66.02 65.53 1gfy s SER 80 CO 0.01 0.16 -0.11 -0.31 0.41 0.00 0.00 173.24 173.40 1gfy s TYR 81 N -1.25 1.02 -0.25 2.43 1.51 -0.17 -3.96 117.35 116.68 1gfy s TYR 81 Ca 0.19 -0.53 -0.15 0.00 -1.01 0.00 0.00 57.07 55.57 1gfy s TYR 81 Cb -0.10 -0.57 -0.04 0.00 -0.11 0.00 0.00 41.96 41.14 1gfy s TYR 81 CO 0.11 0.00 0.37 0.42 -1.11 0.00 0.00 175.55 175.35 1gfy s ILE 82 N -1.66 5.19 -0.15 2.71 1.01 0.10 -0.46 121.20 127.95 1gfy s ILE 82 Ca -0.02 0.60 -0.03 0.00 0.00 0.00 0.00 60.65 61.20 1gfy s ILE 82 Cb -0.08 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.66 1gfy s ILE 82 CO 0.01 0.19 -0.03 -0.76 0.00 0.00 0.00 174.94 174.35 1gfy s LEU 83 N 1.80 3.31 0.05 2.97 1.02 -0.07 -0.06 118.68 127.70 1gfy s LEU 83 Ca 0.16 -0.09 -0.04 0.00 0.02 0.00 0.00 54.13 54.18 1gfy s LEU 83 Cb -0.15 -1.79 -0.02 0.00 0.02 0.00 0.00 46.19 44.24 1gfy s LEU 83 CO 0.09 0.20 0.05 0.28 0.02 0.00 0.00 176.35 176.99 1gfy s THR 84 N 0.18 0.17 0.72 5.49 -1.32 -0.84 -0.97 115.64 119.08 1gfy s THR 84 Ca -0.01 -1.43 -0.11 0.00 -1.21 0.00 0.00 61.69 58.92 1gfy s THR 84 Cb -0.14 -1.26 0.02 0.00 -1.51 0.00 0.00 72.50 69.62 1gfy s THR 84 CO 0.03 -0.79 1.08 0.00 -2.21 0.00 0.00 174.62 172.73 1gfy s GLN 85 N -3.45 2.71 0.15 7.08 -2.07 -1.19 -3.10 119.66 119.79 1gfy s GLN 85 Ca 0.02 0.63 -0.31 0.00 -1.82 0.00 0.00 55.36 53.88 1gfy s GLN 85 Cb 0.04 -1.99 -0.09 0.00 -1.09 0.00 0.00 33.01 29.88 1gfy s GLN 85 CO -0.08 -1.18 1.51 0.20 -1.32 0.00 0.00 175.29 174.42 1gfy s GLY 86 N -4.10 1.69 0.50 2.60 0.00 0.18 -4.86 107.32 103.33 1gfy s GLY 86 Ca 0.59 1.28 -0.21 0.00 0.00 0.00 0.00 44.72 46.38 1gfy s GLY 86 CO 0.53 2.54 0.84 -1.05 0.00 0.00 0.00 173.10 175.97 1gfy n PRO 87 N 4.00 0.96 -2.46 2.90 -0.02 -1.26 -4.60 135.00 134.52 1gfy n PRO 87 Ca 0.13 0.36 -0.23 0.00 -2.02 0.00 0.00 63.50 61.74 1gfy n PRO 87 Cb 0.40 -1.94 0.06 0.00 -0.02 0.00 0.00 33.50 31.99 1gfy n PRO 87 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1gfy s LEU 88 N -0.40 3.07 0.58 2.45 2.01 -1.26 -0.29 118.68 124.84 1gfy s LEU 88 Ca 0.68 0.12 0.35 0.00 0.01 0.00 0.00 54.13 55.29 1gfy s LEU 88 Cb -0.50 -2.85 1.80 0.00 0.01 0.00 0.00 46.19 44.66 1gfy s LEU 88 CO 0.54 -1.41 2.18 -0.65 1.01 0.00 0.00 176.35 178.01 1gfy h PRO 89 N -0.26 0.00 -0.28 1.29 0.11 -1.96 -2.11 132.00 128.79 1gfy h PRO 89 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1gfy h PRO 89 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1gfy h PRO 89 CO 0.54 0.04 0.00 0.27 -0.21 0.00 0.00 178.00 178.64 1gfy n ASN 90 N -3.36 3.17 -0.18 -2.05 6.94 -1.26 -4.47 115.26 114.05 1gfy n ASN 90 Ca -0.02 -1.93 0.04 0.00 -0.02 0.00 0.00 54.58 52.65 1gfy n ASN 90 Cb 0.18 -0.18 0.06 0.00 -2.36 0.00 0.00 39.78 37.49 1gfy n ASN 90 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1gfy n THR 91 N 1.30 1.00 0.03 5.53 -2.24 -0.80 -4.71 114.28 114.38 1gfy n THR 91 Ca 0.16 -1.17 -0.08 0.00 -2.27 0.00 0.00 64.05 60.70 1gfy n THR 91 Cb 0.55 0.22 0.08 0.00 -2.10 0.00 0.00 70.33 69.09 1gfy n THR 91 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gfy h GLY 93 N 1.16 0.88 0.36 0.00 0.00 -1.91 -1.88 103.07 101.68 1gfy h GLY 93 Ca 0.01 -0.87 0.08 0.00 0.00 0.00 0.00 47.33 46.55 1gfy h GLY 93 CO 0.10 0.79 0.04 0.45 0.00 0.00 0.00 176.54 177.92 1gfy h HIS 94 N 0.59 0.06 -0.41 5.60 -0.00 -1.85 0.15 115.15 119.29 1gfy h HIS 94 Ca 0.06 0.03 0.08 0.00 -0.00 0.00 0.00 60.37 60.54 1gfy h HIS 94 Cb 0.86 0.04 -0.08 0.00 -0.00 0.00 0.00 27.41 28.24 1gfy h HIS 94 CO 0.07 -0.04 -0.08 0.35 -0.00 0.00 0.00 177.93 178.22 1gfy h PHE 95 N 0.16 -0.18 -0.13 2.45 3.57 -1.09 0.15 116.94 121.88 1gfy h PHE 95 Ca 0.22 0.04 -0.12 0.00 3.53 0.00 0.00 57.97 61.63 1gfy h PHE 95 Cb 0.30 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 1gfy h PHE 95 CO -0.25 -0.16 -0.46 -1.49 -2.23 0.00 0.00 178.31 173.73 1gfy h TRP 96 N 0.02 0.37 -0.54 0.41 4.06 -1.16 -0.68 115.95 118.44 1gfy h TRP 96 Ca 0.20 -0.11 0.04 0.00 2.06 0.00 0.00 58.89 61.08 1gfy h TRP 96 Cb 0.30 -0.08 -0.04 0.00 -1.00 0.00 0.00 29.16 28.34 1gfy h TRP 96 CO -0.34 0.72 0.29 1.49 -3.56 0.00 0.00 178.44 177.03 1gfy h GLU 97 N 0.25 0.54 0.09 0.49 4.81 0.02 -1.41 114.58 119.37 1gfy h GLU 97 Ca 0.02 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1gfy h GLU 97 Cb 0.91 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.17 1gfy h GLU 97 CO 0.07 0.36 -0.04 1.98 -0.73 0.00 0.00 179.01 180.65 1gfy h MET 98 N 0.55 -0.12 -0.74 1.92 4.05 -0.46 -1.29 114.93 118.86 1gfy h MET 98 Ca 0.24 0.01 0.09 0.00 -0.28 0.00 0.00 59.70 59.76 1gfy h MET 98 Cb 0.13 0.03 -0.07 0.00 -0.80 0.00 0.00 31.60 30.88 1gfy h MET 98 CO -0.15 -0.08 0.38 0.28 0.23 0.00 0.00 176.91 177.57 1gfy h VAL 99 N -0.12 0.87 0.19 -5.77 2.07 -0.86 -0.94 116.25 111.68 1gfy h VAL 99 Ca -0.01 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1gfy h VAL 99 Cb 0.09 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 1gfy h VAL 99 CO 0.02 0.12 -0.09 -0.25 0.02 0.00 0.00 177.57 177.39 1gfy h TRP 100 N 0.65 -0.24 -0.47 1.57 2.91 -0.95 -0.82 115.95 118.59 1gfy h TRP 100 Ca 0.36 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.35 1gfy h TRP 100 Cb 0.36 0.08 -0.02 0.00 -0.51 0.00 0.00 29.16 29.07 1gfy h TRP 100 CO -0.09 0.02 0.21 0.93 -1.03 0.00 0.00 178.44 178.47 1gfy h GLU 101 N -0.48 0.69 0.00 2.65 5.08 -1.17 -2.77 114.58 118.59 1gfy h GLU 101 Ca -0.03 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1gfy h GLU 101 Cb 0.36 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1gfy h GLU 101 CO 0.04 0.61 0.00 1.96 -1.00 0.00 0.00 179.01 180.62 1gfy h GLN 102 N 0.62 0.00 -2.00 2.33 1.08 -1.22 -3.47 115.11 112.45 1gfy h GLN 102 Ca 0.16 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.17 1gfy h GLN 102 Cb 0.16 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.60 1gfy h GLN 102 CO -0.02 0.00 -0.27 1.63 -0.95 0.00 0.00 178.83 179.22 1gfy n LYS 103 N -2.37 -1.75 -2.70 1.46 5.02 -0.38 -3.98 118.16 113.46 1gfy n LYS 103 Ca 0.02 0.44 -0.35 0.00 -2.02 0.00 0.00 58.31 56.40 1gfy n LYS 103 Cb 0.27 -4.35 -0.06 0.00 -0.02 0.00 0.00 35.03 30.87 1gfy n LYS 103 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1gfy s SER 104 N -2.76 6.97 -0.20 4.39 0.01 -0.78 0.36 113.70 121.69 1gfy s SER 104 Ca 0.09 1.87 0.17 0.00 1.31 0.00 0.00 55.95 59.38 1gfy s SER 104 Cb -0.04 -2.57 -0.24 0.00 0.21 0.00 0.00 66.02 63.38 1gfy s SER 104 CO 0.11 -0.33 0.05 -1.14 0.41 0.00 0.00 173.24 172.34 1gfy n ARG 105 N -0.08 0.74 -4.49 12.44 0.00 -1.26 -4.87 116.66 119.14 1gfy n ARG 105 Ca 0.05 -0.00 -0.26 0.00 -0.00 0.00 0.00 57.85 57.64 1gfy n ARG 105 Cb 0.51 -1.51 -0.13 0.00 0.00 0.00 0.00 32.46 31.33 1gfy n ARG 105 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1gfy s GLY 106 N -5.51 1.24 -0.13 5.14 0.00 -1.26 -0.98 107.32 105.82 1gfy s GLY 106 Ca -0.11 -1.19 -0.00 0.00 0.00 0.00 0.00 44.72 43.41 1gfy s GLY 106 CO 0.80 -1.15 -0.10 0.14 0.00 0.00 0.00 173.10 172.79 1gfy s VAL 107 N -0.97 1.27 -0.27 1.40 1.01 -0.16 -2.37 120.40 120.31 1gfy s VAL 107 Ca 0.08 -0.