#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1isf n ARG 3 N 0.00 4.62 -3.54 -0.99 1.74 -1.25 -4.56 116.66 112.68 1isf n ARG 3 Ca 0.00 -4.41 -0.09 0.00 -0.77 0.00 0.00 57.85 52.57 1isf n ARG 3 Cb 0.00 -2.40 -0.03 0.00 -1.02 0.00 0.00 32.46 29.01 1isf n ARG 3 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1isf s ALA 4 N -4.20 -1.89 0.37 7.54 0.00 -1.01 -4.48 121.76 118.09 1isf s ALA 4 Ca 0.43 1.31 -0.24 0.00 0.00 0.00 0.00 51.96 53.46 1isf s ALA 4 Cb 0.26 -0.10 -0.14 0.00 0.00 0.00 0.00 23.12 23.14 1isf s ALA 4 CO -0.20 -0.52 0.45 0.39 0.00 0.00 0.00 175.76 175.89 1isf n GLU 5 N 0.19 0.38 -1.50 0.00 1.02 -1.26 -0.40 120.64 119.07 1isf n GLU 5 Ca -0.09 0.14 -0.29 0.00 -0.02 0.00 0.00 57.16 56.90 1isf n GLU 5 Cb 0.60 -1.31 0.15 0.00 -0.02 0.00 0.00 31.44 30.86 1isf n GLU 5 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1isf s GLY 6 N -0.94 1.58 0.65 0.62 0.00 -1.24 -2.31 107.32 105.68 1isf s GLY 6 Ca 0.62 -0.57 -0.18 0.00 0.00 0.00 0.00 44.72 44.59 1isf s GLY 6 CO 0.59 0.02 1.15 -1.30 0.00 0.00 0.00 173.10 173.57 1isf n THR 7 N -3.85 4.27 -2.17 0.90 -2.24 -0.71 -4.61 114.28 105.85 1isf n THR 7 Ca 0.07 -0.47 -0.41 0.00 -2.27 0.00 0.00 64.05 60.97 1isf n THR 7 Cb 0.59 -1.33 -0.03 0.00 -2.10 0.00 0.00 70.33 67.46 1isf n THR 7 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1isf s SER 8 N -1.41 6.85 0.31 3.42 0.01 0.19 -4.76 113.70 118.31 1isf s SER 8 Ca 0.80 2.55 -0.29 0.00 1.31 0.00 0.00 55.95 60.32 1isf s SER 8 Cb -0.38 -2.63 -0.10 0.00 0.21 0.00 0.00 66.02 63.11 1isf s SER 8 CO 0.43 -0.51 1.39 0.00 0.41 0.00 0.00 173.24 174.97 1isf s ALA 9 N -0.64 3.56 -1.41 1.44 0.00 -1.26 -2.64 121.76 120.81 1isf s ALA 9 Ca 0.52 1.34 -0.09 0.00 0.00 0.00 0.00 51.96 53.74 1isf s ALA 9 Cb -0.38 -3.53 0.02 0.00 0.00 0.00 0.00 23.12 19.23 1isf s ALA 9 CO 0.46 -0.75 1.06 0.72 0.00 0.00 0.00 175.76 177.25 1isf n HIS 10 N 1.29 -2.67 -0.20 0.00 8.25 -1.26 -4.89 115.22 115.74 1isf n HIS 10 Ca 0.03 0.92 0.00 0.00 -0.26 0.00 0.00 57.72 58.41 1isf n HIS 10 Cb 0.41 -4.84 0.09 0.00 1.12 0.00 0.00 29.99 26.77 1isf n HIS 10 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1isf h LEU 11 N -2.41 -0.34 0.01 2.41 5.85 -1.91 -2.30 115.31 116.61 1isf h LEU 11 Ca -0.56 0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 1isf h LEU 11 Cb 1.37 0.29 0.00 0.00 0.37 0.00 0.00 40.66 42.69 1isf h LEU 11 CO 0.57 -0.13 -0.00 -0.09 -0.34 0.00 0.00 178.44 178.44 1isf h ARG 12 N 0.08 -0.01 -0.29 1.25 2.43 -1.90 -0.45 114.38 115.49 1isf h ARG 12 Ca 0.31 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.48 1isf h ARG 12 Cb 0.49 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1isf h ARG 12 CO -0.54 0.01 0.18 -0.44 -1.51 0.00 0.00 179.97 177.67 1isf h ASP 13 N -0.03 0.34 -0.02 -3.80 3.32 -1.90 0.37 116.42 114.70 1isf h ASP 13 Ca -0.00 -0.04 0.02 0.00 0.02 0.00 0.00 57.03 57.03 1isf h ASP 13 Cb 0.03 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.47 1isf h ASP 13 CO 0.00 0.28 -0.10 0.40 -1.72 0.00 0.00 179.24 178.10 1isf h ILE 14 N 0.37 0.74 0.22 0.35 2.04 -1.34 0.49 117.51 120.38 1isf h ILE 14 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1isf h ILE 14 Cb -0.01 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.79 1isf h ILE 14 CO -0.02 0.00 -0.43 0.15 0.00 0.00 0.00 178.15 177.85 1isf h PHE 15 N -0.16 -1.23 -1.01 1.37 3.57 -0.85 0.19 116.94 118.83 1isf h PHE 15 Ca 0.05 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.67 1isf h PHE 15 Cb 0.22 0.51 -0.08 0.00 2.79 0.00 0.00 35.95 39.39 1isf h PHE 15 CO -0.17 -0.52 0.64 -0.07 -2.23 0.00 0.00 178.31 175.96 1isf h LEU 16 N -0.71 0.97 0.38 0.59 3.38 -0.73 0.78 115.31 119.98 1isf h LEU 16 Ca -0.02 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1isf h LEU 16 Cb 0.67 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1isf h LEU 16 CO -0.17 0.55 -0.18 1.23 0.09 0.00 0.00 178.44 179.96 1isf h GLY 17 N 1.06 -0.54 0.54 0.83 0.00 0.48 -0.42 103.07 105.03 1isf h GLY 17 Ca 0.48 0.20 0.10 0.00 0.00 0.00 0.00 47.33 48.10 1isf h GLY 17 CO -0.24 -0.20 0.55 3.21 0.00 0.00 0.00 176.54 179.87 1isf h ARG 18 N -0.64 0.90 -0.55 4.80 3.08 -0.09 -1.10 114.38 120.78 1isf h ARG 18 Ca -0.05 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 1isf h ARG 18 Cb 0.46 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 1isf h ARG 18 CO 0.09 0.59 0.24 0.00 -1.07 0.00 0.00 179.97 179.82 1isf h ALA 20 N 1.08 0.19 -0.68 0.00 0.00 0.09 -2.24 119.26 117.70 1isf h ALA 20 Ca 0.19 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1isf h ALA 20 Cb 0.16 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1isf h ALA 20 CO -0.02 -0.23 0.34 0.93 0.00 0.00 0.00 179.25 180.27 1isf h GLU 21 N 0.10 0.96 -0.22 0.00 5.08 -1.16 -2.62 114.58 116.72 1isf h GLU 21 Ca 0.05 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.19 1isf h GLU 21 Cb 0.15 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1isf h GLU 21 CO -0.01 0.73 -0.29 -0.92 -1.00 0.00 0.00 179.01 177.52 1isf h TYR 22 N 0.96 0.48 -0.78 4.33 3.20 -1.05 -2.93 116.97 121.18 1isf h TYR 22 Ca 0.24 -0.11 0.14 0.00 3.14 0.00 0.00 58.73 62.14 1isf h TYR 22 Cb 0.08 -0.12 -0.09 0.00 1.54 0.00 0.00 36.73 38.14 1isf h TYR 22 CO 0.01 0.68 0.36 0.00 -1.64 0.00 0.00 178.16 177.57 1isf h ARG 23 N 0.37 0.51 -0.65 1.82 3.08 -1.01 0.11 114.38 118.61 1isf h ARG 23 Ca 0.05 -0.03 0.13 0.00 0.07 0.00 0.00 59.98 60.20 1isf h ARG 23 Cb 0.71 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 1isf h ARG 23 CO 0.05 0.34 0.44 0.00 -1.07 0.00 0.00 179.97 179.73 1isf h ALA 24 N 1.54 2.16 -0.20 0.04 0.00 -1.57 -0.26 119.26 120.97 1isf h ALA 24 Ca 0.43 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 55.15 1isf h ALA 24 Cb 0.61 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1isf h ALA 24 CO -0.37 -0.33 -0.59 -0.07 0.00 0.00 0.00 179.25 177.88 1isf h LEU 25 N 0.32 0.75-10.20 0.00 3.38 -0.88 -3.45 115.31 105.23 1isf h LEU 25 Ca 0.31 -0.42 -0.54 0.00 0.09 0.00 0.00 57.88 57.33 1isf h LEU 25 Cb 0.78 -0.22 0.18 0.00 0.09 0.00 0.00 40.66 41.50 1isf h LEU 25 CO -0.08 1.17 0.35 -0.76 0.09 0.00 0.00 178.44 179.21 1isf s LEU 26 N -8.42 3.15 0.36 1.67 1.43 -0.11 -4.98 118.68 111.78 1isf s LEU 26 Ca -0.08 2.39 -0.22 0.00 -1.03 0.00 0.00 54.13 55.18 1isf s LEU 26 Cb 0.11 -4.59 -0.10 0.00 0.03 0.00 0.00 46.19 41.63 1isf s LEU 26 CO 0.86 -2.67 0.89 -0.94 0.23 0.00 0.00 176.35 174.73 1isf s SER 27 N -2.12 7.06 0.32 2.29 1.04 -1.26 -4.75 113.70 116.27 1isf s SER 27 Ca 0.74 1.65 0.10 0.00 0.48 0.00 0.00 55.95 58.91 1isf s SER 27 Cb -0.29 -2.52 0.91 0.00 0.10 0.00 0.00 66.02 64.23 1isf s SER 27 CO 0.50 -0.20 1.70 1.55 0.98 0.00 0.00 173.24 177.77 1isf h PRO 28 N 2.53 0.44 0.00 4.02 0.13 -1.93 0.42 132.00 137.60 1isf h PRO 28 Ca -0.48 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1isf h PRO 28 Cb 1.18 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1isf h PRO 28 CO 0.63 0.29 0.00 -0.85 -0.23 0.00 0.00 178.00 177.84 1isf n GLU 29 N -4.98 0.06 0.00 0.86 0.00 -1.26 -1.81 120.64 113.51 1isf n GLU 29 Ca 0.27 0.19 0.00 0.00 0.00 0.00 0.00 57.16 57.63 1isf n GLU 29 Cb 0.80 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.74 1isf n GLU 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1isf n GLN 30 N -1.22 0.00 0.08 3.44 10.64 0.24 -4.87 117.38 125.70 1isf n GLN 30 Ca 0.02 -0.22 0.10 0.00 -1.83 0.00 0.00 57.00 55.07 1isf n GLN 30 Cb 0.02 -0.36 0.43 0.00 -0.86 0.00 0.00 30.24 29.47 1isf n GLN 30 CO 0.00 0.00 0.00 -2.13 -1.83 0.00 0.00 177.06 173.10 1isf n ARG 31 N 0.00 0.12 -2.53 2.61 0.63 0.12 -4.41 116.66 113.20 1isf n ARG 31 Ca 0.00 0.35 -0.42 0.00 -0.92 0.00 0.00 57.85 56.86 1isf n ARG 31 Cb 0.41 -1.73 -0.01 0.00 0.45 0.00 0.00 32.46 31.58 1isf n ARG 31 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1isf s ASN 32 N -3.79 6.65 -0.08 6.15 2.47 -1.26 -4.91 114.94 120.18 1isf s ASN 32 Ca 0.05 -2.27 0.04 0.00 0.42 0.00 0.00 52.86 51.10 1isf s ASN 32 Cb 0.10 -2.58 -0.02 0.00 -1.45 0.00 0.00 41.25 37.30 1isf s ASN 32 CO 0.35 -1.36 -0.19 -0.54 -3.72 0.00 0.00 177.10 171.64 1isf s LYS 33 N 4.50 2.79 -0.67 0.43 -0.14 -1.26 -5.08 119.74 120.31 1isf s LYS 33 Ca 0.54 -0.79 -0.16 0.00 -1.36 0.00 0.00 55.97 54.21 1isf s LYS 33 Cb 0.03 -2.36 0.16 0.00 -1.68 0.00 0.00 37.83 33.98 1isf s LYS 33 CO 0.06 0.39 0.67 0.34 -0.76 0.00 0.00 175.35 176.06 1isf s ASP 34 N -0.16 6.41 