#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gio n GLN 2 N 0.00 -1.77 -0.28 0.00 6.02 -1.26 -4.94 117.38 115.16 1gio n GLN 2 Ca 0.00 0.74 0.00 0.00 -0.01 0.00 0.00 57.00 57.73 1gio n GLN 2 Cb 0.00 -4.99 0.00 0.00 1.02 0.00 0.00 30.24 26.27 1gio n GLN 2 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1gio n ASP 3 N -2.81 0.00 -3.36 1.08 5.75 -1.26 -5.00 116.55 110.95 1gio n ASP 3 Ca -0.05 -1.40 0.02 0.00 -0.01 0.00 0.00 54.79 53.35 1gio n ASP 3 Cb 0.59 -0.08 -0.02 0.00 -1.03 0.00 0.00 41.12 40.58 1gio n ASP 3 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1gio s ASP 4 N -0.40 -1.21 0.00 -1.12 1.01 -1.26 -5.03 116.67 108.66 1gio s ASP 4 Ca 0.00 1.12 0.00 0.00 0.71 0.00 0.00 52.55 54.38 1gio s ASP 4 Cb 0.00 2.16 0.00 0.00 1.01 0.00 0.00 42.92 46.09 1gio s ASP 4 CO 0.00 -0.23 0.00 -1.22 0.21 0.00 0.00 175.17 173.93 1gio n TYR 5 N 5.42 0.00 0.95 4.23 4.01 -1.26 -4.64 117.16 125.87 1gio n TYR 5 Ca -0.06 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.81 1gio n TYR 5 Cb 0.50 0.00 0.40 0.00 -0.31 0.00 0.00 39.34 39.94 1gio n TYR 5 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1gio n ARG 6 N -2.42 0.03 0.00 -0.72 1.74 -1.26 -3.93 116.66 110.11 1gio n ARG 6 Ca 0.00 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.10 1gio n ARG 6 Cb 0.49 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.40 1gio n ARG 6 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1gio n TYR 7 N -1.58 0.00 -0.09 -1.55 9.36 -1.26 -3.79 117.16 118.25 1gio n TYR 7 Ca 0.06 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.14 1gio n TYR 7 Cb 0.35 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.03 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 1.27 -0.94 2.97 1.08 -1.82 -2.28 117.51 117.79 1gio h ILE 8 Ca 0.00 -1.66 0.05 0.00 -0.39 0.00 0.00 64.86 62.86 1gio h ILE 8 Cb 0.00 1.53 -0.06 0.00 -3.07 0.00 0.00 36.82 35.22 1gio h ILE 8 CO 0.00 0.55 0.61 0.45 -0.69 0.00 0.00 178.15 179.06 1gio h HIS 9 N 0.70 1.13 -0.40 1.37 3.86 -1.76 -1.13 115.15 118.93 1gio h HIS 9 Ca 0.03 0.03 -0.14 0.00 -1.16 0.00 0.00 60.37 59.13 1gio h HIS 9 Cb 1.08 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 29.17 1gio h HIS 9 CO 0.07 0.62 -0.32 0.35 0.86 0.00 0.00 177.93 179.50 1gio h PHE 10 N 1.14 1.05 0.00 2.45 3.57 -1.55 -2.55 116.94 121.05 1gio h PHE 10 Ca 0.39 -0.29 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1gio h PHE 10 Cb 0.09 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1gio h PHE 10 CO -0.01 1.09 -0.38 1.28 -2.23 0.00 0.00 178.31 178.06 1gio n LEU 11 N -4.07 0.56 -0.02 0.59 7.99 -0.90 -2.15 117.00 119.00 1gio n LEU 11 Ca -0.01 0.28 -0.17 0.00 -0.01 0.00 0.00 56.01 56.10 1gio n LEU 11 Cb 0.51 -0.27 -0.14 0.00 -0.11 0.00 0.00 43.42 43.40 1gio n LEU 11 CO 0.47 -0.03 0.22 0.74 -1.51 0.00 0.00 177.39 177.29 1gio h THR 12 N 0.00 1.66 0.16 -5.08 2.02 -1.16 -3.17 112.91 107.34 1gio h THR 12 Ca 0.00 -2.44 -0.01 0.00 0.77 0.00 0.00 66.41 64.74 1gio h THR 12 Cb 0.65 3.30 0.00 0.00 -1.74 0.00 0.00 68.15 70.36 1gio h THR 12 CO 0.00 0.66 -0.08 1.56 0.37 0.00 0.00 175.52 178.03 1gio h GLN 13 N -0.71 -0.21 0.00 6.66 7.50 -1.52 -3.41 115.11 123.42 1gio h GLN 13 Ca -0.07 0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.09 1gio h GLN 13 Cb 1.30 0.05 0.00 0.00 0.05 0.00 0.00 27.48 28.88 1gio h GLN 13 CO 0.07 0.19 0.00 0.72 -1.50 0.00 0.00 178.83 178.31 1gio n HIS 14 N -4.98 0.00 -2.14 2.96 8.25 -0.91 -4.89 115.22 113.51 1gio n HIS 14 Ca -0.09 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.01 1gio n HIS 14 Cb 0.26 -0.26 0.01 0.00 1.12 0.00 0.00 29.99 31.12 1gio n HIS 14 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1gio s TYR 15 N -0.86 2.67 -0.27 4.41 5.04 -1.20 -3.50 117.35 123.65 1gio s TYR 15 Ca 0.00 1.50 -0.06 0.00 -2.44 0.00 0.00 57.07 56.07 1gio s TYR 15 Cb 0.00 -3.46 0.14 0.00 0.35 0.00 0.00 41.96 38.99 1gio s TYR 15 CO 0.00 -1.87 0.55 0.34 -1.34 0.00 0.00 175.55 173.23 1gio s ASP 16 N -1.37 -0.84 -0.05 4.32 2.15 -0.70 -4.60 116.67 115.57 1gio s ASP 16 Ca 0.68 1.09 -0.22 0.00 0.43 0.00 0.00 52.55 54.54 1gio s ASP 16 Cb -0.30 1.91 -0.31 0.00 -0.30 0.00 0.00 42.92 43.92 1gio s ASP 16 CO 0.36 -0.24 0.88 0.00 -0.17 0.00 0.00 175.17 176.00 1gio h ALA 17 N 8.06 -0.08 -3.27 3.66 0.00 -1.89 -3.34 119.26 122.40 1gio h ALA 17 Ca -0.19 -0.71 -0.69 0.00 0.00 0.00 0.00 54.91 53.32 1gio h ALA 17 Cb 1.13 0.11 -0.32 0.00 0.00 0.00 0.00 17.79 18.70 1gio h ALA 17 CO 0.17 0.39 -0.62 0.21 0.00 0.00 0.00 179.25 179.40 1gio s LYS 18 N -2.43 2.33 0.00 0.00 2.36 -1.26 -4.52 119.74 116.22 1gio s LYS 18 Ca -0.14 -1.45 0.00 0.00 -2.55 0.00 0.00 55.97 51.83 1gio s LYS 18 Cb 0.01 -3.41 0.00 0.00 -1.05 0.00 0.00 37.83 33.38 1gio s LYS 18 CO 0.83 -0.81 0.00 -0.35 1.55 0.00 0.00 175.35 176.57 1gio n PRO 19 N 4.67 0.00 -1.72 4.03 -0.04 -1.26 -5.07 135.00 135.61 1gio n PRO 19 Ca -0.09 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1gio n PRO 19 Cb 0.43 -0.18 -0.00 0.00 -0.04 0.00 0.00 33.50 33.71 1gio n PRO 19 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1gio n LYS 20 N -0.22 -0.71 0.00 0.54 0.00 -1.26 -5.02 118.16 111.50 1gio n LYS 20 Ca 0.00 0.96 0.00 0.00 0.00 0.00 0.00 58.31 59.27 1gio n LYS 20 Cb 0.00 -1.80 0.00 0.00 0.00 0.00 0.00 35.03 33.23 1gio n LYS 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1gio n GLY 21 N 0.18 2.37 0.44 3.14 0.00 -1.26 -4.94 105.19 105.11 1gio n GLY 21 Ca -0.02 -1.49 0.01 0.00 0.00 0.00 0.00 46.02 44.52 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 1.83 0.12 0.00 1.61 3.00 -1.26 -4.87 116.66 117.09 1gio n ARG 22 Ca 0.00 -1.11 0.00 0.00 -0.01 0.00 0.00 57.85 56.73 1gio n ARG 22 Cb 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 32.46 31.87 1gio n ARG 22 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1gio n ASN 23 N -0.13 0.00 -0.04 0.55 6.94 -1.26 -4.77 115.26 116.56 1gio n ASN 23 Ca 0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 54.58 54.44 1gio n ASN 23 Cb 0.68 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.99 1gio n ASN 23 CO 0.00 0.00 0.00 -0.78 -1.03 0.00 0.00 177.26 175.45 1gio h ASP 24 N 0.00 -0.00 1.41 0.53 3.58 -1.95 -3.25 116.42 116.74 1gio h ASP 24 Ca 0.00 -0.73 0.00 0.00 0.42 0.00 0.00 57.03 56.72 1gio h ASP 24 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1gio h ASP 24 CO 0.00 0.73 -0.03 1.21 -2.88 0.00 0.00 179.24 178.28 1gio n GLU 25 N -4.74 0.24 0.36 0.28 2.13 -1.26 -2.05 120.64 115.61 1gio n GLU 25 Ca -0.09 0.19 -0.14 0.00 0.66 0.00 0.00 57.16 57.77 1gio n GLU 25 Cb 0.36 -1.77 -0.07 0.00 0.27 0.00 0.00 31.44 30.23 1gio n GLU 25 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 1gio h TYR 26 N 0.00 -0.87 -0.36 4.31 3.20 -1.90 -2.42 116.97 118.94 1gio h TYR 26 Ca 0.00 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.79 1gio h TYR 26 Cb 0.72 0.29 -0.02 0.00 1.54 0.00 0.00 36.73 39.25 1gio h TYR 26 CO 0.00 -0.54 -0.02 0.00 -1.64 0.00 0.00 178.16 175.96 1gio h PHE 28 N 0.54 0.51 0.00 0.00 3.57 -1.49 -1.25 116.94 118.83 1gio h PHE 28 Ca 0.11 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.48 1gio h PHE 28 Cb 0.38 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.01 1gio h PHE 28 CO 0.01 0.75 -0.32 -0.91 -2.23 0.00 0.00 178.31 175.61 1gio h ASN 29 N 0.13 0.00 1.34 0.41 2.35 -1.35 -2.12 115.58 116.35 1gio h ASN 29 Ca 0.04 -0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1gio h ASN 29 Cb 0.63 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.99 1gio h ASN 29 CO 0.03 0.02 -0.67 0.24 -1.65 0.00 0.00 177.43 175.40 1gio h MET 30 N 0.00 0.00 0.05 0.81 2.86 -1.27 -1.86 114.93 115.52 1gio h MET 30 Ca 0.00 0.00 -0.23 0.00 -2.06 0.00 0.00 59.70 57.41 1gio h MET 30 Cb 0.89 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.54 1gio h MET 30 CO 0.00 0.10 -1.04 1.98 1.06 0.00 0.00 176.91 179.01 1gio h MET 31 N 0.00 0.20 -0.27 1.72 -1.53 -1.10 -2.85 114.93 111.10 1gio h MET 31 Ca -0.02 -0.28 -0.11 0.00 -3.44 0.00 0.00 59.70 55.84 1gio h MET 31 Cb 1.12 