#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 -2.74 0.00 1.43 -0.00 -1.26 -4.38 115.22 108.26 1k0t n HIS 2 Ca 0.00 -0.79 0.00 0.00 -0.00 0.00 0.00 57.72 56.93 1k0t n HIS 2 Cb 0.00 -0.21 0.00 0.00 -0.00 0.00 0.00 29.99 29.78 1k0t n HIS 2 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 1k0t n SER 3 N -2.75 -0.64 -0.35 4.39 3.41 0.53 -4.37 113.62 113.84 1k0t n SER 3 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1k0t n SER 3 Cb 0.22 0.78 0.00 0.00 -0.26 0.00 0.00 64.21 64.95 1k0t n SER 3 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1k0t n VAL 4 N -0.40 0.00 -1.36 -3.33 0.31 -1.26 -4.75 118.33 107.53 1k0t n VAL 4 Ca 0.00 0.00 -0.47 0.00 -0.01 0.00 0.00 64.34 63.86 1k0t n VAL 4 Cb 0.00 0.60 -0.03 0.00 -0.91 0.00 0.00 33.84 33.50 1k0t n VAL 4 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1k0t n LYS 5 N 0.00 0.00 -1.32 5.55 0.00 -1.26 -4.23 118.16 116.89 1k0t n LYS 5 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 58.31 57.76 1k0t n LYS 5 Cb 0.63 -0.98 -0.12 0.00 0.00 0.00 0.00 35.03 34.56 1k0t n LYS 5 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1k0t n ILE 6 N -0.01 0.03 -3.86 3.15 -0.00 -1.26 -4.86 119.36 112.54 1k0t n ILE 6 Ca 0.18 -0.05 -0.09 0.00 -0.00 0.00 0.00 62.75 62.78 1k0t n ILE 6 Cb 0.24 -0.70 -0.07 0.00 -0.00 0.00 0.00 39.64 39.12 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 6.75 0.19 -0.33 1.39 2.02 -1.26 -5.03 117.35 121.07 1k0t s TYR 7 Ca 1.21 -0.58 -0.02 0.00 -0.37 0.00 0.00 57.07 57.31 1k0t s TYR 7 Cb -1.35 -0.00 0.15 0.00 -0.40 0.00 0.00 41.96 40.36 1k0t s TYR 7 CO 0.60 -0.64 2.27 -0.40 -1.57 0.00 0.00 175.55 175.81 1k0t n ASP 8 N -0.15 6.38 -4.43 2.29 5.75 -1.26 -4.79 116.55 120.34 1k0t n ASP 8 Ca -0.12 -3.05 -0.44 0.00 -0.01 0.00 0.00 54.79 51.17 1k0t n ASP 8 Cb 0.63 -1.12 -0.03 0.00 -1.03 0.00 0.00 41.12 39.57 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 -2.05 4.79 0.22 2.12 -1.32 -1.26 -4.94 115.64 113.20 1k0t s THR 9 Ca 0.38 -1.52 -0.22 0.00 -1.21 0.00 0.00 61.69 59.12 1k0t s THR 9 Cb 0.27 -4.72 0.04 0.00 -1.51 0.00 0.00 72.50 66.58 1k0t s THR 9 CO -0.06 -1.43 0.75 0.00 -2.21 0.00 0.00 174.62 171.67 1k0t n ILE 11 N -0.44 0.00 0.00 0.00 -6.64 -1.26 -5.05 119.36 105.97 1k0t n ILE 11 Ca -0.07 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.91 1k0t n ILE 11 Cb 0.61 -0.10 0.00 0.00 -1.44 0.00 0.00 39.64 38.71 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 -0.51 0.00 3.74 3.28 0.00 -1.26 -5.06 105.19 105.38 1k0t n GLY 12 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1k0t n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0t