0.37 2.83 -1.08 -1.26 -4.92 116.67 118.87 1isf s ASP 34 Ca -0.02 -2.05 0.07 0.00 -0.52 0.00 0.00 52.55 50.03 1isf s ASP 34 Cb -0.14 -2.24 0.79 0.00 -1.46 0.00 0.00 42.92 39.88 1isf s ASP 34 CO 0.04 -0.82 1.95 0.00 0.52 0.00 0.00 175.17 176.85 1isf h THR 36 N 0.70 1.27 -0.65 0.00 2.02 -1.97 0.06 112.91 114.33 1isf h THR 36 Ca 0.33 -1.00 -0.06 0.00 0.77 0.00 0.00 66.41 66.45 1isf h THR 36 Cb 0.37 1.37 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 1isf h THR 36 CO -0.11 0.32 0.17 0.00 0.37 0.00 0.00 175.52 176.26 1isf h ALA 37 N 0.80 1.08 -0.65 6.16 0.00 -1.81 -1.02 119.26 123.81 1isf h ALA 37 Ca 0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1isf h ALA 37 Cb 0.48 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1isf h ALA 37 CO 0.02 0.62 0.34 0.82 0.00 0.00 0.00 179.25 181.04 1isf h ILE 38 N 0.97 1.21 -0.20 0.00 2.04 -0.61 -1.97 117.51 118.96 1isf h ILE 38 Ca 0.21 -0.57 -0.09 0.00 1.00 0.00 0.00 64.86 65.41 1isf h ILE 38 Cb 0.32 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1isf h ILE 38 CO -0.00 0.24 -0.27 -0.25 0.00 0.00 0.00 178.15 177.87 1isf h TRP 39 N 0.90 0.42 0.00 1.37 2.91 -0.41 -2.39 115.95 118.75 1isf h TRP 39 Ca 0.23 -0.09 -0.12 0.00 1.13 0.00 0.00 58.89 60.04 1isf h TRP 39 Cb 0.08 -0.10 -0.02 0.00 -0.51 0.00 0.00 29.16 28.61 1isf h TRP 39 CO -0.00 0.61 -0.57 0.93 -1.03 0.00 0.00 178.44 178.38 1isf h GLU 40 N 0.33 0.00 -0.06 2.65 5.08 -0.76 0.30 114.58 122.12 1isf h GLU 40 Ca 0.05 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.17 1isf h GLU 40 Cb 0.65 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.91 1isf h GLU 40 CO 0.05 0.57 -0.91 0.00 -1.00 0.00 0.00 179.01 177.71 1isf h ALA 41 N 1.43 0.27 -0.37 3.43 0.00 -1.15 -3.17 119.26 119.70 1isf h ALA 41 Ca -0.01 -0.66 -0.06 0.00 0.00 0.00 0.00 54.91 54.19 1isf h ALA 41 Cb 1.12 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1isf h ALA 41 CO 0.07 0.71 0.00 0.35 0.00 0.00 0.00 179.25 180.39 1isf h PHE 42 N 0.41 0.71 -0.25 0.00 3.57 -1.33 -3.10 116.94 116.95 1isf h PHE 42 Ca -0.09 -0.12 0.07 0.00 3.53 0.00 0.00 57.97 61.36 1isf h PHE 42 Cb 1.55 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 40.09 1isf h PHE 42 CO 0.09 0.74 0.52 -0.22 -2.23 0.00 0.00 178.31 177.21 1isf h LYS 43 N 0.47 0.00 -0.96 1.11 3.64 -0.91 -2.83 116.57 117.09 1isf h LYS 43 Ca 0.11 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.61 1isf h LYS 43 Cb 0.46 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 32.19 1isf h LYS 43 CO 0.02 0.00 0.59 -0.24 -2.27 0.00 0.00 179.45 177.55 1isf h VAL 44 N 0.00 0.89 0.00 2.00 3.04 -1.57 -0.32 116.25 120.29 1isf h VAL 44 Ca 0.12 -0.32 0.00 0.00 -1.01 0.00 0.00 66.70 65.49 1isf h VAL 44 Cb 1.16 -0.11 0.00 0.00 -2.01 0.00 0.00 31.29 30.34 1isf h VAL 44 CO -0.00 0.17 0.00 0.00 -1.01 0.00 0.00 177.57 176.73 1isf h ALA 45 N 1.53 1.00 -0.13 3.17 0.00 -1.76 -1.51 119.26 121.56 1isf h ALA 45 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1isf h ALA 45 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1isf h ALA 45 CO -0.28 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.25 1isf n LEU 46 N -2.72 1.21 -0.00 0.00 4.77 -0.13 -3.47 117.00 116.65 1isf n LEU 46 Ca -0.01 -0.52 0.06 0.00 -0.03 0.00 0.00 56.01 55.52 1isf n LEU 46 Cb 0.15 -0.08 -0.09 0.00 -2.33 0.00 0.00 43.42 41.07 1isf n LEU 46 CO 0.19 0.26 -0.46 0.47 -1.33 0.00 0.00 177.39 176.52 1isf n ASP 47 N 0.03 1.77 -4.34 -1.43 8.00 -0.57 -4.57 116.55 115.44 1isf n ASP 47 Ca 0.15 -0.22 -0.24 0.00 0.71 0.00 0.00 54.79 55.18 1isf n ASP 47 Cb 0.25 1.39 0.14 0.00 -0.02 0.00 0.00 41.12 42.88 1isf n ASP 47 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1isf n LYS 48 N -1.73 -0.38 -2.45 -1.24 5.02 -1.23 -5.05 118.16 111.11 1isf n LYS 48 Ca -0.01 -2.51 -0.41 0.00 -2.02 0.00 0.00 58.31 53.36 1isf n LYS 48 Cb 0.27 -0.81 -0.04 0.00 -0.02 0.00 0.00 35.03 34.43 1isf n LYS 48 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1isf s ASP 49 N -5.17 7.17 0.00 4.39 2.15 -1.26 -4.63 116.67 119.32 1isf s ASP 49 Ca 0.67 2.13 0.00 0.00 0.43 0.00 0.00 52.55 55.78 1isf s ASP 49 Cb -0.03 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 1isf s ASP 49 CO 0.45 -0.32 0.79 -0.81 -0.17 0.00 0.00 175.17 175.12 1isf n PRO 50 N 2.66 0.00 -0.03 4.34 -0.04 -1.26 -0.10 135.00 140.56 1isf n PRO 50 Ca 0.04 0.31 0.03 0.00 -0.04 0.00 0.00 63.50 63.84 1isf n PRO 50 Cb 0.46 -1.61 0.04 0.00 -0.04 0.00 0.00 33.50 32.35 1isf n PRO 50 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1isf n SER 52 N -0.73 2.24 -4.53 0.00 7.64 0.86 -4.40 113.62 114.70 1isf n SER 52 Ca 0.05 -3.53 -0.35 0.00 1.01 0.00 0.00 58.87 56.05 1isf n SER 52 Cb 0.39 -0.46 -0.11 0.00 -1.01 0.00 0.00 64.21 63.01 1isf n SER 52 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1isf s VAL 53 N -3.08 4.31 0.21 0.44 1.01 -0.25 -4.73 120.40 118.31 1isf s VAL 53 Ca 0.40 -0.20 0.06 0.00 0.00 0.00 0.00 61.98 62.24 1isf s VAL 53 Cb 0.38 -2.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 1isf s VAL 53 CO -0.06 0.44 0.15 -0.76 0.00 0.00 0.00 175.10 174.87 1isf s LEU 54 N 0.73 3.77 0.42 3.92 1.43 -1.26 -4.16 118.68 123.53 1isf s LEU 54 Ca 0.01 -0.22 0.12 0.00 -1.03 0.00 0.00 54.13 53.01 1isf s LEU 54 Cb -0.14 -2.34 0.96 0.00 0.03 0.00 0.00 46.19 44.71 1isf s LEU 54 CO 0.02 0.02 1.99 -0.65 0.23 0.00 0.00 176.35 177.96 1isf h PRO 55 N 1.95 0.46 0.00 1.29 0.11 -1.96 -1.79 132.00 132.08 1isf h PRO 55 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1isf h PRO 55 Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1isf h PRO 55 CO 0.62 0.31 0.00 0.66 -0.21 0.00 0.00 178.00 179.37 1isf h SER 56 N 0.48 0.00 0.43 -2.05 4.64 -1.95 -2.56 113.55 112.53 1isf h SER 56 Ca 0.26 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 1isf h SER 56 Cb 0.40 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1isf h SER 56 CO -0.07 0.00 -0.07 0.44 -0.87 0.00 0.00 176.83 176.26 1isf h ASP 57 N 0.00 0.00 -0.49 4.97 3.32 -1.72 -1.71 116.42 120.80 1isf h ASP 57 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1isf h ASP 57 Cb 0.35 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.90 1isf h ASP 57 CO 0.00 0.07 0.00 -1.22 -1.72 0.00 0.00 179.24 176.37 1isf n TYR 58 N -3.40 0.76 -0.23 4.55 4.02 -0.96 -4.44 117.16 117.46 1isf n TYR 58 Ca -0.02 -0.35 -0.04 0.00 -0.01 0.00 0.00 57.90 57.48 1isf n TYR 58 Cb 0.21 -0.05 0.07 0.00 -0.02 0.00 0.00 39.34 39.56 1isf n TYR 58 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 176.86 175.41 1isf h ASP 59 N 2.90 0.64 0.03 7.72 3.32 -1.47 -1.54 116.42 128.02 1isf h ASP 59 Ca 0.00 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1isf h ASP 59 Cb 0.77 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1isf h ASP 59 CO 0.04 0.44 -0.01 0.25 -1.72 0.00 0.00 179.24 178.24 1isf h LEU 60 N 0.77 -0.03 -0.68 1.55 6.46 -1.83 -0.82 115.31 120.73 1isf h LEU 60 Ca 0.26 -0.04 0.13 0.00 -0.12 0.00 0.00 57.88 58.11 1isf h LEU 60 Cb 0.04 0.01 -0.13 0.00 -0.73 0.00 0.00 40.66 39.85 1isf h LEU 60 CO -0.11 0.02 -0.24 0.15 -0.62 0.00 0.00 178.44 177.63 1isf h PHE 61 N -0.08 -0.59 -0.37 1.25 3.57 -1.70 -0.06 116.94 118.96 1isf h PHE 61 Ca -0.00 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 1isf h PHE 61 Cb 0.07 0.36 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 1isf h PHE 61 CO -0.06 -0.34 0.16 0.82 -2.23 0.00 0.00 178.31 176.66 1isf h ILE 62 N -0.06 1.18 -0.95 1.41 1.08 -0.84 -1.98 117.51 117.35 1isf h ILE 62 Ca 0.30 -0.52 0.08 0.00 -0.39 0.00 0.00 64.86 64.33 1isf h ILE 62 Cb 0.54 0.84 -0.07 0.00 -3.07 0.00 0.00 36.82 35.06 1isf h ILE 62 CO -0.72 0.19 0.61 0.74 -0.69 0.00 0.00 178.15 178.28 1isf h THR 63 N 0.45 1.04 0.00 -0.27 2.02 0.31 0.74 112.91 117.20 1isf h THR 63 Ca 0.12 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1isf h THR 63 Cb 0.15 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.45 1isf h THR 63 CO -0.01 0.19 -0.06 -0.07 0.37 0.00 0.00 175.52 175.93 1isf h LEU 64 N 1.05 0.00 0.00 2.58 3.38 -0.76 -3.35 115.31 118.21 1isf h LEU 64 Ca 0.42 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.38 1isf h LEU 64 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1isf h LEU 64 CO -0.17 0.01 -0.45 -1.54 0.09 0.00 0.00 178.44 176.38 1isf n SER 65 N -2.57 1.60 -4.71 -0.43 3.41 -0.77 -4.71 113.62 105.44 1isf n SER 65 Ca 0.05 -0.36 -0.42 0.00 -0.26 0.00 0.00 58.87 57.87 