#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kpc n THR 17 N 0.00 0.00 0.12 -3.53 -2.24 -1.26 -4.95 114.28 102.43 1kpc n THR 17 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1kpc n THR 17 Cb 0.00 -0.30 0.18 0.00 -2.10 0.00 0.00 70.33 68.11 1kpc n THR 17 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1kpc h ILE 18 N 0.47 1.40 0.00 2.28 2.10 -2.00 -2.19 117.51 119.56 1kpc h ILE 18 Ca 0.00 -1.96 -0.06 0.00 1.08 0.00 0.00 64.86 63.92 1kpc h ILE 18 Cb 0.00 2.03 -0.01 0.00 -1.09 0.00 0.00 36.82 37.76 1kpc h ILE 18 CO 0.00 0.57 -0.27 -0.26 -1.08 0.00 0.00 178.15 177.11 1kpc h PHE 19 N 0.06 0.00 0.07 2.19 0.04 -1.98 -2.16 116.94 115.16 1kpc h PHE 19 Ca -0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 1kpc h PHE 19 Cb 1.04 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.19 1kpc h PHE 19 CO 0.01 0.27 -0.03 0.78 -0.60 0.00 0.00 178.31 178.73 1kpc h GLY 20 N 1.89 -0.09 1.50 -1.45 0.00 -1.76 -1.89 103.07 101.27 1kpc h GLY 20 Ca -0.00 0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.32 1kpc h GLY 20 CO 0.04 -0.03 0.08 0.50 0.00 0.00 0.00 176.54 177.12 1kpc h LYS 21 N -0.19 0.63 -0.13 4.80 1.57 -1.35 -1.81 116.57 120.09 1kpc h LYS 21 Ca -0.01 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 58.53 1kpc h LYS 21 Cb 0.16 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1kpc h LYS 21 CO 0.02 0.59 -0.45 0.82 -0.57 0.00 0.00 179.45 179.86 1kpc h ILE 22 N 0.61 1.32 -0.02 1.86 2.04 -1.32 0.17 117.51 122.18 1kpc h ILE 22 Ca 0.14 -1.62 -0.13 0.00 1.00 0.00 0.00 64.86 64.25 1kpc h ILE 22 Cb 0.27 1.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 1kpc h ILE 22 CO 0.00 0.49 -0.58 0.40 0.00 0.00 0.00 178.15 178.46 1kpc h ILE 23 N 0.25 1.41 -0.15 -0.67 2.04 -0.54 -2.54 117.51 117.31 1kpc h ILE 23 Ca 0.02 -1.97 0.00 0.00 1.00 0.00 0.00 64.86 63.91 1kpc h ILE 23 Cb 0.89 2.05 0.00 0.00 -0.74 0.00 0.00 36.82 39.02 1kpc h ILE 23 CO 0.07 0.57 0.00 0.54 0.00 0.00 0.00 178.15 179.33 1kpc n ARG 24 N -3.86 1.45 -1.02 2.37 1.74 -0.79 -4.86 116.66 111.70 1kpc n ARG 24 Ca -0.01 -0.69 -0.01 0.00 -0.77 0.00 0.00 57.85 56.36 1kpc n ARG 24 Cb 0.59 -1.27 -0.00 0.00 -1.02 0.00 0.00 32.46 30.76 1kpc n ARG 24 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1kpc n LYS 25 N -0.02 -1.56 0.05 5.56 4.01 -0.83 -4.84 118.16 120.52 1kpc n LYS 25 Ca 0.12 0.42 -0.04 0.00 -0.51 0.00 0.00 58.31 58.30 1kpc n LYS 25 Cb 0.20 -4.60 0.18 0.00 -0.51 0.00 0.00 35.03 30.29 1kpc n LYS 25 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 1kpc h GLU 26 N 0.20 0.39 -5.45 1.97 5.08 -0.95 -3.43 114.58 112.39 1kpc h GLU 26 Ca -0.01 -0.18 -0.43 0.00 -1.00 0.00 0.00 59.36 57.74 1kpc h GLU 26 Cb 0.80 -0.00 -0.20 0.00 0.50 0.00 0.00 28.75 29.85 1kpc h GLU 26 CO 0.02 0.72 -0.77 0.96 -1.00 0.00 0.00 179.01 178.94 1kpc s ILE 27 N -4.22 1.28 0.50 3.13 -4.36 -1.15 -5.00 121.20 111.37 1kpc s ILE 27 Ca -0.06 -1.55 -0.21 0.00 -0.26 0.00 0.00 60.65 58.57 1kpc s ILE 27 Cb 0.13 -1.37 -0.07 0.00 1.25 0.00 0.00 42.46 42.40 1kpc s ILE 27 CO 0.79 -0.32 1.10 -2.16 0.24 0.00 0.00 174.94 174.60 1kpc s PRO 28 N -2.27 3.63 -0.01 0.37 0.04 -1.26 -4.52 135.00 130.98 1kpc s PRO 28 Ca 0.05 1.56 -0.26 0.00 0.04 0.00 0.00 61.00 62.38 1kpc s PRO 28 Cb -0.07 -2.15 0.06 0.00 0.04 0.00 0.00 34.50 32.38 1kpc s PRO 28 CO 0.03 -0.61 0.58 0.00 0.04 0.00 0.00 177.00 177.04 1kpc s ALA 29 N -1.78 -1.49 -1.41 8.56 0.00 -1.26 -5.03 121.76 119.35 1kpc s ALA 29 Ca 0.68 0.95 -0.14 0.00 0.00 0.00 0.00 51.96 53.45 1kpc s ALA 29 Cb -0.22 0.13 0.06 0.00 0.00 0.00 0.00 23.12 23.09 1kpc s ALA 29 CO 0.26 -0.40 2.10 1.63 0.00 0.00 0.00 175.76 179.36 1kpc n LYS 30 N 0.81 3.00 -1.73 0.00 4.76 -1.26 -4.95 118.16 