0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 32.25 1gio h MET 31 CO 0.01 1.07 -0.30 -0.22 0.14 0.00 0.00 176.91 177.61 1gio h LYS 32 N 0.08 0.56 -0.46 0.39 1.63 -1.37 -1.45 116.57 115.96 1gio h LYS 32 Ca -0.07 -0.24 -0.12 0.00 -0.85 0.00 0.00 60.65 59.36 1gio h LYS 32 Cb 1.73 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 33.33 1gio h LYS 32 CO 0.16 0.80 -0.18 -0.97 -3.45 0.00 0.00 179.45 175.81 1gio h ASN 33 N 0.48 0.96 0.20 4.20 -0.73 -1.35 -3.08 115.58 116.26 1gio h ASN 33 Ca 0.06 -0.39 0.00 0.00 1.87 0.00 0.00 56.30 57.84 1gio h ASN 33 Cb 0.77 -0.26 0.00 0.00 0.27 0.00 0.00 38.32 39.10 1gio h ASN 33 CO 0.06 1.13 -0.18 0.54 -0.37 0.00 0.00 177.43 178.61 1gio n ARG 34 N -4.17 1.00 -3.94 6.67 5.12 -1.08 -4.97 116.66 115.29 1gio n ARG 34 Ca -0.00 -0.56 -0.41 0.00 -1.93 0.00 0.00 57.85 54.94 1gio n ARG 34 Cb 0.43 -1.49 0.03 0.00 -1.16 0.00 0.00 32.46 30.27 1gio n ARG 34 CO 0.00 0.00 0.00 2.89 -1.93 0.00 0.00 177.63 178.59 1gio n ARG 35 N -0.51 -0.58 -0.57 5.56 0.00 -0.61 -4.91 116.66 115.04 1gio n ARG 35 Ca 0.14 0.22 0.04 0.00 -0.00 0.00 0.00 57.85 58.25 1gio n ARG 35 Cb 0.34 -3.05 0.20 0.00 -0.00 0.00 0.00 32.46 29.95 1gio n ARG 35 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1gio n LEU 36 N -4.72 3.00 -1.33 2.89 4.77 -0.84 -4.63 117.00 116.13 1gio n LEU 36 Ca -0.11 -3.75 0.09 0.00 -0.03 0.00 0.00 56.01 52.22 1gio n LEU 36 Cb 0.57 -0.54 0.30 0.00 -2.33 0.00 0.00 43.42 41.43 1gio n LEU 36 CO 0.72 1.27 0.76 0.41 -1.33 0.00 0.00 177.39 179.21 1gio n THR 37 N -1.15 1.29 -3.76 -5.08 -1.04 -1.26 -4.30 114.28 98.99 1gio n THR 37 Ca 0.22 -0.96 -0.37 0.00 -2.04 0.00 0.00 64.05 60.89 1gio n THR 37 Cb 0.76 0.23 -0.12 0.00 -1.82 0.00 0.00 70.33 69.38 1gio n THR 37 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1gio s ARG 38 N -1.52 2.55 -0.77 -2.82 0.52 -1.26 -2.17 118.95 113.46 1gio s ARG 38 Ca 0.44 -1.26 0.02 0.00 -0.52 0.00 0.00 55.73 54.41 1gio s ARG 38 Cb 0.26 -3.46 0.34 0.00 0.52 0.00 0.00 34.95 32.61 1gio s ARG 38 CO 0.25 -0.72 1.41 -0.35 0.02 0.00 0.00 175.30 175.91 1gio n PRO 39 N 4.78 4.14 0.00 3.54 -0.04 -1.26 -4.58 135.00 141.57 1gio n PRO 39 Ca -0.12 -4.66 0.00 0.00 -0.04 0.00 0.00 63.50 58.69 1gio n PRO 39 Cb 0.44 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 1gio n PRO 39 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1gio n LYS 41 N 0.00 -2.12 0.00 0.00 5.02 -1.26 -4.81 118.16 114.99 1gio n LYS 41 Ca 0.00 1.50 0.00 0.00 -2.02 0.00 0.00 58.31 57.79 1gio n LYS 41 Cb 0.00 -2.55 0.00 0.00 -0.02 0.00 0.00 35.03 32.46 1gio n LYS 41 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1gio n ASP 42 N -3.54 0.00 -4.32 4.39 8.00 -1.26 -4.63 116.55 115.18 1gio n ASP 42 Ca -0.01 0.08 -0.21 0.00 0.71 0.00 0.00 54.79 55.35 1gio n ASP 42 Cb 0.47 -0.11 -0.11 0.00 -0.02 0.00 0.00 41.12 41.34 1gio n ASP 42 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1gio s ARG 43 N -0.23 1.25 -0.03 -1.24 0.52 -1.26 -2.02 118.95 115.94 1gio s ARG 43 Ca 0.00 -1.40 -0.10 0.00 -0.52 0.00 0.00 55.73 53.71 1gio s ARG 43 Cb 0.00 -1.28 0.01 0.00 0.52 0.00 0.00 34.95 34.21 1gio s ARG 43 CO 0.00 0.26 0.23 0.54 0.02 0.00 0.00 175.30 176.34 1gio s ASN 44 N -2.67 -0.12 -0.11 0.23 4.22 -0.88 -5.02 114.94 110.58 1gio s ASN 44 Ca 0.15 0.07 -0.01 0.00 -2.14 0.00 0.00 52.86 50.93 1gio s ASN 44 Cb -0.05 0.32 -0.03 0.00 1.28 0.00 0.00 41.25 42.77 1gio s ASN 44 CO 0.06 -0.32 -0.05 0.42 -2.04 0.00 0.00 177.10 175.16 1gio s THR 45 N -0.98 3.80 0.19 0.54 -4.23 -1.26 -1.79 115.64 111.90 1gio s THR 45 Ca -0.11 -0.42 -0.02 0.00 -1.18 0.00 0.00 61.69 59.96 1gio s THR 45 Cb -0.05 -2.61 -0.05 0.00 1.34 0.00 0.00 72.50 71.13 1gio s THR 45 CO 0.02 0.55 0.40 -0.36 -0.54 0.00 0.00 174.62 174.69 1gio s PHE 46 N -0.23 3.48 -0.06 3.99 0.08 -0.45 -4.56 117.98 120.22 1gio s PHE 46 Ca 0.04 0.44 0.03 0.00 0.12 0.00 0.00 56.93 57.55 1gio s PHE 46 Cb -0.13 -1.92 0.01 0.00 -0.57 0.00 0.00 43.02 40.40 1gio s PHE 46 CO 0.02 0.38 -0.15 0.42 -0.10 0.00 0.00 175.22 175.79 1gio s ILE 