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.49 1gfy s VAL 107 Cb -0.09 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 1gfy s VAL 107 CO 0.03 0.38 0.13 -0.69 0.00 0.00 0.00 175.10 174.95 1gfy s VAL 108 N 1.60 4.76 -0.25 2.92 1.01 0.04 -0.59 120.40 129.90 1gfy s VAL 108 Ca 0.04 -0.03 -0.04 0.00 0.00 0.00 0.00 61.98 61.95 1gfy s VAL 108 Cb -0.13 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 33.00 1gfy s VAL 108 CO -0.09 0.29 -0.01 -0.32 0.00 0.00 0.00 175.10 174.97 1gfy s MET 109 N 1.68 3.23 0.00 2.72 0.00 0.11 -0.51 119.30 126.52 1gfy s MET 109 Ca 0.07 -0.74 0.19 0.00 0.00 0.00 0.00 55.69 55.21 1gfy s MET 109 Cb -0.16 -3.12 0.40 0.00 0.00 0.00 0.00 34.83 31.96 1gfy s MET 109 CO 0.07 -0.29 1.33 1.28 0.00 0.00 0.00 175.02 177.40 1gfy n LEU 110 N 4.80 3.25 -4.43 4.11 4.77 0.42 -0.66 117.00 129.26 1gfy n LEU 110 Ca -0.17 -1.65 -0.21 0.00 -0.03 0.00 0.00 56.01 53.95 1gfy n LEU 110 Cb 0.49 -0.26 -0.10 0.00 -2.33 0.00 0.00 43.42 41.22 1gfy n LEU 110 CO 0.29 0.74 -0.26 0.54 -1.33 0.00 0.00 177.39 177.38 1gfy s ASN 111 N -1.21 2.17 0.32 -1.43 2.20 -1.24 -4.59 114.94 111.15 1gfy s ASN 111 Ca 0.34 -1.41 0.01 0.00 -0.94 0.00 0.00 52.86 50.86 1gfy s ASN 111 Cb 0.19 0.02 -0.03 0.00 -2.00 0.00 0.00 41.25 39.43 1gfy s ASN 111 CO 0.26 -0.66 0.51 -0.13 -2.94 0.00 0.00 177.10 174.13 1gfy s ARG 112 N -3.91 3.48 0.11 3.55 0.52 -1.26 -4.80 118.95 116.64 1gfy s ARG 112 Ca 0.36 -0.40 -0.21 0.00 -0.52 0.00 0.00 55.73 54.95 1gfy s ARG 112 Cb 0.08 -2.71 -0.09 0.00 0.52 0.00 0.00 34.95 32.74 1gfy s ARG 112 CO 0.15 0.22 1.73 0.28 0.02 0.00 0.00 175.30 177.70 1gfy h VAL 113 N 0.89 0.94 -3.31 3.52 2.07 -1.93 -3.41 116.25 115.03 1gfy h VAL 113 Ca -0.50 -0.01 -0.63 0.00 0.82 0.00 0.00 66.70 66.38 1gfy h VAL 113 Cb 1.22 0.89 -0.19 0.00 -1.52 0.00 0.00 31.29 31.70 1gfy h VAL 113 CO 0.62 0.01 -0.61 -0.32 0.02 0.00 0.00 177.57 177.29 1gfy s MET 114 N -6.19 3.84 -0.11 1.57 -2.45 -1.26 0.32 119.30 115.02 1gfy s MET 114 Ca -0.13 -0.42 -0.10 0.00 -1.25 0.00 0.00 55.69 53.79 1gfy s MET 114 Cb 0.08 -3.09 0.03 0.00 1.25 0.00 0.00 34.83 33.10 1gfy s MET 114 CO 0.67 0.24 0.29 -1.21 1.05 0.00 0.00 175.02 176.07 1gfy s GLU 115 N 0.41 0.33 -1.65 4.11 2.02 -0.49 -4.86 118.70 118.57 1gfy s GLU 115 Ca 0.00 0.41 -0.11 0.00 0.02 0.00 0.00 54.97 55.29 1gfy s GLU 115 Cb -0.13 0.16 0.10 0.00 0.10 0.00 0.00 34.13 34.36 1gfy s GLU 115 CO 0.01 -0.04 0.44 1.63 0.02 0.00 0.00 175.26 177.32 1gfy n LYS 116 N 2.97 -1.88 -0.99 1.61 5.02 -1.26 -1.06 118.16 122.57 1gfy n LYS 116 Ca -0.13 0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1gfy n LYS 116 Cb 0.58 -4.45 0.00 0.00 -0.02 0.00 0.00 35.03 31.14 1gfy n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gfy n GLY 117 N -1.77 0.90 3.22 0.72 0.00 -1.26 -4.99 105.19 102.02 1gfy n GLY 117 Ca -0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.73 1gfy n GLY 117 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1gfy s SER 118 N -2.81 1.97 -0.83 1.61 0.01 -0.22 -5.10 113.70 108.32 1gfy s SER 118 Ca 0.00 -0.73 -0.22 0.00 1.31 0.00 0.00 55.95 56.31 1gfy s SER 118 Cb 0.00 -0.07 0.08 0.00 0.21 0.00 0.00 66.02 66.24 1gfy s SER 118 CO 0.00 -0.09 1.15 -0.76 0.41 0.00 0.00 173.24 173.95 1gfy s LEU 119 N -2.13 4.28 0.00 2.44 1.43 -1.26 -1.39 118.68 122.04 1gfy s LEU 119 Ca 0.05 -1.36 0.28 0.00 -1.03 0.00 0.00 54.13 52.07 1gfy s LEU 119 Cb -0.07 -2.46 1.33 0.00 0.03 0.00 0.00 46.19 45.02 1gfy s LEU 119 CO 0.03 -1.38 1.95 0.29 0.23 0.00 0.00 176.35 177.47 1gfy n LYS 120 N 7.76 0.23 -3.61 1.70 4.76 0.15 -4.87 118.16 124.29 1gfy n LYS 120 Ca 0.13 0.02 -0.09 0.00 -2.87 0.00 0.00 58.31 55.51 1gfy n LYS 120 Cb 0.48 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.11 1gfy n LYS 120 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1gfy s ALA 122 N -0.61 2.23 -1.12 0.00 0.00 0.60 -4.71 121.76 118.15 1gfy s ALA 122 Ca 0.01 1.03 -0.21 0.00 0.00 0.00 0.00 51.96 52.79 1gfy s ALA 122 Cb -0.02 -3.51 0.04 0.00 0.00 0.00 0.00 23.12 19.63 1gfy s ALA 122 CO -0.03 -1.74 1.62 -1.14 0.00 0.00 0.00 175.76 174.47 1gfy s GLN 123 N -3.66 3.56 0.00 0.00 2.00 -1.26 -4.80 119.66 115.50 1gfy s GLN 123 Ca 0.78 -1.35 0.28 0.00 -2.00 0.00 0.00 55.36 53.07 1gfy s GLN 123 Cb -0.33 -5.39 1.05 0.00 0.80 0.00 0.00 33.01 29.14 1gfy s GLN 123 CO 0.42 -2.45 1.74 2.48 -0.50 0.00 0.00 175.29 176.99 1gfy n TYR 124 N 9.53 0.00 -4.25 1.67 4.11 -1.26 -4.89 117.16 122.07 1gfy n TYR 124 Ca 0.40 0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 58.10 1gfy n TYR 124 Cb 0.49 -0.02 -0.12 0.00 -0.00 0.00 0.00 39.34 39.69 1gfy n TYR 124 CO 0.00 0.00 0.00 1.67 -0.00 0.00 0.00 176.86 178.53 1gfy s TRP 125 N -2.08 1.50 0.14 -3.48 -2.14 -1.26 -5.05 118.94 106.56 1gfy s TRP 125 Ca 0.36 -0.49 -0.31 0.00 2.66 0.00 0.00 56.10 58.32 1gfy s TRP 125 Cb 0.21 -0.80 -0.09 0.00 -3.10 0.00 0.00 33.47 29.69 1gfy s TRP 125 CO 0.37 0.16 1.42 -1.25 -2.66 0.00 0.00 176.95 174.99 1gfy s PRO 126 N -2.30 4.30 0.00 3.25 0.04 -1.26 -4.94 135.00 134.09 1gfy s PRO 126 Ca 0.07 2.14 0.28 0.00 0.04 0.00 0.00 61.00 63.53 1gfy s PRO 126 Cb -0.07 -3.22 1.10 0.00 0.04 0.00 0.00 34.50 32.35 1gfy s PRO 126 CO 0.04 -0.45 1.79 1.04 0.04 0.00 0.00 177.00 179.45 1gfy n GLN 127 N 3.74 0.56 -3.76 4.56 6.02 -1.26 -4.63 117.38 122.61 1gfy n GLN 127 Ca 0.11 -0.21 -0.13 0.00 -0.01 0.00 0.00 57.00 56.75 1gfy n GLN 127 Cb 0.41 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.09 1gfy n GLN 127 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 1gfy s LYS 128 N -2.59 0.64 0.19 -1.09 -2.85 -1.26 -5.05 119.74 107.74 1gfy s LYS 128 Ca 0.25 -0.12 -0.12 0.00 -1.00 0.00 0.00 55.97 54.98 1gfy s LYS 128 Cb 0.20 0.29 0.22 0.00 -2.06 0.00 0.00 37.83 36.47 1gfy s LYS 128 CO 0.51 -0.17 1.71 0.93 0.10 0.00 0.00 175.35 178.43 1gfy h GLU 129 N 4.04 0.23 0.00 1.78 3.07 -1.90 -2.19 114.58 119.61 1gfy h GLU 129 Ca -0.29 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 1gfy h GLU 129 Cb 1.18 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.03 1gfy h GLU 129 CO 0.39 0.15 0.00 0.93 -1.40 0.00 0.00 179.01 179.08 1gfy h GLU 130 N 0.24 0.00 -2.59 2.33 3.07 -1.96 -3.36 114.58 112.30 1gfy h GLU 130 Ca 0.27 0.00 -0.63 0.00 -0.50 0.00 0.00 59.36 58.50 1gfy h GLU 130 Cb 0.37 0.00 -0.40 0.00 -0.84 0.00 0.00 28.75 27.88 1gfy h GLU 130 CO -0.35 0.00 -0.45 1.63 -1.40 0.00 0.00 179.01 178.44 1gfy n LYS 131 N -2.63 2.48 -0.85 2.33 4.76 -0.82 -5.09 118.16 118.34 1gfy n LYS 131 Ca -0.01 -4.60 -0.33 0.00 -2.87 0.00 0.00 58.31 50.50 1gfy n LYS 131 Cb 0.13 -2.30 0.12 0.00 -1.84 0.00 0.00 35.03 31.15 1gfy n LYS 131 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1gfy n GLU 132 N 1.31 -0.22 -4.13 1.97 4.71 -1.26 -4.60 120.64 118.43 1gfy n GLU 132 Ca 0.26 -0.02 -0.34 0.00 -0.01 0.00 0.00 57.16 57.05 1gfy n GLU 132 Cb 0.38 -1.93 -0.10 0.00 -1.01 0.00 0.00 31.44 28.78 1gfy n GLU 132 CO 0.00 0.00 0.00 -1.64 0.09 0.00 0.00 177.13 175.58 1gfy s MET 133 N -3.65 3.87 -0.16 3.49 -1.94 0.57 -4.98 119.30 116.49 1gfy s MET 133 Ca 0.60 -0.40 -0.05 0.00 -1.71 0.00 0.00 55.69 54.13 1gfy s MET 133 Cb -0.23 -3.12 -0.03 0.00 2.01 0.00 0.00 34.83 33.46 1gfy s MET 133 CO 0.65 0.28 -0.00 0.42 -0.01 0.00 0.00 175.02 176.35 1gfy s ILE 134 N 0.33 4.21 -0.49 2.53 1.09 -1.26 -1.32 121.20 126.29 1gfy s ILE 134 Ca 0.01 -0.24 -0.11 0.00 -1.10 0.00 0.00 60.65 59.21 1gfy s ILE 134 Cb -0.13 -2.86 0.12 0.00 -1.06 0.00 0.00 42.46 38.53 1gfy s ILE 134 CO 0.01 0.49 0.39 -0.36 -0.10 0.00 0.00 174.94 175.36 1gfy s PHE 135 N 0.32 3.39 0.15 3.97 0.08 0.27 -4.93 117.98 121.23 1gfy s PHE 135 Ca -0.01 -1.75 -0.06 0.00 0.12 0.00 0.00 56.93 55.23 1gfy s PHE 135 Cb -0.13 -3.57 -0.03 0.00 -0.57 0.00 0.00 43.02 38.71 1gfy s PHE 135 CO 0.02 -1.00 1.37 0.93 -0.10 0.00 0.00 175.22 176.44 1gfy h GLU 136 N 8.53 0.53 -0.58 0.44 5.08 -1.97 0.88 114.58 127.49 1gfy h GLU 136 Ca -0.23 -0.45 0.13 0.00 -1.00 0.00 0.00 