#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rhf n ALA 8 N 0.00 3.31 -1.76 4.61 0.00 -1.26 -5.11 120.51 120.30 1rhf n ALA 8 Ca 0.00 -4.14 -0.37 0.00 0.00 0.00 0.00 53.44 48.93 1rhf n ALA 8 Cb 0.00 -0.93 0.02 0.00 0.00 0.00 0.00 19.45 18.54 1rhf n ALA 8 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1rhf s PRO 9 N -1.21 3.32 0.12 0.00 0.04 -1.26 -4.80 135.00 131.20 1rhf s PRO 9 Ca 0.30 1.91 -0.23 0.00 0.04 0.00 0.00 61.00 63.02 1rhf s PRO 9 Cb 0.02 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 32.29 1rhf s PRO 9 CO -0.15 -0.95 0.68 0.54 0.04 0.00 0.00 177.00 177.16 1rhf s VAL 10 N -1.50 4.55 -0.24 -0.36 0.11 -0.50 -4.92 120.40 117.54 1rhf s VAL 10 Ca 0.71 1.49 -0.05 0.00 -2.93 0.00 0.00 61.98 61.20 1rhf s VAL 10 Cb -0.32 -4.03 -0.01 0.00 -1.53 0.00 0.00 36.38 30.49 1rhf s VAL 10 CO 0.37 0.53 -0.01 -0.54 -3.33 0.00 0.00 175.10 172.12 1rhf s LYS 11 N -1.05 3.33 -0.14 1.54 1.02 -1.26 -0.59 119.74 122.59 1rhf s LYS 11 Ca 0.33 -0.67 -0.00 0.00 0.02 0.00 0.00 55.97 55.65 1rhf s LYS 11 Cb -0.21 -3.12 -0.01 0.00 -0.52 0.00 0.00 37.83 33.97 1rhf s LYS 11 CO 0.23 -0.25 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.10 1rhf s LEU 12 N 1.49 2.65 -0.11 3.17 2.96 -0.06 -4.97 118.68 123.81 1rhf s LEU 12 Ca 0.05 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 1rhf s LEU 12 Cb -0.15 -1.60 -0.00 0.00 0.50 0.00 0.00 46.19 44.94 1rhf s LEU 12 CO -0.01 0.14 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.07 1rhf s THR 13 N 0.49 2.38 0.02 3.68 2.01 -1.26 -0.26 115.64 122.69 1rhf s THR 13 Ca -0.10 -0.90 0.02 0.00 0.31 0.00 0.00 61.69 61.03 1rhf s THR 13 Cb -0.16 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.39 1rhf s THR 13 CO 0.04 0.55 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.75 1rhf s VAL 14 N 0.40 0.58 0.34 3.82 1.01 -0.62 -4.99 120.40 120.95 1rhf s VAL 14 Ca -0.15 -0.71 -0.17 0.00 0.00 0.00 0.00 61.98 60.95 1rhf s VAL 14 Cb -0.17 -0.56 -0.09 0.00 0.00 0.00 0.00 36.38 35.55 1rhf s VAL 14 CO 0.07 -0.11 0.79 -0.44 0.00 0.00 0.00 175.10 175.41 1rhf s SER 15 N -0.90 6.84 0.30 3.32 0.01 -1.26 -0.75 113.70 121.26 1rhf s SER 15 Ca -0.03 1.40 -0.28 0.00 1.31 0.00 0.00 55.95 58.34 1rhf s SER 15 Cb -0.06 -2.42 -0.13 0.00 0.21 0.00 0.00 66.02 63.61 1rhf s SER 15 CO 0.00 -0.23 1.17 0.00 0.41 0.00 0.00 173.24 174.59 1rhf n GLN 16 N -0.36 1.73 -0.30 12.44 6.02 -0.38 -2.32 117.38 134.21 1rhf n GLN 16 Ca 0.04 0.61 0.00 0.00 -0.01 0.00 0.00 57.00 57.64 1rhf n GLN 16 Cb 0.53 -2.10 0.00 0.00 1.02 0.00 0.00 30.24 29.69 1rhf n GLN 16 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rhf n GLY 17 N 1.15 1.27 3.91 1.08 0.00 -0.13 -4.92 105.19 107.55 1rhf n GLY 17 Ca 0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.79 1rhf n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rhf s GLN 18 N -0.41 3.58 0.59 1.61 -1.52 -0.98 -4.40 119.66 118.13 1rhf s GLN 18 Ca 0.00 -0.18 -0.11 0.00 -1.95 0.00 0.00 55.36 53.12 1rhf s GLN 18 Cb 0.00 -2.86 -0.05 0.00 -0.22 0.00 0.00 33.01 29.88 1rhf s GLN 18 CO 0.00 0.46 1.00 -1.25 -0.25 0.00 0.00 175.29 175.26 1rhf s PRO 19 N -2.80 3.64 0.01 2.91 0.04 -1.26 -0.91 135.00 136.63 1rhf s PRO 19 Ca 0.40 0.73 -0.20 0.00 0.04 0.00 0.00 61.00 61.97 1rhf s PRO 19 Cb -0.12 -2.11 0.04 0.00 0.04 0.00 0.00 34.50 32.35 1rhf s PRO 19 CO 0.26 -0.50 0.45 0.54 0.04 0.00 0.00 177.00 177.79 1rhf s VAL 20 N -3.06 0.04 -0.09 -0.36 0.11 -0.53 -4.91 120.40 111.60 1rhf s VAL 20 Ca 0.55 -0.35 0.01 0.00 -2.93 0.00 0.00 61.98 59.26 1rhf s VAL 20 Cb -0.11 -0.87 0.02 0.00 -1.53 0.00 0.00 36.38 33.88 1rhf s VAL 20 CO 0.50 -0.20 -0.12 -0.54 -3.33 0.00 0.00 175.10 171.41 1rhf s LYS 21 N -1.95 1.85 0.10 1.54 1.02 -1.26 -0.41 119.74 120.63 1rhf s LYS 21 Ca -0.08 -0.43 -0.02 0.00 0.02 0.00 0.00 55.97 55.45 1rhf s LYS 21 Cb -0.02 -1.62 -0.05 0.00 -0.52 0.00 0.00 37.83 35.62 1rhf s LYS 21 CO 0.02 -0.07 0.29 -0.51 -0.92 0.00 0.00 175.35 174.16 1rhf s LEU 22 N 1.01 4.31 0.12 3.17 1.43 0.35 -4.92 118.68 124.15 1rhf s LEU 22 Ca -0.07 0.43 0.04 0.00 -1.03 0.00 0.00 54.13 53.49 1rhf s LEU 22 Cb -0.15 -3.13 -0.04 0.00 0.03 0.00 0.00 46.19 42.90 1rhf s LEU 22 CO -0.01 0.11 -0.09 0.54 0.23 0.00 0.00 176.35 177.13 1rhf s ASN 23 N -2.47 1.52 0.09 2.29 2.20 -1.26 -1.08 114.94 116.23 1rhf s ASN 23 Ca 0.38 -0.94 -0.00 0.00 -0.94 0.00 0.00 52.86 51.36 1rhf s ASN 23 Cb -0.13 0.02 -0.04 0.00 -2.00 0.00 0.00 41.25 39.10 1rhf s ASN 23 CO 0.26 -0.34 -0.02 0.00 -2.94 0.00 0.00 177.10 174.07 1rhf s SER 25 N -3.00 2.38 -0.11 0.00 0.01 -1.26 -0.70 113.70 111.01 1rhf s SER 25 Ca 0.14 -0.38 0.01 0.00 1.31 0.00 0.00 55.95 57.02 1rhf s SER 25 Cb 0.07 -0.53 0.02 0.00 0.21 0.00 0.00 66.02 65.79 1rhf s SER 25 CO -0.05 0.20 -0.13 -0.69 0.41 0.00 0.00 173.24 172.98 1rhf s VAL 26 N -0.16 1.39 0.10 3.43 1.01 0.74 -1.69 120.40 125.22 1rhf s VAL 26 Ca -0.00 -0.56 0.06 0.00 0.00 0.00 0.00 61.98 61.48 1rhf s VAL 26 Cb -0.11 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 1rhf s VAL 26 CO 0.01 0.42 -0.16 -1.61 0.00 0.00 0.00 175.10 173.77 1rhf s GLU 27 N 1.19 0.97 0.00 2.72 2.02 -0.36 0.12 118.70 125.35 1rhf s GLU 27 Ca -0.03 -1.11 0.00 0.00 0.02 0.00 0.00 54.97 53.86 1rhf s GLU 27 Cb -0.14 -0.99 0.00 0.00 0.10 0.00 0.00 34.13 33.10 1rhf s GLU 27 CO -0.04 0.21 0.00 0.41 0.02 0.00 0.00 175.26 175.86 1rhf n GLY 28 N 0.97 0.85 0.64 -1.39 0.00 -0.12 -1.08 105.19 105.06 1rhf n GLY 28 Ca -0.19 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.83 1rhf n GLY 28 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rhf n GLU 30 N 0.00 0.01 -3.16 1.61 -0.58 -1.26 -4.87 120.64 112.39 1rhf n GLU 30 Ca 0.00 0.00 -0.21 0.00 -0.42 0.00 0.00 57.16 56.54 1rhf n GLU 30 Cb 0.00 -0.69 -0.04 0.00 -0.57 0.00 0.00 31.44 30.14 1rhf n GLU 30 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1rhf