118.79 1kpc n LYS 30 Ca -0.19 -2.83 -0.42 0.00 -2.87 0.00 0.00 58.31 52.00 1kpc n LYS 30 Cb 0.58 -3.27 -0.03 0.00 -1.84 0.00 0.00 35.03 30.47 1kpc n LYS 30 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1kpc s ILE 31 N 2.98 2.43 -0.22 -0.18 1.01 -1.26 -0.47 121.20 125.49 1kpc s ILE 31 Ca 0.47 0.06 -0.05 0.00 0.00 0.00 0.00 60.65 61.13 1kpc s ILE 31 Cb 0.12 -3.04 -0.19 0.00 0.01 0.00 0.00 42.46 39.36 1kpc s ILE 31 CO -0.05 0.00 -0.03 -0.38 0.00 0.00 0.00 174.94 174.48 1kpc n ILE 32 N 4.54 1.59 -3.73 2.92 5.41 0.22 -4.91 119.36 125.39 1kpc n ILE 32 Ca 0.17 -0.51 -0.10 0.00 1.00 0.00 0.00 62.75 63.31 1kpc n ILE 32 Cb 0.38 -1.65 -0.05 0.00 -0.71 0.00 0.00 39.64 37.61 1kpc n ILE 32 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 176.55 176.67 1kpc s PHE 33 N -2.51 -0.06 -0.15 1.39 5.36 -0.56 -4.99 117.98 116.45 1kpc s PHE 33 Ca -0.31 -0.28 -0.28 0.00 -0.96 0.00 0.00 56.93 55.10 1kpc s PHE 33 Cb 0.09 0.25 0.08 0.00 -0.34 0.00 0.00 43.02 43.10 1kpc s PHE 33 CO 0.63 -0.78 0.75 -2.00 -1.46 0.00 0.00 175.22 172.36 1kpc s GLU 34 N -3.86 0.91 0.00 10.12 2.12 -1.26 -0.21 118.70 126.52 1kpc s GLU 34 Ca 0.08 0.53 0.00 0.00 0.36 0.00 0.00 54.97 55.93 1kpc s GLU 34 Cb 0.01 0.43 0.00 0.00 0.26 0.00 0.00 34.13 34.83 1kpc s GLU 34 CO -0.07 -0.22 0.00 -0.40 -0.54 0.00 0.00 175.26 174.03 1kpc n ASP 35 N 1.59 0.00 0.18 -1.70 5.68 -0.75 -5.03 116.55 116.52 1kpc n ASP 35 Ca -0.16 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.20 1kpc n ASP 35 Cb 0.56 0.00 0.14 0.00 -1.14 0.00 0.00 41.12 40.68 1kpc n ASP 35 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 1kpc h ASP 36 N 0.00 0.00 -0.00 -1.12 2.03 -2.04 -3.38 116.42 111.91 1kpc h ASP 36 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1kpc h ASP 36 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1kpc h ASP 36 CO 0.00 0.28 -0.06 -2.11 -1.03 0.00 0.00 179.24 176.32 1kpc n ARG 37 N -3.19 2.84 -3.54 4.15 1.85 -1.26 -4.92 116.66 112.59 1kpc n ARG 37 Ca 0.03 -0.33 -0.11 0.00 -1.00 0.00 0.00 57.85 56.44 1kpc n ARG 37 Cb 0.62 -0.83 -0.03 0.00 -1.05 0.00 0.00 32.46 31.16 1kpc n ARG 37 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1kpc s LEU 39 N -2.74 1.62 -0.11 0.00 2.96 -0.13 -1.82 118.68 118.46 1kpc s LEU 39 Ca 0.02 -0.20 0.01 0.00 -0.22 0.00 0.00 54.13 53.74 1kpc s LEU 39 Cb 0.00 -0.59 -0.01 0.00 0.50 0.00 0.00 46.19 46.09 1kpc s LEU 39 CO -0.12 0.02 -0.16 0.00 -1.32 0.00 0.00 176.35 174.77 1kpc s ALA 40 N 0.52 2.51 0.24 5.97 0.00 0.71 -0.68 121.76 131.03 1kpc s ALA 40 Ca -0.09 -0.92 -0.16 0.00 0.00 0.00 0.00 51.96 50.79 1kpc s ALA 40 Cb -0.12 -1.07 0.01 0.00 0.00 0.00 0.00 23.12 21.94 1kpc s ALA 40 CO 0.01 0.31 0.55 -0.59 0.00 0.00 0.00 175.76 176.04 1kpc s PHE 41 N 0.18 0.09 0.53 0.00 -0.71 -0.83 0.69 117.98 117.94 1kpc s PHE 41 Ca -0.09 -0.47 -0.18 0.00 -1.04 0.00 0.00 56.93 55.14 1kpc s PHE 41 Cb -0.16 0.38 -0.06 0.00 -1.21 0.00 0.00 43.02 41.97 1kpc s PHE 41 CO 0.06 -1.04 1.05 -1.01 -1.34 0.00 0.00 175.22 172.93 1kpc s HIS 42 N -3.95 3.01 -0.14 3.49 3.76 0.38 -0.53 115.29 121.31 1kpc s HIS 42 Ca 0.16 1.55 -0.19 0.00 -0.15 0.00 0.00 55.06 56.42 1kpc s HIS 42 Cb -0.02 -3.04 -0.04 0.00 1.11 0.00 0.00 32.58 30.60 1kpc s HIS 42 CO 0.05 -0.94 0.54 0.34 -0.85 0.00 0.00 174.74 173.89 1kpc s ASP 43 N -2.34 6.71 0.44 1.40 -1.08 -0.23 -4.71 116.67 116.86 1kpc s ASP 43 Ca 0.66 0.85 0.11 0.00 -0.52 0.00 0.00 52.55 53.65 1kpc s ASP 43 Cb -0.16 -2.32 0.99 0.00 -1.46 0.00 0.00 42.92 39.97 1kpc s ASP 43 CO 0.27 -0.09 2.05 0.16 0.52 0.00 0.00 175.17 178.08 1kpc h ILE 44 N 4.87 1.02 -2.54 4.11 3.07 -1.96 -3.12 117.51 122.97 1kpc h ILE 44 Ca -0.38 -0.14 -0.71 0.00 1.55 0.00 0.00 64.86 65.18 