#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2flb s VAL 7 N 0.00 1.36 0.44 12.58 -7.23 -1.26 -5.11 120.40 121.18 2flb s VAL 7 Ca 0.00 -1.23 -0.20 0.00 -1.81 0.00 0.00 61.98 58.74 2flb s VAL 7 Cb 0.00 -1.24 -0.10 0.00 0.56 0.00 0.00 36.38 35.60 2flb s VAL 7 CO 0.00 -0.02 0.94 0.00 -0.31 0.00 0.00 175.10 175.71 2flb s ALA 8 N -1.01 3.07 0.80 1.32 0.00 -1.26 -4.78 121.76 119.90 2flb s ALA 8 Ca 0.03 0.32 -0.12 0.00 0.00 0.00 0.00 51.96 52.20 2flb s ALA 8 Cb -0.09 -3.11 0.08 0.00 0.00 0.00 0.00 23.12 19.99 2flb s ALA 8 CO 0.02 0.06 1.14 0.00 0.00 0.00 0.00 175.76 176.98 2flb s ALA 9 N -2.27 1.98 0.22 0.00 0.00 -1.26 -4.66 121.76 115.77 2flb s ALA 9 Ca 0.61 0.54 -0.10 0.00 0.00 0.00 0.00 51.96 53.01 2flb s ALA 9 Cb -0.09 -3.38 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 2flb s ALA 9 CO 0.18 -2.08 0.38 1.52 0.00 0.00 0.00 175.76 175.76 2flb s TYR 10 N -2.56 0.48 -1.17 0.00 -0.85 -0.10 -4.76 117.35 108.40 2flb s TYR 10 Ca 0.67 -0.81 -0.08 0.00 -0.52 0.00 0.00 57.07 56.32 2flb s TYR 10 Cb -0.22 0.02 0.01 0.00 0.38 0.00 0.00 41.96 42.15 2flb s TYR 10 CO 0.53 -0.87 1.02 0.09 -1.52 0.00 0.00 175.55 174.79 2flb n ASN 11 N -0.32 -5.78 -4.68 -0.18 4.13 -1.26 -1.37 115.26 105.79 2flb n ASN 11 Ca -0.03 -0.46 -0.42 0.00 1.68 0.00 0.00 54.58 55.35 2flb n ASN 11 Cb 0.63 -4.39 -0.03 0.00 -1.54 0.00 0.00 39.78 34.45 2flb n ASN 11 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2flb s LEU 12 N -6.41 4.32 -0.01 3.41 1.02 -1.26 -4.19 118.68 115.56 2flb s LEU 12 Ca 0.50 2.19 0.01 0.00 0.02 0.00 0.00 54.13 56.85 2flb s LEU 12 Cb -0.22 -3.55 0.01 0.00 0.02 0.00 0.00 46.19 42.44 2flb s LEU 12 CO 0.62 -0.79 -0.03 -0.89 0.02 0.00 0.00 176.35 175.28 2flb s THR 13 N 2.80 0.27 -0.22 5.49 2.01 -0.05 -4.40 115.64 121.54 2flb s THR 13 Ca 0.67 -0.09 -0.16 0.00 0.31 0.00 0.00 61.69 62.43 2flb s THR 13 Cb -0.33 -0.27 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 2flb s THR 13 CO 0.27 0.11 0.40 0.26 -0.69 0.00 0.00 174.62 174.97 2flb s TRP 14 N 0.27 3.34 -0.22 4.92 0.52 -1.26 -0.69 118.94 125.82 2flb s TRP 14 Ca -0.03 0.58 -0.03 0.00 0.02 0.00 0.00 56.10 56.64 2flb s TRP 14 Cb -0.06 -2.55 -0.00 0.00 -1.15 0.00 0.00 33.47 29.71 2flb s TRP 14 CO -0.01 -0.07 -0.05 0.15 0.02 0.00 0.00 176.95 176.99 2flb s LYS 15 N 1.53 3.27 -0.10 4.98 -0.14 0.85 -4.98 119.74 125.15 2flb s LYS 15 Ca 0.18 -0.69 -0.05 0.00 -1.36 0.00 0.00 55.97 54.05 2flb s LYS 15 Cb -0.15 -2.99 0.05 0.00 -1.68 0.00 0.00 37.83 33.06 2flb s LYS 15 CO 0.08 -0.23 0.23 0.45 -0.76 0.00 0.00 175.35 175.12 2flb s SER 16 N 1.45 -0.03 -0.03 2.83 0.15 -1.26 -0.73 113.70 116.07 2flb s SER 16 Ca 0.05 0.50 0.01 0.00 0.70 0.00 0.00 55.95 57.20 2flb s SER 16 Cb -0.15 0.43 0.02 0.00 -1.71 0.00 0.00 66.02 64.62 2flb s SER 16 CO -0.04 -0.19 -0.02 -0.89 1.20 0.00 0.00 173.24 173.30 2flb s THR 17 N 1.58 0.34 -1.18 6.45 2.01 -0.75 -1.10 115.64 122.98 2flb s THR 17 Ca -0.06 -0.02 -0.07 0.00 0.31 0.00 0.00 61.69 61.85 2flb s THR 17 Cb -0.11 -0.39 0.05 0.00 0.01 0.00 0.00 72.50 72.06 2flb s THR 17 CO -0.08 0.17 0.37 0.59 -0.69 0.00 0.00 174.62 174.98 2flb n ASN 18 N 3.99 -3.65 0.00 3.53 4.13 0.79 -1.14 115.26 122.91 2flb n ASN 18 Ca -0.25 -0.23 0.00 0.00 1.68 0.00 0.00 54.58 55.78 2flb n ASN 18 Cb 0.51 -3.04 0.00 0.00 -1.54 0.00 0.00 39.78 35.71 2flb n ASN 18 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2flb n PHE 19 N -3.76 0.00 -2.25 3.10 3.72 -1.26 -1.33 117.46 115.67 2flb n PHE 19 Ca -0.04 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.94 2flb n PHE 19 Cb 0.55 -0.26 -0.02 0.00 -0.94 0.00 0.00 39.48 38.81 2flb n PHE 19 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2flb s LYS 20 N -0.16 3.35 -0.19 -1.08 2.47 -0.30 -4.74 119.74 119.09 2flb s LYS 20 Ca 0.00 0.88 -0.00 0.00 -1.56 0.00 0.00 55.97 55.29 2flb s LYS 20 Cb 0.00 -4.13 0.01 0.00 -1.46 0.00 0.00 37.83 32.26 2flb s LYS 20 CO 0.00 -1.85 -0.15 0.99 0.16 0.00 0.00 175.35 174.50 2flb s THR 21 N 6.30 2.46 -0.06 3.43 2.01 -1.26 -1.81 115.64 126.71 2flb s THR 21 Ca 0.64 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.84 2flb s THR 21 Cb -0.15 -2.07 0.01 0.00 0.01 0.00 0.00 72.50 70.31 2flb s THR 21 CO 0.30 0.50 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.99 2flb s ILE 22 N 1.35 1.01 0.13 1.82 1.09 0.09 -0.96 121.20 125.73 2flb s ILE 22 Ca 0.05 -0.40 -0.13 0.00 -1.10 0.00 0.00 60.65 59.06 2flb s ILE 22 Cb -0.13 -0.94 -0.07 0.00 -1.06 0.00 0.00 42.46 40.26 2flb s ILE 22 CO -0.10 0.33 0.51 -0.22 -0.10 0.00 0.00 174.94 175.36 2flb s LEU 23 N 0.71 4.34 0.08 2.97 2.96 -0.63 -0.10 118.68 129.01 2flb s LEU 23 Ca -0.14 1.01 0.02 0.00 -0.22 0.00 0.00 54.13 54.80 2flb s LEU 23 Cb -0.16 -3.19 -0.04 0.00 0.50 0.00 0.00 46.19 43.30 2flb s LEU 23 CO 0.03 0.12 -0.07 -1.61 -1.32 0.00 0.00 176.35 173.50 2flb s GLU 24 N -1.94 0.76 0.23 1.98 2.02 0.13 -0.75 118.70 121.13 2flb s GLU 24 Ca 0.36 -1.19 -0.13 0.00 0.02 0.00 0.00 54.97 54.04 2flb s GLU 24 Cb -0.15 -0.22 0.05 0.00 0.10 0.00 0.00 34.13 33.91 2flb s GLU 24 CO 0.19 -0.00 0.64 -2.67 0.02 0.00 0.00 175.26 173.44 2flb n TRP 25 N 0.32 -1.70 -4.07 1.61 