#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2afg s LYS 12 N 0.00 2.01 -0.02 -0.52 1.02 0.41 -2.08 119.74 120.56 2afg s LYS 12 Ca 0.00 -2.24 0.05 0.00 0.02 0.00 0.00 55.97 53.80 2afg s LYS 12 Cb 0.00 -0.87 -0.01 0.00 -0.52 0.00 0.00 37.83 36.43 2afg s LYS 12 CO 0.00 -0.45 -0.17 -0.51 -0.92 0.00 0.00 175.35 173.30 2afg s LEU 13 N -3.68 2.02 -0.36 3.17 1.43 0.11 -1.43 118.68 119.93 2afg s LEU 13 Ca 0.19 -0.31 -0.09 0.00 -1.03 0.00 0.00 54.13 52.89 2afg s LEU 13 Cb 0.02 -0.87 0.03 0.00 0.03 0.00 0.00 46.19 45.40 2afg s LEU 13 CO 0.11 0.20 0.16 -0.76 0.23 0.00 0.00 176.35 176.30 2afg s LEU 14 N -0.36 4.54 -0.21 1.79 1.43 -1.26 -0.12 118.68 124.49 2afg s LEU 14 Ca 0.06 -1.06 -0.09 0.00 -1.03 0.00 0.00 54.13 52.00 2afg s LEU 14 Cb -0.07 -1.95 -0.05 0.00 0.03 0.00 0.00 46.19 44.15 2afg s LEU 14 CO -0.00 -0.36 0.12 -0.47 0.23 0.00 0.00 176.35 175.86 2afg s TYR 15 N 1.48 3.32 -0.15 0.29 6.14 0.15 -1.89 117.35 126.70 2afg s TYR 15 Ca 0.00 0.20 -0.21 0.00 0.64 0.00 0.00 57.07 57.70 2afg s TYR 15 Cb -0.19 -2.17 -0.03 0.00 0.42 0.00 0.00 41.96 39.98 2afg s TYR 15 CO 0.05 0.16 0.61 0.00 0.64 0.00 0.00 175.55 177.01 2afg h SER 17 N 7.16 1.05 0.00 0.00 0.87 -0.52 0.16 113.55 122.27 2afg h SER 17 Ca -0.36 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 2afg h SER 17 Cb 1.16 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.86 2afg h SER 17 CO 0.76 0.76 0.00 -3.20 -0.53 0.00 0.00 176.83 174.62 2afg n ASN 18 N -4.40 0.00 -0.66 6.23 2.85 -1.02 -4.00 115.26 114.26 2afg n ASN 18 Ca 0.11 0.40 0.12 0.00 -0.11 0.00 0.00 54.58 55.10 2afg n ASN 18 Cb 0.03 0.00 0.09 0.00 1.24 0.00 0.00 39.78 41.14 2afg n ASN 18 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2afg n GLY 19 N -0.59 0.36 1.92 8.20 0.00 -1.25 -4.90 105.19 108.92 2afg n GLY 19 Ca 0.00 -0.63 -0.01 0.00 0.00 0.00 0.00 46.02 45.38 2afg n GLY 19 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2afg n GLY 20 N 1.37 0.46 3.90 -0.02 0.00 0.56 -5.05 105.19 106.41 2afg n GLY 20 Ca 0.12 -0.82 -0.31 0.00 0.00 0.00 0.00 46.02 45.00 2afg n GLY 20 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2afg s HIS 21 N -2.22 3.47 -0.06 1.61 3.76 -1.19 -4.72 115.29 115.93 2afg s HIS 21 Ca 0.00 0.56 -0.15 0.00 -0.15 0.00 0.00 55.06 55.32 2afg s HIS 21 Cb -0.00 -2.01 -0.05 0.00 1.11 0.00 0.00 32.58 31.63 2afg s HIS 21 CO 0.00 0.41 0.39 -0.06 -0.85 0.00 0.00 174.74 174.63 2afg s PHE 22 N -1.71 3.62 0.13 1.40 0.08 -0.50 -0.11 117.98 120.89 2afg s PHE 22 Ca 0.41 0.88 -0.31 0.00 0.12 0.00 0.00 56.93 58.03 2afg s PHE 22 Cb -0.12 -2.35 -0.10 0.00 -0.57 0.00 0.00 43.02 39.88 2afg s PHE 22 CO 0.25 0.45 1.76 -1.17 -0.10 0.00 0.00 175.22 176.41 2afg s LEU 23 N -0.35 4.39 -0.12 -0.37 2.96 -0.80 -2.20 118.68 122.20 2afg s LEU 23 Ca 0.23 2.71 0.03 0.00 -0.22 0.00 0.00 54.13 56.88 2afg s LEU 23 Cb -0.15 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 42.97 2afg s LEU 23 CO 0.10 -0.96 -0.23 -0.60 -1.32 0.00 0.00 176.35 173.34 2afg s ARG 24 N 2.34 3.02 -0.49 1.98 3.52 0.89 -4.39 118.95 125.81 2afg s ARG 24 Ca 0.78 -0.86 -0.14 0.00 -0.13 0.00 0.00 55.73 55.37 2afg s ARG 24 Cb -0.45 -2.36 0.10 0.00 -1.56 0.00 0.00 34.95 30.68 2afg s ARG 24 CO 0.34 0.07 0.42 0.42 -0.81 0.00 0.00 175.30 175.74 2afg s ILE 25 N 0.60 5.01 0.48 4.11 1.01 -0.82 -1.69 121.20 129.91 2afg s ILE 25 Ca -0.12 -1.35 -0.21 0.00 0.00 0.00 0.00 60.65 58.97 2afg s ILE 25 Cb -0.17 -4.12 -0.08 0.00 0.01 0.00 0.00 42.46 38.11 2afg s ILE 25 CO 0.03 -0.71 1.07 -0.76 0.00 0.00 0.00 174.94 174.57 2afg s LEU 26 N 1.57 3.88 0.38 2.97 1.43 0.38 -4.84 118.68 124.46 2afg s LEU 26 Ca 0.04 2.03 0.11 0.00 -1.03 0.00 0.00 54.13 55.28 2afg s LEU 26 Cb -0.27 -4.48 0.90 0.00 0.03 0.00 0.00 46.19 42.37 2afg s LEU 26 CO 0.04 -0.84 1.89 -0.65 0.23 0.00 0.00 176.35 177.01 2afg h PRO 27 N 1.67 0.58 0.00 1.29 0.11 -1.97 -0.81 132.00 132.86 2afg h PRO 27 Ca -0.49 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2afg h PRO 27 Cb 1.23 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2afg h PRO 27 CO 0.59 0.38 0.00 -0.40 -0.21 0.00 0.00 178.00 178.36 2afg n ASP 28 N -4.53 0.00 0.00 -2.05 5.68 -1.26 -4.86 116.55 109.53 2afg n ASP 28 Ca 0.16 -0.74 0.00 0.00 -0.50 