#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gio s GLN 2 N 0.00 4.44 -0.30 0.00 -0.21 -1.26 -5.02 119.66 117.32 1gio s GLN 2 Ca 0.00 0.99 -0.07 0.00 0.02 0.00 0.00 55.36 56.31 1gio s GLN 2 Cb 0.00 -3.30 0.17 0.00 1.00 0.00 0.00 33.01 30.88 1gio s GLN 2 CO 0.00 0.46 0.75 0.16 -2.12 0.00 0.00 175.29 174.53 1gio s ASP 3 N -0.64 -1.06 0.05 5.90 -4.77 -1.26 -5.05 116.67 109.84 1gio s ASP 3 Ca 0.35 0.89 0.28 0.00 -3.30 0.00 0.00 52.55 50.77 1gio s ASP 3 Cb -0.21 1.98 0.99 0.00 -1.09 0.00 0.00 42.92 44.59 1gio s ASP 3 CO 0.23 -0.20 1.78 -0.90 0.70 0.00 0.00 175.17 176.78 1gio n ASP 4 N 5.39 0.28 0.00 2.11 5.75 -1.26 -4.92 116.55 123.90 1gio n ASP 4 Ca -0.05 0.38 0.00 0.00 -0.01 0.00 0.00 54.79 55.10 1gio n ASP 4 Cb 0.51 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 1gio n ASP 4 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1gio n TYR 5 N -1.69 0.00 0.10 2.11 9.36 -1.26 -4.73 117.16 121.05 1gio n TYR 5 Ca 0.06 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.25 1gio n TYR 5 Cb 0.36 0.00 0.02 0.00 -0.63 0.00 0.00 39.34 39.09 1gio n TYR 5 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1gio h ARG 6 N 0.00 0.00 0.00 2.98 3.08 -2.01 -3.28 114.38 115.15 1gio h ARG 6 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1gio h ARG 6 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1gio h ARG 6 CO 0.00 0.77 -0.92 0.98 -1.07 0.00 0.00 179.97 179.74 1gio n TYR 7 N -3.46 0.00 -0.05 3.04 9.36 -1.26 -3.67 117.16 121.13 1gio n TYR 7 Ca 0.00 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.09 1gio n TYR 7 Cb 0.79 -0.09 -0.01 0.00 -0.63 0.00 0.00 39.34 39.39 1gio n TYR 7 CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 1gio h ILE 8 N 0.00 1.29 -0.96 2.97 1.08 -1.95 -1.58 117.51 118.37 1gio h ILE 8 Ca 0.00 -1.78 0.03 0.00 -0.39 0.00 0.00 64.86 62.71 1gio h ILE 8 Cb 0.40 1.71 -0.05 0.00 -3.07 0.00 0.00 36.82 35.81 1gio h ILE 8 CO 0.00 0.57 0.63 0.45 -0.69 0.00 0.00 178.15 179.11 1gio h HIS 9 N 0.58 1.18 -0.19 1.37 3.86 -1.73 -2.25 115.15 117.97 1gio h HIS 9 Ca 0.01 0.03 -0.16 0.00 -1.16 0.00 0.00 60.37 59.08 1gio h HIS 9 Cb 1.17 -0.40 0.00 0.00 1.06 0.00 0.00 27.41 29.24 1gio h HIS 9 CO 0.07 0.71 -0.50 0.35 0.86 0.00 0.00 177.93 179.41 1gio h PHE 10 N 1.24 0.88 0.00 2.45 3.57 -1.43 -2.43 116.94 121.23 1gio h PHE 10 Ca 0.37 -0.34 -0.10 0.00 3.53 0.00 0.00 57.97 61.43 1gio h PHE 10 Cb -0.06 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 1gio h PHE 10 CO -0.01 1.13 -0.48 -0.07 -2.23 0.00 0.00 178.31 176.65 1gio h LEU 11 N 0.38 0.00 0.16 0.59 -0.00 -1.31 -1.81 115.31 113.32 1gio h LEU 11 Ca -0.01 0.00 -0.31 0.00 -0.00 0.00 0.00 57.88 57.56 1gio h LEU 11 Cb 1.12 0.00 0.03 0.00 -0.00 0.00 0.00 40.66 41.81 1gio h LEU 11 CO 0.11 0.48 -1.33 0.74 -0.00 0.00 0.00 178.44 178.44 1gio h THR 12 N 0.00 1.30 0.56 0.22 2.02 -1.43 -3.12 112.91 112.45 1gio h THR 12 Ca -0.00 -2.59 -0.03 0.00 0.77 0.00 0.00 66.41 64.56 1gio h THR 12 Cb 1.26 2.83 0.01 0.00 -1.74 0.00 0.00 68.15 70.51 1gio h THR 12 CO 0.06 0.78 -0.27 1.56 0.37 0.00 0.00 175.52 178.03 1gio h GLN 13 N 0.22 -0.72 0.00 6.66 4.20 -1.44 -3.44 115.11 120.59 1gio h GLN 13 Ca -0.21 0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.55 1gio h GLN 13 Cb 2.01 0.16 0.00 0.00 0.30 0.00 0.00 27.48 29.95 1gio h GLN 13 CO 0.25 -0.44 0.00 0.72 -0.67 0.00 0.00 178.83 178.69 1gio n HIS 14 N -5.29 0.00 -1.56 2.96 8.25 -0.68 -4.84 115.22 114.07 1gio n HIS 14 Ca -0.10 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 56.97 1gio n HIS 14 Cb 0.32 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.47 1gio n HIS 14 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1gio n TYR 15 N -0.64 0.27 -4.09 4.41 9.36 -1.18 -4.07 117.16 121.22 1gio n TYR 15 Ca 0.00 0.46 -0.11 0.00 3.32 0.00 0.00 57.90 61.57 1gio n TYR 15 Cb 0.00 -2.08 -0.07 0.00 -0.63 0.00 0.00 39.34 36.56 1gio n TYR 15 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1gio s ASP 16 N -1.16 0.12 0.00 2.98 2.15 -0.70 -4.66 116.67 115.40 1gio s ASP 16 Ca 0.72 -1.17 