#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 0.72 0.24 0.54 1.02 0.27 -4.13 119.74 118.40 2afg s LYS 12 Ca 0.00 0.94 -0.22 0.00 0.02 0.00 0.00 55.97 56.71 2afg s LYS 12 Cb 0.00 0.31 -0.09 0.00 -0.52 0.00 0.00 37.83 37.53 2afg s LYS 12 CO 0.00 -0.10 0.79 -0.51 -0.92 0.00 0.00 175.35 174.60 2afg s LEU 13 N 0.61 4.37 -0.44 3.17 1.43 0.09 -2.17 118.68 125.73 2afg s LEU 13 Ca -0.02 1.55 -0.06 0.00 -1.03 0.00 0.00 54.13 54.57 2afg s LEU 13 Cb -0.05 -3.67 0.11 0.00 0.03 0.00 0.00 46.19 42.62 2afg s LEU 13 CO -0.03 0.02 0.28 -0.76 0.23 0.00 0.00 176.35 176.09 2afg s LEU 14 N -1.91 5.46 0.06 1.79 1.43 -1.26 -0.40 118.68 123.85 2afg s LEU 14 Ca 0.44 -1.95 -0.26 0.00 -1.03 0.00 0.00 54.13 51.33 2afg s LEU 14 Cb -0.18 -1.93 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 2afg s LEU 14 CO 0.22 -0.62 0.82 -0.47 0.23 0.00 0.00 176.35 176.54 2afg s TYR 15 N 1.26 3.75 -0.18 0.29 6.14 0.24 -1.19 117.35 127.67 2afg s TYR 15 Ca 0.07 1.57 -0.12 0.00 0.64 0.00 0.00 57.07 59.23 2afg s TYR 15 Cb -0.24 -2.89 -0.05 0.00 0.42 0.00 0.00 41.96 39.19 2afg s TYR 15 CO -0.02 0.24 0.21 0.00 0.64 0.00 0.00 175.55 176.62 2afg h SER 17 N 6.65 0.00 0.00 0.00 0.87 -1.59 -1.43 113.55 118.05 2afg h SER 17 Ca -0.41 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 2afg h SER 17 Cb 1.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2afg h SER 17 CO 0.76 0.11 0.00 -3.20 -0.53 0.00 0.00 176.83 173.97 2afg n ASN 18 N -4.36 0.00 -0.33 6.23 5.15 -1.13 -4.12 115.26 116.70 2afg n ASN 18 Ca -0.03 0.55 0.05 0.00 -0.60 0.00 0.00 54.58 54.55 2afg n ASN 18 Cb 0.19 -0.05 0.11 0.00 -0.53 0.00 0.00 39.78 39.50 2afg n ASN 18 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2afg n GLY 19 N -0.79 3.53 2.25 8.20 0.00 -1.25 -4.90 105.19 112.23 2afg n GLY 19 Ca 0.00 -0.52 -0.08 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.45 -0.01 3.53 -0.02 0.00 -0.55 -5.04 105.19 102.65 2afg n GLY 20 Ca 0.10 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.18 2.44 -0.18 1.61 3.76 -1.16 -4.61 115.29 113.97 2afg s HIS 21 Ca 0.13 -0.29 -0.07 0.00 -0.15 0.00 0.00 55.06 54.67 2afg s HIS 21 Cb -0.02 -1.07 -0.04 0.00 1.11 0.00 0.00 32.58 32.56 2afg s HIS 21 CO 0.35 0.68 0.07 -0.06 -0.85 0.00 0.00 174.74 174.93 2afg s PHE 22 N -2.41 3.28 0.21 1.40 0.08 0.11 0.11 117.98 120.75 2afg s PHE 22 Ca 0.30 0.12 -0.32 0.00 0.12 0.00 0.00 56.93 57.15 2afg s PHE 22 Cb -0.06 -2.07 -0.13 0.00 -0.57 0.00 0.00 43.02 40.19 2afg s PHE 22 CO 0.17 0.20 1.59 -0.11 -0.10 0.00 0.00 175.22 176.97 2afg n LEU 23 N 3.43 3.56 -4.10 -0.37 7.94 -0.33 -2.77 117.00 124.36 2afg n LEU 23 Ca -0.17 1.10 -0.18 0.00 -1.11 0.00 0.00 56.01 55.65 2afg n LEU 23 Cb 0.52 -1.50 -0.13 0.00 0.53 0.00 0.00 43.42 42.84 2afg n LEU 23 CO 0.35 -0.12 -0.44 -0.60 -1.11 0.00 0.00 177.39 175.47 2afg s ARG 24 N 0.52 0.80 -0.35 1.96 3.52 0.50 -4.53 118.95 121.36 2afg s ARG 24 Ca 0.73 -0.67 0.04 0.00 -0.13 0.00 0.00 55.73 55.70 2afg s ARG 24 Cb -0.59 -0.76 0.10 0.00 -1.56 0.00 0.00 34.95 32.14 2afg s ARG 24 CO 0.40 0.19 0.07 0.42 -0.81 0.00 0.00 175.30 175.57 2afg s ILE 25 N -0.82 2.19 0.38 4.11 1.01 -0.98 -0.67 121.20 126.42 2afg s ILE 25 Ca -0.00 -2.36 -0.24 0.00 0.00 0.00 0.00 60.65 58.05 2afg s ILE 25 Cb -0.07 -2.62 -0.10 0.00 0.01 0.00 0.00 42.46 39.68 2afg s ILE 25 CO 0.01 -0.62 0.98 -0.76 0.00 0.00 0.00 174.94 174.54 2afg s LEU 26 N 0.85 4.15 0.46 2.97 1.02 0.61 -4.84 118.68 123.91 2afg s LEU 26 Ca 0.11 1.85 0.30 0.00 0.02 0.00 0.00 54.13 56.41 2afg s LEU 26 Cb -0.19 -4.23 1.38 0.00 0.02 0.00 0.00 46.19 43.16 2afg s LEU 26 CO -0.09 -0.29 1.72 -0.65 0.02 0.00 0.00 176.35 177.07 2afg h PRO 27 N 2.57 0.15 -0.52 1.29 0.11 -1.99 0.55 132.00 134.16 2afg h PRO 27 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2afg h PRO 27 Cb 1.19 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2afg h PRO 27 CO 0.63 0.10 0.00 -0.40 -0.21 0.00 0.00 178.00 178.12 2afg n ASP 28 N -4.46 0.52 0.00 -2.05 5.75 -1.26 -4.78 116.55 110.28 2afg n ASP 28 Ca 0.30 -1.81 0.00 0.00 -0.01 0.00 0.00 54.79 53.27 