0.00 0.00 54.79 53.71 2afg n ASP 28 Cb 0.49 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.47 2afg n ASP 28 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2afg n GLY 29 N 0.50 0.57 3.87 6.12 0.00 -0.31 -5.00 105.19 110.94 2afg n GLY 29 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2afg n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2afg s THR 30 N -2.29 4.75 -0.03 2.61 2.01 -1.24 -0.08 115.64 121.36 2afg s THR 30 Ca 0.00 0.69 0.03 0.00 0.31 0.00 0.00 61.69 62.73 2afg s THR 30 Cb 0.00 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.74 2afg s THR 30 CO 0.00 -0.70 -0.13 -0.69 -0.69 0.00 0.00 174.62 172.41 2afg s VAL 31 N -2.60 1.09 0.00 3.82 1.01 -1.26 -0.47 120.40 122.00 2afg s VAL 31 Ca 0.52 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.98 2afg s VAL 31 Cb -0.10 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.32 2afg s VAL 31 CO 0.37 0.33 0.00 -0.90 0.00 0.00 0.00 175.10 174.89 2afg n ASP 32 N 3.23 0.00 -4.41 3.32 5.75 -0.68 -4.27 116.55 119.49 2afg n ASP 32 Ca -0.18 -1.00 -0.20 0.00 -0.01 0.00 0.00 54.79 53.40 2afg n ASP 32 Cb 0.54 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 40.52 2afg n ASP 32 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2afg s GLY 33 N -1.61 1.77 0.03 6.12 0.00 -0.31 0.30 107.32 113.63 2afg s GLY 33 Ca 0.00 -1.87 -0.01 0.00 0.00 0.00 0.00 44.72 42.83 2afg s GLY 33 CO 0.00 -1.81 -0.01 -1.08 0.00 0.00 0.00 173.10 170.21 2afg s THR 34 N -3.09 0.15 -1.30 0.90 -1.32 -0.93 -4.82 115.64 105.23 2afg s THR 34 Ca 0.29 -1.25 0.18 0.00 -1.21 0.00 0.00 61.69 59.70 2afg s THR 34 Cb 0.04 -0.81 0.58 0.00 -1.51 0.00 0.00 72.50 70.80 2afg s THR 34 CO 0.11 -0.69 1.49 0.54 -2.21 0.00 0.00 174.62 173.86 2afg n ARG 35 N 0.94 3.11 -3.16 7.08 1.74 -1.26 -1.42 116.66 123.69 2afg n ARG 35 Ca -0.20 -2.60 -0.44 0.00 -0.77 0.00 0.00 57.85 53.84 2afg n ARG 35 Cb 0.58 -1.62 -0.05 0.00 -1.02 0.00 0.00 32.46 30.35 2afg n ARG 35 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2afg s ASP 36 N -1.04 6.19 0.00 0.55 -1.08 -1.26 -4.88 116.67 115.15 2afg s ASP 36 Ca 0.43 -1.27 0.02 0.00 -0.52 0.00 0.00 52.55 51.21 2afg s ASP 36 Cb 0.25 -2.28 0.15 0.00 -1.46 0.00 0.00 42.92 39.58 2afg s ASP 36 CO 0.24 -0.98 0.51 -1.14 0.52 0.00 0.00 175.17 174.32 2afg n ARG 37 N 6.11 0.34 -0.00 4.34 0.63 -1.26 -1.73 116.66 125.08 2afg n ARG 37 Ca -0.09 0.00 0.04 0.00 -0.92 0.00 0.00 57.85 56.88 2afg n ARG 37 Cb 0.43 -1.11 -0.06 0.00 0.45 0.00 0.00 32.46 32.17 2afg n ARG 37 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2afg n SER 38 N -0.61 2.03 -4.58 6.15 7.64 -1.26 -5.02 113.62 117.96 2afg n SER 38 Ca 0.02 -0.27 -0.50 0.00 1.01 0.00 0.00 58.87 59.13 2afg n SER 38 Cb 0.01 1.23 -0.05 0.00 -1.01 0.00 0.00 64.21 64.39 2afg n SER 38 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2afg n ASP 39 N -1.55 1.41 0.00 6.43 -0.08 -0.71 -4.84 116.55 117.21 2afg n ASP 39 Ca -0.00 1.14 0.13 0.00 -1.51 0.00 0.00 54.79 54.54 2afg n ASP 39 Cb 0.18 -1.21 0.70 0.00 2.34 0.00 0.00 41.12 43.14 2afg n ASP 39 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2afg n GLN 40 N 1.97 0.61 -0.19 -0.67 -0.00 -1.26 -3.43 117.38 114.42 2afg n GLN 40 Ca 0.16 0.02 0.06 0.00 -0.00 0.00 0.00 57.00 57.25 2afg n GLN 40 Cb 0.23 -1.50 0.17 0.00 -0.00 0.00 0.00 30.24 29.13 2afg n GLN 40 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 2afg n HIS 41 N -1.12 0.50 0.99 2.61 8.25 -1.26 -4.44 115.22 120.75 2afg n HIS 41 Ca 0.16 -0.47 0.11 0.00 -0.26 0.00 0.00 57.72 57.26 2afg n HIS 41 Cb 0.13 -0.02 0.03 0.00 1.12 0.00 0.00 29.99 31.25 2afg n HIS 41 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2afg n ILE 42 N 0.65 0.00 -2.74 1.59 -5.35 -1.22 -1.95 119.36 110.34 2afg n ILE 42 Ca 0.13 -0.34 -0.42 0.00 -0.27 0.00 0.00 62.75 61.84 2afg n ILE 42 Cb 0.44 1.34 -0.04 0.00 -1.74 0.00 0.00 39.64 39.64 2afg n ILE 42 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2afg s GLN 43 N -2.30 3.21 0.37 6.28 -1.52 -1.26 -4.54 119.66 119.90 2afg s GLN 43 Ca 0.21 -0.46 0.07 0.00 -1.95 0.00 0.00 55.36 53.24 2afg s GLN 43 Cb 0.19 -4.16 -0.02 0.00 -0.22 0.00 0.00 33.01 28.80 2afg s GLN 43 CO 0.48 -1.85 0.39 -0.51 -0.25 0.00 0.00 175.29 173.55 