1isf n SER 65 Cb 0.47 1.04 -0.00 0.00 -0.26 0.00 0.00 64.21 65.46 1isf n SER 65 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 1isf n ARG 66 N -1.23 2.14 -3.72 4.33 0.63 0.25 -4.44 116.66 114.61 1isf n ARG 66 Ca 0.00 0.75 -0.10 0.00 -0.92 0.00 0.00 57.85 57.59 1isf n ARG 66 Cb 0.04 -2.38 -0.04 0.00 0.45 0.00 0.00 32.46 30.53 1isf n ARG 66 CO 0.00 0.00 0.00 -3.38 -2.51 0.00 0.00 177.63 171.74 1isf s HIS 67 N -1.12 -0.11 0.49 -0.14 -3.43 -1.26 -5.03 115.29 104.69 1isf s HIS 67 Ca 0.57 -0.22 -0.21 0.00 -0.80 0.00 0.00 55.06 54.40 1isf s HIS 67 Cb -0.54 0.34 -0.08 0.00 -1.43 0.00 0.00 32.58 30.87 1isf s HIS 67 CO 0.61 -0.86 1.07 -1.54 -2.00 0.00 0.00 174.74 172.02 1isf s SER 68 N -2.86 6.21 -0.18 7.38 1.04 -1.26 -5.04 113.70 119.00 1isf s SER 68 Ca 0.08 2.02 -0.03 0.00 0.48 0.00 0.00 55.95 58.51 1isf s SER 68 Cb -0.00 -2.57 -0.02 0.00 0.10 0.00 0.00 66.02 63.53 1isf s SER 68 CO -0.05 -0.87 -0.06 -0.63 0.98 0.00 0.00 173.24 172.61 1isf s ILE 69 N -1.88 3.44 0.41 -1.02 1.01 -1.26 -5.09 121.20 116.81 1isf s ILE 69 Ca 0.68 -0.50 -0.25 0.00 0.00 0.00 0.00 60.65 60.58 1isf s ILE 69 Cb -0.19 -2.52 -0.11 0.00 0.01 0.00 0.00 42.46 39.65 1isf s ILE 69 CO 0.23 0.47 1.06 -2.65 0.00 0.00 0.00 174.94 174.05 1isf n PRO 70 N 4.11 1.46 -1.80 2.79 -0.02 -1.26 -4.76 135.00 135.51 1isf n PRO 70 Ca -0.18 0.52 -0.40 0.00 -2.02 0.00 0.00 63.50 61.42 1isf n PRO 70 Cb 0.52 -2.09 0.02 0.00 -0.02 0.00 0.00 33.50 31.92 1isf n PRO 70 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1isf s ARG 71 N -2.02 3.72 -1.32 -0.52 3.52 -1.26 -1.98 118.95 119.09 1isf s ARG 71 Ca 0.62 2.42 0.00 0.00 -0.13 0.00 0.00 55.73 58.65 1isf s ARG 71 Cb -0.56 -2.68 0.00 0.00 -1.56 0.00 0.00 34.95 30.16 1isf s ARG 71 CO 0.57 -0.79 0.00 -0.25 -0.81 0.00 0.00 175.30 174.02 1isf n ASP 72 N -0.15 -5.31 -0.21 -2.12 8.00 -0.45 -4.84 116.55 111.47 1isf n ASP 72 Ca 0.05 0.31 0.05 0.00 0.71 0.00 0.00 54.79 55.91 1isf n ASP 72 Cb 0.42 -3.90 -0.01 0.00 -0.02 0.00 0.00 41.12 37.61 1isf n ASP 72 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1isf n LYS 73 N -1.56 2.25 -2.44 -1.24 4.76 -0.84 -4.76 118.16 114.34 1isf n LYS 73 Ca -0.12 -0.54 -0.40 0.00 -2.87 0.00 0.00 58.31 54.37 1isf n LYS 73 Cb 0.54 -1.09 -0.04 0.00 -1.84 0.00 0.00 35.03 32.60 1isf n LYS 73 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 1isf s SER 74 N -1.51 7.17 -0.24 4.39 0.01 -1.26 -0.53 113.70 121.73 1isf s SER 74 Ca 0.08 2.30 -0.03 0.00 1.31 0.00 0.00 55.95 59.62 1isf s SER 74 Cb 0.09 -2.63 0.08 0.00 0.21 0.00 0.00 66.02 63.77 1isf s SER 74 CO 0.30 -0.21 0.07 -0.22 0.41 0.00 0.00 173.24 173.58 1isf s LEU 75 N -1.58 1.26 0.58 2.44 2.96 -1.26 -2.48 118.68 120.61 1isf s LEU 75 Ca 0.46 -1.08 -0.00 0.00 -0.22 0.00 0.00 54.13 53.29 1isf s LEU 75 Cb -0.32 -0.59 0.04 0.00 0.50 0.00 0.00 46.19 45.82 1isf s LEU 75 CO 0.41 -0.36 0.82 -0.36 -1.32 0.00 0.00 176.35 175.55 1isf s PHE 76 N 1.86 2.82 -0.01 5.38 0.40 0.97 -4.35 117.98 125.05 1isf s PHE 76 Ca 0.03 0.05 -0.30 0.00 -0.60 0.00 0.00 56.93 56.11 1isf s PHE 76 Cb -0.17 -2.83 0.11 0.00 0.51 0.00 0.00 43.02 40.64 1isf s PHE 76 CO -0.17 -0.99 1.19 1.67 0.70 0.00 0.00 175.22 177.62 1isf s TRP 77 N -2.85 -0.09 -0.18 0.36 1.48 -1.26 -0.98 118.94 115.41 1isf s TRP 77 Ca 0.58 -0.04 -0.09 0.00 -1.06 0.00 0.00 56.10 55.48 1isf s TRP 77 Cb -0.10 0.56 0.06 0.00 -1.16 0.00 0.00 33.47 32.83 1isf s TRP 77 CO 0.40 -0.39 0.43 -1.21 -4.06 0.00 0.00 176.95 172.12 1isf s GLU 78 N -2.63 0.40 -1.23 3.25 0.41 -1.03 -4.80 118.70 113.07 1isf s GLU 78 Ca 0.12 0.83 -0.08 0.00 -0.41 0.00 0.00 54.97 55.44 1isf s GLU 78 Cb 0.02 0.01 0.01 0.00 -1.78 0.00 0.00 34.13 32.39 1isf s GLU 78 CO -0.03 -0.17 1.04 0.09 -0.49 0.00 0.00 175.26 175.71 1isf n ASN 79 N 4.35 -5.95 -0.68 -0.19 3.02 -1.26 -3.42 115.26 111.14 1isf n ASN 79 Ca -0.22 -0.47 -0.01 0.00 -0.03 0.00 0.00 54.58 53.84 1isf n ASN 79 Cb 0.55 -4.57 -0.01 0.00 -0.61 0.00 0.00 39.78 35.13 1isf n ASN 79 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1isf n SER 80 N -2.53 -0.14 -0.34 6.41 7.64 -1.26 -4.50 113.62 118.90 1isf n SER 80 Ca 0.00 -1.46 -0.06 0.00 1.01 0.00 0.00 58.87 58.36 1isf n SER 80 Cb 0.56 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.72 1isf n SER 80 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1isf n HIS 81 N 0.04 -0.23 -0.09 1.43 -0.00 -1.26 -1.00 115.22 114.10 1isf n HIS 81 Ca -0.05 1.05 -0.07 0.00 0.46 0.00 0.00 57.72 59.10 1isf n HIS 81 Cb 0.63 -0.65 0.10 0.00 -0.12 0.00 0.00 29.99 29.94 1isf n HIS 81 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 1isf h LEU 82 N 0.00 0.78 -1.03 0.27 3.38 -2.00 -2.17 115.31 114.54 1isf h LEU 82 Ca 0.19 -0.27 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 1isf h LEU 82 Cb 0.40 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1isf h LEU 82 CO -0.81 0.96 -0.43 0.25 0.09 0.00 0.00 178.44 178.51 1isf h LEU 83 N 0.68 0.12 -0.03 1.67 5.85 -1.61 -1.26 115.31 120.74 1isf h LEU 83 Ca 0.10 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 1isf h LEU 83 Cb 0.70 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 1isf h LEU 83 CO 0.05 0.54 -0.05 0.58 -0.34 0.00 0.00 178.44 179.23 1isf h VAL 84 N 0.10 1.41 -0.79 1.05 2.07 -0.85 -0.22 116.25 119.03 1isf h VAL 84 Ca 0.01 -1.30 -0.01 0.00 0.82 0.00 0.00 66.70 66.21 1isf h VAL 84 Cb 0.80 2.22 -0.04 0.00 -1.52 0.00 0.00 31.29 32.75 1isf h VAL 84 CO 0.06 0.35 0.44 0.78 0.02 0.00 0.00 177.57 179.21 1isf h ASN 85 N -0.42 0.98 -0.31 0.57 2.35 -1.33 0.15 115.58 117.57 1isf h ASN 85 Ca 0.00 -0.09 -0.05 0.00 -0.55 0.00 0.00 56.30 55.60 1isf h ASN 85 Cb 0.59 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1isf h ASN 85 CO 0.01 0.79 -0.02 -1.28 -1.65 0.00 0.00 177.43 175.28 1isf h SER 86 N 1.09 0.55 -0.20 5.81 0.87 -1.25 -2.02 113.55 118.40 1isf h SER 86 Ca 0.28 -0.32 -0.07 0.00 -1.23 0.00 0.00 61.79 60.44 1isf h SER 86 Cb 0.03 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1isf h SER 86 CO -0.05 0.74 -0.16 0.15 -0.53 0.00 0.00 176.83 176.99 1isf h PHE 87 N 0.35 0.55 -0.05 2.24 -0.00 -0.82 -2.92 116.94 116.29 1isf h PHE 87 Ca 0.08 -0.15 0.01 0.00 -0.00 0.00 0.00 57.97 57.91 1isf h PHE 87 Cb 0.47 -0.12 -0.00 0.00 -0.00 0.00 0.00 35.95 36.30 1isf h PHE 87 CO 0.04 0.79 0.03 0.00 -0.00 0.00 0.00 178.31 179.18 1isf h ALA 88 N 0.67 2.04 -6.18 2.41 0.00 -0.72 -3.43 119.26 114.05 1isf h ALA 88 Ca 0.04 -0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.59 1isf h ALA 88 Cb 0.68 0.00 0.05 0.00 0.00 0.00 0.00 17.79 18.52 1isf h ALA 88 CO 0.04 -0.05 -0.78 -3.47 0.00 0.00 0.00 179.25 174.99 1isf n ASP 89 N -4.53 -5.74 -3.87 0.00 2.03 -0.76 -1.74 116.55 101.94 1isf n ASP 89 Ca -0.02 -0.81 -0.25 0.00 0.52 0.00 0.00 54.79 54.23 1isf n ASP 89 Cb 0.13 -3.34 0.01 0.00 -0.72 0.00 0.00 41.12 37.20 1isf n ASP 89 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1isf n ASN 90 N -2.45 -1.58 0.00 1.67 5.15 -1.26 -1.80 115.26 114.99 1isf n ASN 90 Ca -0.13 -0.90 0.00 0.00 -0.60 0.00 0.00 54.58 52.95 1isf n ASN 90 Cb 0.60 -3.56 0.00 0.00 -0.53 0.00 0.00 39.78 36.29 1isf n ASN 90 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1isf n THR 91 N -4.39 0.00 0.23 -0.44 -2.24 -1.19 -4.91 114.28 101.34 1isf n THR 91 Ca -0.22 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.40 1isf n THR 91 Cb 0.64 -0.05 -0.08 0.00 -2.10 0.00 0.00 70.33 68.74 1isf n THR 91 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1isf h ARG 92 N 1.99 -0.53 0.02 -0.78 3.08 -1.20 -3.36 114.38 113.60 1isf h ARG 92 Ca 0.00 0.04 -0.20 0.00 0.07 0.00 0.00 59.98 59.89 1isf h ARG 92 Cb 0.00 0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1isf h ARG 92 CO 0.00 -0.32 -1.08 0.00 -1.07 0.00 0.00 179.97 177.50 1isf h ARG 93 N -0.59 0.03 -4.10 0.04 3.08 -1.55 -3.50 114.38 107.79 1isf h ARG 93 Ca -0.06 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 59.78 1isf h ARG 93 Cb 0.45 0.02 -0.12 0.00 0.08 0.00 0.00 29.97 30.40 1isf h ARG 93 CO 0.09 1.03 -0.34 -0.06 -1.07 0.00 0.00 179.97 179.62 1isf s PHE 94 N -2.35 0.77 -0.65 3.04 0.40 -1.19 -5.01 117.98 112.98 1isf s PHE 94 Ca -0.26 -1.05 0.05 0.00 -0.60 0.00 0.00 56.93 55.07 1isf s PHE 94 Cb 0.04 -0.16 0.18 0.00 0.51 0.00 0.00 43.02 43.59 1isf s PHE 94 CO 0.63 -0.85 0.50 -0.12 0.70 0.00 0.00 175.22 176.08 1isf n MET 95 N -0.35 1.62 -1.44 0.44 1.56 0.31 -3.54 117.12 115.72 1isf n MET 95 Ca 0.00 -4.27 -0.29 0.00 -0.27 0.00 0.00 57.70 52.87 1isf n MET 95 Cb 0.64 -2.16 0.18 0.00 2.15 0.00 0.00 33.22 34.03 1isf n MET 95 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 1isf s PRO 96 N -1.33 0.26 0.25 2.12 0.04 -1.26 -3.99 135.00 131.09 1isf s PRO 96 Ca 0.28 0.07 -0.03 0.00 0.04 0.00 0.00 61.00 61.36 1isf s PRO 96 Cb -0.00 -1.76 0.48 0.00 0.04 0.00 0.00 34.50 33.26 1isf s PRO 96 CO -0.16 -2.75 1.76 1.25 0.04 0.00 0.00 177.00 177.14 1isf h LEU 97 N -1.89 0.46 -2.58 -3.56 5.85 -1.95 0.17 115.31 111.81 1isf h LEU 97 Ca -0.48 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1isf h LEU 97 Cb 1.30 0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.35 1isf h LEU 97 CO 0.49 0.21 0.05 0.77 -0.34 0.00 0.00 178.44 179.61 1isf h SER 98 N 0.58 0.00 -0.64 1.25 4.64 -1.92 -2.03 113.55 115.44 1isf h SER 98 Ca 0.43 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 61.35 1isf h SER 98 Cb 0.59 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.44 1isf h SER 98 CO -0.35 0.00 -0.01 0.47 -0.87 0.00 0.00 176.83 176.07 1isf n ASP 99 N -2.90 4.26 -4.06 4.97 8.00 0.60 -3.04 116.55 124.38 1isf n ASP 99 Ca -0.03 -3.77 -0.23 0.00 0.71 0.00 0.00 54.79 51.48 1isf n ASP 99 Cb 0.11 -0.65 -0.16 0.00 -0.02 0.00 0.00 41.12 40.40 1isf n ASP 99 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1isf s VAL 100 N -3.92 1.06 0.15 2.53 1.01 -0.76 -4.71 120.40 115.75 1isf s VAL 100 Ca 0.52 -0.52 -0.20 0.00 0.00 0.00 0.00 61.98 61.78 1isf s VAL 100 Cb 0.44 -0.92 0.05 0.00 0.00 0.00 0.00 36.38 35.94 1isf s VAL 100 CO 0.01 0.32 1.23 -0.11 0.00 0.00 0.00 175.10 176.55 1isf n LEU 101 N 3.19 -0.71 0.09 3.92 7.94 -1.26 -0.17 117.00 129.99 1isf n LEU 101 Ca -0.18 1.41 0.09 0.00 -1.11 0.00 0.00 56.01 56.22 1isf n LEU 101 Cb 0.54 -0.24 0.41 0.00 0.53 0.00 0.00 43.42 44.65 1isf n LEU 101 CO 0.25 -1.20 0.78 0.00 -1.11 0.00 0.00 177.39 176.11 1isf n TYR 102 N -5.07 0.49 -0.11 1.96 0.18 -1.26 -2.72 117.16 110.63 1isf n TYR 102 Ca 0.04 0.21 -0.16 0.00 1.88 0.00 0.00 57.90 59.87 1isf n TYR 102 Cb 0.25 -0.84 -0.13 0.00 -0.38 0.00 0.00 39.34 38.25 1isf n TYR 102 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1isf n GLY 103 N -0.35 -0.54 0.24 -7.48 0.00 0.76 -4.49 105.19 93.32 1isf n GLY 103 Ca 0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 1isf n GLY 103 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1isf h ARG 104 N 0.01 0.60 0.00 1.61 9.65 -0.72 -1.72 114.38 123.80 1isf h ARG 104 Ca -0.55 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.29 1isf h ARG 104 Cb 1.99 -0.13 0.00 0.00 -1.39 0.00 0.00 29.97 30.44 1isf h ARG 104 CO -0.04 0.40 0.00 -0.39 2.80 0.00 0.00 179.97 182.73 1isf h VAL 105 N 0.62 0.00 0.00 0.20 -1.51 -1.75 -3.14 116.25 110.67 1isf h VAL 105 Ca 0.27 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 65.64 1isf h VAL 105 Cb 0.16 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.31 1isf h VAL 105 CO -0.17 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.17 1isf n ALA 106 N -2.02 2.02 -1.62 5.19 0.00 -1.04 -4.56 120.51 118.49 1isf n ALA 106 Ca -0.02 -0.08 -0.57 0.00 0.00 0.00 0.00 53.44 52.77 1isf n ALA 106 Cb 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.49 1isf n ALA 106 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1isf n ASP 107 N -0.80 1.34 0.00 0.00 4.64 -0.68 -0.73 116.55 120.32 1isf n ASP 107 Ca 0.00 1.13 0.00 0.00 -1.38 0.00 0.00 54.79 54.54 1isf n ASP 107 Cb 0.00 -1.07 0.00 0.00 -1.04 0.00 0.00 41.12 39.01 1isf n ASP 107 CO 0.00 0.00 0.00 0.49 -0.82 0.00 0.00 177.20 176.87 1isf n PHE 108 N 3.09 0.00 -2.40 -0.67 3.01 -1.26 -4.98 117.46 114.25 1isf n PHE 108 Ca 0.22 0.00 -0.24 0.00 1.01 0.00 0.00 57.45 58.44 1isf n PHE 108 Cb 0.12 -0.78 0.05 0.00 -0.01 0.00 0.00 39.48 38.86 1isf n PHE 108 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1isf s LEU 109 N 0.00 3.02 0.04 4.37 1.43 0.09 -5.06 118.68 122.57 1isf s LEU 109 Ca 0.00 0.27 0.01 0.00 -1.03 0.00 0.00 54.13 53.37 1isf s LEU 109 Cb 0.00 -3.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.17 1isf s LEU 109 CO 0.00 -1.39 -0.04 -0.44 0.23 0.00 0.00 176.35 174.71 1isf s SER 110 N -4.47 0.49 -0.13 2.29 0.01 -1.26 -4.98 113.70 105.65 1isf s SER 110 Ca 0.59 -0.62 -0.30 0.00 1.31 0.00 0.00 55.95 56.92 1isf s SER 110 Cb -0.11 0.10 0.12 0.00 0.21 0.00 0.00 66.02 66.34 1isf s SER 110 CO 0.42 -0.33 0.95 -1.66 0.41 0.00 0.00 173.24 173.03 1isf s TRP 111 N -1.96 -0.39 0.00 2.43 -2.14 -1.26 -0.64 118.94 114.99 1isf s TRP 111 Ca -0.09 0.60 0.00 0.00 2.66 0.00 0.00 56.10 59.27 1isf s TRP 111 Cb -0.06 0.46 0.00 0.00 -3.10 0.00 0.00 33.47 30.77 1isf s TRP 111 CO -0.02 -0.40 0.00 0.00 -2.66 0.00 0.00 176.95 173.87 1isf s ARG 113 N -2.00 3.53 0.63 0.00 3.52 -1.26 -1.79 118.95 121.58 1isf s ARG 113 Ca 0.00 -0.06 -0.18 0.00 -0.13 0.00 0.00 55.73 55.37 1isf s ARG 113 Cb 0.00 -2.54 -0.02 0.00 -1.56 0.00 0.00 34.95 30.84 1isf s ARG 113 CO 0.00 0.01 1.22 -0.65 -0.81 0.00 0.00 175.30 175.06 1isf s GLN 114 N -4.40 2.75 0.22 5.12 -0.21 -0.50 -4.39 119.66 118.25 1isf s GLN 114 Ca 0.44 1.84 -0.08 0.00 0.02 0.00 0.00 55.36 57.58 1isf s GLN 114 Cb -0.10 -1.90 0.35 0.00 1.00 0.00 0.00 33.01 32.36 1isf s GLN 114 CO 0.39 -1.38 1.72 -0.22 -2.12 0.00 0.00 175.29 173.68 1isf h LYS 115 N 0.58 0.34 0.00 2.91 3.64 -1.96 -3.32 116.57 118.76 1isf h LYS 115 Ca -0.50 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 1isf h LYS 115 Cb 1.30 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 1isf h LYS 115 CO 0.54 0.23 -0.89 0.00 -2.27 0.00 0.00 179.45 177.05 1isf n ALA 116 N -2.54 2.01 -2.15 5.00 0.00 -1.26 -4.82 120.51 116.74 1isf n ALA 116 Ca 0.11 -0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.33 1isf n ALA 116 Cb 0.34 -0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.81 1isf n ALA 116 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1isf s ASP 117 N -1.90 5.56 0.24 0.00 2.15 -1.25 -5.02 116.67 116.45 1isf s ASP 117 Ca -0.00 0.11 0.18 0.00 0.43 0.00 0.00 52.55 53.27 1isf s ASP 117 Cb 0.00 -1.18 0.06 0.00 -0.30 0.00 0.00 42.92 41.50 1isf s ASP 117 CO 0.00 -0.92 1.25 0.77 -0.17 0.00 0.00 175.17 176.11 1isf h SER 118 N 0.25 0.00 -4.21 -0.34 4.64 -1.97 -3.34 113.55 108.57 1isf h SER 118 Ca -0.44 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.41 1isf h SER 118 Cb 1.27 0.00 0.13 0.00 -0.31 0.00 0.00 62.40 63.49 1isf h SER 118 CO 0.54 0.34 0.30 -0.83 -0.87 0.00 0.00 176.83 176.31 1isf s GLY 119 N -4.48 1.60 0.30 -0.77 0.00 -1.26 -4.77 107.32 97.93 1isf s GLY 119 Ca 0.02 -0.35 -0.29 0.00 0.00 0.00 0.00 44.72 44.10 1isf s GLY 119 CO 0.76 0.16 1.12 1.08 0.00 0.00 0.00 173.10 176.21 1isf s LEU 120 N -5.99 4.50 -0.59 0.66 1.43 -1.26 -1.41 118.68 116.02 1isf s LEU 120 Ca 0.63 2.29 -0.23 0.00 -1.03 0.00 0.00 54.13 55.79 1isf s LEU 120 Cb -0.15 -3.69 0.06 0.00 0.03 0.00 0.00 46.19 42.44 1isf s LEU 120 CO 0.54 -0.23 0.90 -0.62 0.23 0.00 0.00 176.35 177.18 1isf s ASP 121 N -0.91 6.25 0.00 2.29 -1.08 -0.74 -4.65 116.67 117.83 1isf s ASP 121 Ca 0.46 -0.73 0.27 0.00 -0.52 0.00 0.00 52.55 52.04 1isf s ASP 121 Cb -0.32 -2.41 0.86 0.00 -1.46 0.00 0.00 42.92 39.60 1isf s ASP 121 CO 0.41 -1.27 1.63 -1.22 0.52 0.00 0.00 175.17 175.24 1isf n TYR 122 N 7.37 0.00 0.08 -5.34 4.02 -1.26 -1.74 117.16 120.28 1isf n TYR 122 Ca -0.02 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.81 1isf n TYR 122 Cb 0.46 -0.12 -0.03 0.00 -0.02 0.00 0.00 39.34 39.62 1isf n TYR 122 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1isf h GLN 123 N 1.17 -0.29 -2.94 -0.72 5.75 -1.91 -3.38 115.11 112.79 1isf h GLN 123 Ca 0.00 0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.54 1isf h GLN 123 Cb 0.48 0.07 -0.10 0.00 1.07 0.00 0.00 27.48 28.99 1isf h GLN 123 CO 0.00 -0.12 0.24 -1.54 -2.65 0.00 0.00 178.83 174.76 1isf s SER 124 N -5.25 -0.47 0.02 -0.69 1.04 -1.26 -3.70 113.70 103.40 1isf s SER 124 Ca -0.06 -0.17 0.04 0.00 0.48 0.00 0.00 55.95 56.24 1isf s SER 124 Cb 0.00 0.62 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 1isf s SER 124 CO 0.20 -1.04 -0.13 0.00 0.98 0.00 0.00 173.24 173.25 1isf n PRO 126 N 2.22 2.06 -2.96 0.00 -0.04 -1.26 -2.42 135.00 132.61 1isf n PRO 126 Ca -0.17 0.73 -0.18 0.00 -0.04 0.00 0.00 63.50 63.84 1isf n PRO 126 Cb 0.55 -2.32 0.02 0.00 -0.04 0.00 0.00 33.50 31.71 1isf n PRO 126 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1isf s