2afg n ASP 28 Cb 1.24 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 41.07 2afg n ASP 28 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2afg n GLY 29 N 0.20 0.67 3.75 6.12 0.00 0.19 -4.95 105.19 111.17 2afg n GLY 29 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.92 4.20 -0.12 2.61 2.01 -1.17 -1.10 115.64 119.14 2afg s THR 30 Ca 0.00 2.05 0.02 0.00 0.31 0.00 0.00 61.69 64.07 2afg s THR 30 Cb 0.00 -4.31 -0.00 0.00 0.01 0.00 0.00 72.50 68.20 2afg s THR 30 CO 0.00 0.46 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.50 2afg s VAL 31 N -0.89 2.40 0.00 3.82 1.01 -1.26 -0.28 120.40 125.19 2afg s VAL 31 Ca 0.42 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.51 2afg s VAL 31 Cb -0.25 -1.96 0.00 0.00 0.00 0.00 0.00 36.38 34.16 2afg s VAL 31 CO 0.31 0.54 0.00 -0.90 0.00 0.00 0.00 175.10 175.05 2afg n ASP 32 N 3.73 0.00 -4.42 3.32 5.75 0.15 -4.55 116.55 120.54 2afg n ASP 32 Ca -0.19 -0.83 -0.29 0.00 -0.01 0.00 0.00 54.79 53.47 2afg n ASP 32 Cb 0.52 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.49 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 -0.83 1.62 0.04 6.12 0.00 0.27 0.19 107.32 114.72 2afg s GLY 33 Ca 0.00 -1.46 -0.09 0.00 0.00 0.00 0.00 44.72 43.17 2afg s GLY 33 CO 0.00 -1.45 0.18 -1.08 0.00 0.00 0.00 173.10 170.75 2afg s THR 34 N -1.15 0.11 -0.16 0.90 -1.32 -1.11 -4.66 115.64 108.25 2afg s THR 34 Ca 0.16 -0.91 0.21 0.00 -1.21 0.00 0.00 61.69 59.93 2afg s THR 34 Cb -0.10 -0.89 -0.12 0.00 -1.51 0.00 0.00 72.50 69.88 2afg s THR 34 CO 0.07 -0.50 0.82 0.54 -2.21 0.00 0.00 174.62 173.35 2afg n ARG 35 N 0.72 0.62 -1.80 7.08 1.74 -1.26 0.04 116.66 123.79 2afg n ARG 35 Ca -0.19 0.07 -0.21 0.00 -0.77 0.00 0.00 57.85 56.76 2afg n ARG 35 Cb 0.59 -1.74 -0.06 0.00 -1.02 0.00 0.00 32.46 30.22 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 -5.29 4.52 0.62 0.55 -1.08 -1.26 -4.81 116.67 109.91 2afg s ASP 36 Ca -0.03 -0.26 0.21 0.00 -0.52 0.00 0.00 52.55 51.95 2afg s ASP 36 Cb 0.10 -2.55 1.14 0.00 -1.46 0.00 0.00 42.92 40.15 2afg s ASP 36 CO 0.82 -3.30 1.63 -0.09 0.52 0.00 0.00 175.17 174.75 2afg h ARG 37 N 12.26 0.00 -0.01 4.34 2.43 -2.01 0.19 114.38 131.58 2afg h ARG 37 Ca 0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2afg h ARG 37 Cb 1.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2afg h ARG 37 CO 1.11 0.00 -0.21 -1.13 -1.51 0.00 0.00 179.97 178.23 2afg n SER 38 N -2.69 1.53 -4.77 -3.80 3.41 -1.26 -4.94 113.62 101.10 2afg n SER 38 Ca -0.01 -1.27 -0.40 0.00 -0.26 0.00 0.00 58.87 56.93 2afg n SER 38 Cb 0.52 0.15 0.02 0.00 -0.26 0.00 0.00 64.21 64.64 2afg n SER 38 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2afg s ASP 39 N -2.32 5.89 0.00 4.04 -1.08 0.66 -4.88 116.67 118.97 2afg s ASP 39 Ca 0.27 2.95 0.26 0.00 -0.52 0.00 0.00 52.55 55.52 2afg s ASP 39 Cb 0.20 -2.66 0.76 0.00 -1.46 0.00 0.00 42.92 39.75 2afg s ASP 39 CO 0.46 -1.17 1.57 0.00 0.52 0.00 0.00 175.17 176.55 2afg n GLN 40 N -0.16 0.59 -0.44 4.34 6.02 -1.26 -3.86 117.38 122.61 2afg n GLN 40 Ca 0.05 -0.33 0.11 0.00 -0.01 0.00 0.00 57.00 56.82 2afg n GLN 40 Cb 0.41 -1.49 0.33 0.00 1.02 0.00 0.00 30.24 30.51 2afg n GLN 40 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 2afg n HIS 41 N -0.92 1.13 0.83 1.08 8.25 -1.26 -4.28 115.22 120.05 2afg n HIS 41 Ca 0.11 -0.54 0.10 0.00 -0.26 0.00 0.00 57.72 57.12 2afg n HIS 41 Cb 0.34 -0.08 0.03 0.00 1.12 0.00 0.00 29.99 31.40 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 1.44 0.00 -2.78 1.59 -5.35 -1.25 -2.31 119.36 110.70 2afg n ILE 42 Ca 0.25 -0.39 -0.43 0.00 -0.27 0.00 0.00 62.75 61.91 2afg n ILE 42 Cb 0.70 1.31 -0.03 0.00 -1.74 0.00 0.00 39.64 39.87 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 -1.93 3.83 0.47 6.28 -0.21 -1.26 -4.36 119.66 122.47 2afg s GLN 43 Ca 0.19 0.59 0.07 0.00 0.02 0.00 0.00 55.36 56.23 2afg s GLN 43 Cb 0.16 -3.81 0.01 0.00 1.00 0.00 0.00 33.01 30.36 2afg s GLN 43 CO 0.38 -1.00 0.43 -0.51 -2.12 0.00 0.00 175.29 172.47 2afg s LEU 44 N 3.59 3.17 -0.15 2.90 1.43 -0.92 -2.35 118.68 126.34 2afg s