#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 1.83 -2.81 -0.99 3.00 -1.25 -4.67 116.66 111.78 1isf n ARG 3 Ca 0.00 -0.62 -0.21 0.00 -0.01 0.00 0.00 57.85 57.01 1isf n ARG 3 Cb 0.00 -1.24 0.03 0.00 0.00 0.00 0.00 32.46 31.25 1isf n ARG 3 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1isf s ALA 4 N -1.94 3.95 0.32 7.54 0.00 -0.33 -4.95 121.76 126.35 1isf s ALA 4 Ca 0.11 -1.31 -0.29 0.00 0.00 0.00 0.00 51.96 50.48 1isf s ALA 4 Cb 0.12 -2.02 -0.13 0.00 0.00 0.00 0.00 23.12 21.09 1isf s ALA 4 CO 0.43 -0.57 1.32 -1.91 0.00 0.00 0.00 175.76 175.03 1isf n GLU 5 N -2.19 2.12 -1.60 0.00 0.00 -1.26 -2.10 120.64 115.61 1isf n GLU 5 Ca 0.06 0.75 -0.29 0.00 0.00 0.00 0.00 57.16 57.67 1isf n GLU 5 Cb 0.59 -2.35 0.14 0.00 0.00 0.00 0.00 31.44 29.83 1isf n GLU 5 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1isf s GLY 6 N -0.15 1.60 0.28 8.31 0.00 -1.26 -3.36 107.32 112.74 1isf s GLY 6 Ca 0.58 -0.66 -0.30 0.00 0.00 0.00 0.00 44.72 44.34 1isf s GLY 6 CO 0.59 -0.06 1.42 -0.37 0.00 0.00 0.00 173.10 174.68 1isf n THR 7 N -3.78 1.22 -1.68 0.90 5.66 -0.81 -4.64 114.28 111.14 1isf n THR 7 Ca 0.08 -0.30 -0.45 0.00 -3.05 0.00 0.00 64.05 60.33 1isf n THR 7 Cb 0.60 -1.61 -0.03 0.00 -1.55 0.00 0.00 70.33 67.74 1isf n THR 7 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1isf n SER 8 N 1.82 3.12 -4.75 1.09 7.64 -0.32 -4.67 113.62 117.55 1isf n SER 8 Ca 0.09 1.11 -0.41 0.00 1.01 0.00 0.00 58.87 60.67 1isf n SER 8 Cb 0.34 -1.45 -0.02 0.00 -1.01 0.00 0.00 64.21 62.06 1isf n SER 8 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1isf s ALA 9 N 0.53 3.61 -1.23 -0.43 0.00 -1.26 -2.46 121.76 120.52 1isf s ALA 9 Ca 0.74 1.32 -0.02 0.00 0.00 0.00 0.00 51.96 54.00 1isf s ALA 9 Cb -0.64 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 18.93 1isf s ALA 9 CO 0.42 -0.74 0.29 0.72 0.00 0.00 0.00 175.76 176.46 1isf n HIS 10 N 2.20 -1.21 -0.29 0.00 8.25 -1.26 -4.91 115.22 118.00 1isf n HIS 10 Ca 0.06 0.25 0.11 0.00 -0.26 0.00 0.00 57.72 57.88 1isf n HIS 10 Cb 0.40 -3.49 0.28 0.00 1.12 0.00 0.00 29.99 28.30 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 -0.66 0.23 -0.26 2.41 5.85 -1.87 -1.84 115.31 119.17 1isf h LEU 11 Ca -0.39 0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.45 1isf h LEU 11 Cb 1.28 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.45 1isf h LEU 11 CO 0.43 -0.02 0.02 -0.09 -0.34 0.00 0.00 178.44 178.45 1isf h ARG 12 N 0.36 0.45 -0.51 1.25 2.43 -1.91 -1.49 114.38 114.96 1isf h ARG 12 Ca 0.53 -0.13 -0.03 0.00 -0.81 0.00 0.00 59.98 59.54 1isf h ARG 12 Cb 0.98 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.46 1isf h ARG 12 CO -0.53 0.59 0.22 -0.44 -1.51 0.00 0.00 179.97 178.30 1isf h ASP 13 N 0.25 0.69 -0.21 -3.80 3.32 -1.79 -1.04 116.42 113.84 1isf h ASP 13 Ca 0.08 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1isf h ASP 13 Cb 0.37 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1isf h ASP 13 CO 0.01 0.65 0.13 0.40 -1.72 0.00 0.00 179.24 178.72 1isf h ILE 14 N 0.68 1.04 0.29 0.35 2.04 -1.33 -0.49 117.51 120.09 1isf h ILE 14 Ca 0.17 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.94 1isf h ILE 14 Cb 0.17 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 1isf h ILE 14 CO -0.02 0.05 -0.39 0.15 0.00 0.00 0.00 178.15 177.95 1isf h PHE 15 N 0.27 -1.06 -0.42 1.37 3.57 -1.06 0.61 116.94 120.22 1isf h PHE 15 Ca 0.08 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 1isf h PHE 15 Cb -0.02 0.43 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 1isf h PHE 15 CO -0.07 -0.52 0.18 -0.07 -2.23 0.00 0.00 178.31 175.60 1isf h LEU 16 N -0.73 0.53 -0.17 0.59 3.38 -1.12 -0.28 115.31 117.51 1isf h LEU 16 Ca -0.01 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.84 1isf h LEU 16 Cb 0.69 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 1isf h LEU 16 CO -0.12 0.48 -0.15 1.23 0.09 0.00 0.00 178.44 179.96 1isf h GLY 17 N 0.73 0.44 1.02 0.83 0.00 -0.75 0.72 103.07 106.05 1isf h GLY 17 Ca 0.15 -0.44 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 1isf h GLY 17 CO -0.02 0.40 0.28 3.21 0.00 0.00 0.00 176.54 180.42 1isf h ARG 18 N 0.05 1.01 -0.27 4.80 3.08 -0.62 -0.83 114.38 121.61 1isf h ARG 18 Ca 0.03 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 1isf h ARG 18 Cb 0.68 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1isf h ARG 18 CO 0.04 0.83 0.15 0.00 -1.07 0.00 0.00 179.97 179.93 1isf h ALA 20 N 1.04 0.60 -0.62 0.00 0.00 -0.60 -2.26 119.26 117.42 1isf h ALA 20 Ca 0.10 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1isf h ALA 20 Cb 0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1isf h ALA 20 CO -0.02 0.18 0.25 0.93 0.00 0.00 0.00 179.25 180.59 1isf h GLU 21 N 0.61 0.93 -0.02 0.00 5.08 -0.92 -2.65 114.58 117.61 1isf h GLU 21 Ca 0.16 -0.17 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 1isf h GLU 21 Cb 0.15 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.24 1isf h GLU 21 CO -0.02 0.79 -0.12 -0.92 -1.00 0.00 0.00 179.01 177.73 1isf h TYR 22 N 0.87 0.03 -0.88 4.33 3.20 -0.84 -2.66 116.97 121.02 1isf h TYR 22 Ca 0.21 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.27 1isf h TYR 22 Cb 0.20 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.40 1isf h TYR 22 CO 0.01 0.15 0.58 0.00 -1.64 0.00 0.00 178.16 177.26 1isf h ARG 23 N 0.03 0.39 0.00 1.82 3.08 -1.02 0.12 114.38 118.79 1isf h ARG 23 Ca 0.00 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1isf h ARG 23 Cb 0.24 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 1isf h ARG 23 CO 0.02 0.26 -0.25 0.00 -1.07 0.00 0.00 179.97 178.92 1isf h ALA 24 N 1.61 1.27 -0.00 0.04 0.00 -1.59 -2.52 119.26 118.06 1isf h ALA 24 Ca 0.45 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1isf h ALA 24 Cb 1.13 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1isf h ALA 24 CO -0.16 0.32 -0.13 1.28 0.00 0.00 0.00 179.25 180.55 1isf n LEU 25 N -3.78 0.20 -4.87 0.00 4.77 0.42 -4.87 117.00 108.86 1isf n LEU 25 Ca -0.01 0.27 -0.30 0.00 -0.03 0.00 0.00 56.01 55.93 1isf n LEU 25 Cb 0.35 -0.36 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 1isf n LEU 25 CO 0.35 0.04 0.46 -0.76 -1.33 0.00 0.00 177.39 176.15 1isf s LEU 26 N -2.85 3.82 0.44 2.23 1.43 -0.95 -5.05 118.68 117.74 1isf s LEU 26 Ca 0.18 1.16 -0.24 0.00 -1.03 0.00 0.00 54.13 54.19 1isf s LEU 26 Cb 0.19 -4.04 -0.08 0.00 0.03 0.00 0.00 46.19 42.29 1isf s LEU 26 CO 0.55 -0.41 1.24 -0.94 0.23 0.00 0.00 176.35 177.02 1isf s SER 27 N -3.15 6.18 0.54 2.29 1.04 -1.26 -4.78 113.70 114.56 1isf s SER 27 Ca 0.52 2.51 0.30 0.00 0.48 0.00 0.00 55.95 59.75 1isf s SER 27 Cb -0.10 -2.62 1.46 0.00 0.10 0.00 0.00 66.02 64.85 1isf s SER 27 CO 0.31 -0.93 1.92 -0.65 0.98 0.00 0.00 173.24 174.88 1isf h PRO 28 N 2.34 0.00 -0.38 4.02 0.11 -1.96 0.14 132.00 136.26 1isf h PRO 28 Ca -0.49 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.53 1isf h PRO 28 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1isf h PRO 28 CO 0.61 0.00 -0.08 0.93 -0.21 0.00 0.00 178.00 179.25 1isf h GLU 29 N 0.00 0.73 -0.75 1.05 3.07 -2.03 -3.13 114.58 113.52 1isf h GLU 29 Ca 0.37 -0.27 -0.43 0.00 -0.50 0.00 0.00 59.36 58.52 1isf h GLU 29 Cb 1.49 -0.05 -0.25 0.00 -0.84 0.00 0.00 28.75 29.11 1isf h GLU 29 CO -0.00 0.87 0.31 1.04 -1.40 0.00 0.00 179.01 179.82 1isf n GLN 30 N -4.37 2.30 0.03 2.33 6.02 -0.14 -4.47 117.38 119.07 1isf n GLN 30 Ca -0.01 -3.23 0.12 0.00 -0.01 0.00 0.00 57.00 53.86 1isf n GLN 30 Cb 0.34 -2.08 0.13 0.00 1.02 0.00 0.00 30.24 29.65 1isf n GLN 30 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1isf n ARG 31 N -1.06 0.19 -1.96 -1.09 3.00 -0.17 -4.65 116.66 110.92 1isf n ARG 31 Ca 0.50 0.02 -0.39 0.00 -0.00 0.00 0.00 57.85 57.98 1isf n ARG 31 Cb 1.20 -1.59 -0.03 0.00 0.00 0.00 0.00 32.46 32.05 1isf n ARG 31 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1isf n ASN 32 N -1.85 3.75 -4.20 6.15 6.94 -1.26 -4.90 115.26 119.89 1isf n ASN 32 Ca 0.03 -2.80 -0.32 0.00 -0.02 0.00 0.00 54.58 51.47 1isf n ASN 32 Cb 0.40 -1.59 -0.16 0.00 -2.36 0.00 0.00 39.78 36.06 1isf n ASN 32 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1isf s LYS 33 N 4.63 3.06 -0.66 -3.83 -0.14 -1.26 -5.08 119.74 116.47 1isf s