#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gou n VAL 2 N 0.00 -7.08 -3.59 0.00 0.31 -1.26 -5.01 118.33 101.70 1gou n VAL 2 Ca 0.00 1.34 -0.41 0.00 -0.01 0.00 0.00 64.34 65.26 1gou n VAL 2 Cb 0.00 -4.72 -0.11 0.00 -0.91 0.00 0.00 33.84 28.10 1gou n VAL 2 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1gou s ILE 3 N -0.70 4.58 0.00 2.52 1.01 -1.26 -4.91 121.20 122.43 1gou s ILE 3 Ca -0.10 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.65 1gou s ILE 3 Cb 0.01 -3.59 0.02 0.00 0.01 0.00 0.00 42.46 38.91 1gou s ILE 3 CO 0.40 -0.27 0.95 -0.46 0.00 0.00 0.00 174.94 175.56 1gou n ASN 4 N 5.00 0.05 -4.97 3.58 6.94 -1.26 -4.78 115.26 119.82 1gou n ASN 4 Ca -0.12 -1.89 -0.21 0.00 -0.02 0.00 0.00 54.58 52.35 1gou n ASN 4 Cb 0.46 -0.18 -0.01 0.00 -2.36 0.00 0.00 39.78 37.69 1gou n ASN 4 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1gou s THR 5 N 0.00 4.41 0.12 5.53 -4.23 -1.26 -0.67 115.64 119.54 1gou s THR 5 Ca 0.02 -0.84 -0.22 0.00 -1.18 0.00 0.00 61.69 59.47 1gou s THR 5 Cb 0.02 -3.56 -0.05 0.00 1.34 0.00 0.00 72.50 70.25 1gou s THR 5 CO -0.01 -0.27 1.70 -0.26 -0.54 0.00 0.00 174.62 175.24 1gou h PHE 6 N 0.83 -0.20 -0.35 3.99 -1.00 -1.98 -1.24 116.94 116.98 1gou h PHE 6 Ca -0.48 0.02 -0.13 0.00 2.81 0.00 0.00 57.97 60.19 1gou h PHE 6 Cb 1.25 0.11 -0.01 0.00 3.61 0.00 0.00 35.95 40.91 1gou h PHE 6 CO 0.44 -0.13 -0.28 -0.44 -1.61 0.00 0.00 178.31 176.30 1gou h ASP 7 N -0.09 0.84 -0.40 2.17 3.45 -1.98 -1.72 116.42 118.70 1gou h ASP 7 Ca 0.07 -0.45 0.04 0.00 0.43 0.00 0.00 57.03 57.12 1gou h ASP 7 Cb 0.20 -0.24 -0.04 0.00 -0.56 0.00 0.00 39.33 38.70 1gou h ASP 7 CO -0.17 1.11 0.18 1.23 -1.57 0.00 0.00 179.24 180.02 1gou h GLY 8 N 0.58 0.53 1.11 2.75 0.00 -1.93 -1.04 103.07 105.08 1gou h GLY 8 Ca 0.06 -0.12 -0.21 0.00 0.00 0.00 0.00 47.33 47.06 1gou h GLY 8 CO 0.07 0.08 -0.76 -2.08 0.00 0.00 0.00 176.54 173.85 1gou h VAL 9 N 0.37 1.30 -0.45 4.60 2.07 -1.25 -1.69 116.25 121.21 1gou h VAL 9 Ca 0.17 -1.98 0.01 0.00 0.82 0.00 0.00 66.70 65.73 1gou h VAL 9 Cb 0.10 2.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1gou h VAL 9 CO -0.14 0.62 0.28 0.00 0.02 0.00 0.00 177.57 178.35 1gou h ALA 10 N 0.51 0.57 -0.18 1.67 0.00 -1.20 -0.30 119.26 120.33 1gou h ALA 10 Ca -0.06 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.69 1gou h ALA 10 Cb 1.40 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 1gou h ALA 10 CO 0.16 -0.03 -0.47 -0.44 0.00 0.00 0.00 179.25 178.47 1gou h ASP 11 N 0.56 0.51 -0.29 0.00 3.32 -1.19 -2.13 116.42 117.21 1gou h ASP 11 Ca 0.17 -0.25 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 1gou h ASP 11 Cb -0.02 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1gou h ASP 11 CO -0.07 0.91 0.14 0.22 -1.72 0.00 0.00 179.24 178.72 1gou h TYR 12 N 0.38 0.42 -0.66 4.55 3.20 -1.01 -1.81 116.97 122.02 1gou h TYR 12 Ca 0.02 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.92 1gou h TYR 12 Cb 0.97 -0.13 -0.05 0.00 1.54 0.00 0.00 36.73 39.06 1gou h TYR 12 CO 0.03 0.38 0.39 -0.07 -1.64 0.00 0.00 178.16 177.25 1gou h LEU 13 N 0.33 0.60 -0.38 2.82 3.38 -0.83 0.28 115.31 121.52 1gou h LEU 13 Ca 0.10 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1gou h LEU 13 Cb 0.12 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1gou h LEU 13 CO -0.01 0.40 0.12 0.40 0.09 0.00 0.00 178.44 179.43 1gou h ILE 14 N 0.73 1.21 -0.16 1.22 2.04 -1.22 0.21 117.51 121.54 1gou h ILE 14 Ca 0.29 -0.70 -0.09 0.00 1.00 0.00 0.00 64.86 65.36 1gou h ILE 14 Cb 0.13 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.17 1gou h ILE 14 CO -0.15 0.24 -0.24 -0.09 0.00 0.00 0.00 178.15 177.91 1gou h ARG 15 N 0.46 0.45 -0.00 2.37 2.43 -1.09 -3.38 114.38 115.62 1gou h ARG 15 Ca 0.12 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1gou h ARG 15 Cb 0.26 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1gou h ARG 15 CO -0.00 0.86 -0.55 0.66 -1.51 0.00 0.00 179.97 179.43 1gou n TYR 16 N -4.43 0.00 -1.98 2.20 4.02 0.07 -5.01 117.16 112.03 1gou n TYR 16 Ca -0.06 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.65 1gou n TYR 16 Cb 0.44 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.72 1gou n TYR 16 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1gou n LYS 17 N -1.24 -1.34 -3.60 -0.72 4.76 0.74 -4.96 118.16 111.80 1gou n LYS 17 Ca 0.02 0.98 -0.11 0.00 -2.87 0.00 0.00 58.31 56.34 1gou n LYS 17 Cb 0.19 -5.37 -0.04 0.00 -1.84 0.00 0.00 35.03 27.97 1gou n LYS 17 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 1gou s ARG 18 N -4.28 1.16 0.64 1.97 1.70 -1.26 -5.06 118.95 113.82 1gou s ARG 18 Ca 0.00 -0.68 -0.15 0.00 -0.47 0.00 0.00 55.73 54.43 1gou s ARG 18 Cb 0.00 0.50 -0.01 0.00 -0.57 0.00 0.00 34.95 34.87 1gou s ARG 18 CO 0.00 -0.47 1.09 -0.51 -1.08 0.00 0.00 175.30 174.33 1gou s LEU 19 N -2.80 3.42 1.08 -1.89 1.43 -1.26 -4.11 118.68 114.54 1gou s LEU 19 Ca 0.03 1.94 -0.12 0.00 -1.03 0.00 0.00 54.13 54.96 1gou s LEU 19 Cb 0.01 -4.55 0.24 0.00 0.03 0.00 0.00 46.19 41.92 1gou s LEU 19 CO -0.11 -1.49 1.07 -2.84 0.23 0.00 0.00 176.35 173.21 1gou s PRO 20 N -4.10 -0.27 0.00 1.29 0.02 -1.26 -4.90 135.00 125.78 1gou s PRO 20 Ca 0.66 1.05 0.18 0.00 0.02 0.00 0.00 61.00 62.91 1gou s PRO 20 Cb -0.19 -1.61 0.84 0.00 0.02 0.00 0.00 34.50 33.56 1gou s PRO 20 CO 0.40 -3.35 1.54 0.09 -0.33 0.00 0.00 177.00 175.35 1gou n ASN 21 N -4.68 0.00 -0.27 2.53 3.02 -1.26 -2.20 115.26 112.40 1gou n ASN 21 Ca 0.06 0.18 0.15 0.00 -0.03 0.00 0.00 54.58 54.94 1gou n ASN 21 Cb 0.54 -0.36 0.71 0.00 -0.61 0.00 0.00 39.78 40.06 1gou n ASN 21 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1gou n ASP 22 N -1.36 0.86 -4.78 6.41 3.85 -1.26 -4.84 116.55 115.42 1gou n ASP 22 Ca 0.07 -1.29 -0.36 0.00 -0.71 0.00 0.00 54.79 52.51 1gou n ASP 22 Cb 0.16 -0.00 -0.07 0.00 -1.35 0.00 0.00 41.12 39.86 1gou n ASP 22 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1gou s TYR 23 N -2.00 3.45 0.02 2.11 1.51 -0.93 -0.87 117.35 120.64 1gou s TYR 23 Ca 0.42 0.37 0.03 0.00 -1.01 0.00 0.00 57.07 56.88 1gou s TYR 23 Cb 0.21 -2.00 -0.02 0.00 -0.11 0.00 0.00 41.96 40.04 1gou s TYR 23 CO 0.35 0.50 -0.08 0.96 -1.11 0.00 0.00 175.55 176.17 1gou s ILE 24 N -0.43 0.62 0.95 2.71 -4.36 -0.59 -4.88 121.20 115.22 1gou s ILE 24 Ca 0.11 -0.72 -0.12 0.00 -0.26 0.00 0.00 60.65 59.65 1gou s ILE 24 Cb -0.12 -0.60 0.16 0.00 1.25 0.00 0.00 42.46 43.15 1gou s ILE 24 CO 0.02 -0.10 1.12 0.42 0.24 0.00 0.00 174.94 176.64 1gou s THR 25 N -0.77 2.03 0.21 8.37 -4.23 -1.13 -0.60 115.64 119.52 1gou s THR 25 Ca -0.03 0.01 -0.10 0.00 -1.18 0.00 0.00 61.69 60.40 1gou s THR 25 Cb -0.06 -2.66 0.17 0.00 1.34 0.00 0.00 72.50 71.28 1gou s THR 25 CO 0.00 -0.01 1.88 0.11 -0.54 0.00 0.00 174.62 176.06 1gou h LYS 26 N -1.66 1.04 -0.15 3.99 1.57 -1.97 -0.25 116.57 119.15 1gou h LYS 26 Ca -0.52 -0.07 -0.11 0.00 -1.87 0.00 0.00 60.65 58.08 1gou h LYS 26 Cb 1.33 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 1gou h LYS 26 CO 0.60 0.70 -0.40 0.66 -0.57 0.00 0.00 179.45 180.45 1gou h SER 27 N 1.07 0.34 -0.23 0.86 4.64 -1.99 -0.90 113.55 117.34 1gou h SER 27 Ca 0.29 -0.14 -0.06 0.00 -0.47 0.00 0.00 61.79 61.40 1gou h SER 27 Cb -0.10 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1gou h SER 27 CO -0.06 0.71 -0.10 -0.61 -0.87 0.00 0.00 176.83 175.89 1gou h GLN 28 N 0.27 0.48 -0.76 4.77 5.75 -1.76 -1.87 