n GLU 31 N -2.85 1.34 -2.47 3.49 2.13 -1.26 -4.73 120.64 116.30 1rhf n GLU 31 Ca -0.01 -3.63 -0.40 0.00 0.66 0.00 0.00 57.16 53.78 1rhf n GLU 31 Cb 0.51 -1.74 -0.04 0.00 0.27 0.00 0.00 31.44 30.43 1rhf n GLU 31 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 1rhf s PRO 32 N -2.42 4.60 -0.56 5.31 0.04 -1.26 -5.00 135.00 135.71 1rhf s PRO 32 Ca 0.41 1.79 -0.19 0.00 0.04 0.00 0.00 61.00 63.05 1rhf s PRO 32 Cb 0.31 -3.14 0.09 0.00 0.04 0.00 0.00 34.50 31.79 1rhf s PRO 32 CO -0.09 0.18 0.67 0.34 0.04 0.00 0.00 177.00 178.14 1rhf s ASP 33 N -0.92 6.19 -0.14 6.66 -1.08 -1.26 -5.05 116.67 121.07 1rhf s ASP 33 Ca 0.45 -1.26 -0.11 0.00 -0.52 0.00 0.00 52.55 51.12 1rhf s ASP 33 Cb -0.31 -2.29 -0.05 0.00 -1.46 0.00 0.00 42.92 38.80 1rhf s ASP 33 CO 0.40 -1.03 0.21 -0.63 0.52 0.00 0.00 175.17 174.65 1rhf s ILE 34 N 2.63 5.37 0.00 4.11 1.01 -1.26 -3.60 121.20 129.46 1rhf s ILE 34 Ca 0.12 0.37 0.07 0.00 0.00 0.00 0.00 60.65 61.22 1rhf s ILE 34 Cb -0.23 -3.53 -0.02 0.00 0.01 0.00 0.00 42.46 38.70 1rhf s ILE 34 CO 0.08 0.49 -0.21 -1.10 0.00 0.00 0.00 174.94 174.20 1rhf s GLN 35 N -0.16 1.64 0.28 2.79 -0.21 -0.17 -4.98 119.66 118.85 1rhf s GLN 35 Ca 0.14 -0.82 -0.27 0.00 0.02 0.00 0.00 55.36 54.44 1rhf s GLN 35 Cb -0.12 -1.64 -0.09 0.00 1.00 0.00 0.00 33.01 32.15 1rhf s GLN 35 CO 0.03 0.44 0.91 -1.58 -2.12 0.00 0.00 175.29 172.98 1rhf s TRP 36 N -0.58 3.80 -0.02 0.91 0.52 -1.26 -0.83 118.94 121.47 1rhf s TRP 36 Ca 0.08 1.78 0.04 0.00 0.02 0.00 0.00 56.10 58.03 1rhf s TRP 36 Cb -0.08 -2.90 -0.01 0.00 -1.15 0.00 0.00 33.47 29.32 1rhf s TRP 36 CO -0.00 0.32 -0.15 0.08 0.02 0.00 0.00 176.95 177.22 1rhf s VAL 37 N -1.44 1.20 -0.16 4.03 1.01 0.77 -0.74 120.40 125.06 1rhf s VAL 37 Ca 0.46 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1rhf s VAL 37 Cb -0.21 -1.01 0.02 0.00 0.00 0.00 0.00 36.38 35.18 1rhf s VAL 37 CO 0.26 0.34 -0.16 -0.75 0.00 0.00 0.00 175.10 174.79 1rhf s LYS 38 N -0.21 2.56 -1.57 2.72 2.20 0.18 -1.48 119.74 124.14 1rhf s LYS 38 Ca 0.03 -0.69 -0.13 0.00 -0.36 0.00 0.00 55.97 54.82 1rhf s LYS 38 Cb -0.07 -2.31 0.10 0.00 -1.51 0.00 0.00 37.83 34.03 1rhf s LYS 38 CO 0.00 -0.24 0.84 -0.25 -0.36 0.00 0.00 175.35 175.34 1rhf n ASP 39 N 4.70 -3.59 0.00 1.43 8.00 -0.04 -1.99 116.55 125.07 1rhf n ASP 39 Ca -0.18 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.42 1rhf n ASP 39 Cb 0.50 -3.39 0.00 0.00 -0.02 0.00 0.00 41.12 38.21 1rhf n ASP 39 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rhf n GLY 40 N -1.61 2.32 3.52 0.44 0.00 -1.26 -5.05 105.19 103.56 1rhf n GLY 40 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1rhf n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rhf s ALA 41 N -2.49 2.99 0.45 4.61 0.00 -0.84 -5.08 121.76 121.40 1rhf s ALA 41 Ca 0.00 -0.84 -0.25 0.00 0.00 0.00 0.00 51.96 50.87 1rhf s ALA 41 Cb 0.00 -1.44 -0.09 0.00 0.00 0.00 0.00 23.12 21.59 1rhf s ALA 41 CO 0.00 0.34 1.27 0.28 0.00 0.00 0.00 175.76 177.65 1rhf n VAL 42 N 3.10 2.78 -3.59 0.00 0.31 -1.26 -0.65 118.33 119.02 1rhf n VAL 42 Ca -0.18 -0.50 -0.37 0.00 -0.01 0.00 0.00 64.34 63.29 1rhf n VAL 42 Cb 0.53 -1.57 -0.09 0.00 -0.91 0.00 0.00 33.84 31.79 1rhf n VAL 42 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1rhf s VAL 43 N -1.23 5.32 -0.19 2.52 1.01 0.08 -4.81 120.40 123.10 1rhf s VAL 43 Ca 0.63 0.33 -0.09 0.00 0.00 0.00 0.00 61.98 62.85 1rhf s VAL 43 Cb -0.49 -3.56 -0.08 0.00 0.00 0.00 0.00 36.38 32.25 1rhf s VAL 43 CO 0.56 0.33 -0.24 1.67 0.00 0.00 0.00 175.10 177.42 1rhf n GLN 44 N 4.28 0.41 0.01 2.72 -0.06 -1.26 -4.71 117.38 118.76 1rhf n GLN 44 Ca -0.13 0.17 0.09 0.00 -2.00 0.00 0.00 57.00 55.14 1rhf n GLN 44 Cb 0.52 -1.19 -0.13 0.00 -4.06 0.00 0.00 30.24 25.38 1rhf n GLN 44 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1rhf n ASN 45 N -3.82 0.19 -4.77 1.69 5.03 -1.26 -4.94 115.26 107.39 1rhf n ASN 45 Ca -0.37 0.07 -0.39 0.00 0.87 0.00 0.00 54.58 54.76 1rhf n ASN 45 Cb 0.77 1.59 -0.02 0.00 -1.02 0.00 0.00 39.78 41.10 1rhf n ASN 45 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1rhf s LEU 46 N -4.78 4.30 -0.38 3.41 1.43 -1.26 -4.90 118.68 116.50 1rhf s LEU 46 Ca -0.07 2.43 -0.38 0.00 -1.03 0.00 0.00 54.13 55.09 1rhf s LEU 46 Cb 0.13 -3.87 -0.14 0.00 0.03 0.00 0.00 46.19 42.34 1rhf s LEU 46 CO 0.88 -0.58 2.14 0.47 0.23 0.00 0.00 176.35 179.49 1rhf n ASP 47 N 0.40 1.80 -4.44 2.29 9.92 -1.26 -4.84 116.55 120.43 1rhf n ASP 47 Ca 0.02 0.54 -0.33 0.00 -0.53 0.00 0.00 54.79 54.49 1rhf n ASP 47 Cb 0.45 -1.16 -0.14 0.00 -0.64 0.00 0.00 41.12 39.63 1rhf n ASP 47 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 1rhf s GLN 48 N 5.94 2.74 -0.01 -1.24 -0.21 -1.26 -1.45 119.66 124.17 1rhf s GLN 48 Ca 1.11 -0.70 0.03 0.00 0.02 0.00 0.00 55.36 55.82 1rhf s GLN 48 Cb -1.04 -2.44 -0.00 0.00 1.00 0.00 0.00 33.01 30.53 1rhf s GLN 48 CO 0.55 0.50 -0.09 -1.17 -2.12 0.00 0.00 175.29 172.96 1rhf s LEU 49 N -0.42 1.95 -0.10 2.90 2.96 -0.31 -4.98 118.68 120.67 1rhf s LEU 49 Ca 0.05 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 1rhf s LEU 49 Cb -0.12 -0.47 0.02 0.00 0.50 0.00 0.00 46.19 46.12 1rhf s LEU 49 CO 0.02 0.09 -0.10 -0.31 -1.32 0.00 0.00 176.35 174.73 1rhf s TYR 50 N -0.09 1.54 -0.01 5.38 1.51 -1.26 -0.42 117.35 124.00 1rhf s TYR 50 Ca 0.02 -0.71 0.01 0.00 -1.01 0.00 0.00 57.07 55.38 1rhf s TYR 50 Cb -0.05 -1.21 0.00 0.00 -0.11 0.00 0.00 41.96 40.60 1rhf s TYR 50 CO -0.00 -0.44 -0.05 0.96 -1.11 0.00 0.00 175.55 174.91 1rhf s ILE 51 N 1.28 0.43 -0.09 2.71 -5.25 -0.72 -5.02 121.20 114.55 1rhf s ILE 51 Ca -0.03 -0.19 -0.26 0.00 -0.99 0.00 0.00 60.65 59.19 1rhf s ILE 51 Cb -0.14 -0.39 -0.03 0.00 2.95 0.00 0.00 42.46 44.85 1rhf s ILE 51 CO -0.04 0.14 0.83 -2.16 -1.79 0.00 0.00 174.94 171.92 1rhf s PRO 52 N 0.16 4.41 -0.17 0.37 0.04 -1.26 -1.34 