2.14 -0.75 -0.87 117.44 114.12 2flb n TRP 25 Ca -0.15 -1.21 -0.07 0.00 2.07 0.00 0.00 57.50 58.14 2flb n TRP 25 Cb 0.59 0.60 -0.10 0.00 -0.81 0.00 0.00 31.31 31.59 2flb n TRP 25 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 2flb s GLU 26 N -2.06 0.58 0.53 -2.67 2.02 -0.47 -4.79 118.70 111.84 2flb s GLU 26 Ca 0.13 -1.14 0.05 0.00 0.02 0.00 0.00 54.97 54.03 2flb s GLU 26 Cb -0.03 0.20 0.05 0.00 0.10 0.00 0.00 34.13 34.45 2flb s GLU 26 CO 0.07 -0.11 0.74 -1.25 0.02 0.00 0.00 175.26 174.73 2flb s PRO 27 N -3.63 2.48 0.03 0.39 0.04 -1.26 -0.92 135.00 132.13 2flb s PRO 27 Ca 0.04 -1.12 -0.30 0.00 0.04 0.00 0.00 61.00 59.66 2flb s PRO 27 Cb 0.06 -2.58 -0.07 0.00 0.04 0.00 0.00 34.50 31.94 2flb s PRO 27 CO -0.09 -0.69 1.59 0.15 0.04 0.00 0.00 177.00 178.00 2flb s LYS 28 N -4.66 4.22 0.07 4.56 3.01 -1.26 -4.90 119.74 120.77 2flb s LYS 28 Ca 0.58 2.21 -0.30 0.00 -1.01 0.00 0.00 55.97 57.45 2flb s LYS 28 Cb -0.09 -3.65 -0.05 0.00 -1.01 0.00 0.00 37.83 33.02 2flb s LYS 28 CO 0.37 -0.71 1.13 -1.25 0.51 0.00 0.00 175.35 175.41 2flb s PRO 29 N 2.80 4.49 -0.45 -1.68 0.04 -1.26 -5.00 135.00 133.93 2flb s PRO 29 Ca 0.71 1.68 -0.10 0.00 0.04 0.00 0.00 61.00 63.33 2flb s PRO 29 Cb -0.37 -3.36 0.09 0.00 0.04 0.00 0.00 34.50 30.91 2flb s PRO 29 CO 0.30 -0.15 0.32 0.08 0.04 0.00 0.00 177.00 177.59 2flb s VAL 30 N 0.84 4.40 -1.11 -0.36 1.01 -1.26 -4.53 120.40 119.39 2flb s VAL 30 Ca 0.56 -1.49 -0.07 0.00 0.00 0.00 0.00 61.98 60.98 2flb s VAL 30 Cb -0.27 -3.76 0.01 0.00 0.00 0.00 0.00 36.38 32.36 2flb s VAL 30 CO 0.30 -0.62 0.93 0.59 0.00 0.00 0.00 175.10 176.30 2flb n ASN 31 N 4.97 -5.55 -3.74 3.32 5.03 -1.26 -4.98 115.26 113.05 2flb n ASN 31 Ca -0.10 -0.42 -0.13 0.00 0.87 0.00 0.00 54.58 54.80 2flb n ASN 31 Cb 0.42 -4.17 -0.08 0.00 -1.02 0.00 0.00 39.78 34.93 2flb n ASN 31 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 2flb s GLN 32 N -6.03 0.74 0.23 3.52 0.74 -1.26 -1.53 119.66 116.07 2flb s GLN 32 Ca 0.46 -0.29 0.04 0.00 0.05 0.00 0.00 55.36 55.62 2flb s GLN 32 Cb -0.20 0.33 -0.05 0.00 1.10 0.00 0.00 33.01 34.18 2flb s GLN 32 CO 0.57 -0.22 -0.01 0.14 -0.55 0.00 0.00 175.29 175.22 2flb s VAL 33 N -1.79 1.07 0.11 1.34 -7.23 -0.10 -4.71 120.40 109.10 2flb s VAL 33 Ca -0.10 -2.04 0.07 0.00 -1.81 0.00 0.00 61.98 58.10 2flb s VAL 33 Cb -0.03 -2.34 -0.04 0.00 0.56 0.00 0.00 36.38 34.54 2flb s VAL 33 CO 0.02 -0.33 -0.17 -0.31 -0.31 0.00 0.00 175.10 173.99 2flb s TYR 34 N -3.40 1.57 0.03 2.82 2.02 -0.67 -0.70 117.35 119.03 2flb s TYR 34 Ca 0.28 -0.46 0.02 0.00 -0.37 0.00 0.00 57.07 56.54 2flb s TYR 34 Cb 0.05 -0.85 -0.02 0.00 -0.40 0.00 0.00 41.96 40.75 2flb s TYR 34 CO 0.09 0.18 -0.07 0.99 -1.57 0.00 0.00 175.55 175.16 2flb s THR 35 N -1.52 0.52 -0.02 -0.71 2.01 -0.91 -1.16 115.64 113.84 2flb s THR 35 Ca 0.06 -0.83 -0.01 0.00 0.31 0.00 0.00 61.69 61.22 2flb s THR 35 Cb -0.08 -0.55 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 2flb s THR 35 CO 0.04 -0.23 0.06 -0.69 -0.69 0.00 0.00 174.62 173.11 2flb s VAL 36 N -1.00 4.59 -0.03 3.82 1.01 -0.82 0.07 120.40 128.04 2flb s VAL 36 Ca -0.06 -0.39 0.06 0.00 0.00 0.00 0.00 61.98 61.59 2flb s VAL 36 Cb -0.08 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.23 2flb s VAL 36 CO 0.00 0.41 -0.21 -1.10 0.00 0.00 0.00 175.10 174.21 2flb s GLN 37 N -1.53 1.80 0.08 2.72 -0.21 0.04 -0.48 119.66 122.08 2flb s GLN 37 Ca 0.20 -0.73 0.08 0.00 0.02 0.00 0.00 55.36 54.93 2flb s GLN 37 Cb -0.12 -1.67 -0.03 0.00 1.00 0.00 0.00 33.01 32.19 2flb s GLN 37 CO 0.11 0.40 -0.22 -1.50 -2.12 0.00 0.00 175.29 171.95 2flb s ILE 38 N -0.34 1.81 0.19 1.08 2.07 -0.27 -0.97 121.20 124.78 2flb s ILE 38 Ca 0.04 -1.42 -0.13 0.00 -1.41 0.00 0.00 60.65 57.73 2flb s ILE 38 Cb -0.09 -1.60 0.01 0.00 0.13 0.00 0.00 42.46 40.90 2flb s ILE 38 CO 0.00 0.11 0.41 -0.94 -1.91 0.00 0.00 174.94 172.61 2flb s SER 39 N -1.58 -0.09 0.57 4.50 1.04 -0.69 -0.66 113.70 116.79 2flb s SER 39 Ca 0.08 -0.74 0.01 0.00 0.48 0.00 0.00 55.95 55.78 2flb s SER 39 Cb -0.10 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.58 2flb s SER 39 CO 0.03 -1.00 0.80 0.42 0.98 0.00 0.00 173.24 174.47 2flb s THR 40 N -3.94 2.62 0.49 2.02 -4.23 -1.26 -1.25 115.64 110.09 2flb s THR 40 Ca 0.15 -0.64 0.14 0.00 -1.18 0.00 0.00 61.69 60.17 2flb s THR 40 Cb 0.01 -2.99 0.26 0.00 1.34 0.00 0.00 72.50 71.12 2flb s THR 40 CO 0.01 0.00 2.11 0.11 -0.54 0.00 0.00 174.62 176.31 2flb h LYS 41 N 0.01 0.11 -0.00 3.99 1.79 -1.94 -2.69 116.57 117.84 2flb h LYS 41 Ca -0.42 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.04 2flb h LYS 41 Cb 1.30 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.92 2flb h LYS 41 CO 0.52 0.09 -0.52 0.43 -1.08 0.00 0.00 179.45 178.90 2flb n SER 42 N -4.50 0.84 -4.91 0.86 7.64 -1.26 -5.03 113.62 107.26 2flb n SER 42 Ca -0.02 -0.92 -0.28 0.00 1.01 0.00 0.00 58.87 58.66 2flb n SER 42 Cb 0.10 0.86 0.08 0.00 -1.01 0.00 0.00 64.21 64.23 2flb n SER 42 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2flb s GLY 43 N -2.08 1.63 0.59 0.23 0.00 -1.02 -5.07 107.32 101.60 2flb s GLY 43 Ca 0.07 -0.72 -0.13 0.00 0.00 0.00 0.00 