59.36 57.81 1gfy h GLU 136 Cb 1.08 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 1gfy h GLU 136 CO 0.90 1.08 0.40 0.38 -1.00 0.00 0.00 179.01 180.77 1gfy h ASP 137 N 0.36 0.21 -0.06 1.42 2.03 -1.97 -2.70 116.42 115.71 1gfy h ASP 137 Ca -0.05 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.26 1gfy h ASP 137 Cb 1.38 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 39.84 1gfy h ASP 137 CO 0.14 0.12 0.00 0.35 -1.03 0.00 0.00 179.24 178.82 1gfy n THR 138 N -4.44 1.10 -3.20 1.15 -2.24 -1.10 -5.01 114.28 100.54 1gfy n THR 138 Ca 0.10 -1.13 -0.15 0.00 -2.27 0.00 0.00 64.05 60.61 1gfy n THR 138 Cb 0.49 0.42 0.07 0.00 -2.10 0.00 0.00 70.33 69.22 1gfy n THR 138 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1gfy n ASN 139 N -0.43 -3.42 -3.92 3.42 5.15 0.27 -4.91 115.26 111.43 1gfy n ASN 139 Ca 0.04 -0.58 -0.11 0.00 -0.60 0.00 0.00 54.58 53.32 1gfy n ASN 139 Cb 0.32 -4.65 -0.13 0.00 -0.53 0.00 0.00 39.78 34.79 1gfy n ASN 139 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1gfy s LEU 140 N -5.63 2.10 -0.00 1.20 2.01 -1.00 -1.22 118.68 116.13 1gfy s LEU 140 Ca 0.14 -0.21 0.06 0.00 0.01 0.00 0.00 54.13 54.13 1gfy s LEU 140 Cb -0.02 0.01 -0.02 0.00 0.01 0.00 0.00 46.19 46.18 1gfy s LEU 140 CO 0.65 -0.11 -0.20 -0.75 1.01 0.00 0.00 176.35 176.95 1gfy s LYS 141 N -0.60 1.54 -0.04 1.70 2.20 0.64 -0.56 119.74 124.61 1gfy s LYS 141 Ca -0.06 -0.75 0.02 0.00 -0.36 0.00 0.00 55.97 54.82 1gfy s LYS 141 Cb -0.04 -1.52 0.01 0.00 -1.51 0.00 0.00 37.83 34.77 1gfy s LYS 141 CO -0.00 0.41 -0.08 -1.17 -0.36 0.00 0.00 175.35 174.15 1gfy s LEU 142 N -0.61 1.55 0.00 5.43 2.96 -0.43 0.18 118.68 127.76 1gfy s LEU 142 Ca 0.07 -0.19 0.06 0.00 -0.22 0.00 0.00 54.13 53.85 1gfy s LEU 142 Cb -0.08 -0.57 -0.02 0.00 0.50 0.00 0.00 46.19 46.02 1gfy s LEU 142 CO -0.00 0.00 -0.17 -0.89 -1.32 0.00 0.00 176.35 173.97 1gfy s THR 143 N 0.63 1.37 -0.24 3.68 2.01 -0.30 -0.32 115.64 122.47 1gfy s THR 143 Ca -0.10 -0.85 -0.29 0.00 0.31 0.00 0.00 61.69 60.76 1gfy s THR 143 Cb -0.13 -1.16 -0.02 0.00 0.01 0.00 0.00 72.50 71.19 1gfy s THR 143 CO 0.01 0.30 1.60 -0.22 -0.69 0.00 0.00 174.62 175.62 1gfy s LEU 144 N -0.64 3.86 -0.07 4.42 2.96 -1.26 -0.48 118.68 127.45 1gfy s LEU 144 Ca 0.06 1.54 -0.03 0.00 -0.22 0.00 0.00 54.13 55.48 1gfy s LEU 144 Cb -0.07 -3.53 -0.26 0.00 0.50 0.00 0.00 46.19 42.82 1gfy s LEU 144 CO 0.00 -1.28 0.54 0.40 -1.32 0.00 0.00 176.35 174.69 1gfy h ILE 145 N 6.19 0.79 0.00 6.68 1.08 0.11 -3.39 117.51 128.97 1gfy h ILE 145 Ca -0.33 -2.51 0.00 0.00 -0.39 0.00 0.00 64.86 61.63 1gfy h ILE 145 Cb 1.15 2.57 0.00 0.00 -3.07 0.00 0.00 36.82 37.47 1gfy h ILE 145 CO 1.01 0.80 0.00 -1.54 -0.69 0.00 0.00 178.15 177.73 1gfy n SER 146 N -3.41 0.00 -3.65 1.72 3.41 -0.92 -4.97 113.62 105.81 1gfy n SER 146 Ca -0.25 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.20 1gfy n SER 146 Cb 1.05 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.93 1gfy n SER 146 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1gfy s GLU 147 N -2.00 0.85 -0.31 4.33 -1.05 -1.26 -0.68 118.70 118.58 1gfy s GLU 147 Ca 0.00 0.02 0.03 0.00 -0.15 0.00 0.00 54.97 54.87 1gfy s GLU 147 Cb 0.00 0.39 0.09 0.00 -0.44 0.00 0.00 34.13 34.17 1gfy s GLU 147 CO 0.00 -0.25 0.02 0.34 0.95 0.00 0.00 175.26 176.32 1gfy s ASP 148 N -1.26 4.50 -0.31 0.83 2.15 0.22 -4.97 116.67 117.84 1gfy s ASP 148 Ca -0.12 -1.86 -0.18 0.00 0.43 0.00 0.00 52.55 50.82 1gfy s ASP 148 Cb -0.03 -1.44 -0.02 0.00 -0.30 0.00 0.00 42.92 41.13 1gfy s ASP 148 CO 0.07 -0.34 0.52 -0.63 -0.17 0.00 0.00 175.17 174.62 1gfy s ILE 149 N 1.10 5.03 0.04 4.11 1.01 -1.26 -0.70 121.20 130.53 1gfy s ILE 149 Ca 0.06 0.64 0.00 0.00 0.00 0.00 0.00 60.65 61.35 1gfy s ILE 149 Cb -0.19 -3.90 0.00 0.00 0.01 0.00 0.00 42.46 38.38 1gfy s ILE 149 CO -0.10 -0.07 0.03 0.29 0.00 0.00 0.00 174.94 175.09 1gfy n LYS 150 N 5.67 1.27 0.08 2.79 4.76 0.12 -4.99 118.16 127.87 1gfy n LYS 150 Ca -0.04 -0.21 0.00 0.00 -2.87 0.00 0.00 58.31 55.19 1gfy n LYS 150 Cb 0.49 0.01 -0.04 0.00 -1.84 0.00 0.00 35.03 33.65 1gfy n LYS 150 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 1gfy h THR 151 N 0.32 0.74 -0.00 -0.18 1.35 -0.91 -3.36 112.91 110.88 1gfy h THR 151 Ca -0.02 -2.20 0.00 0.00 -0.55 0.00 0.00 66.41 63.64 1gfy h THR 151 Cb 0.08 2.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1gfy h THR 151 CO 0.03 0.42 -0.03 0.00 -0.25 0.00 0.00 175.52 175.70 1gfy n TYR 152 N -3.06 0.00 -3.84 4.73 0.18 -1.26 -5.00 117.16 108.90 1gfy n TYR 152 Ca -0.04 0.00 -0.10 0.00 1.88 0.00 0.00 57.90 59.64 1gfy n TYR 152 Cb 0.81 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 39.71 1gfy n TYR 152 CO 0.00 0.00 0.00 1.52 -2.08 0.00 0.00 176.86 176.30 1gfy s TYR 153 N -0.56 0.14 -0.00 -3.48 1.13 -1.26 -1.34 117.35 111.97 1gfy s TYR 153 Ca 0.01 -0.50 0.03 0.00 -1.41 0.00 0.00 57.07 55.20 1gfy s TYR 153 Cb 0.01 0.10 -0.01 0.00 -1.10 0.00 0.00 41.96 40.96 1gfy s TYR 153 CO 0.03 -0.73 -0.10 0.99 -2.51 0.00 0.00 175.55 173.23 1gfy s THR 154 N -3.90 0.77 -0.17 -3.49 2.01 -0.86 0.15 115.64 110.15 1gfy s THR 154 Ca 0.11 -0.45 -0.04 0.00 0.31 0.00 0.00 61.69 61.61 1gfy s THR 154 Cb 0.02 -0.65 -0.03 0.00 0.01 0.00 0.00 72.50 71.85 1gfy s THR 154 CO -0.04 0.20 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.38 1gfy s VAL 155 N -0.27 4.03 0.06 3.82 1.01 0.13 -1.24 120.40 127.93 1gfy s VAL 155 Ca 0.03 -0.30 0.07 0.00 0.00 0.00 0.00 61.98 61.79 1gfy s VAL 155 Cb -0.04 -2.79 -0.03 0.00 0.00 0.00 0.00 36.38 33.52 1gfy s VAL 155 CO -0.00 0.48 -0.18 -0.13 0.00 0.00 0.00 175.10 175.26 1gfy s ARG 156 N 0.49 2.01 -0.17 2.72 0.52 -0.08 0.73 118.95 125.15 1gfy s ARG 156 Ca -0.02 -1.03 -0.04 0.00 -0.52 0.00 0.00 55.73 54.12 1gfy s ARG 156 Cb -0.14 -2.17 -0.03 0.00 0.52 0.00 0.00 34.95 33.13 1gfy s ARG 156 CO 0.02 0.53 -0.02 -1.14 0.02 0.00 0.00 175.30 174.71 1gfy s GLN 157 N -1.60 3.64 0.10 3.54 0.74 0.15 -0.77 119.66 125.45 1gfy s GLN 157 Ca 0.15 -0.52 0.08 0.00 0.05 0.00 0.00 55.36 55.12 1gfy s GLN 157 Cb -0.11 -2.98 -0.04 0.00 1.10 0.00 0.00 33.01 30.99 1gfy s GLN 157 CO 0.06 0.14 -0.16 -0.51 -0.55 0.00 0.00 175.29 174.28 1gfy s LEU 158 N 0.64 2.78 -0.23 3.68 1.02 -0.21 0.83 118.68 127.19 1gfy s LEU 158 Ca -0.02 -0.48 -0.05 0.00 0.02 0.00 0.00 54.13 53.60 1gfy s LEU 158 Cb -0.14 -1.61 -0.02 0.00 0.02 0.00 0.00 46.19 44.44 1gfy s LEU 158 CO 0.02 0.20 0.00 -0.70 0.02 0.00 0.00 176.35 175.89 1gfy s GLU 159 N -2.01 3.51 -0.28 1.70 2.12 0.37 -1.43 118.70 122.68 1gfy s GLU 159 Ca 0.18 -0.56 -0.10 0.00 0.36 0.00 0.00 54.97 54.86 1gfy s GLU 159 Cb -0.11 -3.13 -0.04 0.00 0.26 0.00 0.00 34.13 31.12 1gfy s GLU 159 CO 0.10 -0.16 0.15 -1.17 -0.54 0.00 0.00 175.26 173.64 1gfy s LEU 160 N 1.45 3.86 -0.24 2.70 0.20 0.54 -1.15 118.68 126.03 1gfy s LEU 160 Ca 0.05 -0.17 -0.08 0.00 0.69 0.00 0.00 54.13 54.62 1gfy s LEU 160 Cb -0.15 -2.04 -0.04 0.00 -0.43 0.00 0.00 46.19 43.54 1gfy s LEU 160 CO -0.00 -0.07 0.09 -0.70 -0.29 0.00 0.00 176.35 175.38 1gfy s GLU 161 N 1.69 3.78 -0.51 1.98 2.12 0.13 -0.25 118.70 127.64 1gfy s GLU 161 Ca 0.06 -0.42 -0.28 0.00 0.36 0.00 0.00 54.97 54.69 1gfy s GLU 161 Cb -0.16 -3.36 0.02 0.00 0.26 0.00 0.00 34.13 30.88 1gfy s GLU 161 CO 0.08 -0.09 1.35 1.21 -0.54 0.00 0.00 175.26 177.27 1gfy s ASN 162 N 1.37 6.30 0.07 -1.70 3.84 0.10 -0.26 114.94 124.65 1gfy s ASN 162 Ca 0.06 0.46 0.13 0.00 0.21 0.00 0.00 52.86 53.71 1gfy s ASN 162 Cb -0.15 -2.55 0.57 0.00 -0.55 0.00 0.00 41.25 