1kpc h ILE 44 Cb 1.17 0.58 -0.35 0.00 -0.27 0.00 0.00 36.82 37.95 1kpc h ILE 44 CO 0.75 0.07 0.13 -1.20 -1.05 0.00 0.00 178.15 176.86 1kpc n SER 45 N -4.48 5.23 -4.67 2.16 7.64 -1.26 -5.07 113.62 113.16 1kpc n SER 45 Ca 0.04 -3.46 -0.42 0.00 1.01 0.00 0.00 58.87 56.04 1kpc n SER 45 Cb 0.16 -0.97 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 1kpc n SER 45 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1kpc n PRO 46 N 0.97 1.83 0.00 1.43 -0.04 -1.18 -4.92 135.00 133.09 1kpc n PRO 46 Ca 0.29 0.65 0.05 0.00 -0.04 0.00 0.00 63.50 64.45 1kpc n PRO 46 Cb 0.36 -2.25 0.02 0.00 -0.04 0.00 0.00 33.50 31.59 1kpc n PRO 46 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1kpc n GLN 47 N 0.30 1.41 -3.88 0.54 1.13 -1.26 -5.00 117.38 110.61 1kpc n GLN 47 Ca 0.07 -0.81 -0.10 0.00 -1.94 0.00 0.00 57.00 54.23 1kpc n GLN 47 Cb 0.38 -1.12 -0.06 0.00 0.11 0.00 0.00 30.24 29.54 1kpc n GLN 47 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1kpc s ALA 48 N -1.13 -0.32 0.64 -1.58 0.00 -1.26 -5.02 121.76 113.09 1kpc s ALA 48 Ca 0.10 -0.65 0.36 0.00 0.00 0.00 0.00 51.96 51.77 1kpc s ALA 48 Cb 0.08 0.84 2.03 0.00 0.00 0.00 0.00 23.12 26.07 1kpc s ALA 48 CO 0.19 -0.69 2.22 -1.35 0.00 0.00 0.00 175.76 176.13 1kpc h PRO 49 N 2.44 0.00 -3.81 0.00 0.11 -1.74 -3.34 132.00 125.66 1kpc h PRO 49 Ca -0.31 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.26 1kpc h PRO 49 Cb 1.24 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.96 1kpc h PRO 49 CO 0.45 0.00 -0.77 0.99 -0.21 0.00 0.00 178.00 178.46 1kpc s THR 50 N -4.32 0.84 -0.24 -1.15 2.01 -0.86 -4.96 115.64 106.95 1kpc s THR 50 Ca -0.05 -0.73 -0.04 0.00 0.31 0.00 0.00 61.69 61.18 1kpc s THR 50 Cb 0.13 -1.25 0.09 0.00 0.01 0.00 0.00 72.50 71.48 1kpc s THR 50 CO 0.44 -0.15 0.13 -2.28 -0.69 0.00 0.00 174.62 172.07 1kpc s HIS 51 N 1.72 0.18 0.38 4.92 2.46 -1.25 -0.93 115.29 122.76 1kpc s HIS 51 Ca -0.02 -0.55 0.04 0.00 0.47 0.00 0.00 55.06 55.00 1kpc s HIS 51 Cb -0.17 -0.76 -0.05 0.00 -0.13 0.00 0.00 32.58 31.47 1kpc s HIS 51 CO -0.07 -0.70 0.07 -0.59 -2.47 0.00 0.00 174.74 170.98 1kpc s PHE 52 N 2.15 1.92 0.21 3.88 -0.71 -0.43 -1.07 117.98 123.94 1kpc s PHE 52 Ca 0.06 -1.05 0.10 0.00 -1.04 0.00 0.00 56.93 55.00 1kpc s PHE 52 Cb -0.16 -1.31 -0.05 0.00 -1.21 0.00 0.00 43.02 40.30 1kpc s PHE 52 CO -0.25 -0.05 -0.19 -0.51 -1.34 0.00 0.00 175.22 172.88 1kpc s LEU 53 N -3.58 2.50 -0.14 -1.99 1.43 0.31 -1.02 118.68 116.20 1kpc s LEU 53 Ca 0.29 -0.94 -0.03 0.00 -1.03 0.00 0.00 54.13 52.43 1kpc s LEU 53 Cb 0.06 -0.95 0.05 0.00 0.03 0.00 0.00 46.19 45.37 1kpc s LEU 53 CO 0.14 -0.00 0.03 -0.69 0.23 0.00 0.00 176.35 176.06 1kpc s VAL 54 N -2.24 0.32 0.14 -1.59 1.01 -0.28 -1.97 120.40 115.79 1kpc s VAL 54 Ca 0.22 -0.18 0.10 0.00 0.00 0.00 0.00 61.98 62.12 1kpc s VAL 54 Cb -0.05 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 1kpc s VAL 54 CO 0.10 -0.03 -0.23 0.27 0.00 0.00 0.00 175.10 175.21 1kpc s ILE 55 N 1.97 2.08 0.62 2.22 -4.36 0.15 -1.21 121.20 122.66 1kpc s ILE 55 Ca 0.02 -1.79 -0.16 0.00 -0.26 0.00 0.00 60.65 58.46 1kpc s ILE 55 Cb -0.15 -1.90 -0.02 0.00 1.25 0.00 0.00 42.46 41.64 1kpc s ILE 55 CO -0.07 -0.05 1.08 -2.16 0.24 0.00 0.00 174.94 173.98 1kpc s PRO 56 N -2.27 3.09 0.18 0.37 0.04 -1.26 -0.96 135.00 134.19 1kpc s PRO 56 Ca 0.14 1.31 0.09 0.00 0.04 0.00 0.00 61.00 62.58 1kpc s PRO 56 Cb -0.09 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 1kpc s PRO 56 CO 0.07 -1.01 1.38 0.87 0.04 0.00 0.00 177.00 178.35 1kpc h LYS 57 N 0.31 0.00 -6.26 4.56 1.79 -1.48 -3.43 116.57 112.06 1kpc h LYS 57 Ca -0.47 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.43 1kpc h LYS 57 Cb 1.23 