LYS 33 Ca 0.56 -0.84 -0.18 0.00 -1.36 0.00 0.00 55.97 54.15 1isf s LYS 33 Cb 0.08 -2.43 0.12 0.00 -1.68 0.00 0.00 37.83 33.92 1isf s LYS 33 CO 0.06 0.05 0.74 0.34 -0.76 0.00 0.00 175.35 175.78 1isf s ASP 34 N 0.67 6.31 0.18 2.83 -1.08 -1.26 -4.92 116.67 119.40 1isf s ASP 34 Ca -0.10 -1.70 -0.14 0.00 -0.52 0.00 0.00 52.55 50.09 1isf s ASP 34 Cb -0.16 -2.29 0.16 0.00 -1.46 0.00 0.00 42.92 39.17 1isf s ASP 34 CO 0.01 -1.02 1.71 0.00 0.52 0.00 0.00 175.17 176.39 1isf h THR 36 N 0.19 1.12 -0.28 0.00 2.02 -1.97 0.69 112.91 114.69 1isf h THR 36 Ca 0.23 -0.40 -0.09 0.00 0.77 0.00 0.00 66.41 66.91 1isf h THR 36 Cb 0.32 -0.16 -0.01 0.00 -1.74 0.00 0.00 68.15 66.56 1isf h THR 36 CO -0.33 0.21 -0.19 0.00 0.37 0.00 0.00 175.52 175.58 1isf h ALA 37 N 1.42 0.39 -0.86 6.16 0.00 -1.72 -0.99 119.26 123.67 1isf h ALA 37 Ca 0.40 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1isf h ALA 37 Cb 0.09 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1isf h ALA 37 CO -0.15 0.33 0.57 0.82 0.00 0.00 0.00 179.25 180.81 1isf h ILE 38 N 0.35 1.20 -0.20 0.00 2.04 0.87 -1.37 117.51 120.40 1isf h ILE 38 Ca 0.05 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 1isf h ILE 38 Cb 0.73 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 1isf h ILE 38 CO 0.05 0.21 0.07 -0.25 0.00 0.00 0.00 178.15 178.23 1isf h TRP 39 N 1.15 0.33 -0.67 1.37 2.91 0.53 -1.64 115.95 119.92 1isf h TRP 39 Ca 0.32 -0.03 0.09 0.00 1.13 0.00 0.00 58.89 60.40 1isf h TRP 39 Cb -0.11 -0.09 -0.04 0.00 -0.51 0.00 0.00 29.16 28.41 1isf h TRP 39 CO -0.01 0.39 0.45 1.49 -1.03 0.00 0.00 178.44 179.73 1isf h GLU 40 N 0.16 0.53 -0.20 2.65 4.57 -0.66 0.94 114.58 122.57 1isf h GLU 40 Ca 0.07 -0.03 -0.15 0.00 -1.18 0.00 0.00 59.36 58.06 1isf h GLU 40 Cb 0.22 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 1isf h GLU 40 CO -0.00 0.35 -0.46 0.00 -1.18 0.00 0.00 179.01 177.72 1isf h ALA 41 N 1.66 0.32 -0.83 2.92 0.00 -0.94 -2.96 119.26 119.43 1isf h ALA 41 Ca 0.31 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1isf h ALA 41 Cb 0.48 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 1isf h ALA 41 CO -0.10 0.47 0.49 0.35 0.00 0.00 0.00 179.25 180.46 1isf h PHE 42 N 0.35 1.10 0.00 0.00 3.57 -0.33 -2.11 116.94 119.52 1isf h PHE 42 Ca -0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1isf h PHE 42 Cb 1.07 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 39.45 1isf h PHE 42 CO 0.09 0.74 -0.03 -0.22 -2.23 0.00 0.00 178.31 176.66 1isf h LYS 43 N 1.15 0.00 -0.10 1.11 3.64 -0.70 -2.67 116.57 119.00 1isf h LYS 43 Ca 0.30 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.71 1isf h LYS 43 Cb -0.03 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.78 1isf h LYS 43 CO -0.05 0.03 0.07 0.28 -2.27 0.00 0.00 179.45 177.50 1isf h VAL 44 N 0.00 0.93 0.00 2.00 2.07 -1.22 0.20 116.25 120.23 1isf h VAL 44 Ca -0.00 0.00 -0.22 0.00 0.82 0.00 0.00 66.70 67.30 1isf h VAL 44 Cb 0.25 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1isf h VAL 44 CO 0.00 0.00 -1.23 0.00 0.02 0.00 0.00 177.57 176.36 1isf h ALA 45 N 1.95 0.58 0.00 1.67 0.00 -1.64 -3.33 119.26 118.49 1isf h ALA 45 Ca 0.05 -1.03 -0.07 0.00 0.00 0.00 0.00 54.91 53.86 1isf h ALA 45 Cb 0.19 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1isf h ALA 45 CO -0.00 1.24 -0.31 -0.07 0.00 0.00 0.00 179.25 180.10 1isf h LEU 46 N 0.00 0.00 -0.03 0.00 3.38 -1.05 -3.01 115.31 114.60 1isf h LEU 46 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1isf h LEU 46 Cb 1.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.53 1isf h LEU 46 CO 0.09 0.31 -0.07 0.47 0.09 0.00 0.00 178.44 179.33 1isf n ASP 47 N -3.60 0.12 -4.66 -0.43 8.00 -0.65 -4.12 116.55 111.22 1isf n ASP 47 Ca -0.01 0.12 -0.25 0.00 0.71 0.00 0.00 54.79 55.36 1isf n ASP 47 Cb 0.44 -0.30 0.11 0.00 -0.02 0.00 0.00 41.12 41.34 1isf n ASP 47 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1isf s LYS 48 N -2.83 1.68 0.18 -1.24 1.02 -1.14 -5.03 119.74 112.38 1isf s LYS 48 Ca 0.19 -0.75 -0.31 0.00 0.02 0.00 0.00 55.97 55.12 1isf s LYS 48 Cb 0.19 -2.22 -0.10 0.00 -0.52 0.00 0.00 37.83 35.19 1isf s LYS 48 CO 0.53 -1.51 1.48 0.34 -0.92 0.00 0.00 175.35 175.26 1isf s ASP 49 N -4.69 6.67 0.00 2.83 2.15 -1.26 -4.59 116.67 117.78 1isf s ASP 49 Ca 0.65 2.57 0.00 0.00 0.43 0.00 0.00 52.55 56.20 1isf s ASP 49 Cb -0.07 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 1isf s ASP 49 CO 0.45 -0.74 0.72 -0.81 -0.17 0.00 0.00 175.17 174.62 1isf n PRO 50 N 3.36 0.00 -0.33 4.34 -0.04 -1.26 -0.31 135.00 140.76 1isf n PRO 50 Ca 0.11 0.25 0.05 0.00 -0.04 0.00 0.00 63.50 63.87 1isf n PRO 50 Cb 0.40 -1.68 0.08 0.00 -0.04 0.00 0.00 33.50 32.26 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 -0.75 1.24 -4.67 0.00 7.64 0.57 -4.52 113.62 113.14 1isf n SER 52 Ca 0.09 -2.66 -0.36 0.00 1.01 0.00 0.00 58.87 56.94 1isf n SER 52 Cb 0.69 -0.38 -0.09 0.00 -1.01 0.00 0.00 64.21 63.41 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 -1.13 5.36 0.20 0.44 1.01 -0.38 -4.79 120.40 121.10 1isf s VAL 53 Ca 0.35 0.20 0.07 0.00 0.00 0.00 0.00 61.98 62.60 1isf s VAL 53 Cb 0.38 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 1isf s VAL 53 CO -0.13 0.35 0.05 -0.76 0.00 0.00 0.00 175.10 174.61 1isf s LEU 54 N 1.02 3.46 0.28 3.92 1.43 -1.26 -4.06 118.68 123.47 1isf s LEU 54 Ca 0.08 -0.36 0.02 0.00 -1.03 0.00 0.00 54.13 52.84 1isf s LEU 54 Cb -0.13 -2.07 0.61 0.00 0.03 0.00 0.00 46.19 44.63 1isf s LEU 54 CO 0.04 0.06 1.79 -0.65 0.23 0.00 0.00 176.35 177.81 1isf h PRO 55 N 2.37 0.75 -0.06 1.29 0.11 -1.96 0.14 132.00 134.64 1isf h PRO 55 Ca -0.47 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.61 1isf h PRO 55 Cb 1.21 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1isf h PRO 55 CO 0.60 0.50 0.17 0.66 -0.21 0.00 0.00 178.00 179.71 1isf h SER 56 N 0.77 0.00 0.58 -2.05 4.64 -1.95 -0.23 113.55 115.31 1isf h SER 56 Ca 0.52 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.82 1isf h SER 56 Cb 0.70 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.79 1isf h SER 56 CO -0.34 0.00 -0.06 0.44 -0.87 0.00 0.00 176.83 176.00 1isf h ASP 57 N 0.00 0.00 -0.60 4.97 3.32 -1.11 -2.12 116.42 120.88 1isf h ASP 57 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1isf h ASP 57 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 1isf h ASP 57 CO -0.00 0.06 0.00 -1.22 -1.72 0.00 0.00 179.24 176.35 1isf n TYR 58 N -3.27 1.33 -0.27 4.55 4.02 -0.10 -4.44 117.16 118.98 1isf n TYR 58 Ca -0.01 -0.53 -0.04 0.00 -0.01 0.00 0.00 57.90 57.31 1isf n TYR 58 Cb 0.24 -0.21 0.07 0.00 -0.02 0.00 0.00 39.34 39.42 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 3.73 0.82 -0.17 7.72 3.32 -1.50 -0.71 116.42 129.63 1isf h ASP 59 Ca 0.00 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1isf h ASP 59 Cb 1.31 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.66 1isf h ASP 59 CO 0.20 0.58 0.07 -0.07 -1.72 0.00 0.00 179.24 178.30 1isf h LEU 60 N 0.97 0.24 -0.27 1.55 3.38 -1.82 -0.20 115.31 119.16 1isf h LEU 60 Ca 0.28 -0.17 0.06 0.00 0.09 0.00 0.00 57.88 58.15 1isf h LEU 60 Cb -0.06 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.55 1isf h LEU 60 CO -0.08 0.35 -0.23 0.15 0.09 0.00 0.00 178.44 178.72 1isf h PHE 61 N 0.12 -0.59 0.12 1.13 3.57 -1.70 -0.73 116.94 118.86 1isf h PHE 61 Ca 0.06 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.61 1isf h PHE 61 Cb 0.18 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 1isf h PHE 61 CO -0.01 -0.30 -0.16 0.82 -2.23 0.00 0.00 178.31 176.42 1isf h ILE 62 N -0.22 0.63 -0.55 1.41 1.08 -0.96 -2.15 117.51 116.75 1isf h ILE 62 Ca 0.15 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.72 1isf h ILE 62 Cb 0.44 0.63 -0.11 0.00 -3.07 0.00 0.00 36.82 34.71 1isf h ILE 62 CO -0.40 0.00 -0.20 0.74 -0.69 0.00 0.00 178.15 177.61 1isf h THR 63 N -0.33 0.35 0.00 -0.27 2.02 -0.31 0.84 112.91 115.20 1isf h THR 63 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1isf h THR 63 Cb 0.34 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 1isf h THR 63 CO -0.07 0.00 0.00 0.18 0.37 0.00 0.00 175.52 176.00 1isf n LEU 64 N -5.41 0.22 -0.00 2.58 4.77 -0.35 -3.59 117.00 115.21 1isf n LEU 64 Ca 0.05 0.54 