38.57 1gfy s ASN 162 CO 0.05 -1.54 1.40 0.18 -2.79 0.00 0.00 177.10 174.40 1gfy n LEU 163 N 8.98 0.15 -0.00 3.21 4.32 -0.36 0.77 117.00 134.08 1gfy n LEU 163 Ca 0.13 0.55 -0.08 0.00 -0.02 0.00 0.00 56.01 56.59 1gfy n LEU 163 Cb 0.49 -0.54 -0.13 0.00 -1.62 0.00 0.00 43.42 41.62 1gfy n LEU 163 CO 0.71 -0.42 -0.40 0.74 -1.22 0.00 0.00 177.39 176.80 1gfy h THR 164 N 0.00 0.96 0.00 -5.08 2.02 -1.89 -3.35 112.91 105.56 1gfy h THR 164 Ca 0.00 -2.76 -0.00 0.00 0.77 0.00 0.00 66.41 64.41 1gfy h THR 164 Cb 0.19 2.46 -0.00 0.00 -1.74 0.00 0.00 68.15 69.06 1gfy h THR 164 CO 0.00 0.54 -1.55 0.35 0.37 0.00 0.00 175.52 175.23 1gfy n THR 165 N -3.08 0.01 -0.96 3.16 -2.24 -1.06 -4.98 114.28 105.13 1gfy n THR 165 Ca -0.14 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 1gfy n THR 165 Cb 1.02 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 1gfy n THR 165 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gfy n GLN 166 N -1.93 -0.91 -1.93 -0.78 6.02 0.23 -5.02 117.38 113.07 1gfy n GLN 166 Ca -0.02 0.23 -0.37 0.00 -0.01 0.00 0.00 57.00 56.82 1gfy n GLN 166 Cb 0.32 -4.00 0.04 0.00 1.02 0.00 0.00 30.24 27.61 1gfy n GLN 166 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1gfy s GLU 167 N -1.00 3.06 0.05 -1.09 2.12 -1.23 -4.82 118.70 115.79 1gfy s GLU 167 Ca 0.00 1.99 0.05 0.00 0.36 0.00 0.00 54.97 57.37 1gfy s GLU 167 Cb 0.00 -2.08 -0.02 0.00 0.26 0.00 0.00 34.13 32.29 1gfy s GLU 167 CO 0.00 -1.18 -0.15 0.99 -0.54 0.00 0.00 175.26 174.38 1gfy s THR 168 N -1.46 1.18 -0.00 -1.70 2.01 -1.26 -0.72 115.64 113.69 1gfy s THR 168 Ca 0.75 -1.11 -0.10 0.00 0.31 0.00 0.00 61.69 61.54 1gfy s THR 168 Cb -0.35 -1.08 0.01 0.00 0.01 0.00 0.00 72.50 71.09 1gfy s THR 168 CO 0.39 -0.04 0.20 -0.13 -0.69 0.00 0.00 174.62 174.36 1gfy s ARG 169 N -1.32 0.55 -0.03 4.92 0.52 0.65 -4.97 118.95 119.28 1gfy s ARG 169 Ca 0.01 -0.31 -0.15 0.00 -0.52 0.00 0.00 55.73 54.76 1gfy s ARG 169 Cb -0.09 0.23 -0.05 0.00 0.52 0.00 0.00 34.95 35.57 1gfy s ARG 169 CO 0.02 -0.14 0.41 -2.00 0.02 0.00 0.00 175.30 173.61 1gfy s GLU 170 N -1.34 4.00 -0.09 3.54 2.12 -1.26 -0.34 118.70 125.34 1gfy s GLU 170 Ca -0.14 0.39 0.03 0.00 0.36 0.00 0.00 54.97 55.61 1gfy s GLU 170 Cb -0.07 -3.27 0.00 0.00 0.26 0.00 0.00 34.13 31.06 1gfy s GLU 170 CO 0.03 0.58 -0.19 0.42 -0.54 0.00 0.00 175.26 175.55 1gfy s ILE 171 N -0.71 1.69 -0.10 -3.70 -1.09 -0.52 -4.79 121.20 111.97 1gfy s ILE 171 Ca 0.23 -0.81 -0.11 0.00 -2.23 0.00 0.00 60.65 57.74 1gfy s ILE 171 Cb -0.16 -1.48 -0.05 0.00 -1.58 0.00 0.00 42.46 39.19 1gfy s ILE 171 CO 0.12 0.48 0.24 -0.76 -1.23 0.00 0.00 174.94 173.79 1gfy s LEU 172 N 0.46 4.37 -0.24 2.97 1.02 -0.16 -1.04 118.68 126.06 1gfy s LEU 172 Ca -0.17 0.59 -0.03 0.00 0.02 0.00 0.00 54.13 54.54 1gfy s LEU 172 Cb -0.17 -2.27 0.01 0.00 0.02 0.00 0.00 46.19 43.78 1gfy s LEU 172 CO 0.07 0.30 -0.05 -2.28 0.02 0.00 0.00 176.35 174.41 1gfy s HIS 173 N -0.60 3.02 -0.36 0.29 2.46 0.05 -0.99 115.29 119.15 1gfy s HIS 173 Ca 0.17 -1.32 -0.08 0.00 0.47 0.00 0.00 55.06 54.30 1gfy s HIS 173 Cb -0.13 -2.08 0.04 0.00 -0.13 0.00 0.00 32.58 30.28 1gfy s HIS 173 CO 0.06 -0.67 0.15 -0.06 -2.47 0.00 0.00 174.74 171.75 1gfy s PHE 174 N 1.38 3.27 -0.39 3.88 0.08 0.24 -0.91 117.98 125.54 1gfy s PHE 174 Ca 0.02 -1.33 -0.06 0.00 0.12 0.00 0.00 56.93 55.68 1gfy s PHE 174 Cb -0.16 -2.41 0.08 0.00 -0.57 0.00 0.00 43.02 39.96 1gfy s PHE 174 CO -0.04 -0.73 0.18 -1.58 -0.10 0.00 0.00 175.22 172.95 1gfy s HIS 175 N 1.44 3.38 -0.30 0.36 2.46 -0.37 -0.72 115.29 121.54 1gfy s HIS 175 Ca -0.00 -1.80 -0.23 0.00 0.47 0.00 0.00 55.06 53.50 1gfy s HIS 175 Cb -0.20 -2.80 -0.00 0.00 -0.13 0.00 0.00 32.58 29.45 1gfy s HIS 175 CO 0.04 -0.86 0.76 -0.47 -2.47 0.00 0.00 174.74 171.74 1gfy s TYR 176 N 1.32 3.22 -2.60 3.88 6.14 0.17 -2.03 117.35 127.45 1gfy s TYR 176 Ca 0.02 0.81 0.23 0.00 0.64 0.00 0.00 57.07 58.77 1gfy s TYR 176 Cb -0.22 -3.14 0.31 0.00 0.42 0.00 0.00 41.96 39.33 1gfy s TYR 176 CO 0.00 -0.52 1.31 0.25 0.64 0.00 0.00 175.55 177.23 1gfy n THR 177 N 5.46 0.28 -2.27 4.34 -2.24 -0.45 -3.73 114.28 115.67 1gfy n THR 177 Ca 0.03 -0.64 0.03 0.00 -2.27 0.00 0.00 64.05 61.20 1gfy n THR 177 Cb 0.48 1.20 0.07 0.00 -2.10 0.00 0.00 70.33 69.99 1gfy n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1gfy n THR 178 N 1.38 0.78 -3.71 4.28 -2.24 -1.24 -4.85 114.28 108.67 1gfy n THR 178 Ca 0.16 -1.87 -0.38 0.00 -2.27 0.00 0.00 64.05 59.69 1gfy n THR 178 Cb 0.58 0.62 -0.12 0.00 -2.10 0.00 0.00 70.33 69.31 1gfy n THR 178 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1gfy s TRP 179 N -1.30 3.25 0.35 4.78 -0.11 -1.26 -4.54 118.94 120.10 1gfy s TRP 179 Ca 0.35 -1.30 -0.27 0.00 1.22 0.00 0.00 56.10 56.10 1gfy s TRP 179 Cb 0.38 -2.31 -0.09 0.00 -1.50 0.00 0.00 33.47 29.94 1gfy s TRP 179 CO -0.13 -0.71 1.14 -2.14 -4.62 0.00 0.00 176.95 170.50 1gfy s PRO 180 N 1.44 4.32 0.24 5.86 0.02 -1.26 -4.78 135.00 140.84 1gfy s PRO 180 Ca -0.01 1.82 -0.31 0.00 0.02 0.00 0.00 61.00 62.53 1gfy s PRO 180 Cb -0.19 -2.88 -0.14 0.00 0.02 0.00 0.00 34.50 31.30 1gfy s PRO 180 CO 0.04 -0.09 1.26 -3.47 -0.33 0.00 0.00 177.00 174.41 1gfy n ASP 181 N 0.53 2.13 -1.04 2.53 -0.08 -1.26 0.81 116.55 120.18 1gfy n ASP 181 Ca 0.02 1.16 -0.13 0.00 -1.51 0.00 0.00 54.79 54.33 1gfy n ASP 181 Cb 0.46 -1.36 -0.06 0.00 2.34 0.00 0.00 41.12 42.51 1gfy n ASP 181 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1gfy n PHE 182 N 1.31 -0.04 -3.93 -0.67 3.72 -1.26 -4.95 117.46 111.64 1gfy n PHE 182 Ca 0.11 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.44 1gfy n PHE 182 Cb 0.30 -2.86 -0.01 0.00 -0.94 0.00 0.00 39.48 35.97 1gfy n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gfy n GLY 183 N 0.08 3.59 3.38 1.37 0.00 0.24 -4.93 105.19 108.92 1gfy n GLY 183 Ca -0.13 -2.23 -0.20 0.00 0.00 0.00 0.00 46.02 43.47 1gfy n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1gfy s VAL 184 N -1.10 1.74 0.94 1.61 -7.23 -1.26 -4.76 120.40 110.34 1gfy s VAL 184 Ca 0.03 -2.19 -0.10 0.00 -1.81 0.00 0.00 61.98 57.90 1gfy s VAL 184 Cb -0.00 -2.19 0.16 0.00 0.56 0.00 0.00 36.38 34.91 1gfy s VAL 184 CO 0.02 -0.49 1.13 -2.84 -0.31 0.00 0.00 175.10 172.61 1gfy s PRO 185 N -3.67 0.82 0.34 4.82 0.02 -1.26 -4.24 135.00 131.83 1gfy s PRO 185 Ca 0.25 1.43 0.05 0.00 0.02 0.00 0.00 61.00 62.76 1gfy s PRO 185 Cb 0.00 -1.71 0.69 0.00 0.02 0.00 0.00 34.50 33.51 1gfy s PRO 185 CO 0.09 -2.73 1.92 0.93 -0.33 0.00 0.00 177.00 176.87 1gfy h GLU 186 N -1.94 0.80 -2.84 5.54 3.07 -1.99 -3.45 114.58 113.78 1gfy h GLU 186 Ca -0.46 -0.05 0.02 0.00 -0.50 0.00 0.00 59.36 58.38 1gfy h GLU 186 Cb 1.28 -0.18 -0.12 0.00 -0.84 0.00 0.00 28.75 28.89 1gfy h GLU 186 CO 0.43 0.53 0.28 -1.54 -1.40 0.00 0.00 179.01 177.31 1gfy s SER 187 N -6.02 -0.48 0.29 1.42 1.04 -1.26 -5.01 113.70 103.68 1gfy s SER 187 Ca -0.10 -0.08 0.04 0.00 0.48 0.00 0.00 55.95 56.29 1gfy s SER 187 Cb 0.20 0.57 0.70 0.00 0.10 0.00 0.00 66.02 67.60 1gfy s SER 187 CO 0.79 -0.94 1.75 -0.65 0.98 0.00 0.00 173.24 175.16 1gfy h PRO 188 N 2.00 0.61 -0.31 4.02 0.11 -1.94 -2.19 132.00 134.30 1gfy h PRO 188 Ca -0.30 -0.04 0.05 0.00 0.11 0.00 0.00 66.00 65.83 1gfy h PRO 188 Cb 1.29 -0.14 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 1gfy h PRO 188 CO 0.35 0.40 -0.00 0.00 -0.21 0.00 0.00 178.00 178.54 1gfy h ALA 189 N 1.65 0.27 0.08 -0.75 0.00 -1.95 0.19 119.26 118.75 1gfy h ALA 189 Ca 0.55 0.09 -0.26 0.00 0.00 0.00 0.00 54.91 55.29 1gfy h ALA 