135.00 137.21 1rhf s PRO 52 Ca -0.02 1.08 -0.14 0.00 0.04 0.00 0.00 61.00 61.97 1rhf s PRO 52 Cb -0.05 -3.50 -0.22 0.00 0.04 0.00 0.00 34.50 30.76 1rhf s PRO 52 CO -0.00 -0.12 0.26 1.33 0.04 0.00 0.00 177.00 178.51 1rhf n VAL 53 N 4.19 1.66 -3.92 -0.36 0.24 -0.36 -4.97 118.33 114.81 1rhf n VAL 53 Ca 0.03 -0.35 -0.06 0.00 -2.04 0.00 0.00 64.34 61.92 1rhf n VAL 53 Cb 0.50 -1.88 -0.02 0.00 -1.47 0.00 0.00 33.84 30.97 1rhf n VAL 53 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1rhf n SER 54 N -3.95 -0.39 -4.72 -1.34 3.41 -1.16 -5.05 113.62 100.43 1rhf n SER 54 Ca -0.33 -1.75 -0.42 0.00 -0.26 0.00 0.00 58.87 56.12 1rhf n SER 54 Cb 0.87 0.78 -0.03 0.00 -0.26 0.00 0.00 64.21 65.57 1rhf n SER 54 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1rhf s GLU 55 N -2.39 4.29 -1.63 4.33 2.56 -1.26 -2.69 118.70 121.91 1rhf s GLU 55 Ca 0.13 2.17 0.00 0.00 0.00 0.00 0.00 54.97 57.27 1rhf s GLU 55 Cb 0.00 -3.20 0.00 0.00 2.00 0.00 0.00 34.13 32.93 1rhf s GLU 55 CO 0.09 -0.46 0.00 1.04 -0.56 0.00 0.00 175.26 175.37 1rhf n GLN 56 N 3.68 -1.75 -3.67 4.30 6.02 -1.26 -4.94 117.38 119.76 1rhf n GLN 56 Ca 0.11 0.92 -0.23 0.00 -0.01 0.00 0.00 57.00 57.79 1rhf n GLN 56 Cb 0.41 -5.48 -0.17 0.00 1.02 0.00 0.00 30.24 26.02 1rhf n GLN 56 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1rhf s HIS 57 N -2.79 0.24 0.19 1.08 3.76 -1.10 -0.95 115.29 115.73 1rhf s HIS 57 Ca 0.00 -0.07 0.11 0.00 -0.15 0.00 0.00 55.06 54.96 1rhf s HIS 57 Cb 0.00 -0.63 -0.04 0.00 1.11 0.00 0.00 32.58 33.02 1rhf s HIS 57 CO 0.00 -0.35 -0.24 -1.58 -0.85 0.00 0.00 174.74 171.73 1rhf s TRP 58 N 2.11 2.28 -0.05 1.40 0.52 0.12 -1.22 118.94 124.10 1rhf s TRP 58 Ca 0.04 -0.36 0.06 0.00 0.02 0.00 0.00 56.10 55.85 1rhf s TRP 58 Cb -0.14 -1.13 -0.01 0.00 -1.15 0.00 0.00 33.47 31.04 1rhf s TRP 58 CO -0.06 0.49 -0.24 0.42 0.02 0.00 0.00 176.95 177.59 1rhf s ILE 59 N -1.68 2.17 0.11 2.03 1.01 -0.45 -0.19 121.20 124.20 1rhf s ILE 59 Ca 0.20 -1.03 0.04 0.00 0.00 0.00 0.00 60.65 59.86 1rhf s ILE 59 Cb -0.08 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 1rhf s ILE 59 CO 0.10 0.57 0.07 -0.83 0.00 0.00 0.00 174.94 174.85 1rhf s GLY 60 N -0.27 1.91 -0.01 6.18 0.00 0.13 -1.75 107.32 113.50 1rhf s GLY 60 Ca -0.00 -1.10 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1rhf s GLY 60 CO 0.03 -1.09 0.00 -0.12 0.00 0.00 0.00 173.10 171.92 1rhf s PHE 61 N -1.47 0.15 -0.05 1.90 5.36 0.44 -1.30 117.98 123.00 1rhf s PHE 61 Ca 0.29 0.03 -0.01 0.00 -0.96 0.00 0.00 56.93 56.28 1rhf s PHE 61 Cb -0.11 -0.21 0.03 0.00 -0.34 0.00 0.00 43.02 42.38 1rhf s PHE 61 CO 0.21 -0.06 0.01 -1.17 -1.46 0.00 0.00 175.22 172.75 1rhf s LEU 62 N 0.56 0.81 -0.15 6.12 2.96 -0.24 -1.17 118.68 127.57 1rhf s LEU 62 Ca -0.05 -0.04 -0.03 0.00 -0.22 0.00 0.00 54.13 53.79 1rhf s LEU 62 Cb -0.08 -0.30 -0.03 0.00 0.50 0.00 0.00 46.19 46.29 1rhf s LEU 62 CO -0.01 -0.15 -0.04 -0.44 -1.32 0.00 0.00 176.35 174.38 1rhf s SER 63 N 1.52 4.75 -0.13 3.68 0.01 -0.53 -0.50 113.70 122.51 1rhf s SER 63 Ca -0.02 -0.14 -0.00 0.00 1.31 0.00 0.00 55.95 57.10 1rhf s SER 63 Cb -0.13 -1.77 -0.01 0.00 0.21 0.00 0.00 66.02 64.32 1rhf s SER 63 CO -0.03 0.17 -0.13 -0.76 0.41 0.00 0.00 173.24 172.90 1rhf s LEU 64 N 0.35 2.67 -0.01 2.44 1.02 0.45 -4.07 118.68 121.53 1rhf s LEU 64 Ca -0.05 -0.35 -0.19 0.00 0.02 0.00 0.00 54.13 53.56 1rhf s LEU 64 Cb -0.14 -1.60 -0.05 0.00 0.02 0.00 0.00 46.19 44.41 1rhf s LEU 64 CO 0.03 0.15 0.54 -0.54 0.02 0.00 0.00 176.35 176.55 1rhf s LYS 65 N 0.44 4.24 -0.27 1.70 1.02 -1.26 -1.45 119.74 124.15 1rhf s LYS 65 Ca -0.10 0.63 -0.24 0.00 0.02 0.00 0.00 55.97 56.28 1rhf s LYS 65 Cb -0.16 -3.32 0.04 0.00 -0.52 0.00 0.00 37.83 33.87 1rhf s LYS 65 CO 0.05 0.43 0.40 -1.13 -0.92 0.00 0.00 175.35 174.18 1rhf n SER 66 N 2.57 -4.78 -4.77 2.83 3.41 -1.19 -4.83 113.62 106.86 1rhf n SER 66 Ca -0.09 -0.01 -0.39 0.00 -0.26 0.00 0.00 58.87 58.13 1rhf n SER 66 Cb 0.51 -1.31 -0.01 0.00 -0.26 0.00 0.00 64.21 63.13 1rhf n SER 66 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1rhf s VAL 67 N -1.10 2.94 0.41 -3.33 -7.23 -0.09 -4.57 120.40 107.43 1rhf s VAL 67 Ca 0.23 0.80 0.04 0.00 -1.81 0.00 0.00 61.98 61.25 1rhf s VAL 67 Cb -0.02 -3.46 -0.05 0.00 0.56 0.00 0.00 36.38 33.41 1rhf s VAL 67 CO 0.53 0.09 0.05 -1.61 -0.31 0.00 0.00 175.10 173.84 1rhf s GLU 68 N -2.29 1.92 0.50 4.82 0.41 -1.26 -0.95 118.70 121.85 1rhf s GLU 68 Ca 0.57 -2.14 0.20 0.00 -0.41 0.00 0.00 54.97 53.19 1rhf s GLU 68 Cb -0.33 -1.16 1.26 0.00 -1.78 0.00 0.00 34.13 32.11 1rhf s GLU 68 CO 0.42 -0.26 2.03 0.00 -0.49 0.00 0.00 175.26 176.96 1rhf h ARG 69 N 1.77 0.12 0.00 1.61 3.08 -1.96 -0.52 114.38 118.48 1rhf h ARG 69 Ca -0.41 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 59.58 1rhf h ARG 69 Cb 1.27 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.28 1rhf h ARG 69 CO 0.71 0.08 -0.26 0.66 -1.07 0.00 0.00 179.97 180.08 1rhf h SER 70 N 0.12 0.00 0.84 7.04 4.64 -1.99 -2.78 113.55 121.41 1rhf h SER 70 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 1rhf h SER 70 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 1rhf h SER 70 CO -0.02 0.26 0.00 0.44 -0.87 0.00 0.00 176.83 176.64 1rhf h ASP 71 N 0.00 0.00 -4.04 4.97 3.45 -1.49 -3.45 116.42 115.87 1rhf h ASP 71 Ca -0.00 0.00 -0.55 0.00 0.43 0.00 0.00 57.03 56.91 1rhf h ASP 71 Cb 0.72 0.00 0.14 0.00 -0.56 0.00 0.00 39.33 39.62 1rhf h ASP 71 CO 0.03 0.00 0.63 0.00 -1.57 0.00 0.00 179.24 178.34 1rhf s ALA 72 N -3.59 2.91 0.00 3.45 0.00 -1.05 -4.92 121.76 118.55 1rhf s ALA 72 Ca 0.02 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.35 1rhf s ALA 72 Cb 0.09 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1rhf s ALA 72 CO 0.48 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 175.29 1rhf n GLY 73 N 0.70 -1.17 3.61 0.00 