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.84 1kpc h LYS 57 CO 0.56 0.85 0.96 0.21 -1.08 0.00 0.00 179.45 180.95 1kpc s LYS 58 N -2.95 4.04 -1.04 3.15 2.20 -1.26 -4.91 119.74 118.97 1kpc s LYS 58 Ca 0.01 1.48 -0.24 0.00 -0.36 0.00 0.00 55.97 56.86 1kpc s LYS 58 Cb 0.10 -3.85 -0.16 0.00 -1.51 0.00 0.00 37.83 32.41 1kpc s LYS 58 CO 0.80 -0.96 1.96 1.58 -0.36 0.00 0.00 175.35 178.37 1kpc n HIS 59 N 7.28 1.95 -3.20 4.03 -0.00 -1.26 -4.89 115.22 119.14 1kpc n HIS 59 Ca 0.15 -1.08 -0.43 0.00 -0.00 0.00 0.00 57.72 56.36 1kpc n HIS 59 Cb 0.46 -2.40 -0.07 0.00 -0.00 0.00 0.00 29.99 27.97 1kpc n HIS 59 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1kpc s ILE 60 N 11.97 4.93 0.40 3.57 1.01 -1.26 -4.96 121.20 136.86 1kpc s ILE 60 Ca 0.71 -0.11 0.17 0.00 0.00 0.00 0.00 60.65 61.42 1kpc s ILE 60 Cb 0.01 -4.15 0.38 0.00 0.01 0.00 0.00 42.46 38.71 1kpc s ILE 60 CO 0.16 -0.54 1.82 0.77 0.00 0.00 0.00 174.94 177.15 1kpc h SER 61 N 8.83 0.46 -4.68 3.58 4.64 -1.90 0.32 113.55 124.78 1kpc h SER 61 Ca -0.26 0.06 0.08 0.00 -0.47 0.00 0.00 61.79 61.20 1kpc h SER 61 Cb 1.10 -0.02 -0.15 0.00 -0.31 0.00 0.00 62.40 63.02 1kpc h SER 61 CO 0.86 0.15 0.43 0.00 -0.87 0.00 0.00 176.83 177.40 1kpc s GLN 62 N -5.49 0.90 0.26 4.77 -2.07 -1.26 -2.28 119.66 114.48 1kpc s GLN 62 Ca -0.09 -0.27 -0.04 0.00 -1.82 0.00 0.00 55.36 53.14 1kpc s GLN 62 Cb 0.24 0.41 0.36 0.00 -1.09 0.00 0.00 33.01 32.94 1kpc s GLN 62 CO 0.79 -0.38 1.89 0.97 -1.32 0.00 0.00 175.29 177.24 1kpc h ILE 63 N 2.08 1.12 0.00 3.63 6.09 -1.87 -2.65 117.51 125.91 1kpc h ILE 63 Ca -0.24 -0.41 0.00 0.00 -1.37 0.00 0.00 64.86 62.84 1kpc h ILE 63 Cb 1.24 -0.17 0.00 0.00 0.47 0.00 0.00 36.82 38.36 1kpc h ILE 63 CO 0.33 0.22 0.08 0.77 -3.07 0.00 0.00 178.15 176.47 1kpc h SER 64 N 1.18 0.00 -0.10 2.19 4.64 -1.96 -0.52 113.55 118.99 1kpc h SER 64 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1kpc h SER 64 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1kpc h SER 64 CO -0.15 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.14 1kpc n VAL 65 N -2.98 0.14 -1.80 0.95 0.24 -1.00 -4.99 118.33 108.89 1kpc n VAL 65 Ca -0.03 -0.57 -0.42 0.00 -2.04 0.00 0.00 64.34 61.28 1kpc n VAL 65 Cb 0.14 1.26 -0.03 0.00 -1.47 0.00 0.00 33.84 33.74 1kpc n VAL 65 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1kpc s ALA 66 N -1.46 3.28 0.81 2.33 0.00 -0.21 -4.99 121.76 121.53 1kpc s ALA 66 Ca 0.24 0.93 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 1kpc s ALA 66 Cb 0.16 -3.90 0.08 0.00 0.00 0.00 0.00 23.12 19.46 1kpc s ALA 66 CO 0.23 -1.97 1.09 -1.83 0.00 0.00 0.00 175.76 173.28 1kpc s GLU 67 N 4.97 1.94 0.42 0.00 -1.05 -1.26 -4.89 118.70 118.84 1kpc s GLU 67 Ca 0.86 1.02 0.13 0.00 -0.15 0.00 0.00 54.97 56.84 1kpc s GLU 67 Cb -0.35 -1.87 1.00 0.00 -0.44 0.00 0.00 34.13 32.47 1kpc s GLU 67 CO 0.36 -1.82 1.95 -0.44 0.95 0.00 0.00 175.26 176.25 1kpc h ASP 68 N -1.25 0.42 0.20 0.83 5.19 -2.02 0.15 116.42 119.95 1kpc h ASP 68 Ca -0.46 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 55.95 1kpc h ASP 68 Cb 1.25 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.68 1kpc h ASP 68 CO 0.53 0.24 -0.07 0.44 -3.12 0.00 0.00 179.24 177.26 1kpc h ASP 69 N 0.46 0.00 0.03 6.45 3.32 -2.03 -1.00 116.42 123.66 1kpc h ASP 69 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1kpc h ASP 69 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1kpc h ASP 69 CO -0.10 0.07 0.00 0.47 -1.72 0.00 0.00 179.24 177.96 1kpc n ASP 70 N -3.76 0.00 0.15 6.45 8.00 0.53 -4.07 116.55 123.85 1kpc n ASP 70 Ca -0.02 -0.55 -0.09 0.00 0.71 0.00 0.00 54.79 54.83 1kpc n ASP 70 Cb 0.17 -0.02 -0.05 0.00 -0.02 0.00 0.00 41.12 41.20 1kpc n ASP 70 