2afg s LEU 44 N 4.63 3.61 -0.04 2.90 1.43 -0.52 -0.60 118.68 130.09 2afg s LEU 44 Ca 0.29 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.89 2afg s LEU 44 Cb -0.13 -2.33 0.02 0.00 0.03 0.00 0.00 46.19 43.79 2afg s LEU 44 CO 0.15 -0.53 -0.04 -1.58 0.23 0.00 0.00 176.35 174.58 2afg s GLN 45 N -4.13 0.72 -0.09 1.70 0.74 0.17 -0.45 119.66 118.33 2afg s GLN 45 Ca 0.46 -0.09 -0.03 0.00 0.05 0.00 0.00 55.36 55.75 2afg s GLN 45 Cb -0.06 -0.74 -0.04 0.00 1.10 0.00 0.00 33.01 33.27 2afg s GLN 45 CO 0.29 -0.06 0.04 -0.51 -0.55 0.00 0.00 175.29 174.50 2afg s LEU 46 N 0.80 3.79 -0.06 3.68 1.02 -1.26 -1.94 118.68 124.71 2afg s LEU 46 Ca -0.10 0.22 -0.03 0.00 0.02 0.00 0.00 54.13 54.24 2afg s LEU 46 Cb -0.13 -1.92 0.04 0.00 0.02 0.00 0.00 46.19 44.20 2afg s LEU 46 CO -0.00 0.38 0.13 -0.55 0.02 0.00 0.00 176.35 176.33 2afg s SER 47 N -1.00 0.02 -0.01 2.29 0.15 -0.85 -4.96 113.70 109.34 2afg s SER 47 Ca 0.15 0.27 -0.19 0.00 0.70 0.00 0.00 55.95 56.88 2afg s SER 47 Cb -0.12 0.16 -0.05 0.00 -1.71 0.00 0.00 66.02 64.30 2afg s SER 47 CO 0.04 -0.16 0.53 0.00 1.20 0.00 0.00 173.24 174.85 2afg s ALA 48 N 1.30 3.54 -0.03 5.45 0.00 -1.26 0.40 121.76 131.17 2afg s ALA 48 Ca -0.08 -0.06 -0.20 0.00 0.00 0.00 0.00 51.96 51.63 2afg s ALA 48 Cb -0.12 -2.64 -0.33 0.00 0.00 0.00 0.00 23.12 20.04 2afg s ALA 48 CO -0.06 0.24 0.91 1.49 0.00 0.00 0.00 175.76 178.34 2afg h GLU 49 N 5.47 0.37 0.00 0.00 4.57 -1.43 -3.48 114.58 120.08 2afg h GLU 49 Ca -0.46 -0.63 -0.02 0.00 -1.18 0.00 0.00 59.36 57.07 2afg h GLU 49 Cb 1.20 0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 30.02 2afg h GLU 49 CO 0.68 1.30 -0.02 0.43 -1.18 0.00 0.00 179.01 180.22 2afg n SER 50 N -4.00 -0.06 -4.66 1.04 7.64 -1.25 -5.05 113.62 107.28 2afg n SER 50 Ca -0.15 -1.13 -0.43 0.00 1.01 0.00 0.00 58.87 58.18 2afg n SER 50 Cb 0.91 0.13 -0.02 0.00 -1.01 0.00 0.00 64.21 64.21 2afg n SER 50 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2afg s VAL 51 N -2.25 3.85 -0.16 0.44 1.01 -1.26 -2.76 120.40 119.27 2afg s VAL 51 Ca 0.02 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2afg s VAL 51 Cb 0.00 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.69 2afg s VAL 51 CO 0.02 -0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.60 2afg n GLY 52 N 4.03 0.51 2.98 4.51 0.00 -1.26 -4.99 105.19 110.97 2afg n GLY 52 Ca 0.16 -0.81 -0.25 0.00 0.00 0.00 0.00 46.02 45.12 2afg n GLY 52 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2afg s GLU 53 N -1.78 1.59 0.06 1.61 2.02 -1.11 -0.82 118.70 120.26 2afg s GLU 53 Ca 0.00 -0.35 -0.01 0.00 0.02 0.00 0.00 54.97 54.64 2afg s GLU 53 Cb 0.00 -1.41 -0.04 0.00 0.10 0.00 0.00 34.13 32.78 2afg s GLU 53 CO 0.00 -0.06 -0.04 0.54 0.02 0.00 0.00 175.26 175.72 2afg s VAL 54 N 0.96 0.28 0.07 2.63 0.11 0.36 -1.03 120.40 123.79 2afg s VAL 54 Ca -0.09 -1.79 0.04 0.00 -2.93 0.00 0.00 61.98 57.21 2afg s VAL 54 Cb -0.15 -1.49 -0.04 0.00 -1.53 0.00 0.00 36.38 33.17 2afg s VAL 54 CO 0.00 -0.96 0.03 -0.31 -3.33 0.00 0.00 175.10 170.53 2afg s TYR 55 N -3.77 3.08 -0.18 1.54 2.02 0.16 -2.02 117.35 118.19 2afg s TYR 55 Ca 0.07 0.03 -0.01 0.00 -0.37 0.00 0.00 57.07 56.79 2afg s TYR 55 Cb 0.07 -1.59 0.05 0.00 -0.40 0.00 0.00 41.96 40.09 2afg s TYR 55 CO -0.09 0.50 -0.04 0.42 -1.57 0.00 0.00 175.55 174.77 2afg s ILE 56 N -1.32 1.09 -0.05 2.71 1.01 -1.26 -2.02 121.20 121.36 2afg s ILE 56 Ca 0.26 -0.69 0.06 0.00 0.00 0.00 0.00 60.65 60.28 2afg s ILE 56 Cb -0.12 -1.31 -0.01 0.00 0.01 0.00 0.00 42.46 41.03 2afg s ILE 56 CO 0.19 0.06 -0.23 -0.75 0.00 0.00 0.00 174.94 174.20 2afg s LYS 57 N 1.63 2.34 -0.25 2.79 2.20 -0.82 0.24 119.74 127.88 2afg s LYS 57 Ca -0.00 -0.84 -0.28 0.00 -0.36 0.00 0.00 55.97 54.48 2afg s LYS 57 Cb -0.16 -2.02 0.01 0.00 -1.51 0.00 0.00 37.83 34.15 2afg s LYS 57 CO -0.07 0.37 1.00 0.45 -0.36 0.00 0.00 175.35 176.73 2afg s SER 58 N -0.17 7.01 0.44 1.43 0.15 -1.12 0.45 113.70 121.89 2afg s SER 58 Ca -0.02 1.23 0.14 0.00 0.70 0.00 0.00 55.95 58.00 2afg s SER 58 Cb -0.13 -2.52 1.04 0.00 -1.71 0.00 0.00 66.02 62.71 2afg s SER 58 CO 0.03 -0.67 1.98 0.71 1.20 0.00 0.00 173.24 176.49 2afg h THR 59 N 5.50 0.89 0.04 6.45 1.35 -1.15 0.71 112.91 126.70 2afg h THR 59 