#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k0t n HIS 2 N 0.00 0.23 -1.05 0.66 8.25 -1.26 -4.51 115.22 117.54 1k0t n HIS 2 Ca 0.00 1.00 0.00 0.00 -0.26 0.00 0.00 57.72 58.46 1k0t n HIS 2 Cb 0.00 -2.05 0.00 0.00 1.12 0.00 0.00 29.99 29.06 1k0t n HIS 2 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1k0t n SER 3 N 1.73 -0.28 -3.80 0.41 3.41 -1.23 -4.72 113.62 109.14 1k0t n SER 3 Ca 0.19 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.58 1k0t n SER 3 Cb 0.16 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.10 1k0t n SER 3 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1k0t n VAL 4 N 0.00 -1.13 -0.44 -3.33 0.24 -1.26 -4.82 118.33 107.59 1k0t n VAL 4 Ca 0.00 -0.29 -0.30 0.00 -2.04 0.00 0.00 64.34 61.72 1k0t n VAL 4 Cb 0.00 -0.98 0.28 0.00 -1.47 0.00 0.00 33.84 31.67 1k0t n VAL 4 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1k0t s LYS 5 N -6.03 -2.19 -1.00 7.34 -2.85 -1.26 -4.52 119.74 109.22 1k0t s LYS 5 Ca 0.19 0.40 -0.03 0.00 -1.00 0.00 0.00 55.97 55.53 1k0t s LYS 5 Cb -0.11 -1.44 0.29 0.00 -2.06 0.00 0.00 37.83 34.51 1k0t s LYS 5 CO 0.50 -4.45 1.24 -0.89 0.10 0.00 0.00 175.35 171.84 1k0t n ILE 6 N -5.37 4.53 -4.38 3.79 -0.00 -1.26 -4.31 119.36 112.35 1k0t n ILE 6 Ca 0.08 -5.65 -0.19 0.00 -0.00 0.00 0.00 62.75 56.99 1k0t n ILE 6 Cb 0.58 -2.20 -0.10 0.00 -0.00 0.00 0.00 39.64 37.91 1k0t n ILE 6 CO 0.00 0.00 0.00 -0.31 -0.00 0.00 0.00 176.55 176.24 1k0t s TYR 7 N -2.34 1.73 -0.32 1.39 1.51 -1.26 -5.03 117.35 113.03 1k0t s TYR 7 Ca 0.32 -0.94 -0.02 0.00 -1.01 0.00 0.00 57.07 55.42 1k0t s TYR 7 Cb 0.02 -1.05 0.14 0.00 -0.11 0.00 0.00 41.96 40.97 1k0t s TYR 7 CO 0.03 -0.02 2.29 -0.40 -1.11 0.00 0.00 175.55 176.34 1k0t n ASP 8 N -0.53 6.36 -4.42 2.29 5.75 -1.26 -4.79 116.55 119.95 1k0t n ASP 8 Ca -0.04 -3.04 -0.44 0.00 -0.01 0.00 0.00 54.79 51.26 1k0t n ASP 8 Cb 0.65 -1.12 -0.03 0.00 -1.03 0.00 0.00 41.12 39.59 1k0t n ASP 8 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1k0t s THR 9 N -2.00 4.87 -0.06 2.12 -1.32 -1.26 -4.96 115.64 113.03 1k0t s THR 9 Ca 0.38 -1.54 -0.25 0.00 -1.21 0.00 0.00 61.69 59.07 1k0t s THR 9 Cb 0.27 -4.67 0.05 0.00 -1.51 0.00 0.00 72.50 66.64 1k0t s THR 9 CO -0.06 -1.36 0.55 0.00 -2.21 0.00 0.00 174.62 171.55 1k0t n ILE 11 N 1.21 0.03 0.00 0.00 -6.64 -1.26 -4.98 119.36 107.72 1k0t n ILE 11 Ca -0.19 -0.25 0.00 0.00 -1.77 0.00 0.00 62.75 60.53 1k0t n ILE 11 Cb 0.57 0.20 0.00 0.00 -1.44 0.00 0.00 39.64 38.97 1k0t n ILE 11 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1k0t n GLY 12 N 1.92 1.58 3.76 3.28 0.00 -1.26 -5.01 105.19 109.46 1k0t n GLY 12 Ca -0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 1k0t