0.00 -0.51 -5.00 105.19 102.81 1rhf n GLY 73 Ca 0.09 -1.45 -0.38 0.00 0.00 0.00 0.00 46.02 44.28 1rhf n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rhf s ARG 74 N -1.89 3.99 -0.03 1.61 0.52 -1.26 -0.83 118.95 121.06 1rhf s ARG 74 Ca 0.00 -0.25 0.06 0.00 -0.52 0.00 0.00 55.73 55.01 1rhf s ARG 74 Cb 0.00 -3.63 -0.02 0.00 0.52 0.00 0.00 34.95 31.81 1rhf s ARG 74 CO 0.00 -0.14 -0.19 0.71 0.02 0.00 0.00 175.30 175.70 1rhf s TYR 75 N 1.66 2.56 0.25 -0.53 1.51 0.02 -0.86 117.35 121.96 1rhf s TYR 75 Ca 0.08 -0.26 -0.20 0.00 -1.01 0.00 0.00 57.07 55.68 1rhf s TYR 75 Cb -0.15 -1.56 0.02 0.00 -0.11 0.00 0.00 41.96 40.15 1rhf s TYR 75 CO 0.10 0.12 0.65 1.67 -1.11 0.00 0.00 175.55 176.98 1rhf s TRP 76 N -0.72 -0.14 -0.04 2.71 -2.14 -0.55 -0.52 118.94 117.55 1rhf s TRP 76 Ca 0.11 -0.27 -0.01 0.00 2.66 0.00 0.00 56.10 58.59 1rhf s TRP 76 Cb -0.10 0.59 -0.04 0.00 -3.10 0.00 0.00 33.47 30.82 1rhf s TRP 76 CO 0.01 -1.13 0.06 0.00 -2.66 0.00 0.00 176.95 173.23 1rhf s GLN 78 N -1.44 1.46 0.25 0.00 -2.07 -0.01 -4.97 119.66 112.88 1rhf s GLN 78 Ca 0.19 -1.74 0.02 0.00 -1.82 0.00 0.00 55.36 52.01 1rhf s GLN 78 Cb -0.12 -0.90 -0.05 0.00 -1.09 0.00 0.00 33.01 30.85 1rhf s GLN 78 CO 0.10 -0.03 0.08 0.14 -1.32 0.00 0.00 175.29 174.25 1rhf s VAL 79 N -3.21 0.62 0.21 3.63 -7.23 -1.26 -1.00 120.40 112.16 1rhf s VAL 79 Ca 0.29 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.35 1rhf s VAL 79 Cb 0.05 -2.57 -0.07 0.00 0.56 0.00 0.00 36.38 34.35 1rhf s VAL 79 CO 0.11 -0.07 0.56 -1.61 -0.31 0.00 0.00 175.10 173.78 1rhf s GLU 80 N -4.01 3.87 -1.26 4.82 2.02 -1.24 -4.36 118.70 118.55 1rhf s GLU 80 Ca 0.36 0.37 -0.02 0.00 0.02 0.00 0.00 54.97 55.70 1rhf s GLU 80 Cb 0.08 -2.72 -0.01 0.00 0.10 0.00 0.00 34.13 31.58 1rhf s GLU 80 CO 0.12 0.36 0.77 -3.47 0.02 0.00 0.00 175.26 173.06 1rhf n ASP 81 N 0.14 -1.97 -0.30 -0.19 2.03 -1.26 -4.83 116.55 110.17 1rhf n ASP 81 Ca -0.01 -0.80 -0.07 0.00 0.52 0.00 0.00 54.79 54.44 1rhf n ASP 81 Cb 0.52 -4.26 -0.05 0.00 -0.72 0.00 0.00 41.12 36.61 1rhf n ASP 81 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rhf n GLY 82 N -1.49 -1.80 7.00 0.27 0.00 -1.26 -4.89 105.19 103.02 1rhf n GLY 82 Ca -0.27 0.85 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1rhf n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rhf n GLY 83 N -1.21 0.71 1.84 -0.02 0.00 -1.26 -2.91 105.19 102.34 1rhf n GLY 83 Ca 0.03 -0.86 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 1rhf n GLY 83 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1rhf n GLU 84 N 11.53 2.97 -1.62 1.61 -0.58 -1.26 -5.04 120.64 128.25 1rhf n GLU 84 Ca 0.00 -3.07 -0.46 0.00 -0.42 0.00 0.00 57.16 53.21 1rhf n GLU 84 Cb 0.00 -2.12 -0.03 0.00 -0.57 0.00 0.00 31.44 28.72 1rhf n GLU 84 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1rhf n THR 85 N -0.61 1.08 -3.20 2.62 -1.04 -1.15 -4.96 114.28 107.03 1rhf n THR 85 Ca 0.43 -0.27 -0.42 0.00 -2.04 0.00 0.00 64.05 61.76 1rhf n THR 85 Cb 1.37 -1.16 -0.07 0.00 -1.82 0.00 0.00 70.33 68.65 1rhf n THR 85 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1rhf s GLU 86 N -0.58 3.58 -0.07 -2.82 0.41 -0.24 -4.96 118.70 114.02 1rhf s GLU 86 Ca 0.69 -0.15 0.04 0.00 -0.41 0.00 0.00 54.97 55.13 1rhf s GLU 86 Cb -0.74 -3.83 -0.02 0.00 -1.78 0.00 0.00 34.13 27.77 1rhf s GLU 86 CO 0.52 -0.71 -0.18 0.42 -0.49 0.00 0.00 175.26 174.83 1rhf s ILE 87 N 2.50 2.72 0.79 -1.63 1.01 -1.26 -1.23 121.20 124.10 1rhf s ILE 87 Ca 0.20 -0.83 -0.13 0.00 0.00 0.00 0.00 60.65 59.89 1rhf s ILE 87 Cb -0.15 -2.06 0.07 0.00 0.01 0.00 0.00 42.46 40.33 1rhf s ILE 87 CO 0.14 0.57 1.20 -0.94 0.00 0.00 0.00 174.94 175.90 1rhf s SER 88 N -0.29 3.76 0.69 3.58 1.04 -0.68 -4.95 113.70 116.85 1rhf s SER 88 Ca 0.01 2.32 -0.16 0.00 0.48 0.00 0.00 55.95 58.60 1rhf s SER 88 Cb -0.13 -2.58 0.01 0.00 0.10 0.00 0.00 66.02 63.42 1rhf s SER 88 CO 0.03 -2.55 1.23 -1.10 0.98 0.00 0.00 173.24 171.82 1rhf s GLN 89 N -4.15 2.37 0.73 4.02 -1.52 -1.26 -4.80 119.66 115.05 1rhf s GLN 89 Ca 0.72 1.86 -0.16 0.00 -1.95 0.00 0.00 55.36 55.84 1rhf s GLN 89 Cb -0.28 -1.85 0.02 0.00 -0.22 0.00 0.00 33.01 30.69 1rhf s GLN 89 CO 0.50 -1.69 1.07 -2.30 -0.25 0.00 0.00 175.29 172.62 1rhf n PRO 90 N -2.33 0.52 -3.70 2.91 -0.02 -1.26 -4.71 135.00 126.40 1rhf n PRO 90 Ca 0.14 0.24 -0.37 0.00 -2.02 0.00 0.00 63.50 61.49 1rhf n PRO 90 Cb 0.49 -2.32 -0.12 0.00 -0.02 0.00 0.00 33.50 31.53 1rhf n PRO 90 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1rhf s VAL 91 N -1.83 4.49 -0.55 -1.45 1.01 0.32 -1.40 120.40 120.99 1rhf s VAL 91 Ca 0.75 -0.25 -0.24 0.00 0.00 0.00 0.00 61.98 62.23 1rhf s VAL 91 Cb -0.34 -3.18 0.04 0.00 0.00 0.00 0.00 36.38 32.90 1rhf s VAL 91 CO 0.49 0.22 0.96 0.26 0.00 0.00 0.00 175.10 177.03 1rhf s TRP 92 N 1.62 2.78 -0.20 5.22 0.52 0.24 -0.80 118.94 128.33 1rhf s TRP 92 Ca 0.06 0.01 -0.24 0.00 0.02 0.00 0.00 56.10 55.95 1rhf s TRP 92 Cb -0.16 -4.10 -0.02 0.00 -1.15 0.00 0.00 33.47 28.04 1rhf s TRP 92 CO 0.05 -1.36 0.77 -1.17 0.02 0.00 0.00 176.95 175.25 1rhf s LEU 93 N 4.00 4.14 -0.11 2.99 2.96 -0.01 -0.88 118.68 131.78 1rhf s LEU 93 Ca 0.31 1.03 0.00 0.00 -0.22 0.00 0.00 54.13 55.25 1rhf s LEU 93 Cb -0.12 -3.11 -0.02 0.00 0.50 0.00 0.00 46.19 43.43 1rhf s LEU 93 CO 0.20 -0.39 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.84 1rhf s THR 94 N 2.24 3.32 -0.28 3.68 2.01 0.64 -1.42 115.64 125.82 1rhf s THR 94 Ca 0.34 -0.59 -0.06 0.00 0.31 0.00 0.00 61.69 61.69 1rhf s THR 94 Cb -0.16 -2.38 0.00 0.00 0.01 0.00 0.00 72.50 69.97 1rhf s THR 94 CO 0.11 0.55 0.06 -0.69 -0.69 0.00 0.00 174.62 173.95 1rhf s VAL 95 N -0.07 3.91 0.14 3.82 1.01 -1.26 -1.59 120.40 126.36 1rhf s VAL 95 Ca -0.01 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 1rhf s VAL 95 Cb -0.14 -2.98 -0.06 0.00 0.00 0.00 0.00 