44.72 43.93 2flb s GLY 43 CO 0.48 -0.28 1.02 0.99 0.00 0.00 0.00 173.10 175.31 2flb s ASP 44 N -4.53 6.23 0.23 1.64 1.01 -1.26 -4.60 116.67 115.39 2flb s ASP 44 Ca 0.61 1.54 -0.30 0.00 0.71 0.00 0.00 52.55 55.11 2flb s ASP 44 Cb -0.11 -2.49 -0.09 0.00 1.01 0.00 0.00 42.92 41.24 2flb s ASP 44 CO 0.48 -0.87 1.13 0.26 0.21 0.00 0.00 175.17 176.38 2flb s TRP 45 N -2.89 3.52 -0.08 4.23 0.52 -1.26 -4.56 118.94 118.42 2flb s TRP 45 Ca 0.58 1.59 0.05 0.00 0.02 0.00 0.00 56.10 58.34 2flb s TRP 45 Cb -0.11 -3.33 -0.00 0.00 -1.15 0.00 0.00 33.47 28.87 2flb s TRP 45 CO 0.44 -0.78 -0.24 0.21 0.02 0.00 0.00 176.95 176.60 2flb s LYS 46 N -0.87 2.85 0.38 4.98 2.20 0.17 -4.93 119.74 124.52 2flb s LYS 46 Ca 0.48 -0.89 -0.15 0.00 -0.36 0.00 0.00 55.97 55.06 2flb s LYS 46 Cb -0.32 -2.25 -0.08 0.00 -1.51 0.00 0.00 37.83 33.67 2flb s LYS 46 CO 0.39 0.26 0.80 -1.12 -0.36 0.00 0.00 175.35 175.31 2flb s SER 47 N 0.14 6.70 0.20 1.43 0.01 -1.26 -1.11 113.70 119.82 2flb s SER 47 Ca -0.13 1.32 -0.15 0.00 1.31 0.00 0.00 55.95 58.30 2flb s SER 47 Cb -0.16 -2.39 0.01 0.00 0.21 0.00 0.00 66.02 63.69 2flb s SER 47 CO 0.07 -0.32 0.47 -0.54 0.41 0.00 0.00 173.24 173.33 2flb s LYS 48 N -3.37 1.37 -1.05 12.44 -0.14 0.37 -4.96 119.74 124.39 2flb s LYS 48 Ca 0.55 -1.00 -0.20 0.00 -1.36 0.00 0.00 55.97 53.96 2flb s LYS 48 Cb -0.10 0.48 0.02 0.00 -1.68 0.00 0.00 37.83 36.56 2flb s LYS 48 CO 0.22 -0.57 0.66 0.00 -0.76 0.00 0.00 175.35 174.90 2flb s PHE 50 N -3.30 3.15 -1.59 0.00 0.08 -1.26 -3.21 117.98 111.85 2flb s PHE 50 Ca 0.29 1.01 -0.05 0.00 0.12 0.00 0.00 56.93 58.30 2flb s PHE 50 Cb -0.15 -3.59 0.05 0.00 -0.57 0.00 0.00 43.02 38.76 2flb s PHE 50 CO 0.93 -2.04 0.21 0.66 -0.10 0.00 0.00 175.22 174.88 2flb n TYR 51 N 4.55 -1.33 -2.28 0.36 4.01 -0.88 -4.95 117.16 116.63 2flb n TYR 51 Ca 0.11 0.66 -0.30 0.00 -0.16 0.00 0.00 57.90 58.21 2flb n TYR 51 Cb 0.44 -2.81 -0.00 0.00 -0.31 0.00 0.00 39.34 36.66 2flb n TYR 51 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2flb s THR 52 N -4.08 4.76 -1.11 -0.72 -1.32 -0.31 -4.65 115.64 108.21 2flb s THR 52 Ca 0.17 0.67 0.16 0.00 -1.21 0.00 0.00 61.69 61.48 2flb s THR 52 Cb -0.10 -3.84 -0.09 0.00 -1.51 0.00 0.00 72.50 66.97 2flb s THR 52 CO 0.98 -0.94 0.76 0.35 -2.21 0.00 0.00 174.62 173.57 2flb n THR 53 N -2.31 0.00 -0.65 5.08 -2.24 -1.26 -1.67 114.28 111.23 2flb n THR 53 Ca 0.04 -0.23 -0.31 0.00 -2.27 0.00 0.00 64.05 61.28 2flb n THR 53 Cb 0.54 1.10 0.18 0.00 -2.10 0.00 0.00 70.33 70.05 2flb n THR 53 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2flb n ASP 54 N -0.74 -0.24 -0.66 3.42 10.43 -1.26 -4.61 116.55 122.88 2flb n ASP 54 Ca 0.05 0.31 0.05 0.00 2.57 0.00 0.00 54.79 57.76 2flb n ASP 54 Cb 0.29 -1.41 0.20 0.00 1.84 0.00 0.00 41.12 42.04 2flb n ASP 54 CO 0.00 0.00 0.00 0.35 -1.07 0.00 0.00 177.20 176.48 2flb n THR 55 N -4.34 2.19 -3.95 -3.53 -2.24 -1.26 -4.85 114.28 96.29 2flb n THR 55 Ca 0.10 -3.25 -0.08 0.00 -2.27 0.00 0.00 64.05 58.55 2flb n THR 55 Cb 0.53 -0.25 -0.08 0.00 -2.10 0.00 0.00 70.33 68.42 2flb n THR 55 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2flb s GLU 56 N -3.20 0.83 -0.20 -0.78 -1.05 -1.26 -1.82 118.70 111.22 2flb s GLU 56 Ca 0.38 -1.09 -0.06 0.00 -0.15 0.00 0.00 54.97 54.05 2flb s GLU 56 Cb 0.37 0.30 0.09 0.00 -0.44 0.00 0.00 34.13 34.46 2flb s GLU 56 CO -0.07 -0.25 0.41 0.00 0.95 0.00 0.00 175.26 176.31 2flb s ASP 58 N 2.60 7.07 -0.05 0.00 2.15 -1.26 -1.60 116.67 125.58 2flb s ASP 58 Ca -0.00 2.05 0.07 0.00 0.43 0.00 0.00 52.55 55.09 2flb s ASP 58 Cb -0.12 -2.58 0.10 0.00 -0.30 0.00 0.00 42.92 40.02 2flb s ASP 58 CO -0.13 -0.47 0.97 0.18 -0.17 0.00 0.00 175.17 175.55 2flb n LEU 59 N 3.80 1.43 -0.23 -1.34 4.77 -0.13 -4.85 117.00 120.46 2flb n LEU 59 Ca 0.09 -1.87 0.01 0.00 -0.03 0.00 0.00 56.01 54.20 2flb n LEU 59 Cb 0.46 -0.15 0.12 0.00 -2.33 0.00 0.00 43.42 41.52 2flb n LEU 59 CO 0.56 0.45 1.05 0.74 -1.33 0.00 0.00 177.39 178.85 2flb h THR 60 N 1.76 0.85 -0.58 -5.08 2.02 -1.81 -2.27 112.91 107.79 2flb h THR 60 Ca 0.00 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.99 2flb h THR 60 Cb 0.92 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 2flb h THR 60 CO 0.00 0.10 0.37 0.44 0.37 0.00 0.00 175.52 176.80 2flb h ASP 61 N 0.56 0.68 0.01 4.18 3.32 -1.91 -0.11 116.42 123.15 2flb h ASP 61 Ca 0.33 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 2flb h ASP 61 Cb 0.35 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2flb h ASP 61 CO -0.26 0.51 -0.00 -0.33 -1.72 0.00 0.00 179.24 177.43 2flb h GLU 62 N 0.80 -0.01 0.00 3.56 4.39 -1.85 -3.37 114.58 118.10 2flb h GLU 62 Ca 0.21 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.88 2flb h GLU 62 Cb -0.06 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.59 2flb h GLU 62 CO -0.04 0.83 -0.14 -0.84 -1.16 0.00 0.00 179.01 177.67 2flb h ILE 63 N -0.93 0.35 -0.00 3.13 -0.00 -0.99 -2.57 117.51 116.49 2flb h ILE 63 Ca -0.00 -0.87 0.00 0.00 -0.00 0.00 0.00 64.86 63.99 2flb h ILE 63 Cb 0.85 1.66 0.00 0.00 -0.00 0.00 0.00 36.82 39.33 2flb h ILE 63 CO 0.00 0.13 -0.01 1.33 -0.00 0.00 0.00 178.15 179.60 