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 1kpc h GLU 71 N 0.00 -0.50 -0.57 -1.24 4.81 -1.29 -1.49 114.58 114.30 1kpc h GLU 71 Ca 0.00 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.37 1kpc h GLU 71 Cb 0.01 0.11 -0.11 0.00 0.63 0.00 0.00 28.75 29.40 1kpc h GLU 71 CO 0.00 -0.33 -0.29 0.77 -0.73 0.00 0.00 179.01 178.43 1kpc h SER 72 N -0.52 -1.01 -0.37 1.04 0.02 -1.83 -2.68 113.55 108.20 1kpc h SER 72 Ca -0.03 0.21 0.07 0.00 -0.84 0.00 0.00 61.79 61.20 1kpc h SER 72 Cb 0.45 0.52 -0.09 0.00 0.14 0.00 0.00 62.40 63.42 1kpc h SER 72 CO -0.04 -0.29 -0.37 0.25 -1.14 0.00 0.00 176.83 175.25 1kpc h LEU 73 N -0.14 -1.22 -0.66 5.07 5.85 -1.78 0.48 115.31 122.90 1kpc h LEU 73 Ca 0.24 0.20 0.09 0.00 0.84 0.00 0.00 57.88 59.25 1kpc h LEU 73 Cb 0.53 0.55 -0.07 0.00 0.37 0.00 0.00 40.66 42.04 1kpc h LEU 73 CO -0.65 -0.35 0.30 -0.07 -0.34 0.00 0.00 178.44 177.34 1kpc h LEU 74 N -0.31 0.38 -0.77 2.25 3.38 -0.97 -0.13 115.31 119.14 1kpc h LEU 74 Ca 0.15 0.06 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 1kpc h LEU 74 Cb 0.56 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1kpc h LEU 74 CO -0.53 0.22 -0.19 1.23 0.09 0.00 0.00 178.44 179.26 1kpc h GLY 75 N 0.53 0.79 0.53 0.83 0.00 -1.15 -2.91 103.07 101.69 1kpc h GLY 75 Ca 0.32 -0.64 0.12 0.00 0.00 0.00 0.00 47.33 47.13 1kpc h GLY 75 CO -0.27 0.59 0.62 0.84 0.00 0.00 0.00 176.54 178.32 1kpc h HIS 76 N 0.65 1.09 -0.45 5.60 -0.00 0.93 0.58 115.15 123.56 1kpc h HIS 76 Ca 0.10 0.03 0.04 0.00 -0.00 0.00 0.00 60.37 60.54 1kpc h HIS 76 Cb 0.67 -0.35 -0.04 0.00 -0.00 0.00 0.00 27.41 27.69 1kpc h HIS 76 CO 0.03 0.45 0.20 -0.07 -0.00 0.00 0.00 177.93 178.54 1kpc h LEU 77 N 0.97 0.27 -0.57 0.26 3.38 -1.18 -0.37 115.31 118.06 1kpc h LEU 77 Ca 0.48 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.46 1kpc h LEU 77 Cb 0.48 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1kpc h LEU 77 CO -0.24 0.19 0.28 0.24 0.09 0.00 0.00 178.44 179.01 1kpc h MET 78 N 0.40 0.81 0.47 1.13 2.86 -0.84 0.18 114.93 119.95 1kpc h MET 78 Ca 0.20 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.70 1kpc h MET 78 Cb 0.14 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.65 1kpc h MET 78 CO -0.16 0.65 -0.23 0.82 1.06 0.00 0.00 176.91 179.06 1kpc h ILE 79 N 0.77 0.52 -0.98 -1.22 1.08 -0.75 -0.09 117.51 116.83 1kpc h ILE 79 Ca 0.20 -0.23 0.10 0.00 -0.39 0.00 0.00 64.86 64.54 1kpc h ILE 79 Cb 0.10 0.62 -0.08 0.00 -3.07 0.00 0.00 36.82 34.40 1kpc h ILE 79 CO -0.03 0.04 0.62 0.58 -0.69 0.00 0.00 178.15 178.68 1kpc h VAL 80 N -0.77 0.97 0.25 1.67 2.07 -1.05 0.41 116.25 119.80 1kpc h VAL 80 Ca -0.06 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 1kpc h VAL 80 Cb 0.55 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1kpc h VAL 80 CO 0.11 0.19 -0.20 1.23 0.02 0.00 0.00 177.57 178.91 1kpc h GLY 81 N 1.02 -0.47 0.95 2.17 0.00 -0.40 0.18 103.07 106.52 1kpc h GLY 81 Ca 0.46 0.23 0.02 0.00 0.00 0.00 0.00 47.33 48.04 1kpc h GLY 81 CO -0.22 -0.20 0.62 0.07 0.00 0.00 0.00 176.54 176.81 1kpc h LYS 82 N -0.46 1.20 -0.04 4.80 5.09 -0.56 -1.22 116.57 125.39 1kpc h LYS 82 Ca -0.01 -0.07 -0.00 0.00 0.09 0.00 0.00 60.65 60.65 1kpc h LYS 82 Cb 0.41 -0.27 -0.00 0.00 0.10 0.00 0.00 32.23 32.47 1kpc h LYS 82 CO -0.02 0.80 0.02 0.87 -2.09 0.00 0.00 179.45 179.03 1kpc h LYS 83 N 1.24 0.05 -0.51 0.07 1.57 -0.48 -1.67 116.57 116.84 1kpc h LYS 83 Ca 0.36 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.17 1kpc h LYS 83 Cb -0.08 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1kpc h LYS 83 CO -0.09 0.12 0.34 0.00 -0.57 0.00 0.00 179.45 179.25 1kpc h ALA 85 N 1.71 0.63 -0.34 0.00 0.00 -0.65 -1.03 119.26 119.57 1kpc h