47 N -1.82 1.36 0.12 0.64 -1.09 -1.23 -1.69 121.20 117.50 1gio s ILE 47 Ca 0.40 -0.63 0.10 0.00 -2.23 0.00 0.00 60.65 58.29 1gio s ILE 47 Cb -0.11 -1.21 -0.04 0.00 -1.58 0.00 0.00 42.46 39.52 1gio s ILE 47 CO 0.28 0.40 -0.25 -1.00 -1.23 0.00 0.00 174.94 173.14 1gio s HIS 48 N 0.42 2.16 -5.00 3.97 3.76 -0.44 -1.73 115.29 118.44 1gio s HIS 48 Ca -0.12 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.40 1gio s HIS 48 Cb -0.15 -1.18 0.00 0.00 1.11 0.00 0.00 32.58 32.36 1gio s HIS 48 CO 0.04 0.29 0.00 0.41 -0.85 0.00 0.00 174.74 174.63 1gio n GLY 49 N 1.02 -0.52 3.74 -2.22 0.00 -1.26 -2.14 105.19 103.81 1gio n GLY 49 Ca -0.18 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 43.86 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 -2.67 7.22 0.22 1.61 -0.87 -1.26 -4.86 114.94 114.33 1gio s ASN 50 Ca 0.00 1.45 0.01 0.00 -1.57 0.00 0.00 52.86 52.76 1gio s ASN 50 Cb 0.00 -2.47 0.21 0.00 -0.02 0.00 0.00 41.25 38.97 1gio s ASN 50 CO 0.00 0.01 1.55 0.50 -2.57 0.00 0.00 177.10 176.59 1gio h LYS 51 N 5.69 0.39 0.00 -0.60 3.64 -1.99 -2.20 116.57 121.50 1gio h LYS 51 Ca -0.44 -0.25 -0.06 0.00 -1.27 0.00 0.00 60.65 58.64 1gio h LYS 51 Cb 1.21 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.04 1gio h LYS 51 CO 0.71 0.84 -0.27 -0.91 -2.27 0.00 0.00 179.45 177.55 1gio h ASN 52 N 0.30 0.00 0.23 4.20 4.21 -1.99 -2.46 115.58 120.07 1gio h ASN 52 Ca 0.01 0.00 -0.25 0.00 1.21 0.00 0.00 56.30 57.26 1gio h ASN 52 Cb 1.05 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.27 1gio h ASN 52 CO 0.09 0.27 -1.04 0.44 -1.29 0.00 0.00 177.43 175.90 1gio h ASP 53 N 0.00 0.69 -0.41 5.81 5.19 -1.81 -2.46 116.42 123.44 1gio h ASP 53 Ca -0.00 -0.58 0.05 0.00 -0.62 0.00 0.00 57.03 55.88 1gio h ASP 53 Cb 0.90 -0.21 -0.05 0.00 0.18 0.00 0.00 39.33 40.15 1gio h ASP 53 CO 0.03 1.39 0.14 0.40 -3.12 0.00 0.00 179.24 178.08 1gio h ILE 54 N 0.28 0.87 0.16 0.35 5.03 -1.24 -2.81 117.51 120.14 1gio h ILE 54 Ca -0.12 -0.10 0.00 0.00 -0.12 0.00 0.00 64.86 64.53 1gio h ILE 54 Cb 1.70 0.55 -0.01 0.00 -3.03 0.00 0.00 36.82 36.02 1gio h ILE 54 CO 0.19 0.05 -0.15 0.07 -0.68 0.00 0.00 178.15 177.64 1gio h LYS 55 N 0.30 -0.32 -0.95 2.37 5.09 -1.44 -2.69 116.57 118.94 1gio h LYS 55 Ca 0.19 0.02 0.00 0.00 0.09 0.00 0.00 60.65 60.95 1gio h LYS 55 Cb 0.18 0.07 0.00 0.00 0.10 0.00 0.00 32.23 32.58 1gio h LYS 55 CO -0.20 -0.21 0.00 0.00 -2.09 0.00 0.00 179.45 176.95 1gio n ALA 56 N -2.36 2.57 0.14 0.07 0.00 -0.93 -2.31 120.51 117.70 1gio n ALA 56 Ca -0.08 -0.10 0.01 0.00 0.00 0.00 0.00 53.44 53.28 1gio n ALA 56 Cb 0.19 -1.01 0.13 0.00 0.00 0.00 0.00 19.45 18.77 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 0.20 1.10 -0.95 0.00 1.08 -1.21 -3.16 117.51 114.58 1gio h ILE 57 Ca 0.00 -2.17 -0.53 0.00 -0.39 0.00 0.00 64.86 61.77 1gio h ILE 57 Cb 0.56 2.28 -0.21 0.00 -3.07 0.00 0.00 36.82 36.38 1gio h ILE 57 CO 0.02 0.55 0.65 0.00 -0.69 0.00 0.00 178.15 178.69 1gio h GLU 59 N 2.11 -0.00 0.00 0.00 4.81 -1.77 -3.43 114.58 116.29 1gio h GLU 59 Ca 0.45 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.68 1gio h GLU 59 Cb 0.73 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.11 1gio h GLU 59 CO 1.15 -0.00 0.00 -0.25 -0.73 0.00 0.00 179.01 179.18 1gio n ASP 60 N -2.02 0.00 -0.13 1.04 8.00 -1.24 -4.92 116.55 117.28 1gio n ASP 60 Ca -0.00 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.29 1gio n ASP 60 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 41.12 40.99 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 0.60 -0.12 -1.24 5.12 -1.26 -3.63 116.66 116.13 1gio n ARG 61 Ca 0.00 0.18 0.09 0.00 -1.93 0.00 0.00 57.85 56.19 1gio n ARG 61 Cb 0.00 -1.47 0.29 0.00 -1.16 0.00 0.00 32.46 30.12 1gio n ARG 61 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1gio n ASN 62 N -3.59 1.74 -3.28 0.55 2.85 -1.26 -4.03 115.26 108.24 1gio n ASN 62 Ca -0.47 -1.82 -0.06 0.00 -0.11 0.00 0.00 54.58 52.12 1gio n ASN 62 Cb 0.93 -0.15 -0.05 0.00 1.24 0.00 0.00 39.78 41.74 1gio n ASN 62 