#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 -2.60 -0.94 1.43 -0.00 -1.26 -3.94 115.22 107.91 1k0t n HIS 2 Ca 0.00 1.38 -0.31 0.00 -0.00 0.00 0.00 57.72 58.79 1k0t n HIS 2 Cb 0.00 -2.54 0.02 0.00 -0.00 0.00 0.00 29.99 27.47 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 -0.69 -3.49 -0.03 0.41 3.41 -1.24 -4.61 113.62 107.38 1k0t n SER 3 Ca 0.00 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 1k0t n SER 3 Cb 0.00 -0.66 0.00 0.00 -0.26 0.00 0.00 64.21 63.29 1k0t n SER 3 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1k0t n VAL 4 N -1.43 0.24 -1.65 -3.33 3.14 -1.25 -4.51 118.33 109.54 1k0t n VAL 4 Ca 0.04 -0.25 -0.47 0.00 -2.96 0.00 0.00 64.34 60.70 1k0t n VAL 4 Cb 0.40 0.85 -0.04 0.00 -1.06 0.00 0.00 33.84 33.98 1k0t n VAL 4 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1k0t n LYS 5 N -0.13 1.89 -1.41 1.45 4.76 -1.26 -4.81 118.16 118.65 1k0t n LYS 5 Ca 0.00 0.68 -0.46 0.00 -2.87 0.00 0.00 58.31 55.66 1k0t n LYS 5 Cb 0.46 -2.39 -0.02 0.00 -1.84 0.00 0.00 35.03 31.24 1k0t n LYS 5 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1k0t n ILE 6 N 2.84 1.74 0.00 -0.18 -0.00 -1.26 -4.93 119.36 117.57 1k0t n ILE 6 Ca 0.16 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.41 1k0t n ILE 6 Cb 0.27 -0.17 0.00 0.00 -0.00 0.00 0.00 39.64 39.75 1k0t n ILE 6 CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 1k0t n TYR 7 N -0.23 0.00 -0.80 4.28 4.01 -1.26 -4.99 117.16 118.17 1k0t n TYR 7 Ca 0.15 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.77 1k0t n TYR 7 Cb 0.30 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.35 1k0t n TYR 7 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1k0t n ASP 8 N 0.00 6.12 -4.36 7.72 5.75 -1.26 -4.77 116.55 125.76 1k0t n ASP 8 Ca 0.00 -2.87 -0.46 0.00 -0.01 0.00 0.00 54.79 51.45 1k0t n ASP 8 Cb 0.00 -1.09 -0.02 0.00 -1.03 0.00 0.00 41.12 38.98 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 -1.56 5.42 -0.01 2.12 -1.32 -1.26 -4.98 115.64 114.05 1k0t s THR 9 Ca 0.24 -2.30 -0.15 0.00 -1.21 0.00 0.00 61.69 58.27 1k0t s THR 9 Cb 0.18 -4.55 0.02 0.00 -1.51 0.00 0.00 72.50 66.64 1k0t s THR 9 CO -0.01 -1.15 0.31 0.00 -2.21 0.00 0.00 174.62 171.57 1k0t n ILE 11 N 1.29 0.08 0.00 0.00 -6.64 -1.26 -5.04 119.36 107.78 1k0t n ILE 11 Ca -0.22 -0.03 0.00 0.00 -1.77 0.00 0.00 62.75 60.74 1k0t n ILE 11 Cb 0.56 -0.63 0.00 0.00 -1.44 0.00 0.00 39.64 38.13 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 3.39 0.16 3.02 3.28 0.00 -1.26 -5.05 105.19 108.74 1k0t n GLY 12 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.29 1.18 -1.20 0.00 -2.24 -1.26 -4.93 114.28 104.55 1k0t n THR 14 Ca -0.10 -0.54 -0.39 0.00 -2.27 0.00 0.00 64.05 60.75 1k0t n THR 14 Cb 0.52 -1.02 -0.01 0.00 -2.10 0.00 0.00 70.33 67.72 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 -2.95 0.00 0.00 -0.78 10.64 -1.26 -0.26 117.38 122.77 1k0t n GLN 15 Ca -0.34 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.83 1k0t n GLN 15 Cb 0.94 -0.91 0.00 0.00 -0.86 0.00 0.00 30.24 