189 Cb 0.92 0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.86 1gfy h ALA 189 CO -0.42 -0.41 -1.13 0.66 0.00 0.00 0.00 179.25 177.96 1gfy h SER 190 N 0.09 0.56 -0.24 0.00 4.64 -1.77 0.14 113.55 116.96 1gfy h SER 190 Ca 0.15 -0.52 -0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1gfy h SER 190 Cb 0.20 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1gfy h SER 190 CO -0.25 1.36 0.14 0.15 -0.87 0.00 0.00 176.83 177.35 1gfy h PHE 191 N 0.18 0.33 -0.82 4.77 3.57 -1.24 0.36 116.94 124.09 1gfy h PHE 191 Ca -0.12 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.34 1gfy h PHE 191 Cb 1.80 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 40.40 1gfy h PHE 191 CO 0.07 0.28 0.39 -0.07 -2.23 0.00 0.00 178.31 176.75 1gfy h LEU 192 N 0.29 1.07 -0.20 0.59 3.38 -0.52 0.92 115.31 120.84 1gfy h LEU 192 Ca 0.09 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1gfy h LEU 192 Cb 0.05 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1gfy h LEU 192 CO -0.01 0.90 0.01 -1.13 0.09 0.00 0.00 178.44 178.30 1gfy h ASN 193 N 1.16 -0.04 -0.06 -0.43 -1.24 -0.66 -0.36 115.58 113.95 1gfy h ASN 193 Ca 0.28 0.04 0.03 0.00 0.71 0.00 0.00 56.30 57.36 1gfy h ASN 193 Cb 0.12 0.06 -0.03 0.00 0.73 0.00 0.00 38.32 39.20 1gfy h ASN 193 CO -0.04 0.01 -0.10 0.15 -1.29 0.00 0.00 177.43 176.16 1gfy h PHE 194 N 0.09 -0.24 -0.84 0.67 3.57 -0.42 0.07 116.94 119.84 1gfy h PHE 194 Ca 0.09 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.69 1gfy h PHE 194 Cb 0.11 0.12 -0.07 0.00 2.79 0.00 0.00 35.95 38.89 1gfy h PHE 194 CO -0.16 -0.15 0.49 1.25 -2.23 0.00 0.00 178.31 177.51 1gfy h LEU 195 N -0.14 0.73 -0.29 0.59 5.85 -0.41 -1.86 115.31 119.78 1gfy h LEU 195 Ca 0.06 0.04 -0.20 0.00 0.84 0.00 0.00 57.88 58.61 1gfy h LEU 195 Cb 0.22 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 1gfy h LEU 195 CO -0.14 0.43 -0.84 -0.26 -0.34 0.00 0.00 178.44 177.29 1gfy h PHE 196 N 0.84 0.53 -0.48 1.25 -1.00 -1.02 0.79 116.94 117.85 1gfy h PHE 196 Ca 0.39 -0.26 0.09 0.00 2.81 0.00 0.00 57.97 61.00 1gfy h PHE 196 Cb 0.32 -0.07 -0.07 0.00 3.61 0.00 0.00 35.95 39.74 1gfy h PHE 196 CO -0.05 1.05 0.05 0.87 -1.61 0.00 0.00 178.31 178.63 1gfy h LYS 197 N 0.23 0.17 -0.05 1.51 1.79 -0.21 0.62 116.57 120.63 1gfy h LYS 197 Ca -0.05 -0.01 0.01 0.00 -2.18 0.00 0.00 60.65 58.42 1gfy h LYS 197 Cb 1.45 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 32.04 1gfy h LYS 197 CO 0.14 0.11 -0.03 0.28 -1.08 0.00 0.00 179.45 178.87 1gfy h VAL 198 N 0.17 0.90 0.17 0.50 2.07 -1.09 -2.86 116.25 116.11 1gfy h VAL 198 Ca 0.24 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.77 1gfy h VAL 198 Cb 0.34 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 1gfy h VAL 198 CO -0.35 0.00 -0.26 0.03 0.02 0.00 0.00 177.57 177.01 1gfy h ARG 199 N -0.04 -0.48 -0.38 1.57 3.08 -0.47 -2.11 114.38 115.55 1gfy h ARG 199 Ca 0.03 0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.22 1gfy h ARG 199 Cb 0.08 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1gfy h ARG 199 CO -0.07 -0.32 0.37 0.93 -1.07 0.00 0.00 179.97 179.81 1gfy h GLU 200 N -0.50 0.00 0.00 0.04 4.39 -0.85 -1.51 114.58 116.15 1gfy h GLU 200 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1gfy h GLU 200 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1gfy h GLU 200 CO -0.12 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 176.60 1gfy n SER 201 N -3.88 0.13 0.00 1.42 3.41 -0.79 -4.86 113.62 109.05 1gfy n SER 201 Ca 0.06 0.52 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 1gfy n SER 201 Cb 0.54 -0.55 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 1gfy n SER 201 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gfy n GLY 202 N 0.75 1.02 0.06 5.00 0.00 -0.57 -4.92 105.19 106.54 1gfy n GLY 202 Ca 0.05 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.18 1gfy n GLY 202 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1gfy n SER 203 N 0.00 0.35 -0.75 1.61 7.64 -1.25 -1.61 113.62 119.62 1gfy n SER 203 Ca 0.00 0.57 0.07 0.00 1.01 0.00 0.00 58.87 60.52 1gfy n SER 203 Cb 0.00 -0.65 0.20 0.00 -1.01 0.00 0.00 64.21 62.75 1gfy n SER 203 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1gfy n LEU 204 N -1.87 2.17 -4.87 -3.43 4.77 -1.26 -4.41 117.00 108.10 1gfy n LEU 204 Ca 0.04 -1.07 -0.32 0.00 -0.03 0.00 0.00 56.01 54.63 1gfy n LEU 204 Cb 0.25 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.03 1gfy n LEU 204 CO 0.20 0.53 0.24 -0.44 -1.33 0.00 0.00 177.39 176.59 1gfy s SER 205 N -1.06 6.66 0.00 -1.43 0.01 -0.63 -4.92 113.70 112.32 1gfy s SER 205 Ca 0.28 0.97 0.24 0.00 1.31 0.00 0.00 55.95 58.75 1gfy s SER 205 Cb 0.15 -2.25 1.26 0.00 0.21 0.00 0.00 66.02 65.39 1gfy s SER 205 CO 0.20 -0.07 1.80 -0.81 0.41 0.00 0.00 173.24 174.76 1gfy n PRO 206 N -0.09 0.42 0.28 12.44 -0.04 -1.26 -1.32 135.00 145.43 1gfy n PRO 206 Ca 0.00 0.05 0.17 0.00 -0.04 0.00 0.00 63.50 63.69 1gfy n PRO 206 Cb 0.52 -1.50 0.73 0.00 -0.04 0.00 0.00 33.50 33.22 1gfy n PRO 206 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1gfy h GLU 207 N 0.00 0.00 -6.42 0.54 9.09 -1.94 -3.45 114.58 112.39 1gfy h GLU 207 Ca 0.00 0.00 -0.46 0.00 0.05 0.00 0.00 59.36 58.95 1gfy h GLU 207 Cb 0.18 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.29 1gfy h GLU 207 CO 0.00 0.01 -0.27 -1.01 0.05 0.00 0.00 179.01 177.80 1gfy s HIS 208 N -3.73 3.42 1.33 2.06 3.76 -0.43 -5.11 115.29 116.58 1gfy s HIS 208 Ca 0.00 0.17 -0.18 0.00 -0.15 0.00 0.00 55.06 54.90 1gfy s HIS 208 Cb 0.09 -1.85 0.34 0.00 1.11 0.00 0.00 32.58 32.27 1gfy s HIS 208 CO 0.53 0.15 0.94 0.41 -0.85 0.00 0.00 174.74 175.92 1gfy n GLY 209 N -1.69 -2.94 3.77 -2.22 0.00 0.16 -4.89 105.19 97.37 1gfy n GLY 209 Ca -0.05 -1.43 -0.39 0.00 0.00 0.00 0.00 46.02 44.15 1gfy n GLY 209 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gfy s PRO 210 N -4.66 3.89 0.30 1.61 0.04 -1.26 -4.54 135.00 130.38 1gfy s PRO 210 Ca 0.68 2.22 -0.30 0.00 0.04 0.00 0.00 61.00 63.65 1gfy s PRO 210 Cb -0.20 -2.73 -0.12 0.00 0.04 0.00 0.00 34.50 31.50 1gfy s PRO 210 CO 0.62 -0.58 1.49 1.55 0.04 0.00 0.00 177.00 180.12 1gfy n VAL 211 N 0.03 1.33 -2.58 -0.36 3.14 -1.25 -4.55 118.33 114.09 1gfy n VAL 211 Ca 0.04 -0.33 -0.43 0.00 -2.96 0.00 0.00 64.34 60.66 1gfy n VAL 211 Cb 0.43 -1.80 -0.02 0.00 -1.06 0.00 0.00 33.84 31.39 1gfy n VAL 211 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1gfy s VAL 212 N -0.38 4.29 -0.16 1.55 1.01 -1.00 0.00 120.40 125.71 1gfy s VAL 212 Ca 0.62 1.41 -0.05 0.00 0.00 0.00 0.00 61.98 63.95 1gfy s VAL 212 Cb -0.54 -4.45 -0.03 0.00 0.00 0.00 0.00 36.38 31.36 1gfy s VAL 212 CO 0.54 -0.73 0.01 -0.69 0.00 0.00 0.00 175.10 174.23 1gfy s VAL 213 N 4.21 4.34 0.09 2.92 1.01 0.92 -0.78 120.40 133.11 1gfy s VAL 213 Ca 0.49 -0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.30 1gfy s VAL 213 Cb -0.11 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 1gfy s VAL 213 CO 0.25 0.49 -0.09 -1.38 0.00 0.00 0.00 175.10 174.36 1gfy s HIS 214 N 0.24 0.98 0.00 5.22 -3.43 0.34 -1.98 115.29 116.65 1gfy s HIS 214 Ca 0.01 -0.67 0.00 0.00 -0.80 0.00 0.00 55.06 53.60 1gfy s HIS 214 Cb -0.13 -0.54 0.00 0.00 -1.43 0.00 0.00 32.58 30.47 1gfy s HIS 214 CO 0.02 -0.04 0.00 0.00 -2.00 0.00 0.00 174.74 172.72 1gfy h SER 216 N 0.00 0.70 0.00 0.00 0.87 -1.89 -2.24 113.55 110.99 1gfy h SER 216 Ca 0.00 -0.93 0.00 0.00 -1.23 0.00 0.00 61.79 59.63 1gfy h SER 216 Cb 0.00 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 