ALA 85 Ca 0.21 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1kpc h ALA 85 Cb 0.14 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1kpc h ALA 85 CO -0.05 0.22 0.15 0.00 0.00 0.00 0.00 179.25 179.56 1kpc h ALA 86 N 1.05 0.44 -0.56 0.00 0.00 -0.40 -0.57 119.26 119.22 1kpc h ALA 86 Ca 0.16 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1kpc h ALA 86 Cb 0.17 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1kpc h ALA 86 CO -0.02 0.02 0.13 -0.44 0.00 0.00 0.00 179.25 178.95 1kpc h ASP 87 N 0.41 0.80 0.22 0.00 3.32 -0.99 -1.63 116.42 118.56 1kpc h ASP 87 Ca 0.11 -0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.02 1kpc h ASP 87 Cb 0.15 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1kpc h ASP 87 CO -0.01 0.79 0.00 0.18 -1.72 0.00 0.00 179.24 178.47 1kpc n LEU 88 N -4.27 0.00 -0.01 1.55 4.77 -0.40 -4.92 117.00 113.72 1kpc n LEU 88 Ca 0.04 0.12 -0.00 0.00 -0.03 0.00 0.00 56.01 56.14 1kpc n LEU 88 Cb 0.23 -0.12 -0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1kpc n LEU 88 CO 0.40 -0.01 -0.00 0.61 -1.33 0.00 0.00 177.39 177.06 1kpc n GLY 89 N 0.99 0.48 2.94 -0.72 0.00 -0.53 -4.95 105.19 103.40 1kpc n GLY 89 Ca 0.19 -0.13 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 1kpc n GLY 89 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1kpc n LEU 90 N -0.01 3.84 0.05 0.99 4.77 -0.33 -4.69 117.00 121.62 1kpc n LEU 90 Ca -0.00 -2.64 0.12 0.00 -0.03 0.00 0.00 56.01 53.46 1kpc n LEU 90 Cb 0.02 -1.01 0.46 0.00 -2.33 0.00 0.00 43.42 40.56 1kpc n LEU 90 CO 0.00 -0.19 0.86 -0.46 -1.33 0.00 0.00 177.39 176.27 1kpc n ASN 91 N 6.18 0.34 -0.79 -1.43 6.94 -1.26 -2.71 115.26 122.53 1kpc n ASN 91 Ca 0.43 0.55 0.12 0.00 -0.02 0.00 0.00 54.58 55.67 1kpc n ASN 91 Cb 0.27 -0.64 0.30 0.00 -2.36 0.00 0.00 39.78 37.36 1kpc n ASN 91 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1kpc n LYS 92 N -1.85 2.05 0.00 -3.83 5.02 -1.26 -5.07 118.16 113.22 1kpc n LYS 92 Ca 0.05 -1.56 0.00 0.00 -2.02 0.00 0.00 58.31 54.77 1kpc n LYS 92 Cb 0.30 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.85 1kpc n LYS 92 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1kpc n GLY 93 N 1.29 -0.71 3.59 0.72 0.00 -1.10 -5.07 105.19 103.91 1kpc n GLY 93 Ca 0.17 -2.23 0.04 0.00 0.00 0.00 0.00 46.02 44.00 1kpc n GLY 93 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1kpc s TYR 94 N -0.36 -0.00 -0.04 1.61 -0.85 -1.26 -4.57 117.35 111.88 1kpc s TYR 94 Ca 0.00 -0.00 0.03 0.00 -0.52 0.00 0.00 57.07 56.58 1kpc s TYR 94 Cb 0.00 0.50 0.00 0.00 0.38 0.00 0.00 41.96 42.84 1kpc s TYR 94 CO 0.00 -0.01 -0.13 0.50 -1.52 0.00 0.00 175.55 174.39 1kpc s ARG 95 N -2.01 1.44 -0.13 -3.49 3.52 -0.33 -4.96 118.95 112.99 1kpc s ARG 95 Ca 0.16 -0.46 -0.06 0.00 -0.13 0.00 0.00 55.73 55.25 1kpc s ARG 95 Cb 0.07 -1.27 -0.04 0.00 -1.56 0.00 0.00 34.95 32.16 1kpc s ARG 95 CO -0.07 0.16 0.07 -1.64 -0.81 0.00 0.00 175.30 173.01 1kpc s MET 96 N 0.20 3.47 -0.02 5.12 -1.94 -1.26 -1.44 119.30 123.42 1kpc s MET 96 Ca -0.05 -0.28 -0.00 0.00 -1.71 0.00 0.00 55.69 53.65 1kpc s MET 96 Cb -0.11 -3.08 0.03 0.00 2.01 0.00 0.00 34.83 33.68 1kpc s MET 96 CO 0.02 0.60 0.04 0.08 -0.01 0.00 0.00 175.02 175.74 1kpc s VAL 97 N -0.55 -0.06 -0.18 -6.03 1.01 -0.82 -4.95 120.40 108.82 1kpc s VAL 97 Ca 0.11 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.33 1kpc s VAL 97 Cb -0.12 -0.09 0.01 0.00 0.00 0.00 0.00 36.38 36.18 1kpc s VAL 97 CO 0.02 0.10 -0.17 -0.69 0.00 0.00 0.00 175.10 174.35 1kpc s VAL 98 N 1.17 2.31 -0.14 2.92 1.01 -1.26 -0.61 120.40 125.80 1kpc s VAL 98 Ca -0.08 -0.86 -0.14 0.00 0.00 0.00 0.00 61.98 60.90 1kpc s VAL 98 Cb -0.13 -1.98 -0.05 0.00 0.00 0.00 0.00 36.38 