LEU 44 Ca 0.39 -0.89 -0.06 0.00 -1.03 0.00 0.00 54.13 52.53 2afg s LEU 44 Cb -0.11 -1.77 0.07 0.00 0.03 0.00 0.00 46.19 44.40 2afg s LEU 44 CO 0.20 -0.85 0.34 -1.58 0.23 0.00 0.00 176.35 174.69 2afg s GLN 45 N -4.23 0.26 -0.14 1.70 0.74 -1.03 -0.57 119.66 116.40 2afg s GLN 45 Ca 0.46 0.80 -0.10 0.00 0.05 0.00 0.00 55.36 56.57 2afg s GLN 45 Cb -0.03 0.06 -0.05 0.00 1.10 0.00 0.00 33.01 34.09 2afg s GLN 45 CO 0.27 -0.23 0.18 -0.51 -0.55 0.00 0.00 175.29 174.46 2afg s LEU 46 N 2.05 4.32 -0.11 3.68 1.02 -1.26 -2.83 118.68 125.55 2afg s LEU 46 Ca -0.04 0.45 0.02 0.00 0.02 0.00 0.00 54.13 54.58 2afg s LEU 46 Cb -0.11 -2.17 0.01 0.00 0.02 0.00 0.00 46.19 43.95 2afg s LEU 46 CO -0.11 0.29 -0.15 -0.94 0.02 0.00 0.00 176.35 175.46 2afg s SER 47 N -0.39 2.43 -0.26 2.29 1.04 -0.58 -4.92 113.70 113.31 2afg s SER 47 Ca 0.14 -0.43 -0.12 0.00 0.48 0.00 0.00 55.95 56.03 2afg s SER 47 Cb -0.12 -1.09 -0.05 0.00 0.10 0.00 0.00 66.02 64.86 2afg s SER 47 CO 0.03 0.01 0.21 0.00 0.98 0.00 0.00 173.24 174.48 2afg s ALA 48 N 0.99 3.57 -0.22 5.32 0.00 -1.26 0.10 121.76 130.27 2afg s ALA 48 Ca -0.07 -0.94 -0.17 0.00 0.00 0.00 0.00 51.96 50.78 2afg s ALA 48 Cb -0.15 -2.45 -0.18 0.00 0.00 0.00 0.00 23.12 20.34 2afg s ALA 48 CO -0.02 -0.40 0.08 -1.91 0.00 0.00 0.00 175.76 173.51 2afg n GLU 49 N 4.74 0.60 -4.39 0.00 2.13 -0.44 -4.97 120.64 118.31 2afg n GLU 49 Ca -0.13 0.44 -0.25 0.00 0.66 0.00 0.00 57.16 57.88 2afg n GLU 49 Cb 0.52 -1.67 -0.11 0.00 0.27 0.00 0.00 31.44 30.44 2afg n GLU 49 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2afg s SER 50 N -7.02 3.17 -0.09 4.31 0.01 -1.24 -5.04 113.70 107.80 2afg s SER 50 Ca -0.31 -0.88 -0.31 0.00 1.31 0.00 0.00 55.95 55.77 2afg s SER 50 Cb 0.08 -0.22 -0.09 0.00 0.21 0.00 0.00 66.02 66.00 2afg s SER 50 CO 0.59 0.06 2.04 0.52 0.41 0.00 0.00 173.24 176.86 2afg n VAL 51 N 0.20 0.58 0.00 3.43 0.31 -1.26 -0.84 118.33 120.75 2afg n VAL 51 Ca -0.12 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2afg n VAL 51 Cb 0.57 -2.25 0.00 0.00 -0.91 0.00 0.00 33.84 31.25 2afg n VAL 51 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2afg n GLY 52 N 4.98 0.72 3.10 2.92 0.00 -1.26 -5.04 105.19 110.61 2afg n GLY 52 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.99 2.23 0.42 1.61 2.02 -0.02 -0.58 118.70 123.39 2afg s GLU 53 Ca 0.00 -1.38 0.08 0.00 0.02 0.00 0.00 54.97 53.69 2afg s GLU 53 Cb 0.00 -3.03 -0.01 0.00 0.10 0.00 0.00 34.13 31.19 2afg s GLU 53 CO 0.00 -0.63 0.41 0.14 0.02 0.00 0.00 175.26 175.19 2afg s VAL 54 N 1.13 2.65 -0.03 2.63 -7.23 -0.30 -1.32 120.40 117.93 2afg s VAL 54 Ca -0.06 -1.31 0.07 0.00 -1.81 0.00 0.00 61.98 58.88 2afg s VAL 54 Cb -0.20 -2.96 -0.02 0.00 0.56 0.00 0.00 36.38 33.77 2afg s VAL 54 CO -0.04 0.00 -0.24 -0.31 -0.31 0.00 0.00 175.10 174.20 2afg s TYR 55 N -2.47 2.24 -0.27 2.82 2.02 0.29 -2.16 117.35 119.81 2afg s TYR 55 Ca 0.49 -0.51 0.03 0.00 -0.37 0.00 0.00 57.07 56.70 2afg s TYR 55 Cb -0.04 -1.45 0.07 0.00 -0.40 0.00 0.00 41.96 40.14 2afg s TYR 55 CO 0.28 -0.10 -0.06 0.42 -1.57 0.00 0.00 175.55 174.52 2afg s ILE 56 N -0.41 2.00 0.08 2.71 1.01 -1.26 -1.53 121.20 123.80 2afg s ILE 56 Ca 0.05 -1.66 0.08 0.00 0.00 0.00 0.00 60.65 59.11 2afg s ILE 56 Cb -0.11 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 2afg s ILE 56 CO 0.01 -0.17 -0.20 -1.59 0.00 0.00 0.00 174.94 172.99 2afg s LYS 57 N 1.15 1.16 -0.04 2.79 -2.85 -1.13 0.12 119.74 120.95 2afg s LYS 57 Ca -0.04 -1.07 -0.30 0.00 -1.00 0.00 0.00 55.97 53.56 2afg s LYS 57 Cb -0.19 -1.36 -0.04 0.00 -2.06 0.00 0.00 37.83 34.18 2afg s LYS 57 CO -0.06 0.32 1.20 0.45 0.10 0.00 0.00 175.35 177.36 2afg s SER 58 N -1.66 7.06 0.52 0.03 0.15 0.43 -2.45 113.70 117.77 2afg s SER 58 Ca 0.06 1.84 0.21 0.00 0.70 0.00 0.00 55.95 58.77 2afg s SER 58 Cb -0.10 -2.56 1.36 0.00 -1.71 0.00 0.00 66.02 63.02 2afg s SER 58 CO 0.03 -0.56 2.11 0.71 1.20 0.00 0.00 173.24 176.73 2afg h THR 59 N 4.93 0.83 0.25 6.45 1.35 -1.77 -0.22 112.91 124.74 2afg h THR 59 Ca -0.35 -0.31 -0.01 0.00 -0.55 0.00 0.00 66.41 65.19 2afg h THR 59 Cb 1.17 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 2afg h THR 59 CO 0.87 0.08 -0.12 -0.08 -0.25 0.00 0.00 175.52 176.02 2afg h GLU 60 N 0.00 -0.32 -0.50 4.72 4.57 -1.82 -3.38 114.58 117.85 2afg h GLU 60 Ca -0.00 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 2afg h GLU 60 Cb 0.17 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 2afg h GLU 60 CO 0.01 -0.21 0.00 0.25 -1.18 0.00 0.00 179.01 177.88 2afg n THR 61 N -3.51 0.66 -0.75 0.32 -2.24 -1.24 -4.97 114.28 102.55 2afg n THR 61 Ca -0.04 -0.