29.42 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 0.00 1.01 0.07 0.00 0.31 0.64 -3.69 118.33 116.67 1k0t n VAL 17 Ca 0.00 -0.64 0.00 0.00 -0.01 0.00 0.00 64.34 63.69 1k0t n VAL 17 Cb 0.00 -0.07 0.00 0.00 -0.91 0.00 0.00 33.84 32.86 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 0.48 0.00 -0.18 5.55 3.00 -1.12 -4.84 116.66 119.55 1k0t n ARG 18 Ca 0.14 0.00 -0.06 0.00 -0.01 0.00 0.00 57.85 57.92 1k0t n ARG 18 Cb 0.55 -0.27 -0.01 0.00 0.00 0.00 0.00 32.46 32.73 1k0t n ARG 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1k0t h ALA 19 N 0.00 -0.12 -0.22 7.54 0.00 -1.87 -3.38 119.26 121.21 1k0t h ALA 19 Ca 0.00 0.14 -0.61 0.00 0.00 0.00 0.00 54.91 54.44 1k0t h ALA 19 Cb 0.00 0.79 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 1k0t h ALA 19 CO 0.00 -0.71 1.56 0.00 0.00 0.00 0.00 179.25 180.10 1k0t h PRO 21 N 11.51 0.38 0.00 0.00 0.13 -1.95 -3.00 132.00 139.08 1k0t h PRO 21 Ca -0.10 -0.37 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1k0t h PRO 21 Cb 1.35 0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.57 1k0t h PRO 21 CO 1.23 1.04 0.00 1.28 -0.23 0.00 0.00 178.00 181.32 1k0t n LEU 22 N -4.30 0.43 -3.03 1.56 4.32 -1.26 -4.86 117.00 109.87 1k0t n LEU 22 Ca -0.10 0.68 -0.09 0.00 -0.02 0.00 0.00 56.01 56.48 1k0t n LEU 22 Cb 0.61 -0.70 0.04 0.00 -1.62 0.00 0.00 43.42 41.75 1k0t n LEU 22 CO 0.45 -0.76 0.12 0.47 -1.22 0.00 0.00 177.39 176.45 1k0t n ASP 23 N -2.06 -6.55 -0.11 -1.43 9.92 -1.13 -4.91 116.55 110.28 1k0t n ASP 23 Ca -0.00 -0.45 -0.25 0.00 -0.53 0.00 0.00 54.79 53.56 1k0t n ASP 23 Cb 0.07 -4.81 -0.11 0.00 -0.64 0.00 0.00 41.12 35.62 1k0t n ASP 23 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1k0t n VAL 24 N -2.62 1.56 -1.72 2.53 0.31 -1.26 -4.77 118.33 112.36 1k0t n VAL 24 Ca -0.04 -0.30 -0.26 0.00 -0.01 0.00 0.00 64.34 63.73 1k0t n VAL 24 Cb 0.57 -1.88 -0.05 0.00 -0.91 0.00 0.00 33.84 31.58 1k0t n VAL 24 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1k0t s LEU 25 N -7.49 3.13 0.00 7.52 1.02 -1.26 -4.50 118.68 117.09 1k0t s LEU 25 Ca -0.33 0.26 0.00 0.00 0.02 0.00 0.00 54.13 54.08 1k0t s LEU 25 Cb 0.10 -2.53 0.00 0.00 0.02 0.00 0.00 46.19 43.78 1k0t s LEU 25 CO 0.57 -3.19 0.00 -0.62 0.02 0.00 0.00 176.35 173.13 1k0t n GLU 26 N 8.93 1.41 -3.78 1.70 -0.58 -0.70 -4.74 120.64 122.89 1k0t n GLU 26 Ca 0.39 0.00 -0.36 0.00 -0.42 0.00 0.00 57.16 56.77 1k0t n GLU 26 Cb 0.48 0.00 -0.07 0.00 -0.57 0.00 0.00 31.44 31.29 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 -1.40 3.80 0.36 3.49 0.23 -1.26 0.16 119.30 124.68 1k0t s MET 27 Ca 0.00 -0.12 0.06 0.00 -1.03 0.00 0.00 55.69 54.60 1k0t s MET 27 Cb 0.00 -3.29 -0.07 0.00 -1.53 0.00 0.00 34.83 29.94 1k0t s MET 27 CO 0.00 0.56 0.01 0.14 -2.03 0.00 0.00 175.02 173.70 1k0t s VAL 28 N -0.41 1.65 -0.25 5.16 -7.23 0.14 -4.83 120.40 114.63 1k0t s VAL 28 Ca 0.13 -2.03 -0.29 0.00 -1.81 0.00 0.00 61.98 57.98 1k0t s VAL 28 Cb -0.12 -2.82 -0.01 0.00 0.56 0.00 0.00 36.38 33.99 1k0t s VAL 28 CO 0.02 -0.05 1.32 -2.16 -0.31 0.00 