0.02 0.00 0.43 0.00 0.00 52.55 52.55 1gio s ASP 16 Cb -0.45 0.52 0.03 0.00 -0.30 0.00 0.00 42.92 42.72 1gio s ASP 16 CO 0.51 -1.04 0.75 0.00 -0.17 0.00 0.00 175.17 175.22 1gio n ALA 17 N -0.36 2.53 -3.29 3.66 0.00 -1.26 -4.14 120.51 117.65 1gio n ALA 17 Ca 0.00 -0.49 -0.23 0.00 0.00 0.00 0.00 53.44 52.72 1gio n ALA 17 Cb 0.63 -0.21 -0.08 0.00 0.00 0.00 0.00 19.45 19.79 1gio n ALA 17 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1gio s LYS 18 N 0.00 0.93 -0.63 0.00 2.47 -1.26 -5.00 119.74 116.25 1gio s LYS 18 Ca 0.02 -1.94 -0.25 0.00 -1.56 0.00 0.00 55.97 52.24 1gio s LYS 18 Cb 0.03 -1.19 0.04 0.00 -1.46 0.00 0.00 37.83 35.25 1gio s LYS 18 CO -0.01 -1.38 1.09 -1.25 0.16 0.00 0.00 175.35 173.95 1gio s PRO 19 N 0.20 3.28 -0.43 4.03 0.04 -1.26 -4.91 135.00 135.95 1gio s PRO 19 Ca 0.32 -0.28 0.02 0.00 0.04 0.00 0.00 61.00 61.11 1gio s PRO 19 Cb 0.03 -4.12 0.14 0.00 0.04 0.00 0.00 34.50 30.60 1gio s PRO 19 CO -0.17 -1.77 0.26 0.15 0.04 0.00 0.00 177.00 175.50 1gio s LYS 20 N 4.64 1.15 0.00 4.56 -0.14 -1.26 -4.84 119.74 123.85 1gio s LYS 20 Ca 0.32 -1.94 0.00 0.00 -1.36 0.00 0.00 55.97 52.99 1gio s LYS 20 Cb -0.11 -2.08 0.00 0.00 -1.68 0.00 0.00 37.83 33.96 1gio s LYS 20 CO 0.17 -1.20 0.00 0.41 -0.76 0.00 0.00 175.35 173.97 1gio n GLY 21 N 3.50 -0.74 3.30 -3.33 0.00 -1.26 -4.98 105.19 101.68 1gio n GLY 21 Ca 0.12 0.31 -0.19 0.00 0.00 0.00 0.00 46.02 46.26 1gio n GLY 21 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gio n ARG 22 N 0.00 -6.68 0.00 1.61 1.74 -1.26 -5.00 116.66 107.06 1gio n ARG 22 Ca 0.00 0.75 0.00 0.00 -0.77 0.00 0.00 57.85 57.83 1gio n ARG 22 Cb 0.00 -5.52 0.00 0.00 -1.02 0.00 0.00 32.46 25.92 1gio n ARG 22 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1gio n ASN 23 N -2.67 1.51 -0.10 0.55 5.15 -1.26 -5.00 115.26 113.43 1gio n ASN 23 Ca -0.09 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.77 1gio n ASN 23 Cb 0.59 0.00 -0.15 0.00 -0.53 0.00 0.00 39.78 39.69 1gio n ASN 23 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 1gio n ASP 24 N 0.00 0.41 0.17 1.20 5.75 -1.26 -3.85 116.55 118.97 1gio n ASP 24 Ca 0.00 -0.03 0.05 0.00 -0.01 0.00 0.00 54.79 54.81 1gio n ASP 24 Cb 0.00 0.74 0.16 0.00 -1.03 0.00 0.00 41.12 40.98 1gio n ASP 24 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1gio h GLU 25 N 0.00 0.00 0.45 0.11 4.81 -1.97 -1.78 114.58 116.21 1gio h GLU 25 Ca -0.55 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.67 1gio h GLU 25 Cb 2.17 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.53 1gio h GLU 25 CO 0.01 0.39 -0.50 -0.92 -0.73 0.00 0.00 179.01 177.26 1gio h TYR 26 N 0.00 -1.39 0.00 0.92 3.20 -1.94 -2.50 116.97 115.25 1gio h TYR 26 Ca -0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1gio h TYR 26 Cb 1.17 0.55 0.00 0.00 1.54 0.00 0.00 36.73 39.99 1gio h TYR 26 CO 0.00 -0.65 0.00 0.00 -1.64 0.00 0.00 178.16 175.87 1gio h PHE 28 N 0.00 0.35 0.00 0.00 3.57 -1.34 -2.21 116.94 117.32 1gio h PHE 28 Ca 0.00 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.41 1gio h PHE 28 Cb 0.89 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.55 1gio h PHE 28 CO 0.00 0.60 -0.05 -0.91 -2.23 0.00 0.00 178.31 175.71 1gio h ASN 29 N 0.01 0.00 -0.08 0.41 2.35 -1.20 -1.65 115.58 115.41 1gio h ASN 29 Ca 0.04 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.60 1gio h ASN 29 Cb 0.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.86 1gio h ASN 29 CO 0.02 0.05 -0.65 0.24 -1.65 0.00 0.00 177.43 175.44 1gio h MET 30 N 0.00 0.70 0.00 0.81 2.86 -1.20 -2.36 114.93 115.74 1gio h MET 30 Ca -0.00 -0.50 -0.03 0.00 -2.06 0.00 0.00 59.70 57.11 1gio h MET 30 Cb 1.04 0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.77 1gio h MET 30 CO 0.01 1.12 -0.16 0.52 1.06 0.00 0.00 176.91 179.45 1gio h MET 31 N 0.51 0.00 -0.35 1.72 2.86 -1.25 -1.87 114.93 116.55 1gio h MET 31 Ca -0.01 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.46 1gio h MET 31 Cb 1.24 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.89 1gio h MET 31 CO 0.13 0.16 -0.42 