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.91 2afg n THR 61 Cb 0.13 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 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 1.57 0.09 3.87 3.38 0.00 -0.09 -4.95 105.19 109.05 2afg n GLY 62 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 2afg n GLY 62 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2afg s GLN 63 N -1.28 3.72 0.07 1.61 -2.07 -1.25 -4.67 119.66 115.79 2afg s GLN 63 Ca 0.00 0.71 0.01 0.00 -1.82 0.00 0.00 55.36 54.26 2afg s GLN 63 Cb 0.00 -2.17 -0.04 0.00 -1.09 0.00 0.00 33.01 29.71 2afg s GLN 63 CO 0.00 -0.37 0.17 0.71 -1.32 0.00 0.00 175.29 174.48 2afg s TYR 64 N -2.86 3.41 0.33 9.60 1.51 -0.79 0.16 117.35 128.72 2afg s TYR 64 Ca 0.55 0.19 -0.24 0.00 -1.01 0.00 0.00 57.07 56.56 2afg s TYR 64 Cb -0.10 -1.71 -0.10 0.00 -0.11 0.00 0.00 41.96 39.94 2afg s TYR 64 CO 0.43 0.57 0.91 -1.17 -1.11 0.00 0.00 175.55 175.18 2afg s LEU 65 N -2.49 4.27 0.17 -1.29 2.96 0.32 -1.05 118.68 121.56 2afg s LEU 65 Ca 0.33 1.74 -0.17 0.00 -0.22 0.00 0.00 54.13 55.81 2afg s LEU 65 Cb -0.13 -4.05 0.03 0.00 0.50 0.00 0.00 46.19 42.55 2afg s LEU 65 CO 0.26 -0.11 0.49 0.00 -1.32 0.00 0.00 176.35 175.68 2afg s ALA 66 N -1.71 -0.98 -0.09 5.97 0.00 0.36 -4.53 121.76 120.79 2afg s ALA 66 Ca 0.51 -0.12 0.03 0.00 0.00 0.00 0.00 51.96 52.39 2afg s ALA 66 Cb -0.17 0.81 0.01 0.00 0.00 0.00 0.00 23.12 23.77 2afg s ALA 66 CO 0.21 -0.75 -0.19 1.41 0.00 0.00 0.00 175.76 176.44 2afg s MET 67 N -3.84 2.48 0.56 0.00 1.75 -1.10 0.28 119.30 119.42 2afg s MET 67 Ca 0.07 -0.68 -0.10 0.00 -1.25 0.00 0.00 55.69 53.73 2afg s MET 67 Cb -0.00 -1.92 0.13 0.00 2.84 0.00 0.00 34.83 35.88 2afg s MET 67 CO -0.06 0.11 0.73 -0.40 -0.65 0.00 0.00 175.02 174.75 2afg n ASP 68 N 3.65 -0.11 0.00 1.11 5.68 0.19 -4.87 116.55 122.20 2afg n ASP 68 Ca -0.21 -1.23 0.09 0.00 -0.50 0.00 0.00 54.79 52.94 2afg n ASP 68 Cb 0.52 -0.57 0.40 0.00 -1.14 0.00 0.00 41.12 40.34 2afg n ASP 68 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 2afg n THR 69 N -3.11 0.70 -1.21 2.12 -1.04 -1.26 -2.04 114.28 108.43 2afg n THR 69 Ca 0.09 0.17 0.08 0.00 -2.04 0.00 0.00 64.05 62.36 2afg n THR 69 Cb 0.32 -0.87 0.17 0.00 -1.82 0.00 0.00 70.33 68.14 2afg n THR 69 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 2afg n ASP 70 N -1.45 2.36 -0.08 8.00 8.00 -1.26 -4.94 116.55 127.17 2afg n ASP 70 Ca 0.05 -3.32 -0.01 0.00 0.71 0.00 0.00 54.79 52.22 2afg n ASP 70 Cb 0.20 -0.48 -0.00 0.00 -0.02 0.00 0.00 41.12 40.81 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 -1.25 0.50 3.81 0.44 0.00 -0.86 -4.56 105.19 103.26 2afg n GLY 71 Ca 0.18 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.23 4.36 0.36 0.99 0.20 -1.26 -0.24 118.68 122.86 2afg s LEU 72 Ca 0.00 0.63 -0.25 0.00 0.69 0.00 0.00 54.13 55.20 2afg s LEU 72 Cb 0.00 -2.34 -0.09 0.00 -0.43 0.00 0.00 46.19 43.32 2afg s LEU 72 CO 0.00 0.26 1.02 -0.76 -0.29 0.00 0.00 176.35 176.58 2afg s LEU 73 N -0.47 4.26 0.21 -0.68 1.43 -1.26 0.55 118.68 122.72 2afg s LEU 73 Ca 0.18 1.99 -0.10 0.00 -1.03 0.00 0.00 54.13 55.17 2afg s LEU 73 Cb -0.14 -4.06 -0.01 0.00 0.03 0.00 0.00 46.19 42.01 2afg s LEU 73 CO 0.07 -0.30 0.36 -0.72 0.23 0.00 0.00 176.35 175.99 2afg s TYR 74 N -1.59 0.45 -0.29 0.29 1.13 0.81 -4.55 117.35 113.61 2afg s TYR 74 Ca 0.53 -0.80 -0.11 0.00 -1.41 0.00 0.00 57.07 55.29 2afg s TYR 74 Cb -0.22 0.01 -0.05 0.00 -1.10 0.00 0.00 41.96 40.61 2afg s TYR 74 CO 0.28 -0.84 0.20 0.20 -2.51 0.00 0.00 175.55 172.88 2afg s GLY 75 