34.22 1kpc s VAL 98 CO -0.03 0.52 0.31 0.20 0.00 0.00 0.00 175.10 176.10 1kpc s ASN 99 N 1.27 6.49 -0.15 3.32 0.01 -1.26 -5.08 114.94 119.54 1kpc s ASN 99 Ca 0.04 0.58 0.00 0.00 -0.71 0.00 0.00 52.86 52.77 1kpc s ASN 99 Cb -0.13 -2.19 -0.00 0.00 0.41 0.00 0.00 41.25 39.33 1kpc s ASN 99 CO -0.10 0.14 -0.15 -0.70 -1.51 0.00 0.00 177.10 174.78 1kpc s GLU 100 N 0.18 3.23 1.32 -0.60 2.56 -1.26 -4.67 118.70 119.46 1kpc s GLU 100 Ca 0.18 -0.75 0.00 0.00 0.00 0.00 0.00 54.97 54.40 1kpc s GLU 100 Cb -0.13 -2.61 0.00 0.00 2.00 0.00 0.00 34.13 33.39 1kpc s GLU 100 CO 0.05 0.05 0.00 0.41 -0.56 0.00 0.00 175.26 175.21 1kpc n GLY 101 N 3.96 0.90 0.27 -1.50 0.00 -1.26 -1.70 105.19 105.86 1kpc n GLY 101 Ca -0.19 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.12 1kpc n GLY 101 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1kpc h SER 102 N 2.84 -0.62 0.38 1.61 0.87 -1.97 0.13 113.55 116.80 1kpc h SER 102 Ca 0.00 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.58 1kpc h SER 102 Cb 0.00 0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1kpc h SER 102 CO 0.00 -0.40 -0.06 0.44 -0.53 0.00 0.00 176.83 176.28 1kpc h ASP 103 N -0.65 0.00 1.08 6.23 3.32 -2.00 -1.35 116.42 123.05 1kpc h ASP 103 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1kpc h ASP 103 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1kpc h ASP 103 CO 0.08 0.06 0.00 0.61 -1.72 0.00 0.00 179.24 178.27 1kpc n GLY 104 N -0.68 -1.52 2.87 2.75 0.00 -0.69 -4.92 105.19 103.00 1kpc n GLY 104 Ca -0.02 -0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.75 1kpc n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kpc n GLY 105 N 1.38 -0.19 3.61 -0.02 0.00 -0.51 -4.21 105.19 105.24 1kpc n GLY 105 Ca 0.06 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 1kpc n GLY 105 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1kpc s GLN 106 N -5.68 3.55 0.19 1.61 0.74 0.36 -4.87 119.66 115.55 1kpc s GLN 106 Ca 0.33 1.23 0.10 0.00 0.05 0.00 0.00 55.36 57.07 1kpc s GLN 106 Cb -0.14 -4.08 -0.08 0.00 1.10 0.00 0.00 33.01 29.81 1kpc s GLN 106 CO 0.41 -1.60 1.36 0.66 -0.55 0.00 0.00 175.29 175.57 1kpc h SER 107 N 11.36 0.00 -3.51 6.67 4.64 -1.91 -3.46 113.55 127.34 1kpc h SER 107 Ca -0.30 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.68 1kpc h SER 107 Cb 1.13 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.89 1kpc h SER 107 CO 1.05 0.80 -0.74 -0.69 -0.87 0.00 0.00 176.83 176.38 1kpc s VAL 108 N -2.84 0.13 -1.07 0.95 1.01 -1.26 -5.07 120.40 112.24 1kpc s VAL 108 Ca 0.02 0.11 -0.08 0.00 0.00 0.00 0.00 61.98 62.03 1kpc s VAL 108 Cb 0.09 -0.23 -0.12 0.00 0.00 0.00 0.00 36.38 36.13 1kpc s VAL 108 CO 0.79 0.13 2.84 -1.22 0.00 0.00 0.00 175.10 177.64 1kpc n TYR 109 N 4.10 1.59 -3.35 5.22 4.01 -1.26 -4.56 117.16 122.91 1kpc n TYR 109 Ca -0.27 -2.40 -0.04 0.00 -0.16 0.00 0.00 57.90 55.03 1kpc n TYR 109 Cb 0.50 -2.05 -0.05 0.00 -0.31 0.00 0.00 39.34 37.43 1kpc n TYR 109 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1kpc s HIS 110 N 2.22 -1.15 0.18 -0.72 2.46 -0.97 -4.18 115.29 113.14 1kpc s HIS 110 Ca 0.60 1.38 -0.30 0.00 0.47 0.00 0.00 55.06 57.21 1kpc s HIS 110 Cb 0.19 0.33 -0.17 0.00 -0.13 0.00 0.00 32.58 32.80 1kpc s HIS 110 CO -0.04 -0.74 0.76 0.28 -2.47 0.00 0.00 174.74 172.54 1kpc n VAL 111 N 5.40 1.58 -3.69 0.89 0.31 0.11 -4.94 118.33 117.99 1kpc n VAL 111 Ca -0.04 -0.39 -0.12 0.00 -0.01 0.00 0.00 64.34 63.78 1kpc n VAL 111 Cb 0.50 -0.28 -0.09 0.00 -0.91 0.00 0.00 33.84 33.06 1kpc n VAL 111 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 1kpc s HIS 112 N -0.77 -0.64 -0.21 3.52 -3.43 -1.26 -4.12 115.29 108.39 1kpc s HIS 112 Ca 0.68 1.44 -0.11 0.00 -0.80 