2flb n VAL 64 N -3.29 0.00 -0.18 0.16 0.24 -0.09 -3.22 118.33 111.95 2flb n VAL 64 Ca 0.00 -0.02 -0.09 0.00 -2.04 0.00 0.00 64.34 62.19 2flb n VAL 64 Cb 0.38 -0.40 0.03 0.00 -1.47 0.00 0.00 33.84 32.38 2flb n VAL 64 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2flb h LYS 65 N 0.19 1.01 -1.88 7.34 1.57 -1.62 -3.39 116.57 119.79 2flb h LYS 65 Ca 0.00 -0.36 -0.28 0.00 -1.87 0.00 0.00 60.65 58.15 2flb h LYS 65 Cb 0.16 -0.07 -0.30 0.00 0.08 0.00 0.00 32.23 32.09 2flb h LYS 65 CO 0.00 1.04 -0.61 0.34 -0.57 0.00 0.00 179.45 179.66 2flb s ASP 66 N -6.64 0.94 0.00 0.86 -1.08 -1.20 -5.02 116.67 104.52 2flb s ASP 66 Ca -0.11 -0.85 0.09 0.00 -0.52 0.00 0.00 52.55 51.17 2flb s ASP 66 Cb 0.13 0.80 0.43 0.00 -1.46 0.00 0.00 42.92 42.82 2flb s ASP 66 CO 0.86 -0.33 1.26 1.33 0.52 0.00 0.00 175.17 178.81 2flb n VAL 67 N 5.00 1.16 1.05 1.11 0.24 -1.20 -1.84 118.33 123.86 2flb n VAL 67 Ca 0.03 0.29 0.11 0.00 -2.04 0.00 0.00 64.34 62.73 2flb n VAL 67 Cb 0.48 -1.13 0.06 0.00 -1.47 0.00 0.00 33.84 31.77 2flb n VAL 67 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2flb n LYS 68 N -1.43 0.89 -1.56 7.34 5.02 -1.26 -0.54 118.16 126.63 2flb n LYS 68 Ca 0.03 -0.70 -0.30 0.00 -2.02 0.00 0.00 58.31 55.32 2flb n LYS 68 Cb 0.10 -1.49 0.10 0.00 -0.02 0.00 0.00 35.03 33.73 2flb n LYS 68 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2flb s GLN 69 N -2.59 1.81 -0.27 1.97 -1.52 -0.77 -4.93 119.66 113.37 2flb s GLN 69 Ca 0.18 0.52 -0.04 0.00 -1.95 0.00 0.00 55.36 54.06 2flb s GLN 69 Cb 0.18 -1.90 0.02 0.00 -0.22 0.00 0.00 33.01 31.09 2flb s GLN 69 CO 0.62 -1.78 0.01 0.99 -0.25 0.00 0.00 175.29 174.87 2flb s THR 70 N -3.21 3.41 0.07 -0.19 2.01 -1.26 -3.99 115.64 112.49 2flb s THR 70 Ca 0.62 -0.86 -0.03 0.00 0.31 0.00 0.00 61.69 61.73 2flb s THR 70 Cb -0.14 -2.75 -0.05 0.00 0.01 0.00 0.00 72.50 69.57 2flb s THR 70 CO 0.54 0.14 0.26 -0.31 -0.69 0.00 0.00 174.62 174.56 2flb s TYR 71 N 1.41 3.52 -0.01 4.92 1.51 0.22 -3.24 117.35 125.68 2flb s TYR 71 Ca 0.01 0.40 0.05 0.00 -1.01 0.00 0.00 57.07 56.53 2flb s TYR 71 Cb -0.17 -1.87 -0.01 0.00 -0.11 0.00 0.00 41.96 39.79 2flb s TYR 71 CO -0.01 0.56 -0.18 -1.17 -1.11 0.00 0.00 175.55 173.64 2flb s LEU 72 N -2.35 2.04 0.18 -1.29 1.98 -0.38 -1.44 118.68 117.42 2flb s LEU 72 Ca 0.34 -0.33 0.09 0.00 -2.89 0.00 0.00 54.13 51.35 2flb s LEU 72 Cb -0.13 -0.91 -0.04 0.00 0.66 0.00 0.00 46.19 45.77 2flb s LEU 72 CO 0.24 0.21 -0.18 0.00 -1.89 0.00 0.00 176.35 174.73 2flb s ALA 73 N -0.43 2.12 0.06 5.97 0.00 -1.26 -1.70 121.76 126.51 2flb s ALA 73 Ca 0.07 -1.56 -0.05 0.00 0.00 0.00 0.00 51.96 50.42 2flb s ALA 73 Cb -0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.84 2flb s ALA 73 CO -0.01 0.23 0.08 -0.98 0.00 0.00 0.00 175.76 175.09 2flb s ARG 74 N -2.98 0.68 -0.10 0.00 1.70 -0.14 -0.18 118.95 117.93 2flb s ARG 74 Ca 0.18 -0.99 0.01 0.00 -0.47 0.00 0.00 55.73 54.47 2flb s ARG 74 Cb -0.05 0.26 0.02 0.00 -0.57 0.00 0.00 34.95 34.61 2flb s ARG 74 CO 0.08 -0.17 -0.13 0.08 -1.08 0.00 0.00 175.30 174.07 2flb s VAL 75 N -3.50 1.33 0.08 4.99 1.01 -0.64 -0.78 120.40 122.89 2flb s VAL 75 Ca 0.03 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.48 2flb s VAL 75 Cb 0.04 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 2flb s VAL 75 CO -0.09 0.41 0.20 -0.36 0.00 0.00 0.00 175.10 175.26 2flb s PHE 76 N 1.10 3.46 -0.12 5.22 0.08 0.11 -1.98 117.98 125.84 2flb s PHE 76 Ca -0.05 0.20 0.03 0.00 0.12 0.00 0.00 56.93 57.23 2flb s PHE 76 Cb -0.14 -1.72 0.00 0.00 -0.57 0.00 0.00 43.02 40.58 2flb s PHE 76 CO -0.02 0.57 -0.21 -1.12 -0.10 0.00 0.00 175.22 174.34 2flb s SER 77 N -2.61 3.28 -0.01 1.36 0.01 -0.79 -2.14 113.70 112.79 2flb s SER 77 Ca 0.34 -0.53 0.04 0.00 1.31 0.00 0.00 55.95 57.11 2flb s SER 77 Cb -0.13 -1.46 -0.01 0.00 0.21 0.00 0.00 66.02 64.63 2flb s SER 77 CO 0.27 0.13 -0.13 -0.31 0.41 0.00 0.00 173.24 173.61 2flb s TYR 78 N 0.55 1.16 -0.23 2.43 2.02 0.12 -3.99 117.35 119.41 2flb s TYR 78 Ca -0.13 -0.22 -0.41 0.00 -0.37 0.00 0.00 57.07 55.94 2flb s TYR 78 Cb -0.17 -0.75 -0.18 0.00 -0.40 0.00 0.00 41.96 40.47 2flb s TYR 78 CO 0.04 -0.02 1.54 -2.30 -1.57 0.00 0.00 175.55 173.24 2flb n PRO 79 N 2.75 0.70 -2.08 -1.71 -0.02 -1.25 -0.92 135.00 132.46 2flb n PRO 79 Ca -0.14 0.25 -0.41 0.00 -2.02 0.00 0.00 63.50 61.18 2flb n PRO 79 Cb 0.56 -1.86 -0.03 0.00 -0.02 0.00 0.00 33.50 32.15 2flb n PRO 79 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2flb s ALA 80 N 2.33 3.59 0.00 3.55 0.00 -0.58 -1.63 121.76 129.02 2flb s ALA 80 Ca 0.96 1.25 0.00 0.00 0.00 0.00 0.00 51.96 54.18 2flb s ALA 80 Cb -1.19 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 18.40 2flb s ALA 80 CO 0.65 -0.67 0.00 0.41 0.00 0.00 0.00 175.76 176.15 2flb n GLY 81 N 2.22 1.91 3.47 0.00 0.00 -1.26 -4.87 105.19 106.65 2flb n GLY 81 Ca 0.06 -0.64 -0.44 0.00 0.00 0.00 0.00 46.02 45.00 2flb n GLY 81 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2flb s ASN 82 N -0.41 7.07 0.00 1.61 2.47 -0.65 -4.71 114.94 120.32 2flb s ASN 82 Ca 0.00 -2.98 0.19 0.00 0.42 0.00 0.00 52.86 50.48 2flb s ASN 82 Cb 0.00 -2.41 1.09 0.00 -1.45 