0.00 175.10 173.92 1k0t s PRO 29 N -3.78 3.99 0.00 4.82 0.04 -1.26 -0.94 135.00 137.88 1k0t s PRO 29 Ca 0.35 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1k0t s PRO 29 Cb 0.08 -3.86 0.00 0.00 0.04 0.00 0.00 34.50 30.76 1k0t s PRO 29 CO 0.16 -1.02 0.00 1.87 0.04 0.00 0.00 177.00 178.05 1k0t n TRP 30 N 7.42 0.00 0.00 0.56 -0.00 0.76 -4.71 117.44 121.48 1k0t n TRP 30 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.65 1k0t n TRP 30 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.77 1k0t n TRP 30 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 177.69 174.22 1k0t n ASP 31 N 0.00 0.00 0.10 5.87 2.03 -1.15 -4.70 116.55 118.69 1k0t n ASP 31 Ca 0.00 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.37 1k0t n ASP 31 Cb 0.00 0.00 0.31 0.00 -0.72 0.00 0.00 41.12 40.71 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 0.00 -0.65 3.85 0.27 0.00 -1.26 -3.86 105.19 103.54 1k0t n GLY 32 Ca 0.00 0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 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 0.92 0.00 -0.16 0.00 1.79 -1.88 0.29 116.57 117.53 1k0t h LYS 34 Ca -0.47 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 57.98 1k0t h LYS 34 Cb 1.19 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.82 1k0t h LYS 34 CO 0.62 0.00 -0.05 0.00 -1.08 0.00 0.00 179.45 178.94 1k0t n ALA 35 N -2.44 2.98 -4.08 3.86 0.00 -1.26 -4.95 120.51 114.61 1k0t n ALA 35 Ca 0.02 -2.63 -0.34 0.00 0.00 0.00 0.00 53.44 50.49 1k0t n ALA 35 Cb 0.31 -0.57 -0.00 0.00 0.00 0.00 0.00 19.45 19.18 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 -0.99 -0.47 2.95 0.00 0.00 0.10 -4.88 105.19 101.90 1k0t n GLY 36 Ca 0.21 0.16 -0.14 0.00 0.00 0.00 0.00 46.02 46.24 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 -6.79 0.11 -0.07 1.61 1.03 -1.26 -0.17 119.66 114.13 1k0t s GLN 37 Ca 0.71 0.63 -0.07 0.00 0.04 0.00 0.00 55.36 56.67 1k0t s GLN 37 Cb -0.38 -0.14 -0.04 0.00 0.03 0.00 0.00 33.01 32.48 1k0t s GLN 37 CO 0.88 -0.27 0.19 -1.50 -2.54 0.00 0.00 175.29 172.05 1k0t s ILE 38 N 2.11 5.43 -0.29 3.63 1.10 -0.11 -4.70 121.20 128.37 1k0t s ILE 38 Ca -0.00 0.17 -0.29 0.00 -0.51 0.00 0.00 60.65 60.02 1k0t s ILE 38 Cb -0.12 -3.48 -0.01 0.00 0.15 0.00 0.00 42.46 39.01 1k0t s ILE 38 CO -0.07 0.52 1.44 0.00 -2.11 0.00 0.00 174.94 174.72 1k0t s ALA 39 N -1.13 3.26 0.27 1.50 0.00 -1.26 0.25 121.76 124.64 1k0t s ALA 39 Ca 0.20 0.19 -0.20 0.00 0.00 0.00 0.00 51.96 52.15 1k0t s ALA 39 Cb -0.13 -3.84 0.02 0.00 0.00 0.00 0.00 23.12 19.18 1k0t s ALA 39 CO 0.10 -1.96 0.69 -1.12 0.00 0.00 0.00 175.76 173.47 1k0t s SER 40 N 3.59 -0.27 -0.03 0.00 0.01 0.42 -4.81 113.70 112.61 1k0t s SER 40 Ca 0.63 -0.60 -0.30 0.00 1.31 0.00 0.00 55.95 56.99 1k0t s SER 40 Cb -0.19 0.71 -0.04 0.00 0.21 0.00 0.00 66.02 66.71 1k0t s SER 40 CO 0.27 -1.31 1.20 -0.44 0.41 0.00 0.00 173.24 173.37 1k0t s SER 41 N -2.92 7.06 -0.07 2.44 0.01 -1.26 -1.72 113.70 117.24 1k0t s SER 41 Ca 0.11 1.85 -0.20 0.00 1.31 0.00 0.00 55.95 59.03 1k0t s SER 41 Cb -0.05 -2.56 -0.16 0.00 0.21 0.00 0.00 66.02 63.46 1k0t s SER 41 CO 0.06 -0.56 0.75 1.55 0.41 0.00 0.00 173.24 175.45 1k0t h PRO 42 N 7.34 -0.14 0.00 12.44 0.13 -1.90 -3.42 132.00 146.46 1k0t h PRO 42 Ca -0.36 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1k0t h PRO 42 Cb 1.17 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1k0t h PRO 42 CO 0.87 0.35 -0.04 0.54 -0.23 0.00 0.00 178.00 179.49 1k0t n ARG 43 N -4.84 0.00 -1.49 0.86 1.74 -1.26 -4.98 116.66 106.69 1k0t n ARG 43 Ca -0.07 -0.51 -0.04 0.00 -0.77 0.00 0.00 57.85 56.46 1k0t n ARG 43 Cb 0.27 -0.48 -0.01 0.00 -1.02 0.00 0.00 32.46 31.22 1k0t n ARG 43 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1k0t n THR 44 N 0.00 -0.05 -0.43 0.55 -1.04 -1.26 -4.68 114.28 107.37 1k0t n THR 44 Ca 0.00 0.00 0.36 0.00 -2.04 0.00 0.00 64.05 62.37 1k0t n THR 44 Cb 0.51 -0.40 0.66 0.00 -1.82 0.00 0.00 70.33 69.28 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 0.00 0.12 0.00 -2.82 4.11 -1.95 -3.39 114.58 110.64 1k0t h GLU 45 Ca -0.08 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.34 1k0t h GLU 45 Cb 0.47 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1k0t h GLU 45 CO 0.11 0.08 0.00 -3.47 0.07 0.00 0.00 179.01 175.80 1k0t n ASP 46 N -4.49 0.08 -0.63 3.06 -0.08 -1.26 -5.04 116.55 108.20 1k0t n ASP 46 Ca 0.34 -0.33 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 1k0t n ASP 46 Cb 1.36 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.82 1k0t n ASP 46 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1k0t n VAL 48 N -0.73 0.14 -1.98 0.00 0.24 -1.26 -5.01 118.33 109.73 1k0t n VAL 48 Ca 0.00 -1.71 -0.00 0.00 -2.04 0.00 0.00 64.34 60.59 1k0t n VAL 48 Cb 0.00 0.95 0.00 0.00 -1.47 0.00 0.00 33.84 33.32 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 -0.53 -0.58 2.98 7.63 0.00 -1.26 -5.06 105.19 108.37 1k0t n GLY 49 Ca -0.01 0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1k0t n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k0t s LYS 51 N 1.45 3.42 0.13 0.00 3.01 -1.26 -4.33 119.74 122.15 1k0t s LYS 51 Ca 0.00 -1.43 0.00 0.00 -1.01 0.00 0.00 55.97 53.53 1k0t s LYS 51 Cb -0.15 -5.38 0.00 0.00 -1.01 0.00 0.00 37.83 31.28 1k0t s LYS 51 CO -0.09 -2.74 0.00 0.54 0.51 0.00 0.00 175.35 173.57 1k0t n ARG 52 N 8.54 0.00 -0.02 1.68 5.12 -1.26 -4.89 116.66 125.83 1k0t n ARG 52 Ca 0.43 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 56.35 1k0t n ARG 52 Cb 0.47 -0.28 -0.00 0.00 -1.16 0.00 0.00 32.46 31.49 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 -3.00 -0.69 0.02 0.00 0.28 -1.26 -4.48 120.64 111.50 1k0t n GLU 54 Ca -0.00 0.04 0.00 0.00 -0.16 0.00 0.00 57.16 57.04 1k0t n GLU 54 Cb 0.01 -0.82 0.00 0.00 1.43 0.00 0.00 31.44 32.07 1k0t n GLU 54 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1k0t n THR 55 N -2.17 0.00 0.00 3.84 5.66 -1.25 -4.95 114.28 115.41 1k0t n THR 55 Ca -0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 1k0t n THR 55 Cb 0.29 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.07 