0.87 1.06 0.00 0.00 176.91 178.71 1gio h LYS 32 N 0.00 0.88 0.00 1.72 1.57 -1.29 -2.20 116.57 117.25 1gio h LYS 32 Ca -0.00 -0.48 -0.02 0.00 -1.87 0.00 0.00 60.65 58.28 1gio h LYS 32 Cb 1.10 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 1gio h LYS 32 CO 0.02 1.12 -0.09 -0.91 -0.57 0.00 0.00 179.45 179.03 1gio h ASN 33 N 0.71 0.00 0.87 0.86 4.21 -1.11 -2.79 115.58 118.33 1gio h ASN 33 Ca 0.05 0.00 -0.21 0.00 1.21 0.00 0.00 56.30 57.35 1gio h ASN 33 Cb 1.01 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.17 1gio h ASN 33 CO 0.10 0.09 -1.21 0.03 -1.29 0.00 0.00 177.43 175.15 1gio h ARG 34 N 0.00 0.00 -4.14 0.81 2.47 -1.34 -3.49 114.38 108.69 1gio h ARG 34 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1gio h ARG 34 Cb 0.72 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.04 1gio h ARG 34 CO 0.01 0.66 -0.12 -2.13 0.56 0.00 0.00 179.97 178.96 1gio n ARG 35 N -3.17 -0.89 -1.14 0.04 0.63 -0.92 -5.00 116.66 106.22 1gio n ARG 35 Ca -0.06 1.13 -0.02 0.00 -0.92 0.00 0.00 57.85 57.98 1gio n ARG 35 Cb 0.93 -3.57 -0.03 0.00 0.45 0.00 0.00 32.46 30.24 1gio n ARG 35 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1gio n LEU 36 N -0.92 -0.13 -3.24 6.15 0.00 -0.87 -4.89 117.00 113.09 1gio n LEU 36 Ca 0.03 -1.89 -0.32 0.00 0.00 0.00 0.00 56.01 53.82 1gio n LEU 36 Cb 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 43.42 43.77 1gio n LEU 36 CO 0.25 1.03 0.63 0.41 0.00 0.00 0.00 177.39 179.71 1gio n THR 37 N 0.19 4.20 -3.92 1.96 -1.04 -1.25 -4.69 114.28 109.73 1gio n THR 37 Ca -0.12 -5.73 -0.28 0.00 -2.04 0.00 0.00 64.05 55.88 1gio n THR 37 Cb 0.86 -1.50 -0.16 0.00 -1.82 0.00 0.00 70.33 67.70 1gio n THR 37 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 1gio s ARG 38 N -3.72 1.60 -0.02 -2.82 3.52 -1.26 -4.48 118.95 111.77 1gio s ARG 38 Ca 0.45 -0.50 -0.23 0.00 -0.13 0.00 0.00 55.73 55.32 1gio s ARG 38 Cb 0.24 -1.96 -0.16 0.00 -1.56 0.00 0.00 34.95 31.51 1gio s ARG 38 CO -0.12 -0.38 1.05 -1.00 -0.81 0.00 0.00 175.30 174.05 1gio h PRO 39 N 8.11 -0.36 0.00 5.12 0.13 -1.91 -3.37 132.00 139.72 1gio h PRO 39 Ca -0.27 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1gio h PRO 39 Cb 1.12 0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1gio h PRO 39 CO 0.42 -0.02 0.00 0.00 -0.23 0.00 0.00 178.00 178.18 1gio s LYS 41 N 0.00 3.47 0.00 0.00 0.00 -1.26 -4.87 119.74 117.09 1gio s LYS 41 Ca 0.00 1.59 0.00 0.00 0.00 0.00 0.00 55.97 57.56 1gio s LYS 41 Cb 0.00 -2.06 0.00 0.00 0.00 0.00 0.00 37.83 35.77 1gio s LYS 41 CO 0.00 -0.75 0.00 -3.47 0.00 0.00 0.00 175.35 171.13 1gio n ASP 42 N -1.15 0.00 -2.59 0.03 2.03 -1.26 -4.76 116.55 108.85 1gio n ASP 42 Ca 0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.42 1gio n ASP 42 Cb 0.51 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 1gio n ASP 42 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1gio n ARG 43 N 0.00 -0.84 -3.61 -0.67 1.85 -1.22 -4.90 116.66 107.27 1gio n ARG 43 Ca 0.00 0.92 -0.16 0.00 -1.00 0.00 0.00 57.85 57.61 1gio n ARG 43 Cb 0.00 -0.71 -0.07 0.00 -1.05 0.00 0.00 32.46 30.63 1gio n ARG 43 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 1gio s ASN 44 N -0.22 -0.58 -0.31 2.89 -0.87 -0.89 -5.01 114.94 109.95 1gio s ASN 44 Ca 0.00 0.83 -0.13 0.00 -1.57 0.00 0.00 52.86 51.99 1gio s ASN 44 Cb 0.00 0.79 -0.03 0.00 -0.02 0.00 0.00 41.25 41.99 1gio s ASN 44 CO 0.00 -0.43 0.27 -0.89 -2.57 0.00 0.00 177.10 173.48 1gio s THR 45 N -0.63 5.25 0.38 1.60 2.01 -1.26 -2.01 115.64 120.97 1gio s THR 45 Ca -0.07 0.07 -0.19 0.00 0.31 0.00 0.00 61.69 61.81 1gio s THR 45 Cb -0.02 -3.68 -0.10 0.00 0.01 0.00 0.00 72.50 68.70 1gio s THR 45 CO 0.06 0.07 0.86 -0.36 -0.69 0.00 0.00 174.62 174.55 1gio s PHE 46 N 1.85 3.36 -0.09 4.92 0.08 -0.56 -4.46 117.98 123.09 1gio s PHE 46 Ca 0.09 1.46 0.01 0.00 0.12 0.00 0.00 56.93 58.61 1gio s PHE 46 Cb -0.17 -2.72 0.02 0.00 -0.57 0.00 0.00 43.02 39.58 1gio s PHE 46 CO 0.11 0.00 -0.10 0.42 -0.10 0.00 0.00 175.22 175.54 1gio s ILE 47 N -2.05 1.10 0.11 0.64 -1.09 -1.26 -1.68 121.20 