s THR 14 N -2.61 3.08 -0.27 0.00 -4.23 -1.26 -5.00 115.64 105.36 1k0t s THR 14 Ca 0.40 -3.92 -0.28 0.00 -1.18 0.00 0.00 61.69 56.71 1k0t s THR 14 Cb -0.03 -3.02 0.18 0.00 1.34 0.00 0.00 72.50 70.96 1k0t s THR 14 CO 0.26 -0.96 1.29 0.00 -0.54 0.00 0.00 174.62 174.67 1k0t s GLN 15 N -1.09 0.19 0.00 3.99 -2.07 -1.26 -4.97 119.66 114.45 1k0t s GLN 15 Ca 0.23 0.09 0.00 0.00 -1.82 0.00 0.00 55.36 53.86 1k0t s GLN 15 Cb -0.11 0.09 0.00 0.00 -1.09 0.00 0.00 33.01 31.90 1k0t s GLN 15 CO -0.11 -0.05 0.00 0.00 -1.32 0.00 0.00 175.29 173.81 1k0t n VAL 17 N 0.00 0.49 0.00 0.00 0.31 -1.26 -4.09 118.33 113.78 1k0t n VAL 17 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 1k0t n VAL 17 Cb 0.00 0.26 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 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 0.59 0.00 -2.35 5.55 3.00 -1.26 -4.89 116.66 117.29 1k0t n ARG 18 Ca 0.13 0.00 -0.36 0.00 -0.01 0.00 0.00 57.85 57.61 1k0t n ARG 18 Cb 0.32 -0.49 -0.03 0.00 0.00 0.00 0.00 32.46 32.25 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 -1.99 2.52 -0.31 7.54 0.00 -1.26 -4.67 121.76 123.58 1k0t s ALA 19 Ca 0.00 -2.36 -0.09 0.00 0.00 0.00 0.00 51.96 49.51 1k0t s ALA 19 Cb 0.00 -4.62 0.19 0.00 0.00 0.00 0.00 23.12 18.69 1k0t s ALA 19 CO 0.00 -4.15 1.01 0.00 0.00 0.00 0.00 175.76 172.63 1k0t h PRO 21 N 6.52 0.47 0.00 0.00 0.13 -1.99 -2.88 132.00 134.25 1k0t h PRO 21 Ca -0.06 -0.46 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1k0t h PRO 21 Cb 1.20 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.45 1k0t h PRO 21 CO -0.07 1.10 0.00 1.28 -0.23 0.00 0.00 178.00 180.08 1k0t n LEU 22 N -3.80 0.57 -2.63 1.56 4.32 -1.26 -4.92 117.00 110.84 1k0t n LEU 22 Ca -0.06 0.68 -0.05 0.00 -0.02 0.00 0.00 56.01 56.55 1k0t n LEU 22 Cb 0.79 -0.64 0.01 0.00 -1.62 0.00 0.00 43.42 41.96 1k0t n LEU 22 CO 0.51 -0.65 -0.09 0.47 -1.22 0.00 0.00 177.39 176.41 1k0t n ASP 23 N -2.17 -7.18 0.05 -1.43 8.00 -1.09 -5.00 116.55 107.73 1k0t n ASP 23 Ca 0.01 0.69 0.00 0.00 0.71 0.00 0.00 54.79 56.20 1k0t n ASP 23 Cb 0.16 -4.80 0.00 0.00 -0.02 0.00 0.00 41.12 36.46 1k0t n ASP 23 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1k0t n VAL 24 N -0.06 0.97 -1.54 2.53 0.31 -1.26 -4.95 118.33 114.32 1k0t n VAL 24 Ca 0.07 0.32 -0.30 0.00 -0.01 0.00 0.00 64.34 64.42 1k0t n VAL 24 Cb 0.29 -1.49 -0.08 0.00 -0.91 0.00 0.00 33.84 31.65 1k0t n VAL 24 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1k0t n LEU 25 N -3.42 1.52 0.00 7.52 4.32 -1.26 -4.57 117.00 121.11 1k0t n LEU 25 Ca 0.00 -0.62 -0.01 0.00 -0.02 0.00 0.00 56.01 55.35 