#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 -1.98 -1.29 1.43 -0.00 -1.26 -4.53 115.22 107.59 1k0t n HIS 2 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 1k0t n HIS 2 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 29.99 1k0t n HIS 2 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1k0t n SER 3 N -1.63 -6.95 -2.70 0.41 2.88 -1.26 -4.44 113.62 99.93 1k0t n SER 3 Ca 0.00 1.53 -0.06 0.00 -1.33 0.00 0.00 58.87 59.01 1k0t n SER 3 Cb 0.00 -3.99 0.04 0.00 -0.75 0.00 0.00 64.21 59.51 1k0t n SER 3 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 1k0t n VAL 4 N -2.38 1.37 -1.31 2.46 0.24 -1.26 -4.58 118.33 112.87 1k0t n VAL 4 Ca 0.00 -3.17 -0.35 0.00 -2.04 0.00 0.00 64.34 58.78 1k0t n VAL 4 Cb 0.39 0.78 0.11 0.00 -1.47 0.00 0.00 33.84 33.65 1k0t n VAL 4 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1k0t n LYS 5 N -0.46 0.48 -1.97 7.34 4.81 -1.26 -4.86 118.16 122.24 1k0t n LYS 5 Ca 0.13 0.23 -0.43 0.00 -0.87 0.00 0.00 58.31 57.37 1k0t n LYS 5 Cb 0.82 -2.41 -0.03 0.00 0.02 0.00 0.00 35.03 33.43 1k0t n LYS 5 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1k0t s ILE 6 N -1.88 3.49 0.28 3.15 1.09 -1.26 -4.93 121.20 121.14 1k0t s ILE 6 Ca 0.76 0.55 -0.20 0.00 -1.10 0.00 0.00 60.65 60.66 1k0t s ILE 6 Cb -0.32 -3.51 0.02 0.00 -1.06 0.00 0.00 42.46 37.59 1k0t s ILE 6 CO 0.48 -0.22 0.68 -0.31 -0.10 0.00 0.00 174.94 175.48 1k0t s TYR 7 N 5.67 -0.10 -0.28 3.97 2.02 -1.26 -5.03 117.35 122.34 1k0t s TYR 7 Ca 0.79 -0.35 -0.02 0.00 -0.37 0.00 0.00 57.07 57.12 1k0t s TYR 7 Cb -0.28 0.63 0.13 0.00 -0.40 0.00 0.00 41.96 42.04 1k0t s TYR 7 CO 0.32 -1.21 2.25 -0.40 -1.57 0.00 0.00 175.55 174.94 1k0t n ASP 8 N -0.46 6.24 -4.51 2.29 5.75 -1.26 -4.76 116.55 119.83 1k0t n ASP 8 Ca -0.04 -2.96 -0.42 0.00 -0.01 0.00 0.00 54.79 51.36 1k0t n ASP 8 Cb 0.59 -1.12 -0.03 0.00 -1.03 0.00 0.00 41.12 39.53 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 -1.77 4.18 -0.28 2.12 -1.32 -1.26 -4.91 115.64 112.41 1k0t s THR 9 Ca 0.34 -0.75 -0.19 0.00 -1.21 0.00 0.00 61.69 59.88 1k0t s THR 9 Cb 0.24 -4.90 0.09 0.00 -1.51 0.00 0.00 72.50 66.42 1k0t s THR 9 CO -0.04 -1.73 0.77 0.00 -2.21 0.00 0.00 174.62 171.41 1k0t n ILE 11 N 3.55 0.00 0.00 0.00 -0.00 -1.26 -4.98 119.36 116.67 1k0t n ILE 11 Ca -0.17 -0.29 0.00 0.00 -0.00 0.00 0.00 62.75 62.29 1k0t n ILE 11 Cb 0.57 0.82 0.00 0.00 -0.00 0.00 0.00 39.64 41.03 1k0t n ILE 11 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1k0t n GLY 12 N 1.42 1.24 3.79 3.28 0.00 -1.26 -5.11 105.19 108.56 1k0t n GLY 12 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.32 4.51 -4.05 0.00 5.66 -1.26 -4.97 114.28 112.85 1k0t n THR 14 Ca -0.00 -5.66 -0.14 0.00 -3.05 0.00 0.00 64.05 55.20 1k0t n THR 14 Cb 0.62 -1.45 -0.13 0.00 -1.55 0.00 0.00 70.33 67.81 1k0t n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1k0t s GLN 15 N -3.92 0.33 0.00 1.09 -2.07 -1.26 -4.78 119.66 109.05 1k0t s GLN 15 Ca 0.44 -0.32 0.00 0.00 -1.82 0.00 0.00 55.36 53.67 1k0t s