115.11 121.98 1gou h GLN 28 Ca 0.03 -0.21 0.07 0.00 -0.15 0.00 0.00 58.65 58.40 1gou h GLN 28 Cb 0.82 -0.02 -0.06 0.00 1.07 0.00 0.00 27.48 29.29 1gou h GLN 28 CO 0.07 0.74 0.43 0.00 -2.65 0.00 0.00 178.83 177.42 1gou h ALA 29 N 0.72 1.05 -0.86 3.38 0.00 -0.87 -2.19 119.26 120.49 1gou h ALA 29 Ca 0.05 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1gou h ALA 29 Cb 0.60 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1gou h ALA 29 CO 0.03 0.10 0.55 0.77 0.00 0.00 0.00 179.25 180.69 1gou h SER 30 N 0.76 1.02 -0.16 0.00 0.02 -0.97 -1.25 113.55 112.97 1gou h SER 30 Ca 0.35 -0.05 0.02 0.00 -0.84 0.00 0.00 61.79 61.27 1gou h SER 30 Cb 0.26 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 1gou h SER 30 CO -0.21 0.76 0.11 0.00 -1.14 0.00 0.00 176.83 176.35 1gou h ALA 31 N 1.30 1.97 -0.00 3.77 0.00 -0.72 -1.64 119.26 123.95 1gou h ALA 31 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1gou h ALA 31 Cb -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1gou h ALA 31 CO -0.06 0.01 -0.15 1.28 0.00 0.00 0.00 179.25 180.32 1gou n LEU 32 N -4.51 0.51 0.00 0.00 4.77 -0.73 -4.93 117.00 112.11 1gou n LEU 32 Ca -0.00 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1gou n LEU 32 Cb 0.13 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1gou n LEU 32 CO 0.34 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1gou n GLY 33 N 1.32 1.22 3.73 -0.72 0.00 -0.61 -4.84 105.19 105.29 1gou n GLY 33 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1gou n GLY 33 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1gou s TRP 34 N -2.00 3.23 -0.15 1.61 -0.00 -0.55 -4.98 118.94 116.10 1gou s TRP 34 Ca 0.00 1.09 -0.01 0.00 -0.00 0.00 0.00 56.10 57.18 1gou s TRP 34 Cb 0.00 -3.66 0.04 0.00 -0.00 0.00 0.00 33.47 29.85 1gou s TRP 34 CO 0.00 -2.18 -0.06 0.08 -0.00 0.00 0.00 176.95 174.80 1gou s VAL 35 N 0.50 1.04 0.36 5.86 1.01 -1.26 -4.38 120.40 123.54 1gou s VAL 35 Ca 0.60 -0.49 0.08 0.00 0.00 0.00 0.00 61.98 62.18 1gou s VAL 35 Cb -0.37 -1.17 0.31 0.00 0.00 0.00 0.00 36.38 35.15 1gou s VAL 35 CO 0.35 0.20 1.91 0.00 0.00 0.00 0.00 175.10 177.57 1gou h ALA 36 N 8.15 1.81 0.00 5.51 0.00 -2.00 -1.25 119.26 131.49 1gou h ALA 36 Ca -0.26 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 1gou h ALA 36 Cb 1.12 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 1gou h ALA 36 CO 0.40 -0.00 -0.09 0.66 0.00 0.00 0.00 179.25 180.22 1gou h SER 37 N 0.69 0.00 0.76 0.00 4.64 -2.03 -2.27 113.55 115.34 1gou h SER 37 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1gou h SER 37 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1gou h SER 37 CO -0.16 0.09 -0.74 0.29 -0.87 0.00 0.00 176.83 175.45 1gou n LYS 38 N -3.30 0.30 -3.48 4.77 5.02 -0.48 -4.98 118.16 116.02 1gou n LYS 38 Ca -0.00 0.06 -0.25 0.00 -2.02 0.00 0.00 58.31 56.10 1gou n LYS 38 Cb 0.30 -1.67 0.05 0.00 -0.02 0.00 0.00 35.03 33.69 1gou n LYS 38 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1gou n GLY 39 N 1.34 -0.53 1.46 0.72 0.00 -0.86 -4.91 105.19 102.42 1gou n GLY 39 Ca 0.03 0.20 0.08 0.00 0.00 0.00 0.00 46.02 46.33 1gou n GLY 39 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gou n ASP 40 N -2.80 4.74 -0.22 1.61 5.75 -1.26 -3.82 116.55 120.56 1gou n ASP 40 Ca -0.02 -2.68 -0.05 0.00 -0.01 0.00 0.00 54.79 52.03 1gou n ASP 40 Cb 0.57 -0.58 0.05 0.00 -1.03 0.00 0.00 41.12 40.14 1gou n ASP 40 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 1gou h LEU 41 N 3.41 0.65 -1.56 -2.12 5.85 -1.90 -1.78 115.31 117.87 1gou h LEU 41 Ca 0.00 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1gou h LEU 41 Cb 1.56 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.44 