Ca -0.20 -0.13 -0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2afg h THR 59 Cb 1.07 0.47 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2afg h THR 59 CO 0.96 0.07 -0.02 -0.08 -0.25 0.00 0.00 175.52 176.21 2afg h GLU 60 N 0.39 -0.05 0.00 4.72 4.57 -1.83 -3.38 114.58 118.99 2afg h GLU 60 Ca 0.27 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.46 2afg h GLU 60 Cb 0.56 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 2afg h GLU 60 CO -0.07 0.35 -0.61 0.25 -1.18 0.00 0.00 179.01 177.75 2afg n THR 61 N -4.92 0.00 0.00 0.32 -2.24 -1.12 -5.00 114.28 101.32 2afg n THR 61 Ca -0.08 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 2afg n THR 61 Cb 0.22 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 2afg n THR 61 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2afg n GLY 62 N 1.31 2.92 3.48 3.38 0.00 0.23 -5.01 105.19 111.48 2afg n GLY 62 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 2afg n GLY 62 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2afg s GLN 63 N -0.03 -1.27 0.15 1.61 -0.21 -1.26 -4.77 119.66 113.88 2afg s GLN 63 Ca 0.00 0.57 0.08 0.00 0.02 0.00 0.00 55.36 56.03 2afg s GLN 63 Cb 0.00 -1.54 -0.04 0.00 1.00 0.00 0.00 33.01 32.44 2afg s GLN 63 CO 0.00 -3.88 -0.18 0.71 -2.12 0.00 0.00 175.29 169.81 2afg s TYR 64 N -2.52 1.76 0.16 0.91 1.51 0.50 -2.79 117.35 116.88 2afg s TYR 64 Ca 0.68 -0.47 -0.30 0.00 -1.01 0.00 0.00 57.07 55.98 2afg s TYR 64 Cb -0.21 -0.90 -0.07 0.00 -0.11 0.00 0.00 41.96 40.67 2afg s TYR 64 CO 0.62 0.28 0.95 -1.17 -1.11 0.00 0.00 175.55 175.12 2afg s LEU 65 N -2.48 4.56 0.03 -1.29 2.96 0.14 -0.12 118.68 122.48 2afg s LEU 65 Ca 0.13 1.84 -0.17 0.00 -0.22 0.00 0.00 54.13 55.71 2afg s LEU 65 Cb -0.07 -3.58 0.03 0.00 0.50 0.00 0.00 46.19 43.07 2afg s LEU 65 CO 0.06 0.03 0.37 0.00 -1.32 0.00 0.00 176.35 175.48 2afg s ALA 66 N -0.46 -0.90 -0.13 5.97 0.00 0.87 -4.46 121.76 122.65 2afg s ALA 66 Ca 0.44 0.26 0.02 0.00 0.00 0.00 0.00 51.96 52.69 2afg s ALA 66 Cb -0.24 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.15 2afg s ALA 66 CO 0.30 -0.40 -0.20 1.41 0.00 0.00 0.00 175.76 176.87 2afg s MET 67 N -2.24 3.11 0.72 0.00 1.75 -1.20 0.24 119.30 121.68 2afg s MET 67 Ca -0.07 -0.82 -0.12 0.00 -1.25 0.00 0.00 55.69 53.42 2afg s MET 67 Cb -0.02 -2.45 0.17 0.00 2.84 0.00 0.00 34.83 35.38 2afg s MET 67 CO -0.01 0.09 0.81 -0.40 -0.65 0.00 0.00 175.02 174.86 2afg n ASP 68 N 3.81 -0.74 -0.19 1.11 5.68 0.17 -4.89 116.55 121.50 2afg n ASP 68 Ca -0.19 -1.15 0.10 0.00 -0.50 0.00 0.00 54.79 53.05 2afg n ASP 68 Cb 0.52 -0.67 0.50 0.00 -1.14 0.00 0.00 41.12 40.33 2afg n ASP 68 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2afg n THR 69 N -3.60 0.07 0.57 2.12 -2.24 -1.26 -2.26 114.28 107.68 2afg n THR 69 Ca 0.11 -0.12 0.07 0.00 -2.27 0.00 0.00 64.05 61.83 2afg n THR 69 Cb 0.39 -0.06 0.05 0.00 -2.10 0.00 0.00 70.33 68.60 2afg n THR 69 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2afg n ASP 70 N -0.40 2.00 0.00 3.42 8.00 -1.26 -4.97 116.55 123.34 2afg n ASP 70 Ca 0.15 -1.50 0.00 0.00 0.71 0.00 0.00 54.79 54.15 2afg n ASP 70 Cb 0.16 0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 2afg n ASP 70 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2afg n GLY 71 N 0.82 0.64 3.85 0.44 0.00 -0.96 -4.74 105.19 105.24 2afg n GLY 71 Ca 0.07 -0.56 -0.37 0.00 0.00 0.00 0.00 46.02 45.17 2afg n GLY 71 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2afg s LEU 72 N 0.00 4.32 0.11 0.99 0.20 -1.26 -1.67 118.68 121.38 2afg s LEU 72 Ca 0.00 0.43 -0.27 0.00 0.69 0.00 0.00 54.13 54.98 2afg s LEU 72 Cb 0.00 -2.06 -0.06 0.00 -0.43 0.00 0.00 46.19 43.64 2afg s LEU 72 CO 0.00 0.38 0.84 -0.76 -0.29 0.00 0.00 176.35 176.52 2afg s LEU 73 N -0.87 4.51 0.27 -0.68 1.43 -1.26 0.43 118.68 122.51 2afg s LEU 73 Ca 0.14 1.63 0.03 0.00 -1.03 0.00 0.00 54.13 54.90 2afg s LEU 73 Cb -0.12 -3.38 -0.04 0.00 0.03 0.00 0.00 46.19 42.69 2afg s LEU 73 CO 0.03 0.05 0.19 -0.72 0.23 0.00 0.00 176.35 176.13 2afg s TYR 74 N -0.37 1.49 -0.26 0.29 1.13 0.65 -4.19 117.35 116.09 2afg s TYR 74 Ca 0.40 -1.48 -0.09 0.00 -1.41 0.00 0.00 57.07 54.50 2afg s TYR 74 Cb -0.22 -0.70 -0.04 0.00 -1.10 0.00 0.00 41.96 39.90 