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1gio s GLY 63 N -1.35 -0.67 0.52 8.20 0.00 -1.16 -2.10 107.32 110.75 1gio s GLY 63 Ca 0.29 0.64 -0.18 0.00 0.00 0.00 0.00 44.72 45.47 1gio s GLY 63 CO 0.22 3.07 1.02 1.20 0.00 0.00 0.00 173.10 178.62 1gio s GLN 64 N 2.61 3.75 0.02 2.90 -0.21 -0.94 -3.72 119.66 124.07 1gio s GLN 64 Ca 0.11 1.18 -0.30 0.00 0.02 0.00 0.00 55.36 56.38 1gio s GLN 64 Cb -0.13 -2.10 -0.05 0.00 1.00 0.00 0.00 33.01 31.74 1gio s GLN 64 CO -0.25 -0.45 1.17 -1.25 -2.12 0.00 0.00 175.29 172.39 1gio s PRO 65 N -3.67 4.42 0.67 2.91 0.04 -1.26 -0.92 135.00 137.19 1gio s PRO 65 Ca 0.63 1.70 -0.03 0.00 0.04 0.00 0.00 61.00 63.35 1gio s PRO 65 Cb -0.14 -3.42 0.08 0.00 0.04 0.00 0.00 34.50 31.06 1gio s PRO 65 CO 0.27 -0.29 0.95 -0.47 0.04 0.00 0.00 177.00 177.49 1gio s TYR 66 N 1.41 2.42 0.05 0.56 5.04 -0.34 -4.77 117.35 121.71 1gio s TYR 66 Ca 0.57 0.07 -0.30 0.00 -2.44 0.00 0.00 57.07 54.97 1gio s TYR 66 Cb -0.27 -3.05 -0.05 0.00 0.35 0.00 0.00 41.96 38.94 1gio s TYR 66 CO 0.27 -1.40 1.06 -0.98 -1.34 0.00 0.00 175.55 173.16 1gio s ARG 67 N -5.10 4.53 0.00 4.97 1.70 -1.26 -2.28 118.95 121.52 1gio s ARG 67 Ca 0.62 1.57 0.00 0.00 -0.47 0.00 0.00 55.73 57.44 1gio s ARG 67 Cb -0.09 -3.40 0.00 0.00 -0.57 0.00 0.00 34.95 30.90 1gio s ARG 67 CO 0.43 -0.08 0.00 0.41 -1.08 0.00 0.00 175.30 174.98 1gio n GLY 68 N 2.86 1.01 3.11 3.88 0.00 -1.26 -4.25 105.19 110.54 1gio n GLY 68 Ca 0.06 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.68 1gio n GLY 68 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1gio n ASP 69 N 0.49 -4.00 -4.90 1.61 2.03 -1.19 -5.05 116.55 105.53 1gio n ASP 69 Ca 0.00 -0.59 -0.27 0.00 0.52 0.00 0.00 54.79 54.46 1gio n ASP 69 Cb 0.03 -4.65 -0.01 0.00 -0.72 0.00 0.00 41.12 35.77 1gio n ASP 69 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1gio s LEU 70 N -5.51 2.68 0.17 -2.67 1.02 -0.97 -4.51 118.68 108.88 1gio s LEU 70 Ca 0.20 -1.27 0.11 0.00 0.02 0.00 0.00 54.13 53.19 1gio s LEU 70 Cb -0.03 -1.16 -0.04 0.00 0.02 0.00 0.00 46.19 44.98 1gio s LEU 70 CO 0.65 -1.10 -0.25 -0.13 0.02 0.00 0.00 176.35 175.55 1gio s ARG 71 N -4.27 1.50 -0.12 1.70 1.81 -0.52 -1.20 118.95 117.84 1gio s ARG 71 Ca 0.33 -1.44 0.02 0.00 -1.72 0.00 0.00 55.73 52.92 1gio s ARG 71 Cb -0.02 -1.89 0.01 0.00 -0.45 0.00 0.00 34.95 32.61 1gio s ARG 71 CO 0.20 0.42 -0.18 -1.50 -0.68 0.00 0.00 175.30 173.57 1gio s ILE 72 N -1.42 1.70 0.58 1.52 -1.16 -0.10 -1.96 121.20 120.37 1gio s ILE 72 Ca 0.18 -0.76 -0.18 0.00 -0.51 0.00 0.00 60.65 59.38 1gio s ILE 72 Cb -0.09 -1.54 -0.04 0.00 0.61 0.00 0.00 42.46 41.41 1gio s ILE 72 CO 0.08 0.48 1.12 -0.94 -2.81 0.00 0.00 174.94 172.88 1gio s SER 73 N 0.96 5.51 -0.14 4.50 1.04 -0.91 -2.21 113.70 122.45 1gio s SER 73 Ca -0.06 2.11 -0.07 0.00 0.48 0.00 0.00 55.95 58.41 1gio s SER 73 Cb -0.15 -2.57 -0.25 0.00 0.10 0.00 0.00 66.02 63.15 1gio s SER 73 CO -0.02 -1.36 0.29 1.17 0.98 0.00 0.00 173.24 174.30 1gio n LYS 74 N -1.70 0.73 -2.53 4.02 4.81 -0.89 -4.73 118.16 117.87 1gio n LYS 74 Ca 0.11 0.28 -0.41 0.00 -0.87 0.00 0.00 58.31 57.42 1gio n LYS 74 Cb 0.51 -1.69 -0.04 0.00 0.02 0.00 0.00 35.03 33.83 1gio n LYS 74 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1gio s SER 75 N -6.99 7.30 0.10 3.14 0.01 -1.26 -4.98 113.70 111.03 1gio s SER 75 Ca -0.24 2.10 -0.19 0.00 1.31 0.00 0.00 55.95 58.92 1gio s SER 75 Cb 0.07 -2.61 -0.07 0.00 0.21 0.00 0.00 66.02 63.62 1gio s SER 75 CO 0.74 -0.18 0.60 -1.61 0.41 0.00 0.00 173.24 173.20 1gio s GLU 76 N -0.57 4.21 0.27 12.44 2.02 -1.26 -4.58 118.70 131.23 1gio s GLU 76 Ca 0.48 0.75 0.10 0.00 0.02 0.00 0.00 54.97 56.33 1gio s GLU 76 Cb -0.29 -3.17 -0.05 0.00 0.10 0.00 0.00 34.13 30.72 1gio s GLU 76 CO 0.35 0.59 -0.16 -0.06 0.02 0.00 0.00 175.26 176.00 1gio s PHE 77 N -1.20 2.15 0.13 1.61 0.08 -0.98 -4.91 117.98 114.87 1gio s PHE 77 Ca 0.32 -0.44 -0.15 0.00 0.12 0.00 0.00 56.93 56.79 1gio s PHE 77 Cb -0.19 -1.01 -0.07 0.00 -0.57 0.00 0.00 43.02 41.18 1gio s PHE 77 CO 0.20 