36.38 33.21 1rhf s VAL 95 CO 0.03 0.14 0.37 -1.83 0.00 0.00 0.00 175.10 173.82 1rhf s GLU 96 N 1.50 3.62 0.00 2.72 -1.05 0.07 -4.47 118.70 121.09 1rhf s GLU 96 Ca 0.03 -0.08 -0.04 0.00 -0.15 0.00 0.00 54.97 54.73 1rhf s GLU 96 Cb -0.17 -2.86 0.01 0.00 -0.44 0.00 0.00 34.13 30.67 1rhf s GLU 96 CO 0.02 0.48 0.17 0.41 0.95 0.00 0.00 175.26 177.29 1rhf n GLY 97 N 0.15 0.70 3.69 -3.83 0.00 -0.61 -1.24 105.19 104.05 1rhf n GLY 97 Ca -0.03 -0.88 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 1rhf n GLY 97 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rhf s VAL 98 N -2.20 2.57 0.74 1.61 -7.23 -1.26 -4.04 120.40 110.58 1rhf s VAL 98 Ca 0.04 0.18 -0.15 0.00 -1.81 0.00 0.00 61.98 60.25 1rhf s VAL 98 Cb -0.00 -2.57 0.04 0.00 0.56 0.00 0.00 36.38 34.41 1rhf s VAL 98 CO 0.00 -0.24 1.20 -2.84 -0.31 0.00 0.00 175.10 172.91 1rhf s PRO 99 N -4.85 2.12 -0.12 4.82 0.02 -1.26 -4.89 135.00 130.84 1rhf s PRO 99 Ca 0.64 1.72 0.03 0.00 0.02 0.00 0.00 61.00 63.42 1rhf s PRO 99 Cb -0.19 -1.83 0.01 0.00 0.02 0.00 0.00 34.50 32.50 1rhf s PRO 99 CO 0.58 -1.84 -0.23 0.12 -0.33 0.00 0.00 177.00 175.30 1rhf s PHE 100 N -2.04 2.61 -0.41 6.54 5.36 -0.27 -4.69 117.98 125.08 1rhf s PHE 100 Ca 0.73 -1.21 -0.29 0.00 -0.96 0.00 0.00 56.93 55.21 1rhf s PHE 100 Cb -0.28 -1.76 0.01 0.00 -0.34 0.00 0.00 43.02 40.65 1rhf s PHE 100 CO 0.46 -0.52 1.31 -0.06 -1.46 0.00 0.00 175.22 174.95 1rhf s PHE 101 N 0.59 2.58 0.06 10.12 0.40 -1.26 -1.85 117.98 128.62 1rhf s PHE 101 Ca -0.13 0.73 0.09 0.00 -0.60 0.00 0.00 56.93 57.02 1rhf s PHE 101 Cb -0.17 -4.27 -0.21 0.00 0.51 0.00 0.00 43.02 38.89 1rhf s PHE 101 CO 0.03 -1.71 1.09 1.79 0.70 0.00 0.00 175.22 177.12 1rhf h THR 102 N 6.30 1.43 -3.28 0.64 1.35 -1.59 -3.43 112.91 114.33 1rhf h THR 102 Ca -0.26 -3.17 -0.59 0.00 -0.55 0.00 0.00 66.41 61.84 1rhf h THR 102 Cb 1.09 2.70 -0.37 0.00 -1.73 0.00 0.00 68.15 69.85 1rhf h THR 102 CO 1.09 0.81 -0.81 -0.69 -0.25 0.00 0.00 175.52 175.67 1rhf s VAL 103 N -2.68 1.47 0.20 6.82 1.01 -0.90 -4.93 120.40 121.38 1rhf s VAL 103 Ca -0.01 -0.75 -0.11 0.00 0.00 0.00 0.00 61.98 61.11 1rhf s VAL 103 Cb 0.09 -1.50 -0.07 0.00 0.00 0.00 0.00 36.38 34.90 1rhf s VAL 103 CO 0.82 0.28 0.55 -1.61 0.00 0.00 0.00 175.10 175.14 1rhf s GLU 104 N 1.50 3.87 0.58 2.72 0.41 -1.26 -0.98 118.70 125.54 1rhf s GLU 104 Ca 0.02 0.36 -0.18 0.00 -0.41 0.00 0.00 54.97 54.75 1rhf s GLU 104 Cb -0.15 -2.76 -0.04 0.00 -1.78 0.00 0.00 34.13 29.41 1rhf s GLU 104 CO -0.09 0.38 1.16 -1.25 -0.49 0.00 0.00 175.26 174.97 1rhf s PRO 105 N -2.47 3.09 -0.01 0.39 0.04 -1.18 -4.78 135.00 130.08 1rhf s PRO 105 Ca 0.43 1.68 0.02 0.00 0.04 0.00 0.00 61.00 63.17 1rhf s PRO 105 Cb -0.13 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 1rhf s PRO 105 CO 0.20 -1.07 -0.04 0.15 0.04 0.00 0.00 177.00 176.28 1rhf s LYS 106 N -3.42 2.68 0.41 4.56 1.02 -1.26 -4.61 119.74 119.12 1rhf s LYS 106 Ca 0.74 -0.64 -0.26 0.00 0.02 0.00 0.00 55.97 55.83 1rhf s LYS 106 Cb -0.26 -2.59 -0.08 0.00 -0.52 0.00 0.00 37.83 34.38 1rhf s LYS 106 CO 0.32 0.62 1.25 -0.51 -0.92 0.00 0.00 175.35 176.11 1rhf s ASP 107 N -1.35 6.35 0.06 2.83 1.01 -1.26 -4.63 116.67 119.68 1rhf s ASP 107 Ca 0.17 2.54 0.02 0.00 0.71 0.00 0.00 52.55 55.99 1rhf s ASP 107 Cb -0.11 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.16 1rhf s ASP 107 CO 0.07 -0.81 -0.08 -0.76 0.21 0.00 0.00 175.17 173.81 1rhf s LEU 108 N -2.49 2.33 -0.15 1.23 1.43 -0.95 -4.98 118.68 115.10 1rhf s LEU 108 Ca 0.57 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1rhf s LEU 108 Cb -0.35 -0.14 -0.01 0.00 0.03 0.00 0.00 46.19 45.72 1rhf s LEU 108 CO 0.45 -0.28 -0.14 0.00 0.23 0.00 0.00 176.35 176.61 1rhf s ALA 109 N -2.02 2.54 0.08 4.21 0.00 -1.26 -1.37 121.76 123.93 1rhf s ALA 109 Ca -0.04 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.95 1rhf s ALA 109 Cb -0.06 -1.23 -0.03 0.00 0.00 0.00 0.00 23.12 21.80 1rhf s ALA 109 CO -0.01 0.05 -0.07 0.14 0.00 0.00 0.00 175.76 175.87 1rhf s VAL 110 N 0.68 0.66 0.78 0.00 -7.23 0.11 -4.71 120.40 110.68 1rhf s VAL 110 Ca -0.07 -1.57 -0.11 0.00 -1.81 0.00 0.00 61.98 58.42 1rhf s VAL 110 Cb -0.16 -1.23 0.06 0.00 0.56 0.00 0.00 36.38 35.62 1rhf s VAL 110 CO 0.02 -0.65 1.09 -2.84 -0.31 0.00 0.00 175.10 172.41 1rhf s PRO 111 N -2.84 2.22 0.49 4.82 0.02 -1.26 -0.68 135.00 137.77 1rhf s PRO 111 Ca 0.03 1.12 -0.22 0.00 0.02 0.00 0.00 61.00 61.95 1rhf s PRO 111 Cb -0.02 -1.90 -0.07 0.00 0.02 0.00 0.00 34.50 32.54 1rhf s PRO 111 CO -0.02 -1.66 1.18 -1.25 -0.33 0.00 0.00 177.00 174.92 1rhf s PRO 112 N -4.92 3.57 -1.58 5.54 0.04 -1.26 -3.38 135.00 133.01 1rhf s PRO 112 Ca 0.61 1.80 -0.15 0.00 0.04 0.00 0.00 61.00 63.30 1rhf s PRO 112 Cb -0.17 -2.29 0.10 0.00 0.04 0.00 0.00 34.50 32.19 1rhf s PRO 112 CO 0.56 -0.71 0.94 0.09 0.04 0.00 0.00 177.00 177.92 1rhf n ASN 113 N -0.76 -4.50 -4.24 6.66 4.13 -0.71 -4.95 115.26 110.90 1rhf n ASN 113 Ca 0.09 -0.83 -0.31 0.00 1.68 0.00 0.00 54.58 55.20 1rhf n ASN 113 Cb 0.48 -3.62 -0.17 0.00 -1.54 0.00 0.00 39.78 34.94 1rhf n ASN 113 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1rhf s ALA 114 N -3.29 2.12 0.59 5.41 0.00 -1.22 -4.84 121.76 120.54 1rhf s ALA 114 Ca 0.69 -0.99 -0.18 0.00 0.00 0.00 0.00 51.96 51.48 1rhf s ALA 114 Cb -0.35 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 1rhf s ALA 114 CO 0.85 0.36 1.15 -1.25 0.00 0.00 0.00 175.76 176.88 1rhf s PRO 115 N 0.04 3.06 0.23 0.00 0.04 -0.76 -3.82 135.00 133.79 1rhf s PRO 115 Ca -0.09 1.63 -0.13 0.00 0.04 0.00 0.00 61.00 62.45 1rhf s PRO 115 Cb -0.15 -1.96 -0.00 0.00 0.04 0.00 0.00 34.50 32.42 1rhf s PRO 115 CO 0.05 -1.09 0.47 -0.59 0.04 0.00 0.00 177.00 175.88 1rhf s PHE 116 N -1.86 0.31 -0.02 0.56 -0.12 -0.42 -4.96 117.98 111.46 1rhf s PHE 116 Ca 0.73 -0.67 0.03 0.00 -0.05 0.00 0.00 56.93 56.97 