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 -2.39 0.00 -3.80 1.79 0.00 -1.26 -4.60 120.51 110.24 1k0t n ALA 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1k0t n ALA 56 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 -0.65 0.41 0.01 0.00 -0.04 -1.26 -4.87 135.00 128.60 1k0t n PRO 58 Ca -0.03 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.55 1k0t n PRO 58 Cb 0.61 0.00 0.23 0.00 -0.04 0.00 0.00 33.50 34.30 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 -1.03 0.06 -0.68 0.52 -1.04 -1.26 -3.76 114.28 107.09 1k0t n THR 59 Ca 0.00 -0.05 0.52 0.00 -2.04 0.00 0.00 64.05 62.48 1k0t n THR 59 Cb 0.00 0.19 0.81 0.00 -1.82 0.00 0.00 70.33 69.51 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 -2.03 -3.18 116.42 124.40 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 0.55 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.06 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 -3.92 -0.10 -1.69 4.55 3.72 -1.26 -5.03 117.46 113.73 1k0t n PHE 61 Ca 0.43 0.02 -0.63 0.00 -0.05 0.00 0.00 57.45 57.22 1k0t n PHE 61 Cb 1.98 0.04 -0.09 0.00 -0.94 0.00 0.00 39.48 40.47 1k0t n PHE 61 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1k0t n LEU 62 N -3.06 1.33 0.13 4.37 4.77 -1.20 -4.73 117.00 118.60 1k0t n LEU 62 Ca 0.00 1.15 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 1k0t n LEU 62 Cb 0.00 -0.97 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 1k0t n LEU 62 CO 0.00 -0.92 0.00 -1.20 -1.33 0.00 0.00 177.39 173.94 1k0t n SER 63 N 3.86 -0.20 0.00 -1.43 7.64 -1.26 -4.62 113.62 117.61 1k0t n SER 63 Ca 0.28 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.59 1k0t n SER 63 Cb 0.02 0.40 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 1k0t n SER 63 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1k0t n ILE 64 N -3.35 0.00 -3.44 0.44 2.08 -1.26 -4.44 119.36 109.39 1k0t n ILE 64 Ca 0.00 1.27 -0.38 0.00 0.56 0.00 0.00 62.75 64.20 1k0t n ILE 64 Cb 0.00 -1.94 -0.06 0.00 -0.75 0.00 0.00 39.64 36.88 1k0t n ILE 64 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 1k0t s ARG 65 N -2.07 4.18 -0.25 0.38 0.52 -1.26 -4.97 118.95 115.48 1k0t s ARG 65 Ca 0.00 0.34 0.11 0.00 -0.52 0.00 0.00 55.73 55.66 1k0t s ARG 65 Cb 0.00 -3.36 0.46 0.00 0.52 0.00 0.00 34.95 32.56 1k0t s ARG 65 CO 0.00 0.35 1.19 0.28 0.02 0.00 0.00 175.30 177.14 1k0t n VAL 66 N 3.05 2.13 -3.95 3.52 0.31 -1.26 -4.73 118.33 117.40 1k0t n VAL 66 Ca -0.11 -3.62 -0.09 0.00 -0.01 0.00 0.00 64.34 60.52 1k0t n VAL 66 Cb 0.52 -0.46 -0.09 0.00 -0.91 0.00 0.00 33.84 32.90 1k0t n VAL 66 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1k0t s TYR 67 N -3.33 0.24 0.66 3.52 -0.85 -1.26 -4.38 117.35 111.95 1k0t s TYR 67 Ca 0.44 -0.59 -0.11 0.00 -0.52 0.00 0.00 57.07 56.29 1k0t s TYR 67 Cb 0.39 -0.17 0.17 0.00 0.38 0.00 0.00 41.96 42.72 1k0t s TYR 67 CO -0.01 -0.36 0.37 1.28 -1.52 0.00 0.00 175.55 175.31 1k0t n LEU 68 N 0.69 0.00 0.10 -3.49 4.77 -1.26 -3.73 117.00 114.08 1k0t n LEU 68 Ca -0.18 -0.38 0.17 0.00 -0.03 0.00 0.00 56.01 