THR 127 N -0.80 3.07 0.42 0.52 -1.32 -1.26 -4.85 115.64 111.41 1isf s THR 127 Ca 0.59 -0.90 0.18 0.00 -1.21 0.00 0.00 61.69 60.35 1isf s THR 127 Cb -0.60 -3.06 0.38 0.00 -1.51 0.00 0.00 72.50 67.71 1isf s THR 127 CO 0.59 -0.03 1.86 -1.28 -2.21 0.00 0.00 174.62 173.55 1isf h SER 128 N 0.51 0.39 -0.18 8.08 0.87 -1.91 -0.18 113.55 121.15 1isf h SER 128 Ca -0.41 0.04 -0.21 0.00 -1.23 0.00 0.00 61.79 59.98 1isf h SER 128 Cb 1.28 -0.03 0.01 0.00 -0.44 0.00 0.00 62.40 63.21 1isf h SER 128 CO 0.48 0.16 -0.71 -0.33 -0.53 0.00 0.00 176.83 175.91 1isf h GLU 129 N 0.40 0.79 -0.60 2.24 5.08 -1.96 -3.05 114.58 117.47 1isf h GLU 129 Ca 0.46 -0.62 0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1isf h GLU 129 Cb 1.14 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.48 1isf h GLU 129 CO -0.17 1.23 0.40 -0.44 -1.00 0.00 0.00 179.01 179.03 1isf h ASP 130 N 0.53 0.60 0.00 1.42 3.32 -1.42 -3.44 116.42 117.43 1isf h ASP 130 Ca -0.04 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1isf h ASP 130 Cb 1.34 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1isf h ASP 130 CO 0.15 0.41 0.00 0.00 -1.72 0.00 0.00 179.24 178.08 1isf h GLU 132 N 0.00 0.38 -2.57 0.00 4.81 -1.80 -3.36 114.58 112.05 1isf h GLU 132 Ca 0.00 -0.06 -0.72 0.00 -0.13 0.00 0.00 59.36 58.45 1isf h GLU 132 Cb 0.00 -0.06 -0.13 0.00 0.63 0.00 0.00 28.75 29.19 1isf h GLU 132 CO 0.00 0.40 2.27 0.09 -0.73 0.00 0.00 179.01 181.03 1isf n ASN 133 N -4.79 7.94 -4.93 1.04 3.02 -1.26 -4.71 115.26 111.56 1isf n ASN 133 Ca -0.03 -3.14 -0.25 0.00 -0.03 0.00 0.00 54.58 51.13 1isf n ASN 133 Cb 0.12 -1.35 0.00 0.00 -0.61 0.00 0.00 39.78 37.93 1isf n ASN 133 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1isf s ASN 134 N 0.39 6.10 0.19 6.41 2.20 -1.25 -1.09 114.94 127.88 1isf s ASN 134 Ca 0.55 0.55 -0.12 0.00 -0.94 0.00 0.00 52.86 52.90 1isf s ASN 134 Cb 0.20 -1.92 0.20 0.00 -2.00 0.00 0.00 41.25 37.73 1isf s ASN 134 CO -0.10 -0.55 1.76 -0.65 -2.94 0.00 0.00 177.10 174.62 1isf h PRO 135 N 0.44 0.40 -0.31 3.55 0.11 -1.83 -2.54 132.00 131.82 1isf h PRO 135 Ca -0.48 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 65.55 1isf h PRO 135 Cb 1.23 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1isf h PRO 135 CO 0.60 0.26 -0.05 0.28 -0.21 0.00 0.00 178.00 178.88 1isf h VAL 136 N 0.41 1.27 -0.18 3.15 2.07 -1.92 -1.72 116.25 119.33 1isf h VAL 136 Ca 0.26 -1.07 -0.06 0.00 0.82 0.00 0.00 66.70 66.65 1isf h VAL 136 Cb 0.27 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1isf h VAL 136 CO -0.24 0.35 -0.10 0.44 0.02 0.00 0.00 177.57 178.03 1isf h ASP 137 N 0.37 0.41 0.15 0.57 3.32 -1.90 -2.46 116.42 116.88 1isf h ASP 137 Ca 0.08 -0.43 -0.02 0.00 0.02 0.00 0.00 57.03 56.68 1isf h ASP 137 Cb 0.53 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 1isf h ASP 137 CO 0.03 0.74 -0.10 0.28 -1.72 0.00 0.00 179.24 178.47 1isf h SER 138 N 0.07 0.00 0.24 6.45 0.02 -1.51 -1.33 113.55 117.50 1isf h SER 138 Ca 0.04 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1isf h SER 138 Cb 0.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1isf h SER 138 CO 0.03 0.10 -0.12 0.15 -1.14 0.00 0.00 176.83 175.85 1isf h PHE 139 N 0.00 -0.30 -0.02 3.45 3.57 -1.09 -2.65 116.94 119.89 1isf h PHE 139 Ca -0.00 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 1isf h PHE 139 Cb 0.20 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1isf h PHE 139 CO 0.00 0.03 -0.21 -1.49 -2.23 0.00 0.00 178.31 174.41 1isf h TRP 140 N -0.67 0.04 -0.04 0.41 4.06 -1.05 -0.02 115.95 118.69 1isf h TRP 140 Ca -0.03 -0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.91 1isf h TRP 140 Cb 0.47 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 28.62 1isf h TRP 140 CO 0.03 0.25 0.01 0.87 -3.56 0.00 0.00 178.44 176.04 1isf h LYS 141 N 0.04 0.06 -0.67 0.49 1.57 -1.24 0.73 116.57 117.54 1isf h LYS 141 Ca 0.01 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 1isf h LYS 141 Cb 0.40 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 1isf h LYS 141 CO 0.03 0.24 0.13 -0.09 -0.57 0.00 0.00 179.45 179.18 1isf h ARG 142 N -0.14 1.10 -0.20 3.15 9.65 -1.07 -0.86 114.38 126.00 1isf h ARG 142 Ca 0.01 -0.28 -0.21 0.00 -1.10 0.00 0.00 59.98 58.40 1isf h ARG 142 Cb 0.21 -0.14 0.01 0.00 -1.39 0.00 0.00 29.97 28.66 1isf h ARG 142 CO -0.00 0.99 -0.69 0.00 2.80 0.00 0.00 179.97 183.07 1isf h ALA 143 N 1.09 0.38 -0.69 2.80 0.00 -0.89 -2.66 119.26 119.29 1isf h ALA 143 Ca 0.21 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.50 1isf h ALA 143 Cb 0.42 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1isf h ALA 143 CO 0.01 0.68 0.22 0.77 0.00 0.00 0.00 179.25 180.94 1isf h SER 144 N 0.59 0.97 -0.17 0.00 0.02 0.64 -1.41 113.55 114.20 1isf h SER 144 Ca -0.03 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 1isf h SER 144 Cb 1.31 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 1isf h SER 144 CO 0.15 0.90 0.05 0.40 -1.14 0.00 0.00 176.83 177.19 1isf h ILE 145 N 1.01 1.18 -0.68 3.27 2.04 -1.12 -2.21 117.51 121.01 1isf h ILE 145 Ca 0.22 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 1isf h ILE 145 Cb 0.27 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 1isf h ILE 145 CO -0.01 0.18 0.33 -0.61 0.00 0.00 0.00 178.15 178.04 1isf h GLN 146 N 0.09 0.97 -0.39 2.37 5.75 -1.31 -1.70 115.11 120.90 1isf h GLN 146 Ca 0.05 -0.14 0.03 0.00 -0.15 0.00 0.00 58.65 58.44 1isf h GLN 146 Cb 0.23 -0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.57 1isf h GLN 146 CO -0.00 0.76 0.20 -0.92 -2.65 0.00 0.00 178.83 176.22 1isf h TYR 147 N 0.94 0.38 -0.08 3.99 3.20 -1.16 -1.61 116.97 122.63 1isf h TYR 147 Ca 0.23 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.12 1isf h TYR 147 Cb 0.10 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 1isf h TYR 147 CO 0.00 0.21 0.03 0.77 -1.64 0.00 0.00 178.16 177.53 1isf h SER 148 N 0.41 0.10 -0.89 -2.11 0.02 -1.14 -2.79 113.55 107.16 1isf h SER 148 Ca 0.16 -0.14 0.11 0.00 -0.84 0.00 0.00 61.79 61.08 1isf h SER 148 Cb 0.05 -0.03 -0.07 0.00 0.14 0.00 0.00 62.40 62.50 1isf h SER 148 CO -0.10 0.21 0.57 0.11 -1.14 0.00 0.00 176.83 176.48 1isf h LYS 149 N -0.01 0.81 -0.34 3.45 1.57 -1.05 -1.99 116.57 119.01 1isf h LYS 149 Ca 0.03 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1isf h LYS 149 Cb 0.14 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1isf h LYS 149 CO -0.00 0.54 0.00 -0.25 -0.57 0.00 0.00 179.45 179.16 1isf n ASP 150 N -4.54 2.21 -4.84 0.86 8.00 -0.63 -4.69 116.55 112.93 1isf n ASP 150 Ca 0.16 -1.90 -0.36 0.00 0.71 0.00 0.00 54.79 53.40 1isf n ASP 150 Cb 0.35 -0.22 -0.06 0.00 -0.02 0.00 0.00 41.12 41.17 1isf n ASP 150 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1isf s SER 151 N -1.25 6.85 0.26 -2.24 0.01 -0.75 -4.36 113.70 112.22 1isf s SER 151 Ca 0.31 1.08 -0.10 0.00 1.31 0.00 0.00 55.95 58.56 1isf s SER 151 Cb 0.17 -2.29 -0.01 0.00 0.21 0.00 0.00 66.02 64.10 1isf s SER 151 CO 0.23 0.15 0.43 -0.94 0.41 0.00 0.00 173.24 173.53 1isf s SER 152 N -1.57 0.09 0.19 2.44 1.04 -1.26 -4.66 113.70 109.96 1isf s SER 152 Ca 0.35 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.70 1isf s SER 152 Cb -0.16 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.53 1isf s SER 152 CO 0.19 -1.13 0.00 0.61 0.98 0.00 0.00 173.24 173.89 1isf n GLY 153 N -0.39 0.58 3.65 7.32 0.00 -0.46 -1.34 105.19 114.54 1isf n GLY 153 Ca -0.01 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1isf n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1isf s VAL 154 N 0.00 4.56 -0.26 1.61 1.01 -1.26 -1.76 120.40 124.29 1isf s VAL 154 Ca 0.00 1.84 -0.20 0.00 0.00 0.00 0.00 61.98 63.61 1isf s VAL 154 Cb 0.00 -4.36 -0.02 0.00 0.00 0.00 0.00 36.38 32.00 1isf s VAL 154 CO 0.00 -0.35 0.63 -0.63 0.00 0.00 0.00 175.10 174.75 1isf s ILE 155 N 3.49 4.97 -0.05 2.22 -1.09 -0.48 -4.25 121.20 126.01 1isf s ILE 155 Ca 0.45 1.10 -0.02 0.00 -2.23 0.00 0.00 60.65 59.96 1isf s ILE 155 Cb -0.14 -3.95 -0.04 0.00 -1.58 0.00 0.00 42.46 36.76 1isf s ILE 155 CO 0.12 0.00 0.05 -1.00 -1.23 0.00 0.00 174.94 172.88 1isf s HIS 156 N 2.53 3.27 -0.04 3.97 3.76 -1.04 -0.65 115.29 127.08 1isf s HIS 156 Ca 0.26 0.24 0.00 0.00 -0.15 0.00 0.00 55.06 55.41 1isf s HIS 156 Cb -0.15 -1.78 0.03 0.00 1.11 0.00 0.00 32.58 31.78 1isf s HIS 156 CO 0.09 0.54 -0.01 0.08 -0.85 0.00 0.00 174.74 174.59 1isf s VAL 157 N -1.04 0.34 -0.25 -0.90 1.01 -0.52 -0.02 120.40 119.02 1isf s VAL 157 Ca 0.18 0.03 -0.05 0.00 0.00 0.00 0.00 61.98 62.13 1isf s VAL 157 Cb -0.12 -0.43 -0.00 0.00 0.00 0.00 0.00 36.38 35.83 1isf s VAL 157 CO 0.08 0.20 0.02 -0.32 0.00 0.00 0.00 175.10 175.08 1isf s MET 158 N 1.20 3.30 0.23 2.72 1.75 -0.16 0.20 119.30 128.54 1isf s MET 158 Ca -0.07 -0.70 0.10 0.00 -1.25 0.00 0.00 55.69 53.77 1isf s MET 158 Cb -0.14 -3.20 -0.04 0.00 2.84 0.00 0.00 34.83 34.29 1isf s MET 158 CO -0.02 -0.29 -0.11 -0.51 -0.65 0.00 0.00 175.02 173.44 1isf s LEU 159 N 1.50 2.88 -0.37 4.11 1.43 -0.13 -2.47 118.68 125.64 1isf s LEU 159 Ca 0.04 -0.73 -0.15 0.00 -1.03 0.00 0.00 54.13 52.26 1isf s LEU 159 Cb -0.16 -1.49 -0.00 0.00 0.03 0.00 0.00 46.19 44.57 1isf s LEU 159 CO 0.00 0.06 0.36 0.21 0.23 0.00 0.00 176.35 177.21 1isf s ASN 160 N -3.20 6.16 0.00 2.29 3.84 -1.22 -1.05 114.94 121.76 1isf s ASN 160 Ca 0.27 -0.43 0.19 0.00 0.21 0.00 0.00 52.86 53.11 1isf s ASN 160 Cb -0.07 -2.19 0.95 0.00 -0.55 0.00 0.00 41.25 39.38 1isf s ASN 160 CO 0.16 -0.40 1.64 0.61 -2.79 0.00 0.00 177.10 176.32 1isf n GLY 161 N 5.03 -0.48 0.25 1.21 0.00 0.43 -3.23 105.19 108.39 1isf n GLY 161 Ca -0.09 -0.24 0.05 0.00 0.00 0.00 0.00 46.02 45.74 1isf n GLY 161 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1isf n SER 162 N -0.34 1.29 -4.69 1.61 7.64 -1.25 -1.48 113.62 116.41 1isf n SER 162 Ca 0.15 -1.15 -0.42 0.00 1.01 0.00 0.00 58.87 58.46 1isf n SER 162 Cb 0.17 0.39 -0.03 0.00 -1.01 0.00 0.00 64.21 63.74 1isf n SER 162 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1isf s GLU 163 N -1.25 4.21 0.62 1.43 2.56 -1.20 -4.76 118.70 120.31 1isf s GLU 163 Ca 0.09 2.29 0.33 0.00 0.00 0.00 0.00 54.97 57.68 1isf s GLU 163 Cb 0.08 -3.52 1.89 0.00 2.00 0.00 0.00 34.13 34.57 1isf s GLU 163 CO 0.22 -0.69 2.19 -1.35 -0.56 0.00 0.00 175.26 175.07 1isf h PRO 164 N 8.02 0.00 -0.64 4.30 0.11 -1.93 -1.63 132.00 140.22 1isf h PRO 164 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1isf h PRO 164 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1isf h PRO 164 CO 0.92 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.96 1isf n THR 165 N -3.53 1.14 0.00 -1.15 -2.24 -1.26 -5.04 114.28 102.20 1isf n THR 165 Ca -0.01 -0.92 0.00 0.00 -2.27 0.00 0.00 64.05 60.85 1isf n THR 165 Cb 0.21 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1isf n THR 165 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1isf n GLY 166 N 1.34 0.78 0.24 3.38 0.00 -0.61 -4.73 105.19 105.58 1isf n GLY 166 Ca 0.22 -1.79 0.12 0.00 0.00 0.00 0.00 46.02 44.57 1isf n GLY 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1isf h ALA 167 N 0.00 1.00 -3.61 4.61 0.00 -1.80 -3.42 119.26 116.03 1isf h ALA 167 Ca 0.00 -0.13 -0.62 0.00 0.00 0.00 0.00 54.91 54.15 1isf h ALA 167 Cb 0.00 -0.02 -0.39 0.00 0.00 0.00 0.00 17.79 17.38 1isf h ALA 167 CO 0.00 0.18 -0.77 -0.47 0.00 0.00 0.00 179.25 178.19 1isf s TYR 168 N -3.58 2.71 -0.49 0.00 5.04 -1.26 -4.41 117.35 115.36 1isf s TYR 168 Ca 0.01 -2.10 -0.29 0.00 -2.44 0.00 0.00 57.07 52.26 1isf s TYR 168 Cb 0.09 -1.94 0.03 0.00 0.35 0.00 0.00 41.96 40.49 1isf s TYR 168 CO 0.62 -0.84 1.12 -2.14 -1.34 0.00 0.00 175.55 172.97 1isf s PRO 169 N 1.28 3.68 0.42 4.97 0.02 -1.26 -4.89 135.00 139.23 1isf s PRO 169 Ca -0.00 0.48 0.20 0.00 0.02 0.00 0.00 61.00 61.70 1isf s PRO 169 Cb -0.19 -3.92 1.10 0.00 0.02 0.00 0.00 34.50 31.51 1isf s PRO 169 CO -0.09 -1.41 1.57 -0.84 -0.33 0.00 0.00 177.00 175.90 1isf h ILE 170 N 6.21 0.00 -0.08 2.83 -0.00 -1.98 -1.10 117.51 123.40 1isf h ILE 170 Ca -0.23 0.00 -0.02 0.00 -0.00 0.00 0.00 64.86 64.60 1isf h ILE 170 Cb 1.06 0.45 -0.01 0.00 -0.00 0.00 0.00 36.82 38.32 1isf h ILE 170 CO 1.13 0.00 -0.18 0.29 -0.00 0.00 0.00 178.15 179.39 1isf n LYS 171 N -2.34 1.65 -2.07 0.16 4.76 -1.26 -4.65 118.16 114.41 1isf n LYS 171 Ca -0.01 -2.93 -0.25 0.00 -2.87 0.00 0.00 58.31 52.24 1isf n LYS 171 Cb 0.27 -1.62 0.16 0.00 -1.84 0.00 0.00 35.03 32.00 1isf n LYS 171 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1isf n GLY 172 N -1.18 -0.55 0.31 0.72 0.00 -0.42 -4.83 105.19 99.24 1isf n GLY 172 Ca 0.20 -1.85 -0.07 0.00 0.00 0.00 0.00 46.02 44.30 1isf n GLY 172 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1isf h PHE 173 N -1.23 1.08 -0.93 1.61 -1.00 -1.95 -1.10 116.94 113.41 1isf h PHE 173 Ca -0.36 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 60.25 1isf h PHE 173 Cb 1.13 -0.29 -0.04 0.00 3.61 0.00 0.00 35.95 40.35 1isf h PHE 173 CO 0.00 0.94 0.54 0.35 -1.61 0.00 0.00 178.31 178.53 1isf h PHE 174 N 0.94 1.25 0.02 -0.55 3.57 -1.92 0.26 116.94 120.50 1isf h PHE 174 Ca 0.18 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 1isf h PHE 174 Cb 0.48 -0.41 0.01 0.00 2.79 0.00 0.00 35.95 38.82 1isf h PHE 174 CO 0.03 0.84 -0.28 0.00 -2.23 0.00 0.00 178.31 176.67 1isf h ALA 175 N 1.30 0.01 0.00 2.41 0.00 -1.77 0.94 119.26 122.16 1isf h ALA 175 Ca 0.33 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1isf h ALA 175 Cb -0.03 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1isf h ALA 175 CO -0.06 0.11 -0.88 -0.44 0.00 0.00 0.00 179.25 177.98 1isf h ASP 176 N -0.57 0.00 0.00 0.00 3.32 -1.20 -3.39 116.42 114.57 1isf h ASP 176 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1isf h ASP 176 Cb 1.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1isf h ASP 176 CO 0.05 0.04 -0.49 -1.22 -1.72 0.00 0.00 179.24 175.91 1isf n TYR 177 N -2.76 0.00 -0.08 4.55 4.02 0.83 -4.80 117.16 118.92 1isf n TYR 177 Ca 0.00 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.71 1isf n TYR 177 Cb 0.57 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.83 1isf n TYR 177 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1isf n GLU 178 N -1.04 0.37 -0.19 -0.72 1.02 -0.74 -4.13 120.64 115.21 1isf n GLU 178 Ca 0.00 0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1isf n GLU 178 Cb 0.00 -1.12 0.10 0.00 -0.02 0.00 0.00 31.44 30.40 1isf n GLU 178 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1isf h ILE 179 N -0.63 0.60 0.00 -3.67 2.04 -1.00 -0.27 117.51 114.58 1isf h ILE 179 Ca -0.41 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.38 1isf h ILE 179 Cb 1.33 0.39 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 1isf h ILE 179 CO -0.25 0.04 0.00 -2.65 0.00 0.00 0.00 178.15 175.29 1isf n PRO 180 N -5.18 0.07 -0.11 2.37 -0.02 -1.26 -2.68 135.00 128.18 1isf n PRO 180 Ca 0.08 0.38 0.06 0.00 -2.02 0.00 0.00 63.50 62.01 1isf n PRO 180 Cb 0.32 -1.65 0.12 0.00 -0.02 0.00 0.00 33.50 32.28 1isf n PRO 180 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1isf n ASN 181 N -1.77 2.63 -4.74 2.55 3.02 -0.13 -4.98 115.26 111.84 1isf n ASN 181 Ca 0.02 -1.80 -0.41 0.00 -0.03 0.00 0.00 54.58 52.36 1isf n ASN 181 Cb 0.14 -0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.13 1isf n ASN 181 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1isf s LEU 182 N -1.04 4.42 -0.97 3.41 1.43 -1.07 -3.35 118.68 121.52 1isf s LEU 182 Ca 0.22 2.31 -0.21 0.00 -1.03 0.00 0.00 54.13 55.42 1isf s LEU 182 Cb 0.13 -3.61 0.09 0.00 0.03 0.00 0.00 46.19 42.83 1isf s LEU 182 CO 0.17 -0.47 1.28 -1.10 0.23 0.00 0.00 176.35 176.46 1isf s GLN 183 N -0.05 3.59 0.47 1.70 -1.52 -1.26 -4.84 119.66 117.76 1isf s GLN 183 Ca 0.56 -1.45 0.25 0.00 -1.95 0.00 0.00 55.36 52.76 1isf s GLN 183 Cb -0.34 -5.12 1.28 0.00 -0.22 0.00 0.00 33.01 28.60 1isf s GLN 183 CO 0.37 -1.98 1.84 -0.22 -0.25 0.00 0.00 175.29 175.05 1isf h LYS 184 N 9.29 0.22 -0.45 2.91 3.64 -1.91 0.22 116.57 130.48 1isf h LYS 184 Ca 0.17 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.57 1isf h LYS 184 Cb 1.02 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1isf h LYS 184 CO 1.26 0.14 0.30 1.05 -2.27 0.00 0.00 179.45 179.93 1isf h GLU 185 N 0.22 0.50 -0.26 1.90 9.09 -2.01 -2.81 114.58 121.20 1isf h GLU 185 Ca 0.49 -0.03 -0.13 0.00 0.05 0.00 0.00 59.36 59.74 1isf h GLU 185 Cb 1.55 -0.11 -0.08 0.00 -1.65 0.00 0.00 28.75 28.46 1isf h GLU 185 CO -0.13 0.33 -0.17 0.36 0.05 0.00 0.00 179.01 179.45 1isf n LYS 186 N -4.48 1.81 -4.12 1.06 2.85 0.75 -4.95 118.16 111.09 1isf n LYS 186 Ca 0.05 -3.19 -0.33 0.00 -1.05 0.00 0.00 58.31 53.79 1isf n LYS 186 Cb 0.14 -1.77 -0.16 0.00 -0.65 0.00 0.00 35.03 32.59 1isf n LYS 186 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1isf s ILE 187 N -3.22 1.99 -0.04 0.58 1.01 -1.06 -1.36 