2afg s TYR 74 CO 0.26 -0.69 0.13 0.20 -2.51 0.00 0.00 175.55 172.94 2afg s GLY 75 N -3.29 1.84 -0.03 5.49 0.00 0.89 -0.09 107.32 112.12 2afg s GLY 75 Ca 0.39 -1.10 -0.02 0.00 0.00 0.00 0.00 44.72 43.98 2afg s GLY 75 CO 0.19 0.58 0.09 -0.45 0.00 0.00 0.00 173.10 173.51 2afg s SER 76 N 1.66 5.83 0.24 1.64 0.15 0.83 -4.68 113.70 119.37 2afg s SER 76 Ca 0.07 0.23 0.21 0.00 0.70 0.00 0.00 55.95 57.16 2afg s SER 76 Cb -0.15 -1.73 0.05 0.00 -1.71 0.00 0.00 66.02 62.48 2afg s SER 76 CO 0.07 0.31 1.15 1.56 1.20 0.00 0.00 173.24 177.53 2afg h GLN 77 N 4.34 0.00 -5.37 5.44 4.20 -1.90 1.47 115.11 123.31 2afg h GLN 77 Ca -0.50 0.00 -0.40 0.00 0.06 0.00 0.00 58.65 57.81 2afg h GLN 77 Cb 1.19 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.82 2afg h GLN 77 CO 0.61 0.07 -0.73 0.95 -0.67 0.00 0.00 178.83 179.06 2afg s THR 78 N -3.24 1.44 -0.05 -0.54 -4.23 -1.26 -4.75 115.64 103.01 2afg s THR 78 Ca 0.01 -2.03 -0.25 0.00 -1.18 0.00 0.00 61.69 58.24 2afg s THR 78 Cb 0.08 -1.84 -0.04 0.00 1.34 0.00 0.00 72.50 72.04 2afg s THR 78 CO 0.77 -0.60 0.76 -2.16 -0.54 0.00 0.00 174.62 172.85 2afg s PRO 79 N -3.42 4.47 0.33 3.99 0.04 -1.26 -4.80 135.00 134.35 2afg s PRO 79 Ca 0.17 1.01 -0.03 0.00 0.04 0.00 0.00 61.00 62.19 2afg s PRO 79 Cb -0.01 -3.45 -0.00 0.00 0.04 0.00 0.00 34.50 31.08 2afg s PRO 79 CO 0.04 0.05 0.45 0.54 0.04 0.00 0.00 177.00 178.11 2afg s ASN 80 N 0.81 0.83 0.38 6.66 2.20 -1.26 -5.03 114.94 119.54 2afg s ASN 80 Ca 0.41 -1.45 0.19 0.00 -0.94 0.00 0.00 52.86 51.07 2afg s ASN 80 Cb -0.19 0.64 1.13 0.00 -2.00 0.00 0.00 41.25 40.83 2afg s ASN 80 CO 0.21 -1.25 1.72 -0.08 -2.94 0.00 0.00 177.10 174.76 2afg h GLU 81 N 2.15 0.34 0.00 3.55 4.57 -2.00 0.19 114.58 123.38 2afg h GLU 81 Ca -0.28 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 57.88 2afg h GLU 81 Cb 1.24 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 2afg h GLU 81 CO 0.39 0.23 0.00 0.39 -1.18 0.00 0.00 179.01 178.84 2afg n GLU 82 N -4.74 0.11 -0.05 1.92 1.02 -1.26 -3.48 120.64 114.15 2afg n GLU 82 Ca 0.29 0.19 0.12 0.00 -0.02 0.00 0.00 57.16 57.73 2afg n GLU 82 Cb 0.98 -1.50 0.17 0.00 -0.02 0.00 0.00 31.44 31.07 2afg n GLU 82 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2afg s LEU 84 N -1.85 4.38 0.07 0.00 1.43 -1.23 -4.44 118.68 117.04 2afg s LEU 84 Ca 0.32 1.09 0.06 0.00 -1.03 0.00 0.00 54.13 54.56 2afg s LEU 84 Cb 0.21 -2.88 -0.03 0.00 0.03 0.00 0.00 46.19 43.52 2afg s LEU 84 CO 0.31 0.07 -0.15 -0.36 0.23 0.00 0.00 176.35 176.44 2afg s PHE 85 N 0.02 1.32 -0.10 0.29 0.08 -0.86 -2.03 117.98 116.71 2afg s PHE 85 Ca 0.30 -0.44 -0.20 0.00 0.12 0.00 0.00 56.93 56.71 2afg s PHE 85 Cb -0.17 -0.74 -0.04 0.00 -0.57 0.00 0.00 43.02 41.49 2afg s PHE 85 CO 0.16 0.08 0.55 -0.51 -0.10 0.00 0.00 175.22 175.40 2afg s LEU 86 N -1.71 4.29 -0.44 -0.37 1.43 0.50 -0.48 118.68 121.89 2afg s LEU 86 Ca -0.00 0.94 -0.17 0.00 -1.03 0.00 0.00 54.13 53.88 2afg s LEU 86 Cb -0.10 -2.82 0.03 0.00 0.03 0.00 0.00 46.19 43.33 2afg s LEU 86 CO 0.03 -0.03 0.42 -0.70 0.23 0.00 0.00 176.35 176.29 2afg s GLU 87 N 0.65 3.05 -0.33 1.70 2.12 0.00 -1.64 118.70 124.25 2afg s GLU 87 Ca 0.30 -0.94 -0.06 0.00 0.36 0.00 0.00 54.97 54.62 2afg s GLU 87 Cb -0.16 -4.02 0.04 0.00 0.26 0.00 0.00 34.13 30.25 2afg s GLU 87 CO 0.13 -0.90 0.09 1.03 -0.54 0.00 0.00 175.26 175.07 2afg s ARG 88 N 2.00 2.65 -0.39 4.30 1.81 -0.25 -4.76 118.95 124.29 2afg s ARG 88 Ca 0.09 -1.16 -0.24 0.00 -1.72 0.00 0.00 55.73 52.70 2afg s ARG 88 Cb -0.19 -3.42 0.02 0.00 -0.45 0.00 0.00 34.95 30.91 2afg s ARG 88 CO 0.11 -0.64 0.85 -1.17 -0.68 0.00 0.00 175.30 173.77 2afg s LEU 89 N 1.40 4.09 0.81 2.53 2.96 -1.26 0.70 118.68 129.91 2afg s LEU 89 Ca -0.02 0.32 -0.11 0.00 -0.22 0.00 0.00 54.13 54.11 2afg s LEU 89 Cb -0.19 -3.11 0.08 0.00 0.50 0.00 0.00 46.19 43.47 2afg s LEU 89 CO 0.02 -0.84 1.09 -1.61 -1.32 0.00 0.00 176.35 173.69 2afg s GLU 90 N 3.34 1.93 0.28 1.98 8.01 -0.10 -4.94 118.70 129.20 2afg s GLU 90 Ca 0.34 1.03 0.26 0.00 0.01 0.00 0.00 54.97 56.61 2afg s GLU 90 Cb -0.12 -1.87 0.91 0.00 -4.31 0.00 0.00 34.13 28.73 2afg s GLU 90 CO 0.20 -1.83 1.76 0.93 0.01 0.00 0.00 175.26 176.32 2afg h GLU 91 N -1.26 0.00 -0.85 1.61 5.08 -1.97 -3.04 