61.73 1gfy h SER 216 CO 0.00 1.72 -1.78 0.00 -0.53 0.00 0.00 176.83 176.24 1gfy n ALA 217 N -2.80 3.15 -1.18 6.23 0.00 -1.26 0.49 120.51 125.14 1gfy n ALA 217 Ca -0.21 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.71 1gfy n ALA 217 Cb 1.06 -0.73 0.00 0.00 0.00 0.00 0.00 19.45 19.78 1gfy n ALA 217 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gfy n GLY 218 N 1.33 0.50 1.64 0.00 0.00 -1.18 -4.05 105.19 103.44 1gfy n GLY 218 Ca -0.02 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.10 1gfy n GLY 218 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1gfy n ILE 219 N -3.14 0.03 -0.00 -0.61 -5.35 -1.26 -4.55 119.36 104.48 1gfy n ILE 219 Ca 0.00 0.01 -0.00 0.00 -0.27 0.00 0.00 62.75 62.49 1gfy n ILE 219 Cb 0.16 -0.86 -0.00 0.00 -1.74 0.00 0.00 39.64 37.20 1gfy n ILE 219 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 1gfy h GLY 220 N 0.00 0.00 0.58 3.28 0.00 -1.90 -0.34 103.07 104.69 1gfy h GLY 220 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.38 1gfy h GLY 220 CO 0.00 0.00 -0.01 3.21 0.00 0.00 0.00 176.54 179.74 1gfy h ARG 221 N -0.10 0.07 -0.95 4.80 3.08 -1.95 -2.16 114.38 117.18 1gfy h ARG 221 Ca 0.00 -0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.11 1gfy h ARG 221 Cb 0.00 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 29.97 1gfy h ARG 221 CO 0.00 0.05 0.62 0.77 -1.07 0.00 0.00 179.97 180.33 1gfy h SER 222 N 0.07 0.97 -0.96 7.04 0.02 -1.86 -1.24 113.55 117.59 1gfy h SER 222 Ca 0.12 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1gfy h SER 222 Cb 0.17 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.46 1gfy h SER 222 CO -0.22 0.62 0.59 1.23 -1.14 0.00 0.00 176.83 177.92 1gfy h GLY 223 N 1.10 1.38 0.76 -3.77 0.00 -1.24 -1.63 103.07 99.67 1gfy h GLY 223 Ca 0.41 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 47.15 1gfy h GLY 223 CO -0.16 0.54 -0.02 -0.84 0.00 0.00 0.00 176.54 176.06 1gfy h THR 224 N 1.32 1.28 -0.15 4.70 2.02 -0.75 0.18 112.91 121.50 1gfy h THR 224 Ca 0.35 -0.93 0.04 0.00 0.77 0.00 0.00 66.41 66.64 1gfy h THR 224 Cb -0.08 1.61 -0.07 0.00 -1.74 0.00 0.00 68.15 67.86 1gfy h THR 224 CO -0.07 0.27 -0.45 0.15 0.37 0.00 0.00 175.52 175.80 1gfy h PHE 225 N -0.02 -1.29 -0.55 3.16 3.57 -1.12 -2.33 116.94 118.36 1gfy h PHE 225 Ca 0.04 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 1gfy h PHE 225 Cb 0.43 0.59 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 1gfy h PHE 225 CO 0.05 -0.49 0.12 0.00 -2.23 0.00 0.00 178.31 175.75 1gfy h LEU 227 N 0.79 -0.36 -0.37 0.00 5.85 -0.53 -1.85 115.31 118.84 1gfy h LEU 227 Ca 0.17 0.08 0.07 0.00 0.84 0.00 0.00 57.88 59.04 1gfy h LEU 227 Cb 0.37 0.19 -0.07 0.00 0.37 0.00 0.00 40.66 41.52 1gfy h LEU 227 CO 0.01 -0.15 -0.07 0.00 -0.34 0.00 0.00 178.44 177.88 1gfy h ALA 228 N 1.00 0.26 -0.07 1.25 0.00 -1.38 -0.83 119.26 119.50 1gfy h ALA 228 Ca 0.10 0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1gfy h ALA 228 Cb 0.26 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1gfy h ALA 228 CO -0.23 -0.45 -0.16 0.22 0.00 0.00 0.00 179.25 178.63 1gfy h ASP 229 N 0.02 -0.49 -0.37 0.00 3.58 -0.94 -1.04 116.42 117.18 1gfy h ASP 229 Ca 0.18 0.08 -0.11 0.00 0.42 0.00 0.00 57.03 57.60 1gfy h ASP 229 Cb 0.27 0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.52 1gfy h ASP 229 CO -0.36 -0.22 -0.16 0.74 -2.88 0.00 0.00 179.24 176.36 1gfy h THR 230 N -0.24 1.27 -0.57 2.25 2.02 -1.29 0.13 112.91 116.48 1gfy h THR 230 Ca 0.07 -1.27 0.00 0.00 0.77 0.00 0.00 66.41 65.99 1gfy h THR 230 Cb 0.34 1.10 -0.03 0.00 -1.74 0.00 0.00 68.15 67.82 1gfy h THR 230 CO -0.21 0.43 0.36 0.00 0.37 0.00 0.00 175.52 176.48 1gfy h LEU 232 N 0.77 0.44 -0.29 0.00 3.38 -0.47 -2.21 115.31 116.92 1gfy h LEU 232 Ca 0.21 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1gfy h LEU 232 Cb -0.06 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1gfy h LEU 232 CO -0.04 0.70 0.03 0.25 0.09 0.00 0.00 178.44 179.46 1gfy h LEU 233 N 0.38 0.48 0.16 1.67 6.46 -0.21 -1.89 115.31 122.36 1gfy h LEU 233 Ca 0.05 -0.28 0.02 0.00 -0.12 0.00 0.00 57.88 57.55 1gfy h LEU 233 Cb 0.68 -0.13 -0.04 0.00 -0.73 0.00 0.00 40.66 40.43 1gfy h LEU 233 CO 0.05 0.65 -0.44 -0.07 -0.62 0.00 0.00 178.44 178.01 1gfy h LEU 234 N 0.30 -1.28 -0.87 2.25 4.07 -1.01 0.64 115.31 119.42 1gfy h LEU 234 Ca 0.09 0.14 0.22 0.00 0.08 0.00 0.00 57.88 58.41 1gfy h LEU 234 Cb 0.38 0.47 -0.13 0.00 1.08 0.00 0.00 40.66 42.47 1gfy h LEU 234 CO 0.01 -0.51 0.31 -0.03 -1.08 0.00 0.00 178.44 177.14 1gfy h MET 235 N -0.69 0.29 -0.56 1.13 4.05 -1.43 -1.49 114.93 116.22 1gfy h MET 235 Ca 0.01 -0.02 -0.05 0.00 -0.28 0.00 0.00 59.70 59.36 1gfy h MET 235 Cb 0.70 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.42 1gfy h MET 235 CO -0.23 0.19 0.15 0.22 0.23 0.00 0.00 176.91 177.47 1gfy h ASP 236 N 0.30 0.84 -0.07 1.39 3.58 -0.65 0.81 116.42 122.62 1gfy h ASP 236 Ca 0.54 -0.22 -0.13 0.00 0.42 0.00 0.00 57.03 57.64 1gfy h ASP 236 Cb 1.06 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.88 1gfy h ASP 236 CO -0.58 0.85 -0.39 0.07 -2.88 0.00 0.00 179.24 176.30 1gfy h LYS 237 N 0.80 0.59 -0.00 0.28 2.10 0.15 -2.41 116.57 118.08 1gfy h LYS 237 Ca 0.18 -0.30 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 1gfy h LYS 237 Cb 0.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.66 1gfy h LYS 237 CO -0.00 0.88 -0.50 2.89 -2.00 0.00 0.00 179.45 180.72 1gfy n ARG 238 N -4.04 0.36 -4.26 0.07 1.85 -0.97 -4.97 116.66 104.71 1gfy n ARG 238 Ca -0.02 -0.24 -0.34 0.00 -1.00 0.00 0.00 57.85 56.25 1gfy n ARG 238 Cb 0.51 -1.50 -0.05 0.00 -1.05 0.00 0.00 32.46 30.37 1gfy n ARG 238 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1gfy n LYS 239 N -1.11 -2.19 -3.46 2.89 4.76 0.28 -4.94 118.16 114.38 1gfy n LYS 239 Ca 0.08 0.27 -0.28 0.00 -2.87 0.00 0.00 58.31 55.51 1gfy n LYS 239 Cb 0.35 -4.58 -0.11 0.00 -1.84 0.00 0.00 35.03 28.84 1gfy n LYS 239 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1gfy s ASP 240 N -3.74 2.33 0.57 4.39 2.15 -0.89 -5.00 116.67 116.48 1gfy s ASP 240 Ca 0.46 -2.68 0.28 0.00 0.43 0.00 0.00 52.55 51.04 1gfy s ASP 240 Cb -0.26 -0.49 1.49 0.00 -0.30 0.00 0.00 42.92 43.36 1gfy s ASP 240 CO 0.96 -0.23 1.97 -0.65 -0.17 0.00 0.00 175.17 177.04 1gfy h PRO 241 N 6.30 0.00 0.00 4.34 0.11 -1.92 -1.81 132.00 139.02 1gfy h PRO 241 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1gfy h PRO 241 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1gfy h PRO 241 CO 0.34 0.00 -0.50 0.43 -0.21 0.00 0.00 178.00 178.06 1gfy n SER 242 N -4.00 0.71 -0.73 -2.05 7.64 -1.26 -2.31 113.62 111.61 1gfy n SER 242 Ca 0.08 0.20 0.06 0.00 1.01 0.00 0.00 58.87 60.22 1gfy n SER 242 Cb 0.60 -0.03 0.17 0.00 -1.01 0.00 0.00 64.21 63.94 1gfy n SER 242 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1gfy n SER 243 N -2.11 2.12 -4.65 6.43 3.41 -0.68 -4.86 113.62 113.28 1gfy n SER 243 Ca 0.04 -2.04 -0.37 0.00 -0.26 0.00 0.00 58.87 56.25 1gfy n SER 243 Cb 0.43 -0.28 -0.10 0.00 -0.26 0.00 0.00 64.21 64.01 1gfy n SER 243 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1gfy s VAL 244 N -1.53 5.31 -0.53 -3.33 -7.23 -0.98 -5.05 120.40 107.07 1gfy s VAL 244 Ca 0.25 0.16 -0.11 0.00 -1.81 0.00 0.00 61.98 60.47 1gfy s VAL 244 Cb 0.14 -3.48 0.13 0.00 0.56 0.00 0.00 36.38 33.73 1gfy s VAL 244 CO 0.16 0.34 0.43 -0.62 -0.31 0.00 0.00 175.10 175.11 1gfy s ASP 245 N 1.09 5.91 0.14 4.85 -1.08 -1.26 -4.72 116.67 121.61 1gfy s ASP 