n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0t n THR 14 N -1.31 0.70 -0.05 0.00 -2.24 -1.26 -4.86 114.28 105.27 1k0t n THR 14 Ca -0.02 -4.53 -0.11 0.00 -2.27 0.00 0.00 64.05 57.11 1k0t n THR 14 Cb 0.65 -2.01 -0.04 0.00 -2.10 0.00 0.00 70.33 66.83 1k0t n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k0t n GLN 15 N 1.32 0.24 -0.03 -0.78 10.64 -1.26 -4.50 117.38 123.01 1k0t n GLN 15 Ca 0.25 0.10 0.01 0.00 -1.83 0.00 0.00 57.00 55.53 1k0t n GLN 15 Cb 0.46 -0.94 0.02 0.00 -0.86 0.00 0.00 30.24 28.93 1k0t n GLN 15 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1k0t n VAL 17 N -0.28 0.53 0.01 0.00 0.31 -1.26 -4.70 118.33 112.94 1k0t n VAL 17 Ca 0.02 -0.77 -0.02 0.00 -0.01 0.00 0.00 64.34 63.56 1k0t n VAL 17 Cb 0.09 0.79 -0.01 0.00 -0.91 0.00 0.00 33.84 33.81 1k0t n VAL 17 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1k0t n ARG 18 N 0.19 0.05 -2.09 5.55 3.00 -0.98 -4.91 116.66 117.47 1k0t n ARG 18 Ca 0.05 0.02 -0.29 0.00 -0.01 0.00 0.00 57.85 57.62 1k0t n ARG 18 Cb 0.26 -0.58 -0.05 0.00 0.00 0.00 0.00 32.46 32.09 1k0t n ARG 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1k0t s ALA 19 N -2.05 1.77 -0.30 7.54 0.00 -1.15 -4.71 121.76 122.86 1k0t s ALA 19 Ca -0.03 -1.50 -0.17 0.00 0.00 0.00 0.00 51.96 50.26 1k0t s ALA 19 Cb 0.01 -4.53 0.18 0.00 0.00 0.00 0.00 23.12 18.77 1k0t s ALA 19 CO 0.04 -4.66 1.21 0.00 0.00 0.00 0.00 175.76 172.35 1k0t h PRO 21 N 7.39 -0.01 0.00 0.00 0.13 -1.97 -3.13 132.00 134.41 1k0t h PRO 21 Ca -0.11 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1k0t h PRO 21 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1k0t h PRO 21 CO -0.20 0.72 -0.00 -0.07 -0.23 0.00 0.00 178.00 178.21 1k0t h LEU 22 N -0.76 0.00 -2.30 1.56 4.07 -1.97 -3.46 115.31 112.44 1k0t h LEU 22 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1k0t h LEU 22 Cb 0.73 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.47 1k0t h LEU 22 CO 0.00 0.00 -0.44 0.47 -1.08 0.00 0.00 178.44 177.39 1k0t n ASP 23 N -3.16 -7.83 -0.04 -0.43 9.92 -1.18 -4.96 116.55 108.86 1k0t n ASP 23 Ca -0.03 0.47 -0.06 0.00 -0.53 0.00 0.00 54.79 54.65 1k0t n ASP 23 Cb 0.09 -5.31 -0.05 0.00 -0.64 0.00 0.00 41.12 35.21 1k0t n ASP 23 CO 0.00 0.00 0.00 0.55 0.13 0.00 0.00 177.20 177.88 1k0t n VAL 24 N -0.45 0.55 -2.10 2.53 3.14 -1.26 -4.98 118.33 115.75 1k0t n VAL 24 Ca 0.11 -0.25 -0.42 0.00 -2.96 0.00 0.00 64.34 60.81 1k0t n VAL 24 Cb 0.46 -0.83 -0.03 0.00 -1.06 0.00 0.00 33.84 32.38 1k0t n VAL 24 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1k0t s LEU 25 N -5.20 4.35 0.00 6.55 1.02 -1.26 -4.59 118.68 119.54 1k0t s LEU 25 Ca -0.10 2.33 0.00 0.00 0.02 0.00 0.00 54.13 56.39 1k0t s LEU 25 Cb 0.03 -3.57 -0.00 0.00 0.02 0.00 0.00 46.19 42.66 1k0t s LEU 25 CO 0.26 -0.75 0.02 -0.62 0.02 0.00 0.00 176.35 175.28 1k0t n GLU 26 N 4.79 0.43 -3.93 1.70 -0.58 0.10 -4.98 120.64 118.18 1k0t n GLU 26 Ca 0.13 -0.24 -0.35 0.00 -0.42 0.00 0.00 57.16 56.28 1k0t n GLU 26 Cb 0.42 0.17 -0.08 0.00 -0.57 0.00 0.00 31.44 31.37 1k0t n GLU 26 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1k0t s MET 27 N -2.10 3.84 0.34 3.49 0.23 -1.26 -1.52 119.30 122.31 1k0t s MET 27 Ca 0.02 -0.27 0.10 0.00 -1.03 0.00 0.00 55.69 54.51 1k0t s MET 27 Cb 0.00 -3.23 -0.06 0.00 -1.53 0.00 0.00 34.83 30.00 1k0t s MET 27 CO 0.02 0.43 -0.08 0.14 -2.03 0.00 0.00 175.02 173.49 1k0t s VAL 28 N -0.04 2.34 -0.38 5.16 -7.23 -0.53 -4.93 120.40 114.79 1k0t s VAL 28 Ca 0.08 -2.18 -0.29 0.00 -1.81 0.00 0.00 61.98 57.78 1k0t s VAL 28 Cb -0.12 -2.65 0.01 0.00 0.56 0.00 0.00 36.38 34.18 1k0t s VAL 28 CO 0.00 -0.22 1.39 -2.16 -0.31 0.00 0.00 175.10 173.81 1k0t s PRO 29 N -3.62 3.66 0.38 4.82 0.04 -1.26 -1.88 135.00 137.13 1k0t s PRO 29 Ca 0.33 1.03 0.04 0.00 0.04 0.00 0.00 61.00 62.43 1k0t s PRO 29 Cb 0.01 -3.99 -0.04 0.00 0.04 0.00 0.00 34.50 30.51 1k0t s PRO 29 CO 0.17 -1.46 0.07 -0.46 0.04 0.00 0.00 177.00 175.36 1k0t s TRP 30 N 5.19 1.93 -0.39 0.56 -0.11 0.27 -4.76 118.94 121.62 1k0t s TRP 30 Ca 0.60 -1.05 0.11 0.00 1.22 0.00 0.00 56.10 56.98 1k0t s TRP 30 Cb -0.15 -1.31 0.34 0.00 -1.50 0.00 0.00 33.47 30.85 1k0t s TRP 30 CO 0.30 -0.04 0.72 -3.47 -4.62 0.00 0.00 176.95 169.84 1k0t n ASP 31 N -0.99 1.07 0.00 5.86 2.03 -1.26 -3.62 116.55 119.64 1k0t n ASP 31 Ca -0.06 -3.03 0.00 0.00 0.52 0.00 0.00 54.79 52.22 1k0t n ASP 31 Cb 0.66 -0.62 0.00 0.00 -0.72 0.00 0.00 41.12 40.44 1k0t n ASP 31 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1k0t n GLY 32 N 0.39 0.12 3.74 0.27 0.00 -1.26 -5.02 105.19 103.43 1k0t n GLY 32 Ca 0.25 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1k0t n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0t h LYS 34 N -1.72 0.00 -0.10 0.00 1.79 -1.95 -1.46 116.57 113.14 1k0t h LYS 34 Ca -0.52 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.95 1k0t h LYS 34 Cb 1.33 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 1k0t h LYS 34 CO 0.58 0.09 0.00 0.00 -1.08 0.00 0.00 179.45 179.04 1k0t n ALA 35 N -2.20 2.51 -4.03 3.86 0.00 -1.26 -4.98 120.51 114.41 1k0t n ALA 35 Ca -0.01 -2.42 -0.32 0.00 0.00 0.00 0.00 53.44 50.69 1k0t n ALA 35 Cb 0.25 -0.49 -0.02 0.00 0.00 0.00 0.00 19.45 19.19 1k0t n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k0t n GLY 36 N -1.03 -0.43 3.18 0.00 0.00 -0.55 -4.87 105.19 101.49 1k0t n GLY 36 Ca 0.17 0.24 -0.10 0.00 0.00 0.00 0.00 46.02 46.33 1k0t n GLY 36 