114.58 114.15 2afg h GLU 91 Ca -0.46 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.86 2afg h GLU 91 Cb 1.25 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.47 2afg h GLU 91 CO 0.53 0.00 0.05 0.27 -1.00 0.00 0.00 179.01 178.86 2afg n ASN 92 N -2.39 3.19 0.00 1.42 0.23 -1.26 -4.87 115.26 111.58 2afg n ASN 92 Ca 0.03 -2.48 0.00 0.00 -0.53 0.00 0.00 54.58 51.60 2afg n ASN 92 Cb 0.34 -0.60 0.00 0.00 -2.08 0.00 0.00 39.78 37.44 2afg n ASN 92 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 2afg n HIS 93 N 0.19 0.00 -3.25 -2.53 8.25 -1.15 -4.99 115.22 111.74 2afg n HIS 93 Ca 0.15 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.35 2afg n HIS 93 Cb 0.75 -0.47 -0.02 0.00 1.12 0.00 0.00 29.99 31.37 2afg n HIS 93 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2afg s TYR 94 N -2.57 3.50 0.18 4.41 1.51 -1.26 -4.86 117.35 118.26 2afg s TYR 94 Ca 0.00 0.55 0.04 0.00 -1.01 0.00 0.00 57.07 56.65 2afg s TYR 94 Cb 0.00 -2.05 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 2afg s TYR 94 CO 0.00 0.08 0.24 -0.80 -1.11 0.00 0.00 175.55 173.96 2afg s ASN 95 N -3.67 5.98 0.04 2.29 0.02 0.24 -0.92 114.94 118.91 2afg s ASN 95 Ca 0.43 0.01 0.09 0.00 -1.02 0.00 0.00 52.86 52.36 2afg s ASN 95 Cb -0.10 -1.69 -0.03 0.00 0.02 0.00 0.00 41.25 39.45 2afg s ASN 95 CO 0.35 0.03 -0.25 0.42 0.02 0.00 0.00 177.10 177.67 2afg s THR 96 N -1.82 2.01 -0.17 1.60 -4.23 0.22 -2.66 115.64 110.58 2afg s THR 96 Ca 0.33 -1.30 0.01 0.00 -1.18 0.00 0.00 61.69 59.54 2afg s THR 96 Cb -0.10 -1.72 0.03 0.00 1.34 0.00 0.00 72.50 72.06 2afg s THR 96 CO 0.26 0.36 -0.13 -0.31 -0.54 0.00 0.00 174.62 174.26 2afg s TYR 97 N -0.77 2.33 0.09 3.99 2.02 -1.26 -1.10 117.35 122.65 2afg s TYR 97 Ca 0.11 -1.42 0.09 0.00 -0.37 0.00 0.00 57.07 55.47 2afg s TYR 97 Cb -0.10 -1.64 -0.04 0.00 -0.40 0.00 0.00 41.96 39.79 2afg s TYR 97 CO 0.02 -0.71 -0.20 0.42 -1.57 0.00 0.00 175.55 173.50 2afg s ILE 98 N 1.43 2.69 -0.15 2.71 1.01 -0.65 -0.80 121.20 127.44 2afg s ILE 98 Ca 0.02 -1.41 -0.29 0.00 0.00 0.00 0.00 60.65 58.96 2afg s ILE 98 Cb -0.14 -2.18 -0.01 0.00 0.01 0.00 0.00 42.46 40.14 2afg s ILE 98 CO -0.10 0.21 1.15 -0.55 0.00 0.00 0.00 174.94 175.65 2afg s SER 99 N -1.80 7.06 0.07 3.58 0.15 -1.10 0.19 113.70 121.84 2afg s SER 99 Ca 0.16 1.61 -0.30 0.00 0.70 0.00 0.00 55.95 58.12 2afg s SER 99 Cb -0.10 -2.55 -0.15 0.00 -1.71 0.00 0.00 66.02 61.51 2afg s SER 99 CO 0.07 -0.64 1.47 0.50 1.20 0.00 0.00 173.24 175.83 2afg h LYS 100 N 7.65 -0.85 -1.44 5.44 3.64 -1.73 0.65 116.57 129.94 2afg h LYS 100 Ca -0.27 0.06 0.47 0.00 -1.27 0.00 0.00 60.65 59.64 2afg h LYS 100 Cb 1.11 0.19 -0.12 0.00 -0.41 0.00 0.00 32.23 33.01 2afg h LYS 100 CO 0.93 -0.56 0.96 1.17 -2.27 0.00 0.00 179.45 179.68 2afg n LYS 101 N -5.00 -0.02 -0.68 1.90 4.81 -1.26 0.88 118.16 118.78 2afg n LYS 101 Ca -0.11 1.13 0.06 0.00 -0.87 0.00 0.00 58.31 58.52 2afg n LYS 101 Cb 0.39 -2.31 0.16 0.00 0.02 0.00 0.00 35.03 33.29 2afg n LYS 101 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2afg n HIS 102 N -4.36 0.00 -0.33 5.64 8.25 -0.82 -4.83 115.22 118.77 2afg n HIS 102 Ca 0.39 -1.18 0.09 0.00 -0.26 0.00 0.00 57.72 56.76 2afg n HIS 102 Cb 1.58 -0.21 0.29 0.00 1.12 0.00 0.00 29.99 32.77 2afg n HIS 102 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2afg h ALA 103 N 0.81 1.64 0.00 -1.41 0.00 0.65 -2.17 119.26 118.78 2afg h ALA 103 Ca -0.04 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2afg h ALA 103 Cb 1.18 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 2afg h ALA 103 CO 0.02 0.11 -0.01 1.49 0.00 0.00 0.00 179.25 180.86 2afg h GLU 104 N 0.88 0.00 -0.03 0.00 4.81 -1.85 -1.58 114.58 116.81 2afg h GLU 104 Ca 0.48 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.71 2afg h GLU 104 Cb 0.58 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.96 2afg h GLU 104 CO -0.25 0.01 0.00 1.63 -0.73 0.00 0.00 179.01 179.67 2afg n LYS 105 N -3.35 1.36 -3.53 1.92 5.02 -0.83 -5.01 118.16 113.74 2afg n LYS 105 Ca -0.03 -1.51 -0.19 0.00 -2.02 0.00 0.00 58.31 54.56 2afg n LYS 105 Cb 0.10 -1.32 0.07 0.00 -0.02 0.00 0.00 35.03 33.86 2afg n LYS 105 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2afg n ASN 106 N 