116.96 1gio s ILE 47 Ca 0.58 -0.41 0.08 0.00 -2.23 0.00 0.00 60.65 58.66 1gio s ILE 47 Cb -0.10 -1.05 -0.04 0.00 -1.58 0.00 0.00 42.46 39.69 1gio s ILE 47 CO 0.15 0.36 -0.12 -1.00 -1.23 0.00 0.00 174.94 173.10 1gio s HIS 48 N 1.07 2.68 -5.00 3.97 3.76 0.12 -1.72 115.29 120.17 1gio s HIS 48 Ca -0.07 -0.19 0.00 0.00 -0.15 0.00 0.00 55.06 54.66 1gio s HIS 48 Cb -0.14 -1.41 0.00 0.00 1.11 0.00 0.00 32.58 32.14 1gio s HIS 48 CO -0.01 0.41 0.00 0.41 -0.85 0.00 0.00 174.74 174.70 1gio n GLY 49 N 0.75 -0.27 3.74 -2.22 0.00 -1.26 -2.08 105.19 103.84 1gio n GLY 49 Ca -0.14 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 1gio n GLY 49 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gio s ASN 50 N -1.23 7.50 0.23 1.61 -0.87 -1.26 -4.95 114.94 115.97 1gio s ASN 50 Ca 0.00 1.96 -0.01 0.00 -1.57 0.00 0.00 52.86 53.23 1gio s ASN 50 Cb 0.00 -2.60 0.23 0.00 -0.02 0.00 0.00 41.25 38.86 1gio s ASN 50 CO 0.00 -0.00 1.61 0.50 -2.57 0.00 0.00 177.10 176.64 1gio h LYS 51 N 4.71 0.57 0.00 -0.60 3.64 -1.98 -1.84 116.57 121.07 1gio h LYS 51 Ca -0.44 -0.28 -0.07 0.00 -1.27 0.00 0.00 60.65 58.59 1gio h LYS 51 Cb 1.21 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1gio h LYS 51 CO 0.70 0.86 -0.35 -0.97 -2.27 0.00 0.00 179.45 177.41 1gio h ASN 52 N 0.48 0.00 1.06 4.20 -0.73 -2.00 -2.27 115.58 116.32 1gio h ASN 52 Ca 0.05 0.00 -0.19 0.00 1.87 0.00 0.00 56.30 58.02 1gio h ASN 52 Cb 0.87 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 39.43 1gio h ASN 52 CO 0.07 0.35 -0.95 -0.78 -0.37 0.00 0.00 177.43 175.75 1gio h ASP 53 N 0.00 0.00 -0.45 1.15 3.58 -1.76 -2.20 116.42 116.73 1gio h ASP 53 Ca -0.00 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 1gio h ASP 53 Cb 0.76 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.79 1gio h ASP 53 CO 0.05 0.88 0.21 0.40 -2.88 0.00 0.00 179.24 177.90 1gio h ILE 54 N 0.00 1.19 -0.34 2.25 5.03 -1.02 -2.58 117.51 122.04 1gio h ILE 54 Ca -0.03 -0.54 -0.07 0.00 -0.12 0.00 0.00 64.86 64.10 1gio h ILE 54 Cb 1.70 0.70 -0.01 0.00 -3.03 0.00 0.00 36.82 36.18 1gio h ILE 54 CO 0.11 0.21 -0.08 0.07 -0.68 0.00 0.00 178.15 177.78 1gio h LYS 55 N 0.59 0.65 -0.98 2.37 2.10 -1.40 -2.50 116.57 117.39 1gio h LYS 55 Ca 0.16 -0.25 -0.02 0.00 -2.00 0.00 0.00 60.65 58.54 1gio h LYS 55 Cb 0.13 -0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 31.41 1gio h LYS 55 CO -0.02 0.81 0.02 0.00 -2.00 0.00 0.00 179.45 178.27 1gio n ALA 56 N -2.42 2.68 0.07 0.07 0.00 -0.83 -2.08 120.51 117.99 1gio n ALA 56 Ca -0.02 -0.19 -0.11 0.00 0.00 0.00 0.00 53.44 53.11 1gio n ALA 56 Cb 0.33 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.74 1gio n ALA 56 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1gio h ILE 57 N 0.23 1.44 -0.55 0.00 2.04 -1.02 -3.31 117.51 116.34 1gio h ILE 57 Ca 0.02 -2.49 -0.35 0.00 1.00 0.00 0.00 64.86 63.05 1gio h ILE 57 Cb 0.85 2.41 -0.16 0.00 -0.74 0.00 0.00 36.82 39.18 1gio h ILE 57 CO 0.06 0.74 0.44 0.00 0.00 0.00 0.00 178.15 179.39 1gio h GLU 59 N 1.22 -0.19 0.00 0.00 4.57 -1.76 -3.45 114.58 114.97 1gio h GLU 59 Ca 0.34 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.53 1gio h GLU 59 Cb 1.27 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 1gio h GLU 59 CO 0.79 0.24 0.00 -0.25 -1.18 0.00 0.00 179.01 178.61 1gio n ASP 60 N -4.89 0.00 -0.09 1.04 8.00 -1.25 -4.86 116.55 114.50 1gio n ASP 60 Ca -0.07 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.25 1gio n ASP 60 Cb 0.25 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 41.22 1gio n ASP 60 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1gio n ARG 61 N 0.00 0.68 -0.12 -1.24 3.00 -1.26 -2.47 116.66 115.25 1gio n ARG 61 Ca 0.00 0.16 0.09 0.00 -0.01 0.00 0.00 57.85 58.10 1gio n ARG 61 Cb 0.00 -1.57 0.31 0.00 0.00 0.00 0.00 32.46 31.19 1gio n ARG 61 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1gio n ASN 62 N -3.25 1.84 0.00 0.55 2.85 -1.26 -4.23 115.26 111.77 1gio n ASN 62 Ca -0.40 -1.80 0.00 0.00 -0.11 0.00 0.00 54.58 52.26 1gio n ASN 62 Cb 1.02 -0.15 0.00 0.00 1.24 