121.20 119.09 1isf s ILE 187 Ca 0.43 -0.90 -0.15 0.00 0.00 0.00 0.00 60.65 60.03 1isf s ILE 187 Cb 0.39 -1.80 -0.09 0.00 0.01 0.00 0.00 42.46 40.98 1isf s ILE 187 CO -0.01 0.53 0.61 0.71 0.00 0.00 0.00 174.94 176.78 1isf h THR 188 N 5.95 0.08 -3.26 2.92 1.35 -1.65 -3.47 112.91 114.83 1isf h THR 188 Ca -0.45 -0.67 -0.05 0.00 -0.55 0.00 0.00 66.41 64.69 1isf h THR 188 Cb 1.14 0.13 -0.13 0.00 -1.73 0.00 0.00 68.15 67.56 1isf h THR 188 CO 0.62 0.02 -0.02 0.00 -0.25 0.00 0.00 175.52 175.89 1isf s ARG 189 N -3.23 1.09 -0.17 4.72 1.70 -1.25 -4.41 118.95 117.40 1isf s ARG 189 Ca -0.08 -0.61 -0.02 0.00 -0.47 0.00 0.00 55.73 54.55 1isf s ARG 189 Cb 0.01 0.49 -0.02 0.00 -0.57 0.00 0.00 34.95 34.86 1isf s ARG 189 CO 0.25 -0.43 -0.08 0.42 -1.08 0.00 0.00 175.30 174.38 1isf s ILE 190 N -3.61 3.34 -0.13 4.99 1.01 0.05 -1.38 121.20 125.46 1isf s ILE 190 Ca 0.01 -0.54 0.02 0.00 0.00 0.00 0.00 60.65 60.14 1isf s ILE 190 Cb 0.01 -2.46 -0.00 0.00 0.01 0.00 0.00 42.46 40.02 1isf s ILE 190 CO -0.11 0.48 -0.19 -0.70 0.00 0.00 0.00 174.94 174.43 1isf s GLU 191 N 0.74 3.15 -0.09 2.79 2.12 0.17 -2.05 118.70 125.54 1isf s GLU 191 Ca -0.04 -0.80 -0.03 0.00 0.36 0.00 0.00 54.97 54.47 1isf s GLU 191 Cb -0.15 -2.50 -0.03 0.00 0.26 0.00 0.00 34.13 31.71 1isf s GLU 191 CO 0.02 0.08 0.03 0.42 -0.54 0.00 0.00 175.26 175.28 1isf s ILE 192 N 0.61 4.58 -0.27 -3.70 -1.09 -0.31 -1.43 121.20 119.60 1isf s ILE 192 Ca -0.10 -0.16 0.00 0.00 -2.23 0.00 0.00 60.65 58.15 1isf s ILE 192 Cb -0.16 -2.95 0.05 0.00 -1.58 0.00 0.00 42.46 37.81 1isf s ILE 192 CO 0.03 0.59 -0.06 0.26 -1.23 0.00 0.00 174.94 174.53 1isf s TRP 193 N -0.93 3.20 -0.53 3.97 0.51 0.13 -0.34 118.94 124.94 1isf s TRP 193 Ca 0.14 -1.96 -0.16 0.00 -2.12 0.00 0.00 56.10 52.00 1isf s TRP 193 Cb -0.11 -2.02 0.11 0.00 -0.81 0.00 0.00 33.47 30.63 1isf s TRP 193 CO 0.03 -0.82 0.50 0.08 -0.51 0.00 0.00 176.95 176.24 1isf s VAL 194 N 1.22 5.16 0.14 4.03 1.01 -0.02 -0.95 120.40 130.98 1isf s VAL 194 Ca -0.05 -1.29 -0.14 0.00 0.00 0.00 0.00 61.98 60.50 1isf s VAL 194 Cb -0.19 -4.30 -0.07 0.00 0.00 0.00 0.00 36.38 31.82 1isf s VAL 194 CO -0.04 -0.82 0.54 -0.04 0.00 0.00 0.00 175.10 174.74 1isf s MET 195 N 1.78 3.98 0.03 2.72 -1.94 -0.21 -0.84 119.30 124.81 1isf s MET 195 Ca 0.05 0.49 0.08 0.00 -1.71 0.00 0.00 55.69 54.60 1isf s MET 195 Cb -0.27 -2.94 -0.02 0.00 2.01 0.00 0.00 34.83 33.60 1isf s MET 195 CO 0.05 0.49 -0.24 -1.01 -0.01 0.00 0.00 175.02 174.29 1isf s HIS 196 N -1.45 2.13 0.60 -0.03 3.76 -1.26 0.16 115.29 119.20 1isf s HIS 196 Ca 0.37 -0.40 -0.20 0.00 -0.15 0.00 0.00 55.06 54.69 1isf s HIS 196 Cb -0.15 -1.30 -0.03 0.00 1.11 0.00 0.00 32.58 32.20 1isf s HIS 196 CO 0.19 0.07 1.31 -1.21 -0.85 0.00 0.00 174.74 174.25 1isf s GLU 197 N -1.03 2.87 0.07 1.40 0.41 -1.26 -4.87 118.70 116.29 1isf s GLU 197 Ca 0.10 2.09 -0.31 0.00 -0.41 0.00 0.00 54.97 56.45 1isf s GLU 197 Cb -0.09 -2.03 -0.09 0.00 -1.78 0.00 0.00 34.13 30.14 1isf s GLU 197 CO 0.01 -1.36 1.77 0.42 -0.49 0.00 0.00 175.26 175.61 1isf s ILE 198 N -1.39 2.89 0.00 -1.63 -1.09 -1.26 -1.79 121.20 116.93 1isf s ILE 198 Ca 0.77 0.27 0.00 0.00 -2.23 0.00 0.00 60.65 59.46 1isf s ILE 198 Cb -0.38 -3.17 0.00 0.00 -1.58 0.00 0.00 42.46 37.33 1isf s ILE 198 CO 0.42 -0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.73 1isf n GLY 199 N 4.18 0.76 2.30 6.18 0.00 -1.26 -4.91 105.19 112.44 1isf n GLY 199 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 1isf n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1isf n GLY 200 N 0.00 -2.83 3.77 -0.02 0.00 -0.74 -4.85 105.19 100.52 1isf n GLY 200 Ca 0.00 -0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 1isf n GLY 200 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1isf s PRO 201 N -1.54 4.15 -1.04 1.61 0.04 -1.26 -4.61 135.00 132.36 1isf s PRO 201 Ca 0.29 2.51 -0.05 0.00 0.04 0.00 0.00 61.00 63.79 1isf s PRO 201 Cb -0.01 -3.01 0.28 0.00 0.04 0.00 0.00 34.50 31.81 1isf s PRO 201 CO 0.56 -0.52 1.21 -1.71 0.04 0.00 0.00 177.00 176.58 1isf n ASN 202 N 1.19 5.61 -0.20 6.66 5.15 -1.26 -3.98 115.26 128.42 1isf n ASN 202 Ca 0.04 -3.25 -0.09 0.00 -0.60 0.00 0.00 54.58 50.67 1isf n ASN 202 Cb 0.39 -1.23 0.03 0.00 -0.53 0.00 0.00 39.78 38.44 1isf n ASN 202 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1isf h VAL 203 N 3.56 1.27 -2.80 3.44 2.07 -1.56 -3.45 116.25 118.78 1isf h VAL 203 Ca 0.19 -1.18 -0.13 0.00 0.82 0.00 0.00 66.70 66.40 1isf h VAL 203 Cb 0.73 0.83 -0.25 0.00 -1.52 0.00 0.00 31.29 31.08 1isf h VAL 203 CO 1.12 0.43 -0.30 -1.61 0.02 0.00 0.00 177.57 177.23 1isf s GLU 204 N -4.99 0.40 0.36 1.57 2.02 -0.99 -5.00 118.70 112.08 1isf s GLU 204 Ca -0.12 0.59 0.07 0.00 0.02 0.00 0.00 54.97 55.54 1isf s GLU 204 Cb 0.14 0.12 -0.07 0.00 0.10 0.00 0.00 34.13 34.42 1isf s GLU 204 CO 0.86 -0.09 -0.03 -1.12 0.02 0.00 0.00 175.26 174.90 1isf s SER 205 N 0.61 3.48 0.02 -0.19 0.01 -1.26 -4.49 113.70 111.89 1isf s SER 205 Ca -0.03 -1.29 -0.38 0.00 1.31 0.00 0.00 55.95 55.56 1isf s SER 205 Cb -0.05 -0.31 -0.19 0.00 0.21 0.00 0.00 66.02 65.68 1isf s SER 205 CO -0.04 -0.37 0.98 0.00 0.41 0.00 0.00 173.24 174.22 1isf n GLY 207 N 1.53 0.41 3.48 0.00 0.00 -1.26 -5.03 105.19 104.31 1isf n GLY 207 Ca 0.19 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1isf n GLY 207 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1isf s GLU 208 N -0.59 1.74 1.57 1.61 2.02 -0.34 -4.56 118.70 120.16 1isf s GLU 208 Ca 0.00 -1.21 0.00 0.00 0.02 0.00 0.00 54.97 53.78 1isf s GLU 208 Cb 0.00 -2.09 0.00 0.00 0.10 0.00 0.00 34.13 32.14 1isf s GLU 208 CO 0.00 0.47 0.00 0.41 0.02 0.00 0.00 175.26 176.16 1isf n GLY 209 N 0.77 2.51 0.41 -1.39 0.00 -1.26 -1.05 105.19 105.19 1isf n GLY 209 Ca -0.16 -0.07 0.23 0.00 0.00 0.00 0.00 46.02 46.02 1isf n GLY 209 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1isf h SER 210 N 0.47 0.00 0.30 1.61 4.64 -1.94 0.17 113.55 118.80 1isf h SER 210 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1isf h SER 210 Cb 0.00 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1isf h SER 210 CO 0.00 0.00 -0.07 0.24 -0.87 0.00 0.00 176.83 176.13 1isf h MET 211 N 0.00 0.00 -0.15 4.77 2.07 -1.42 -1.02 114.93 119.18 1isf h MET 211 Ca 0.27 0.00 -0.22 0.00 -2.07 0.00 0.00 59.70 57.68 1isf h MET 211 Cb 1.34 0.00 0.01 0.00 -1.87 0.00 0.00 31.60 31.08 1isf h MET 211 CO -0.00 0.07 -0.77 0.87 1.07 0.00 0.00 176.91 178.15 1isf h LYS 212 N 0.00 0.78 -0.26 1.72 1.57 -0.73 -1.65 116.57 117.99 1isf h LYS 212 Ca -0.00 -0.64 -0.01 0.00 -1.87 0.00 0.00 60.65 58.12 1isf h LYS 212 Cb 0.24 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1isf h LYS 212 CO 0.01 1.25 0.12 0.28 -0.57 0.00 0.00 179.45 180.53 1isf h VAL 213 N 0.51 1.16 0.01 0.50 2.07 -1.32 0.92 116.25 120.10 1isf h VAL 213 Ca -0.06 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 1isf h VAL 213 Cb 1.40 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1isf h VAL 213 CO 0.16 0.16 -0.00 0.25 0.02 0.00 0.00 177.57 178.16 1isf h LEU 214 N 0.28 -0.01 -0.68 2.57 5.85 -1.28 -1.71 115.31 120.33 1isf h LEU 214 Ca 0.09 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.72 1isf h LEU 214 Cb 0.15 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.11 1isf h LEU 214 CO -0.01 0.17 0.35 -0.08 -0.34 0.00 0.00 178.44 178.53 1isf h GLU 215 N -0.19 0.59 -0.36 1.25 4.81 -1.17 -0.87 114.58 118.64 1isf h GLU 215 Ca -0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1isf h GLU 215 Cb 0.18 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1isf h GLU 215 CO 0.00 0.39 0.19 -0.22 -0.73 0.00 0.00 179.01 178.63 1isf h LYS 216 N 0.60 0.51 -0.06 1.92 3.64 -0.65 -0.67 116.57 121.88 1isf h LYS 216 Ca 0.33 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 1isf h LYS 216 Cb 0.32 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.04 1isf h LYS 216 CO -0.25 0.44 0.04 -0.09 -2.27 0.00 0.00 179.45 177.32 1isf h ARG 217 N 0.45 0.07 -0.93 1.90 1.12 -0.71 0.16 114.38 116.44 1isf h ARG 217 Ca 0.13 -0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 58.99 1isf h ARG 217 Cb 0.09 -0.02 -0.04 0.00 -0.01 0.00 0.00 29.97 29.99 1isf h ARG 217 CO -0.02 0.05 0.57 -0.07 -3.11 0.00 0.00 179.97 177.40 1isf h LEU 218 N 0.07 1.10 -0.46 3.80 3.38 -1.05 -1.13 115.31 121.03 1isf h LEU 218 Ca 0.02 -0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.76 1isf h LEU 218 Cb -0.00 