0.95 -2.12 -4.48 4.39 5.03 -0.60 -4.93 115.26 113.51 2afg n ASN 106 Ca 0.10 -0.68 -0.43 0.00 0.87 0.00 0.00 54.58 54.44 2afg n ASN 106 Cb 0.42 -4.78 -0.05 0.00 -1.02 0.00 0.00 39.78 34.36 2afg n ASN 106 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 2afg s TRP 107 N -3.45 2.87 0.62 3.10 0.52 -1.25 -4.75 118.94 116.60 2afg s TRP 107 Ca 0.05 -0.28 -0.03 0.00 0.02 0.00 0.00 56.10 55.86 2afg s TRP 107 Cb -0.02 -3.93 0.04 0.00 -1.15 0.00 0.00 33.47 28.41 2afg s TRP 107 CO 0.76 -1.29 0.89 -0.06 0.02 0.00 0.00 176.95 177.27 2afg s PHE 108 N 3.50 2.96 -0.02 -1.98 0.40 -1.26 -2.73 117.98 118.85 2afg s PHE 108 Ca 0.24 0.30 -0.22 0.00 -0.60 0.00 0.00 56.93 56.65 2afg s PHE 108 Cb -0.16 -2.92 -0.05 0.00 0.51 0.00 0.00 43.02 40.40 2afg s PHE 108 CO 0.15 -1.08 0.63 0.08 0.70 0.00 0.00 175.22 175.71 2afg s VAL 109 N -3.00 4.94 0.10 -0.44 1.01 0.02 -4.25 120.40 118.78 2afg s VAL 109 Ca 0.57 1.32 -0.19 0.00 0.00 0.00 0.00 61.98 63.68 2afg s VAL 109 Cb -0.11 -3.97 0.05 0.00 0.00 0.00 0.00 36.38 32.35 2afg s VAL 109 CO 0.42 0.36 0.47 -0.83 0.00 0.00 0.00 175.10 175.53 2afg s GLY 110 N 0.14 -0.38 -0.02 4.51 0.00 -1.26 -4.55 107.32 105.75 2afg s GLY 110 Ca 0.33 0.29 0.05 0.00 0.00 0.00 0.00 44.72 45.39 2afg s GLY 110 CO 0.18 0.01 -0.15 1.08 0.00 0.00 0.00 173.10 174.21 2afg s LEU 111 N -2.42 1.99 0.40 0.66 1.43 -1.08 -0.84 118.68 118.81 2afg s LEU 111 Ca -0.01 -0.29 -0.08 0.00 -1.03 0.00 0.00 54.13 52.72 2afg s LEU 111 Cb 0.00 -0.81 -0.06 0.00 0.03 0.00 0.00 46.19 45.35 2afg s LEU 111 CO -0.08 0.18 0.73 -0.54 0.23 0.00 0.00 176.35 176.87 2afg s LYS 112 N -0.25 3.70 0.20 1.70 1.02 0.34 -4.59 119.74 121.85 2afg s LYS 112 Ca 0.04 0.31 0.07 0.00 0.02 0.00 0.00 55.97 56.41 2afg s LYS 112 Cb -0.07 -2.44 0.39 0.00 -0.52 0.00 0.00 37.83 35.18 2afg s LYS 112 CO -0.00 -0.02 1.05 1.17 -0.92 0.00 0.00 175.35 176.64 2afg n LYS 113 N -1.42 0.05 -0.69 1.68 4.81 -1.26 -0.69 118.16 120.64 2afg n LYS 113 Ca 0.01 0.44 0.03 0.00 -0.87 0.00 0.00 58.31 57.93 2afg n LYS 113 Cb 0.54 -1.97 0.28 0.00 0.02 0.00 0.00 35.03 33.90 2afg n LYS 113 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2afg n ASN 114 N -1.73 4.13 0.00 3.14 0.23 -1.26 -4.73 115.26 115.04 2afg n ASN 114 Ca -0.00 -3.17 0.00 0.00 -0.53 0.00 0.00 54.58 50.87 2afg n ASN 114 Cb 0.32 -0.62 0.00 0.00 -2.08 0.00 0.00 39.78 37.40 2afg n ASN 114 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2afg n GLY 115 N -0.39 2.79 3.76 4.83 0.00 0.13 -5.01 105.19 111.30 2afg n GLY 115 Ca 0.29 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.95 2afg n GLY 115 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2afg s SER 116 N -0.02 5.47 0.44 1.61 0.15 -1.26 -1.16 113.70 118.93 2afg s SER 116 Ca 0.00 2.32 -0.23 0.00 0.70 0.00 0.00 55.95 58.74 2afg s SER 116 Cb 0.00 -2.59 -0.08 0.00 -1.71 0.00 0.00 66.02 61.64 2afg s SER 116 CO 0.00 -1.40 1.16 0.00 1.20 0.00 0.00 173.24 174.20 2afg s LYS 118 N -2.61 4.28 -0.13 0.00 2.20 -0.02 -4.72 119.74 118.73 2afg s LYS 118 Ca 0.62 0.16 -0.29 0.00 -0.36 0.00 0.00 55.97 56.09 2afg s LYS 118 Cb -0.29 -3.43 -0.01 0.00 -1.51 0.00 0.00 37.83 32.60 2afg s LYS 118 CO 0.35 0.22 1.07 1.03 -0.36 0.00 0.00 175.35 177.66 2afg s ARG 119 N 0.51 4.35 0.08 4.03 0.52 -1.26 -4.38 118.95 122.80 2afg s ARG 119 Ca 0.18 1.45 -0.00 0.00 -0.52 0.00 0.00 55.73 56.84 2afg s ARG 119 Cb -0.13 -3.59 0.17 0.00 0.52 0.00 0.00 34.95 31.92 2afg s ARG 119 CO 0.05 -0.45 0.40 0.41 0.02 0.00 0.00 175.30 175.73 2afg n GLY 120 N 3.24 -0.37 0.11 -3.53 0.00 -0.67 0.30 105.19 104.27 2afg n GLY 120 Ca 0.10 0.26 0.09 0.00 0.00 0.00 0.00 46.02 46.47 2afg n GLY 120 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2afg n PRO 121 N -4.22 0.11 -0.07 1.61 -0.01 -1.26 -0.88 135.00 130.27 2afg n PRO 121 Ca 0.05 0.56 0.08 0.00 -0.01 0.00 0.00 63.50 64.18 2afg n PRO 121 Cb 0.17 -1.82 0.11 0.00 -0.01 0.00 0.00 33.50 31.95 2afg n PRO 121 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 175.50 176.03 2afg n ARG 122 N -2.05 1.65 -3.34 -0.52 5.12 0.15 -4.94 116.66 112.72 2afg n ARG 122 Ca -0.00 -1.67 -0.38 0.00 -1.93 0.00 0.00 57.85 53.86 2afg n ARG 122 Cb 0.06 -1.32 -0.06 0.00 -1.16 0.00 0.00 32.46 29.98 2afg n ARG 122 