245 Ca 0.07 -1.99 -0.17 0.00 -0.52 0.00 0.00 52.55 49.94 1gfy s ASP 245 Cb -0.14 -2.08 0.01 0.00 -1.46 0.00 0.00 42.92 39.25 1gfy s ASP 245 CO 0.05 -0.72 1.77 0.40 0.52 0.00 0.00 175.17 177.18 1gfy h ILE 246 N 5.91 0.97 -0.45 4.11 2.04 -1.98 0.18 117.51 128.29 1gfy h ILE 246 Ca -0.20 -0.10 -0.05 0.00 1.00 0.00 0.00 64.86 65.51 1gfy h ILE 246 Cb 1.07 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1gfy h ILE 246 CO 0.90 0.05 0.08 0.11 0.00 0.00 0.00 178.15 179.30 1gfy h LYS 247 N 0.29 0.69 -0.32 2.37 1.57 -1.99 0.11 116.57 119.29 1gfy h LYS 247 Ca 0.13 -0.14 -0.11 0.00 -1.87 0.00 0.00 60.65 58.66 1gfy h LYS 247 Cb 0.06 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1gfy h LYS 247 CO -0.10 0.65 -0.25 -0.22 -0.57 0.00 0.00 179.45 178.96 1gfy h LYS 248 N 0.66 0.63 -0.57 3.15 3.64 -1.78 -0.14 116.57 122.16 1gfy h LYS 248 Ca 0.15 -0.25 -0.06 0.00 -1.27 0.00 0.00 60.65 59.21 1gfy h LYS 248 Cb 0.29 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.06 1gfy h LYS 248 CO 0.00 0.82 0.10 -0.39 -2.27 0.00 0.00 179.45 177.72 1gfy h VAL 249 N 0.55 1.25 -0.76 2.00 -1.51 -0.28 -1.60 116.25 115.91 1gfy h VAL 249 Ca 0.08 -0.95 -0.02 0.00 -1.23 0.00 0.00 66.70 64.58 1gfy h VAL 249 Cb 0.71 0.78 -0.04 0.00 -2.13 0.00 0.00 31.29 30.61 1gfy h VAL 249 CO 0.05 0.35 0.41 0.25 -1.23 0.00 0.00 177.57 177.40 1gfy h LEU 250 N 0.83 0.94 -0.75 4.19 5.85 -0.69 -1.71 115.31 123.96 1gfy h LEU 250 Ca 0.17 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 1gfy h LEU 250 Cb 0.40 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 1gfy h LEU 250 CO 0.01 0.76 0.31 -0.07 -0.34 0.00 0.00 178.44 179.11 1gfy h LEU 251 N 1.06 1.02 -0.79 2.25 4.07 -0.84 0.41 115.31 122.49 1gfy h LEU 251 Ca 0.27 -0.16 0.01 0.00 0.08 0.00 0.00 57.88 58.08 1gfy h LEU 251 Cb 0.03 -0.26 -0.04 0.00 1.08 0.00 0.00 40.66 41.47 1gfy h LEU 251 CO -0.04 0.90 0.52 -0.78 -1.08 0.00 0.00 178.44 177.96 1gfy h ASP 252 N 1.07 0.90 -0.09 -0.43 3.58 -1.01 -1.65 116.42 118.78 1gfy h ASP 252 Ca 0.25 -0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.60 1gfy h ASP 252 Cb 0.19 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.01 1gfy h ASP 252 CO -0.02 0.64 -0.16 0.24 -2.88 0.00 0.00 179.24 177.06 1gfy h MET 253 N 1.06 0.46 0.00 0.28 2.86 -0.93 -2.63 114.93 116.03 1gfy h MET 253 Ca 0.29 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1gfy h MET 253 Cb -0.10 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.51 1gfy h MET 253 CO -0.07 0.61 0.00 0.54 1.06 0.00 0.00 176.91 179.05 1gfy n ARG 254 N -4.18 0.08 0.29 1.72 1.74 0.10 -1.26 116.66 115.15 1gfy n ARG 254 Ca 0.00 0.39 0.14 0.00 -0.77 0.00 0.00 57.85 57.61 1gfy n ARG 254 Cb 0.34 -1.68 0.87 0.00 -1.02 0.00 0.00 32.46 30.97 1gfy n ARG 254 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1gfy h LYS 255 N 0.00 0.00 0.00 5.56 1.57 -1.07 -3.31 116.57 119.32 1gfy h LYS 255 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1gfy h LYS 255 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1gfy h LYS 255 CO 0.00 0.01 -1.65 1.19 -0.57 0.00 0.00 179.45 178.44 1gfy n PHE 256 N -3.92 0.00 -3.75 -1.35 3.72 -0.39 -4.96 117.46 106.81 1gfy n PHE 256 Ca -0.03 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.24 1gfy n PHE 256 Cb 0.10 -0.36 -0.10 0.00 -0.94 0.00 0.00 39.48 38.17 1gfy n PHE 256 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 1gfy s ARG 257 N -2.79 0.42 0.20 -1.08 3.52 -1.11 -4.60 118.95 113.52 1gfy s ARG 257 Ca -0.05 0.47 -0.31 0.00 -0.13 0.00 0.00 55.73 55.71 1gfy s ARG 257 Cb 0.07 0.20 -0.10 0.00 -1.56 0.00 0.00 34.95 33.57 1gfy s ARG 257 CO 0.54 -0.05 1.50 0.00 -0.81 0.00 0.00 175.30 176.47 1gfy n GLN 259 N 3.16 -0.96 -1.59 0.00 1.13 -1.26 -4.93 117.38 112.93 1gfy n GLN 259 Ca 0.10 0.63 -0.61 0.00 -1.94 0.00 0.00 57.00 55.18 1gfy n GLN 259 Cb 0.40 -4.79 -0.09 0.00 0.11 0.00 0.00 30.24 25.87 1gfy n GLN 259 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1gfy n LEU 260 N -1.71 1.61 -0.86 1.08 4.77 -1.26 -4.26 117.00 116.37 1gfy n LEU 260 Ca -0.14 0.94 0.00 0.00 -0.03 0.00 0.00 56.01 56.78 1gfy n LEU 260 Cb 0.59 -1.02 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 1gfy n LEU 260 CO 0.17 -0.68 -0.07 -0.38 -1.33 0.00 0.00 177.39 175.10 1gfy n ILE 261 N 5.17 -3.77 -0.00 -0.08 5.41 -0.23 -4.96 119.36 120.90 1gfy n ILE 261 Ca 0.36 0.51 -0.01 0.00 1.00 0.00 0.00 62.75 64.62 1gfy n ILE 261 Cb 0.04 -2.79 -0.11 0.00 -0.71 0.00 0.00 39.64 36.07 1gfy n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1gfy n GLN 262 N 0.29 0.64 -4.29 0.38 1.13 -1.26 -4.88 117.38 109.40 1gfy n GLN 262 Ca 0.00 0.12 -0.15 0.00 -1.94 0.00 0.00 57.00 55.03 1gfy n GLN 262 Cb 0.00 -1.71 -0.10 0.00 0.11 0.00 0.00 30.24 28.54 1gfy n GLN 262 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1gfy s THR 263 N -2.90 0.55 0.36 5.09 -4.23 -1.26 -5.05 115.64 108.19 1gfy s THR 263 Ca -0.05 -1.99 0.12 0.00 -1.18 0.00 0.00 61.69 58.58 1gfy s THR 263 Cb 0.09 -2.48 0.09 0.00 1.34 0.00 0.00 72.50 71.54 1gfy s THR 263 CO 0.83 -0.14 1.82 0.00 -0.54 0.00 0.00 174.62 176.59 1gfy h ALA 264 N 2.49 1.36 -0.04 3.99 0.00 -1.94 -2.62 119.26 122.50 1gfy h ALA 264 Ca -0.38 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.05 1gfy h ALA 264 Cb 1.24 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1gfy h ALA 264 CO 0.61 0.47 -0.61 0.22 0.00 0.00 0.00 179.25 179.94 1gfy h ASP 265 N 0.04 0.17 -0.83 0.00 3.58 -1.97 -0.35 116.42 117.06 1gfy h ASP 265 Ca 0.00 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.36 1gfy h ASP 265 Cb 0.66 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.62 1gfy h ASP 265 CO 0.05 0.74 0.54 1.56 -2.88 0.00 0.00 179.24 179.25 1gfy h GLN 266 N 0.11 1.11 -0.10 0.28 4.20 -1.79 0.33 115.11 119.26 1gfy h GLN 266 Ca -0.01 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1gfy h GLN 266 Cb 1.11 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 28.64 1gfy h GLN 266 CO 0.09 0.75 0.06 1.25 -0.67 0.00 0.00 178.83 180.31 1gfy h LEU 267 N 1.14 0.11 -0.51 1.46 5.85 -1.12 -0.98 115.31 121.26 1gfy h LEU 267 Ca 0.30 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.00 1gfy h LEU 267 Cb -0.11 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1gfy h LEU 267 CO -0.06 0.10 0.28 -0.09 -0.34 0.00 0.00 178.44 178.32 1gfy h ARG 268 N 0.12 0.71 -0.81 1.25 2.43 -0.85 -1.94 114.38 115.29 1gfy h ARG 268 Ca 0.03 -0.08 0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1gfy h ARG 268 Cb 0.00 -0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 29.37 1gfy h ARG 268 CO -0.01 0.55 0.54 0.35 -1.51 0.00 0.00 179.97 179.89 1gfy h PHE 269 N 0.68 0.98 -0.77 2.20 3.57 -0.24 -1.89 116.94 121.47 1gfy h PHE 269 Ca 0.18 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.71 1gfy h PHE 269 Cb 0.05 -0.33 -0.04 0.00 2.79 0.00 0.00 35.95 38.42 1gfy h PHE 269 CO -0.02 0.58 0.51 0.77 -2.23 0.00 0.00 178.31 177.93 1gfy h SER 270 N 1.03 0.88 -0.46 0.41 0.02 -0.43 0.17 113.55 115.17 1gfy h SER 270 Ca 0.32 -0.02 0.06 0.00 -0.84 0.00 0.00 61.79 61.31 1gfy h SER 270 Cb -0.01 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.26 1gfy h SER 270 CO -0.09 0.63 0.15 1.88 -1.14 0.00 0.00 176.83 178.26 1gfy h TYR 271 N 1.03 0.27 -0.19 3.45 -1.99 -1.10 -0.79 116.97 117.64 1gfy h TYR 271 Ca 0.29 0.02 0.05 0.00 2.00 0.00 0.00 58.73 61.09 1gfy h TYR 271 Cb -0.10 -0.05 -0.05 0.00 2.00 0.00 0.00 36.73 38.53 1gfy h TYR 271 CO -0.02 0.08 -0.12 -0.07 -0.00 0.00 0.00 