0.59 0.54 -0.65 -0.10 0.00 0.00 175.22 175.80 1gio s GLN 78 N -3.57 3.99 -0.27 0.44 -1.52 -0.91 -1.14 119.66 116.69 1gio s GLN 78 Ca 0.29 0.50 -0.01 0.00 -1.95 0.00 0.00 55.36 54.19 1gio s GLN 78 Cb -0.02 -2.97 0.14 0.00 -0.22 0.00 0.00 33.01 29.94 1gio s GLN 78 CO 0.13 0.50 0.36 -1.50 -0.25 0.00 0.00 175.29 174.54 1gio s ILE 79 N -1.42 -0.56 -0.26 1.08 -1.16 -0.94 -1.32 121.20 116.62 1gio s ILE 79 Ca 0.36 -0.22 -0.09 0.00 -0.51 0.00 0.00 60.65 60.19 1gio s ILE 79 Cb -0.15 -0.90 -0.04 0.00 0.61 0.00 0.00 42.46 41.98 1gio s ILE 79 CO 0.19 -0.24 0.13 -0.89 -2.81 0.00 0.00 174.94 171.31 1gio s THR 80 N 2.50 4.82 0.11 4.00 2.01 -0.68 -1.68 115.64 126.72 1gio s THR 80 Ca 0.11 0.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.81 1gio s THR 80 Cb -0.14 -3.27 -0.06 0.00 0.01 0.00 0.00 72.50 69.04 1gio s THR 80 CO -0.24 0.30 0.97 -0.63 -0.69 0.00 0.00 174.62 174.33 1gio s ILE 81 N 1.62 4.50 -0.27 1.82 -1.09 -0.36 -1.34 121.20 126.08 1gio s ILE 81 Ca 0.07 2.06 -0.01 0.00 -2.23 0.00 0.00 60.65 60.53 1gio s ILE 81 Cb -0.15 -4.32 0.04 0.00 -1.58 0.00 0.00 42.46 36.45 1gio s ILE 81 CO 0.07 0.31 -0.04 0.00 -1.23 0.00 0.00 174.94 174.04 1gio s LYS 83 N 1.29 1.49 -0.06 0.00 -2.85 -0.95 -2.08 119.74 116.58 1gio s LYS 83 Ca -0.02 -0.31 -0.29 0.00 -1.00 0.00 0.00 55.97 54.35 1gio s LYS 83 Cb -0.18 -1.35 -0.02 0.00 -2.06 0.00 0.00 37.83 34.22 1gio s LYS 83 CO -0.03 -0.07 0.94 -1.58 0.10 0.00 0.00 175.35 174.71 1gio s HIS 84 N 0.98 3.58 -0.16 1.78 5.65 -0.86 -0.75 115.29 125.52 1gio s HIS 84 Ca -0.09 1.58 -0.29 0.00 0.25 0.00 0.00 55.06 56.50 1gio s HIS 84 Cb -0.15 -3.10 -0.01 0.00 -1.18 0.00 0.00 32.58 28.15 1gio s HIS 84 CO 0.00 -0.09 1.19 0.15 -0.65 0.00 0.00 174.74 175.34 1gio s LYS 85 N 1.40 4.26 3.21 2.88 -0.14 -1.26 -4.66 119.74 125.43 1gio s LYS 85 Ca 0.48 1.58 0.00 0.00 -1.36 0.00 0.00 55.97 56.67 1gio s LYS 85 Cb -0.19 -3.70 0.00 0.00 -1.68 0.00 0.00 37.83 32.26 1gio s LYS 85 CO 0.22 -0.64 0.00 0.41 -0.76 0.00 0.00 175.35 174.59 1gio n GLY 86 N 3.49 -0.18 3.50 -3.33 0.00 -1.26 -4.77 105.19 102.63 1gio n GLY 86 Ca 0.13 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.10 1gio n GLY 86 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1gio s GLY 87 N -0.20 -0.38 -1.29 -0.02 0.00 -1.26 -4.94 107.32 99.22 1gio s GLY 87 Ca 0.00 2.80 -0.07 0.00 0.00 0.00 0.00 44.72 47.45 1gio s GLY 87 CO 0.00 3.15 0.61 1.44 0.00 0.00 0.00 173.10 178.29 1gio n SER 88 N 5.09 -2.13 -0.01 1.64 7.64 -1.26 -4.91 113.62 119.67 1gio n SER 88 Ca -0.11 -0.96 -0.00 0.00 1.01 0.00 0.00 58.87 58.81 1gio n SER 88 Cb 0.52 -3.44 -0.03 0.00 -1.01 0.00 0.00 64.21 60.25 1gio n SER 88 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1gio n SER 89 N -2.91 4.21 -4.56 6.43 7.64 -1.26 -5.04 113.62 118.12 1gio n SER 89 Ca -0.24 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.41 1gio n SER 89 Cb 0.65 0.82 0.00 0.00 -1.01 0.00 0.00 64.21 64.68 1gio n SER 89 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1gio n ARG 90 N -1.91 0.75 -3.91 1.43 5.12 -1.26 -5.03 116.66 111.85 1gio n ARG 90 Ca -0.03 -3.08 -0.35 0.00 -1.93 0.00 0.00 57.85 52.45 1gio n ARG 90 Cb 0.39 0.30 -0.14 0.00 -1.16 0.00 0.00 32.46 31.85 1gio n ARG 90 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1gio s PRO 91 N -4.06 2.66 0.00 5.56 0.04 -1.26 -2.97 135.00 134.97 1gio s PRO 91 Ca 0.30 -1.11 0.27 0.00 0.04 0.00 0.00 61.00 60.50 1gio s PRO 91 Cb -0.02 -3.12 1.37 0.00 0.04 0.00 0.00 34.50 32.77 1gio s PRO 91 CO 0.19 -0.51 1.92 -2.30 0.04 0.00 0.00 177.00 176.33 1gio n PRO 92 N 4.67 0.42 -3.82 0.56 -0.02 -1.26 -4.82 135.00 130.72 1gio n PRO 92 Ca -0.15 0.03 -0.04 0.00 -2.02 0.00 0.00 63.50 61.32 1gio n PRO 92 Cb 0.45 -1.50 0.01 0.00 -0.02 0.00 0.00 33.50 32.44 1gio n PRO 92 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gio n ARG 94 N -0.58 0.39 -3.76 0.00 -4.01 -1.26 -4.82 116.66 102.62 1gio n ARG 94 Ca -0.05 -2.19 -0.13 0.00 -1.04 0.00 0.00 57.85 54.44 1gio n ARG 94 Cb 0.60 1.93 -0.13 0.00 -3.04 0.00 