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 1isf n LEU 64 Cb 0.32 -0.49 -0.00 0.00 -2.33 0.00 0.00 43.42 40.92 1isf n LEU 64 CO 0.06 -0.21 0.08 -1.54 -1.33 0.00 0.00 177.39 174.45 1isf n SER 65 N -1.72 0.32 -4.72 -1.43 3.41 -0.28 -4.76 113.62 104.44 1isf n SER 65 Ca 0.05 -0.66 -0.43 0.00 -0.26 0.00 0.00 58.87 57.57 1isf n SER 65 Cb 0.27 0.69 -0.02 0.00 -0.26 0.00 0.00 64.21 64.89 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 -0.69 2.59 -3.77 4.33 0.00 0.28 -4.40 116.66 114.99 1isf n ARG 66 Ca 0.00 0.92 -0.11 0.00 -0.00 0.00 0.00 57.85 58.67 1isf n ARG 66 Cb 0.00 -2.71 -0.07 0.00 0.00 0.00 0.00 32.46 29.69 1isf n ARG 66 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1isf s HIS 67 N 0.38 -0.04 0.75 -0.14 -3.43 -1.26 -5.03 115.29 106.51 1isf s HIS 67 Ca 0.69 -0.20 -0.11 0.00 -0.80 0.00 0.00 55.06 54.64 1isf s HIS 67 Cb -0.53 0.07 0.04 0.00 -1.43 0.00 0.00 32.58 30.73 1isf s HIS 67 CO 0.43 -0.53 1.09 -1.54 -2.00 0.00 0.00 174.74 172.19 1isf s SER 68 N -2.35 4.66 -0.16 7.38 1.04 -1.26 -5.01 113.70 117.99 1isf s SER 68 Ca -0.02 1.85 -0.00 0.00 0.48 0.00 0.00 55.95 58.26 1isf s SER 68 Cb 0.01 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.60 1isf s SER 68 CO -0.06 -1.93 -0.15 -0.63 0.98 0.00 0.00 173.24 171.45 1isf s ILE 69 N -2.81 2.65 0.48 -1.02 1.01 -1.26 -5.09 121.20 115.16 1isf s ILE 69 Ca 0.62 -0.77 -0.22 0.00 0.00 0.00 0.00 60.65 60.29 1isf s ILE 69 Cb -0.18 -2.13 -0.09 0.00 0.01 0.00 0.00 42.46 40.07 1isf s ILE 69 CO 0.53 0.51 0.84 -2.65 0.00 0.00 0.00 174.94 174.18 1isf n PRO 70 N 4.21 0.99 -2.02 2.79 -0.02 -1.26 -4.76 135.00 134.94 1isf n PRO 70 Ca -0.19 0.37 -0.39 0.00 -2.02 0.00 0.00 63.50 61.26 1isf n PRO 70 Cb 0.51 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 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 -2.09 3.76 0.00 -0.52 3.52 -1.26 -2.73 118.95 119.62 1isf s ARG 71 Ca 0.66 2.13 0.00 0.00 -0.13 0.00 0.00 55.73 58.39 1isf s ARG 71 Cb -0.52 -2.60 0.00 0.00 -1.56 0.00 0.00 34.95 30.27 1isf s ARG 71 CO 0.55 -0.66 0.00 -0.25 -0.81 0.00 0.00 175.30 174.13 1isf n ASP 72 N -0.21 -2.52 -0.65 -2.12 8.00 -0.33 -4.81 116.55 113.90 1isf n ASP 72 Ca 0.06 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.63 1isf n ASP 72 Cb 0.44 -2.34 0.10 0.00 -0.02 0.00 0.00 41.12 39.30 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 -1.02 1.48 -2.43 -1.24 5.02 -1.11 -4.74 118.16 114.13 1isf n LYS 73 Ca 0.00 -1.59 -0.39 0.00 -2.02 0.00 0.00 58.31 54.32 1isf n LYS 73 Cb 0.18 -1.30 -0.04 0.00 -0.02 0.00 0.00 35.03 33.86 1isf n LYS 73 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1isf s SER 74 N -1.18 6.91 -0.23 4.39 0.01 -1.26 -0.51 113.70 121.83 1isf s SER 74 Ca 0.21 2.24 -0.04 0.00 1.31 0.00 0.00 55.95 59.67 1isf s SER 74 Cb 0.13 -2.61 0.08 0.00 0.21 0.00 0.00 66.02 63.83 1isf s SER 74 CO 0.19 -0.39 0.11 -0.22 0.41 0.00 0.00 173.24 173.34 1isf s LEU 75 N -2.06 0.50 0.62 2.44 2.96 -1.26 -2.72 118.68 119.17 1isf s LEU 75 Ca 0.52 -0.98 -0.02 0.00 -0.22 0.00 0.00 54.13 53.43 1isf s LEU 75 Cb -0.29 -0.32 0.05 0.00 0.50 0.00 0.00 46.19 46.13 1isf s LEU 75 CO 0.37 -0.40 0.88 -0.36 -1.32 0.00 0.00 176.35 175.52 1isf s PHE 76 N 2.10 2.86 0.03 5.38 0.40 0.14 -4.39 117.98 124.50 1isf s PHE 76 Ca 0.06 0.17 -0.29 0.00 -0.60 0.00 0.00 56.93 56.27 1isf s PHE 76 Cb -0.16 -2.94 0.11 0.00 0.51 0.00 0.00 43.02 40.53 1isf s PHE 76 CO -0.23 -1.11 1.20 1.67 0.70 0.00 0.00 175.22 177.45 1isf s TRP 77 N -2.97 -0.06 -0.16 0.36 1.48 -1.26 -0.66 118.94 115.67 1isf s TRP 77 Ca 0.59 -0.09 -0.14 0.00 -1.06 0.00 0.00 56.10 55.39 1isf s TRP 77 Cb -0.10 0.57 0.04 0.00 -1.16 0.00 0.00 33.47 32.82 1isf s TRP 77 CO 0.41 -0.43 0.41 -1.21 -4.06 0.00 0.00 176.95 172.08 1isf s GLU 78 N -2.66 0.48 -1.44 3.25 0.41 -0.92 -4.77 118.70 113.05 1isf s GLU 78 Ca 0.14 0.58 -0.03 0.00 -0.41 0.00 0.00 54.97 55.25 1isf s GLU 78 Cb 0.03 0.22 0.02 0.00 -1.78 0.00 0.00 34.13 32.63 1isf s GLU 78 CO -0.02 -0.06 0.52 0.09 -0.49 0.00 0.00 175.26 175.29 1isf n ASN 79 N 2.93 -0.99 -1.64 -0.19 3.02 -1.26 -3.53 115.26 113.60 1isf n ASN 79 Ca -0.14 -0.98 -0.02 0.00 -0.03 0.00 0.00 54.58 53.42 1isf n ASN 79 Cb 0.57 -3.14 0.03 0.00 -0.61 0.00 0.00 39.78 36.63 1isf n ASN 79 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1isf n SER 80 N -2.94 -0.66 -0.03 6.41 3.41 -1.26 -4.43 113.62 114.12 1isf n SER 80 Ca -0.24 -1.41 -0.13 0.00 -0.26 0.00 0.00 58.87 56.83 1isf n SER 80 Cb 0.65 0.28 -0.07 0.00 -0.26 0.00 0.00 64.21 64.81 1isf n SER 80 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1isf h HIS 81 N 0.33 -1.37 -0.47 7.33 6.17 -1.97 0.57 115.15 125.74 1isf h HIS 81 Ca -0.25 0.06 -0.05 0.00 0.71 0.00 0.00 60.37 60.84 1isf h HIS 81 Cb 1.09 0.63 -0.02 0.00 2.52 0.00 0.00 27.41 31.62 1isf h HIS 81 CO -0.13 -0.50 0.07 -0.07 0.71 0.00 0.00 177.93 178.01 1isf h LEU 82 N -0.49 0.68 -0.70 0.26 3.38 -1.99 -0.42 115.31 116.02 1isf h LEU 82 Ca 0.07 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 1isf h LEU 82 Cb 0.64 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1isf h LEU 82 CO -0.45 0.70 -0.21 0.25 0.09 0.00 0.00 178.44 178.82 1isf h LEU 83 N 0.70 0.78 -0.20 1.67 5.85 -1.86 -1.37 115.31 120.88 1isf h LEU 83 Ca 0.15 -0.28 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 1isf h LEU 83 Cb 0.32 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.14 1isf h LEU 83 CO 0.00 0.98 -0.23 0.58 -0.34 0.00 0.00 178.44 179.43 1isf h VAL 84 N 0.68 1.33 -0.90 1.05 2.07 -0.47 -0.22 116.25 119.80 1isf h VAL 84 Ca 0.10 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.20 1isf h VAL 84 Cb 0.72 1.78 -0.04 0.00 -1.52 0.00 0.00 31.29 32.23 1isf h VAL 84 CO 0.06 0.43 0.54 0.78 0.02 0.00 0.00 177.57 179.40 1isf h ASN 85 N 0.18 1.07 -0.25 0.57 -0.26 -1.02 -0.10 115.58 115.78 1isf h ASN 85 Ca 0.03 -0.06 -0.18 0.00 -0.56 0.00 0.00 56.30 55.53 1isf h ASN 85 Cb 0.79 -0.27 -0.00 0.00 -1.06 0.00 0.00 38.32 37.78 1isf h ASN 85 CO 0.06 0.82 -0.52 -1.28 -1.06 0.00 0.00 177.43 175.44 1isf h SER 86 N 1.23 0.93 -0.18 5.81 0.87 -1.20 -2.89 113.55 118.12 1isf h SER 86 Ca 0.32 -0.48 -0.21 0.00 -1.23 0.00 0.00 61.79 60.18 1isf h SER 86 Cb -0.06 -0.26 0.01 0.00 -0.44 0.00 0.00 62.40 61.65 1isf h SER 86 CO -0.06 1.27 -0.72 0.15 -0.53 0.00 0.00 176.83 176.94 1isf h PHE 87 N 0.65 1.07 0.00 2.24 3.04 -0.79 -3.01 116.94 120.14 1isf h PHE 87 Ca 0.02 -0.46 -0.01 0.00 3.98 0.00 0.00 57.97 61.51 1isf h PHE 87 Cb 1.12 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 39.46 1isf h PHE 87 CO 0.07 1.29 -0.03 0.00 -2.02 0.00 0.00 178.31 177.62 1isf h ALA 88 N 0.57 1.69 -6.54 2.41 0.00 -1.06 -3.43 119.26 112.91 1isf h ALA 88 Ca -0.04 -0.02 -0.51 0.00 0.00 0.00 0.00 54.91 54.34 1isf h ALA 88 Cb 1.35 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 1isf h ALA 88 CO 0.15 0.03 -0.91 -3.47 0.00 0.00 0.00 179.25 175.05 1isf n ASP 89 N -4.13 -1.17 -3.44 0.00 2.03 -1.09 -2.06 116.55 106.69 1isf n ASP 89 Ca -0.03 -1.05 -0.18 0.00 0.52 0.00 0.00 54.79 54.05 1isf n ASP 89 Cb 0.11 -2.88 0.08 0.00 -0.72 0.00 0.00 41.12 37.71 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 -2.88 -3.03 0.00 1.67 5.15 -1.26 -2.66 115.26 112.25 1isf n ASN 90 Ca -0.27 -0.68 0.00 0.00 -0.60 0.00 0.00 54.58 53.03 1isf n ASN 90 Cb 0.67 -4.93 0.00 0.00 -0.53 0.00 0.00 39.78 34.98 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 -3.95 0.00 -0.02 -0.44 -2.24 -1.18 -4.90 114.28 101.55 1isf n THR 91 Ca -0.24 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.41 1isf n THR 91 Cb 0.66 -0.26 -0.10 0.00 -2.10 0.00 0.00 70.33 68.53 1isf n THR 91 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1isf h ARG 92 N 1.45 -0.00 0.00 -0.78 2.43 -1.30 -3.40 114.38 112.78 1isf h ARG 92 Ca 0.00 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 1isf h ARG 92 Cb 0.11 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 1isf h ARG 92 CO 0.00 0.51 -1.32 0.54 -1.51 0.00 0.00 179.97 178.19 1isf n ARG 93 N -4.84 0.54 -4.19 0.20 1.74 -0.87 -5.04 116.66 104.20 1isf n ARG 93 Ca -0.09 0.48 -0.11 0.00 -0.77 0.00 0.00 57.85 57.36 1isf n ARG 93 Cb 0.26 -1.66 -0.10 0.00 -1.02 0.00 0.00 32.46 29.94 1isf n ARG 93 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1isf s PHE 94 