0.00 0.00 41.25 38.48 2flb s ASN 82 CO 0.00 -0.76 1.51 0.52 -3.72 0.00 0.00 177.10 174.65 2flb n VAL 83 N 4.69 0.05 -1.07 -5.21 0.31 -1.22 -2.01 118.33 113.87 2flb n VAL 83 Ca 0.37 0.01 0.03 0.00 -0.01 0.00 0.00 64.34 64.75 2flb n VAL 83 Cb 0.43 -0.72 0.28 0.00 -0.91 0.00 0.00 33.84 32.92 2flb n VAL 83 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2flb n GLU 84 N -1.03 3.19 -2.41 5.55 -0.58 -1.26 -5.01 120.64 119.08 2flb n GLU 84 Ca 0.13 -3.00 -0.36 0.00 -0.42 0.00 0.00 57.16 53.51 2flb n GLU 84 Cb 0.07 -1.98 -0.02 0.00 -0.57 0.00 0.00 31.44 28.93 2flb n GLU 84 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2flb s SER 85 N -1.68 6.42 -0.09 1.62 0.01 -0.85 -5.04 113.70 114.09 2flb s SER 85 Ca 0.47 2.14 -0.08 0.00 1.31 0.00 0.00 55.95 59.79 2flb s SER 85 Cb 0.39 -2.59 0.02 0.00 0.21 0.00 0.00 66.02 64.05 2flb s SER 85 CO 0.09 -0.73 0.24 -0.89 0.41 0.00 0.00 173.24 172.36 2flb s THR 86 N -1.65 0.00 0.77 1.44 2.01 -1.26 -4.00 115.64 112.95 2flb s THR 86 Ca 0.62 -0.02 -0.05 0.00 0.31 0.00 0.00 61.69 62.55 2flb s THR 86 Cb -0.24 -0.34 0.16 0.00 0.01 0.00 0.00 72.50 72.09 2flb s THR 86 CO 0.30 -0.01 1.06 0.61 -0.69 0.00 0.00 174.62 175.88 2flb n GLY 87 N 2.90 -0.04 0.56 4.40 0.00 0.12 -4.84 105.19 108.28 2flb n GLY 87 Ca -0.13 -1.92 0.32 0.00 0.00 0.00 0.00 46.02 44.28 2flb n GLY 87 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2flb n SER 88 N -3.20 0.00 -0.70 1.61 7.64 -1.26 0.33 113.62 118.03 2flb n SER 88 Ca 0.16 0.79 0.07 0.00 1.01 0.00 0.00 58.87 60.90 2flb n SER 88 Cb 0.56 -0.29 0.21 0.00 -1.01 0.00 0.00 64.21 63.68 2flb n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2flb n ALA 89 N -2.34 2.45 -1.84 -0.43 0.00 -1.26 -4.89 120.51 112.19 2flb n ALA 89 Ca 0.26 -0.66 -0.21 0.00 0.00 0.00 0.00 53.44 52.83 2flb n ALA 89 Cb 1.61 -0.99 -0.07 0.00 0.00 0.00 0.00 19.45 20.01 2flb n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2flb n GLY 90 N 1.13 1.23 3.29 0.00 0.00 0.15 -4.97 105.19 106.03 2flb n GLY 90 Ca 0.14 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.91 2flb n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2flb s GLU 91 N -4.15 1.14 0.47 1.61 2.02 -1.24 -4.84 118.70 113.71 2flb s GLU 91 Ca 0.00 -1.20 -0.23 0.00 0.02 0.00 0.00 54.97 53.57 2flb s GLU 91 Cb 0.00 -1.35 -0.07 0.00 0.10 0.00 0.00 34.13 32.81 2flb s GLU 91 CO 0.00 0.31 1.19 -1.25 0.02 0.00 0.00 175.26 175.53 2flb s PRO 92 N -2.06 3.68 0.38 0.39 0.04 -1.26 -0.70 135.00 135.48 2flb s PRO 92 Ca 0.08 1.83 -0.28 0.00 0.04 0.00 0.00 61.00 62.67 2flb s PRO 92 Cb -0.09 -2.39 -0.10 0.00 0.04 0.00 0.00 34.50 31.96 2flb s PRO 92 CO 0.05 -0.63 1.42 -1.17 0.04 0.00 0.00 177.00 176.71 2flb s LEU 93 N -3.08 4.31 0.35 -3.56 2.96 -1.26 -4.87 118.68 113.53 2flb s LEU 93 Ca 0.64 2.92 -0.04 0.00 -0.22 0.00 0.00 54.13 57.43 2flb s LEU 93 Cb -0.30 -3.72 0.01 0.00 0.50 0.00 0.00 46.19 42.68 2flb s LEU 93 CO 0.36 -0.84 0.52 -0.72 -1.32 0.00 0.00 176.35 174.36 2flb s TYR 94 N -1.15 0.95 -0.08 5.38 1.13 -1.26 -1.89 117.35 120.42 2flb s TYR 94 Ca 0.53 -1.23 -0.15 0.00 -1.41 0.00 0.00 57.07 54.81 2flb s TYR 94 Cb -0.44 0.04 0.03 0.00 -1.10 0.00 0.00 41.96 40.50 2flb s TYR 94 CO 0.59 -1.20 0.36 -2.00 -2.51 0.00 0.00 175.55 170.79 2flb s GLU 95 N -2.93 0.57 0.31 -3.49 2.56 -0.84 -4.86 118.70 110.03 2flb s GLU 95 Ca 0.28 0.19 -0.06 0.00 0.00 0.00 0.00 54.97 55.38 2flb s GLU 95 Cb -0.01 0.26 -0.05 0.00 2.00 0.00 0.00 34.13 36.33 2flb s GLU 95 CO 0.19 -0.12 0.60 -0.80 -0.56 0.00 0.00 175.26 174.57 2flb s ASN 96 N -0.55 6.47 0.80 -1.70 0.01 -1.26 -1.61 114.94 117.09 2flb s ASN 96 Ca -0.07 0.81 -0.07 0.00 -0.71 0.00 0.00 52.86 52.83 2flb s ASN 96 Cb -0.04 -2.19 0.14 0.00 0.41 0.00 0.00 41.25 39.58 2flb s ASN 96 CO 0.03 -0.24 1.11 -0.94 -1.51 0.00 0.00 177.10 175.54 2flb s SER 97 N -3.14 4.02 0.79 -1.22 1.04 0.75 -4.81 113.70 111.12 2flb s SER 97 Ca 0.46 -0.00 -0.14 0.00 0.48 0.00 0.00 55.95 56.74 2flb s SER 97 Cb -0.11 -0.32 0.06 0.00 0.10 0.00 0.00 66.02 65.76 2flb s SER 97 CO 0.30 -2.10 1.15 -2.65 0.98 0.00 0.00 173.24 170.91 2flb n PRO 98 N -3.16 0.30 -2.25 4.02 -0.02 -1.26 -4.76 135.00 127.87 2flb n PRO 98 Ca 0.14 0.17 -0.33 0.00 -2.02 0.00 0.00 63.50 61.46 2flb n PRO 98 Cb 0.60 -2.39 -0.01 0.00 -0.02 0.00 0.00 33.50 31.68 2flb n PRO 98 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2flb s GLU 99 N -3.90 3.49 -0.12 -0.52 2.02 -1.26 -4.52 118.70 113.89 2flb s GLU 99 Ca 0.74 1.31 -0.05 0.00 0.02 0.00 0.00 54.97 56.99 2flb s GLU 99 Cb -0.31 -2.05 0.06 0.00 0.10 0.00 0.00 34.13 31.93 2flb s GLU 99 CO 0.50 -0.68 0.25 0.12 0.02 0.00 0.00 175.26 175.47 2flb s PHE 100 N -2.20 -0.37 -0.37 1.61 5.36 -0.52 -4.95 117.98 116.53 2flb s PHE 100 Ca 0.66 0.87 -0.03 0.00 -0.96 0.00 0.00 56.93 57.48 2flb s PHE 100 Cb -0.17 -0.03 0.09 0.00 -0.34 0.00 0.00 43.02 42.57 2flb s PHE 100 CO 0.30 -0.30 0.14 0.99 -1.46 0.00 0.00 175.22 174.88 2flb s THR 101 N 2.00 3.20 0.20 0.12 2.01 -1.26 -0.61 115.64 121.31 2flb s THR 101 Ca -0.02 -1.84 -0.15 0.00 0.31 0.00 0.00 61.69 59.98 2flb s THR 101 Cb -0.11 -3.09 0.20 0.00 0.01 0.00 0.00 72.50 69.51 2flb s THR 101 CO -0.08 -0.51 1.62 -0.65 -0.69 0.00 0.00 174.62 174.31 2flb h PRO 102 N 8.03 -0.04 -0.41 4.92 0.11 -1.67 -1.33 132.00 141.61 2flb h PRO 102 Ca -0.15 0.00 0.07 0.00 0.11 0.00 0.00 66.00 66.03 2flb h PRO 102 Cb 1.05 0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 2flb h PRO 102 CO 0.64 -0.03 0.28 -0.92 -0.21 0.00 0.00 178.00 177.77 2flb h TYR 103 N -0.04 0.27 0.00 0.65 3.20 -1.14 -0.31 116.97 119.60 2flb h TYR 103 Ca 0.28 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.15 2flb h TYR 103 Cb 0.47 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.65 2flb h TYR 103 CO -0.52 0.14 -1.70 1.28 -1.64 0.00 0.00 178.16 175.72 2flb n LEU 104 N -4.47 0.20 -0.00 2.82 4.77 -0.87 -4.68 117.00 114.77 2flb n LEU 104 Ca 0.06 -0.