1k0t n LEU 25 Cb 0.07 -1.40 -0.00 0.00 -1.62 0.00 0.00 43.42 40.47 1k0t n LEU 25 CO 0.00 -1.66 -0.01 -0.62 -1.22 0.00 0.00 177.39 173.88 1k0t n GLU 26 N 8.58 1.81 -3.44 3.23 -0.58 0.30 -4.83 120.64 125.71 1k0t n GLU 26 Ca 0.47 -0.18 -0.38 0.00 -0.42 0.00 0.00 57.16 56.66 1k0t n GLU 26 Cb 0.39 0.04 -0.06 0.00 -0.57 0.00 0.00 31.44 31.24 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 -2.09 4.08 0.40 3.49 0.23 -1.26 0.14 119.30 124.29 1k0t s MET 27 Ca 0.00 0.42 0.04 0.00 -1.03 0.00 0.00 55.69 55.12 1k0t s MET 27 Cb -0.00 -3.30 -0.05 0.00 -1.53 0.00 0.00 34.83 29.95 1k0t s MET 27 CO 0.00 0.50 0.05 0.14 -2.03 0.00 0.00 175.02 173.68 1k0t s VAL 28 N -0.46 1.27 -0.25 5.16 -7.23 0.12 -4.84 120.40 114.17 1k0t s VAL 28 Ca 0.24 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.12 1k0t s VAL 28 Cb -0.16 -2.63 -0.01 0.00 0.56 0.00 0.00 36.38 34.14 1k0t s VAL 28 CO 0.12 0.00 1.32 -2.16 -0.31 0.00 0.00 175.10 174.07 1k0t s PRO 29 N -3.81 4.00 0.30 4.82 0.04 -1.26 -1.59 135.00 137.50 1k0t s PRO 29 Ca 0.28 1.41 0.03 0.00 0.04 0.00 0.00 61.00 62.76 1k0t s PRO 29 Cb 0.06 -3.86 -0.04 0.00 0.04 0.00 0.00 34.50 30.71 1k0t s PRO 29 CO 0.13 -1.01 0.15 -0.46 0.04 0.00 0.00 177.00 175.86 1k0t s TRP 30 N 4.19 1.58 -0.38 0.56 -0.00 -0.32 -4.68 118.94 119.89 1k0t s TRP 30 Ca 0.57 -1.36 0.12 0.00 -0.00 0.00 0.00 56.10 55.43 1k0t s TRP 30 Cb -0.19 -0.85 0.35 0.00 -0.00 0.00 0.00 33.47 32.78 1k0t s TRP 30 CO 0.21 -0.51 0.75 -3.47 -0.00 0.00 0.00 176.95 173.92 1k0t n ASP 31 N -0.88 1.08 0.00 5.86 -0.08 -1.26 -3.62 116.55 117.65 1k0t n ASP 31 Ca 0.01 -3.05 0.00 0.00 -1.51 0.00 0.00 54.79 50.24 1k0t n ASP 31 Cb 0.65 -0.62 0.00 0.00 2.34 0.00 0.00 41.12 43.49 1k0t n ASP 31 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1k0t n GLY 32 N 0.24 0.11 3.75 0.27 0.00 -1.26 -5.02 105.19 103.28 1k0t n GLY 32 Ca 0.25 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.42 0.00 -0.12 0.00 3.64 -1.99 0.29 116.57 116.98 1k0t h LYS 34 Ca -0.49 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.89 1k0t h LYS 34 Cb 1.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.11 1k0t h LYS 34 CO 0.57 0.03 0.00 0.00 -2.27 0.00 0.00 179.45 177.79 1k0t n ALA 35 N -2.20 2.57 -4.06 5.00 0.00 -1.26 -4.98 120.51 115.58 1k0t n ALA 35 Ca -0.02 -2.42 -0.31 0.00 0.00 0.00 0.00 53.44 50.69 1k0t n ALA 35 Cb 0.15 -0.52 -0.03 0.00 0.00 0.00 0.00 19.45 19.05 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 -0.97 -0.36 3.24 0.00 0.00 0.09 -4.89 105.19 102.30 1k0t n GLY 36 Ca 0.18 0.22 -0.09 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 -6.90 0.31 -0.11 