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2afg s THR 123 N -1.22 5.17 0.02 0.55 -4.23 -0.06 -4.98 115.64 110.88 2afg s THR 123 Ca 0.22 0.93 0.02 0.00 -1.18 0.00 0.00 61.69 61.69 2afg s THR 123 Cb 0.14 -3.80 -0.01 0.00 1.34 0.00 0.00 72.50 70.16 2afg s THR 123 CO 0.20 0.36 -0.07 -1.00 -0.54 0.00 0.00 174.62 173.57 2afg s HIS 124 N 0.43 0.64 0.35 3.99 3.76 -1.26 -4.72 115.29 118.48 2afg s HIS 124 Ca 0.25 -0.29 -0.28 0.00 -0.15 0.00 0.00 55.06 54.59 2afg s HIS 124 Cb -0.15 -0.39 -0.12 0.00 1.11 0.00 0.00 32.58 33.03 2afg s HIS 124 CO 0.10 -0.04 1.45 0.98 -0.85 0.00 0.00 174.74 176.39 2afg n TYR 125 N 2.20 2.76 0.00 1.40 4.19 -1.26 -1.75 117.16 124.70 2afg n TYR 125 Ca -0.18 0.45 0.00 0.00 3.31 0.00 0.00 57.90 61.48 2afg n TYR 125 Cb 0.56 -2.51 0.00 0.00 0.49 0.00 0.00 39.34 37.88 2afg n TYR 125 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2afg n GLY 126 N 0.85 3.20 3.77 2.98 0.00 -1.26 -5.02 105.19 109.70 2afg n GLY 126 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2afg n GLY 126 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2afg s GLN 127 N -0.47 3.88 0.38 1.61 -0.21 -0.72 -4.88 119.66 119.25 2afg s GLN 127 Ca 0.00 2.11 0.19 0.00 0.02 0.00 0.00 55.36 57.67 2afg s GLN 127 Cb 0.00 -2.67 0.71 0.00 1.00 0.00 0.00 33.01 32.04 2afg s GLN 127 CO 0.00 -0.55 1.75 0.87 -2.12 0.00 0.00 175.29 175.24 2afg h LYS 128 N 2.51 0.00 0.00 2.91 1.57 -1.95 -2.99 116.57 118.61 2afg h LYS 128 Ca -0.50 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.28 2afg h LYS 128 Cb 1.25 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.56 2afg h LYS 128 CO 0.62 0.37 -0.04 0.00 -0.57 0.00 0.00 179.45 179.82 2afg h ALA 129 N 1.63 1.05 -0.04 3.86 0.00 -1.90 -1.79 119.26 122.08 2afg h ALA 129 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2afg h ALA 129 Cb 0.87 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2afg h ALA 129 CO 0.05 0.05 0.00 0.44 0.00 0.00 0.00 179.25 179.79 2afg n ILE 130 N -3.21 0.03 -3.66 0.00 -5.35 -1.13 -2.62 119.36 103.42 2afg n ILE 130 Ca -0.01 -0.25 -0.36 0.00 -0.27 0.00 0.00 62.75 61.87 2afg n ILE 130 Cb 0.25 0.43 -0.08 0.00 -1.74 0.00 0.00 39.64 38.50 2afg n ILE 130 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2afg s LEU 131 N -1.93 4.20 -0.09 7.28 1.43 -0.70 -4.53 118.68 124.33 2afg s LEU 131 Ca 0.38 0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.78 2afg s LEU 131 Cb 0.20 -2.17 0.01 0.00 0.03 0.00 0.00 46.19 44.27 2afg s LEU 131 CO 0.33 0.13 -0.14 -0.36 0.23 0.00 0.00 176.35 176.54 2afg s PHE 132 N 0.54 1.77 -0.22 0.29 0.40 -1.09 0.06 117.98 119.73 2afg s PHE 132 Ca 0.10 -0.78 -0.06 0.00 -0.60 0.00 0.00 56.93 55.59 2afg s PHE 132 Cb -0.12 -1.30 -0.02 0.00 0.51 0.00 0.00 43.02 42.09 2afg s PHE 132 CO 0.01 -0.41 0.02 -1.17 0.70 0.00 0.00 175.22 174.37 2afg s LEU 133 N 0.94 3.31 -0.33 -0.37 2.96 0.39 -0.59 118.68 124.99 2afg s LEU 133 Ca -0.08 -0.21 -0.27 0.00 -0.22 0.00 0.00 54.13 53.35 2afg s LEU 133 Cb -0.15 -1.86 0.01 0.00 0.50 0.00 0.00 46.19 44.69 2afg s LEU 133 CO -0.00 0.02 0.95 -2.84 -1.32 0.00 0.00 176.35 173.17 2afg s PRO 134 N 1.25 3.98 -0.03 0.98 0.02 -1.25 0.35 135.00 140.30 2afg s PRO 134 Ca 0.04 0.80 0.04 0.00 0.02 0.00 0.00 61.00 61.90 2afg s PRO 134 Cb -0.15 -3.75 -0.03 0.00 0.02 0.00 0.00 34.50 30.59 2afg s PRO 134 CO 0.02 -0.85 -0.14 -0.51 -0.33 0.00 0.00 177.00 175.18 2afg s LEU 135 N 3.41 2.75 0.68 -5.54 1.43 0.83 -4.85 118.68 117.39 2afg s LEU 135 Ca 0.40 -0.23 -0.17 0.00 -1.03 0.00 0.00 54.13 53.10 2afg s LEU 135 Cb -0.13 -1.57 -0.01 0.00 0.03 0.00 0.00 46.19 44.51 2afg s LEU 135 CO 0.15 0.32 1.01 -2.65 0.23 0.00 0.00 176.35 175.42 2afg n PRO 136 N 2.11 0.69 -3.85 1.29 -0.02 -1.26 0.05 135.00 134.01 2afg n PRO 136 Ca -0.17 0.29 -0.35 0.00 -2.02 0.00 0.00 63.50 61.25 2afg n PRO 136 Cb 0.52 -2.25 -0.09 0.00 -0.02 0.00 0.00 33.50 31.66 2afg n PRO 136 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2afg s VAL 137 N -1.68 5.07 0.00 -1.45 -7.23 -0.88 -4.72 120.40 109.50 2afg s VAL 137 Ca 0.76 0.07 0.00 0.00 -1.81 0.00 0.00 61.98 60.99 2afg s VAL 137 Cb -0.37 -3.31 0.00 0.00 0.56 0.00 0.00 36.38 33.26 2afg s VAL 137 CO 0.48 0.43 0.00 -1.20 -0.31 0.00 0.00 175.10 174.50