1gou h LEU 41 CO 0.29 0.46 -0.22 0.00 -0.34 0.00 0.00 178.44 178.63 1gou h ALA 42 N 1.26 1.29 0.18 1.25 0.00 -1.84 0.75 119.26 122.14 1gou h ALA 42 Ca 0.24 -0.20 -0.30 0.00 0.00 0.00 0.00 54.91 54.65 1gou h ALA 42 Cb -0.02 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.76 1gou h ALA 42 CO -0.09 0.27 -1.36 0.93 0.00 0.00 0.00 179.25 179.01 1gou h GLU 43 N 0.00 0.38 0.00 0.00 3.07 -1.70 -3.07 114.58 113.26 1gou h GLU 43 Ca -0.00 -0.64 -0.08 0.00 -0.50 0.00 0.00 59.36 58.14 1gou h GLU 43 Cb 0.51 0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.64 1gou h GLU 43 CO 0.03 1.30 -1.09 -0.39 -1.40 0.00 0.00 179.01 177.47 1gou h VAL 44 N 0.10 0.27 -1.81 3.13 -1.51 -1.24 -3.41 116.25 111.79 1gou h VAL 44 Ca -0.19 -1.51 -0.52 0.00 -1.23 0.00 0.00 66.70 63.25 1gou h VAL 44 Cb 2.05 1.82 -0.36 0.00 -2.13 0.00 0.00 31.29 32.68 1gou h VAL 44 CO 0.23 0.15 -1.01 0.00 -1.23 0.00 0.00 177.57 175.71 1gou n ALA 45 N -2.27 1.98 -1.67 5.19 0.00 0.24 -4.90 120.51 119.08 1gou n ALA 45 Ca -0.04 -3.10 -0.45 0.00 0.00 0.00 0.00 53.44 49.86 1gou n ALA 45 Cb 0.69 -0.87 -0.03 0.00 0.00 0.00 0.00 19.45 19.23 1gou n ALA 45 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1gou n PRO 46 N 1.65 2.06 -0.76 0.00 -0.02 -1.16 -1.62 135.00 135.15 1gou n PRO 46 Ca 0.21 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 1gou n PRO 46 Cb 0.54 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 1gou n PRO 46 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gou n GLY 47 N 2.30 1.44 3.93 -1.23 0.00 -1.26 -5.02 105.19 105.35 1gou n GLY 47 Ca 0.12 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.87 1gou n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gou s LYS 48 N -0.02 3.52 0.10 1.61 -0.14 -0.64 -4.81 119.74 119.36 1gou s LYS 48 Ca 0.00 -0.35 0.05 0.00 -1.36 0.00 0.00 55.97 54.30 1gou s LYS 48 Cb 0.00 -2.83 -0.04 0.00 -1.68 0.00 0.00 37.83 33.29 1gou s LYS 48 CO 0.00 0.38 -0.12 -1.12 -0.76 0.00 0.00 175.35 173.73 1gou s SER 49 N -3.25 1.71 0.10 2.83 0.01 -0.05 -4.83 113.70 110.21 1gou s SER 49 Ca 0.38 -0.79 -0.30 0.00 1.31 0.00 0.00 55.95 56.56 1gou s SER 49 Cb -0.11 -0.03 -0.06 0.00 0.21 0.00 0.00 66.02 66.03 1gou s SER 49 CO 0.29 -0.19 1.16 -0.63 0.41 0.00 0.00 173.24 174.28 1gou s ILE 50 N -2.16 4.02 -0.24 1.44 -1.09 -1.26 -1.54 121.20 120.36 1gou s ILE 50 Ca 0.06 1.54 -0.35 0.00 -2.23 0.00 0.00 60.65 59.66 1gou s ILE 50 Cb -0.05 -3.98 0.16 0.00 -1.58 0.00 0.00 42.46 37.01 1gou s ILE 50 CO 0.02 0.17 1.29 -0.83 -1.23 0.00 0.00 174.94 174.36 1gou s GLY 51 N 0.68 -0.18 0.00 6.18 0.00 0.23 -1.00 107.32 113.23 1gou s GLY 51 Ca 0.55 1.99 0.00 0.00 0.00 0.00 0.00 44.72 47.26 1gou s GLY 51 CO 0.31 0.71 0.00 0.61 0.00 0.00 0.00 173.10 174.73 1gou n GLY 52 N 0.10 0.80 3.75 0.20 0.00 0.61 -2.86 105.19 107.80 1gou n GLY 52 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1gou n GLY 52 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1gou s ASP 53 N -1.92 5.07 0.35 1.61 1.01 -1.25 -4.73 116.67 116.81 1gou s ASP 53 Ca 0.00 2.33 -0.28 0.00 0.71 0.00 0.00 52.55 55.31 1gou s ASP 53 Cb 0.00 -2.59 -0.11 0.00 1.01 0.00 0.00 42.92 41.23 1gou s ASP 53 CO 0.00 -1.67 1.48 -0.69 0.21 0.00 0.00 175.17 174.50 1gou s VAL 54 N -1.73 2.14 -0.29 -1.27 1.01 -1.26 -1.64 120.40 117.35 1gou s VAL 54 Ca 0.76 0.14 -0.04 0.00 0.00 0.00 0.00 61.98 62.84 1gou s VAL 54 Cb -0.29 -3.09 0.03 0.00 0.00 0.00 0.00 36.38 33.04 1gou s VAL 54 CO 0.35 0.03 0.02 0.12 0.00 0.00 0.00 175.10 175.62 1gou s PHE 55 N -0.90 3.18 -0.13 5.22 5.36 -0.36 -4.80 117.98 125.56 1gou s PHE 55 Ca 0.54 -1.51 -0.25 0.00 -0.96 0.00 0.00 56.93 54.76 1gou s PHE 55 Cb -0.46 -2.16 -0.02 0.00 -0.34 