1.61 1.03 -1.24 -1.17 119.66 113.19 1k0t s GLN 37 Ca 0.12 1.01 -0.10 0.00 0.04 0.00 0.00 55.36 56.44 1k0t s GLN 37 Cb -0.06 0.30 -0.05 0.00 0.03 0.00 0.00 33.01 33.24 1k0t s GLN 37 CO 0.94 -0.25 0.22 -1.50 -2.54 0.00 0.00 175.29 172.15 1k0t s ILE 38 N 2.60 5.36 -0.49 3.63 1.10 -0.62 -4.68 121.20 128.10 1k0t s ILE 38 Ca -0.01 0.39 -0.28 0.00 -0.51 0.00 0.00 60.65 60.23 1k0t s ILE 38 Cb -0.12 -3.51 0.02 0.00 0.15 0.00 0.00 42.46 39.00 1k0t s ILE 38 CO -0.12 0.56 1.33 0.00 -2.11 0.00 0.00 174.94 174.60 1k0t s ALA 39 N -0.72 2.98 0.21 1.50 0.00 -1.26 0.16 121.76 124.64 1k0t s ALA 39 Ca 0.16 -0.46 0.04 0.00 0.00 0.00 0.00 51.96 51.70 1k0t s ALA 39 Cb -0.13 -4.00 -0.02 0.00 0.00 0.00 0.00 23.12 18.98 1k0t s ALA 39 CO 0.05 -2.57 0.15 0.43 0.00 0.00 0.00 175.76 173.82 1k0t n SER 40 N 8.82 -0.00 -4.01 0.00 7.64 0.38 -4.86 113.62 121.60 1k0t n SER 40 Ca 0.13 -2.30 -0.33 0.00 1.01 0.00 0.00 58.87 57.39 1k0t n SER 40 Cb 0.49 0.89 -0.12 0.00 -1.01 0.00 0.00 64.21 64.46 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 -2.41 4.79 -0.05 6.43 0.01 -1.26 0.11 113.70 121.32 1k0t s SER 41 Ca 0.21 -3.07 -0.08 0.00 1.31 0.00 0.00 55.95 54.32 1k0t s SER 41 Cb 0.01 -1.74 -0.04 0.00 0.21 0.00 0.00 66.02 64.46 1k0t s SER 41 CO 0.15 -0.27 0.37 1.55 0.41 0.00 0.00 173.24 175.45 1k0t h PRO 42 N 6.58 -0.28 -4.21 12.44 0.13 -1.91 -3.39 132.00 141.36 1k0t h PRO 42 Ca -0.02 0.02 -0.76 0.00 -0.87 0.00 0.00 66.00 64.36 1k0t h PRO 42 Cb 0.90 0.06 -0.22 0.00 0.13 0.00 0.00 31.00 31.87 1k0t h PRO 42 CO 0.71 -0.19 1.03 0.54 -0.23 0.00 0.00 178.00 179.86 1k0t n ARG 43 N -4.51 3.47 -0.55 0.86 5.12 -1.26 -4.80 116.66 114.98 1k0t n ARG 43 Ca -0.04 -4.09 -0.11 0.00 -1.93 0.00 0.00 57.85 51.69 1k0t n ARG 43 Cb 0.11 -2.84 0.08 0.00 -1.16 0.00 0.00 32.46 28.65 1k0t n ARG 43 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1k0t n THR 44 N 3.75 2.00 0.29 0.55 -1.04 -1.26 -4.27 114.28 114.29 1k0t n THR 44 Ca 0.32 -0.87 0.16 0.00 -2.04 0.00 0.00 64.05 61.63 1k0t n THR 44 Cb 0.41 -0.78 0.88 0.00 -1.82 0.00 0.00 70.33 69.03 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 0.46 0.00 -4.65 -2.82 4.11 -1.97 -3.35 114.58 106.37 1k0t h GLU 45 Ca 0.28 0.00 -0.67 0.00 0.07 0.00 0.00 59.36 59.04 1k0t h GLU 45 Cb 1.82 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 30.68 1k0t h GLU 45 CO 0.50 0.05 -0.68 -0.51 0.07 0.00 0.00 179.01 178.44 1k0t s ASP 46 N -5.83 4.88 0.00 3.06 1.11 -1.26 -5.00 116.67 113.63 1k0t s ASP 46 Ca -0.03 -2.09 0.00 0.00 0.18 0.00 0.00 52.55 50.61 1k0t s ASP 46 Cb 0.13 -1.68 0.00 0.00 1.07 0.00 0.00 42.92 42.44 1k0t s ASP 46 