0.00 32.46 31.81 1gio n ARG 94 CO 0.00 0.00 0.00 0.71 -3.04 0.00 0.00 177.63 175.30 1gio s TYR 95 N -3.21 -0.25 -0.49 2.89 2.02 -1.26 -4.46 117.35 112.59 1gio s TYR 95 Ca 0.25 0.62 -0.24 0.00 -0.37 0.00 0.00 57.07 57.32 1gio s TYR 95 Cb 0.00 0.02 0.03 0.00 -0.40 0.00 0.00 41.96 41.61 1gio s TYR 95 CO 0.18 -0.17 0.89 0.20 -1.57 0.00 0.00 175.55 175.07 1gio s GLY 96 N 0.88 1.49 -0.27 0.71 0.00 0.08 -4.58 107.32 105.63 1gio s GLY 96 Ca -0.06 -1.01 -0.19 0.00 0.00 0.00 0.00 44.72 43.46 1gio s GLY 96 CO -0.05 1.97 0.58 0.00 0.00 0.00 0.00 173.10 175.59 1gio s ALA 97 N 3.68 3.59 -0.18 3.20 0.00 -1.26 -2.25 121.76 128.55 1gio s ALA 97 Ca 0.33 -0.56 -0.01 0.00 0.00 0.00 0.00 51.96 51.72 1gio s ALA 97 Cb -0.12 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 20.03 1gio s ALA 97 CO 0.23 -0.83 -0.13 0.99 0.00 0.00 0.00 175.76 176.02 1gio s THR 98 N 2.43 2.75 0.09 0.00 2.01 -0.78 -4.95 115.64 117.19 1gio s THR 98 Ca 0.24 -0.72 -0.22 0.00 0.31 0.00 0.00 61.69 61.29 1gio s THR 98 Cb -0.15 -2.19 -0.07 0.00 0.01 0.00 0.00 72.50 70.10 1gio s THR 98 CO 0.09 0.49 0.66 -1.61 -0.69 0.00 0.00 174.62 173.57 1gio s GLU 99 N 1.10 4.37 0.28 4.92 2.02 -1.26 -1.22 118.70 128.91 1gio s GLU 99 Ca 0.00 0.91 0.03 0.00 0.02 0.00 0.00 54.97 55.93 1gio s GLU 99 Cb -0.14 -3.28 -0.04 0.00 0.10 0.00 0.00 34.13 30.77 1gio s GLU 99 CO -0.04 0.54 0.19 0.34 0.02 0.00 0.00 175.26 176.31 1gio s ASP 100 N -0.87 1.14 0.21 -0.19 -1.08 -0.67 -4.95 116.67 110.26 1gio s ASP 100 Ca 0.32 -1.57 -0.03 0.00 -0.52 0.00 0.00 52.55 50.75 1gio s ASP 100 Cb -0.21 0.44 0.01 0.00 -1.46 0.00 0.00 42.92 41.71 1gio s ASP 100 CO 0.21 -0.93 0.34 -1.54 0.52 0.00 0.00 175.17 173.77 1gio n SER 101 N -0.93 -0.97 0.00 -0.34 3.41 -1.26 -2.21 113.62 111.32 1gio n SER 101 Ca 0.04 -2.05 0.00 0.00 -0.26 0.00 0.00 58.87 56.60 1gio n SER 101 Cb 0.64 1.72 0.00 0.00 -0.26 0.00 0.00 64.21 66.31 1gio n SER 101 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1gio n ARG 102 N -0.33 0.00 -1.81 4.33 1.74 -0.29 -4.86 116.66 115.44 1gio n ARG 102 Ca -0.01 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.65 1gio n ARG 102 Cb 0.34 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.78 1gio n ARG 102 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1gio s VAL 103 N -0.50 2.10 0.50 1.55 -7.23 -1.26 -2.31 120.40 113.25 1gio s VAL 103 Ca 0.00 0.10 0.07 0.00 -1.81 0.00 0.00 61.98 60.34 1gio s VAL 103 Cb 0.00 -3.06 0.03 0.00 0.56 0.00 0.00 36.38 33.91 1gio s VAL 103 CO 0.00 0.02 0.50 0.27 -0.31 0.00 0.00 175.10 175.58 1gio s ILE 104 N -0.70 2.17 -0.04 -0.62 -4.36 -1.26 -4.95 121.20 111.44 1gio s ILE 104 Ca 0.56 -1.29 0.06 0.00 -0.26 0.00 0.00 60.65 59.73 1gio s ILE 104 Cb -0.46 -2.47 -0.01 0.00 1.25 0.00 0.00 42.46 40.77 1gio s ILE 104 CO 0.57 0.00 -0.24 0.68 0.24 0.00 0.00 174.94 176.19 1gio s VAL 105 N -2.63 1.95 0.47 8.37 -7.23 -1.26 -2.15 120.40 117.92 1gio s VAL 105 Ca 0.47 -1.02 0.03 0.00 -1.81 0.00 0.00 61.98 59.64 1gio s VAL 105 Cb -0.04 -1.64 -0.03 0.00 0.56 0.00 0.00 36.38 35.24 1gio s VAL 105 CO 0.28 0.55 0.02 0.68 -0.31 0.00 0.00 175.10 176.32 1gio s VAL 106 N -0.29 1.24 0.02 1.32 -7.23 -0.83 -3.22 120.40 111.41 1gio s VAL 106 Ca 0.01 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.19 1gio s VAL 106 Cb -0.12 -2.37 -0.02 0.00 0.56 0.00 0.00 36.38 34.43 1gio s VAL 106 CO 0.02 0.00 -0.04 -0.83 -0.31 0.00 0.00 175.10 173.94 1gio s GLY 107 N -3.79 0.29 0.17 2.32 0.00 -0.91 -1.44 107.32 103.96 1gio s GLY 107 Ca 0.15 -0.52 0.06 0.00 0.00 0.00 0.00 44.72 44.41 1gio s GLY 107 CO 0.08 -0.57 0.06 0.00 0.00 0.00 0.00 173.10 172.67 1gio s GLU 109 N -3.00 0.35 0.00 0.00 0.41 -0.92 -4.85 118.70 110.69 1gio s GLU 109 Ca 0.29 -0.45 0.00 0.00 -0.41 0.00 0.00 54.97 54.40 1gio s GLU 109 Cb -0.10 0.14 0.00 0.00 -1.78 0.00 0.00 34.13 32.39 1gio s GLU 109 CO 0.21 -0.07 0.00 0.09 -0.49 0.00 0.00 175.26 175.00 1gio n ASN 110 N 1.70 0.00 0.00 -0.19 3.02 -1.26 -2.40 115.26 116.13 1gio n ASN 110 Ca -0.22 