N -2.40 1.07 -0.55 -1.55 0.40 -1.23 -4.98 117.98 108.73 1isf s PHE 94 Ca -0.28 -1.30 0.04 0.00 -0.60 0.00 0.00 56.93 54.80 1isf s PHE 94 Cb 0.07 -0.55 0.15 0.00 0.51 0.00 0.00 43.02 43.19 1isf s PHE 94 CO 0.47 -0.56 0.34 1.41 0.70 0.00 0.00 175.22 177.59 1isf s MET 95 N -4.10 1.83 0.94 0.44 1.75 0.33 -3.44 119.30 117.05 1isf s MET 95 Ca 0.32 -2.64 -0.13 0.00 -1.25 0.00 0.00 55.69 51.99 1isf s MET 95 Cb 0.07 -2.87 0.16 0.00 2.84 0.00 0.00 34.83 35.03 1isf s MET 95 CO 0.08 -1.21 1.15 -1.25 -0.65 0.00 0.00 175.02 173.13 1isf s PRO 96 N -0.47 0.90 0.43 4.11 0.04 -1.26 -4.11 135.00 134.63 1isf s PRO 96 Ca 0.22 0.22 0.20 0.00 0.04 0.00 0.00 61.00 61.68 1isf s PRO 96 Cb -0.15 -1.82 1.15 0.00 0.04 0.00 0.00 34.50 33.73 1isf s PRO 96 CO -0.08 -2.35 1.83 1.25 0.04 0.00 0.00 177.00 177.69 1isf h LEU 97 N -1.61 0.36 -0.76 -3.56 5.85 -1.95 0.38 115.31 114.02 1isf h LEU 97 Ca -0.50 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1isf h LEU 97 Cb 1.32 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.34 1isf h LEU 97 CO 0.58 0.12 0.00 0.77 -0.34 0.00 0.00 178.44 179.57 1isf h SER 98 N 0.34 0.00 -0.46 1.25 4.64 -1.91 -2.92 113.55 114.49 1isf h SER 98 Ca 0.50 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.61 1isf h SER 98 Cb 1.37 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.33 1isf h SER 98 CO -0.18 0.00 0.06 0.47 -0.87 0.00 0.00 176.83 176.31 1isf n ASP 99 N -2.31 2.93 -4.23 4.97 8.00 0.13 -3.18 116.55 122.87 1isf n ASP 99 Ca 0.02 -3.64 -0.28 0.00 0.71 0.00 0.00 54.79 51.60 1isf n ASP 99 Cb 0.24 -0.66 -0.16 0.00 -0.02 0.00 0.00 41.12 40.51 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 -3.20 1.71 0.19 2.53 1.01 -1.10 -4.76 120.40 116.77 1isf s VAL 100 Ca 0.47 -0.91 -0.25 0.00 0.00 0.00 0.00 61.98 61.29 1isf s VAL 100 Cb 0.41 -1.42 0.07 0.00 0.00 0.00 0.00 36.38 35.44 1isf s VAL 100 CO 0.03 0.48 1.54 -0.11 0.00 0.00 0.00 175.10 177.05 1isf n LEU 101 N 2.64 -0.87 0.31 3.92 7.94 -1.26 -0.25 117.00 129.43 1isf n LEU 101 Ca -0.16 1.76 0.20 0.00 -1.11 0.00 0.00 56.01 56.71 1isf n LEU 101 Cb 0.53 -0.31 0.95 0.00 0.53 0.00 0.00 43.42 45.12 1isf n LEU 101 CO 0.24 -1.50 1.09 0.10 -1.11 0.00 0.00 177.39 176.21 1isf h TYR 102 N 0.00 0.00 0.07 1.96 -0.00 -1.89 -2.69 116.97 114.42 1isf h TYR 102 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 58.73 58.70 1isf h TYR 102 Cb 0.49 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.21 1isf h TYR 102 CO -0.96 0.00 -1.44 0.78 -0.00 0.00 0.00 178.16 176.54 1isf h GLY 103 N 1.03 0.18 0.32 0.10 0.00 -0.92 -3.39 103.07 100.39 1isf h GLY 103 Ca -0.00 -0.46 0.15 0.00 0.00 0.00 0.00 47.33 47.02 1isf h GLY 103 CO 0.00 0.40 0.61 -0.09 0.00 0.00 0.00 176.54 177.46 1isf h ARG 104 N -0.48 0.85 0.00 4.80 9.65 -0.32 -1.75 114.38 127.13 1isf h ARG 104 Ca -0.34 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.49 1isf h ARG 104 Cb 1.64 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 30.03 1isf h ARG 104 CO -0.03 0.56 0.00 -0.39 2.80 0.00 0.00 179.97 182.92 1isf h VAL 105 N 0.88 0.00 0.00 0.20 -1.51 -1.67 -3.25 116.25 110.90 1isf h VAL 105 Ca 0.53 -0.33 0.00 0.00 -1.23 0.00 0.00 66.70 65.66 1isf h VAL 105 Cb 0.65 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 31.00 1isf h VAL 105 CO -0.32 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.02 1isf n ALA 106 N -1.94 2.37 -1.69 5.19 0.00 -0.76 -4.60 120.51 119.09 1isf n ALA 106 Ca 0.01 -0.42 -0.51 0.00 0.00 0.00 0.00 53.44 52.52 1isf n ALA 106 Cb 0.24 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.64 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 -0.14 3.11 0.00 0.00 4.64 -0.73 -1.61 116.55 121.81 1isf n ASP 107 Ca 0.00 1.01 0.00 0.00 -1.38 0.00 0.00 54.79 54.42 1isf n ASP 107 Cb 0.00 -1.30 0.00 0.00 -1.04 0.00 0.00 41.12 38.78 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 6.18 0.00 -2.03 -0.67 3.01 -1.26 -5.01 117.46 117.67 1isf n PHE 108 Ca 0.24 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.42 1isf n PHE 108 Cb 0.24 -0.18 0.08 0.00 -0.01 0.00 0.00 39.48 39.61 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 2.64 0.06 4.37 1.43 -0.64 -5.07 118.68 121.48 1isf s LEU 109 Ca 0.00 0.63 0.01 0.00 -1.03 0.00 0.00 54.13 53.74 1isf s LEU 109 Cb 0.00 -3.18 -0.03 0.00 0.03 0.00 0.00 46.19 43.00 1isf s LEU 109 CO 0.00 -1.79 -0.06 -0.44 0.23 0.00 0.00 176.35 174.29 1isf s SER 110 N -4.56 0.81 -0.18 2.29 0.01 -1.26 -4.97 113.70 105.84 1isf s SER 110 Ca 0.61 -0.82 -0.30 0.00 1.31 0.00 0.00 55.95 56.76 1isf s SER 110 Cb -0.11 0.10 0.13 0.00 0.21 0.00 0.00 66.02 66.36 1isf s SER 110 CO 0.47 -0.41 1.02 -1.66 0.41 0.00 0.00 173.24 173.08 1isf s TRP 111 N -2.82 -0.36 0.00 2.43 -2.14 -1.26 -1.18 118.94 113.60 1isf s TRP 111 Ca 0.02 0.65 0.00 0.00 2.66 0.00 0.00 56.10 59.42 1isf s TRP 111 Cb -0.00 0.44 0.00 0.00 -3.10 0.00 0.00 33.47 30.81 1isf s TRP 111 CO -0.04 -0.31 0.00 0.00 -2.66 0.00 0.00 176.95 173.94 1isf s ARG 113 N -1.83 3.80 0.44 0.00 3.52 -1.26 -0.78 118.95 122.84 1isf s ARG 113 Ca 0.00 0.70 -0.26 0.00 -0.13 0.00 0.00 55.73 56.04 1isf s ARG 113 Cb 0.00 -2.23 -0.09 0.00 -1.56 0.00 0.00 34.95 31.07 1isf s ARG 113 CO 0.00 -0.24 1.41 1.04 -0.81 0.00 0.00 175.30 176.70 1isf n GLN 114 N -1.74 2.23 -0.34 5.12 6.02 0.28 -4.45 117.38 124.51 1isf n GLN 114 Ca 0.05 0.79 0.16 0.00 -0.01 0.00 0.00 57.00 57.99 1isf n GLN 114 Cb 0.54 -2.59 0.31 0.00 1.02 0.00 0.00 30.24 29.52 1isf n GLN 114 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1isf n LYS 115 N -0.09 -0.08 -3.16 -1.09 0.00 -1.26 -3.25 118.16 109.23 1isf n LYS 115 Ca 0.05 1.48 -0.20 0.00 0.00 0.00 0.00 58.31 59.64 1isf n LYS 115 Cb 0.41 -2.37 -0.06 0.00 0.00 0.00 0.00 35.03 33.02 1isf n LYS 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1isf n ALA 116 N -3.12 1.47 0.00 3.14 0.00 -1.26 -4.76 120.51 115.98 1isf n ALA 116 Ca 0.24 -2.65 0.00 0.00 0.00 0.00 0.00 53.44 51.03 1isf n ALA 116 Cb 0.79 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.28 1isf n ALA 116 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1isf n ASP 117 N 2.33 0.00 0.27 0.00 2.03 -1.20 -5.04 116.55 114.94 1isf n ASP 117 Ca 0.23 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.67 1isf n ASP 117 Cb 0.52 0.00 0.77 0.00 -0.72 0.00 0.00 41.12 41.70 1isf n ASP 117 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1isf h SER 118 N 0.00 0.00 -4.17 1.67 4.64 -1.97 -3.30 113.55 110.41 1isf h SER 118 Ca 0.00 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.85 1isf h SER 118 Cb 0.00 0.00 0.13 0.00 -0.31 0.00 0.00 62.40 62.22 1isf h SER 118 CO 0.00 0.09 0.29 -0.83 -0.87 0.00 0.00 176.83 175.50 1isf s GLY 119 N -4.17 1.59 0.36 -0.77 0.00 -1.26 -4.81 107.32 98.25 1isf s GLY 119 Ca -0.03 -0.38 -0.20 0.00 0.00 0.00 0.00 44.72 44.10 1isf s GLY 119 CO 0.58 0.15 0.86 1.08 0.00 0.00 0.00 173.10 175.77 1isf s LEU 120 N -6.06 4.09 -0.81 0.66 1.43 -1.26 -0.56 118.68 116.17 1isf s LEU 120 Ca 0.63 1.56 -0.16 0.00 -1.03 0.00 0.00 54.13 55.13 1isf s LEU 120 Cb -0.16 -4.21 0.17 0.00 0.03 0.00 0.00 46.19 42.02 1isf s LEU 120 CO 0.55 -0.22 0.87 -0.62 0.23 0.00 0.00 176.35 177.15 1isf s ASP 121 N -2.05 6.61 0.00 2.29 -1.08 0.04 -4.57 116.67 117.90 1isf s ASP 121 Ca 0.56 -2.24 0.03 0.00 -0.52 0.00 0.00 52.55 50.37 1isf s ASP 121 Cb -0.12 -2.29 0.18 0.00 -1.46 0.00 0.00 42.92 39.23 1isf s ASP 121 CO 0.17 -0.83 1.04 -1.22 0.52 0.00 0.00 175.17 174.85 1isf n TYR 122 N 5.26 0.00 -0.11 -5.34 4.02 -1.26 -1.93 117.16 117.80 1isf n TYR 122 Ca 0.13 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.82 1isf n TYR 122 Cb 0.47 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.71 1isf n TYR 122 CO 0.00 0.00 0.00 0.94 -1.01 0.00 0.00 176.86 176.79 1isf n GLN 123 N -0.55 0.55 -3.48 -0.72 -0.06 -1.26 -4.58 117.38 107.28 1isf n GLN 123 Ca 0.02 0.40 -0.11 0.00 -2.00 0.00 0.00 57.00 55.31 1isf n GLN 123 Cb 0.01 -1.60 -0.03 0.00 -4.06 0.00 0.00 30.24 24.56 1isf n GLN 123 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 1isf s SER 124 N -6.76 -0.49 0.03 1.69 1.04 -1.24 -3.99 113.70 103.98 1isf s SER 124 Ca -0.30 0.15 0.04 0.00 0.48 0.00 0.00 55.95 56.32 1isf s SER 124 Cb 0.08 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.67 