1rhf s PHE 116 Cb -0.25 0.19 -0.00 0.00 -0.63 0.00 0.00 43.02 42.33 1rhf s PHE 116 CO 0.33 -0.96 -0.12 -1.14 -0.05 0.00 0.00 175.22 173.28 1rhf s GLN 117 N -4.00 1.17 0.24 1.99 0.74 -1.26 -1.04 119.66 117.50 1rhf s GLN 117 Ca 0.20 -0.42 0.10 0.00 0.05 0.00 0.00 55.36 55.29 1rhf s GLN 117 Cb -0.00 -1.08 -0.04 0.00 1.10 0.00 0.00 33.01 32.98 1rhf s GLN 117 CO 0.07 0.19 -0.07 -0.51 -0.55 0.00 0.00 175.29 174.42 1rhf s LEU 118 N 0.01 3.01 0.01 3.68 1.43 -0.56 -4.98 118.68 121.28 1rhf s LEU 118 Ca -0.01 -0.69 -0.01 0.00 -1.03 0.00 0.00 54.13 52.39 1rhf s LEU 118 Cb -0.08 -1.58 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 1rhf s LEU 118 CO 0.01 0.04 0.00 -0.94 0.23 0.00 0.00 176.35 175.69 1rhf s SER 119 N -3.35 0.16 0.05 2.29 1.04 -1.26 -1.00 113.70 111.63 1rhf s SER 119 Ca 0.29 -0.35 -0.08 0.00 0.48 0.00 0.00 55.95 56.29 1rhf s SER 119 Cb -0.07 0.10 -0.00 0.00 0.10 0.00 0.00 66.02 66.15 1rhf s SER 119 CO 0.17 -0.25 0.16 0.00 0.98 0.00 0.00 173.24 174.30 1rhf s GLU 121 N -2.77 0.66 0.05 0.00 2.02 -0.15 -1.11 118.70 117.39 1rhf s GLU 121 Ca -0.03 -0.13 0.05 0.00 0.02 0.00 0.00 54.97 54.87 1rhf s GLU 121 Cb -0.00 -0.67 -0.02 0.00 0.10 0.00 0.00 34.13 33.54 1rhf s GLU 121 CO -0.05 -0.01 -0.14 0.00 0.02 0.00 0.00 175.26 175.09 1rhf s ALA 122 N 0.54 1.13 0.32 5.21 0.00 -1.26 -1.38 121.76 126.31 1rhf s ALA 122 Ca -0.07 -0.85 0.05 0.00 0.00 0.00 0.00 51.96 51.10 1rhf s ALA 122 Cb -0.10 -0.15 -0.06 0.00 0.00 0.00 0.00 23.12 22.80 1rhf s ALA 122 CO -0.00 0.19 0.01 0.14 0.00 0.00 0.00 175.76 176.10 1rhf s VAL 123 N -0.95 1.49 0.00 0.00 -7.23 -0.77 -4.79 120.40 108.15 1rhf s VAL 123 Ca 0.00 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.13 1rhf s VAL 123 Cb -0.08 -2.70 0.00 0.00 0.56 0.00 0.00 36.38 34.15 1rhf s VAL 123 CO 0.01 -0.11 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 1rhf n GLY 124 N -0.70 1.81 3.89 2.32 0.00 -1.26 -1.12 105.19 110.14 1rhf n GLY 124 Ca -0.04 -1.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.07 1rhf n GLY 124 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rhf s PRO 125 N 4.93 3.29 0.75 1.61 0.04 -1.26 -4.75 135.00 139.61 1rhf s PRO 125 Ca 0.00 0.38 -0.11 0.00 0.04 0.00 0.00 61.00 61.31 1rhf s PRO 125 Cb 0.00 -2.19 0.04 0.00 0.04 0.00 0.00 34.50 32.39 1rhf s PRO 125 CO 0.00 -0.59 1.08 -1.25 0.04 0.00 0.00 177.00 176.28 1rhf s PRO 126 N -5.05 2.44 0.18 0.56 0.04 -1.26 -1.57 135.00 130.34 1rhf s PRO 126 Ca 0.53 1.02 0.07 0.00 0.04 0.00 0.00 61.00 62.66 1rhf s PRO 126 Cb -0.11 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 1rhf s PRO 126 CO 0.49 -1.47 0.02 -1.21 0.04 0.00 0.00 177.00 174.87 1rhf s GLU 127 N -4.98 2.46 0.57 4.56 0.41 -1.26 -4.66 118.70 115.80 1rhf s GLU 127 Ca 0.60 -1.09 0.01 0.00 -0.41 0.00 0.00 54.97 54.07 1rhf s GLU 127 Cb -0.16 -2.38 0.04 0.00 -1.78 0.00 0.00 34.13 29.85 1rhf s GLU 127 CO 0.56 0.45 0.80 -1.25 -0.49 0.00 0.00 175.26 175.33 1rhf s PRO 128 N -3.00 2.47 -0.06 0.39 0.04 -1.26 -4.96 135.00 128.61 1rhf s PRO 128 Ca 0.28 -0.78 0.04 0.00 0.04 0.00 0.00 61.00 60.58 1rhf s PRO 128 Cb -0.09 -2.46 -0.02 0.00 0.04 0.00 0.00 34.50 31.97 1rhf s PRO 128 CO 0.19 -0.79 -0.17 0.08 0.04 0.00 0.00 177.00 176.35 1rhf s VAL 129 N -2.81 2.77 0.14 -0.36 1.01 -1.26 -4.52 120.40 115.36 1rhf s VAL 129 Ca 0.58 -0.82 0.10 0.00 0.00 0.00 0.00 61.98 61.85 1rhf s VAL 129 Cb -0.10 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 1rhf s VAL 129 CO 0.39 0.58 -0.25 0.42 0.00 0.00 0.00 175.10 176.24 1rhf s THR 130 N -0.48 2.15 -0.03 3.92 -4.23 -0.49 -2.65 115.64 113.83 1rhf s THR 130 Ca 0.06 -1.77 0.04 0.00 -1.18 0.00 0.00 61.69 58.85 1rhf s THR 130 Cb -0.12 -1.93 -0.01 0.00 1.34 0.00 0.00 72.50 71.79 1rhf s THR 130 CO 0.01 0.01 -0.16 -0.63 -0.54 0.00 0.00 174.62 173.32 1rhf s ILE 131 N -1.22 1.27 0.08 2.99 1.01 0.37 -0.48 121.20 125.23 1rhf s ILE 131 Ca 0.14 -0.66 0.10 0.00 0.00 0.00 0.00 60.65 60.23 1rhf s ILE 131 Cb -0.09 -1.08 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 1rhf s ILE 131 CO 0.06 0.37 -0.26 -0.69 0.00 0.00 0.00 174.94 174.42 1rhf s VAL 132 N -0.15 2.15 -0.06 2.92 1.01 -0.21 -1.95 120.40 124.11 1rhf s VAL 132 Ca 0.01 -1.54 -0.02 0.00 0.00 0.00 0.00 61.98 60.43 1rhf s VAL 132 Cb -0.09 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1rhf s VAL 132 CO 0.01 0.23 0.04 0.26 0.00 0.00 0.00 175.10 175.64 1rhf s TRP 133 N -0.92 3.25 -0.15 5.22 0.52 -0.81 -0.62 118.94 125.42 1rhf s TRP 133 Ca 0.12 0.24 0.01 0.00 0.02 0.00 0.00 56.10 56.49 1rhf s TRP 133 Cb -0.10 -1.78 -0.00 0.00 -1.15 0.00 0.00 33.47 30.43 1rhf s TRP 133 CO 0.04 0.53 -0.16 -1.58 0.02 0.00 0.00 176.95 175.80 1rhf s TRP 134 N -1.01 2.75 -0.33 -1.98 0.52 0.67 -1.19 118.94 118.37 1rhf s TRP 134 Ca 0.17 -1.03 -0.08 0.00 0.02 0.00 0.00 56.10 55.17 1rhf s TRP 134 Cb -0.12 -1.86 0.02 0.00 -1.15 0.00 0.00 33.47 30.36 1rhf s TRP 134 CO 0.07 -0.46 0.13 0.50 0.02 0.00 0.00 176.95 177.21 1rhf s ARG 135 N 0.73 3.00 7.99 4.98 3.52 -0.20 -1.27 118.95 137.71 1rhf s ARG 135 Ca -0.07 -0.94 0.00 0.00 -0.13 0.00 0.00 55.73 54.59 1rhf s ARG 135 Cb -0.16 -3.52 0.00 0.00 -1.56 0.00 0.00 34.95 29.71 1rhf s ARG 135 CO 0.01 -0.54 0.00 0.41 -0.81 0.00 0.00 175.30 174.37 1rhf n GLY 136 N 4.92 4.23 0.88 8.12 0.00 -1.26 -0.91 105.19 121.16 1rhf n GLY 136 Ca -0.13 0.10 0.08 0.00 0.00 0.00 0.00 46.02 46.07 1rhf n GLY 136 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rhf n THR 137 N 0.00 1.03 -3.89 2.61 -2.24 -1.26 -4.94 114.28 105.59 1rhf n THR 137 Ca 0.00 -1.02 -0.35 0.00 -2.27 0.00 0.00 64.05 60.41 1rhf n THR 137 Cb 0.00 0.48 -0.10 0.00 -2.10 0.00 0.00 70.33 68.61 1rhf n THR 137 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1rhf s THR 138 N -1.04 4.81 -0.07 4.28 2.01 -0.09 -5.05 115.64 120.49 1rhf s THR 138 Ca 0.32 -0.02 -0.30 0.00 