0.00 0.00 43.02 40.04 1gou s PHE 55 CO 0.59 -0.72 0.79 -1.54 -1.46 0.00 0.00 175.22 172.88 1gou s SER 56 N 1.36 6.98 -0.85 6.13 1.04 -1.26 -4.25 113.70 122.84 1gou s SER 56 Ca -0.01 1.19 -0.01 0.00 0.48 0.00 0.00 55.95 57.59 1gou s SER 56 Cb -0.18 -2.44 0.35 0.00 0.10 0.00 0.00 66.02 63.84 1gou s SER 56 CO -0.00 -0.30 1.95 -3.20 0.98 0.00 0.00 173.24 172.67 1gou n ASN 57 N 4.70 7.35 0.24 7.02 5.15 -1.26 -4.69 115.26 133.76 1gou n ASN 57 Ca 0.02 -3.81 0.09 0.00 -0.60 0.00 0.00 54.58 50.28 1gou n ASN 57 Cb 0.50 -1.05 0.59 0.00 -0.53 0.00 0.00 39.78 39.29 1gou n ASN 57 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1gou h ARG 58 N 3.13 0.00 -0.00 1.20 2.47 -1.99 -1.93 114.38 117.26 1gou h ARG 58 Ca 0.55 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.27 1gou h ARG 58 Cb 0.11 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.43 1gou h ARG 58 CO 1.37 0.19 -0.02 0.39 0.56 0.00 0.00 179.97 182.46 1gou n GLU 59 N -3.83 0.97 -2.21 0.04 1.02 -1.26 -4.94 120.64 110.42 1gou n GLU 59 Ca -0.02 -0.21 -0.21 0.00 -0.02 0.00 0.00 57.16 56.70 1gou n GLU 59 Cb 0.29 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.19 1gou n GLU 59 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1gou n GLY 60 N 1.13 0.09 0.18 0.62 0.00 -0.72 -4.88 105.19 101.59 1gou n GLY 60 Ca 0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.26 1gou n GLY 60 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1gou h ARG 61 N 0.00 0.00 -6.16 1.61 3.08 -1.92 -3.43 114.38 107.55 1gou h ARG 61 Ca -0.48 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 58.96 1gou h ARG 61 Cb 1.37 0.00 -0.07 0.00 0.08 0.00 0.00 29.97 31.35 1gou h ARG 61 CO 0.60 0.42 -0.57 -0.51 -1.07 0.00 0.00 179.97 178.84 1gou s LEU 62 N -7.21 3.87 0.33 3.04 1.43 -1.26 -5.03 118.68 113.85 1gou s LEU 62 Ca -0.00 -0.03 -0.29 0.00 -1.03 0.00 0.00 54.13 52.78 1gou s LEU 62 Cb 0.11 -2.51 -0.11 0.00 0.03 0.00 0.00 46.19 43.71 1gou s LEU 62 CO 0.70 0.12 1.48 -2.16 0.23 0.00 0.00 176.35 176.72 1gou s PRO 63 N -2.75 4.17 0.00 1.29 0.04 -1.26 -5.00 135.00 131.49 1gou s PRO 63 Ca 0.31 2.48 -0.01 0.00 0.04 0.00 0.00 61.00 63.81 1gou s PRO 63 Cb -0.11 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.37 1gou s PRO 63 CO 0.23 -0.49 0.13 -1.12 0.04 0.00 0.00 177.00 175.79 1gou s SER 64 N 0.05 5.98 0.09 6.66 0.01 -1.26 -5.08 113.70 120.14 1gou s SER 64 Ca 0.56 0.22 -0.14 0.00 1.31 0.00 0.00 55.95 57.91 1gou s SER 64 Cb -0.45 -1.79 0.02 0.00 0.21 0.00 0.00 66.02 64.01 1gou s SER 64 CO 0.55 0.26 0.33 0.00 0.41 0.00 0.00 173.24 174.78 1gou s ALA 65 N -1.27 -0.70 0.00 1.44 0.00 -1.26 -5.08 121.76 114.89 1gou s ALA 65 Ca 0.25 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.08 1gou s ALA 65 Cb -0.12 0.51 0.00 0.00 0.00 0.00 0.00 23.12 23.51 1gou s ALA 65 CO 0.17 -0.53 0.65 0.41 0.00 0.00 0.00 175.76 176.46 1gou n GLY 66 N 0.09 -3.33 1.72 0.00 0.00 -1.26 -1.90 105.19 100.51 1gou n GLY 66 Ca -0.17 0.68 -0.12 0.00 0.00 0.00 0.00 46.02 46.41 1gou n GLY 66 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1gou n SER 67 N -1.71 3.55 -4.69 1.61 2.88 -1.26 -4.95 113.62 109.06 1gou n SER 67 Ca 0.00 -2.95 -0.39 0.00 -1.33 0.00 0.00 58.87 54.20 1gou n SER 67 Cb 0.00 -0.70 -0.06 0.00 -0.75 0.00 0.00 64.21 62.70 1gou n SER 67 CO 0.00 0.00 0.00 -0.60 -1.23 0.00 0.00 175.04 173.21 1gou s ARG 68 N -2.09 4.28 0.39 -1.46 3.52 -0.80 -4.95 118.95 117.84 1gou s ARG 68 Ca 0.36 0.55 0.06 0.00 -0.13 0.00 0.00 55.73 56.57 1gou s ARG 68 Cb 0.30 -3.51 -0.08 0.00 -1.56 0.00 0.00 34.95 30.10 1gou s ARG 68 CO 0.07 -0.05 0.02 0.95 -0.81 0.00 0.00 175.30 175.49 1gou s THR 69 N 1.27 1.77 0.04 4.11 -4.23 -1.26 -4.76 115.64 