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.47 1isf h LEU 218 CO -0.00 0.83 -0.57 0.11 0.09 0.00 0.00 178.44 178.89 1isf h LYS 219 N 1.27 0.61 -0.74 1.13 1.57 -0.78 -1.53 116.57 118.09 1isf h LYS 219 Ca 0.33 -0.40 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 1isf h LYS 219 Cb -0.08 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 1isf h LYS 219 CO -0.07 1.01 0.26 -0.44 -0.57 0.00 0.00 179.45 179.64 1isf h ASP 220 N 0.46 1.04 0.16 0.86 3.32 -0.29 -1.27 116.42 120.69 1isf h ASP 220 Ca 0.00 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1isf h ASP 220 Cb 1.13 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.41 1isf h ASP 220 CO 0.11 0.95 0.00 0.23 -1.72 0.00 0.00 179.24 178.81 1isf n MET 221 N -4.27 0.38 -1.95 3.56 2.81 -0.46 -4.86 117.12 112.34 1isf n MET 221 Ca 0.06 0.07 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 1isf n MET 221 Cb 0.21 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.22 1isf n MET 221 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1isf n GLY 222 N 0.09 0.71 3.92 3.03 0.00 -0.48 -5.07 105.19 107.39 1isf n GLY 222 Ca 0.10 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 1isf n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1isf s PHE 223 N -2.34 3.51 0.13 1.61 0.40 -0.59 -5.03 117.98 115.66 1isf s PHE 223 Ca 0.00 0.29 -0.30 0.00 -0.60 0.00 0.00 56.93 56.32 1isf s PHE 223 Cb 0.00 -1.79 -0.06 0.00 0.51 0.00 0.00 43.02 41.68 1isf s PHE 223 CO 0.00 0.55 0.99 -1.14 0.70 0.00 0.00 175.22 176.31 1isf s GLN 224 N -2.65 4.69 0.07 0.44 0.74 -1.26 -4.54 119.66 117.15 1isf s GLN 224 Ca 0.36 1.50 0.06 0.00 0.05 0.00 0.00 55.36 57.33 1isf s GLN 224 Cb -0.13 -3.36 -0.03 0.00 1.10 0.00 0.00 33.01 30.60 1isf s GLN 224 CO 0.28 0.20 -0.17 -0.47 -0.55 0.00 0.00 175.29 174.57 1isf s TYR 225 N -0.09 1.50 0.03 1.67 5.04 -1.26 -0.77 117.35 123.47 1isf s TYR 225 Ca 0.47 -0.41 -0.21 0.00 -2.44 0.00 0.00 57.07 54.49 1isf s TYR 225 Cb -0.24 -0.85 0.05 0.00 0.35 0.00 0.00 41.96 41.26 1isf s TYR 225 CO 0.31 0.10 0.48 -1.54 -1.34 0.00 0.00 175.55 173.56 1isf s SER 226 N -1.54 -0.38 -0.02 4.32 1.04 -0.87 -4.97 113.70 111.27 1isf s SER 226 Ca 0.03 0.16 -0.01 0.00 0.48 0.00 0.00 55.95 56.61 1isf s SER 226 Cb -0.09 0.45 0.02 0.00 0.10 0.00 0.00 66.02 66.50 1isf s SER 226 CO 0.03 -0.66 0.06 0.00 0.98 0.00 0.00 173.24 173.64 1isf s ILE 228 N 0.48 1.14 0.00 0.00 1.01 0.54 -4.94 121.20 119.42 1isf s ILE 228 Ca -0.04 -0.48 -0.25 0.00 0.00 0.00 0.00 60.65 59.89 1isf s ILE 228 Cb -0.05 -1.04 -0.05 0.00 0.01 0.00 0.00 42.46 41.33 1isf s ILE 228 CO -0.02 0.36 0.76 0.20 0.00 0.00 0.00 174.94 176.24 1isf s ASN 229 N 0.69 7.15 -1.19 3.58 0.01 -1.26 -0.84 114.94 123.08 1isf s ASN 229 Ca -0.14 1.38 -0.27 0.00 -0.71 0.00 0.00 52.86 53.11 1isf s ASN 229 Cb -0.16 -2.46 0.02 0.00 0.41 0.00 0.00 41.25 39.06 1isf s ASN 229 CO 0.03 -0.05 0.72 0.47 -1.51 0.00 0.00 177.10 176.77 1isf n ASP 230 N 3.22 -4.57 -4.71 -1.22 8.00 -0.02 -4.75 116.55 112.49 1isf n ASP 230 Ca -0.01 -1.16 -0.59 0.00 0.71 0.00 0.00 54.79 53.74 1isf n ASP 230 Cb 0.51 -2.53 -0.08 0.00 -0.02 0.00 0.00 41.12 39.00 1isf n ASP 230 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1isf n TYR 231 N -4.62 1.94 -0.37 1.24 9.36 -1.26 -4.65 117.16 118.80 1isf n TYR 231 Ca -0.11 0.67 -0.07 0.00 3.32 0.00 0.00 57.90 61.71 1isf n TYR 231 Cb 0.58 -2.40 -0.04 0.00 -0.63 0.00 0.00 39.34 36.85 1isf n TYR 231 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 1isf h ARG 232 N 6.55 -0.04 -0.76 2.98 9.65 -1.98 -1.44 114.38 129.33 1isf h ARG 232 Ca -0.46 0.00 0.16 0.00 -1.10 0.00 0.00 59.98 58.58 1isf h ARG 232 Cb 1.33 0.01 -0.10 0.00 -1.39 0.00 0.00 29.97 29.82 1isf h ARG 232 CO 0.95 -0.03 0.27 -1.35 2.80 0.00 0.00 179.97 182.61 1isf h PRO 233 N -0.04 0.37 -0.17 0.20 0.11 -2.00 0.15 132.00 130.61 1isf h PRO 233 Ca 0.23 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 66.17 1isf h PRO 233 Cb 0.51 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1isf h PRO 233 CO -0.92 0.24 -0.53 0.28 -0.21 0.00 0.00 178.00 176.87 1isf h VAL 234 N 0.38 1.33 -0.64 3.15 2.07 -1.77 -2.70 116.25 118.07 1isf h VAL 234 Ca 0.43 -1.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.17 1isf h VAL 234 Cb 0.71 1.77 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 1isf h VAL 234 CO -0.45 0.55 0.37 0.50 0.02 0.00 0.00 177.57 178.55 1isf h LYS 235 N 0.39 0.87 -0.76 1.57 1.63 0.04 -0.10 116.57 120.21 1isf h LYS 235 Ca 0.01 -0.09 0.02 0.00 -0.85 0.00 0.00 60.65 59.74 1isf h LYS 235 Cb 1.06 -0.18 -0.04 0.00 -0.60 0.00 0.00 32.23 32.47 1isf h LYS 235 CO 0.10 0.64 0.50 -0.07 -3.45 0.00 0.00 179.45 177.17 1isf h LEU 236 N 0.86 0.85 -0.26 5.20 3.38 -0.63 0.19 115.31 124.91 1isf h LEU 236 Ca 0.23 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.10 1isf h LEU 236 Cb 0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1isf h LEU 236 CO -0.04 0.60 -0.16 0.25 0.09 0.00 0.00 178.44 179.18 1isf h LEU 237 N 0.99 0.58 -0.72 1.67 5.85 -1.04 -2.79 115.31 119.86 1isf h LEU 237 Ca 0.29 -0.43 0.05 0.00 0.84 0.00 0.00 57.88 58.63 1isf h LEU 237 Cb -0.05 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.76 1isf h LEU 237 CO -0.07 0.89 0.42 1.56 -0.34 0.00 0.00 178.44 180.90 1isf h GLN 238 N 0.28 0.77 0.00 1.25 4.20 -0.33 -2.18 115.11 119.10 1isf h GLN 238 Ca 0.05 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 1isf h GLN 238 Cb 0.69 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.29 1isf h GLN 238 CO 0.04 0.51 -0.01 0.00 -0.67 0.00 0.00 178.83 178.71 1isf h VAL 240 N 0.00 0.68 -0.69 0.00 2.07 -1.14 0.11 116.25 117.27 1isf h VAL 240 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1isf h VAL 240 Cb 0.04 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1isf h VAL 240 CO 0.00 0.00 0.00 0.47 0.02 0.00 0.00 177.57 178.06 1isf n ASP 241 N -4.34 3.74 -2.74 0.57 8.00 -1.04 -4.22 116.55 116.52 1isf n ASP 241 Ca 0.12 -2.00 -0.04 0.00 0.71 0.00 0.00 54.79 53.58 1isf n ASP 241 Cb 0.72 -0.46 0.07 0.00 -0.02 0.00 0.00 41.12 41.42 1isf n ASP 241 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1isf n HIS 242 N 1.55 0.13 -0.31 1.24 8.25 0.32 -4.96 115.22 121.44 1isf n HIS 242 Ca 0.23 -2.24 0.24 0.00 -0.26 0.00 0.00 57.72 55.69 1isf n HIS 242 Cb 0.59 0.29 0.54 0.00 1.12 0.00 0.00 29.99 32.53 1isf n HIS 242 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1isf h SER 243 N 2.37 0.37 -0.97 0.41 4.64 -1.59 -1.57 113.55 117.21 1isf h SER 243 Ca -0.20 0.06 -0.60 0.00 -0.47 0.00 0.00 61.79 60.58 1isf h SER 243 Cb 1.25 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 63.05 1isf h SER 243 CO 0.18 0.08 0.71 0.35 -0.87 0.00 0.00 176.83 177.29 1isf n THR 244 N -4.54 3.42 -4.64 2.95 -2.24 -1.26 -4.57 114.28 103.40 1isf n THR 244 Ca 0.24 -2.62 -0.33 0.00 -2.27 0.00 0.00 64.05 59.06 1isf n THR 244 Cb 0.90 -0.89 -0.13 0.00 -2.10 0.00 0.00 70.33 68.10 1isf n THR 244 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1isf s HIS 245 N -3.62 2.89 0.56 4.78 5.04 -0.59 -5.01 115.29 119.35 1isf s HIS 245 Ca 0.61 -0.32 0.42 0.00 -1.54 0.00 0.00 55.06 54.23 1isf s HIS 245 Cb 0.49 -1.82 1.56 0.00 0.04 0.00 0.00 32.58 32.86 1isf s HIS 245 CO 0.03 0.02 1.64 -1.00 -2.34 0.00 0.00 174.74 173.10 1isf h PRO 246 N 6.18 0.00 0.00 2.88 0.13 -1.92 0.96 132.00 140.23 1isf h PRO 246 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1isf h PRO 246 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1isf h PRO 246 CO 0.56 0.00 0.00 -0.44 -0.23 0.00 0.00 178.00 177.89 1isf h ASP 247 N 0.00 0.00 -0.02 1.44 3.32 -1.95 -3.24 116.42 115.98 1isf h ASP 247 Ca 0.71 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.76 1isf h ASP 247 Cb 2.99 0.00 0.00 0.00 0.22 0.00 0.00 39.33 42.54 1isf h ASP 247 CO -0.01 0.00 -0.16 0.00 -1.72 0.00 0.00 179.24 177.35 1isf s ALA 249 N -1.78 3.39 0.15 0.00 0.00 -1.00 -4.90 121.76 117.62 1isf s ALA 249 Ca 0.19 1.34 0.03 0.00 0.00 0.00 0.00 51.96 53.51 1isf s ALA 249 Cb 0.15 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 1isf s ALA 249 CO 0.33 -0.86 0.25 -0.51 0.00 0.00 0.00 175.76 174.97 1isf s LEU 250 N -2.21 4.21 0.00 0.00 1.43 -1.26 -5.08 118.68 115.77 1isf s LEU 250 Ca 0.54 0.10 0.21 0.00 -1.03 0.00 0.00 54.13 53.95 1isf s LEU 250 Cb -0.41 -2.79 1.25 0.00 0.03 0.00 0.00 46.19 44.28 1isf s LEU 250 CO 0.54 0.06 1.64 0.29 0.23 0.00 0.00 176.35 179.10