0.31 0.00 0.00 61.69 62.01 1rhf s THR 138 Cb 0.17 -3.20 -0.05 0.00 0.01 0.00 0.00 72.50 69.43 1rhf s THR 138 CO 0.21 0.41 1.59 -0.75 -0.69 0.00 0.00 174.62 175.40 1rhf s LYS 139 N 0.75 4.19 0.00 4.92 2.20 -1.26 -1.03 119.74 129.51 1rhf s LYS 139 Ca 0.04 2.10 0.00 0.00 -0.36 0.00 0.00 55.97 57.76 1rhf s LYS 139 Cb -0.13 -3.95 0.00 0.00 -1.51 0.00 0.00 37.83 32.24 1rhf s LYS 139 CO 0.02 -0.83 0.00 -0.89 -0.36 0.00 0.00 175.35 173.29 1rhf n ILE 140 N 5.47 0.00 -2.38 5.43 2.08 -0.33 -4.94 119.36 124.68 1rhf n ILE 140 Ca 0.17 0.00 -0.26 0.00 0.56 0.00 0.00 62.75 63.22 1rhf n ILE 140 Cb 0.43 -0.48 0.13 0.00 -0.75 0.00 0.00 39.64 38.97 1rhf n ILE 140 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1rhf s GLY 141 N -0.01 1.76 0.00 7.39 0.00 -1.25 -4.86 107.32 110.36 1rhf s GLY 141 Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 44.72 43.16 1rhf s GLY 141 CO 0.00 -0.93 0.00 0.61 0.00 0.00 0.00 173.10 172.78 1rhf n GLY 142 N -3.12 -1.16 3.69 0.20 0.00 -1.26 -1.93 105.19 101.61 1rhf n GLY 142 Ca 0.15 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 44.62 1rhf n GLY 142 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1rhf s PRO 143 N 0.00 4.22 0.06 1.61 0.02 -1.26 -4.94 135.00 134.70 1rhf s PRO 143 Ca 0.00 2.27 -0.00 0.00 0.02 0.00 0.00 61.00 63.29 1rhf s PRO 143 Cb 0.00 -3.52 -0.04 0.00 0.02 0.00 0.00 34.50 30.96 1rhf s PRO 143 CO 0.00 -0.68 -0.04 0.00 -0.33 0.00 0.00 177.00 175.95 1rhf s ALA 144 N 2.34 0.56 0.72 -1.55 0.00 -0.82 -4.91 121.76 118.10 1rhf s ALA 144 Ca 0.72 -1.11 -0.16 0.00 0.00 0.00 0.00 51.96 51.40 1rhf s ALA 144 Cb -0.39 0.21 0.02 0.00 0.00 0.00 0.00 23.12 22.96 1rhf s ALA 144 CO 0.31 -0.28 1.10 -0.35 0.00 0.00 0.00 175.76 176.54 1rhf n PRO 145 N 0.40 0.59 -2.68 0.00 -0.04 -1.26 -0.48 135.00 131.54 1rhf n PRO 145 Ca -0.16 0.26 -0.37 0.00 -0.04 0.00 0.00 63.50 63.19 1rhf n PRO 145 Cb 0.60 -2.35 -0.05 0.00 -0.04 0.00 0.00 33.50 31.65 1rhf n PRO 145 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1rhf s SER 146 N -1.68 7.20 0.68 3.54 0.15 -1.08 -4.06 113.70 118.45 1rhf s SER 146 Ca 0.76 1.95 -0.13 0.00 0.70 0.00 0.00 55.95 59.23 1rhf s SER 146 Cb -0.34 -2.59 0.01 0.00 -1.71 0.00 0.00 66.02 61.39 1rhf s SER 146 CO 0.48 -0.18 1.08 -2.84 1.20 0.00 0.00 173.24 172.98 1rhf s PRO 147 N -2.03 2.82 -0.02 5.44 0.02 -1.26 -4.99 135.00 134.97 1rhf s PRO 147 Ca 0.51 1.17 0.04 0.00 0.02 0.00 0.00 61.00 62.74 1rhf s PRO 147 Cb -0.22 -1.97 -0.00 0.00 0.02 0.00 0.00 34.50 32.33 1rhf s PRO 147 CO 0.28 -1.20 -0.13 0.45 -0.33 0.00 0.00 177.00 176.06 1rhf s SER 148 N -3.16 1.59 0.23 2.53 0.15 -0.26 -5.03 113.70 109.74 1rhf s SER 148 Ca 0.62 -0.25 0.11 0.00 0.70 0.00 0.00 55.95 57.14 1rhf s SER 148 Cb -0.17 -0.33 -0.05 0.00 -1.71 0.00 0.00 66.02 63.77 1rhf s SER 148 CO 0.48 0.13 -0.20 0.68 1.20 0.00 0.00 173.24 175.52 1rhf s VAL 149 N -0.05 2.51 -0.14 4.45 -7.23 -1.26 -1.06 120.40 117.61 1rhf s VAL 149 Ca 0.00 -2.14 -0.01 0.00 -1.81 0.00 0.00 61.98 58.02 1rhf s VAL 149 Cb -0.08 -2.26 0.04 0.00 0.56 0.00 0.00 36.38 34.65 1rhf s VAL 149 CO 0.00 -0.23 -0.02 -0.22 -0.31 0.00 0.00 175.10 174.32 1rhf s LEU 150 N -3.03 1.22 -0.18 1.32 2.96 -0.17 -4.99 118.68 115.81 1rhf s LEU 150 Ca 0.25 -0.52 -0.18 0.00 -0.22 0.00 0.00 54.13 53.46 1rhf s LEU 150 Cb -0.07 -0.72 -0.04 0.00 0.50 0.00 0.00 46.19 45.87 1rhf s LEU 150 CO 0.13 -0.21 0.48 0.20 -1.32 0.00 0.00 176.35 175.63 1rhf s ASN 151 N 1.78 6.57 -0.10 3.68 -0.87 -1.26 -1.49 114.94 123.24 1rhf s ASN 151 Ca 0.02 0.68 0.02 0.00 -1.57 0.00 0.00 52.86 52.01 1rhf s ASN 151 Cb -0.15 -2.28 -0.01 0.00 -0.02 0.00 0.00 41.25 38.79 1rhf s ASN 151 CO -0.07 -0.11 -0.17 -0.69 -2.57 0.00 0.00 177.10 173.49 1rhf s VAL 152 N 1.31 2.76 0.28 1.60 1.01 -0.21 -5.02 120.40 122.12 1rhf s VAL 152 Ca 0.24 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.46 1rhf s VAL 152 Cb -0.15 -2.11 0.04 0.00 0.00 0.00 0.00 36.38 34.16 1rhf s VAL 152 CO 0.09 0.55 1.69 0.71 0.00 0.00 0.00 175.10 178.14 1rhf h THR 153 N 5.18 1.29 0.00 3.92 1.35 -1.88 -1.12 112.91 121.65 1rhf h THR 153 Ca -0.30 -1.42 0.00 0.00 -0.55 0.00 0.00 66.41 64.14 1rhf h THR 153 Cb 1.20 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 69.15 1rhf h THR 153 CO 0.52 0.44 0.00 0.61 -0.25 0.00 0.00 175.52 176.84 1rhf n GLY 154 N -0.23 2.71 3.43 5.82 0.00 -1.25 -1.82 105.19 113.86 1rhf n GLY 154 Ca -0.01 -0.93 -0.21 0.00 0.00 0.00 0.00 46.02 44.87 1rhf n GLY 154 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rhf s VAL 155 N -2.00 1.54 0.00 1.61 -7.23 -1.26 -4.83 120.40 108.23 1rhf s VAL 155 Ca 0.00 -2.09 0.00 0.00 -1.81 0.00 0.00 61.98 58.08 1rhf s VAL 155 Cb 0.00 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.41 1rhf s VAL 155 CO 0.00 -0.24 0.26 0.41 -0.31 0.00 0.00 175.10 175.23 1rhf n THR 156 N -0.61 0.00 -3.85 5.32 -1.04 -1.26 -1.74 114.28 111.10 1rhf n THR 156 Ca -0.05 -0.34 -0.08 0.00 -2.04 0.00 0.00 64.05 61.55 1rhf n THR 156 Cb 0.64 1.25 -0.02 0.00 -1.82 0.00 0.00 70.33 70.37 1rhf n THR 156 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1rhf s GLN 157 N -0.16 1.73 0.07 -2.82 -2.07 -1.26 -5.03 119.66 110.12 1rhf s GLN 157 Ca 0.00 -0.99 -0.36 0.00 -1.82 0.00 0.00 55.36 52.19 1rhf s GLN 157 Cb 0.00 0.59 -0.15 0.00 -1.09 0.00 0.00 33.01 32.36 1rhf s GLN 157 CO 0.00 -0.78 1.51 0.45 -1.32 0.00 0.00 175.29 175.15 1rhf n SER 158 N -0.44 2.41 -1.03 12.60 2.88 -1.26 -4.80 113.62 123.98 1rhf n SER 158 Ca -0.05 1.09 -0.00 0.00 -1.33 0.00 0.00 58.87 58.58 1rhf n SER 158 Cb 0.60 -1.29 -0.00 0.00 -0.75 0.00 0.00 64.21 62.76 1rhf n SER 158 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1rhf n THR 159 N 3.23 0.00 0.00 2.46 -1.04 0.45 -5.00 114.28 114.38 1rhf n THR 159 Ca 0.19 -0.03 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 1rhf n THR 159 Cb 0.23 