1isf s SER 124 CO 0.47 -0.73 -0.12 0.00 0.98 0.00 0.00 173.24 173.85 1isf n PRO 126 N 2.13 1.66 -2.85 0.00 -0.04 -1.26 -1.18 135.00 133.46 1isf n PRO 126 Ca -0.17 0.60 -0.20 0.00 -0.04 0.00 0.00 63.50 63.70 1isf n PRO 126 Cb 0.55 -2.39 0.08 0.00 -0.04 0.00 0.00 33.50 31.69 1isf n PRO 126 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1isf n THR 127 N -0.73 0.00 0.27 0.52 -2.24 -1.26 -4.68 114.28 106.17 1isf n THR 127 Ca 0.09 -1.82 0.11 0.00 -2.27 0.00 0.00 64.05 60.16 1isf n THR 127 Cb 0.42 -0.60 0.76 0.00 -2.10 0.00 0.00 70.33 68.82 1isf n THR 127 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1isf h SER 128 N -0.03 0.00 0.04 3.42 0.87 -1.92 -2.53 113.55 113.40 1isf h SER 128 Ca -0.27 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.16 1isf h SER 128 Cb 1.21 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.18 1isf h SER 128 CO 0.37 0.02 -0.53 -0.33 -0.53 0.00 0.00 176.83 175.83 1isf h GLU 129 N 0.00 0.28 -0.83 2.24 5.08 -1.97 -3.23 114.58 116.15 1isf h GLU 129 Ca -0.00 -0.36 0.22 0.00 -1.00 0.00 0.00 59.36 58.22 1isf h GLU 129 Cb 0.04 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 1isf h GLU 129 CO 0.00 1.09 0.58 -0.44 -1.00 0.00 0.00 179.01 179.24 1isf h ASP 130 N -0.36 0.13 0.00 1.42 3.32 -1.82 -3.44 116.42 115.67 1isf h ASP 130 Ca -0.08 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1isf h ASP 130 Cb 1.31 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1isf h ASP 130 CO 0.10 0.05 0.00 0.00 -1.72 0.00 0.00 179.24 177.67 1isf h GLU 132 N 0.00 0.30 -2.94 0.00 4.81 -1.83 -3.37 114.58 111.56 1isf h GLU 132 Ca 0.00 -0.50 -0.72 0.00 -0.13 0.00 0.00 59.36 58.01 1isf h GLU 132 Cb 0.00 0.18 -0.07 0.00 0.63 0.00 0.00 28.75 29.49 1isf h GLU 132 CO 0.00 1.23 2.91 0.09 -0.73 0.00 0.00 179.01 182.51 1isf n ASN 133 N -4.14 7.67 -4.92 1.04 3.02 -1.26 -4.69 115.26 111.99 1isf n ASN 133 Ca -0.14 -2.93 -0.28 0.00 -0.03 0.00 0.00 54.58 51.20 1isf n ASN 133 Cb 0.81 -1.46 -0.03 0.00 -0.61 0.00 0.00 39.78 38.48 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 1.22 6.42 0.20 6.41 2.20 -1.26 -1.25 114.94 128.88 1isf s ASN 134 Ca 0.57 0.53 -0.17 0.00 -0.94 0.00 0.00 52.86 52.86 1isf s ASN 134 Cb 0.17 -2.07 0.19 0.00 -2.00 0.00 0.00 41.25 37.55 1isf s ASN 134 CO -0.07 -0.08 1.61 -0.65 -2.94 0.00 0.00 177.10 174.96 1isf h PRO 135 N 2.01 -0.08 -0.06 3.55 0.11 -1.83 -2.20 132.00 133.49 1isf h PRO 135 Ca -0.48 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 1isf h PRO 135 Cb 1.19 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 1isf h PRO 135 CO 0.68 -0.05 0.01 0.28 -0.21 0.00 0.00 178.00 178.70 1isf h VAL 136 N -0.08 1.23 -0.59 3.15 2.07 -1.94 -1.83 116.25 118.25 1isf h VAL 136 Ca 0.28 -0.70 -0.08 0.00 0.82 0.00 0.00 66.70 67.02 1isf h VAL 136 Cb 0.51 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 1isf h VAL 136 CO -0.67 0.19 0.06 0.44 0.02 0.00 0.00 177.57 177.62 1isf h ASP 137 N -0.15 0.97 -0.27 0.57 3.32 -1.88 -2.58 116.42 116.39 1isf h ASP 137 Ca 0.02 -0.28 -0.05 0.00 0.02 0.00 0.00 57.03 56.74 1isf h ASP 137 Cb 0.30 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1isf h ASP 137 CO 0.00 1.00 0.01 0.28 -1.72 0.00 0.00 179.24 178.82 1isf h SER 138 N 0.90 0.55 0.76 6.45 0.02 -1.43 -2.31 113.55 118.48 1isf h SER 138 Ca 0.17 -0.11 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1isf h SER 138 Cb 0.47 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1isf h SER 138 CO 0.02 0.61 -0.49 0.15 -1.14 0.00 0.00 176.83 175.98 1isf h PHE 139 N 0.56 -1.32 0.00 3.45 3.57 -0.97 -2.05 116.94 120.18 1isf h PHE 139 Ca 0.12 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1isf h PHE 139 Cb 0.34 0.48 -0.00 0.00 2.79 0.00 0.00 35.95 39.56 1isf h PHE 139 CO 0.01 -0.73 -0.02 -1.49 -2.23 0.00 0.00 178.31 173.86 1isf h TRP 140 N -1.18 0.00 0.02 0.41 4.06 -1.37 -0.10 115.95 117.79 1isf h TRP 140 Ca -0.10 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.85 1isf h TRP 140 Cb 0.96 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.12 1isf h TRP 140 CO -0.13 0.02 -0.01 0.87 -3.56 0.00 0.00 178.44 175.63 1isf h LYS 141 N 0.00 -0.03 -0.52 0.49 1.57 -1.01 0.01 116.57 117.08 1isf h LYS 141 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1isf h LYS 141 Cb 0.10 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 1isf h LYS 141 CO 0.00 0.53 0.32 0.00 -0.57 0.00 0.00 179.45 179.74 1isf h ARG 142 N -0.61 0.71 -0.82 3.15 2.47 -0.64 -1.14 114.38 117.49 1isf h ARG 142 Ca -0.00 -0.06 -0.04 0.00 -1.26 0.00 0.00 59.98 58.62 1isf h ARG 142 Cb 0.57 -0.15 -0.04 0.00 -1.65 0.00 0.00 29.97 28.71 1isf h ARG 142 CO 0.00 0.51 0.37 0.00 0.56 0.00 0.00 179.97 181.42 1isf h ALA 143 N 1.16 1.06 -0.54 0.04 0.00 -1.07 -2.15 119.26 117.76 1isf h ALA 143 Ca 0.19 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1isf h ALA 143 Cb -0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 1isf h ALA 143 CO -0.04 0.65 -0.05 0.77 0.00 0.00 0.00 179.25 180.58 1isf h SER 144 N 1.18 0.95 -0.37 0.00 0.02 -0.66 -0.51 113.55 114.16 1isf h SER 144 Ca 0.28 -0.28 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 1isf h SER 144 Cb 0.15 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.42 1isf h SER 144 CO -0.03 1.03 0.11 0.40 -1.14 0.00 0.00 176.83 177.20 1isf h ILE 145 N 0.87 1.21 0.07 3.27 2.04 -0.90 -1.37 117.51 122.70 1isf h ILE 145 Ca 0.15 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 1isf h ILE 145 Cb 0.58 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1isf h ILE 145 CO 0.04 0.24 -0.03 -0.61 0.00 0.00 0.00 178.15 177.79 1isf h GLN 146 N 0.45 -0.09 -0.65 2.37 5.75 -1.27 -0.06 115.11 121.61 1isf h GLN 146 Ca 0.12 0.01 0.13 0.00 -0.15 0.00 0.00 58.65 58.75 1isf h GLN 146 Cb 0.26 0.02 -0.09 0.00 1.07 0.00 0.00 27.48 28.74 1isf h GLN 146 CO -0.00 0.22 0.14 -0.92 -2.65 0.00 0.00 178.83 175.62 1isf h TYR 147 N -0.39 0.23 -0.06 3.99 3.20 -1.07 0.11 116.97 122.97 1isf h TYR 147 Ca -0.01 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.90 1isf h TYR 147 Cb 0.34 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 1isf h TYR 147 CO 0.03 -0.05 0.03 0.77 -1.64 0.00 0.00 178.16 177.30 1isf h SER 148 N 0.27 0.08 -0.38 -2.11 0.02 -1.05 -2.61 113.55 107.76 1isf h SER 148 Ca 0.35 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 61.17 1isf h SER 148 Cb 0.54 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 1isf h SER 148 CO -0.44 0.16 0.16 0.11 -1.14 0.00 0.00 176.83 175.68 1isf h LYS 149 N -0.01 0.61 -0.11 3.45 1.57 -0.04 -2.59 116.57 119.46 1isf h LYS 149 Ca 0.02 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1isf h LYS 149 Cb 0.10 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1isf h LYS 149 CO -0.00 0.52 0.00 -0.25 -0.57 0.00 0.00 179.45 179.14 1isf n ASP 150 N -4.36 1.24 -4.87 0.86 8.00 0.28 -4.76 116.55 112.94 1isf n ASP 150 Ca 0.03 -1.61 -0.31 0.00 0.71 0.00 0.00 54.79 53.61 1isf n ASP 150 Cb 0.15 -0.07 -0.05 0.00 -0.02 0.00 0.00 41.12 41.14 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 -1.62 6.64 0.20 -2.24 0.01 -0.98 -4.35 113.70 111.37 1isf s SER 151 Ca 0.32 1.11 -0.17 0.00 1.31 0.00 0.00 55.95 58.53 1isf s SER 151 Cb 0.17 -2.31 0.02 0.00 0.21 0.00 0.00 66.02 64.11 1isf s SER 151 CO 0.26 -0.23 0.52 -0.94 0.41 0.00 0.00 173.24 173.25 1isf s SER 152 N -2.62 -0.24 0.89 2.44 1.04 -1.26 -4.72 113.70 109.23 1isf s SER 152 Ca 0.51 -0.53 0.00 0.00 0.48 0.00 0.00 55.95 56.41 1isf s SER 152 Cb -0.10 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.59 1isf s SER 152 CO 0.23 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 174.00 1isf n GLY 153 N -0.34 0.58 3.59 7.32 0.00 0.23 -1.19 105.19 115.37 1isf n GLY 153 Ca -0.09 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 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 4.86 -0.10 1.61 1.01 -1.26 -0.90 120.40 125.62 1isf s VAL 154 Ca 0.00 0.80 -0.23 0.00 0.00 0.00 0.00 61.98 62.54 1isf s VAL 154 Cb 0.00 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 1isf s VAL 154 CO 0.00 -0.27 0.70 -0.63 0.00 0.00 0.00 175.10 174.90 1isf s ILE 155 N 2.78 5.03 0.02 2.22 -1.09 -0.75 -4.28 121.20 125.13 1isf s ILE 155 Ca 0.27 1.43 0.05 0.00 -2.23 0.00 0.00 60.65 60.16 1isf s ILE 155 Cb -0.14 -4.04 -0.03 0.00 -1.58 0.00 0.00 42.46 36.67 1isf s ILE 155 CO 0.14 0.21 -0.11 -1.00 -1.23 0.00 0.00 174.94 172.95 1isf s HIS 156 N 1.09 2.75 -0.04 3.97 3.76 -1.10 -1.13 115.29 124.58 1isf s HIS 156 Ca 0.36 -0.13 -0.00 0.00 -0.15 0.00 0.00 55.06 55.14 1isf s HIS 156 Cb -0.17 -1.55 0.03 0.00 1.11 0.00 0.00 32.58 32.00 1isf s HIS 156 CO 0.16 0.32 -0.00 0.08 -0.85 0.00 0.00 174.74 174.45 1isf s VAL 157 N -0.97 0.26 -0.28 -0.90 1.01 -0.61 0.26 120.40 119.17 1isf s VAL 157 Ca 0.16 0.