0.00 0.00 39.78 41.89 1gio n ASN 62 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1gio n GLY 63 N 1.14 0.52 0.00 8.20 0.00 -1.12 -3.15 105.19 110.77 1gio n GLY 63 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1gio n GLY 63 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1gio n GLN 64 N 0.00 0.00 -2.69 1.61 6.02 -0.53 -3.72 117.38 118.07 1gio n GLN 64 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 1gio n GLN 64 Cb 0.00 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.23 1gio n GLN 64 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1gio s PRO 65 N -1.65 4.43 -0.09 -1.09 0.04 -1.24 -1.57 135.00 133.83 1gio s PRO 65 Ca 0.00 1.39 -0.02 0.00 0.04 0.00 0.00 61.00 62.41 1gio s PRO 65 Cb 0.00 -3.53 -0.03 0.00 0.04 0.00 0.00 34.50 30.97 1gio s PRO 65 CO 0.00 -0.29 -0.02 -0.47 0.04 0.00 0.00 177.00 176.26 1gio s TYR 66 N 1.92 3.10 -0.20 0.56 5.04 -0.82 -4.72 117.35 122.23 1gio s TYR 66 Ca 0.49 0.11 -0.00 0.00 -2.44 0.00 0.00 57.07 55.22 1gio s TYR 66 Cb -0.18 -1.80 0.00 0.00 0.35 0.00 0.00 41.96 40.33 1gio s TYR 66 CO 0.19 0.38 0.00 0.54 -1.34 0.00 0.00 175.55 175.33 1gio n ARG 67 N 2.33 -0.99 -2.04 4.97 5.12 -1.26 -1.25 116.66 123.53 1gio n ARG 67 Ca -0.18 -0.01 -0.14 0.00 -1.93 0.00 0.00 57.85 55.59 1gio n ARG 67 Cb 0.53 -0.43 -0.03 0.00 -1.16 0.00 0.00 32.46 31.38 1gio n ARG 67 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1gio n GLY 68 N -1.21 0.19 1.18 -0.13 0.00 -1.26 -4.47 105.19 99.48 1gio n GLY 68 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1gio n GLY 68 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gio n ASP 69 N -1.36 0.00 -4.18 1.61 8.00 -1.09 -5.13 116.55 114.40 1gio n ASP 69 Ca -0.15 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.16 1gio n ASP 69 Cb 0.56 0.21 0.09 0.00 -0.02 0.00 0.00 41.12 41.96 1gio n ASP 69 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1gio n LEU 70 N -2.09 0.00 -3.91 0.64 7.99 -0.38 -4.25 117.00 115.00 1gio n LEU 70 Ca 0.00 -1.82 -0.19 0.00 -0.01 0.00 0.00 56.01 54.00 1gio n LEU 70 Cb 0.00 -0.51 -0.16 0.00 -0.11 0.00 0.00 43.42 42.64 1gio n LEU 70 CO 0.00 -0.87 -0.41 -0.13 -1.51 0.00 0.00 177.39 174.47 1gio s ARG 71 N -4.59 0.70 -0.16 3.23 1.81 -0.68 -1.94 118.95 117.32 1gio s ARG 71 Ca 0.55 -0.13 -0.11 0.00 -1.72 0.00 0.00 55.73 54.32 1gio s ARG 71 Cb -0.03 -0.72 -0.05 0.00 -0.45 0.00 0.00 34.95 33.70 1gio s ARG 71 CO 0.36 -0.02 0.20 -1.50 -0.68 0.00 0.00 175.30 173.66 1gio s ILE 72 N 0.62 5.37 0.87 1.52 -1.16 -0.61 -1.40 121.20 126.42 1gio s ILE 72 Ca -0.08 0.35 -0.11 0.00 -0.51 0.00 0.00 60.65 60.29 1gio s ILE 72 Cb -0.11 -3.52 0.11 0.00 0.61 0.00 0.00 42.46 39.55 1gio s ILE 72 CO 0.00 0.47 1.09 -0.94 -2.81 0.00 0.00 174.94 172.76 1gio s SER 73 N -0.02 3.72 -0.05 4.50 1.04 -0.60 -1.45 113.70 120.85 1gio s SER 73 Ca 0.13 1.60 -0.00 0.00 0.48 0.00 0.00 55.95 58.16 1gio s SER 73 Cb -0.12 -2.28 -0.00 0.00 0.10 0.00 0.00 66.02 63.72 1gio s SER 73 CO 0.02 -2.50 -0.01 0.50 0.98 0.00 0.00 173.24 172.24 1gio h LYS 74 N -1.45 0.00 -6.94 4.02 3.64 -1.63 -3.44 116.57 110.77 1gio h LYS 74 Ca -0.48 0.00 -0.47 0.00 -1.27 0.00 0.00 60.65 58.43 1gio h LYS 74 Cb 1.27 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 1gio h LYS 74 CO 0.53 0.00 0.24 -1.12 -2.27 0.00 0.00 179.45 176.83 1gio s SER 75 N -4.15 6.79 -0.12 4.20 0.01 -1.26 -4.96 113.70 114.21 1gio s SER 75 Ca -0.00 1.48 -0.30 0.00 1.31 0.00 0.00 55.95 58.44 1gio s SER 75 Cb 0.00 -2.46 -0.01 0.00 0.21 0.00 0.00 66.02 63.76 1gio s SER 75 CO 0.01 -0.34 1.07 -1.61 0.41 0.00 0.00 173.24 172.77 1gio s GLU 76 N -3.31 4.37 0.02 12.44 8.01 -1.26 -4.59 118.70 134.37 1gio s GLU 76 Ca 0.58 1.47 -0.02 0.00 0.01 0.00 0.00 54.97 57.01 1gio s GLU 76 Cb -0.10 -3.57 -0.04 0.00 -4.31 0.00 0.00 34.13 26.11 1gio s GLU 76 CO 0.19 -0.42 0.20 -0.06 0.01 0.00 0.00 175.26 175.18 1gio s PHE 77 N 2.34 3.54 -0.46 1.61 0.40 -0.78 -4.81 117.98 119.83 1gio s PHE 77 Ca 0.50 0.33 -0.21 0.00 -0.60 0.00 0.00 56.93 56.95 1gio s PHE 77 Cb -0.19 -1.82 0.03 0.00 0.51 0.00 0.00 