GLN 15 Cb 0.25 -0.23 0.00 0.00 -1.09 0.00 0.00 33.01 31.95 1k0t s GLN 15 CO -0.16 0.05 0.00 0.00 -1.32 0.00 0.00 175.29 173.87 1k0t n VAL 17 N 0.00 0.93 0.00 0.00 0.31 -1.26 -4.06 118.33 114.24 1k0t n VAL 17 Ca 0.00 -0.57 0.00 0.00 -0.01 0.00 0.00 64.34 63.76 1k0t n VAL 17 Cb 0.00 -0.12 0.00 0.00 -0.91 0.00 0.00 33.84 32.81 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 0.39 0.00 -0.36 5.55 3.00 -1.26 -4.85 116.66 119.13 1k0t n ARG 18 Ca 0.12 0.00 0.01 0.00 -0.01 0.00 0.00 57.85 57.97 1k0t n ARG 18 Cb 0.52 -0.22 0.07 0.00 0.00 0.00 0.00 32.46 32.83 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 0.32 -0.91 7.54 0.00 -1.93 -3.39 119.26 120.90 1k0t h ALA 19 Ca 0.00 0.31 -0.84 0.00 0.00 0.00 0.00 54.91 54.38 1k0t h ALA 19 Cb 0.24 0.90 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1k0t h ALA 19 CO 0.00 -0.54 0.84 0.00 0.00 0.00 0.00 179.25 179.55 1k0t h PRO 21 N 6.09 0.21 0.00 0.00 0.13 -1.91 -3.42 132.00 133.10 1k0t h PRO 21 Ca -0.38 -0.21 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 1k0t h PRO 21 Cb 1.37 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.55 1k0t h PRO 21 CO 1.00 0.91 0.00 1.28 -0.23 0.00 0.00 178.00 180.96 1k0t n LEU 22 N -3.72 0.00 0.00 1.56 4.32 -1.26 -5.06 117.00 112.84 1k0t n LEU 22 Ca -0.03 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.96 1k0t n LEU 22 Cb 0.76 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.56 1k0t n LEU 22 CO 0.47 0.00 0.00 -0.67 -1.22 0.00 0.00 177.39 175.97 1k0t n ASP 23 N 0.00 0.00 -0.10 -1.43 2.03 -1.26 -5.04 116.55 110.74 1k0t n ASP 23 Ca 0.00 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.11 1k0t n ASP 23 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 1k0t n ASP 23 CO 0.00 0.00 0.00 0.55 -1.92 0.00 0.00 177.20 175.83 1k0t n VAL 24 N 0.00 1.16 -2.13 5.18 3.14 -1.26 -4.82 118.33 119.59 1k0t n VAL 24 Ca 0.00 -0.35 -0.32 0.00 -2.96 0.00 0.00 64.34 60.71 1k0t n VAL 24 Cb 0.00 -1.57 -0.04 0.00 -1.06 0.00 0.00 33.84 31.17 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 -6.79 3.24 0.00 6.55 1.02 -1.26 -4.16 118.68 117.28 1k0t s LEU 25 Ca -0.29 -0.48 0.00 0.00 0.02 0.00 0.00 54.13 53.39 1k0t s LEU 25 Cb 0.10 -2.55 0.00 0.00 0.02 0.00 0.00 46.19 43.75 1k0t s LEU 25 CO 0.40 -2.45 0.00 -0.62 0.02 0.00 0.00 176.35 173.70 1k0t n GLU 26 N 8.98 3.02 -3.38 1.70 1.02 0.35 -4.80 120.64 127.53 1k0t n GLU 26 Ca 0.32 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 57.08 1k0t n GLU 26 Cb 0.49 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.85 1k0t n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1k0t s MET 27 N 0.15 4.15 0.30 3.49 0.23 -1.26 -0.33 119.30 126.02 1k0t s MET 27 Ca 0.00 0.49 0.04 0.00 -1.03 0.00 0.00 55.69 55.19 1k0t s MET 27 Cb 0.00 -3.31 -0.06 0.00 -1.53 0.00 0.00 34.83 29.93 1k0t s MET 27 CO 0.00 0.46 0.05 0.14 -2.03 0.00 0.00 175.02 173.64 1k0t s VAL 28 N -0.39 1.12 -0.24 5.16 -7.23 -0.14 -4.88 120.40 113.80 1k0t s VAL 28 Ca 0.26 -2.01 -0.29 0.00 -1.81 0.00 0.00 