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1k0t s GLN 37 N -6.86 0.27 -0.08 1.61 1.03 -1.24 -0.57 119.66 113.83 1k0t s GLN 37 Ca 0.17 0.93 -0.14 0.00 0.04 0.00 0.00 55.36 56.37 1k0t s GLN 37 Cb -0.08 0.19 -0.05 0.00 0.03 0.00 0.00 33.01 33.11 1k0t s GLN 37 CO 0.93 -0.28 0.34 -1.50 -2.54 0.00 0.00 175.29 172.24 1k0t s ILE 38 N 2.56 5.20 -0.67 3.63 1.10 -0.79 -4.70 121.20 127.53 1k0t s ILE 38 Ca -0.00 0.67 -0.27 0.00 -0.51 0.00 0.00 60.65 60.54 1k0t s ILE 38 Cb -0.12 -3.65 0.02 0.00 0.15 0.00 0.00 42.46 38.86 1k0t s ILE 38 CO -0.12 0.50 1.37 0.00 -2.11 0.00 0.00 174.94 174.58 1k0t s ALA 39 N -0.44 2.72 0.00 1.50 0.00 -1.26 -1.45 121.76 122.83 1k0t s ALA 39 Ca 0.21 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1k0t s ALA 39 Cb -0.15 -4.21 0.00 0.00 0.00 0.00 0.00 23.12 18.77 1k0t s ALA 39 CO 0.09 -3.22 0.00 0.43 0.00 0.00 0.00 175.76 173.06 1k0t n SER 40 N 9.71 0.66 -3.90 0.00 7.64 -0.58 -4.93 113.62 122.22 1k0t n SER 40 Ca 0.08 -0.88 -0.30 0.00 1.01 0.00 0.00 58.87 58.78 1k0t n SER 40 Cb 0.49 0.00 -0.14 0.00 -1.01 0.00 0.00 64.21 63.56 1k0t n SER 40 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1k0t s SER 41 N -0.76 4.20 -0.03 6.43 0.01 -1.26 0.03 113.70 122.32 1k0t s SER 41 Ca 0.00 -2.97 -0.05 0.00 1.31 0.00 0.00 55.95 54.24 1k0t s SER 41 Cb 0.00 -1.53 -0.03 0.00 0.21 0.00 0.00 66.02 64.68 1k0t s SER 41 CO 0.00 -0.23 0.32 1.55 0.41 0.00 0.00 173.24 175.29 1k0t h PRO 42 N 6.50 -0.17 -4.29 12.44 0.13 -1.90 -3.39 132.00 141.33 1k0t h PRO 42 Ca -0.06 0.01 -0.76 0.00 -0.87 0.00 0.00 66.00 64.32 1k0t h PRO 42 Cb 0.89 0.04 -0.22 0.00 0.13 0.00 0.00 31.00 31.84 1k0t h PRO 42 CO 0.65 -0.11 0.97 1.03 -0.23 0.00 0.00 178.00 180.31 1k0t s ARG 43 N -2.08 4.11 -0.19 0.86 1.81 -1.26 -4.81 118.95 117.39 1k0t s ARG 43 Ca -0.03 -2.80 0.02 0.00 -1.72 0.00 0.00 55.73 51.20 1k0t s ARG 43 Cb 0.00 -4.85 0.29 0.00 -0.45 0.00 0.00 34.95 29.94 1k0t s ARG 43 CO 0.08 -1.56 1.38 2.41 -0.68 0.00 0.00 175.30 176.93 1k0t n THR 44 N 3.89 1.92 0.31 0.02 -1.04 -1.26 -4.30 114.28 113.82 1k0t n THR 44 Ca 0.31 -0.81 0.18 0.00 -2.04 0.00 0.00 64.05 61.69 1k0t n THR 44 Cb 0.42 -0.77 1.01 0.00 -1.82 0.00 0.00 70.33 69.17 1k0t n THR 44 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 1k0t h GLU 45 N 0.45 0.00 -4.19 -2.82 4.11 -1.96 -3.34 114.58 106.83 1k0t h GLU 45 Ca 0.27 0.00 -0.62 0.00 0.07 0.00 0.00 59.36 59.08 1k0t h GLU 45 Cb 1.78 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 30.64 1k0t h GLU 45 CO 0.47 0.01 -0.75 -0.51 0.07 0.00 0.00 179.01 178.30 1k0t s ASP 46 N -5.78 4.23 0.00 3.06 1.11 -1.26 -4.99 116.67 113.05 1k0t s ASP 46 Ca -0.05 -1.68 0.00 0.00 0.18 0.00 0.00 52.55 51.00 1k0t s ASP 46 Cb 0.14 -1.23 