43.02 41.55 1gio s PHE 77 CO 0.17 0.62 0.68 -1.14 0.70 0.00 0.00 175.22 176.24 1gio s GLN 78 N -2.17 3.27 -0.16 0.44 -0.44 -0.88 -1.92 119.66 117.80 1gio s GLN 78 Ca 0.31 -0.42 -0.07 0.00 -2.50 0.00 0.00 55.36 52.67 1gio s GLN 78 Cb -0.13 -3.98 -0.04 0.00 -1.64 0.00 0.00 33.01 27.22 1gio s GLN 78 CO 0.22 -1.10 0.08 0.96 0.50 0.00 0.00 175.29 175.95 1gio s ILE 79 N 2.93 4.95 -0.34 -2.34 -0.00 -0.40 -0.70 121.20 125.29 1gio s ILE 79 Ca 0.23 0.01 -0.08 0.00 -0.00 0.00 0.00 60.65 60.81 1gio s ILE 79 Cb -0.15 -3.20 0.03 0.00 -0.00 0.00 0.00 42.46 39.14 1gio s ILE 79 CO 0.18 0.51 0.13 -0.89 -0.00 0.00 0.00 174.94 174.87 1gio s THR 80 N -0.07 4.08 -0.40 8.37 2.01 -0.68 -1.65 115.64 127.30 1gio s THR 80 Ca 0.07 -0.96 -0.21 0.00 0.31 0.00 0.00 61.69 60.91 1gio s THR 80 Cb -0.12 -3.26 0.02 0.00 0.01 0.00 0.00 72.50 69.15 1gio s THR 80 CO 0.01 -0.15 0.67 -0.63 -0.69 0.00 0.00 174.62 173.83 1gio s ILE 81 N 1.47 4.82 -0.41 1.82 1.01 -0.88 -1.49 121.20 127.53 1gio s ILE 81 Ca 0.00 0.38 -0.17 0.00 0.00 0.00 0.00 60.65 60.86 1gio s ILE 81 Cb -0.19 -4.17 0.02 0.00 0.01 0.00 0.00 42.46 38.13 1gio s ILE 81 CO 0.04 -0.50 0.40 0.00 0.00 0.00 0.00 174.94 174.88 1gio s LYS 83 N 2.02 2.64 0.25 0.00 2.20 -0.93 -2.09 119.74 123.83 1gio s LYS 83 Ca 0.10 -1.11 -0.30 0.00 -0.36 0.00 0.00 55.97 54.31 1gio s LYS 83 Cb -0.17 -3.02 -0.09 0.00 -1.51 0.00 0.00 37.83 33.03 1gio s LYS 83 CO 0.13 -0.48 1.32 -1.58 -0.36 0.00 0.00 175.35 174.38 1gio s HIS 84 N 1.27 3.17 0.80 4.03 5.65 -1.26 -0.85 115.29 128.11 1gio s HIS 84 Ca -0.02 1.27 -0.11 0.00 0.25 0.00 0.00 55.06 56.45 1gio s HIS 84 Cb -0.18 -3.64 0.08 0.00 -1.18 0.00 0.00 32.58 27.65 1gio s HIS 84 CO -0.04 -1.94 1.10 0.15 -0.65 0.00 0.00 174.74 173.36 1gio s LYS 85 N -0.73 1.99 0.51 2.88 -0.14 -1.24 -4.83 119.74 118.18 1gio s LYS 85 Ca 0.54 1.14 -0.19 0.00 -1.36 0.00 0.00 55.97 56.10 1gio s LYS 85 Cb -0.38 -1.87 -0.07 0.00 -1.68 0.00 0.00 37.83 33.83 1gio s LYS 85 CO 0.43 -1.83 1.05 0.20 -0.76 0.00 0.00 175.35 174.45 1gio s GLY 86 N -3.34 2.45 0.00 -3.33 0.00 -1.26 -3.90 107.32 97.94 1gio s GLY 86 Ca 0.62 0.58 0.00 0.00 0.00 0.00 0.00 44.72 45.92 1gio s GLY 86 CO 0.56 0.91 0.00 0.61 0.00 0.00 0.00 173.10 175.18 1gio n GLY 87 N -0.36 0.86 3.52 0.20 0.00 -1.26 -5.03 105.19 103.12 1gio n GLY 87 Ca 0.09 -0.26 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 1gio n GLY 87 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gio s SER 88 N -2.26 6.35 0.00 1.61 0.15 -1.25 -4.76 113.70 113.54 1gio s SER 88 Ca 0.00 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.32 1gio s SER 88 Cb 0.00 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.88 1gio s SER 88 CO 0.00 -1.17 0.00 -1.20 1.20 0.00 0.00 173.24 172.07 1gio n SER 89 N 7.31 0.00 -4.64 5.45 7.64 -1.26 -5.01 113.62 123.11 1gio n SER 89 Ca 0.02 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.66 1gio n SER 89 Cb 0.47 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.60 1gio n SER 89 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gio s ARG 90 N 0.53 2.19 0.47 1.43 1.70 -1.26 -4.09 118.95 119.93 1gio s ARG 90 Ca 0.00 -1.55 -0.22 0.00 -0.47 0.00 0.00 55.73 53.48 1gio s ARG 90 Cb 0.00 -2.07 -0.07 0.00 -0.57 0.00 0.00 34.95 32.24 1gio s ARG 90 CO 0.00 0.26 1.18 -2.14 -1.08 0.00 0.00 175.30 173.52 1gio s PRO 91 N -3.70 3.67 0.03 3.89 0.02 -1.26 -4.37 135.00 133.29 1gio s PRO 91 Ca 0.33 1.79 -0.26 0.00 0.02 0.00 0.00 61.00 62.89 1gio s PRO 91 Cb -0.04 -2.36 -0.05 0.00 0.02 0.00 0.00 34.50 32.07 1gio s PRO 91 CO 0.20 -0.63 0.79 -1.25 -0.33 0.00 0.00 177.00 175.78 1gio s PRO 92 N -2.77 4.51 -0.05 5.54 0.04 -1.26 -5.17 135.00 135.84 1gio s PRO 92 Ca 0.65 1.10 0.06 0.00 0.04 0.00 0.00 61.00 62.85 1gio s PRO 92 Cb -0.29 -3.38 -0.01 0.00 0.04 0.00 0.00 34.50 30.86 1gio s PRO 92 CO 0.35 0.22 -0.22 0.00 0.04 0.00 0.00 177.00 177.39 1gio s ARG 94 N -0.14 2.69 0.33 0.00 1.81 -1.26 -4.90 118.95 117.48 1gio s ARG 94 Ca -0.02 -0.58 -0.00 0.00 -1.72 0.00 0.00 55.73 53.40 1gio s ARG 94 Cb -0.12 -2.55 -0.04 0.00 -0.45 