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 2flb n LEU 104 Cb 0.29 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.38 2flb n LEU 104 CO 0.35 0.05 -0.08 -0.62 -1.33 0.00 0.00 177.39 175.76 2flb n GLU 105 N -2.04 5.79 -2.38 3.23 1.02 -0.56 -4.54 120.64 121.17 2flb n GLU 105 Ca -0.02 -0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.71 2flb n GLU 105 Cb 0.48 -0.60 -0.04 0.00 -0.02 0.00 0.00 31.44 31.26 2flb n GLU 105 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2flb s THR 106 N -1.21 3.53 0.14 2.62 -1.32 -0.16 -4.91 115.64 114.33 2flb s THR 106 Ca 0.00 1.33 -0.31 0.00 -1.21 0.00 0.00 61.69 61.51 2flb s THR 106 Cb 0.01 -3.85 -0.08 0.00 -1.51 0.00 0.00 72.50 67.06 2flb s THR 106 CO 0.03 0.23 1.38 0.20 -2.21 0.00 0.00 174.62 174.25 2flb s ASN 107 N -0.05 6.82 0.50 8.08 0.01 -0.26 -4.80 114.94 125.24 2flb s ASN 107 Ca 0.51 2.36 -0.20 0.00 -0.71 0.00 0.00 52.86 54.83 2flb s ASN 107 Cb -0.33 -2.59 -0.08 0.00 0.41 0.00 0.00 41.25 38.66 2flb s ASN 107 CO 0.38 -0.64 1.05 -0.76 -1.51 0.00 0.00 177.10 175.62 2flb s LEU 108 N 0.81 3.81 0.00 0.60 1.43 -1.26 -0.15 118.68 123.93 2flb s LEU 108 Ca 0.63 1.94 0.00 0.00 -1.03 0.00 0.00 54.13 55.67 2flb s LEU 108 Cb -0.37 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.29 2flb s LEU 108 CO 0.32 -0.84 0.00 0.61 0.23 0.00 0.00 176.35 176.67 2flb n GLY 109 N -0.26 0.52 6.21 -3.19 0.00 -1.26 -4.51 105.19 102.69 2flb n GLY 109 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2flb n GLY 109 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2flb n ASP 129 N -1.31 0.00 -4.67 1.61 5.68 -1.26 -3.89 116.55 112.70 2flb n ASP 129 Ca 0.00 0.00 -0.42 0.00 -0.50 0.00 0.00 54.79 53.87 2flb n ASP 129 Cb 0.00 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 39.95 2flb n ASP 129 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 2flb s GLU 130 N 0.00 4.15 0.41 0.11 2.02 -1.26 -4.80 118.70 119.32 2flb s GLU 130 Ca 0.00 2.56 -0.25 0.00 0.02 0.00 0.00 54.97 57.30 2flb s GLU 130 Cb 0.00 -3.88 -0.08 0.00 0.10 0.00 0.00 34.13 30.27 2flb s GLU 130 CO 0.00 -0.89 1.15 -0.98 0.02 0.00 0.00 175.26 174.56 2flb s ARG 131 N 3.61 4.02 0.34 1.61 1.70 -1.26 -0.51 118.95 128.45 2flb s ARG 131 Ca 0.83 1.77 0.04 0.00 -0.47 0.00 0.00 55.73 57.91 2flb s ARG 131 Cb -0.43 -2.60 0.04 0.00 -0.57 0.00 0.00 34.95 31.39 2flb s ARG 131 CO 0.38 -0.33 0.37 0.25 -1.08 0.00 0.00 175.30 174.89 2flb n THR 132 N -0.05 0.00 1.53 4.99 -2.24 0.69 -4.78 114.28 114.43 2flb n THR 132 Ca 0.05 -1.21 0.14 0.00 -2.27 0.00 0.00 64.05 60.76 2flb n THR 132 Cb 0.47 -0.49 0.65 0.00 -2.10 0.00 0.00 70.33 68.86 2flb n THR 132 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2flb n LEU 133 N 0.00 0.62 -4.65 3.22 7.99 -0.44 -4.41 117.00 119.33 2flb n LEU 133 Ca 0.05 -0.12 -0.43 0.00 -0.01 0.00 0.00 56.01 55.50 2flb n LEU 133 Cb 0.36 -0.10 -0.02 0.00 -0.11 0.00 0.00 43.42 43.55 2flb n LEU 133 CO 0.22 0.11 1.15 -0.69 -1.51 0.00 0.00 177.39 176.67 2flb s VAL 134 N -2.28 4.13 0.00 4.08 1.01 -1.26 -4.92 120.40 121.17 2flb s VAL 134 Ca 0.34 1.34 -0.00 0.00 0.00 0.00 0.00 61.98 63.66 2flb s VAL 134 Cb 0.21 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 2flb s VAL 134 CO 0.43 -0.24 0.08 -0.13 0.00 0.00 0.00 175.10 175.24 2flb s ARG 135 N 3.84 3.06 -0.10 2.72 0.52 -1.26 -0.21 118.95 127.51 2flb s ARG 135 Ca 0.58 -0.50 0.02 0.00 -0.52 0.00 0.00 55.73 55.31 2flb s ARG 135 Cb -0.22 -2.85 0.01 0.00 0.52 0.00 0.00 34.95 32.42 2flb s ARG 135 CO 0.19 0.64 -0.16 0.50 0.02 0.00 0.00 175.30 176.50 2flb s ARG 136 N -1.81 2.23 -1.42 3.54 3.52 0.05 -4.74 118.95 120.33 2flb s ARG 136 Ca 0.24 -0.57 -0.10 0.00 -0.13 0.00 0.00 55.73 55.17 2flb s ARG 136 Cb -0.12 -1.87 0.04 0.00 -1.56 0.00 0.00 34.95 31.44 2flb s ARG 136 CO 0.15 -0.04 1.06 -1.71 -0.81 0.00 0.00 175.30 173.95 2flb n ASN 137 N 4.11 -5.12 0.00 -2.12 5.15 -1.26 -2.25 115.26 113.77 2flb n ASN 137 Ca -0.19 -0.66 0.00 0.00 -0.60 0.00 0.00 54.58 53.12 2flb n ASN 137 Cb 0.51 -4.50 0.00 0.00 -0.53 0.00 0.00 39.78 35.27 2flb n ASN 137 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2flb n ASN 138 N -2.95 0.00 -4.80 1.20 3.02 -1.26 -4.96 115.26 105.50 2flb n ASN 138 Ca -0.02 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.20 2flb n ASN 138 Cb 0.56 -0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 39.45 2flb n ASN 