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.33 1gio n ASN 110 Cb 0.56 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.70 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 -0.41 0.44 3.18 7.41 0.00 -1.26 -5.13 105.19 109.41 1gio n GLY 111 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1gio n GLY 111 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1gio s LEU 112 N 0.00 1.74 -0.10 0.99 2.34 -1.01 -4.79 118.68 117.85 1gio s LEU 112 Ca 0.00 -0.99 -0.26 0.00 0.06 0.00 0.00 54.13 52.94 1gio s LEU 112 Cb 0.00 0.58 -0.02 0.00 -0.56 0.00 0.00 46.19 46.18 1gio s LEU 112 CO 0.00 -0.73 0.84 -2.16 -1.06 0.00 0.00 176.35 173.24 1gio s PRO 113 N -3.97 4.40 -0.00 1.48 0.05 -1.26 -2.17 135.00 133.53 1gio s PRO 113 Ca 0.15 1.08 0.03 0.00 0.05 0.00 0.00 61.00 62.31 1gio s PRO 113 Cb 0.06 -3.51 -0.04 0.00 0.05 0.00 0.00 34.50 31.06 1gio s PRO 113 CO -0.04 -0.16 0.09 1.33 0.05 0.00 0.00 177.00 178.27 1gio n VAL 114 N 4.29 0.00 -4.38 -0.36 0.24 -0.84 -4.91 118.33 112.37 1gio n VAL 114 Ca 0.03 -0.23 -0.25 0.00 -2.04 0.00 0.00 64.34 61.86 1gio n VAL 114 Cb 0.50 0.67 -0.12 0.00 -1.47 0.00 0.00 33.84 33.43 1gio n VAL 114 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1gio s HIS 115 N -1.82 2.10 -0.09 6.34 5.65 -0.82 -4.82 115.29 121.83 1gio s HIS 115 Ca -0.00 -0.40 -0.01 0.00 0.25 0.00 0.00 55.06 54.89 1gio s HIS 115 Cb 0.02 -1.05 0.03 0.00 -1.18 0.00 0.00 32.58 30.41 1gio s HIS 115 CO 0.13 0.42 0.00 0.12 -0.65 0.00 0.00 174.74 174.76 1gio s PHE 116 N -1.77 0.72 0.04 3.88 5.36 -1.26 -2.13 117.98 122.82 1gio s PHE 116 Ca 0.18 -0.26 -0.21 0.00 -0.96 0.00 0.00 56.93 55.68 1gio s PHE 116 Cb -0.07 -0.84 -0.06 0.00 -0.34 0.00 0.00 43.02 41.71 1gio s PHE 116 CO 0.08 -0.37 0.64 -0.51 -1.46 0.00 0.00 175.22 173.61 1gio s ASP 117 N 1.96 7.08 -0.61 6.13 1.11 -1.20 -4.99 116.67 126.15 1gio s ASP 117 Ca 0.04 1.29 0.04 0.00 0.18 0.00 0.00 52.55 54.10 1gio s ASP 117 Cb -0.13 -2.40 0.16 0.00 1.07 0.00 0.00 42.92 41.63 1gio s ASP 117 CO -0.06 0.14 0.41 -1.83 1.18 0.00 0.00 175.17 175.02 1gio s GLU 118 N -0.49 2.05 0.00 8.23 4.04 -1.26 -4.46 118.70 126.82 1gio s GLU 118 Ca 0.32 -2.93 0.00 0.00 0.04 0.00 0.00 54.97 52.40 1gio s GLU 118 Cb -0.19 -3.01 0.00 0.00 0.02 0.00 0.00 34.13 30.94 1gio s GLU 118 CO 0.20 -1.26 0.00 -1.13 -1.84 0.00 0.00 175.26 171.22 1gio n SER 119 N 2.42 0.00 -4.66 0.83 3.41 -1.26 -5.10 113.62 109.25 1gio n SER 119 Ca 0.18 0.00 -0.54 0.00 -0.26 0.00 0.00 58.87 58.25 1gio n SER 119 Cb 0.36 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.25 1gio n SER 119 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1gio n PHE 120 N -1.44 2.06 -3.27 7.33 7.35 -1.26 -4.99 117.46 123.23 1gio n PHE 120 Ca 0.00 0.35 -0.30 0.00 -0.76 0.00 0.00 57.45 56.74 1gio n PHE 120 Cb 0.00 -2.53 -0.04 0.00 0.35 0.00 0.00 39.48 37.26 1gio n PHE 120 CO 0.00 0.00 0.00 0.96 -0.76 0.00 0.00 176.76 176.96 1gio s ILE 121 N 4.31 4.94 0.37 -2.13 -0.00 -1.26 -5.02 121.20 122.41 1gio s ILE 121 Ca 0.99 0.33 -0.18 0.00 -0.00 0.00 0.00 60.65 61.79 1gio s ILE 121 Cb -0.94 -3.69 -0.10 0.00 -0.00 0.00 0.00 42.46 37.73 1gio s ILE 121 CO 0.60 -0.26 0.85 0.42 -0.00 0.00 0.00 174.94 176.54 1gio s THR 122 N -2.04 4.52 0.46 8.37 -4.23 -1.26 -5.05 115.64 116.42 1gio s THR 122 Ca 0.47 1.25 -0.21 0.00 -1.18 0.00 0.00 61.69 62.02 1gio s THR 122 Cb -0.11 -3.62 -0.09 0.00 1.34 0.00 0.00 72.50 70.01 1gio s THR 122 CO 0.27 -0.23 1.01 -2.16 -0.54 0.00 0.00 174.62 172.97 1gio s PRO 123 N -3.02 3.95 -0.34 3.99 0.04 -1.26 -4.32 135.00 134.04 1gio s PRO 123 Ca 0.58 1.29 -0.09 0.00 0.04 0.00 0.00 61.00 62.81 1gio s PRO 123 Cb -0.10 -2.13 0.01 0.00 0.04 0.00 0.00 34.50 32.32 1gio s PRO 123 CO 0.16 -0.29 0.43 0.54 0.04 0.00 0.00 177.00 177.87 1gio n ARG 124 N -0.83 -1.48 0.00 4.56 1.74 -1.26 -5.22 116.66 114.17 1gio n ARG 124 Ca 0.08 1.53 0.10 0.00 -0.77 0.00 0.00 57.85 58.79 1gio n ARG 124 Cb 0.53 -4.38 0.62 0.00 -1.02 0.00 0.00 32.46 28.21 1gio n ARG 124 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83