0.00 0.00 34.95 31.79 1gio s ARG 94 CO 0.02 0.65 0.54 0.71 -0.68 0.00 0.00 175.30 176.55 1gio s TYR 95 N -0.82 3.50 -0.97 -0.53 1.51 -1.26 -3.69 117.35 115.10 1gio s TYR 95 Ca 0.13 0.39 -0.07 0.00 -1.01 0.00 0.00 57.07 56.51 1gio s TYR 95 Cb -0.11 -1.93 0.24 0.00 -0.11 0.00 0.00 41.96 40.06 1gio s TYR 95 CO 0.02 0.14 0.91 0.20 -1.11 0.00 0.00 175.55 175.70 1gio s GLY 96 N -3.87 3.05 -0.49 0.71 0.00 -0.03 -4.76 107.32 101.94 1gio s GLY 96 Ca 0.40 -3.73 -0.23 0.00 0.00 0.00 0.00 44.72 41.16 1gio s GLY 96 CO 0.35 1.26 0.80 0.00 0.00 0.00 0.00 173.10 175.51 1gio s ALA 97 N -1.02 3.27 -0.21 3.20 0.00 -1.26 -2.20 121.76 123.54 1gio s ALA 97 Ca 0.27 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 51.03 1gio s ALA 97 Cb -0.10 -3.53 0.05 0.00 0.00 0.00 0.00 23.12 19.54 1gio s ALA 97 CO -0.09 -2.08 -0.08 0.99 0.00 0.00 0.00 175.76 174.50 1gio s THR 98 N 3.37 1.56 0.18 0.00 2.01 -0.67 -4.88 115.64 117.21 1gio s THR 98 Ca 0.27 -1.04 0.03 0.00 0.31 0.00 0.00 61.69 61.26 1gio s THR 98 Cb -0.13 -1.71 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 1gio s THR 98 CO 0.20 0.08 0.31 -1.83 -0.69 0.00 0.00 174.62 172.69 1gio s GLU 99 N 1.41 3.45 0.15 4.92 1.03 -1.26 -2.08 118.70 126.33 1gio s GLU 99 Ca -0.03 -0.60 -0.14 0.00 0.03 0.00 0.00 54.97 54.23 1gio s GLU 99 Cb -0.17 -2.93 0.02 0.00 -0.80 0.00 0.00 34.13 30.25 1gio s GLU 99 CO -0.07 0.48 0.40 0.34 -1.33 0.00 0.00 175.26 175.08 1gio s ASP 100 N -3.39 -0.16 -0.21 0.83 2.15 -0.66 -4.96 116.67 110.27 1gio s ASP 100 Ca 0.35 -0.50 0.02 0.00 0.43 0.00 0.00 52.55 52.84 1gio s ASP 100 Cb -0.11 0.49 0.04 0.00 -0.30 0.00 0.00 42.92 43.04 1gio s ASP 100 CO 0.29 -0.91 -0.14 -0.55 -0.17 0.00 0.00 175.17 173.69 1gio s SER 101 N -2.86 3.67 0.22 -0.34 0.15 -1.26 -1.28 113.70 111.99 1gio s SER 101 Ca 0.08 -0.99 -0.23 0.00 0.70 0.00 0.00 55.95 55.51 1gio s SER 101 Cb 0.02 -1.42 0.04 0.00 -1.71 0.00 0.00 66.02 62.95 1gio s SER 101 CO -0.07 -0.11 0.80 0.00 1.20 0.00 0.00 173.24 175.06 1gio s ARG 102 N 1.26 1.51 0.26 5.44 1.70 -0.81 -4.93 118.95 123.38 1gio s ARG 102 Ca -0.02 -0.81 -0.30 0.00 -0.47 0.00 0.00 55.73 54.14 1gio s ARG 102 Cb -0.16 0.53 -0.09 0.00 -0.57 0.00 0.00 34.95 34.65 1gio s ARG 102 CO -0.09 -0.69 1.23 0.14 -1.08 0.00 0.00 175.30 174.82 1gio s VAL 103 N -3.65 3.19 0.44 4.99 -7.23 -1.26 -1.86 120.40 115.02 1gio s VAL 103 Ca 0.11 1.10 0.07 0.00 -1.81 0.00 0.00 61.98 61.45 1gio s VAL 103 Cb -0.04 -3.70 -0.02 0.00 0.56 0.00 0.00 36.38 33.18 1gio s VAL 103 CO 0.03 0.22 0.36 0.27 -0.31 0.00 0.00 175.10 175.68 1gio s ILE 104 N -0.62 2.47 -0.05 -0.62 -4.36 -1.26 -4.95 121.20 111.81 1gio s ILE 104 Ca 0.50 -1.40 0.05 0.00 -0.26 0.00 0.00 60.65 59.54 1gio s ILE 104 Cb -0.36 -2.87 -0.01 0.00 1.25 0.00 0.00 42.46 40.48 1gio s ILE 104 CO 0.43 0.00 -0.21 0.54 0.24 0.00 0.00 174.94 175.94 1gio s VAL 105 N -2.53 1.73 0.01 8.37 0.11 -1.26 -1.56 120.40 125.27 1gio s VAL 105 Ca 0.46 -0.88 0.01 0.00 -2.93 0.00 0.00 61.98 58.63 1gio s VAL 105 Cb -0.02 -1.48 -0.01 0.00 -1.53 0.00 0.00 36.38 33.35 1gio s VAL 105 CO 0.27 0.49 -0.03 0.54 -3.33 0.00 0.00 175.10 173.04 1gio s VAL 106 N -0.01 0.20 -0.08 2.04 0.11 -0.49 -1.53 120.40 120.63 1gio s VAL 106 Ca -0.05 -0.29 -0.10 0.00 -2.93 0.00 0.00 61.98 58.61 1gio s VAL 106 Cb -0.13 -0.21 -0.05 0.00 -1.53 0.00 0.00 36.38 34.47 1gio s VAL 106 CO 0.03 -0.06 0.24 -0.83 -3.33 0.00 0.00 175.10 171.16 1gio s GLY 107 N -0.37 2.27 0.04 6.54 0.00 0.52 -1.68 107.32 114.64 1gio s GLY 107 Ca -0.02 -0.48 0.01 0.00 0.00 0.00 0.00 44.72 44.23 1gio s GLY 107 CO -0.00 -0.14 0.09 0.00 0.00 0.00 0.00 173.10 173.05 1gio s GLU 109 N -2.09 1.49 0.00 0.00 0.41 -0.83 -4.75 118.70 112.92 1gio s GLU 109 Ca 0.27 -0.33 0.00 0.00 -0.41 0.00 0.00 54.97 54.49 1gio s GLU 109 Cb -0.12 -1.28 0.00 0.00 -1.78 0.00 0.00 34.13 30.95 1gio s GLU 109 CO 0.19 -0.01 0.00 0.09 -0.49 0.00 0.00 175.26 175.04 1gio n ASN 110 N 3.91 0.00 0.00 -0.19 3.02 -1.26 -2.26 115.26 118.48 1gio n ASN 110 Ca -0.23 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.32 1gio