112.58 1gou s THR 69 Ca 0.28 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.82 1gou s THR 69 Cb -0.16 -2.94 -0.02 0.00 1.34 0.00 0.00 72.50 70.72 1gou s THR 69 CO 0.11 0.00 -0.10 0.26 -0.54 0.00 0.00 174.62 174.35 1gou s TRP 70 N -2.88 0.85 0.21 3.99 0.52 -1.26 -0.88 118.94 119.50 1gou s TRP 70 Ca 0.35 -0.41 0.03 0.00 0.02 0.00 0.00 56.10 56.10 1gou s TRP 70 Cb 0.10 -0.50 -0.05 0.00 -1.15 0.00 0.00 33.47 31.86 1gou s TRP 70 CO 0.17 -0.02 -0.02 1.03 0.02 0.00 0.00 176.95 178.13 1gou s ARG 71 N -1.33 1.27 0.15 4.98 0.52 -0.16 -1.22 118.95 123.16 1gou s ARG 71 Ca -0.05 -1.63 0.05 0.00 -0.52 0.00 0.00 55.73 53.59 1gou s ARG 71 Cb -0.09 -0.58 -0.04 0.00 0.52 0.00 0.00 34.95 34.76 1gou s ARG 71 CO 0.01 -0.08 -0.11 -1.83 0.02 0.00 0.00 175.30 173.31 1gou s GLU 72 N -3.85 1.09 -0.07 3.54 -1.05 -0.65 -0.93 118.70 116.77 1gou s GLU 72 Ca 0.26 -1.43 -0.11 0.00 -0.15 0.00 0.00 54.97 53.54 1gou s GLU 72 Cb 0.05 -0.72 0.02 0.00 -0.44 0.00 0.00 34.13 33.05 1gou s GLU 72 CO 0.07 0.10 0.28 0.00 0.95 0.00 0.00 175.26 176.66 1gou s ALA 73 N -3.11 -0.70 0.30 -0.84 0.00 0.14 -0.28 121.76 117.26 1gou s ALA 73 Ca 0.16 0.59 -0.28 0.00 0.00 0.00 0.00 51.96 52.43 1gou s ALA 73 Cb 0.01 -0.26 -0.09 0.00 0.00 0.00 0.00 23.12 22.77 1gou s ALA 73 CO 0.02 -0.18 1.00 -0.51 0.00 0.00 0.00 175.76 176.09 1gou s ASP 74 N -0.42 7.33 0.06 0.00 1.11 -0.17 -0.87 116.67 123.71 1gou s ASP 74 Ca -0.05 2.02 0.08 0.00 0.18 0.00 0.00 52.55 54.78 1gou s ASP 74 Cb -0.04 -2.60 -0.03 0.00 1.07 0.00 0.00 42.92 41.32 1gou s ASP 74 CO 0.02 -0.08 -0.22 -0.63 1.18 0.00 0.00 175.17 175.44 1gou s ILE 75 N -1.36 1.80 -1.09 0.77 -1.09 -0.66 -4.72 121.20 114.84 1gou s ILE 75 Ca 0.47 -1.32 0.00 0.00 -2.23 0.00 0.00 60.65 57.56 1gou s ILE 75 Cb -0.25 -1.57 0.00 0.00 -1.58 0.00 0.00 42.46 39.06 1gou s ILE 75 CO 0.32 0.18 0.00 0.59 -1.23 0.00 0.00 174.94 174.80 1gou n ASN 76 N 1.65 -4.73 -4.73 3.58 3.02 0.15 -4.52 115.26 109.68 1gou n ASN 76 Ca -0.18 0.25 -0.41 0.00 -0.03 0.00 0.00 54.58 54.22 1gou n ASN 76 Cb 0.53 -3.14 -0.04 0.00 -0.61 0.00 0.00 39.78 36.52 1gou n ASN 76 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1gou s TYR 77 N -2.22 3.69 0.10 3.10 5.04 -1.26 -4.92 117.35 120.88 1gou s TYR 77 Ca 0.00 1.68 0.00 0.00 -2.44 0.00 0.00 57.07 56.31 1gou s TYR 77 Cb 0.00 -3.17 0.00 0.00 0.35 0.00 0.00 41.96 39.14 1gou s TYR 77 CO 0.00 -0.24 0.00 0.28 -1.34 0.00 0.00 175.55 174.25 1gou n VAL 78 N 2.79 1.19 -3.75 3.14 0.31 -1.26 -4.97 118.33 115.78 1gou n VAL 78 Ca 0.03 0.39 -0.06 0.00 -0.01 0.00 0.00 64.34 64.69 1gou n VAL 78 Cb 0.48 -1.56 -0.02 0.00 -0.91 0.00 0.00 33.84 31.83 1gou n VAL 78 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1gou s SER 79 N -5.96 -0.27 0.00 4.52 1.04 -1.26 -4.76 113.70 107.00 1gou s SER 79 Ca 0.00 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.01 1gou s SER 79 Cb 0.00 0.61 0.00 0.00 0.10 0.00 0.00 66.02 66.73 1gou s SER 79 CO 0.00 -1.10 0.00 0.61 0.98 0.00 0.00 173.24 173.73 1gou n GLY 80 N -0.44 -1.07 3.75 7.32 0.00 -1.25 -4.87 105.19 108.63 1gou n GLY 80 Ca -0.07 -1.24 -0.36 0.00 0.00 0.00 0.00 46.02 44.35 1gou n GLY 80 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gou s PHE 81 N 0.00 2.29 0.69 1.61 0.40 -1.26 -4.58 117.98 117.13 1gou s PHE 81 Ca 0.00 1.50 -0.17 0.00 -0.60 0.00 0.00 56.93 57.66 1gou s PHE 81 Cb 0.00 -3.56 0.02 0.00 0.51 0.00 0.00 43.02 39.98 1gou s PHE 81 CO 0.00 -2.46 1.27 1.03 0.70 0.00 0.00 175.22 175.76 1gou s ARG 82 N -3.32 2.29 0.00 0.44 0.52 -1.26 -5.01 118.95 112.61 1gou s ARG 82 Ca 0.79 1.97 0.00 0.00 -0.52 0.00 0.00 55.73 57.97 1gou s ARG 82 Cb -0.33 -1.83 0.00 0.00 0.52 0.00 0.00 34.95 33.31 1gou s ARG 