N -3.01 1.93 -0.31 5.49 0.00 -0.26 -0.48 107.32 110.68 2afg s GLY 75 Ca 0.22 -1.11 -0.12 0.00 0.00 0.00 0.00 44.72 43.71 2afg s GLY 75 CO 0.05 0.68 0.22 -0.45 0.00 0.00 0.00 173.10 173.61 2afg s SER 76 N 1.75 6.05 0.46 1.64 0.15 -0.22 -4.56 113.70 118.97 2afg s SER 76 Ca 0.07 -0.17 0.31 0.00 0.70 0.00 0.00 55.95 56.87 2afg s SER 76 Cb -0.16 -2.13 1.53 0.00 -1.71 0.00 0.00 66.02 63.54 2afg s SER 76 CO 0.11 -0.14 1.95 1.56 1.20 0.00 0.00 173.24 177.92 2afg h GLN 77 N 8.41 0.00 -4.66 5.44 4.20 -1.92 -2.09 115.11 124.49 2afg h GLN 77 Ca -0.33 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.12 2afg h GLN 77 Cb 1.17 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.81 2afg h GLN 77 CO 0.59 0.00 -0.65 0.95 -0.67 0.00 0.00 178.83 179.05 2afg s THR 78 N -3.69 0.44 0.33 -0.54 -4.23 -1.26 -4.86 115.64 101.83 2afg s THR 78 Ca -0.01 -1.96 -0.20 0.00 -1.18 0.00 0.00 61.69 58.34 2afg s THR 78 Cb 0.09 -2.15 -0.10 0.00 1.34 0.00 0.00 72.50 71.69 2afg s THR 78 CO 0.38 -0.42 0.85 -2.16 -0.54 0.00 0.00 174.62 172.73 2afg s PRO 79 N -3.98 4.26 0.10 3.99 0.04 -1.26 -4.81 135.00 133.33 2afg s PRO 79 Ca 0.26 1.00 -0.26 0.00 0.04 0.00 0.00 61.00 62.04 2afg s PRO 79 Cb 0.07 -2.53 0.08 0.00 0.04 0.00 0.00 34.50 32.15 2afg s PRO 79 CO 0.04 0.18 0.89 0.54 0.04 0.00 0.00 177.00 178.69 2afg s ASN 80 N -1.96 -0.29 0.49 6.66 2.20 -1.26 -5.00 114.94 115.78 2afg s ASN 80 Ca 0.53 -0.22 0.34 0.00 -0.94 0.00 0.00 52.86 52.57 2afg s ASN 80 Cb -0.13 0.47 1.46 0.00 -2.00 0.00 0.00 41.25 41.05 2afg s ASN 80 CO 0.18 -0.81 1.72 -0.08 -2.94 0.00 0.00 177.10 175.17 2afg h GLU 81 N 2.00 0.10 0.00 3.55 4.81 -1.99 1.16 114.58 124.21 2afg h GLU 81 Ca -0.24 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2afg h GLU 81 Cb 1.24 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2afg h GLU 81 CO 0.29 0.07 0.00 0.39 -0.73 0.00 0.00 179.01 179.02 2afg n GLU 82 N -4.34 0.09 -0.23 1.92 1.02 -1.26 -2.92 120.64 114.91 2afg n GLU 82 Ca 0.31 0.19 0.12 0.00 -0.02 0.00 0.00 57.16 57.76 2afg n GLU 82 Cb 1.33 -1.50 0.25 0.00 -0.02 0.00 0.00 31.44 31.50 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 -1.38 4.12 0.09 0.00 1.43 -1.15 -4.53 118.68 117.27 2afg s LEU 84 Ca 0.41 0.34 0.05 0.00 -1.03 0.00 0.00 54.13 53.90 2afg s LEU 84 Cb 0.23 -2.00 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 2afg s LEU 84 CO 0.32 0.37 -0.12 -0.36 0.23 0.00 0.00 176.35 176.79 2afg s PHE 85 N -0.81 1.18 -0.34 0.29 0.40 -0.92 -1.47 117.98 116.31 2afg s PHE 85 Ca 0.13 -0.56 -0.15 0.00 -0.60 0.00 0.00 56.93 55.75 2afg s PHE 85 Cb -0.12 -0.64 -0.01 0.00 0.51 0.00 0.00 43.02 42.76 2afg s PHE 85 CO 0.03 0.05 0.37 -0.51 0.70 0.00 0.00 175.22 175.86 2afg s LEU 86 N -2.19 4.43 -0.14 -0.37 1.43 0.68 -1.15 118.68 121.36 2afg s LEU 86 Ca 0.03 -0.21 -0.22 0.00 -1.03 0.00 0.00 54.13 52.70 2afg s LEU 86 Cb -0.06 -2.36 -0.03 0.00 0.03 0.00 0.00 46.19 43.78 2afg s LEU 86 CO 0.02 -0.35 0.66 -0.70 0.23 0.00 0.00 176.35 176.21 2afg s GLU 87 N 2.04 4.31 -0.13 1.70 2.12 0.25 -0.73 118.70 128.27 2afg s GLU 87 Ca 0.12 0.74 0.02 0.00 0.36 0.00 0.00 54.97 56.21 2afg s GLU 87 Cb -0.16 -3.52 0.01 0.00 0.26 0.00 0.00 34.13 30.72 2afg s GLU 87 CO 0.12 -0.11 -0.19 1.03 -0.54 0.00 0.00 175.26 175.57 2afg s ARG 88 N 1.45 2.67 -0.31 4.30 1.81 0.13 -4.85 118.95 124.14 2afg s ARG 88 Ca 0.33 -0.72 -0.18 0.00 -1.72 0.00 0.00 55.73 53.43 2afg s ARG 88 Cb -0.16 -2.21 -0.01 0.00 -0.45 0.00 0.00 34.95 32.11 2afg s ARG 88 CO 0.13 -0.05 0.50 -0.51 -0.68 0.00 0.00 175.30 174.69 2afg s LEU 89 N 0.93 4.21 0.22 2.53 1.43 -1.26 0.67 118.68 127.42 2afg s LEU 89 Ca -0.06 0.20 -0.29 0.00 -1.03 0.00 0.00 54.13 52.95 2afg s LEU 89 Cb -0.15 -2.60 -0.09 0.00 0.03 0.00 0.00 46.19 43.38 2afg s LEU 89 CO -0.03 -0.39 0.90 -1.61 0.23 0.00 0.00 176.35 175.45 2afg s GLU 90 N 2.34 4.77 0.20 1.70 8.01 0.13 -4.92 118.70 130.94 2afg s GLU 90 Ca 0.19 1.40 0.10 0.00 0.01 0.00 0.00 54.97 56.67 2afg s GLU 90 Cb -0.15 -3.26 0.53 0.00 -4.31 0.00 0.00 34.13 26.94 2afg s GLU 90 CO 0.12 0.53 1.21 0.39 0.01 0.00 0.00 175.26 