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.15 1isf s VAL 157 Cb -0.11 -0.38 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 1isf s VAL 157 CO 0.07 0.19 0.10 -0.32 0.00 0.00 0.00 175.10 175.14 1isf s MET 158 N 1.36 3.46 0.18 2.72 1.75 0.17 0.17 119.30 129.11 1isf s MET 158 Ca -0.05 -0.62 0.10 0.00 -1.25 0.00 0.00 55.69 53.87 1isf s MET 158 Cb -0.13 -3.43 -0.04 0.00 2.84 0.00 0.00 34.83 34.07 1isf s MET 158 CO -0.02 -0.31 -0.14 -0.51 -0.65 0.00 0.00 175.02 173.38 1isf s LEU 159 N 1.60 2.79 -0.52 4.11 1.43 -0.06 -2.15 118.68 125.88 1isf s LEU 159 Ca 0.05 -0.67 -0.19 0.00 -1.03 0.00 0.00 54.13 52.29 1isf s LEU 159 Cb -0.16 -1.50 0.06 0.00 0.03 0.00 0.00 46.19 44.63 1isf s LEU 159 CO 0.05 0.11 0.63 0.21 0.23 0.00 0.00 176.35 177.58 1isf s ASN 160 N -2.75 6.22 0.00 2.29 3.84 -1.23 -0.52 114.94 122.79 1isf s ASN 160 Ca 0.23 -0.98 0.25 0.00 0.21 0.00 0.00 52.86 52.57 1isf s ASN 160 Cb -0.09 -2.29 1.45 0.00 -0.55 0.00 0.00 41.25 39.77 1isf s ASN 160 CO 0.13 -0.91 1.85 0.61 -2.79 0.00 0.00 177.10 175.99 1isf n GLY 161 N 5.18 -0.84 0.82 1.21 0.00 0.35 -2.53 105.19 109.38 1isf n GLY 161 Ca -0.07 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.05 3.08 -4.63 1.61 7.64 -1.24 -1.49 113.62 117.54 1isf n SER 162 Ca 0.17 -1.94 -0.43 0.00 1.01 0.00 0.00 58.87 57.69 1isf n SER 162 Cb 0.11 -0.26 -0.02 0.00 -1.01 0.00 0.00 64.21 63.02 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 -1.04 3.85 0.30 1.43 2.56 -1.05 -4.80 118.70 119.95 1isf s GLU 163 Ca 0.29 1.45 0.05 0.00 0.00 0.00 0.00 54.97 56.77 1isf s GLU 163 Cb 0.16 -3.96 0.81 0.00 2.00 0.00 0.00 34.13 33.14 1isf s GLU 163 CO 0.21 -1.21 1.44 -2.30 -0.56 0.00 0.00 175.26 172.84 1isf n PRO 164 N 7.50 -0.07 -0.19 4.30 -0.02 -1.26 -0.40 135.00 144.86 1isf n PRO 164 Ca 0.17 1.35 0.05 0.00 -2.02 0.00 0.00 63.50 63.05 1isf n PRO 164 Cb 0.46 -2.21 0.14 0.00 -0.02 0.00 0.00 33.50 31.87 1isf n PRO 164 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1isf n THR 165 N -5.30 0.52 0.00 3.45 -2.24 -1.26 -5.01 114.28 104.44 1isf n THR 165 Ca 0.24 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1isf n THR 165 Cb 0.81 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 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 0.90 2.70 0.22 3.38 0.00 0.46 -4.90 105.19 107.95 1isf n GLY 166 Ca 0.11 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.27 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 0.57 -2.64 4.61 0.00 -1.78 -3.41 119.26 116.60 1isf h ALA 167 Ca 0.00 -0.21 -0.73 0.00 0.00 0.00 0.00 54.91 53.98 1isf h ALA 167 Cb 0.00 -0.16 -0.29 0.00 0.00 0.00 0.00 17.79 17.34 1isf h ALA 167 CO 0.00 0.26 -0.40 -0.47 0.00 0.00 0.00 179.25 178.64 1isf s TYR 168 N -5.25 3.41 -0.12 0.00 5.04 -1.26 -4.43 117.35 114.74 1isf s TYR 168 Ca -0.13 -1.80 -0.29 0.00 -2.44 0.00 0.00 57.07 52.41 1isf s TYR 168 Cb 0.10 -3.42 -0.05 0.00 0.35 0.00 0.00 41.96 38.95 1isf s TYR 168 CO 0.78 -0.97 1.68 -2.14 -1.34 0.00 0.00 175.55 173.56 1isf s PRO 169 N 1.38 3.99 0.00 4.97 0.02 -1.26 -4.86 135.00 139.23 1isf s PRO 169 Ca 0.05 2.01 0.28 0.00 0.02 0.00 0.00 61.00 63.36 1isf s PRO 169 Cb -0.26 -4.03 1.50 0.00 0.02 0.00 0.00 34.50 31.73 1isf s PRO 169 CO -0.00 -1.07 1.97 0.44 -0.33 0.00 0.00 177.00 178.01 1isf n ILE 170 N 5.92 0.07 -1.30 2.83 -5.35 -1.26 -3.34 119.36 116.94 1isf n ILE 170 Ca 0.19 0.02 0.07 0.00 -0.27 0.00 0.00 62.75 62.76 1isf n ILE 170 Cb 0.44 -0.57 0.10 0.00 -1.74 0.00 0.00 39.64 37.87 1isf n ILE 170 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1isf n LYS 171 N -1.18 0.96 -1.11 6.28 4.76 -1.26 -4.74 118.16 121.86 1isf n LYS 171 Ca 0.16 -2.16 -0.05 0.00 -2.87 0.00 0.00 58.31 53.39 1isf n LYS 171 Cb 0.17 -1.24 0.02 0.00 -1.84 0.00 0.00 35.03 32.15 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 -1.06 0.97 0.33 0.72 0.00 -1.21 -4.84 105.19 100.10 1isf n GLY 172 Ca 0.12 -2.01 -0.06 0.00 0.00 0.00 0.00 46.02 44.07 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 -0.34 1.18 -0.03 1.61 0.05 -1.95 0.44 116.94 117.89 1isf h PHE 173 Ca -0.07 -0.08 -0.00 0.00 3.82 0.00 0.00 57.97 61.64 1isf h PHE 173 Cb 0.26 -0.36 -0.00 0.00 2.00 0.00 0.00 35.95 37.86 1isf h PHE 173 CO 0.00 0.88 0.02 0.35 -0.18 0.00 0.00 178.31 179.38 1isf h PHE 174 N 1.13 0.05 -0.29 -0.55 3.57 -1.91 0.15 116.94 119.09 1isf h PHE 174 Ca 0.27 -0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.59 1isf h PHE 174 Cb 0.18 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.91 1isf h PHE 174 CO 0.02 0.11 -0.51 0.00 -2.23 0.00 0.00 178.31 175.69 1isf h ALA 175 N 0.93 0.45 0.00 2.41 0.00 -1.77 0.15 119.26 121.45 1isf h ALA 175 Ca 0.01 -0.50 -0.14 0.00 0.00 0.00 0.00 54.91 54.28 1isf h ALA 175 Cb 0.08 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1isf h ALA 175 CO -0.00 0.65 -1.53 -0.25 0.00 0.00 0.00 179.25 178.11 1isf n ASP 176 N -4.04 0.65 0.00 0.00 8.00 0.14 -4.50 116.55 116.80 1isf n ASP 176 Ca -0.04 0.28 0.00 0.00 0.71 0.00 0.00 54.79 55.74 1isf n ASP 176 Cb 0.61 0.54 0.00 0.00 -0.02 0.00 0.00 41.12 42.24 1isf n ASP 176 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1isf n TYR 177 N -2.76 0.00 -0.08 1.24 4.02 0.45 -4.80 117.16 115.23 1isf n TYR 177 Ca -0.10 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.62 1isf n TYR 177 Cb 0.79 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 40.05 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 -0.77 0.35 -0.23 -0.72 1.02 -0.86 -4.08 120.64 115.34 1isf n GLU 178 Ca 0.00 0.15 -0.01 0.00 -0.02 0.00 0.00 57.16 57.28 1isf n GLU 178 Cb 0.00 -1.08 0.10 0.00 -0.02 0.00 0.00 31.44 30.44 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 -0.58 0.94 0.00 -3.67 2.04 -1.20 -1.34 117.51 113.71 1isf h ILE 179 Ca -0.41 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 1isf h ILE 179 Cb 1.36 0.22 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1isf h ILE 179 CO -0.25 0.12 -0.04 -0.65 0.00 0.00 0.00 178.15 177.33 1isf h PRO 180 N 0.66 0.00 -0.37 2.37 0.11 -1.82 -2.94 132.00 130.02 1isf h PRO 180 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 1isf h PRO 180 Cb 0.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.33 1isf h PRO 180 CO -0.20 0.04 0.00 0.09 -0.21 0.00 0.00 178.00 177.72 1isf n ASN 181 N -3.38 3.35 -4.77 -2.05 3.02 -0.53 -4.97 115.26 105.94 1isf n ASN 181 Ca -0.02 -1.96 -0.39 0.00 -0.03 0.00 0.00 54.58 52.18 1isf n ASN 181 Cb 0.17 -0.24 -0.01 0.00 -0.61 0.00 0.00 39.78 39.09 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 -1.41 4.22 -0.83 3.41 1.43 -1.07 -3.65 118.68 120.79 1isf s LEU 182 Ca 0.36 2.52 -0.14 0.00 -1.03 0.00 0.00 54.13 55.85 1isf s LEU 182 Cb 0.21 -3.93 0.22 0.00 0.03 0.00 0.00 46.19 42.72 1isf s LEU 182 CO 0.29 -0.75 0.77 -1.10 0.23 0.00 0.00 176.35 175.79 1isf s GLN 183 N -2.22 3.60 0.32 1.70 -1.52 -1.26 -4.92 119.66 115.36 1isf s GLN 183 Ca 0.56 -2.46 0.10 0.00 -1.95 0.00 0.00 55.36 51.62 1isf s GLN 183 Cb -0.35 -4.43 0.95 0.00 -0.22 0.00 0.00 33.01 28.97 1isf s GLN 183 CO 0.45 -1.29 1.67 -0.22 -0.25 0.00 0.00 175.29 175.65 1isf h LYS 184 N 7.78 0.34 -0.98 2.91 3.64 -1.93 0.18 116.57 128.51 1isf h LYS 184 Ca 0.10 -0.02 0.23 0.00 -1.27 0.00 0.00 60.65 59.69 1isf h LYS 184 Cb 1.04 -0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 32.70 1isf h LYS 184 CO 0.75 0.22 0.63 1.05 -2.27 0.00 0.00 179.45 179.84 1isf h GLU 185 N 0.35 0.43 -0.28 1.90 4.11 -2.01 -1.11 114.58 117.96 1isf h GLU 185 Ca 0.67 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 60.08 1isf h GLU 185 Cb 1.45 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1isf h GLU 185 CO -0.59 0.29 0.00 0.36 0.07 0.00 0.00 179.01 179.14 1isf n LYS 186 N -4.58 3.03 -4.84 1.06 2.85 