138 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2flb s THR 139 N -0.17 3.80 0.28 3.41 -1.32 -0.96 -4.92 115.64 115.77 2flb s THR 139 Ca 0.00 1.05 -0.18 0.00 -1.21 0.00 0.00 61.69 61.35 2flb s THR 139 Cb 0.00 -3.44 -0.09 0.00 -1.51 0.00 0.00 72.50 67.46 2flb s THR 139 CO 0.00 -0.31 0.75 -0.36 -2.21 0.00 0.00 174.62 172.48 2flb s PHE 140 N -2.11 3.52 0.01 9.09 0.08 -1.26 -0.77 117.98 126.54 2flb s PHE 140 Ca 0.66 1.34 -0.02 0.00 0.12 0.00 0.00 56.93 59.03 2flb s PHE 140 Cb -0.16 -2.61 -0.04 0.00 -0.57 0.00 0.00 43.02 39.64 2flb s PHE 140 CO 0.24 0.21 0.19 -0.51 -0.10 0.00 0.00 175.22 175.25 2flb s LEU 141 N -2.45 4.37 0.41 -0.37 1.43 0.71 -4.85 118.68 117.92 2flb s LEU 141 Ca 0.49 0.33 0.05 0.00 -1.03 0.00 0.00 54.13 53.97 2flb s LEU 141 Cb -0.14 -2.69 0.00 0.00 0.03 0.00 0.00 46.19 43.39 2flb s LEU 141 CO 0.19 0.24 0.58 -0.94 0.23 0.00 0.00 176.35 176.65 2flb s SER 142 N -2.06 5.78 0.22 2.29 1.04 -1.26 -0.22 113.70 119.48 2flb s SER 142 Ca 0.29 -0.09 -0.10 0.00 0.48 0.00 0.00 55.95 56.53 2flb s SER 142 Cb -0.13 -1.14 0.31 0.00 0.10 0.00 0.00 66.02 65.16 2flb s SER 142 CO 0.21 -0.66 1.29 0.18 0.98 0.00 0.00 173.24 175.24 2flb n LEU 143 N -1.89 -0.40 0.12 2.42 4.32 0.33 0.04 117.00 121.94 2flb n LEU 143 Ca 0.03 1.43 -0.01 0.00 -0.02 0.00 0.00 56.01 57.45 2flb n LEU 143 Cb 0.58 -0.39 0.27 0.00 -1.62 0.00 0.00 43.42 42.26 2flb n LEU 143 CO 0.43 -1.34 0.68 -0.09 -1.22 0.00 0.00 177.39 175.86 2flb h ARG 144 N 0.00 0.18 -0.16 3.23 9.65 -1.90 0.24 114.38 125.62 2flb h ARG 144 Ca 0.35 -0.08 -0.12 0.00 -1.10 0.00 0.00 59.98 59.03 2flb h ARG 144 Cb 0.56 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.12 2flb h ARG 144 CO -0.84 0.54 -0.43 -0.44 2.80 0.00 0.00 179.97 181.60 2flb h ASP 145 N 0.16 0.40 0.64 -3.80 5.19 -0.75 0.28 116.42 118.53 2flb h ASP 145 Ca 0.02 -0.18 -0.27 0.00 -0.62 0.00 0.00 57.03 55.98 2flb h ASP 145 Cb 0.74 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 40.11 2flb h ASP 145 CO 0.06 0.78 -1.45 0.58 -3.12 0.00 0.00 179.24 176.08 2flb h VAL 146 N 0.31 1.18 -0.01 -1.35 2.07 -0.33 -3.38 116.25 114.74 2flb h VAL 146 Ca 0.02 -2.94 0.00 0.00 0.82 0.00 0.00 66.70 64.60 2flb h VAL 146 Cb 0.89 2.63 0.00 0.00 -1.52 0.00 0.00 31.29 33.28 2flb h VAL 146 CO 0.07 0.72 -0.12 0.49 0.02 0.00 0.00 177.57 178.76 2flb n PHE 147 N -3.24 0.00 -2.15 1.57 3.72 0.74 -5.10 117.46 113.00 2flb n PHE 147 Ca -0.12 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.43 2flb n PHE 147 Cb 1.01 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.52 2flb n PHE 147 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2flb n GLY 148 N 0.90 -1.72 2.62 1.37 0.00 0.99 -3.46 105.19 105.89 2flb n GLY 148 Ca 0.07 -1.13 -0.34 0.00 0.00 0.00 0.00 46.02 44.61 2flb n GLY 148 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2flb n LYS 149 N -3.70 2.62 0.00 1.61 0.00 -1.26 -1.03 118.16 116.40 2flb n LYS 149 Ca 0.01 -1.95 0.00 0.00 0.00 0.00 0.00 58.31 56.36 2flb n LYS 149 Cb 0.51 -2.79 0.00 0.00 0.00 0.00 0.00 35.03 32.75 2flb n LYS 149 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2flb n ASP 150 N 4.92 0.00 -4.81 3.14 8.00 -1.25 -5.10 116.55 121.45 2flb n ASP 150 Ca 0.57 0.00 -0.39 0.00 0.71 0.00 0.00 54.79 55.69 2flb n ASP 150 Cb 0.25 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.29 2flb n ASP 150 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2flb s LEU 151 N 0.00 4.53 0.09 0.64 2.96 -0.20 -4.86 118.68 121.84 2flb s LEU 151 Ca 0.00 1.28 0.04 0.00 -0.22 0.00 0.00 54.13 55.23 2flb s LEU 151 Cb 0.00 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.73 2flb s LEU 151 CO 0.00 0.27 -0.11 0.27 -1.32 0.00 0.00 176.35 175.45 2flb s ILE 152 N -1.12 1.00 -0.09 6.68 -4.36 -1.12 -5.04 121.20 117.15 2flb s ILE 152 Ca 0.30 -1.51 0.05 0.00 -0.26 0.00 0.00 60.65 59.22 2flb s ILE 152 Cb -0.20 -1.23 -0.00 0.00 1.25 0.00 0.00 42.46 42.28 2flb s ILE 152 CO 0.19 -0.43 -0.24 -0.31 0.24 0.00 0.00 174.94 174.39 2flb s TYR 153 N -1.99 2.47 0.21 1.37 2.02 -1.26 -0.52 117.35 119.65 2flb s TYR 153 Ca 0.02 -0.93 -0.30 0.00 -0.37 0.00 0.00 57.07 55.50 2flb s TYR 153 Cb -0.06 -1.64 -0.08 0.00 -0.40 0.00 0.00 41.96 39.78 2flb s TYR 153 CO 0.01 -0.35 1.12 0.99 -1.57 0.00 0.00 175.55 175.74 2flb s THR 154 N 0.20 3.69 -0.15 -0.71 2.01 0.11 -4.88 115.64 115.91 2flb s THR 154 Ca -0.14 1.53 0.00 0.00 0.31 0.00 0.00 61.69 63.39 2flb s THR 154 Cb -0.17 -3.97 -0.10 0.00 0.01 0.00 0.00 72.50 68.27 2flb s THR 154 CO 0.07 0.29 -0.14 -0.11 -0.69 0.00 0.00 174.62 174.05 2flb n LEU 155 N 2.01 2.82 0.00 4.42 7.94 -1.25 -2.41 117.00 130.52 2flb n LEU 155 Ca 0.02 -0.06 0.00 0.00 -1.11 0.00 0.00 56.01 54.86 2flb n LEU 155 Cb 0.45 -0.52 0.00 0.00 0.53 0.00 0.00 43.42 43.88 2flb n LEU 155 CO 0.54 0.72 0.00 0.00 -1.11 0.00 0.00 177.39 177.54 2flb n TYR 156 N -3.01 0.00 -0.71 1.96 -0.00 -1.26 0.53 117.16 114.67 2flb n TYR 156 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.63 2flb n TYR 156 Cb 0.78 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 40.12 2flb n TYR 156 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.86 177.52 