177.51 2afg n GLU 91 N 1.49 0.07 -0.58 1.61 1.02 -1.26 -1.17 120.64 121.81 2afg n GLU 91 Ca -0.03 0.50 0.05 0.00 -0.02 0.00 0.00 57.16 57.66 2afg n GLU 91 Cb 0.48 -1.89 0.27 0.00 -0.02 0.00 0.00 31.44 30.27 2afg n GLU 91 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 2afg n ASN 92 N -1.83 4.05 0.00 1.62 0.23 -1.26 -4.87 115.26 113.20 2afg n ASN 92 Ca -0.01 -2.58 0.00 0.00 -0.53 0.00 0.00 54.58 51.46 2afg n ASN 92 Cb 0.19 -0.61 0.00 0.00 -2.08 0.00 0.00 39.78 37.28 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 0.44 0.00 -3.75 -2.53 8.25 -0.32 -4.98 115.22 112.34 2afg n HIS 93 Ca 0.18 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.31 2afg n HIS 93 Cb 0.85 -0.46 -0.05 0.00 1.12 0.00 0.00 29.99 31.45 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 -2.95 3.55 0.28 4.41 1.51 -1.25 -4.78 117.35 118.13 2afg s TYR 94 Ca 0.00 0.55 0.08 0.00 -1.01 0.00 0.00 57.07 56.69 2afg s TYR 94 Cb 0.00 -1.98 -0.04 0.00 -0.11 0.00 0.00 41.96 39.83 2afg s TYR 94 CO 0.00 0.57 0.12 -0.80 -1.11 0.00 0.00 175.55 174.33 2afg s ASN 95 N -1.93 4.97 0.08 2.29 0.02 0.17 0.19 114.94 120.72 2afg s ASN 95 Ca 0.31 -0.53 0.06 0.00 -1.02 0.00 0.00 52.86 51.69 2afg s ASN 95 Cb -0.13 -1.01 -0.03 0.00 0.02 0.00 0.00 41.25 40.10 2afg s ASN 95 CO 0.19 -0.11 -0.16 0.42 0.02 0.00 0.00 177.10 177.46 2afg s THR 96 N -2.28 1.32 -0.12 1.60 -4.23 0.21 -1.47 115.64 110.67 2afg s THR 96 Ca 0.34 -1.41 0.01 0.00 -1.18 0.00 0.00 61.69 59.46 2afg s THR 96 Cb -0.06 -1.25 0.02 0.00 1.34 0.00 0.00 72.50 72.54 2afg s THR 96 CO 0.23 -0.18 -0.16 -0.31 -0.54 0.00 0.00 174.62 173.66 2afg s TYR 97 N -1.28 2.10 -0.09 3.99 2.02 -1.25 0.17 117.35 123.01 2afg s TYR 97 Ca 0.01 -1.05 0.02 0.00 -0.37 0.00 0.00 57.07 55.69 2afg s TYR 97 Cb -0.10 -1.51 -0.02 0.00 -0.40 0.00 0.00 41.96 39.93 2afg s TYR 97 CO 0.03 -0.54 -0.14 0.42 -1.57 0.00 0.00 175.55 173.75 2afg s ILE 98 N 1.09 3.01 -0.04 2.71 1.01 0.09 -1.68 121.20 127.39 2afg s ILE 98 Ca -0.04 -0.71 -0.32 0.00 0.00 0.00 0.00 60.65 59.58 2afg s ILE 98 Cb -0.14 -2.21 -0.10 0.00 0.01 0.00 0.00 42.46 40.01 2afg s ILE 98 CO -0.04 0.56 1.97 -0.24 0.00 0.00 0.00 174.94 177.19 2afg n SER 99 N 2.87 3.79 -0.14 3.58 2.88 -0.78 -0.23 113.62 125.58 2afg n SER 99 Ca -0.18 0.86 -0.04 0.00 -1.33 0.00 0.00 58.87 58.19 2afg n SER 99 Cb 0.52 -1.46 0.16 0.00 -0.75 0.00 0.00 64.21 62.68 2afg n SER 99 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2afg h LYS 100 N 10.47 0.87 -0.02 -1.46 3.11 -1.59 0.54 116.57 128.48 2afg h LYS 100 Ca -0.48 -0.20 -0.06 0.00 -2.81 0.00 0.00 60.65 57.10 2afg h LYS 100 Cb 1.25 -0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 32.36 2afg h LYS 100 CO 0.95 0.81 -0.25 -0.22 -2.81 0.00 0.00 179.45 177.93 2afg h LYS 101 N 0.83 0.04 -0.26 1.90 3.64 -1.80 -3.07 116.57 117.84 2afg h LYS 101 Ca 0.17 -0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.36 2afg h LYS 101 Cb 0.36 -0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.03 2afg h LYS 101 CO 0.01 0.29 -0.55 0.72 -2.27 0.00 0.00 179.45 177.65 2afg n HIS 102 N -4.23 0.95 -0.26 1.91 8.25 -1.01 -4.84 115.22 115.98 2afg n HIS 102 Ca -0.02 -1.74 0.01 0.00 -0.26 0.00 0.00 57.72 55.71 2afg n HIS 102 Cb 0.31 -0.31 0.23 0.00 1.12 0.00 0.00 29.99 31.34 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 1.36 1.46 -0.02 -1.41 0.00 -0.80 -2.45 119.26 117.40 2afg h ALA 103 Ca 0.14 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.00 2afg h ALA 103 Cb 1.21 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2afg h ALA 103 CO 0.28 0.48 0.12 1.49 0.00 0.00 0.00 179.25 181.62 2afg h GLU 104 N 1.07 0.00 -0.27 0.00 4.81 -1.87 0.36 114.58 118.67 2afg h GLU 104 Ca 0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 2afg h GLU 104 Cb -0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.35 2afg h GLU 104 CO -0.08 0.00 0.00 1.63 -0.73 0.00 0.00 179.01 179.83 2afg n LYS 105 N -3.12 2.07 -3.54 1.92 5.02 -0.93 -5.01 118.16 114.56 2afg n LYS 105 Ca -0.02 -1.92 -0.25 0.00 -2.02 0.00 0.00 58.31 54.10 2afg n LYS 105 Cb 0.19 -1.36 0.05 0.00 -0.02 0.00 0.00 35.03 33.88 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 0.99 -5.82 -4.61 4.39 4.13 0.13 -4.93 115.26 109.53 2afg n ASN 106 Ca 0.14 -0.88 -0.40 0.00 1.68 0.00 0.00 54.58 55.11 2afg n ASN 106 Cb 0.47 -3.91 -0.07 0.00 -1.54 0.00 0.00 39.78 34.73 2afg n ASN 106 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2afg s TRP 107 N -3.40 3.26 0.36 3.10 0.51 -1.23 -4.81 118.94 116.73 2afg s TRP 107 Ca 0.43 0.63 0.08 0.00 -2.12 0.00 0.00 56.10 55.11 2afg s TRP 107 Cb -0.13 -2.74 -0.03 0.00 -0.81 0.00 0.00 33.47 29.77 2afg s TRP 107 CO 0.82 -0.30 0.30 -0.06 -0.51 0.00 0.00 176.95 177.21 2afg s PHE 108 N 2.33 2.85 -0.23 -1.98 0.40 -1.26 -1.87 117.98 118.22 2afg s PHE 108 Ca 0.21 -0.35 -0.29 0.00 -0.60 0.00 0.00 56.93 55.90 2afg s PHE 108 Cb -0.16 -1.88 0.00 0.00 0.51 0.00 0.00 43.02 41.50 2afg s PHE 108 CO 0.09 0.12 1.17 0.08 0.70 0.00 0.00 175.22 177.38 2afg s VAL 109 N -2.35 4.42 0.01 -0.44 1.01 -0.67 -4.46 120.40 117.91 2afg s VAL 109 Ca 0.42 1.69 -0.10 0.00 0.00 0.00 0.00 61.98 63.99 2afg s VAL 109 Cb -0.05 -4.18 0.01 0.00 0.00 0.00 0.00 36.38 32.15 2afg s VAL 109 CO 0.27 -0.25 0.21 -0.83 0.00 0.00 0.00 175.10 174.49 2afg s GLY 110 N 1.80 -0.02 0.20 4.51 0.00 -1.26 -4.37 107.32 108.19 2afg s GLY 110 Ca 0.50 -0.06 0.11 0.00 0.00 0.00 0.00 44.72 45.27 2afg s GLY 110 CO 0.13 -0.23 -0.21 1.08 0.00 0.00 0.00 173.10 173.87 2afg s LEU 111 N -1.64 2.47 0.38 0.66 1.43 -0.83 -0.56 118.68 120.59 2afg s LEU 111 Ca -0.11 -0.90 0.07 0.00 -1.03 0.00 0.00 54.13 52.16 2afg s LEU 111 Cb -0.04 -1.04 -0.00 0.00 0.03 0.00 0.00 46.19 45.13 2afg s LEU 111 CO 0.00 0.05 0.50 -0.54 0.23 0.00 0.00 176.35 176.59 2afg s LYS 112 N -2.91 2.91 0.55 1.70 1.02 0.34 -4.56 119.74 118.79 2afg s LYS 112 Ca 0.21 -1.18 0.34 0.00 0.02 0.00 0.00 55.97 55.36 2afg s LYS 112 Cb -0.06 -2.74 1.51 0.00 -0.52 0.00 0.00 37.83 36.02 2afg s LYS 112 CO 0.10 -0.12 1.83 0.87 -0.92 0.00 0.00 175.35 177.11 2afg h LYS 113 N 0.80 0.00 0.00 1.68 1.79 -1.90 -1.60 116.57 117.34 2afg h LYS 113 Ca -0.43 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.04 2afg h LYS 113 Cb 1.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.92 2afg h LYS 113 CO 0.50 0.00 -1.06 0.27 -1.08 0.00 0.00 179.45 178.08 2afg n ASN 114 N -4.16 0.65 0.00 0.86 6.94 -1.26 -4.39 115.26 113.90 2afg n ASN 114 Ca 0.22 -0.42 0.00 0.00 -0.02 0.00 0.00 54.58 54.36 2afg n ASN 114 Cb 1.12 0.91 0.00 0.00 -2.36 0.00 0.00 39.78 39.45 2afg n ASN 114 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2afg n GLY 115 N 1.41 1.08 3.77 4.83 0.00 -0.60 -4.93 105.19 110.74 2afg n GLY 115 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 2afg n GLY 115 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2afg s SER 116 N -1.64 7.48 0.45 1.61 0.01 -1.26 0.95 113.70 121.31 2afg s SER 116 Ca 0.00 1.75 -0.25 0.00 1.31 0.00 0.00 55.95 58.76 2afg s SER 116 Cb 0.00 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.61 2afg s SER 116 CO 0.00 0.18 1.35 0.00 0.41 0.00 0.00 173.24 175.18 2afg s LYS 118 N -2.47 4.05 0.40 0.00 2.20 0.27 -4.67 119.74 119.52 2afg s LYS 118 Ca 0.62 -0.07 -0.25 0.00 -0.36 0.00 0.00 55.97 55.90 2afg s LYS 118 Cb -0.40 -3.60 -0.09 0.00 -1.51 0.00 0.00 37.83 32.24 2afg s LYS 118 CO 0.50 -0.11 1.19 1.03 -0.36 0.00 0.00 175.35 177.59 2afg s ARG 119 N 1.57 4.07 0.00 4.03 0.52 -1.26 -4.29 118.95 123.58 2afg s ARG 119 Ca 0.12 1.88 0.00 0.00 -0.52 0.00 0.00 55.73 57.22 2afg s ARG 119 Cb -0.15 -2.71 0.00 0.00 0.52 0.00 0.00 34.95 32.61 2afg s ARG 119 CO 0.08 -0.32 0.22 0.41 0.02 0.00 0.00 175.30 175.72 2afg n GLY 120 N 0.66 -1.36 0.40 -3.53 0.00 0.67 -0.35 105.19 101.68 2afg n GLY 120 Ca 0.04 0.28 0.14 0.00 0.00 0.00 0.00 46.02 46.48 2afg n GLY 120 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2afg h PRO 121 N 0.00 0.00 0.00 1.61 0.13 -1.86 0.67 132.00 132.55 2afg h PRO 121 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2afg h PRO 121 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2afg h PRO 121 CO 0.00 0.00 -0.54 0.00 -0.23 