#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 -3.27 0.00 0.66 -0.00 -1.26 -4.61 115.22 106.73 1k0t n HIS 2 Ca 0.00 1.40 0.00 0.00 -0.00 0.00 0.00 57.72 59.12 1k0t n HIS 2 Cb 0.00 -2.53 0.00 0.00 -0.00 0.00 0.00 29.99 27.46 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 -3.87 0.00 0.00 0.41 3.41 -1.26 -4.45 113.62 107.85 1k0t n SER 3 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 1k0t n SER 3 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 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 -1.93 0.00 0.00 -3.33 3.14 -1.26 -4.55 118.33 110.40 1k0t n VAL 4 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1k0t n VAL 4 Cb 0.00 -0.29 0.00 0.00 -1.06 0.00 0.00 33.84 32.49 1k0t n VAL 4 CO 0.00 0.00 0.00 1.17 -6.46 0.00 0.00 176.83 171.54 1k0t n LYS 5 N -2.22 0.00 -3.74 1.45 3.00 -1.26 -4.19 118.16 111.20 1k0t n LYS 5 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 58.31 57.94 1k0t n LYS 5 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 35.03 34.92 1k0t n LYS 5 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.40 177.82 1k0t s ILE 6 N 0.00 3.51 0.01 3.15 1.09 -1.26 -4.46 121.20 123.24 1k0t s ILE 6 Ca 0.00 -1.83 -0.03 0.00 -1.10 0.00 0.00 60.65 57.69 1k0t s ILE 6 Cb 0.00 -3.30 -0.01 0.00 -1.06 0.00 0.00 42.46 38.09 1k0t s ILE 6 CO 0.00 -0.60 0.05 -0.31 -0.10 0.00 0.00 174.94 173.98 1k0t s TYR 7 N 1.23 0.15 -0.33 3.97 2.02 -1.26 -5.04 117.35 118.09 1k0t s TYR 7 Ca 0.05 -0.32 -0.03 0.00 -0.37 0.00 0.00 57.07 56.41 1k0t s TYR 7 Cb -0.23 -0.12 0.08 0.00 -0.40 0.00 0.00 41.96 41.30 1k0t s TYR 7 CO -0.02 -0.23 2.53 -0.40 -1.57 0.00 0.00 175.55 175.86 1k0t n ASP 8 N 1.60 6.29 -4.38 2.29 5.75 -1.26 -4.81 116.55 122.04 1k0t n ASP 8 Ca -0.23 -3.04 -0.46 0.00 -0.01 0.00 0.00 54.79 51.06 1k0t n ASP 8 Cb 0.55 -1.18 -0.02 0.00 -1.03 0.00 0.00 41.12 39.45 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 -1.83 5.29 -0.14 2.12 -1.32 -1.26 -4.96 115.64 113.54 1k0t s THR 9 Ca 0.46 -2.20 -0.19 0.00 -1.21 0.00 0.00 61.69 58.55 1k0t s THR 9 Cb 0.30 -4.61 0.05 0.00 -1.51 0.00 0.00 72.50 66.73 1k0t s THR 9 CO -0.10 -1.24 0.49 0.00 -2.21 0.00 0.00 174.62 171.56 1k0t n ILE 11 N 2.29 0.21 0.00 0.00 -6.64 -1.26 -4.95 119.36 109.01 1k0t n ILE 11 Ca -0.16 -0.09 0.00 0.00 -1.77 0.00 0.00 62.75 60.73 1k0t n ILE 11 Cb 0.56 -0.71 0.00 0.00 -1.44 0.00 0.00 39.64 38.05 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 3.19 0.58 1.85 3.28 0.00 -1.26 -4.99 105.19 107.84 1k0t n GLY 12 Ca -0.06 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.42 2.80 -3.67 0.00 -2.24 -1.26 -4.95 114.28 103.53 1k0t n THR 14 Ca 0.05 -5.36 -0.12 0.00 -2.27 0.00 0.00 64.05 56.35 1k0t n THR 14 Cb 0.29 -1.98 -0.08 0.00 -2.10 0.00 0.00 70.33 66.45 1k0t n THR 14 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1k0t s GLN 15 N -2.70 0.64 0.00 -0.78 0.74 -1.26 -4.89 119.66 111.42 1k0t s GLN 15 Ca 0.41 0.89 0.00 0.00 0.05 0.00 0.00 