n ASN 110 Cb 0.51 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.68 1gio n ASN 110 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gio n GLY 111 N -0.69 1.67 3.06 7.41 0.00 -1.26 -5.11 105.19 110.27 1gio n GLY 111 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1gio n GLY 111 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1gio s LEU 112 N 0.00 2.06 -0.01 0.99 2.96 -0.96 -4.81 118.68 118.92 1gio s LEU 112 Ca 0.00 -0.26 -0.30 0.00 -0.22 0.00 0.00 54.13 53.35 1gio s LEU 112 Cb 0.00 -0.52 -0.03 0.00 0.50 0.00 0.00 46.19 46.14 1gio s LEU 112 CO 0.00 0.09 0.97 -2.84 -1.32 0.00 0.00 176.35 173.25 1gio s PRO 113 N -0.49 4.55 0.08 0.98 0.02 -1.26 -1.97 135.00 136.91 1gio s PRO 113 Ca 0.03 1.40 0.00 0.00 0.02 0.00 0.00 61.00 62.45 1gio s PRO 113 Cb -0.05 -3.46 0.00 0.00 0.02 0.00 0.00 34.50 31.01 1gio s PRO 113 CO -0.00 -0.06 0.00 0.28 -0.33 0.00 0.00 177.00 176.89 1gio n VAL 114 N 3.92 0.69 -3.74 3.83 0.31 -0.97 -4.91 118.33 117.47 1gio n VAL 114 Ca 0.06 0.23 -0.36 0.00 -0.01 0.00 0.00 64.34 64.26 1gio n VAL 114 Cb 0.51 -1.43 -0.07 0.00 -0.91 0.00 0.00 33.84 31.94 1gio n VAL 114 CO 0.00 0.00 0.00 -2.28 -1.32 0.00 0.00 176.83 173.23 1gio s HIS 115 N -2.00 3.50 -0.21 3.52 5.65 -0.82 -4.92 115.29 120.02 1gio s HIS 115 Ca 0.00 0.48 -0.08 0.00 0.25 0.00 0.00 55.06 55.71 1gio s HIS 115 Cb 0.00 -2.12 -0.04 0.00 -1.18 0.00 0.00 32.58 29.24 1gio s HIS 115 CO 0.00 0.46 0.10 0.12 -0.65 0.00 0.00 174.74 174.77 1gio s PHE 116 N -0.20 3.24 -0.07 3.88 5.36 -1.26 -0.36 117.98 128.57 1gio s PHE 116 Ca 0.13 0.04 -0.23 0.00 -0.96 0.00 0.00 56.93 55.91 1gio s PHE 116 Cb -0.12 -2.17 -0.04 0.00 -0.34 0.00 0.00 43.02 40.35 1gio s PHE 116 CO 0.02 0.04 0.66 -0.51 -1.46 0.00 0.00 175.22 173.97 1gio s ASP 117 N 0.81 6.94 0.00 6.13 1.11 -0.58 -4.94 116.67 126.14 1gio s ASP 117 Ca 0.05 1.13 0.07 0.00 0.18 0.00 0.00 52.55 53.98 1gio s ASP 117 Cb -0.13 -2.39 0.02 0.00 1.07 0.00 0.00 42.92 41.48 1gio s ASP 117 CO 0.02 -0.10 0.59 -0.62 1.18 0.00 0.00 175.17 176.25 1gio n GLU 118 N 3.75 1.51 0.00 8.23 1.02 -1.26 -4.20 120.64 129.70 1gio n GLU 118 Ca -0.02 -0.64 0.00 0.00 -0.02 0.00 0.00 57.16 56.47 1gio n GLU 118 Cb 0.51 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.90 1gio n GLU 118 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1gio n SER 119 N -0.07 0.00 -2.65 1.62 7.64 -1.26 -5.05 113.62 113.84 1gio n SER 119 Ca 0.03 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.90 1gio n SER 119 Cb 0.16 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.34 1gio n SER 119 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1gio n PHE 120 N -0.10 -4.09 -2.51 1.43 7.35 -1.26 -4.92 117.46 113.36 1gio n PHE 120 Ca 0.00 2.00 -0.42 0.00 -0.76 0.00 0.00 57.45 58.27 1gio n PHE 120 Cb 0.00 -3.95 -0.03 0.00 0.35 0.00 0.00 39.48 35.85 1gio n PHE 120 CO 0.00 0.00 0.00 -1.50 -0.76 0.00 0.00 176.76 174.50 1gio s ILE 121 N -1.31 4.34 0.23 -2.13 2.07 -1.26 -5.03 121.20 118.10 1gio s ILE 121 Ca -0.09 1.67 0.07 0.00 -1.41 0.00 0.00 60.65 60.89 1gio s ILE 121 Cb 0.01 -4.07 -0.04 0.00 0.13 0.00 0.00 42.46 38.49 1gio s ILE 121 CO 0.78 0.05 0.14 0.42 -1.91 0.00 0.00 174.94 174.42 1gio s THR 122 N 1.73 4.28 0.67 4.00 -4.23 -1.26 -5.12 115.64 115.71 1gio s THR 122 Ca 0.55 -1.39 -0.11 0.00 -1.18 0.00 0.00 61.69 59.56 1gio s THR 122 Cb -0.25 -3.27 -0.01 0.00 1.34 0.00 0.00 72.50 70.32 1gio s THR 122 CO 0.24 -0.28 1.06 -2.16 -0.54 0.00 0.00 174.62 172.94 1gio s PRO 123 N -3.58 3.14 -0.08 3.99 0.04 -1.26 -5.00 135.00 132.26 1gio s PRO 123 Ca 0.32 0.73 -0.26 0.00 0.04 0.00 0.00 61.00 61.83 1gio s PRO 123 Cb -0.08 -2.03 -0.22 0.00 0.04 0.00 0.00 34.50 32.21 1gio s PRO 123 CO 0.23 -0.89 0.97 0.00 0.04 0.00 0.00 177.00 177.35 1gio h ARG 124 N -0.56 -0.03 -0.00 4.56 2.47 -2.06 -3.57 114.38 115.20 1gio h ARG 124 Ca -0.44 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.28 1gio h ARG 124 Cb 1.21 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.54 1gio h ARG 124 CO 0.61 0.66 0.00 -2.39 0.56 0.00 0.00 179.97 179.40