0.59 -4.95 118.16 111.32 1isf n LYS 186 Ca 0.22 -2.82 -0.33 0.00 -1.05 0.00 0.00 58.31 54.34 1isf n LYS 186 Cb 0.76 -1.84 -0.14 0.00 -0.65 0.00 0.00 35.03 33.16 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 -2.72 2.98 -0.20 0.58 1.01 -0.42 -0.61 121.20 121.82 1isf s ILE 187 Ca 0.42 -0.71 -0.21 0.00 0.00 0.00 0.00 60.65 60.16 1isf s ILE 187 Cb 0.33 -2.22 -0.18 0.00 0.01 0.00 0.00 42.46 40.40 1isf s ILE 187 CO 0.10 0.54 0.21 0.71 0.00 0.00 0.00 174.94 176.50 1isf h THR 188 N 5.17 0.88 -3.17 2.92 1.35 -1.30 -3.47 112.91 115.30 1isf h THR 188 Ca -0.30 -2.07 0.02 0.00 -0.55 0.00 0.00 66.41 63.51 1isf h THR 188 Cb 1.20 2.07 -0.08 0.00 -1.73 0.00 0.00 68.15 69.61 1isf h THR 188 CO 0.54 0.30 0.13 0.00 -0.25 0.00 0.00 175.52 176.23 1isf s ARG 189 N -2.33 1.57 -0.09 4.72 1.70 -1.24 -4.50 118.95 118.77 1isf s ARG 189 Ca -0.27 -0.91 0.04 0.00 -0.47 0.00 0.00 55.73 54.12 1isf s ARG 189 Cb 0.05 0.56 0.00 0.00 -0.57 0.00 0.00 34.95 35.00 1isf s ARG 189 CO 0.56 -0.69 -0.21 0.42 -1.08 0.00 0.00 175.30 174.29 1isf s ILE 190 N -3.89 1.83 -0.08 4.99 1.01 -0.34 -1.81 121.20 122.91 1isf s ILE 190 Ca 0.10 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 59.90 1isf s ILE 190 Cb -0.03 -1.59 0.00 0.00 0.01 0.00 0.00 42.46 40.84 1isf s ILE 190 CO 0.02 0.51 -0.20 -0.70 0.00 0.00 0.00 174.94 174.56 1isf s GLU 191 N 0.36 2.47 0.04 2.79 2.12 -0.29 -2.00 118.70 124.20 1isf s GLU 191 Ca -0.16 -0.74 0.04 0.00 0.36 0.00 0.00 54.97 54.46 1isf s GLU 191 Cb -0.17 -1.96 -0.04 0.00 0.26 0.00 0.00 34.13 32.22 1isf s GLU 191 CO 0.07 0.19 -0.02 0.42 -0.54 0.00 0.00 175.26 175.38 1isf s ILE 192 N 0.28 3.93 -0.31 -3.70 -1.09 -0.55 -1.58 121.20 118.18 1isf s ILE 192 Ca -0.13 -0.84 0.03 0.00 -2.23 0.00 0.00 60.65 57.47 1isf s ILE 192 Cb -0.16 -2.80 0.09 0.00 -1.58 0.00 0.00 42.46 38.01 1isf s ILE 192 CO 0.06 0.26 0.01 0.26 -1.23 0.00 0.00 174.94 174.30 1isf s TRP 193 N -1.16 3.17 -0.58 3.97 0.51 0.13 -0.49 118.94 124.49 1isf s TRP 193 Ca 0.22 -2.51 -0.21 0.00 -2.12 0.00 0.00 56.10 51.47 1isf s TRP 193 Cb -0.11 -2.37 0.06 0.00 -0.81 0.00 0.00 33.47 30.24 1isf s TRP 193 CO 0.13 -0.90 0.82 0.08 -0.51 0.00 0.00 176.95 176.57 1isf s VAL 194 N 1.12 4.57 0.08 4.03 1.01 -0.07 -0.89 120.40 130.25 1isf s VAL 194 Ca 0.05 -0.31 -0.09 0.00 0.00 0.00 0.00 61.98 61.62 1isf s VAL 194 Cb -0.19 -4.51 -0.06 0.00 0.00 0.00 0.00 36.38 31.63 1isf s VAL 194 CO -0.10 -1.13 0.39 -0.04 0.00 0.00 0.00 175.10 174.23 1isf s MET 195 N 3.42 3.74 0.08 2.72 -1.94 0.32 -0.57 119.30 127.08 1isf s MET 195 Ca 0.21 0.15 0.09 0.00 -1.71 0.00 0.00 55.69 54.43 1isf s MET 195 Cb -0.17 -2.99 -0.03 0.00 2.01 0.00 0.00 34.83 33.64 1isf s MET 195 CO 0.13 0.56 -0.24 -1.01 -0.01 0.00 0.00 175.02 174.45 1isf s HIS 196 N -1.41 2.05 0.49 -0.03 3.76 -1.26 0.13 115.29 119.02 1isf s HIS 196 Ca 0.33 -0.39 -0.23 0.00 -0.15 0.00 0.00 55.06 54.61 1isf s HIS 196 Cb -0.14 -1.17 -0.06 0.00 1.11 0.00 0.00 32.58 32.32 1isf s HIS 196 CO 0.18 0.19 1.33 -1.21 -0.85 0.00 0.00 174.74 174.37 1isf s GLU 197 N -1.58 3.48 0.11 1.40 0.41 -1.26 -4.86 118.70 116.40 1isf s GLU 197 Ca 0.10 2.17 -0.33 0.00 -0.41 0.00 0.00 54.97 56.49 1isf s GLU 197 Cb -0.10 -2.43 -0.13 0.00 -1.78 0.00 0.00 34.13 29.69 1isf s GLU 197 CO 0.03 -0.90 1.69 -0.89 -0.49 0.00 0.00 175.26 174.70 1isf n ILE 198 N -0.60 0.17 0.00 -1.63 2.08 -1.26 -1.07 119.36 117.05 1isf n ILE 198 Ca 0.08 -0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.36 1isf n ILE 198 Cb 0.45 -1.72 0.00 0.00 -0.75 0.00 0.00 39.64 37.62 1isf n ILE 198 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1isf n GLY 199 N 3.77 0.56 1.85 7.39 0.00 -1.26 -4.90 105.19 112.60 1isf n GLY 199 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.60 3.77 -0.02 0.00 -0.23 -4.83 105.19 101.27 1isf n GLY 200 Ca 0.00 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.23 3.76 -1.12 1.61 0.04 -1.26 -4.62 135.00 132.17 1isf s PRO 201 Ca 0.24 2.33 -0.04 0.00 0.04 0.00 0.00 61.00 63.57 1isf s PRO 201 Cb -0.06 -2.68 0.27 0.00 0.04 0.00 0.00 34.50 32.07 1isf s PRO 201 CO 0.48 -0.73 1.74 -1.71 0.04 0.00 0.00 177.00 176.82 1isf n ASN 202 N -0.12 6.64 -0.20 6.66 5.15 -1.26 -4.15 115.26 127.98 1isf n ASN 202 Ca 0.05 -3.41 -0.01 0.00 -0.60 0.00 0.00 54.58 50.61 1isf n ASN 202 Cb 0.42 -1.29 0.10 0.00 -0.53 0.00 0.00 39.78 38.49 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 3.06 0.80 -2.91 3.44 2.07 -1.71 -3.43 116.25 117.57 1isf h VAL 203 Ca 0.38 -0.15 -0.12 0.00 0.82 0.00 0.00 66.70 67.62 1isf h VAL 203 Cb 0.50 0.33 -0.22 0.00 -1.52 0.00 0.00 31.29 30.38 1isf h VAL 203 CO 1.36 0.08 -0.27 -1.61 0.02 0.00 0.00 177.57 177.15 1isf s GLU 204 N -6.10 0.54 0.41 1.57 2.02 -0.55 -5.01 118.70 111.58 1isf s GLU 204 Ca -0.13 0.21 0.03 0.00 0.02 0.00 0.00 54.97 55.11 1isf s GLU 204 Cb 0.16 0.25 -0.03 0.00 0.10 0.00 0.00 34.13 34.62 1isf s GLU 204 CO 0.74 -0.11 0.10 -1.12 0.02 0.00 0.00 175.26 174.89 1isf s SER 205 N -0.48 2.87 0.24 -0.19 0.01 -1.26 -4.53 113.70 110.35 1isf s SER 205 Ca -0.06 -1.62 -0.30 0.00 1.31 0.00 0.00 55.95 55.28 1isf s SER 205 Cb -0.04 0.41 -0.15 0.00 0.21 0.00 0.00 66.02 66.46 1isf s SER 205 CO 0.02 -0.87 1.10 0.00 0.41 0.00 0.00 173.24 173.91 1isf n GLY 207 N 1.62 0.63 3.22 0.00 0.00 -1.26 -5.03 105.19 104.37 1isf n GLY 207 Ca 0.12 -0.40 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.65 1.17 2.49 1.61 2.02 -0.47 -4.66 118.70 119.20 1isf s GLU 208 Ca 0.00 -0.91 0.00 0.00 0.02 0.00 0.00 54.97 54.08 1isf s GLU 208 Cb 0.00 -1.26 0.00 0.00 0.10 0.00 0.00 34.13 32.97 1isf s GLU 208 CO 0.00 0.31 0.00 0.41 0.02 0.00 0.00 175.26 176.00 1isf n GLY 209 N 1.72 2.87 0.41 -1.39 0.00 -1.26 -0.93 105.19 106.62 1isf n GLY 209 Ca -0.18 0.05 0.21 0.00 0.00 0.00 0.00 46.02 46.10 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 0.00 0.30 -0.66 1.61 4.64 -1.94 0.16 113.55 117.67 1isf h SER 210 Ca 0.00 0.03 0.06 0.00 -0.47 0.00 0.00 61.79 61.41 1isf h SER 210 Cb 0.00 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.03 1isf h SER 210 CO 0.00 0.12 0.43 0.24 -0.87 0.00 0.00 176.83 176.75 1isf h MET 211 N 0.30 0.65 -0.63 4.77 2.07 -1.35 0.28 114.93 121.03 1isf h MET 211 Ca 0.45 -0.04 -0.01 0.00 -2.07 0.00 0.00 59.70 58.03 1isf h MET 211 Cb 1.27 -0.15 -0.03 0.00 -1.87 0.00 0.00 31.60 30.82 1isf h MET 211 CO -0.13 0.43 0.35 0.87 1.07 0.00 0.00 176.91 179.50 1isf h LYS 212 N 0.67 0.87 0.11 1.72 1.57 -0.72 -0.78 116.57 120.01 1isf h LYS 212 Ca 0.28 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 1isf h LYS 212 Cb 0.25 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1isf h LYS 212 CO -0.09 0.65 -0.05 0.28 -0.57 0.00 0.00 179.45 179.67 1isf h VAL 213 N 0.85 0.90 -0.12 0.50 2.07 -1.00 -1.47 116.25 117.99 1isf h VAL 213 Ca 0.22 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.72 1isf h VAL 213 Cb 0.03 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1isf h VAL 213 CO -0.04 0.01 0.00 0.25 0.02 0.00 0.00 177.57 177.81 1isf h LEU 214 N -0.17 -0.04 -0.48 2.57 5.85 -0.91 -0.06 115.31 122.07 1isf h LEU 214 Ca -0.02 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.77 1isf h LEU 214 Cb 0.13 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1isf h LEU 214 CO 0.02 -0.00 0.26 -0.08 -0.34 0.00 0.00 178.44 178.30 1isf h GLU 215 N 0.04 0.49 -0.49 1.25 4.81 -1.09 -0.43 114.58 119.15 1isf h GLU 215 Ca 0.06 -0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 59.17 1isf h GLU 215 Cb 0.06 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 1isf h GLU 215 CO -0.09 0.33 -0.03 -0.22 -0.73 0.00 0.00 179.01 178.26 1isf h LYS 216 N 0.51 0.85 -0.16 1.92 3.64 -0.96 0.39 116.57 122.76 1isf h LYS 216 Ca 0.20 -0.25 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1isf h LYS 216 Cb 0.09 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1isf h LYS 216 CO -0.13 0.87 -0.00 -0.09 -2.27 0.00 0.00 179.45 177.83 1isf h ARG 217 N 0.78 0.29 -0.66 1.90 2.43 -0.48 0.21 114.38 118.85 1isf h ARG 217 Ca 0.14 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1isf h ARG 217 Cb 0.52 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 1isf h ARG 217 CO 0.03 0.52 0.31 -0.07 -1.51 0.00 0.00 179.97 179.24 1isf h LEU 218 N 0.03 0.88 -0.98 3.80 3.38 -0.93 -1.75 115.31 119.74 1isf h LEU 218 Ca 0.05 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1isf h LEU 218 Cb 0.39 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1isf h LEU 218 CO 0.01 0.77 -0.19 0.11 0.09 0.00 0.00 178.44 179.24 1isf h LYS 219 N 0.92 0.52 0.00 1.13 1.57 -0.84 -2.26 116.57 117.62 1isf h LYS 219 Ca 0.23 -0.18 -0.04 0.00 -1.87 0.00 0.00 60.65 58.79 1isf h LYS 219 Cb 0.14 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1isf h LYS 219 CO -0.03 0.69 -0.18 -0.44 -0.57 0.00 0.00 179.45 178.92 1isf h ASP 220 N 0.47 0.00 0.73 0.86 3.32 -0.38 -1.99 116.42 119.43 1isf h ASP 220 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1isf h ASP 220 Cb 0.59 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.14 1isf h ASP 220 CO 0.04 0.18 -0.19 0.23 -1.72 0.00 0.00 179.24 177.78 1isf n MET 221 N -3.59 0.11 -0.19 3.56 2.81 -0.71 -4.94 117.12 114.17 1isf n MET 221 Ca -0.01 -0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 1isf n MET 221 Cb 0.32 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 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 1.46 0.90 3.88 3.03 0.00 -0.75 -5.08 105.19 108.64 1isf n GLY 222 Ca 0.08 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.00 3.48 0.16 1.61 0.40 -0.93 -5.03 117.98 115.67 1isf s PHE 223 Ca 0.00 0.98 -0.21 0.00 -0.60 0.00 0.00 56.93 57.10 1isf s PHE 223 Cb 0.00 -2.39 -0.08 0.00 0.51 0.00 0.00 43.02 41.06 1isf s PHE 223 CO 0.00 -0.10 0.69 -1.14 0.70 0.00 0.00 175.22 175.36 1isf s GLN 224 N -3.93 4.32 0.07 0.44 0.74 -1.26 -4.45 119.66 115.59 1isf s GLN 224 Ca 0.50 0.90 0.03 0.00 0.05 0.00 0.00 55.36 56.85 1isf s GLN 224 Cb -0.10 -3.10 -0.03 0.00 1.10 0.00 0.00 33.01 30.87 1isf s GLN 224 CO 0.33 0.53 -0.10 -0.47 -0.55 0.00 0.00 175.29 175.02 1isf s TYR 225 N -1.29 0.96 -0.02 1.67 5.04 -1.26 -1.20 117.35 121.24 1isf s TYR 225 Ca 0.36 -0.55 -0.29 0.00 -2.44 0.00 0.00 57.07 54.16 1isf s TYR 225 Cb -0.19 -0.54 0.07 0.00 0.35 0.00 0.00 41.96 41.64 1isf s TYR 225 CO 0.22 -0.02 0.63 -1.54 -1.34 0.00 0.00 175.55 173.50 1isf s SER 226 N -1.94 -0.60 -0.01 4.32 1.04 -0.85 -4.96 113.70 110.70 1isf s SER 226 Ca -0.02 0.58 0.01 0.00 0.48 0.00 0.00 55.95 56.99 1isf s SER 226 Cb -0.07 0.52 0.00 0.00 0.10 0.00 0.00 66.02 66.58 1isf s SER 226 CO 0.01 -0.63 -0.02 0.00 0.98 0.00 0.00 173.24 173.57 1isf s ILE 228 N 0.19 1.72 -0.14 0.00 1.01 0.36 -4.93 121.20 119.41 1isf s ILE 228 Ca -0.02 -0.85 -0.22 0.00 0.00 0.00 0.00 60.65 59.57 1isf s ILE 228 Cb -0.04 -1.49 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 1isf s ILE 228 CO -0.00 0.49 0.64 0.20 0.00 0.00 0.00 174.94 176.26 1isf s ASN 229 N 0.19 6.81 -1.23 3.58 0.01 -1.26 -0.89 114.94 122.14 1isf s ASN 229 Ca -0.10 0.98 -0.11 0.00 -0.71 0.00 0.00 52.86 52.92 1isf s ASN 229 Cb -0.15 -2.37 -0.01 0.00 0.41 0.00 0.00 41.25 39.14 1isf s ASN 229 CO 0.05 -0.18 0.69 0.47 -1.51 0.00 0.00 177.10 176.61 1isf n ASP 230 N 4.40 -3.27 -4.65 -1.22 8.00 0.27 -4.76 116.55 115.32 1isf n ASP 230 Ca -0.02 -0.96 -0.63 0.00 0.71 0.00 0.00 54.79 53.89 1isf n ASP 230 Cb 0.50 -3.54 -0.09 0.00 -0.02 0.00 0.00 41.12 37.98 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 -4.21 1.37 -0.27 1.24 9.36 -1.26 -4.61 117.16 118.79 1isf n TYR 231 Ca -0.19 1.05 -0.10 0.00 3.32 0.00 0.00 57.90 61.98 1isf n TYR 231 Cb 0.63 -2.20 -0.07 0.00 -0.63 0.00 0.00 39.34 37.08 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 4.43 -0.18 -0.86 2.98 9.65 -1.98 -0.86 114.38 127.55 1isf h ARG 232 Ca -0.47 0.01 0.15 0.00 -1.10 0.00 0.00 59.98 58.57 1isf h ARG 232 Cb 1.39 0.04 -0.09 0.00 -1.39 0.00 0.00 29.97 29.91 1isf h ARG 232 CO 0.85 -0.12 0.46 -1.35 2.80 0.00 0.00 179.97 182.60 1isf h PRO 233 N -0.19 0.63 -0.08 0.20 0.11 -2.00 -0.14 132.00 130.53 1isf h PRO 233 Ca 0.16 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 66.08 1isf h PRO 233 Cb 0.53 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1isf h PRO 233 CO -0.76 0.42 -0.62 0.28 -0.21 0.00 0.00 178.00 177.11 1isf h VAL 234 N 0.65 1.38 0.03 3.15 2.07 -1.77 -2.60 116.25 119.17 1isf h VAL 234 Ca 0.47 -2.00 -0.00 0.00 0.82 0.00 0.00 66.70 65.99 1isf h VAL 234 Cb 0.65 2.01 0.00 0.00 -1.52 0.00 0.00 31.29 32.43 1isf h VAL 234 CO -0.36 0.59 -0.02 0.50 0.02 0.00 0.00 177.57 178.31 1isf h LYS 235 N 0.20 -0.04 -0.84 1.57 1.63 0.28 -0.90 116.57 118.46 1isf h LYS 235 Ca -0.01 0.00 0.11 0.00 -0.85 0.00 0.00 60.65 59.90 1isf h LYS 235 Cb 1.13 0.01 -0.08 0.00 -0.60 0.00 0.00 32.23 32.69 1isf h LYS 235 CO 0.10 -0.01 0.47 -0.07 -3.45 0.00 0.00 179.45 176.49 1isf h LEU 236 N -0.06 0.66 -0.81 5.20 3.38 -1.00 0.14 115.31 122.81 1isf h LEU 236 Ca -0.00 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1isf h LEU 236 Cb 0.05 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1isf h LEU 236 CO 0.01 0.35 0.30 0.25 0.09 0.00 0.00 178.44 179.44 1isf h LEU 237 N 0.76 1.09 -0.80 1.67 5.85 -1.03 -1.93 115.31 120.93 1isf h LEU 237 Ca 0.42 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.91 1isf h LEU 237 Cb 0.44 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 1isf h LEU 237 CO -0.28 0.97 0.21 1.56 -0.34 0.00 0.00 178.44 180.57 1isf h GLN 238 N 1.15 1.11 0.00 1.25 4.20 0.26 -2.80 115.11 120.28 1isf h GLN 238 Ca 0.26 -0.24 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1isf h GLN 238 Cb 0.23 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 1isf h GLN 238 CO -0.02 0.95 -0.04 0.00 -0.67 0.00 0.00 178.83 179.06 1isf h VAL 240 N 0.00 0.48 -0.69 0.00 2.07 -1.17 0.35 116.25 117.30 1isf h VAL 240 Ca -0.00 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1isf h VAL 240 Cb 0.09 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 1isf h VAL 240 CO 0.00 0.04 0.00 0.47 0.02 0.00 0.00 177.57 178.10 1isf n ASP 241 N -4.44 3.83 -2.77 0.57 8.00 -1.00 -4.25 116.55 116.50 1isf n ASP 241 Ca 0.25 -2.06 -0.01 0.00 0.71 0.00 0.00 54.79 53.68 1isf n ASP 241 Cb 1.02 -0.48 0.08 0.00 -0.02 0.00 0.00 41.12 41.73 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 1.47 -0.03 -0.26 1.24 8.25 0.11 -4.97 115.22 121.03 1isf n HIS 242 Ca 0.23 -2.00 0.32 0.00 -0.26 0.00 0.00 57.72 56.02 1isf n HIS 242 Cb 0.62 0.46 0.73 0.00 1.12 0.00 0.00 29.99 32.92 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 2.02 0.02 0.47 0.41 4.64 -1.41 -1.39 113.55 118.31 1isf h SER 243 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1isf h SER 243 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1isf h SER 243 CO 0.05 0.01 -0.75 0.35 -0.87 0.00 0.00 176.83 175.62 1isf n THR 244 N -4.24 0.11 -2.24 2.95 -2.24 -1.26 -4.61 114.28 102.75 1isf n THR 244 Ca 0.23 -0.12 -0.40 0.00 -2.27 0.00 0.00 64.05 61.49 1isf n THR 244 Cb 1.11 0.27 -0.03 0.00 -2.10 0.00 0.00 70.33 69.58 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 -3.09 3.20 0.51 4.78 5.04 -0.53 -4.90 115.29 120.30 1isf s HIS 245 Ca 0.08 1.52 0.26 0.00 -1.54 0.00 0.00 55.06 55.37 1isf s HIS 245 Cb 0.16 -3.53 1.36 0.00 0.04 0.00 0.00 32.58 30.61 1isf s HIS 245 CO 0.76 -1.41 1.93 -1.00 -2.34 0.00 0.00 174.74 172.67 1isf h PRO 246 N 3.38 0.09 0.00 2.88 0.13 -1.92 0.18 132.00 136.73 1isf h PRO 246 Ca -0.48 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1isf h PRO 246 Cb 1.22 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1isf h PRO 246 CO 0.65 0.06 0.00 -0.44 -0.23 0.00 0.00 178.00 178.04 1isf h ASP 247 N 0.09 0.00 -0.42 1.44 3.32 -1.92 -2.99 116.42 115.94 1isf h ASP 247 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 1isf h ASP 247 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1isf h ASP 247 CO -0.04 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.48 1isf s ALA 249 N -1.00 3.44 0.26 0.00 0.00 -1.11 -4.89 121.76 118.45 1isf s ALA 249 Ca 0.28 0.97 -0.09 0.00 0.00 0.00 0.00 51.96 53.12 1isf s ALA 249 Cb 0.15 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.80 1isf s ALA 249 CO 0.19 -0.35 0.57 -0.51 0.00 0.00 0.00 175.76 175.67 1isf s LEU 250 N -0.63 4.12 0.00 0.00 1.43 -1.26 -5.09 118.68 117.25 1isf s LEU 250 Ca 0.51 0.91 0.26 0.00 -1.03 0.00 0.00 54.13 54.78 1isf s LEU 250 Cb -0.33 -3.70 1.53 0.00 0.03 0.00 0.00 46.19 43.72 1isf s LEU 250 CO 0.39 -0.12 1.88 1.17 0.23 0.00 0.00 176.35 179.90