55.36 56.70 1k0t s GLN 15 Cb 0.16 0.24 0.00 0.00 1.10 0.00 0.00 33.01 34.51 1k0t s GLN 15 CO -0.02 -0.11 0.00 0.00 -0.55 0.00 0.00 175.29 174.61 1k0t n VAL 17 N 0.00 0.55 0.00 0.00 0.31 -1.26 -3.75 118.33 114.18 1k0t n VAL 17 Ca 0.00 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1k0t n VAL 17 Cb 0.00 -0.04 0.00 0.00 -0.91 0.00 0.00 33.84 32.89 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 0.23 0.00 -2.88 5.55 3.00 -1.26 -4.92 116.66 116.38 1k0t n ARG 18 Ca 0.09 0.00 -0.44 0.00 -0.01 0.00 0.00 57.85 57.49 1k0t n ARG 18 Cb 0.34 -0.78 -0.02 0.00 0.00 0.00 0.00 32.46 32.00 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 -1.78 3.43 -0.31 7.54 0.00 -1.25 -4.73 121.76 124.67 1k0t s ALA 19 Ca 0.00 -2.85 -0.11 0.00 0.00 0.00 0.00 51.96 49.00 1k0t s ALA 19 Cb 0.00 -4.14 0.20 0.00 0.00 0.00 0.00 23.12 19.18 1k0t s ALA 19 CO 0.00 -3.01 1.13 0.00 0.00 0.00 0.00 175.76 173.88 1k0t h PRO 21 N 4.78 0.61 0.00 0.00 0.13 -1.99 -3.38 132.00 132.15 1k0t h PRO 21 Ca -0.04 -0.60 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 1k0t h PRO 21 Cb 1.22 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1k0t h PRO 21 CO -0.11 1.21 0.00 1.28 -0.23 0.00 0.00 178.00 180.15 1k0t n LEU 22 N -3.84 0.15 0.00 1.56 7.99 -1.26 -5.01 117.00 116.58 1k0t n LEU 22 Ca -0.08 0.30 0.00 0.00 -0.01 0.00 0.00 56.01 56.22 1k0t n LEU 22 Cb 0.82 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 44.13 1k0t n LEU 22 CO 0.53 0.00 0.00 0.47 -1.51 0.00 0.00 177.39 176.88 1k0t n ASP 23 N -0.32 0.00 0.00 -1.43 9.92 -1.26 -4.72 116.55 118.74 1k0t n ASP 23 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 1k0t n ASP 23 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 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 0.00 0.00 -1.34 2.53 0.31 -1.26 -3.68 118.33 114.89 1k0t n VAL 24 Ca 0.00 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.01 1k0t n VAL 24 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 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 -1.09 2.37 0.00 7.52 4.32 -1.26 -3.19 117.00 125.67 1k0t n LEU 25 Ca 0.00 -2.52 -0.10 0.00 -0.02 0.00 0.00 56.01 53.36 1k0t n LEU 25 Cb 0.00 -1.28 0.03 0.00 -1.62 0.00 0.00 43.42 40.54 1k0t n LEU 25 CO 0.00 -1.99 0.15 -0.62 -1.22 0.00 0.00 177.39 173.72 1k0t n GLU 26 N 7.87 0.86 -2.72 3.23 -0.58 0.83 -4.53 120.64 125.60 1k0t n GLU 26 Ca 0.46 -1.61 -0.42 0.00 -0.42 0.00 0.00 57.16 55.16 1k0t n GLU 26 Cb 0.44 -0.06 -0.03 0.00 -0.57 0.00 0.00 31.44 31.22 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 -3.29 4.42 0.29 3.49 0.23 -1.26 0.10 119.30 123.29 1k0t s MET 27 Ca 0.28 1.34 0.06 0.00 -1.03 0.00 0.00 55.69 56.34 1k0t s MET 27 Cb -0.02 -3.54 -0.06 0.00 -1.53 0.00 0.00 34.83 29.68 1k0t s MET 27 CO 0.18 -0.28 -0.03 0.14 -2.03 0.00 0.00 175.02 172.99 1k0t s VAL 28 N 1.90 1.59 -0.28 5.16 -7.23 -0.52 -4.83 120.40 116.18 1k0t s VAL 28 Ca 0.47 -2.10 -0.29 0.00 -1.81 0.00 0.00 61.98 