CO 0.53 -0.41 0.00 0.00 1.18 0.00 0.00 175.17 176.46 1k0t n VAL 48 N 0.00 1.88 -3.12 0.00 3.14 -1.26 -4.71 118.33 114.26 1k0t n VAL 48 Ca 0.00 -4.39 -0.19 0.00 -2.96 0.00 0.00 64.34 56.80 1k0t n VAL 48 Cb 0.00 -0.63 0.02 0.00 -1.06 0.00 0.00 33.84 32.17 1k0t n VAL 48 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1k0t n GLY 49 N -0.30 -0.93 1.44 7.55 0.00 -1.26 -4.47 105.19 107.22 1k0t n GLY 49 Ca 0.28 1.06 0.05 0.00 0.00 0.00 0.00 46.02 47.41 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 0.50 -1.46 0.10 0.00 4.81 -1.26 -4.89 118.16 115.95 1k0t n LYS 51 Ca 0.19 0.81 0.00 0.00 -0.87 0.00 0.00 58.31 58.44 1k0t n LYS 51 Cb 0.88 -2.72 0.00 0.00 0.02 0.00 0.00 35.03 33.21 1k0t n LYS 51 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1k0t n ARG 52 N -2.66 0.00 0.00 1.64 5.12 -1.26 -5.02 116.66 114.47 1k0t n ARG 52 Ca -0.27 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.65 1k0t n ARG 52 Cb 0.67 -0.19 0.00 0.00 -1.16 0.00 0.00 32.46 31.78 1k0t n ARG 52 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1k0t n GLU 54 N 0.00 0.00 -0.34 0.00 2.13 -1.26 -4.72 120.64 116.45 1k0t n GLU 54 Ca 0.00 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.73 1k0t n GLU 54 Cb 0.00 -0.00 -0.08 0.00 0.27 0.00 0.00 31.44 31.63 1k0t n GLU 54 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1k0t n THR 55 N 0.00 -0.55 -4.26 6.31 -2.24 -1.26 -4.52 114.28 107.76 1k0t n THR 55 Ca 0.00 1.98 -0.34 0.00 -2.27 0.00 0.00 64.05 63.43 1k0t n THR 55 Cb 0.00 -2.46 -0.06 0.00 -2.10 0.00 0.00 70.33 65.72 1k0t n THR 55 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k0t n ALA 56 N -3.36 -1.64 -1.17 6.98 0.00 -1.26 -4.31 120.51 115.74 1k0t n ALA 56 Ca 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.23 1k0t n ALA 56 Cb 0.21 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1k0t n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k0t n PRO 58 N -2.23 1.51 -0.62 0.00 -0.04 -1.26 -4.44 135.00 127.92 1k0t n PRO 58 Ca 0.00 -0.76 0.00 0.00 -0.04 0.00 0.00 63.50 62.70 1k0t n PRO 58 Cb 0.33 -1.88 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 1k0t n PRO 58 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1k0t n THR 59 N 2.64 0.00 -0.60 0.52 -1.04 -1.26 -4.80 114.28 109.74 1k0t n THR 59 Ca 0.32 0.00 0.48 0.00 -2.04 0.00 0.00 64.05 62.81 1k0t n THR 59 Cb 0.68 -0.16 0.80 0.00 -1.82 0.00 0.00 70.33 69.83 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 0.02 0.00 8.00 3.32 -1.87 -3.38 116.42 122.51 1k0t h ASP 60 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1k0t h ASP 60 Cb 0.00 