0.00 0.00 55.06 56.27 1kpc s HIS 112 Cb -0.93 0.27 -0.05 0.00 -1.43 0.00 0.00 32.58 30.44 1kpc s HIS 112 CO 0.56 -0.32 0.17 -1.17 -2.00 0.00 0.00 174.74 171.98 1kpc s LEU 113 N 0.79 4.18 0.20 5.38 2.96 -0.35 -4.54 118.68 127.30 1kpc s LEU 113 Ca -0.04 0.24 -0.06 0.00 -0.22 0.00 0.00 54.13 54.05 1kpc s LEU 113 Cb -0.05 -2.15 -0.06 0.00 0.50 0.00 0.00 46.19 44.43 1kpc s LEU 113 CO -0.06 0.12 0.46 -1.00 -1.32 0.00 0.00 176.35 174.55 1kpc s HIS 114 N 0.63 3.46 -0.16 5.38 3.76 0.22 -1.13 115.29 127.45 1kpc s HIS 114 Ca 0.09 0.63 -0.04 0.00 -0.15 0.00 0.00 55.06 55.59 1kpc s HIS 114 Cb -0.12 -2.07 0.08 0.00 1.11 0.00 0.00 32.58 31.57 1kpc s HIS 114 CO 0.01 0.33 0.26 0.08 -0.85 0.00 0.00 174.74 174.57 1kpc s VAL 115 N -1.81 -0.41 0.06 -0.90 1.01 -0.19 -1.94 120.40 116.22 1kpc s VAL 115 Ca 0.43 0.15 0.08 0.00 0.00 0.00 0.00 61.98 62.64 1kpc s VAL 115 Cb -0.11 -0.54 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 1kpc s VAL 115 CO 0.25 0.02 -0.23 -0.76 0.00 0.00 0.00 175.10 174.38 1kpc s LEU 116 N 2.41 2.19 0.00 3.92 1.02 -0.52 -1.31 118.68 126.38 1kpc s LEU 116 Ca 0.04 -0.58 -0.03 0.00 0.02 0.00 0.00 54.13 53.58 1kpc s LEU 116 Cb -0.13 -1.10 0.01 0.00 0.02 0.00 0.00 46.19 44.99 1kpc s LEU 116 CO -0.10 0.19 0.19 0.61 0.02 0.00 0.00 176.35 177.26 1kpc n GLY 117 N 1.69 2.10 1.73 -3.19 0.00 -0.11 -1.18 105.19 106.23 1kpc n GLY 117 Ca -0.17 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.64 1kpc n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kpc n GLY 118 N -0.15 0.61 3.64 -0.02 0.00 -1.26 -2.03 105.19 105.96 1kpc n GLY 118 Ca -0.02 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 1kpc n GLY 118 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1kpc s ARG 119 N -0.16 0.59 -0.06 1.61 1.70 -1.26 -4.54 118.95 116.84 1kpc s ARG 119 Ca 0.00 -0.30 -0.30 0.00 -0.47 0.00 0.00 55.73 54.66 1kpc s ARG 119 Cb 0.00 0.22 -0.04 0.00 -0.57 0.00 0.00 34.95 34.56 1kpc s ARG 119 CO 0.00 -0.27 1.27 -1.14 -1.08 0.00 0.00 175.30 174.08 1kpc s GLN 120 N -2.68 4.31 0.52 3.89 2.00 -1.26 -4.97 119.66 121.47 1kpc s GLN 120 Ca 0.12 1.76 -0.14 0.00 -2.00 0.00 0.00 55.36 55.10 1kpc s GLN 120 Cb 0.02 -3.60 -0.07 0.00 0.80 0.00 0.00 33.01 30.16 1kpc s GLN 120 CO -0.03 -0.52 0.95 -1.64 -0.50 0.00 0.00 175.29 173.55 1kpc s MET 121 N 2.48 3.83 0.43 1.67 -1.94 -1.26 -5.07 119.30 119.45 1kpc s MET 121 Ca 0.58 0.80 0.06 0.00 -1.71 0.00 0.00 55.69 55.42 1kpc s MET 121 Cb -0.26 -2.18 -0.06 0.00 2.01 0.00 0.00 34.83 34.35 1kpc s MET 121 CO 0.22 -0.29 0.06 -1.01 -0.01 0.00 0.00 175.02 173.99 1kpc s HIS 122 N -2.71 2.40 -0.06 -0.03 0.09 -1.26 -5.13 115.29 108.59 1kpc s HIS 122 Ca 0.56 -0.70 0.02 0.00 -0.00 0.00 0.00 55.06 54.94 1kpc s HIS 122 Cb -0.10 -1.80 0.02 0.00 -0.00 0.00 0.00 32.58 30.69 1kpc s HIS 122 CO 0.37 0.32 -0.09 -0.46 -0.00 0.00 0.00 174.74 174.87 1kpc s TRP 123 N -2.71 1.25 1.01 1.40 -0.00 -1.26 -3.11 118.94 115.52 1kpc s TRP 123 Ca 0.32 -0.46 -0.12 0.00 -0.00 0.00 0.00 56.10 55.83 1kpc s TRP 123 Cb 0.07 -0.97 0.20 0.00 -0.00 0.00 0.00 33.47 32.76 1kpc s TRP 123 CO 0.17 -0.28 1.08 -1.25 -0.00 0.00 0.00 176.95 176.67 1kpc s PRO 124 N 0.87 0.30 -1.28 5.86 0.04 -1.26 -5.06 135.00 134.47 1kpc s PRO 124 Ca -0.11 0.68 -0.08 0.00 0.04 0.00 0.00 61.00 61.53 1kpc s PRO 124 Cb -0.15 -1.71 0.16 0.00 0.04 0.00 0.00 34.50 32.84 1kpc s PRO 124 CO 0.01 -2.86 2.01 -0.35 0.04 0.00 0.00 177.00 175.85 1kpc n PRO 125 N -4.29 3.98 -0.16 0.56 -0.04 -1.18 -5.19 135.00 128.68 1kpc n PRO 125 Ca 0.05 -3.57 0.00 0.00 -0.04 0.00 0.00 63.50 59.94 1kpc n PRO 125 Cb 0.56 -2.81 0.00 0.00 -0.04 0.00 0.00 33.50 31.21 1kpc n PRO 125 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87