0.00 0.00 178.00 177.23 2afg h ARG 122 N 0.00 0.00 -6.53 0.86 2.47 -1.05 -3.46 114.38 106.66 2afg h ARG 122 Ca 0.17 0.00 -0.52 0.00 -1.26 0.00 0.00 59.98 58.37 2afg h ARG 122 Cb 1.89 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 30.18 2afg h ARG 122 CO -0.00 0.00 -0.01 0.95 0.56 0.00 0.00 179.97 181.46 2afg s THR 123 N -3.20 4.80 0.04 2.04 -4.23 0.23 -4.98 115.64 110.33 2afg s THR 123 Ca 0.06 0.77 -0.04 0.00 -1.18 0.00 0.00 61.69 61.29 2afg s THR 123 Cb 0.11 -3.65 -0.02 0.00 1.34 0.00 0.00 72.50 70.28 2afg s THR 123 CO 0.71 -0.04 0.06 -1.00 -0.54 0.00 0.00 174.62 173.81 2afg s HIS 124 N -1.79 0.27 0.67 3.99 3.76 -1.26 -4.73 115.29 116.19 2afg s HIS 124 Ca 0.48 -0.63 -0.17 0.00 -0.15 0.00 0.00 55.06 54.59 2afg s HIS 124 Cb -0.12 -0.20 0.00 0.00 1.11 0.00 0.00 32.58 33.38 2afg s HIS 124 CO 0.19 -0.36 1.21 -0.47 -0.85 0.00 0.00 174.74 174.46 2afg s TYR 125 N -2.84 2.22 0.00 1.40 6.14 -1.26 -2.28 117.35 120.73 2afg s TYR 125 Ca -0.03 1.55 0.00 0.00 0.64 0.00 0.00 57.07 59.23 2afg s TYR 125 Cb 0.00 -3.47 0.00 0.00 0.42 0.00 0.00 41.96 38.91 2afg s TYR 125 CO -0.06 -2.42 0.00 0.41 0.64 0.00 0.00 175.55 174.12 2afg n GLY 126 N 0.40 1.59 3.76 8.97 0.00 -1.26 -5.02 105.19 113.63 2afg n GLY 126 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.56 4.73 0.21 1.61 -0.21 -0.97 -4.94 119.66 119.53 2afg s GLN 127 Ca 0.00 1.38 0.26 0.00 0.02 0.00 0.00 55.36 57.02 2afg s GLN 127 Cb 0.00 -3.14 0.81 0.00 1.00 0.00 0.00 33.01 31.68 2afg s GLN 127 CO 0.00 0.46 1.77 1.17 -2.12 0.00 0.00 175.29 176.58 2afg n LYS 128 N 1.24 0.26 0.24 2.91 4.81 -1.26 -3.22 118.16 123.14 2afg n LYS 128 Ca -0.02 0.21 0.14 0.00 -0.87 0.00 0.00 58.31 57.78 2afg n LYS 128 Cb 0.48 -1.80 0.43 0.00 0.02 0.00 0.00 35.03 34.16 2afg n LYS 128 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2afg h ALA 129 N 2.53 1.00 0.00 3.14 0.00 -1.92 -2.98 119.26 121.02 2afg h ALA 129 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2afg h ALA 129 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2afg h ALA 129 CO 0.00 0.00 -1.43 0.44 0.00 0.00 0.00 179.25 178.26 2afg n ILE 130 N -3.02 0.26 -2.50 0.00 -5.35 -1.20 -1.96 119.36 105.59 2afg n ILE 130 Ca 0.02 -0.46 -0.42 0.00 -0.27 0.00 0.00 62.75 61.62 2afg n ILE 130 Cb 0.41 -0.06 -0.03 0.00 -1.74 0.00 0.00 39.64 38.22 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 -4.69 4.34 0.04 7.28 1.43 -1.22 -4.56 118.68 121.31 2afg s LEU 131 Ca -0.03 1.88 0.05 0.00 -1.03 0.00 0.00 54.13 55.00 2afg s LEU 131 Cb 0.12 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 2afg s LEU 131 CO 0.85 -0.45 -0.15 -0.36 0.23 0.00 0.00 176.35 176.46 2afg s PHE 132 N 1.35 1.35 -0.13 0.29 0.08 -0.54 -2.33 117.98 118.06 2afg s PHE 132 Ca 0.56 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 57.27 2afg s PHE 132 Cb -0.26 -0.81 -0.01 0.00 -0.57 0.00 0.00 43.02 41.37 2afg s PHE 132 CO 0.27 0.04 -0.16 -1.17 -0.10 0.00 0.00 175.22 174.11 2afg s LEU 133 N -1.08 2.56 -0.20 -0.37 2.96 0.73 0.42 118.68 123.70 2afg s LEU 133 Ca 0.03 -0.40 -0.10 0.00 -0.22 0.00 0.00 54.13 53.44 2afg s LEU 133 Cb -0.08 -1.56 -0.05 0.00 0.50 0.00 0.00 46.19 45.00 2afg s LEU 133 CO 0.01 0.15 0.14 -2.16 -1.32 0.00 0.00 176.35 173.17 2afg s PRO 134 N 0.43 4.18 0.28 0.98 0.04 -1.26 0.81 135.00 140.45 2afg s PRO 134 Ca -0.12 -0.22 0.11 0.00 0.04 0.00 0.00 61.00 60.82 2afg s PRO 134 Cb -0.16 -3.44 -0.05 0.00 0.04 0.00 0.00 34.50 30.89 2afg s PRO 134 CO 0.05 0.27 -0.13 -0.51 0.04 0.00 0.00 177.00 176.72 2afg s LEU 135 N 0.46 2.79 0.51 -3.56 1.43 0.47 -4.93 118.68 115.84 2afg s LEU 135 Ca 0.08 -0.92 -0.17 0.00 -1.03 0.00 0.00 54.13 52.09 2afg s LEU 135 Cb -0.11 -1.29 -0.08 0.00 0.03 0.00 0.00 46.19 44.74 2afg s LEU 135 CO -0.01 0.02 0.99 -2.84 0.23 0.00 0.00 176.35 174.74 2afg s PRO 136 N -3.57 3.90 0.00 1.29 0.02 -1.26 -0.73 135.00 134.65 2afg s PRO 136 Ca 0.31 1.04 0.07 0.00 0.02 0.00 0.00 61.00 62.44 2afg s PRO 136 Cb -0.05 -2.13 0.40 0.00 0.02 0.00 0.00 34.50 32.74 2afg s PRO 136 CO 0.17 -0.31 0.86 0.28 -0.33 0.00 0.00 177.00 177.67