61.98 58.12 1k0t s VAL 28 Cb -0.17 -2.69 -0.01 0.00 0.56 0.00 0.00 36.38 34.07 1k0t s VAL 28 CO 0.13 -0.06 1.31 -2.16 -0.31 0.00 0.00 175.10 174.01 1k0t s PRO 29 N -3.89 4.03 0.31 4.82 0.04 -1.26 -1.95 135.00 137.09 1k0t s PRO 29 Ca 0.35 1.45 0.03 0.00 0.04 0.00 0.00 61.00 62.87 1k0t s PRO 29 Cb 0.08 -3.85 -0.04 0.00 0.04 0.00 0.00 34.50 30.73 1k0t s PRO 29 CO 0.14 -0.97 0.16 -0.46 0.04 0.00 0.00 177.00 175.91 1k0t s TRP 30 N 4.09 1.60 -0.37 0.56 -0.00 0.37 -4.70 118.94 120.49 1k0t s TRP 30 Ca 0.57 -1.37 0.12 0.00 -0.00 0.00 0.00 56.10 55.41 1k0t s TRP 30 Cb -0.19 -0.86 0.34 0.00 -0.00 0.00 0.00 33.47 32.76 1k0t s TRP 30 CO 0.20 -0.52 0.72 -3.47 -0.00 0.00 0.00 176.95 173.88 1k0t n ASP 31 N -0.94 0.77 0.00 5.86 2.03 -1.26 -3.68 116.55 119.33 1k0t n ASP 31 Ca 0.01 -2.99 0.00 0.00 0.52 0.00 0.00 54.79 52.33 1k0t n ASP 31 Cb 0.65 -0.60 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 0.36 0.09 3.82 0.27 0.00 -1.26 -5.03 105.19 103.43 1k0t n GLY 32 Ca 0.25 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.32 0.00 -0.27 0.00 1.57 -2.00 -0.93 116.57 113.62 1k0t h LYS 34 Ca -0.49 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.24 1k0t h LYS 34 Cb 1.32 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.60 1k0t h LYS 34 CO 0.63 0.13 -0.01 0.00 -0.57 0.00 0.00 179.45 179.63 1k0t n ALA 35 N -2.33 3.29 -4.29 3.86 0.00 -1.26 -4.96 120.51 114.81 1k0t n ALA 35 Ca -0.02 -2.56 -0.33 0.00 0.00 0.00 0.00 53.44 50.52 1k0t n ALA 35 Cb 0.24 -0.70 -0.08 0.00 0.00 0.00 0.00 19.45 18.91 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 -0.77 -0.22 3.21 0.00 0.00 -0.36 -4.86 105.19 102.19 1k0t n GLY 36 Ca 0.24 0.20 -0.09 0.00 0.00 0.00 0.00 46.02 46.37 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 -7.41 0.30 -0.00 1.61 1.03 -1.24 -0.48 119.66 113.47 1k0t s GLN 37 Ca 0.07 0.96 -0.08 0.00 0.04 0.00 0.00 55.36 56.35 1k0t s GLN 37 Cb -0.04 0.23 -0.05 0.00 0.03 0.00 0.00 33.01 33.18 1k0t s GLN 37 CO 1.00 -0.28 0.29 -1.50 -2.54 0.00 0.00 175.29 172.25 1k0t s ILE 38 N 2.58 5.27 -0.56 3.63 1.10 -0.82 -4.72 121.20 127.68 1k0t s ILE 38 Ca -0.00 0.31 -0.28 0.00 -0.51 0.00 0.00 60.65 60.17 1k0t s ILE 38 Cb -0.12 -3.57 0.03 0.00 0.15 0.00 0.00 42.46 38.95 1k0t s ILE 38 CO -0.12 0.43 1.17 0.00 -2.11 0.00 0.00 174.94 174.30 1k0t s ALA 39 N -1.23 3.04 0.09 1.50 0.00 -1.26 -0.97 121.76 122.92 1k0t s ALA 39 Ca 0.26 -0.77 0.02 0.00 0.00 0.00 0.00 51.96 51.47 1k0t s ALA 39 Cb -0.14 -3.99 -0.01 0.00 0.00 0.00 0.00 23.12 18.99 1k0t s ALA 39 CO 0.14 -2.56 0.07 0.43 0.00 0.00 0.00 175.76 173.84 1k0t n SER 40 N 8.26 -0.08 -4.04 0.00 7.64 0.55 -4.87 113.62 121.07 1k0t n SER 40 Ca 0.09 -1.57 -0.34 0.00 1.01 0.00 0.00 58.87 58.06 1k0t n SER 40 Cb 0.49 0.42 -0.10 0.00 -1.01 0.00 0.00 64.21 64.01 1k0t n SER 40 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1k0t s SER 41 N -1.61 5.17 -0.05 6.43 1.04 -1.26 0.13 113.70 123.55 1k0t s SER 41 Ca 0.10 -3.24 -0.08 0.00 0.48 0.00 0.00 55.95 53.22 1k0t s