58.26 1k0t s VAL 28 Cb -0.18 -2.54 -0.00 0.00 0.56 0.00 0.00 36.38 34.21 1k0t s VAL 28 CO 0.18 -0.23 1.34 -2.16 -0.31 0.00 0.00 175.10 173.92 1k0t s PRO 29 N -3.75 3.91 0.28 4.82 0.04 -1.26 -1.74 135.00 137.31 1k0t s PRO 29 Ca 0.31 1.32 0.02 0.00 0.04 0.00 0.00 61.00 62.69 1k0t s PRO 29 Cb 0.05 -3.89 -0.04 0.00 0.04 0.00 0.00 34.50 30.66 1k0t s PRO 29 CO 0.13 -1.12 0.14 -0.46 0.04 0.00 0.00 177.00 175.73 1k0t s TRP 30 N 4.44 1.55 -0.41 0.56 -0.11 -0.30 -4.69 118.94 119.98 1k0t s TRP 30 Ca 0.58 -1.33 0.10 0.00 1.22 0.00 0.00 56.10 56.68 1k0t s TRP 30 Cb -0.18 -0.84 0.34 0.00 -1.50 0.00 0.00 33.47 31.29 1k0t s TRP 30 CO 0.23 -0.49 0.75 -3.47 -4.62 0.00 0.00 176.95 169.35 1k0t n ASP 31 N -0.76 1.39 0.00 5.86 2.03 -1.26 -3.50 116.55 120.30 1k0t n ASP 31 Ca 0.01 -3.10 0.00 0.00 0.52 0.00 0.00 54.79 52.22 1k0t n ASP 31 Cb 0.65 -0.61 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 0.30 0.09 3.78 0.27 0.00 -1.26 -5.03 105.19 103.35 1k0t n GLY 32 Ca 0.26 -0.05 -0.30 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 -1.15 0.00 -0.12 0.00 3.11 -1.94 0.14 116.57 116.61 1k0t h LYS 34 Ca -0.47 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.37 1k0t h LYS 34 Cb 1.26 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.49 1k0t h LYS 34 CO 0.57 0.01 -0.00 0.00 -2.81 0.00 0.00 179.45 177.22 1k0t n ALA 35 N -2.19 2.62 -4.01 5.00 0.00 -1.26 -4.98 120.51 115.69 1k0t n ALA 35 Ca -0.03 -2.50 -0.31 0.00 0.00 0.00 0.00 53.44 50.60 1k0t n ALA 35 Cb 0.11 -0.53 -0.02 0.00 0.00 0.00 0.00 19.45 19.00 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 -1.02 -0.42 3.29 0.00 0.00 0.50 -4.89 105.19 102.64 1k0t n GLY 36 Ca 0.19 0.23 -0.08 0.00 0.00 0.00 0.00 46.02 46.36 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 0.35 -0.13 1.61 1.03 -1.23 -1.15 119.66 113.35 1k0t s GLN 37 Ca 0.15 1.02 -0.10 0.00 0.04 0.00 0.00 55.36 56.47 1k0t s GLN 37 Cb -0.07 0.30 -0.05 0.00 0.03 0.00 0.00 33.01 33.23 1k0t s GLN 37 CO 0.92 -0.23 0.21 -1.50 -2.54 0.00 0.00 175.29 172.15 1k0t s ILE 38 N 2.44 5.37 -0.49 3.63 1.10 -0.71 -4.63 121.20 127.92 1k0t s ILE 38 Ca -0.03 0.37 -0.28 0.00 -0.51 0.00 0.00 60.65 60.20 1k0t s ILE 38 Cb -0.11 -3.51 0.00 0.00 0.15 0.00 0.00 42.46 38.99 1k0t s ILE 38 CO -0.13 0.53 1.54 0.00 -2.11 0.00 0.00 174.94 174.77 1k0t s ALA 39 N -0.43 2.79 0.33 1.50 0.00 -1.26 -1.44 121.76 123.26 1k0t s ALA 39 Ca 0.15 -0.38 -0.11 0.00 0.00 0.00 0.00 51.96 51.63 1k0t s ALA 39 Cb -0.13 -4.07 0.04 0.00 0.00 0.00 0.00 23.12 18.96 1k0t s ALA 39 CO 0.04 -2.87 0.63 0.43 0.00 0.00 0.00 175.76 173.99 1k0t n SER 40 N 9.93 -1.83 -4.66 0.00 7.64 0.29 -4.76 113.62 120.23 1k0t n SER 40 Ca 0.16 -2.41 -0.43 0.00 1.01 0.00 0.00 58.87 57.21 1k0t n SER 40 Cb 0.49 3.09 -0.02 0.00 -1.01 0.00 0.00 64.21 66.75 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 -2.78 6.95 -0.07 6.43 1.04 -1.19 -0.12 113.70 123.95 1k0t s SER 41 Ca 0.15 1.53 -0.20 0.00 0.48 0.00 