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1k0t h ASP 60 CO 0.00 -0.01 0.00 0.49 -1.72 0.00 0.00 179.24 178.00 1k0t n PHE 61 N -4.05 0.00 -3.27 4.55 3.01 -1.26 -5.04 117.46 111.40 1k0t n PHE 61 Ca 0.39 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.74 1k0t n PHE 61 Cb 1.79 0.00 0.01 0.00 -0.01 0.00 0.00 39.48 41.27 1k0t n PHE 61 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1k0t n LEU 62 N -0.96 -3.39 -3.75 4.37 4.77 -1.26 -4.98 117.00 111.81 1k0t n LEU 62 Ca 0.00 0.26 -0.20 0.00 -0.03 0.00 0.00 56.01 56.05 1k0t n LEU 62 Cb 0.00 -1.63 -0.17 0.00 -2.33 0.00 0.00 43.42 39.28 1k0t n LEU 62 CO 0.00 -1.06 -0.36 -0.44 -1.33 0.00 0.00 177.39 174.20 1k0t s SER 63 N -1.16 1.01 0.36 -1.43 0.01 -1.26 -5.07 113.70 106.17 1k0t s SER 63 Ca 0.11 0.00 0.00 0.00 1.31 0.00 0.00 55.95 57.37 1k0t s SER 63 Cb -0.01 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 65.97 1k0t s SER 63 CO 0.27 -0.19 0.00 -0.38 0.41 0.00 0.00 173.24 173.36 1k0t n ILE 64 N 4.87 -2.29 -0.62 1.44 -0.00 -1.26 -5.05 119.36 116.45 1k0t n ILE 64 Ca -0.12 1.06 0.00 0.00 -0.00 0.00 0.00 62.75 63.69 1k0t n ILE 64 Cb 0.50 -1.66 0.00 0.00 -0.00 0.00 0.00 39.64 38.48 1k0t n ILE 64 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 1k0t n ARG 65 N -1.89 -1.22 -3.41 0.38 5.12 -1.26 -4.92 116.66 109.46 1k0t n ARG 65 Ca 0.00 1.05 -0.27 0.00 -1.93 0.00 0.00 57.85 56.70 1k0t n ARG 65 Cb 0.23 -0.95 -0.10 0.00 -1.16 0.00 0.00 32.46 30.47 1k0t n ARG 65 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 1k0t s VAL 66 N -0.71 0.40 -0.08 1.55 -7.23 -1.26 -4.54 120.40 108.53 1k0t s VAL 66 Ca 0.00 -2.66 -0.03 0.00 -1.81 0.00 0.00 61.98 57.47 1k0t s VAL 66 Cb 0.00 -1.30 0.04 0.00 0.56 0.00 0.00 36.38 35.69 1k0t s VAL 66 CO 0.00 -1.22 0.17 -0.31 -0.31 0.00 0.00 175.10 173.43 1k0t s TYR 67 N 0.05 -0.21 0.58 2.82 2.02 -1.26 -4.81 117.35 116.54 1k0t s TYR 67 Ca 0.32 0.57 0.35 0.00 -0.37 0.00 0.00 57.07 57.94 1k0t s TYR 67 Cb 0.03 -0.06 1.39 0.00 -0.40 0.00 0.00 41.96 42.92 1k0t s TYR 67 CO -0.19 -0.19 1.63 1.25 -1.57 0.00 0.00 175.55 176.48 1k0t h LEU 68 N 7.31 0.00 0.00 -1.29 6.46 -1.95 1.54 115.31 127.38 1k0t h LEU 68 Ca -0.41 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.35 1k0t h LEU 68 Cb 1.14 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.07 1k0t h LEU 68 CO 0.39 0.00 0.00 0.61 -0.62 0.00 0.00 178.44 178.82 1k0t n GLY 69 N -1.73 0.51 1.17 3.75 0.00 -1.26 -4.51 105.19 103.12 1k0t n GLY 69 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 0.00 0.00 -1.28 4.61 0.00 -1.26 -4.62 120.51 117.96 1k0t n ALA 70 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1k0t