2flb n TYR 157 N 0.00 0.00 -0.15 2.98 4.02 -1.26 -5.24 117.16 117.51 2flb n TYR 157 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2flb n TYR 157 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 2flb n TYR 157 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 2flb n SER 188 N -0.02 0.00 -4.87 7.72 7.64 0.19 -5.07 113.62 119.21 2flb n SER 188 Ca 0.00 0.10 -0.33 0.00 1.01 0.00 0.00 58.87 59.65 2flb n SER 188 Cb 0.18 -0.15 -0.05 0.00 -1.01 0.00 0.00 64.21 63.17 2flb n SER 188 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2flb s VAL 189 N -0.04 4.91 -0.05 0.44 -7.23 -0.28 -3.94 120.40 114.21 2flb s VAL 189 Ca 0.00 0.56 -0.02 0.00 -1.81 0.00 0.00 61.98 60.71 2flb s VAL 189 Cb 0.00 -3.64 0.03 0.00 0.56 0.00 0.00 36.38 33.34 2flb s VAL 189 CO 0.00 -0.02 0.10 -1.58 -0.31 0.00 0.00 175.10 173.29 2flb s GLN 190 N -2.67 0.05 0.18 4.82 0.74 -1.01 -0.87 119.66 120.90 2flb s GLN 190 Ca 0.46 0.28 -0.26 0.00 0.05 0.00 0.00 55.36 55.89 2flb s GLN 190 Cb -0.12 -0.17 -0.08 0.00 1.10 0.00 0.00 33.01 33.74 2flb s GLN 190 CO 0.21 -0.15 0.82 0.00 -0.55 0.00 0.00 175.29 175.62 2flb s ALA 191 N 1.00 3.42 0.02 1.58 0.00 -1.26 0.04 121.76 126.56 2flb s ALA 191 Ca -0.08 0.43 0.02 0.00 0.00 0.00 0.00 51.96 52.32 2flb s ALA 191 Cb -0.11 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 19.98 2flb s ALA 191 CO -0.04 0.27 -0.06 0.14 0.00 0.00 0.00 175.76 176.07 2flb s VAL 192 N -1.15 0.41 -0.51 0.00 -7.23 0.32 -0.39 120.40 111.86 2flb s VAL 192 Ca 0.37 -0.60 0.04 0.00 -1.81 0.00 0.00 61.98 59.98 2flb s VAL 192 Cb -0.24 -0.42 0.13 0.00 0.56 0.00 0.00 36.38 36.41 2flb s VAL 192 CO 0.28 -0.13 0.26 -0.63 -0.31 0.00 0.00 175.10 174.56 2flb s ILE 193 N -0.71 2.35 -0.89 -0.62 -1.09 0.35 -2.78 121.20 117.80 2flb s ILE 193 Ca -0.04 -3.18 0.14 0.00 -2.23 0.00 0.00 60.65 55.34 2flb s ILE 193 Cb -0.06 -2.63 0.13 0.00 -1.58 0.00 0.00 42.46 38.32 2flb s ILE 193 CO 0.00 -0.82 1.45 -0.81 -1.23 0.00 0.00 174.94 173.53 2flb n PRO 194 N 3.17 0.04 0.00 2.79 -0.04 -1.26 -1.82 135.00 137.88 2flb n PRO 194 Ca 0.06 0.32 0.14 0.00 -0.04 0.00 0.00 63.50 63.98 2flb n PRO 194 Cb 0.33 -1.57 0.60 0.00 -0.04 0.00 0.00 33.50 32.81 2flb n PRO 194 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2flb n SER 195 N -1.64 0.39 -4.81 3.54 3.41 -1.26 -4.91 113.62 108.34 2flb n SER 195 Ca 0.03 -0.42 -0.34 0.00 -0.26 0.00 0.00 58.87 57.88 2flb n SER 195 Cb 0.15 -0.10 -0.05 0.00 -0.26 0.00 0.00 64.21 63.94 2flb n SER 195 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2flb s ARG 196 N -2.56 4.07 -0.11 4.33 0.52 -0.75 -4.95 118.95 119.49 2flb s ARG 196 Ca 0.26 1.24 -0.11 0.00 -0.52 0.00 0.00 55.73 56.60 2flb s ARG 196 Cb 0.20 -2.19 -0.26 0.00 0.52 0.00 0.00 34.95 33.22 2flb s ARG 196 CO 0.49 -0.18 0.44 1.79 0.02 0.00 0.00 175.30 177.87 2flb h THR 197 N 1.82 0.79 -2.12 0.02 1.35 -1.89 -3.46 112.91 109.42 2flb h THR 197 Ca -0.49 -2.37 -0.59 0.00 -0.55 0.00 0.00 66.41 62.41 2flb h THR 197 Cb 1.20 2.56 -0.12 0.00 -1.73 0.00 0.00 68.15 70.06 2flb h THR 197 CO 0.60 0.79 -0.69 0.68 -0.25 0.00 0.00 175.52 176.66 2flb s VAL 198 N -2.53 2.77 0.00 6.82 -7.23 -1.26 -4.90 120.40 114.07 2flb s VAL 198 Ca -0.21 -2.15 0.00 0.00 -1.81 0.00 0.00 61.98 57.80 2flb s VAL 198 Cb 0.06 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.40 2flb s VAL 198 CO 0.77 -0.33 0.00 0.59 -0.31 0.00 0.00 175.10 175.81 2flb n ASN 199 N -0.79 0.00 0.00 4.85 4.13 -1.26 -4.84 115.26 117.35 2flb n ASN 199 Ca -0.05 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.21 2flb n ASN 199 Cb 0.61 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.85 2flb n ASN 199 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2flb n ARG 200 N 0.00 0.00 -4.27 3.52 1.74 -1.26 -4.75 116.66 111.64 2flb n ARG 200 Ca 0.00 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.76 2flb n ARG 200 Cb 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.35 2flb n ARG 200 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2flb s LYS 201 N 0.00 2.77 0.00 5.56 1.02 -1.26 -0.50 119.74 127.33 2flb s LYS 201 Ca 0.00 -0.63 0.00 0.00 0.02 0.00 0.00 55.97 55.36 2flb s LYS 201 Cb 0.00 -2.66 0.00 0.00 -0.52 0.00 0.00 37.83 34.65 2flb s LYS 201 CO 0.00 0.62 0.00 -1.13 -0.92 0.00 0.00 175.35 173.92 2flb n SER 202 N 1.33 0.00 -4.13 2.83 3.41 0.47 -4.82 113.62 112.72 2flb n SER 202 Ca -0.14 -0.19 -0.26 0.00 -0.26 0.00 0.00 58.87 58.01 2flb n SER 202 Cb 0.53 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.64 2flb n SER 202 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2flb n THR 203 N -0.33 0.00 -4.04 6.66 5.66 -1.25 -4.83 114.28 116.14 2flb n THR 203 Ca 0.00 -1.20 -0.27 0.00 -3.05 0.00 0.00 64.05 59.53 2flb n THR 203 Cb 0.00 -1.26 -0.05 0.00 -1.55 0.00 0.00 70.33 67.47 2flb n THR 203 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2flb s ASP 204 N -5.45 5.73 0.00 1.09 1.11 -1.26 -4.51 116.67 113.37 2flb s ASP 204 Ca 0.70 -0.04 0.00 0.00 0.18 0.00 0.00 52.55 53.39 2flb s ASP 204 Cb -0.03 -1.56 0.00 0.00 1.07 0.00 0.00 42.92 42.40 2flb s ASP 204 CO 0.48 0.08 0.00 -1.20 1.18 0.00 0.00 175.17 175.71