82 CO 0.36 -1.77 0.00 0.27 0.02 0.00 0.00 175.30 174.17 1gou n ASN 83 N -2.31 0.00 -0.95 0.23 0.23 -1.26 -5.05 115.26 106.16 1gou n ASN 83 Ca 0.15 -0.40 0.11 0.00 -0.53 0.00 0.00 54.58 53.90 1gou n ASN 83 Cb 0.49 0.00 0.14 0.00 -2.08 0.00 0.00 39.78 38.32 1gou n ASN 83 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1gou n ALA 84 N -3.00 2.44 -2.75 -2.53 0.00 -1.26 -4.93 120.51 108.48 1gou n ALA 84 Ca 0.00 -0.81 -0.35 0.00 0.00 0.00 0.00 53.44 52.28 1gou n ALA 84 Cb 0.00 -0.75 -0.08 0.00 0.00 0.00 0.00 19.45 18.61 1gou n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gou s ASP 85 N -1.62 6.07 0.01 0.00 1.01 -1.26 -1.30 116.67 119.58 1gou s ASP 85 Ca 0.30 0.19 -0.04 0.00 0.71 0.00 0.00 52.55 53.70 1gou s ASP 85 Cb 0.19 -2.06 -0.01 0.00 1.01 0.00 0.00 42.92 42.05 1gou s ASP 85 CO 0.28 0.17 0.07 -0.13 0.21 0.00 0.00 175.17 175.77 1gou s ARG 86 N 0.39 0.43 -0.09 8.23 1.81 -0.26 -1.65 118.95 127.81 1gou s ARG 86 Ca 0.07 -0.53 -0.00 0.00 -1.72 0.00 0.00 55.73 53.55 1gou s ARG 86 Cb -0.11 0.17 -0.03 0.00 -0.45 0.00 0.00 34.95 34.53 1gou s ARG 86 CO -0.01 -0.09 -0.08 -1.17 -0.68 0.00 0.00 175.30 173.27 1gou s LEU 87 N -1.51 3.09 -0.11 2.53 0.20 -0.05 -1.31 118.68 121.52 1gou s LEU 87 Ca -0.14 -0.10 0.02 0.00 0.69 0.00 0.00 54.13 54.61 1gou s LEU 87 Cb -0.08 -1.69 0.01 0.00 -0.43 0.00 0.00 46.19 44.00 1gou s LEU 87 CO -0.00 0.29 -0.19 -0.69 -0.29 0.00 0.00 176.35 175.47 1gou s VAL 88 N -0.38 1.72 -0.01 1.68 1.01 0.06 -0.69 120.40 123.79 1gou s VAL 88 Ca 0.05 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.27 1gou s VAL 88 Cb -0.12 -1.53 -0.01 0.00 0.00 0.00 0.00 36.38 34.72 1gou s VAL 88 CO 0.02 0.48 -0.10 -0.72 0.00 0.00 0.00 175.10 174.79 1gou s TYR 89 N 0.76 0.92 0.48 5.22 -0.85 -0.10 -0.69 117.35 123.09 1gou s TYR 89 Ca -0.11 -0.19 0.02 0.00 -0.52 0.00 0.00 57.07 56.28 1gou s TYR 89 Cb -0.16 -0.61 0.01 0.00 0.38 0.00 0.00 41.96 41.59 1gou s TYR 89 CO 0.01 -0.03 0.69 -1.54 -1.52 0.00 0.00 175.55 173.16 1gou s SER 90 N -0.14 5.58 0.50 -0.18 1.04 -0.37 -0.99 113.70 119.13 1gou s SER 90 Ca 0.02 0.06 0.32 0.00 0.48 0.00 0.00 55.95 56.83 1gou s SER 90 Cb -0.05 -1.15 1.32 0.00 0.10 0.00 0.00 66.02 66.24 1gou s SER 90 CO -0.00 -0.88 1.94 0.77 0.98 0.00 0.00 173.24 176.04 1gou h SER 91 N 0.31 0.00 -0.53 7.02 4.64 -1.35 -2.09 113.55 121.54 1gou h SER 91 Ca -0.44 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.78 1gou h SER 91 Cb 1.27 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.30 1gou h SER 91 CO 0.54 0.00 0.10 -0.90 -0.87 0.00 0.00 176.83 175.70 1gou n ASP 92 N -2.92 4.55 -0.84 4.97 3.85 -1.26 -4.99 116.55 119.91 1gou n ASP 92 Ca 0.01 -3.16 -0.08 0.00 -0.71 0.00 0.00 54.79 50.84 1gou n ASP 92 Cb 0.29 -0.67 -0.02 0.00 -1.35 0.00 0.00 41.12 39.37 1gou n ASP 92 CO 0.00 0.00 0.00 0.79 -1.01 0.00 0.00 177.20 176.98 1gou n TRP 93 N -0.19 -0.24 -2.70 2.11 7.02 -0.79 -5.03 117.44 117.63 1gou n TRP 93 Ca 0.32 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 56.40 1gou n TRP 93 Cb 1.18 -2.01 -0.05 0.00 -2.42 0.00 0.00 31.31 28.00 1gou n TRP 93 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1gou s LEU 94 N -2.24 4.59 -0.09 -0.99 1.43 -1.26 -4.87 118.68 115.26 1gou s LEU 94 Ca 0.00 1.96 0.00 0.00 -1.03 0.00 0.00 54.13 55.06 1gou s LEU 94 Cb 0.00 -3.61 0.02 0.00 0.03 0.00 0.00 46.19 42.64 1gou s LEU 94 CO 0.00 0.05 -0.07 -0.63 0.23 0.00 0.00 176.35 175.93 1gou s ILE 95 N -0.84 0.92 0.15 -0.59 1.01 -0.65 -1.24 121.20 119.96 1gou s ILE 95 Ca 0.43 -0.27 0.10 0.00 0.00 0.00 0.00 60.65 60.92 1gou s ILE 95 Cb -0.26 -0.93 -0.04 0.00 0.01 0.00 0.00 42.46 41.24 1gou s ILE 95 CO 0.33 0.34 -0.20 -0.31 0.00 0.00 0.00 174.94 