0.00 0.00 1.07 0.00 0.00 42.92 42.90 1k0t s ASP 46 CO 0.50 -0.35 0.00 0.00 1.18 0.00 0.00 175.17 176.50 1k0t n VAL 48 N 0.00 3.45 -3.49 0.00 0.24 -1.26 -4.87 118.33 112.41 1k0t n VAL 48 Ca 0.00 -3.60 -0.33 0.00 -2.04 0.00 0.00 64.34 58.37 1k0t n VAL 48 Cb 0.00 -1.41 0.03 0.00 -1.47 0.00 0.00 33.84 30.99 1k0t n VAL 48 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k0t n GLY 49 N 0.13 -0.26 0.12 7.63 0.00 -1.26 -4.85 105.19 106.70 1k0t n GLY 49 Ca 0.51 1.06 -0.01 0.00 0.00 0.00 0.00 46.02 47.59 1k0t n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0t n LYS 51 N -3.42 -0.07 0.00 0.00 4.81 -1.26 -5.01 118.16 113.21 1k0t n LYS 51 Ca 0.00 0.02 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 1k0t n LYS 51 Cb 0.75 -1.85 0.00 0.00 0.02 0.00 0.00 35.03 33.96 1k0t n LYS 51 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 1k0t n ARG 52 N -1.42 0.00 0.00 1.64 3.00 -1.26 -4.89 116.66 113.73 1k0t n ARG 52 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1k0t n ARG 52 Cb 0.50 -0.88 0.00 0.00 0.00 0.00 0.00 32.46 32.08 1k0t n ARG 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1k0t n GLU 54 N -0.47 -0.90 -0.85 0.00 0.00 -1.26 -4.71 120.64 112.45 1k0t n GLU 54 Ca 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 57.16 57.20 1k0t n GLU 54 Cb 0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 31.44 28.15 1k0t n GLU 54 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1k0t n THR 55 N -4.37 0.00 0.00 6.31 5.66 -1.26 -5.03 114.28 115.58 1k0t n THR 55 Ca -0.29 -0.02 0.00 0.00 -3.05 0.00 0.00 64.05 60.69 1k0t n THR 55 Cb 0.64 0.33 0.00 0.00 -1.55 0.00 0.00 70.33 69.75 1k0t n THR 55 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1k0t n ALA 56 N -0.02 -0.26 0.00 1.79 0.00 -1.26 -3.77 120.51 116.99 1k0t n ALA 56 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1k0t n ALA 56 Cb 0.54 0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.09 1k0t n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k0t s PRO 58 N -2.00 0.68 0.00 0.00 0.04 -1.26 -4.91 135.00 127.54 1k0t s PRO 58 Ca 0.00 0.11 0.14 0.00 0.04 0.00 0.00 61.00 61.29 1k0t s PRO 58 Cb 0.00 -1.80 0.62 0.00 0.04 0.00 0.00 34.50 33.36 1k0t s PRO 58 CO 0.00 -2.48 1.44 2.41 0.04 0.00 0.00 177.00 178.42 1k0t n THR 59 N -3.92 0.97 -0.17 1.26 -1.04 -1.26 -3.08 114.28 107.03 1k0t n THR 59 Ca 0.09 0.24 0.28 0.00 -2.04 0.00 0.00 64.05 62.63 1k0t n THR 59 Cb 0.59 -1.00 0.59 0.00 -1.82 0.00 0.00 70.33 68.69 1k0t n THR 59 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1k0t h ASP 60 N 0.00 0.00 0.00 8.00 5.19 -1.97 -3.29 116.42 124.35 1k0t h ASP 60 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1k0t h ASP 60 Cb 0.