n ALA 70 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 1k0t n ALA 70 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1k0t n GLU 71 N -2.47 -2.72 -2.71 0.00 4.71 -1.26 -4.67 120.64 111.53 1k0t n GLU 71 Ca 0.00 2.23 -0.06 0.00 -0.01 0.00 0.00 57.16 59.32 1k0t n GLU 71 Cb 0.00 -3.27 0.04 0.00 -1.01 0.00 0.00 31.44 27.19 1k0t n GLU 71 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1k0t n THR 72 N -4.10 1.26 -0.02 2.62 -2.24 -1.26 -4.41 114.28 106.11 1k0t n THR 72 Ca -0.08 -3.12 -0.05 0.00 -2.27 0.00 0.00 64.05 58.53 1k0t n THR 72 Cb 0.56 0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 69.58 1k0t n THR 72 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1k0t n THR 73 N -0.37 0.27 -0.01 4.28 -1.04 -1.26 -4.51 114.28 111.63 1k0t n THR 73 Ca 0.11 -0.07 0.03 0.00 -2.04 0.00 0.00 64.05 62.08 1k0t n THR 73 Cb 0.81 -1.56 -0.07 0.00 -1.82 0.00 0.00 70.33 67.69 1k0t n THR 73 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 1k0t n ARG 74 N -3.22 0.61 -0.51 -2.82 0.00 -1.26 -4.50 116.66 104.96 1k0t n ARG 74 Ca -0.10 -0.07 0.08 0.00 -0.00 0.00 0.00 57.85 57.77 1k0t n ARG 74 Cb 0.57 -1.20 0.28 0.00 -0.00 0.00 0.00 32.46 32.10 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 -1.87 4.11 -0.19 2.89 2.88 -1.26 -4.52 113.62 115.66 1k0t n SER 75 Ca -0.03 -3.02 -0.01 0.00 -1.33 0.00 0.00 58.87 54.47 1k0t n SER 75 Cb 0.30 -0.57 0.06 0.00 -0.75 0.00 0.00 64.21 63.26 1k0t n SER 75 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 1k0t h MET 76 N 2.07 0.03 0.00 -1.46 2.86 -1.79 -3.46 114.93 113.19 1k0t h MET 76 Ca 0.00 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1k0t h MET 76 Cb 1.52 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.17 1k0t h MET 76 CO 0.26 0.02 0.00 0.41 1.06 0.00 0.00 176.91 178.66 1k0t n GLY 77 N -1.38 1.91 0.13 8.32 0.00 -1.26 -5.01 105.19 107.89 1k0t n GLY 77 Ca 0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 1k0t n GLY 77 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k0t n LEU 78 N 0.00 1.94 0.07 0.99 4.77 -1.26 -4.95 117.00 118.55 1k0t n LEU 78 Ca 0.00 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 1k0t n LEU 78 Cb 0.00 -0.83 0.00 0.00 -2.33 0.00 0.00 43.42 40.26 1k0t n LEU 78 CO 0.00 0.38 -0.06 0.00 -1.33 0.00 0.00 177.39 176.38 1k0t n ALA 79 N -4.15 3.00 0.00 -1.18 0.00 -1.26 -5.26 120.51 111.66 1k0t n ALA 79 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1k0t n ALA 79 Cb 0.79 0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.33 1k0t n ALA 79 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16