175.09 1gou s TYR 96 N 1.40 2.45 0.16 3.97 1.51 0.14 -0.47 117.35 126.51 1gou s TYR 96 Ca -0.01 -0.30 0.11 0.00 -1.01 0.00 0.00 57.07 55.85 1gou s TYR 96 Cb -0.13 -1.27 -0.04 0.00 -0.11 0.00 0.00 41.96 40.41 1gou s TYR 96 CO -0.04 0.42 -0.25 -1.59 -1.11 0.00 0.00 175.55 172.98 1gou s LYS 97 N -2.36 1.46 -0.01 -0.62 -2.85 0.14 -0.76 119.74 114.74 1gou s LYS 97 Ca 0.19 -1.44 0.02 0.00 -1.00 0.00 0.00 55.97 53.73 1gou s LYS 97 Cb -0.10 -1.87 -0.00 0.00 -2.06 0.00 0.00 37.83 33.80 1gou s LYS 97 CO 0.10 0.42 -0.05 -0.08 0.10 0.00 0.00 175.35 175.84 1gou s THR 98 N -1.38 0.42 -0.25 3.79 -1.32 -0.43 -1.07 115.64 115.40 1gou s THR 98 Ca 0.18 -0.21 0.04 0.00 -1.21 0.00 0.00 61.69 60.49 1gou s THR 98 Cb -0.09 -0.37 0.11 0.00 -1.51 0.00 0.00 72.50 70.64 1gou s THR 98 CO 0.08 0.13 1.09 0.35 -2.21 0.00 0.00 174.62 174.05 1gou n THR 99 N 3.09 1.08 -2.35 5.08 -2.24 -1.26 -1.10 114.28 116.58 1gou n THR 99 Ca -0.15 -1.10 -0.04 0.00 -2.27 0.00 0.00 64.05 60.50 1gou n THR 99 Cb 0.57 0.44 0.06 0.00 -2.10 0.00 0.00 70.33 69.30 1gou n THR 99 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1gou n ASP 100 N -0.29 2.22 -3.60 3.42 3.85 -1.20 -4.67 116.55 116.28 1gou n ASP 100 Ca 0.04 -2.73 -0.20 0.00 -0.71 0.00 0.00 54.79 51.19 1gou n ASP 100 Cb 0.33 -0.41 0.06 0.00 -1.35 0.00 0.00 41.12 39.75 1gou n ASP 100 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.20 177.76 1gou n HIS 101 N -0.43 -2.05 -1.00 2.11 -0.00 -0.42 -2.90 115.22 110.52 1gou n HIS 101 Ca 0.17 0.88 -0.00 0.00 -0.00 0.00 0.00 57.72 58.78 1gou n HIS 101 Cb 0.91 -4.66 -0.00 0.00 -0.00 0.00 0.00 29.99 26.24 1gou n HIS 101 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1gou n TYR 102 N -4.25 0.00 -0.03 1.57 4.02 -1.26 -4.93 117.16 112.28 1gou n TYR 102 Ca -0.28 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.46 1gou n TYR 102 Cb 0.67 -0.23 -0.09 0.00 -0.02 0.00 0.00 39.34 39.67 1gou n TYR 102 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1gou h ALA 103 N 0.00 0.14 -3.02 -0.72 0.00 -1.94 -3.46 119.26 110.26 1gou h ALA 103 Ca -0.00 -0.43 -0.29 0.00 0.00 0.00 0.00 54.91 54.18 1gou h ALA 103 Cb 0.02 -0.01 -0.20 0.00 0.00 0.00 0.00 17.79 17.60 1gou h ALA 103 CO 0.00 0.17 -0.73 0.95 0.00 0.00 0.00 179.25 179.64 1gou s THR 104 N -3.69 0.68 0.07 0.00 -4.23 -1.26 -5.13 115.64 102.08 1gou s THR 104 Ca -0.14 -1.29 0.06 0.00 -1.18 0.00 0.00 61.69 59.14 1gou s THR 104 Cb 0.04 -0.90 -0.03 0.00 1.34 0.00 0.00 72.50 72.95 1gou s THR 104 CO 0.77 -0.45 -0.16 -0.36 -0.54 0.00 0.00 174.62 173.88 1gou s PHE 105 N -1.79 1.39 -0.05 3.99 0.40 -1.26 -4.44 117.98 116.21 1gou s PHE 105 Ca -0.04 -0.43 0.02 0.00 -0.60 0.00 0.00 56.93 55.88 1gou s PHE 105 Cb -0.07 -0.78 0.01 0.00 0.51 0.00 0.00 43.02 42.69 1gou s PHE 105 CO -0.00 0.09 -0.09 0.99 0.70 0.00 0.00 175.22 176.91 1gou s THR 106 N -1.16 0.89 0.14 0.64 2.01 -0.23 -4.95 115.64 112.97 1gou s THR 106 Ca 0.01 -0.35 -0.30 0.00 0.31 0.00 0.00 61.69 61.36 1gou s THR 106 Cb -0.10 -0.83 -0.07 0.00 0.01 0.00 0.00 72.50 71.51 1gou s THR 106 CO 0.03 0.30 1.16 -0.60 -0.69 0.00 0.00 174.62 174.81 1gou s ARG 107 N 0.67 4.51 0.00 4.92 3.52 -1.26 -0.69 118.95 130.62 1gou s ARG 107 Ca -0.12 1.78 0.00 0.00 -0.13 0.00 0.00 55.73 57.26 1gou s ARG 107 Cb -0.14 -3.29 0.00 0.00 -1.56 0.00 0.00 34.95 29.96 1gou s ARG 107 CO 0.02 -0.08 0.00 0.44 -0.81 0.00 0.00 175.30 174.87 1gou n ILE 108 N 2.93 0.00 -1.08 4.11 -5.35 0.38 -4.92 119.36 115.44 1gou n ILE 108 Ca 0.05 -0.07 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 1gou n ILE 108 Cb 0.46 0.57 0.00 0.00 -1.74 0.00 0.00 39.64 38.92 1gou n ILE 108 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33