SER 41 Cb 0.00 -1.80 -0.04 0.00 0.10 0.00 0.00 66.02 64.29 1k0t s SER 41 CO 0.07 -0.26 0.36 1.55 0.98 0.00 0.00 173.24 175.94 1k0t h PRO 42 N 6.45 -0.27 -5.12 4.02 0.13 -1.91 -3.39 132.00 131.91 1k0t h PRO 42 Ca 0.04 0.02 -0.70 0.00 -0.87 0.00 0.00 66.00 64.48 1k0t h PRO 42 Cb 0.88 0.06 -0.16 0.00 0.13 0.00 0.00 31.00 31.91 1k0t h PRO 42 CO 0.74 -0.18 1.29 1.03 -0.23 0.00 0.00 178.00 180.65 1k0t s ARG 43 N -2.43 3.85 -0.00 0.86 0.52 -1.26 -4.78 118.95 115.71 1k0t s ARG 43 Ca -0.04 -2.07 0.00 0.00 -0.52 0.00 0.00 55.73 53.10 1k0t s ARG 43 Cb 0.00 -5.10 0.01 0.00 0.52 0.00 0.00 34.95 30.39 1k0t s ARG 43 CO 0.12 -1.87 0.82 2.41 0.02 0.00 0.00 175.30 176.80 1k0t n THR 44 N 5.38 0.03 -0.03 0.02 -1.04 -1.26 -4.11 114.28 113.27 1k0t n THR 44 Ca 0.33 -0.02 0.23 0.00 -2.04 0.00 0.00 64.05 62.55 1k0t n THR 44 Cb 0.46 -0.19 0.54 0.00 -1.82 0.00 0.00 70.33 69.32 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 0.08 0.00 0.00 -2.82 4.11 -1.97 -3.39 114.58 110.59 1k0t h GLU 45 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1k0t h GLU 45 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1k0t h GLU 45 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 179.01 175.61 1k0t n ASP 46 N -3.32 0.31 -0.83 3.06 2.03 -1.26 -5.05 116.55 111.49 1k0t n ASP 46 Ca 0.14 -0.16 0.00 0.00 0.52 0.00 0.00 54.79 55.29 1k0t n ASP 46 Cb 1.11 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.51 1k0t n ASP 46 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1k0t n VAL 48 N -1.38 0.05 -2.06 0.00 3.14 -1.26 -5.01 118.33 111.80 1k0t n VAL 48 Ca 0.00 -1.56 -0.01 0.00 -2.96 0.00 0.00 64.34 59.80 1k0t n VAL 48 Cb 0.10 0.99 0.01 0.00 -1.06 0.00 0.00 33.84 33.87 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 -0.60 -0.39 0.06 7.55 0.00 -1.26 -4.98 105.19 105.56 1k0t n GLY 49 Ca -0.03 0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.25 0.00 0.00 0.00 5.02 -1.26 -4.73 118.16 116.94 1k0t n LYS 51 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1k0t n LYS 51 Cb 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.05 1k0t n LYS 51 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1k0t n ARG 52 N 7.33 0.00 -1.71 1.97 3.00 -1.26 -4.73 116.66 121.26 1k0t n ARG 52 Ca 0.00 0.00 -0.18 0.00 -0.01 0.00 0.00 57.85 57.66 1k0t n ARG 52 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.36 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 8.29 3.39 -2.55 0.00 2.13 -1.26 -4.63 120.64 126.01 1k0t n GLU 54 Ca 0.43 -4.27 -0.04 0.00 0.66 0.00 0.00 57.16 53.93 1k0t n GLU 54 Cb 0.46 -2.26 0.06 0.00 0.27 0.00 0.00 31.44 29.97 1k0t n GLU 54 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1k0t n THR 55 N -0.57 0.00 -0.28 6.31 5.66 -1.26 -4.99 114.28 119.15 1k0t n THR 55 Ca 0.43 -0.97 0.06 0.00 -3.05 0.00 0.00 64.05 60.52 1k0t n THR 55 Cb 0.71 0.80 0.20 0.00 -1.55 0.00 0.00 70.33 70.49 1k0t n THR 55 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1k0t h ALA 56 N 1.33 1.18 0.00 1.79 0.00 -1.81 -3.32 119.26 118.43 1k0t h ALA 56 Ca -0.38 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1k0t h ALA 56 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1k0t h ALA 56 CO -0.13 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.02 1k0t n PRO 58 N -0.30 2.22 0.00 0.00 -0.04 -1.26 -4.79 135.00 130.83 1k0t n PRO 58 Ca 0.00 -1.32 0.00 0.00 -0.04 0.00 0.00 63.50 62.14 1k0t n PRO 58 Cb 0.00 -2.28 0.00 0.00 -0.04 0.00 0.00 33.50 31.18 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 3.36 0.00 0.00 0.52 -1.04 -1.26 -4.84 114.28 111.01 1k0t n THR 59 Ca 0.47 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.48 1k0t n THR 59 Cb 0.40 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.91 1k0t n THR 59 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1k0t n ASP 60 N -3.04 0.00 0.00 8.00 2.03 -1.26 -4.46 116.55 117.82 1k0t n ASP 60 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1k0t n ASP 60 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1k0t n ASP 60 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1k0t n PHE 61 N 0.00 0.00 0.00 -0.67 3.72 -1.26 -5.05 117.46 114.20 1k0t n PHE 61 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1k0t n PHE 61 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 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 -1.96 0.00 -2.38 4.37 -0.00 -1.26 -4.72 117.00 111.06 1k0t n LEU 62 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 55.89 1k0t n LEU 62 Cb 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 43.42 43.47 1k0t n LEU 62 CO 0.00 0.00 0.11 -1.20 -0.00 0.00 0.00 177.39 176.30 1k0t n SER 63 N 0.00 -3.47 0.06 1.45 7.64 -1.26 -4.94 113.62 113.10 1k0t n SER 63 Ca 0.00 -0.34 0.00 0.00 1.01 0.00 0.00 58.87 59.54 1k0t n SER 63 Cb 0.00 -3.20 0.00 0.00 -1.01 0.00 0.00 64.21 60.00 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 -3.49 0.94 -3.39 0.44 5.41 -1.26 -4.91 119.36 113.10 1k0t n ILE 64 Ca -0.07 0.31 -0.44 0.00 1.00 0.00 0.00 62.75 63.55 1k0t n ILE 64 Cb 0.56 -1.36 -0.06 0.00 -0.71 0.00 0.00 39.64 38.08 1k0t n ILE 64 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 1k0t s ARG 65 N -1.92 2.83 0.47 0.38 3.00 -1.26 -5.05 118.95 117.40 1k0t s ARG 65 Ca 0.00 -1.74 -0.24 0.00 0.00 0.00 0.00 55.73 53.75 1k0t s ARG 65 Cb 0.00 -4.18 -0.08 0.00 0.00 0.00 0.00 34.95 30.69 1k0t s ARG 65 CO 0.00 -1.29 1.29 0.28 0.00 0.00 0.00 175.30 175.58 1k0t n VAL 66 N 5.11 2.95 0.00 3.52 0.31 -1.26 -4.59 118.33 124.37 1k0t n VAL 66 Ca -0.12 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.71 1k0t n VAL 66 Cb 0.40 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.73 1k0t n VAL 66 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1k0t n TYR 67 N -0.50 -0.59 -1.36 3.52 4.01 -1.26 -4.89 117.16 116.09 1k0t n TYR 67 Ca 0.08 0.00 -0.61 0.00 -0.16 0.00 0.00 57.90 57.21 1k0t n TYR 67 Cb 0.41 0.42 -0.11 0.00 -0.31 0.00 0.00 39.34 39.75 1k0t n TYR 67 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1k0t n LEU 68 N -2.26 0.86 -2.94 7.72 4.77 -1.26 -1.34 117.00 122.55 1k0t n LEU 68 Ca 0.00 0.81 -0.02 0.00 -0.03 0.00 0.00 56.01 56.77 1k0t n LEU 68 Cb 0.00 -0.87 0.00 0.00 -2.33 0.00 0.00 43.42 40.22 1k0t n LEU 68 CO 0.00 -0.77 0.27 0.61 -1.33 0.00 0.00 177.39 176.17 1k0t n GLY 69 N 6.34 -1.21 1.39 -0.72 0.00 -1.26 -4.74 105.19 104.99 1k0t n GLY 69 Ca 0.47 0.59 0.00 0.00 0.00 0.00 0.00 46.02 47.08 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 -1.44 0.00 -0.32 4.61 0.00 -0.45 -4.95 120.51 117.97 1k0t n ALA 70 Ca 0.02 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.62 1k0t n ALA 70 Cb 0.49 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.26 1k0t n ALA 70 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1k0t h GLU 71 N 0.00 0.08 -6.78 0.00 4.11 -1.90 -3.45 114.58 106.65 1k0t h GLU 71 Ca 0.00 -0.00 -0.49 0.00 0.07 0.00 0.00 59.36 58.94 1k0t h GLU 71 Cb 0.00 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 1k0t h GLU 71 CO 0.00 0.05 -0.95 0.25 0.07 0.00 0.00 179.01 178.44 1k0t n THR 72 N -5.36 -2.59 -0.03 -1.06 -2.24 -1.26 -4.86 114.28 96.89 1k0t n THR 72 Ca 0.24 -0.24 -0.03 0.00 -2.27 0.00 0.00 64.05 61.75 1k0t n THR 72 Cb 0.78 -2.26 -0.05 0.00 -2.10 0.00 0.00 70.33 66.70 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 -3.41 0.43 0.02 4.28 5.66 -1.26 -3.47 114.28 116.53 1k0t n THR 73 Ca -0.20 -0.27 0.06 0.00 -3.05 0.00 0.00 64.05 60.59 1k0t n THR 73 Cb 0.56 -0.77 -0.10 0.00 -1.55 0.00 0.00 70.33 68.47 1k0t n THR 73 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 1k0t n ARG 74 N -2.22 0.64 -0.02 1.09 0.00 -1.26 -4.15 116.66 110.74 1k0t n ARG 74 Ca -0.10 0.02 0.01 0.00 -0.00 0.00 0.00 57.85 57.77 1k0t n ARG 74 Cb 0.69 -1.68 0.01 0.00 -0.00 0.00 0.00 32.46 31.48 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 -2.59 1.92 -0.33 2.89 2.88 -1.26 -4.53 113.62 112.60 1k0t n SER 75 Ca -0.08 -1.83 -0.08 0.00 -1.33 0.00 0.00 58.87 55.55 1k0t n SER 75 Cb 0.70 -0.02 -0.07 0.00 -0.75 0.00 0.00 64.21 64.07 1k0t n SER 75 CO 0.00 0.00 0.00 0.80 -1.23 0.00 0.00 175.04 174.61 1k0t n MET 76 N -0.31 -0.33 0.00 -1.46 1.56 -1.23 -4.49 117.12 110.86 1k0t n MET 76 Ca 0.01 1.20 0.00 0.00 -0.27 0.00 0.00 57.70 58.64 1k0t n MET 76 Cb 0.23 -1.77 0.00 0.00 2.15 0.00 0.00 33.22 33.83 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 -1.22 0.00 0.38 -5.12 0.00 -1.26 -5.01 105.19 92.96 1k0t n GLY 77 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 0.05 0.08 0.99 4.77 -1.26 -4.83 117.00 116.80 1k0t n LEU 78 Ca 0.00 0.01 -0.23 0.00 -0.03 0.00 0.00 56.01 55.75 1k0t n LEU 78 Cb 0.00 -0.32 -0.15 0.00 -2.33 0.00 0.00 43.42 40.62 1k0t n LEU 78 CO 0.00 -0.50 -0.50 0.00 -1.33 0.00 0.00 177.39 175.06 1k0t h ALA 79 N -1.22 0.11 0.00 -1.18 0.00 -1.90 -3.53 119.26 111.54 1k0t h ALA 79 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 54.91 53.80 1k0t h ALA 79 Cb 0.02 0.43 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1k0t h ALA 79 CO 0.00 0.98 0.00 2.48 0.00 0.00 0.00 179.25 182.71