55.59 1k0t n LEU 68 Cb 0.59 -0.45 0.51 0.00 -2.33 0.00 0.00 43.42 41.74 1k0t n LEU 68 CO 0.23 -2.08 1.16 1.23 -1.33 0.00 0.00 177.39 176.60 1k0t h GLY 69 N -2.13 0.00 0.00 -0.72 0.00 -1.93 -3.44 103.07 94.85 1k0t h GLY 69 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1k0t h GLY 69 CO 0.10 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.64 1k0t n ALA 70 N -2.04 0.00 -0.83 3.60 0.00 -1.26 -4.81 120.51 115.17 1k0t n ALA 70 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1k0t n ALA 70 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.38 1k0t n ALA 70 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1k0t n GLU 71 N 0.00 0.00 -2.42 0.00 0.00 -1.26 -4.72 120.64 112.24 1k0t n GLU 71 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 57.16 57.14 1k0t n GLU 71 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 31.44 31.44 1k0t n GLU 71 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1k0t n THR 72 N 0.00 0.00 -0.01 6.31 -2.24 -1.26 -4.58 114.28 112.49 1k0t n THR 72 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 1k0t n THR 72 Cb 0.00 -0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.19 1k0t n THR 72 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1k0t n THR 73 N -2.36 0.18 0.05 4.28 5.66 -1.26 -3.40 114.28 117.43 1k0t n THR 73 Ca 0.00 -0.09 0.02 0.00 -3.05 0.00 0.00 64.05 60.93 1k0t n THR 73 Cb 0.46 -0.82 -0.06 0.00 -1.55 0.00 0.00 70.33 68.36 1k0t n THR 73 CO 0.00 0.00 0.00 0.03 -3.05 0.00 0.00 175.07 172.05 1k0t h ARG 74 N 0.00 0.00 0.00 1.09 3.08 -1.97 -3.35 114.38 113.23 1k0t h ARG 74 Ca -0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1k0t h ARG 74 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1k0t h ARG 74 CO -0.00 0.28 0.00 0.43 -1.07 0.00 0.00 179.97 179.61 1k0t n SER 75 N -2.91 0.99 0.00 7.04 7.64 -1.26 -4.99 113.62 120.13 1k0t n SER 75 Ca -0.07 -1.11 0.00 0.00 1.01 0.00 0.00 58.87 58.70 1k0t n SER 75 Cb 0.79 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.99 1k0t n SER 75 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1k0t n MET 76 N -0.06 0.00 0.00 1.43 1.56 -1.22 -1.94 117.12 116.89 1k0t n MET 76 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1k0t n MET 76 Cb 0.06 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.43 1k0t n MET 76 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1k0t n GLY 77 N 0.00 0.32 0.36 -5.12 0.00 -1.26 -4.44 105.19 95.04 1k0t n GLY 77 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 0.00 1.68 -0.61 0.99 -0.00 -1.15 -4.47 117.00 113.45 1k0t n LEU 78 Ca 0.00 0.14 0.47 0.00 -0.00 0.00 0.00 56.01 56.62 1k0t n LEU 78 Cb 0.00 -0.53 0.75 0.00 -0.00 0.00 0.00 43.42 43.63 1k0t n LEU 78 CO 0.00 0.47 1.35 0.00 -0.00 0.00 0.00 177.39 179.21 1k0t n ALA 79 N -3.59 1.66 0.43 1.96 0.00 -0.82 -5.12 120.51 115.03 1k0t n ALA 79 Ca -0.33 0.70 0.03 0.00 0.00 0.00 0.00 53.44 53.84 1k0t n ALA 79 Cb 0.76 -1.07 0.20 0.00 0.00 0.00 0.00 19.45 19.34 1k0t n ALA 79 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98