0.02 0.00 0.00 -1.82 0.00 0.00 70.33 68.76 1rhf n THR 159 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1rhf n PHE 161 N -0.01 0.00 -3.88 -1.42 3.01 -0.26 -0.83 117.46 114.07 1rhf n PHE 161 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.37 1rhf n PHE 161 Cb 0.01 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.41 1rhf n PHE 161 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1rhf s SER 162 N 0.00 0.06 -0.02 4.37 1.04 -0.40 -0.53 113.70 118.22 1rhf s SER 162 Ca 0.00 -0.71 -0.01 0.00 0.48 0.00 0.00 55.95 55.70 1rhf s SER 162 Cb 0.00 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.47 1rhf s SER 162 CO 0.00 -0.81 0.09 0.00 0.98 0.00 0.00 173.24 173.51 1rhf s GLU 164 N -1.61 3.02 -0.00 0.00 2.12 0.20 -1.35 118.70 121.08 1rhf s GLU 164 Ca 0.22 -0.83 -0.01 0.00 0.36 0.00 0.00 54.97 54.71 1rhf s GLU 164 Cb -0.12 -2.72 -0.04 0.00 0.26 0.00 0.00 34.13 31.51 1rhf s GLU 164 CO 0.12 -0.24 0.11 0.00 -0.54 0.00 0.00 175.26 174.71 1rhf s ALA 165 N 1.32 3.70 -0.03 6.30 0.00 0.32 -1.05 121.76 132.32 1rhf s ALA 165 Ca 0.04 -0.85 -0.01 0.00 0.00 0.00 0.00 51.96 51.15 1rhf s ALA 165 Cb -0.14 -1.66 0.03 0.00 0.00 0.00 0.00 23.12 21.35 1rhf s ALA 165 CO -0.10 0.71 0.05 -1.58 0.00 0.00 0.00 175.76 174.85 1rhf s HIS 166 N -1.24 -0.00 0.15 0.00 2.46 0.37 -1.35 115.29 115.67 1rhf s HIS 166 Ca 0.24 0.20 0.02 0.00 0.47 0.00 0.00 55.06 55.99 1rhf s HIS 166 Cb -0.12 -0.22 -0.01 0.00 -0.13 0.00 0.00 32.58 32.10 1rhf s HIS 166 CO 0.16 -0.11 0.06 0.27 -2.47 0.00 0.00 174.74 172.65 1rhf n ASN 167 N 4.24 0.84 -0.14 9.88 6.94 -0.80 -1.40 115.26 134.81 1rhf n ASN 167 Ca -0.27 -1.80 0.11 0.00 -0.02 0.00 0.00 54.58 52.60 1rhf n ASN 167 Cb 0.50 0.42 0.45 0.00 -2.36 0.00 0.00 39.78 38.79 1rhf n ASN 167 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1rhf h LEU 168 N 0.00 0.48 -0.25 -4.53 5.85 -1.85 -1.80 115.31 113.21 1rhf h LEU 168 Ca -0.11 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1rhf h LEU 168 Cb 0.45 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1rhf h LEU 168 CO 0.18 0.28 0.00 0.50 -0.34 0.00 0.00 178.44 179.06 1rhf h LYS 169 N 0.53 0.00 0.00 1.25 1.63 -1.94 -3.50 116.57 114.55 1rhf h LYS 169 Ca 0.32 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.12 1rhf h LYS 169 Cb 0.54 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.17 1rhf h LYS 169 CO -0.10 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 176.31 1rhf n GLY 170 N 0.87 0.55 3.49 5.01 0.00 -0.68 -4.73 105.19 109.70 1rhf n GLY 170 Ca 0.04 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 1rhf n GLY 170 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rhf s LEU 171 N 0.00 2.70 0.00 0.99 1.43 -1.26 -1.91 118.68 120.64 1rhf s LEU 171 Ca 0.00 -0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 52.58 1rhf s LEU 171 Cb 0.00 -1.56 -0.01 0.00 0.03 0.00 0.00 46.19 44.65 1rhf s LEU 171 CO 0.00 0.21 0.04 0.00 0.23 0.00 0.00 176.35 176.82 1rhf s ALA 172 N -1.07 -0.06 -0.03 4.21 0.00 -0.45 -4.78 121.76 119.57 1rhf s ALA 172 Ca 0.17 -0.27 -0.02 0.00 0.00 0.00 0.00 51.96 51.84 1rhf s ALA 172 Cb -0.11 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 1rhf s ALA 172 CO 0.09 -0.14 0.12 -1.12 0.00 0.00 0.00 175.76 174.71 1rhf s SER 173 N -1.03 5.98 0.94 0.00 0.01 -1.26 -0.52 113.70 117.81 1rhf s SER 173 Ca -0.11 0.26 -0.14 0.00 1.31 0.00 0.00 55.95 57.27 1rhf s SER 173 Cb -0.07 -1.80 0.16 0.00 0.21 0.00 0.00 66.02 64.52 1rhf s SER 173 CO -0.00 0.30 1.19 -0.94 0.41 0.00 0.00 173.24 174.20 1rhf s SER 174 N -1.63 3.31 0.78 2.44 1.04 -0.45 -4.97 113.70 114.21 1rhf s SER 174 Ca 0.22 0.72 -0.15 0.00 0.48 0.00 0.00 55.95 57.22 1rhf s SER 174 Cb -0.12 -1.10 0.04 0.00 0.10 0.00 0.00 66.02 64.93 1rhf s SER 174 CO 0.13 -2.65 1.00 -2.11 0.98 0.00 0.00 173.24 170.58 1rhf n ARG 175 N -3.79 0.30 -3.00 4.02 1.85 -1.26 -4.74 116.66 110.03 1rhf n ARG 175 Ca 0.10 0.16 -0.41 0.00 -1.00 0.00 0.00 57.85 56.70 1rhf n ARG 175 Cb 0.60 -2.26 -0.05 0.00 -1.05 0.00 0.00 32.46 29.69 1rhf n ARG 175 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1rhf s THR 176 N -2.00 4.91 0.15 8.89 2.01 -1.26 -4.51 115.64 123.83 1rhf s THR 176 Ca 0.72 1.32 -0.25 0.00 0.31 0.00 0.00 61.69 63.78 1rhf s THR 176 Cb -0.31 -4.03 -0.08 0.00 0.01 0.00 0.00 72.50 68.09 1rhf s THR 176 CO 0.52 -0.04 0.78 0.00 -0.69 0.00 0.00 174.62 175.19 1rhf s ALA 177 N 2.68 3.44 -0.18 7.40 0.00 0.31 -4.93 121.76 130.48 1rhf s ALA 177 Ca 0.30 0.35 -0.03 0.00 0.00 0.00 0.00 51.96 52.59 1rhf s ALA 177 Cb -0.15 -2.96 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 1rhf s ALA 177 CO 0.08 0.27 -0.06 0.99 0.00 0.00 0.00 175.76 177.04 1rhf s THR 178 N -1.03 3.47 -0.27 0.00 2.01 -1.26 -1.10 115.64 117.46 1rhf s THR 178 Ca 0.36 -0.49 -0.10 0.00 0.31 0.00 0.00 61.69 61.77 1rhf s THR 178 Cb -0.23 -2.53 -0.05 0.00 0.01 0.00 0.00 72.50 69.70 1rhf s THR 178 CO 0.26 0.47 0.16 -0.69 -0.69 0.00 0.00 174.62 174.13 1rhf s VAL 179 N 0.82 5.10 0.41 3.82 1.01 -0.01 -2.25 120.40 129.30 1rhf s VAL 179 Ca -0.02 0.10 0.04 0.00 0.00 0.00 0.00 61.98 62.10 1rhf s VAL 179 Cb -0.15 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.76 1rhf s VAL 179 CO 0.01 0.28 0.04 -1.38 0.00 0.00 0.00 175.10 174.05 1rhf s HIS 180 N 1.67 2.12 0.23 5.22 -3.43 -0.47 -0.41 115.29 120.21 1rhf s HIS 180 Ca 0.07 -0.90 -0.25 0.00 -0.80 0.00 0.00 55.06 53.18 1rhf s HIS 180 Cb -0.16 -1.51 -0.09 0.00 -1.43 0.00 0.00 32.58 29.39 1rhf s HIS 180 CO 0.09 0.17 0.83 -0.51 -2.00 0.00 0.00 174.74 173.33 1rhf s LEU 181 N -3.67 4.48 0.00 5.38 1.43 -1.26 -0.71 118.68 124.34 1rhf s LEU 181 Ca 0.28 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 55.07 1rhf s LEU 181 Cb 0.07 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1rhf s LEU 181 CO 0.14 0.09 0.26 0.00 0.23 0.00 0.00 176.35 177.07