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.74 1k0t h ASP 60 CO 0.00 0.00 0.00 0.49 -3.12 0.00 0.00 179.24 176.61 1k0t n PHE 61 N -3.50 0.00 -1.63 4.55 3.72 -1.18 -5.04 117.46 114.38 1k0t n PHE 61 Ca 0.20 0.00 -0.52 0.00 -0.05 0.00 0.00 57.45 57.08 1k0t n PHE 61 Cb 1.28 0.05 -0.06 0.00 -0.94 0.00 0.00 39.48 39.81 1k0t n PHE 61 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 176.76 178.18 1k0t n LEU 62 N -2.05 2.08 0.00 4.37 -0.00 -1.24 -4.91 117.00 115.25 1k0t n LEU 62 Ca 0.00 1.10 0.00 0.00 -0.00 0.00 0.00 56.01 57.11 1k0t n LEU 62 Cb 0.00 -1.22 0.00 0.00 -0.00 0.00 0.00 43.42 42.20 1k0t n LEU 62 CO 0.00 -0.77 0.14 -1.20 -0.00 0.00 0.00 177.39 175.56 1k0t n SER 63 N 3.42 0.00 0.00 1.45 7.64 -1.26 -4.46 113.62 120.41 1k0t n SER 63 Ca 0.20 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.46 1k0t n SER 63 Cb 0.20 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1k0t n SER 63 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1k0t n ILE 64 N -0.97 0.00 0.01 0.44 3.06 -1.26 -4.99 119.36 115.65 1k0t n ILE 64 Ca 0.00 0.00 -0.02 0.00 -2.50 0.00 0.00 62.75 60.23 1k0t n ILE 64 Cb 0.00 0.00 -0.01 0.00 0.54 0.00 0.00 39.64 40.17 1k0t n ILE 64 CO 0.00 0.00 0.00 -1.14 -2.50 0.00 0.00 176.55 172.91 1k0t n ARG 65 N 0.00 0.12 -3.57 9.51 0.63 -1.26 -5.12 116.66 116.97 1k0t n ARG 65 Ca 0.00 0.05 -0.12 0.00 -0.92 0.00 0.00 57.85 56.86 1k0t n ARG 65 Cb 0.00 -0.63 -0.05 0.00 0.45 0.00 0.00 32.46 32.23 1k0t n ARG 65 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1k0t s VAL 66 N -1.99 0.00 -0.04 5.15 0.11 -1.26 -5.05 120.40 117.32 1k0t s VAL 66 Ca -0.06 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.69 1k0t s VAL 66 Cb 0.01 -1.00 0.09 0.00 -1.53 0.00 0.00 36.38 33.95 1k0t s VAL 66 CO 0.10 0.00 0.77 -0.31 -3.33 0.00 0.00 175.10 172.33 1k0t s TYR 67 N -1.19 -0.53 0.38 1.54 2.02 -1.26 -3.49 117.35 114.82 1k0t s TYR 67 Ca -0.03 0.77 0.24 0.00 -0.37 0.00 0.00 57.07 57.68 1k0t s TYR 67 Cb -0.00 0.46 1.34 0.00 -0.40 0.00 0.00 41.96 43.35 1k0t s TYR 67 CO 0.03 -0.58 1.50 1.28 -1.57 0.00 0.00 175.55 176.21 1k0t n LEU 68 N 0.52 0.29 -2.98 -1.29 7.99 -1.26 -1.55 117.00 118.73 1k0t n LEU 68 Ca -0.15 1.50 -0.19 0.00 -0.01 0.00 0.00 56.01 57.15 1k0t n LEU 68 Cb 0.59 -0.73 -0.03 0.00 -0.11 0.00 0.00 43.42 43.13 1k0t n LEU 68 CO 0.19 -1.66 2.13 0.61 -1.51 0.00 0.00 177.39 177.14 1k0t n GLY 69 N -1.33 2.94 1.30 -0.72 0.00 -1.26 -2.62 105.19 103.50 1k0t n GLY 69 Ca 0.37 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1k0t n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0t n ALA 70 N 3.87 0.78 -0.02 4.61 0.00 -0.59 -4.80 120.51 124.36 1k0t n ALA 70 Ca 0.41 