0.00 55.95 57.91 1k0t s SER 41 Cb -0.04 -2.54 -0.16 0.00 0.10 0.00 0.00 66.02 63.39 1k0t s SER 41 CO 0.11 -0.78 0.76 1.55 0.98 0.00 0.00 173.24 175.86 1k0t h PRO 42 N 8.14 -0.13 0.00 4.02 0.13 -1.88 -3.43 132.00 138.85 1k0t h PRO 42 Ca -0.24 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1k0t h PRO 42 Cb 1.09 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1k0t h PRO 42 CO 0.98 0.35 -0.11 0.54 -0.23 0.00 0.00 178.00 179.54 1k0t n ARG 43 N -4.84 0.00 -1.93 0.86 1.74 -1.26 -4.98 116.66 106.25 1k0t n ARG 43 Ca -0.07 -0.42 0.00 0.00 -0.77 0.00 0.00 57.85 56.59 1k0t n ARG 43 Cb 0.27 -0.31 0.00 0.00 -1.02 0.00 0.00 32.46 31.40 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 0.00 -0.21 0.55 -1.04 -1.26 -4.68 114.28 107.64 1k0t n THR 44 Ca 0.00 0.00 0.17 0.00 -2.04 0.00 0.00 64.05 62.18 1k0t n THR 44 Cb 0.54 0.00 0.50 0.00 -1.82 0.00 0.00 70.33 69.55 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 0.42 0.00 -2.82 4.11 -1.94 -3.41 114.58 110.93 1k0t h GLU 45 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1k0t h GLU 45 Cb 0.62 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1k0t h GLU 45 CO 0.00 0.28 0.00 -3.47 0.07 0.00 0.00 179.01 175.89 1k0t n ASP 46 N -4.50 0.00 -0.60 3.06 2.03 -1.26 -5.04 116.55 110.24 1k0t n ASP 46 Ca 0.17 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.48 1k0t n ASP 46 Cb 0.61 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.01 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 -0.37 0.53 -1.38 0.00 0.24 -1.26 -5.00 118.33 111.08 1k0t n VAL 48 Ca 0.00 -1.62 0.00 0.00 -2.04 0.00 0.00 64.34 60.68 1k0t n VAL 48 Cb 0.00 0.80 0.00 0.00 -1.47 0.00 0.00 33.84 33.17 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 0.11 -0.12 3.51 7.63 0.00 -1.26 -5.09 105.19 109.97 1k0t n GLY 49 Ca 0.09 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.85 3.10 0.31 0.00 1.02 -1.26 -4.68 119.74 116.38 1k0t s LYS 51 Ca 0.18 -1.99 0.00 0.00 0.02 0.00 0.00 55.97 54.18 1k0t s LYS 51 Cb -0.11 -4.27 0.00 0.00 -0.52 0.00 0.00 37.83 32.93 1k0t s LYS 51 CO 0.09 -1.29 0.00 0.54 -0.92 0.00 0.00 175.35 173.77 1k0t n ARG 52 N 4.73 0.00 0.00 1.68 5.12 -1.26 -5.01 116.66 121.92 1k0t n ARG 52 Ca -0.04 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.88 1k0t n ARG 52 Cb 0.42 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.72 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 -0.18 -1.16 -2.56 0.00 4.07 -1.26 -4.64 120.64 114.91 1k0t n GLU 54 Ca 0.00 0.10 -0.04 0.00 -0.06 0.00 0.00 57.16 57.16 1k0t n GLU 54 Cb 0.00 -4.14 0.08 0.00 -0.06 0.00 0.00 31.44 27.32 1k0t n GLU 54 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 1k0t n THR 55 N -3.35 0.00 -1.91 6.31 5.66 -1.26 -5.03 114.28 114.70 1k0t n THR 55 Ca 0.08 -1.04 -0.41 0.00 -3.05 0.00 0.00 64.05 59.63 1k0t n THR 55 Cb 0.41 0.86 -0.01 0.00 -1.55 0.00 0.00 70.33 70.05 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 -0.79 6.31 -0.32 1.79 0.00 -1.26 -3.36 120.51 122.88 1k0t n ALA 56 Ca -0.12 -4.01 0.04 0.00 0.00 0.00 0.00 53.44 49.36 1k0t n ALA 56 Cb 0.78 -3.10 -0.01 0.00 0.00 0.00 0.00 19.45 17.12 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 -2.50 0.73 0.00 0.00 -0.04 -1.26 -4.86 135.00 127.07 1k0t n PRO 58 Ca -0.00 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.59 1k0t n PRO 58 Cb 0.15 0.00 0.52 0.00 -0.04 0.00 0.00 33.50 34.12 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 -0.61 0.00 -0.10 0.52 -1.04 -1.26 -3.01 114.28 108.79 1k0t n THR 59 Ca 0.00 -0.02 0.26 0.00 -2.04 0.00 0.00 64.05 62.25 1k0t n THR 59 Cb 0.00 -0.14 0.67 0.00 -1.82 0.00 0.00 70.33 69.04 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 0.22 0.00 0.00 8.00 3.32 -1.98 -3.18 116.42 122.81 1k0t h ASP 60 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1k0t h ASP 60 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1k0t h ASP 60 CO 0.00 0.00 -0.62 0.49 -1.72 0.00 0.00 179.24 177.39 1k0t n PHE 61 N -3.69 0.00 -1.58 4.55 3.72 -1.25 -5.02 117.46 114.19 1k0t n PHE 61 Ca 0.16 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 57.09 1k0t n PHE 61 Cb 1.03 0.13 -0.05 0.00 -0.94 0.00 0.00 39.48 39.65 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 -2.60 3.05 0.00 4.37 4.77 -1.16 -3.66 117.00 121.77 1k0t n LEU 62 Ca 0.00 0.54 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 1k0t n LEU 62 Cb 0.31 -1.41 0.00 0.00 -2.33 0.00 0.00 43.42 39.99 1k0t n LEU 62 CO 0.00 -0.45 0.00 -1.54 -1.33 0.00 0.00 177.39 174.07 1k0t n SER 63 N 9.39 0.00 0.00 -1.43 3.41 -1.26 0.19 113.62 123.92 1k0t n SER 63 Ca 0.30 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.91 1k0t n SER 63 Cb 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 1k0t n SER 63 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1k0t n ILE 64 N 0.00 0.00 -3.69 -1.33 2.08 -1.24 -4.39 119.36 110.79 1k0t n ILE 64 Ca 0.00 0.85 -0.38 0.00 0.56 0.00 0.00 62.75 63.78 1k0t n ILE 64 Cb 0.00 -1.52 -0.12 0.00 -0.75 0.00 0.00 39.64 37.25 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 -0.70 3.25 -0.08 0.38 1.81 -1.26 -5.07 118.95 117.28 1k0t s ARG 65 Ca 0.00 -0.77 -0.20 0.00 -1.72 0.00 0.00 55.73 53.04 1k0t s ARG 65 Cb 0.00 -3.50 -0.04 0.00 -0.45 0.00 0.00 34.95 30.96 1k0t s ARG 65 CO 0.00 -0.43 0.56 0.08 -0.68 0.00 0.00 175.30 174.83 1k0t s VAL 66 N 1.57 5.08 0.00 3.52 1.01 -1.26 -4.54 120.40 125.78 1k0t s VAL 66 Ca 0.04 1.14 0.00 0.00 0.00 0.00 0.00 61.98 63.16 1k0t s VAL 66 Cb -0.17 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1k0t s VAL 66 CO 0.05 0.34 0.00 -1.22 0.00 0.00 0.00 175.10 174.27 1k0t n TYR 67 N 3.42 0.00 -0.22 5.22 4.02 -1.26 -4.76 117.16 123.58 1k0t n TYR 67 Ca -0.06 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.77 1k0t n TYR 67 Cb 0.51 0.13 -0.05 0.00 -0.02 0.00 0.00 39.34 39.91 1k0t n TYR 67 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 1k0t h LEU 68 