178.16 178.04 1gfy h LEU 272 N 0.32 -0.38 -0.53 3.88 4.07 -0.42 -0.84 115.31 121.41 1gfy h LEU 272 Ca 0.22 0.09 0.03 0.00 0.08 0.00 0.00 57.88 58.29 1gfy h LEU 272 Cb 0.23 0.20 -0.04 0.00 1.08 0.00 0.00 40.66 42.14 1gfy h LEU 272 CO -0.24 -0.15 0.31 0.00 -1.08 0.00 0.00 178.44 177.29 1gfy h ALA 273 N 1.05 0.69 -0.12 1.53 0.00 -0.53 0.35 119.26 122.22 1gfy h ALA 273 Ca 0.11 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 1gfy h ALA 273 Cb 0.27 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1gfy h ALA 273 CO -0.26 0.01 -0.68 0.28 0.00 0.00 0.00 179.25 178.61 1gfy h VAL 274 N 0.62 1.35 -0.26 0.00 2.07 -0.85 -0.87 116.25 118.31 1gfy h VAL 274 Ca 0.22 -2.01 -0.07 0.00 0.82 0.00 0.00 66.70 65.66 1gfy h VAL 274 Cb 0.04 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1gfy h VAL 274 CO -0.11 0.61 -0.10 0.40 0.02 0.00 0.00 177.57 178.39 1gfy h ILE 275 N 0.35 1.29 -0.43 4.57 2.04 -0.90 -1.02 117.51 123.42 1gfy h ILE 275 Ca -0.02 -1.16 -0.05 0.00 1.00 0.00 0.00 64.86 64.63 1gfy h ILE 275 Cb 1.25 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.83 1gfy h ILE 275 CO 0.12 0.36 0.08 -0.08 0.00 0.00 0.00 178.15 178.64 1gfy h GLU 276 N 0.26 0.70 -0.47 2.37 4.57 -0.93 -3.17 114.58 117.91 1gfy h GLU 276 Ca 0.06 -0.18 -0.01 0.00 -1.18 0.00 0.00 59.36 58.05 1gfy h GLU 276 Cb 0.60 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 29.08 1gfy h GLU 276 CO 0.03 0.72 0.26 0.78 -1.18 0.00 0.00 179.01 179.63 1gfy h GLY 277 N 0.56 0.68 0.80 1.92 0.00 -1.04 -0.87 103.07 105.12 1gfy h GLY 277 Ca 0.13 -0.28 0.17 0.00 0.00 0.00 0.00 47.33 47.35 1gfy h GLY 277 CO 0.01 0.27 0.43 0.00 0.00 0.00 0.00 176.54 177.25 1gfy h ALA 278 N 1.64 2.54 -0.54 3.60 0.00 -1.15 -1.08 119.26 124.27 1gfy h ALA 278 Ca 0.17 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1gfy h ALA 278 Cb 0.01 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1gfy h ALA 278 CO -0.03 -0.71 0.30 0.87 0.00 0.00 0.00 179.25 179.68 1gfy h LYS 279 N 0.02 0.75 -0.00 0.00 1.57 -1.26 0.38 116.57 118.02 1gfy h LYS 279 Ca 0.29 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1gfy h LYS 279 Cb 1.12 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.29 1gfy h LYS 279 CO -0.01 0.57 0.00 0.35 -0.57 0.00 0.00 179.45 179.80 1gfy h PHE 280 N 0.72 0.00 -0.93 -1.35 3.57 -1.42 -1.69 116.94 115.85 1gfy h PHE 280 Ca 0.19 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.78 1gfy h PHE 280 Cb 0.04 -0.00 -0.07 0.00 2.79 0.00 0.00 35.95 38.71 1gfy h PHE 280 CO -0.02 0.22 0.60 0.82 -2.23 0.00 0.00 178.31 177.70 1gfy h ILE 281 N -0.21 0.99 -0.17 1.41 1.08 -0.91 -1.18 117.51 118.52 1gfy h ILE 281 Ca 0.00 -0.33 0.00 0.00 -0.39 0.00 0.00 64.86 64.14 1gfy h ILE 281 Cb 0.22 -0.06 0.00 0.00 -3.07 0.00 0.00 36.82 33.90 1gfy h ILE 281 CO -0.00 0.18 0.00 0.23 -0.69 0.00 0.00 178.15 177.87 1gfy n MET 282 N -4.53 1.85 0.00 2.37 2.81 0.13 -4.82 117.12 114.92 1gfy n MET 282 Ca 0.16 -0.81 0.00 0.00 -1.81 0.00 0.00 57.70 55.23 1gfy n MET 282 Cb 0.28 -1.51 0.00 0.00 -0.71 0.00 0.00 33.22 31.28 1gfy n MET 282 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1gfy n GLY 283 N 0.41 0.89 3.33 3.03 0.00 -0.45 -5.04 105.19 107.36 1gfy n GLY 283 Ca 0.07 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.64 1gfy n GLY 283 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gfy s ASP 284 N -1.43 7.25 0.66 1.61 2.15 -0.65 -4.88 116.67 121.38 1gfy s ASP 284 Ca 0.00 -3.55 0.43 0.00 0.43 0.00 0.00 52.55 49.87 1gfy s ASP 284 Cb 0.00 -2.20 2.36 0.00 -0.30 0.00 0.00 42.92 42.78 1gfy s ASP 284 CO 0.00 -0.30 2.36 0.28 -0.17 0.00 0.00 175.17 177.34 1gfy h SER 285 N 6.71 0.00 0.16 -0.34 0.02 -1.83 -2.16 113.55 116.11 1gfy h SER 285 Ca 0.17 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 1gfy h SER 285 Cb 0.88 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.42 1gfy h SER 285 CO 0.99 0.00 -0.09 0.77 -1.14 0.00 0.00 176.83 177.36 1gfy h SER 286 N 0.00 0.00 -0.67 3.07 4.64 -1.96 -2.01 113.55 116.62 1gfy h SER 286 Ca -0.00 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.36 1gfy h SER 286 Cb 0.01 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.06 1gfy h SER 286 CO 0.00 0.09 0.45 -0.37 -0.87 0.00 0.00 176.83 176.12 1gfy h VAL 287 N 0.00 1.09 -0.73 0.95 -1.51 -1.77 -1.99 116.25 112.30 1gfy h VAL 287 Ca -0.00 -0.27 0.07 0.00 -1.23 0.00 0.00 66.70 65.26 1gfy h VAL 287 Cb 0.19 0.22 -0.06 0.00 -2.13 0.00 0.00 31.29 29.51 1gfy h VAL 287 CO 0.01 0.15 0.41 -0.61 -1.23 0.00 0.00 177.57 176.30 1gfy h GLN 288 N 0.80 0.71 0.00 5.19 4.15 -1.55 0.20 115.11 124.62 1gfy h GLN 288 Ca 0.27 -0.04 -0.05 0.00 0.77 0.00 0.00 58.65 59.60 1gfy h GLN 288 Cb 0.08 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.60 1gfy h GLN 288 CO -0.08 0.47 -0.31 -0.44 -1.93 0.00 0.00 178.83 176.54 1gfy h ASP 289 N 0.73 0.00 -0.60 -0.69 3.32 -1.55 -2.08 116.42 115.55 1gfy h ASP 289 Ca 0.33 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.39 1gfy h ASP 289 Cb 0.23 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 1gfy h ASP 289 CO -0.20 0.22 0.40 1.56 -1.72 0.00 0.00 179.24 179.50 1gfy h GLN 290 N 0.00 0.78 -0.77 3.56 4.20 -0.64 -1.23 115.11 121.02 1gfy h GLN 290 Ca -0.01 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 1gfy h GLN 290 Cb 1.18 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.74 1gfy h GLN 290 CO 0.03 0.52 0.34 -1.49 -0.67 0.00 0.00 178.83 177.56 1gfy h TRP 291 N 0.81 1.13 -0.20 2.96 6.55 -0.76 -0.78 115.95 125.66 1gfy h TRP 291 Ca 0.22 -0.06 0.02 0.00 0.95 0.00 0.00 58.89 60.01 1gfy h TRP 291 Cb -0.09 -0.35 -0.02 0.00 -0.86 0.00 0.00 29.16 27.85 1gfy h TRP 291 CO -0.03 0.84 0.08 -0.22 -1.05 0.00 0.00 178.44 178.06 1gfy h LYS 292 N 1.10 0.18 0.49 0.49 3.64 -1.01 -1.20 116.57 120.26 1gfy h LYS 292 Ca 0.26 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 1gfy h LYS 292 Cb 0.16 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1gfy h LYS 292 CO -0.03 0.12 -0.49 0.93 -2.27 0.00 0.00 179.45 177.71 1gfy h GLU 293 N 0.19 -0.94 -1.01 1.90 4.39 -0.88 -2.80 114.58 115.43 1gfy h GLU 293 Ca 0.08 0.06 0.29 0.00 0.34 0.00 0.00 59.36 60.14 1gfy h GLU 293 Cb 0.04 0.21 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 1gfy h GLU 293 CO -0.07 -0.63 0.80 -0.07 -1.16 0.00 0.00 179.01 177.88 1gfy h LEU 294 N -0.98 0.00 0.00 1.33 4.07 -1.08 -1.47 115.31 117.18 1gfy h LEU 294 Ca -0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.90 1gfy h LEU 294 Cb 0.85 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.59 1gfy h LEU 294 CO -0.06 0.00 -0.20 0.77 -1.08 0.00 0.00 178.44 177.87 1gfy h SER 295 N 0.00 0.00 -5.90 -0.43 4.64 -0.94 -3.47 113.55 107.46 1gfy h SER 295 Ca 0.48 -0.06 -0.37 0.00 -0.47 0.00 0.00 61.79 61.37 1gfy h SER 295 Cb 2.07 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 64.27 1gfy h SER 295 CO -0.01 0.03 -0.84 1.41 -0.87 0.00 0.00 176.83 176.55 1gfy n HIS 296 N -2.34 -2.08 0.22 4.77 8.25 -0.56 -4.89 115.22 118.61 1gfy n HIS 296 Ca 0.05 0.80 0.09 0.00 -0.26 0.00 0.00 57.72 58.40 1gfy n HIS 296 Cb 0.45 -4.32 0.49 0.00 1.12 0.00 0.00 29.99 27.73 1gfy n HIS 296 CO 0.00 0.00 0.00 1.05 0.64 0.00 0.00 176.34 178.03 1gfy h GLU 297 N -1.72 0.00 -0.01 -0.41 4.11 -1.83 -3.42 114.58 111.30 1gfy h GLU 297 Ca -0.62 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.81 1gfy h GLU 297 Cb 1.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1gfy h GLU 297 CO 0.51 0.24 0.00 -0.25 0.07 0.00 0.00 179.01 179.58