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.76 1k0t n ALA 70 Cb 0.22 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.59 1k0t n ALA 70 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1k0t h GLU 71 N 0.00 -0.07 0.00 0.00 5.08 -1.68 -3.25 114.58 114.65 1k0t h GLU 71 Ca 0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1k0t h GLU 71 Cb 0.00 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1k0t h GLU 71 CO 0.00 0.44 0.00 -2.37 -1.00 0.00 0.00 179.01 176.08 1k0t n THR 72 N -4.77 0.00 0.43 1.13 5.66 -1.22 -1.60 114.28 113.92 1k0t n THR 72 Ca -0.06 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.75 1k0t n THR 72 Cb 0.27 -0.56 -0.09 0.00 -1.55 0.00 0.00 70.33 68.39 1k0t n THR 72 CO 0.00 0.00 0.00 0.74 -3.05 0.00 0.00 175.07 172.76 1k0t h THR 73 N 0.00 0.20 0.00 1.09 2.02 -1.77 -2.65 112.91 111.80 1k0t h THR 73 Ca 0.00 -0.02 -0.06 0.00 0.77 0.00 0.00 66.41 67.09 1k0t h THR 73 Cb 0.00 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.61 1k0t h THR 73 CO 0.00 0.00 -1.36 -2.11 0.37 0.00 0.00 175.52 172.43 1k0t n ARG 74 N -5.55 1.88 0.09 6.66 0.00 -1.24 -4.50 116.66 114.01 1k0t n ARG 74 Ca -0.15 -0.03 0.13 0.00 -0.00 0.00 0.00 57.85 57.81 1k0t n ARG 74 Cb 0.43 -1.15 0.41 0.00 -0.00 0.00 0.00 32.46 32.16 1k0t n ARG 74 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1k0t n SER 75 N -2.02 0.74 0.00 2.89 2.88 -0.63 -4.90 113.62 112.59 1k0t n SER 75 Ca -0.06 0.55 0.00 0.00 -1.33 0.00 0.00 58.87 58.03 1k0t n SER 75 Cb 0.48 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 63.21 1k0t n SER 75 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1k0t n MET 76 N -2.19 0.00 0.00 -1.46 2.81 -1.00 -2.23 117.12 113.05 1k0t n MET 76 Ca 0.06 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.95 1k0t n MET 76 Cb 0.42 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.93 1k0t n MET 76 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1k0t n GLY 77 N 0.00 0.10 0.16 3.03 0.00 -1.26 -4.28 105.19 102.95 1k0t n GLY 77 Ca 0.00 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 1k0t n GLY 77 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1k0t n LEU 78 N -0.72 2.36 -0.57 0.99 -0.00 -1.18 -4.32 117.00 113.56 1k0t n LEU 78 Ca 0.00 0.11 0.47 0.00 -0.00 0.00 0.00 56.01 56.59 1k0t n LEU 78 Cb 0.00 -0.80 0.80 0.00 -0.00 0.00 0.00 43.42 43.42 1k0t n LEU 78 CO 0.00 0.71 1.43 0.00 -0.00 0.00 0.00 177.39 179.54 1k0t h ALA 79 N -0.50 3.61 0.00 1.96 0.00 -1.79 -3.52 119.26 119.02 1k0t h ALA 79 Ca -0.60 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1k0t h ALA 79 Cb 1.70 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1k0t h ALA 79 CO -0.25 -2.10 0.00 2.48 0.00 0.00 0.00 179.25 179.38