N 0.00 -1.18 -6.15 7.72 3.38 -1.91 -1.11 115.31 116.06 1k0t h LEU 68 Ca 0.00 0.18 -0.75 0.00 0.09 0.00 0.00 57.88 57.40 1k0t h LEU 68 Cb 0.00 0.52 -0.13 0.00 0.09 0.00 0.00 40.66 41.14 1k0t h LEU 68 CO 0.00 -0.13 2.30 0.61 0.09 0.00 0.00 178.44 181.31 1k0t n GLY 69 N -1.14 4.82 1.54 0.83 0.00 -1.26 -3.71 105.19 106.27 1k0t n GLY 69 Ca 0.01 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.01 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 3.54 0.00 0.18 4.61 0.00 -0.50 -4.92 120.51 123.42 1k0t n ALA 70 Ca 0.48 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.95 1k0t n ALA 70 Cb 0.33 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.10 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 0.00 -2.03 0.00 4.11 -1.46 -3.20 114.58 112.00 1k0t h GLU 71 Ca 0.00 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.27 1k0t h GLU 71 Cb 0.00 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.19 1k0t h GLU 71 CO 0.00 0.43 -0.32 0.25 0.07 0.00 0.00 179.01 179.44 1k0t n THR 72 N -3.83 2.79 0.00 -1.06 -2.24 -1.24 -2.19 114.28 106.50 1k0t n THR 72 Ca -0.01 -1.34 0.00 0.00 -2.27 0.00 0.00 64.05 60.43 1k0t n THR 72 Cb 0.49 -1.93 0.00 0.00 -2.10 0.00 0.00 70.33 66.79 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 2.40 0.00 0.12 4.28 -1.04 -1.21 -4.69 114.28 114.14 1k0t n THR 73 Ca 0.37 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.40 1k0t n THR 73 Cb 0.84 -0.82 -0.03 0.00 -1.82 0.00 0.00 70.33 68.50 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 -2.56 2.88 -0.20 -2.82 0.00 -1.22 -4.50 116.66 108.24 1k0t n ARG 74 Ca 0.00 -0.02 0.08 0.00 -0.00 0.00 0.00 57.85 57.90 1k0t n ARG 74 Cb 0.26 -0.92 0.19 0.00 -0.00 0.00 0.00 32.46 31.99 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 -1.38 3.10 -0.11 2.89 2.88 -0.93 -4.39 113.62 115.68 1k0t n SER 75 Ca 0.00 -1.94 -0.13 0.00 -1.33 0.00 0.00 58.87 55.47 1k0t n SER 75 Cb 0.10 -0.26 -0.12 0.00 -0.75 0.00 0.00 64.21 63.17 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 0.90 0.77 -0.51 -1.46 1.56 -1.25 -4.36 117.12 112.76 1k0t n MET 76 Ca 0.15 0.07 -0.09 0.00 -0.27 0.00 0.00 57.70 57.56 1k0t n MET 76 Cb 0.47 -1.47 0.08 0.00 2.15 0.00 0.00 33.22 34.46 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 2.15 2.97 0.45 -5.12 0.00 -1.26 -3.40 105.19 100.98 1k0t n GLY 77 Ca -0.37 -0.45 -0.02 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.16 0.72 -0.03 0.99 4.77 -1.26 -4.97 117.00 117.06 1k0t n LEU 78 Ca 0.24 0.11 -0.07 0.00 -0.03 0.00 0.00 56.01 56.26 1k0t n LEU 78 Cb 0.97 -0.42 -0.02 0.00 -2.33 0.00 0.00 43.42 41.61 1k0t n LEU 78 CO 0.25 -0.49 -0.52 0.00 -1.33 0.00 0.00 177.39 175.30 1k0t n ALA 79 N -3.20 2.01 0.66 -1.18 0.00 -1.26 -5.18 120.51 112.35 1k0t n ALA 79 Ca -0.04 -0.44 0.08 0.00 0.00 0.00 0.00 53.44 53.04 1k0t n ALA 79 Cb 0.14 0.19 0.07 0.00 0.00 0.00 0.00 19.45 19.85 1k0t n ALA 79 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98