#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k0t s HIS 2 N 0.00 -0.04 0.59 1.43 0.00 -1.26 -4.58 115.29 111.42 1k0t s HIS 2 Ca 0.00 -0.43 0.00 0.00 -3.00 0.00 0.00 55.06 51.63 1k0t s HIS 2 Cb 0.00 0.73 0.00 0.00 -4.00 0.00 0.00 32.58 29.31 1k0t s HIS 2 CO 0.00 -1.18 0.00 -1.13 -1.00 0.00 0.00 174.74 171.43 1k0t n SER 3 N -0.86 -8.57 -2.75 7.38 3.41 -1.26 -4.83 113.62 106.14 1k0t n SER 3 Ca -0.06 1.84 -0.04 0.00 -0.26 0.00 0.00 58.87 60.35 1k0t n SER 3 Cb 0.60 -5.12 0.04 0.00 -0.26 0.00 0.00 64.21 59.47 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 -2.45 1.25 -0.35 -3.33 0.24 -1.26 -4.59 118.33 107.84 1k0t n VAL 4 Ca 0.00 -3.05 -0.15 0.00 -2.04 0.00 0.00 64.34 59.11 1k0t n VAL 4 Cb 0.44 0.97 0.14 0.00 -1.47 0.00 0.00 33.84 33.92 1k0t n VAL 4 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1k0t n LYS 5 N -0.43 -1.75 -3.02 7.34 4.76 -1.26 -4.74 118.16 119.06 1k0t n LYS 5 Ca 0.10 -0.69 -0.44 0.00 -2.87 0.00 0.00 58.31 54.41 1k0t n LYS 5 Cb 0.81 -1.23 0.00 0.00 -1.84 0.00 0.00 35.03 32.77 1k0t n LYS 5 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1k0t n ILE 6 N -4.27 4.71 -4.28 -0.18 2.08 -1.26 -4.71 119.36 111.44 1k0t n ILE 6 Ca 0.07 -5.28 -0.24 0.00 0.56 0.00 0.00 62.75 57.86 1k0t n ILE 6 Cb 0.29 -2.38 -0.08 0.00 -0.75 0.00 0.00 39.64 36.72 1k0t n ILE 6 CO 0.00 0.00 0.00 -0.31 0.56 0.00 0.00 176.55 176.80 1k0t s TYR 7 N -0.96 2.62 -0.25 1.39 2.02 -1.26 -5.01 117.35 115.90 1k0t s TYR 7 Ca 0.34 -0.33 -0.02 0.00 -0.37 0.00 0.00 57.07 56.70 1k0t s TYR 7 Cb -0.01 -1.35 0.08 0.00 -0.40 0.00 0.00 41.96 40.27 1k0t s TYR 7 CO 0.00 0.53 2.40 -0.40 -1.57 0.00 0.00 175.55 176.51 1k0t n ASP 8 N -0.94 6.10 -4.44 2.29 5.75 -1.26 -4.81 116.55 119.24 1k0t n ASP 8 Ca -0.05 -2.90 -0.44 0.00 -0.01 0.00 0.00 54.79 51.39 1k0t n ASP 8 Cb 0.61 -1.16 -0.03 0.00 -1.03 0.00 0.00 41.12 39.51 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 -1.42 4.74 -0.24 2.12 -1.32 -1.26 -4.94 115.64 113.33 1k0t s THR 9 Ca 0.36 -1.46 -0.21 0.00 -1.21 0.00 0.00 61.69 59.17 1k0t s THR 9 Cb 0.24 -4.73 0.06 0.00 -1.51 0.00 0.00 72.50 66.56 1k0t s THR 9 CO -0.05 -1.45 0.63 0.00 -2.21 0.00 0.00 174.62 171.54 1k0t n ILE 11 N 2.92 0.00 0.00 0.00 -6.64 -1.26 -4.98 119.36 109.39 1k0t n ILE 11 Ca -0.15 -0.22 0.00 0.00 -1.77 0.00 0.00 62.75 60.62 1k0t n ILE 11 Cb 0.56 0.39 0.00 0.00 -1.44 0.00 0.00 39.64 39.14 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 1.89 1.68 3.83 3.28 0.00 -1.26 -5.12 105.19 109.50 1k0t n GLY 12 Ca -0.01 0.00 -0.25 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 -1.50 0.34 -0.04 0.00 5.66 -1.26 -4.87 114.28 112.60 1k0t n THR 14 Ca -0.01 -4.39 -0.08 0.00 -3.05 0.00 0.00 64.05 56.51 1k0t n THR 14 Cb 0.64 -1.99 -0.03 0.00 -1.55 0.00 0.00 70.33 67.40 1k0t n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1k0t n GLN 15 N 1.37 0.17 -0.13 1.09 10.64 -1.26 -4.42 117.38 124.84 1k0t n GLN 15 Ca 0.25 0.07 0.02 0.00 -1.83 0.00 0.00 57.00 55.51 1k0t n GLN 15 Cb 0.48 -0.78 0.08 0.00 -0.86 0.00 0.00 30.24 29.16 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 0.04 0.67 -0.03 0.00 0.31 -1.26 -4.76 118.33 113.30 1k0t n VAL 17 Ca 0.06 -0.71 -0.05 0.00 -0.01 0.00 0.00 64.34 63.62 1k0t n VAL 17 Cb 0.27 0.69 -0.02 0.00 -0.91 0.00 0.00 33.84 33.87 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 -0.34 0.11 -1.38 5.55 3.00 -1.08 -4.79 116.66 117.74 1k0t n ARG 18 Ca 0.00 0.05 -0.41 0.00 -0.01 0.00 0.00 57.85 57.47 1k0t n ARG 18 Cb 0.29 -0.74 -0.03 0.00 0.00 0.00 0.00 32.46 31.98 1k0t n ARG 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1k0t n ALA 19 N -3.15 4.58 -3.20 7.54 0.00 -1.19 -4.64 120.51 120.45 1k0t n ALA 19 Ca -0.10 -3.48 -0.00 0.00 0.00 0.00 0.00 53.44 49.86 1k0t n ALA 19 Cb 0.58 -3.54 -0.02 0.00 0.00 0.00 0.00 19.45 16.46 1k0t n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k0t h PRO 21 N 8.03 0.44 0.00 0.00 0.13 -1.93 -2.98 132.00 135.69 1k0t h PRO 21 Ca -0.03 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1k0t h PRO 21 Cb 1.17 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.41 1k0t h PRO 21 CO 0.18 1.08 0.00 1.28 -0.23 0.00 0.00 178.00 180.31 1k0t n LEU 22 N -4.23 0.25 -2.83 1.56 4.77 -1.26 -4.90 117.00 110.35 1k0t n LEU 22 Ca -0.09 0.58 -0.06 0.00 -0.03 0.00 0.00 56.01 56.41 1k0t n LEU 22 Cb 0.64 -0.58 0.01 0.00 -2.33 0.00 0.00 43.42 41.16 1k0t n LEU 22 CO 0.46 -0.52 -0.21 0.47 -1.33 0.00 0.00 177.39 176.26 1k0t n ASP 23 N -1.80 -7.87 0.00 -1.43 9.92 -1.13 -5.02 116.55 109.22 1k0t n ASP 23 Ca 0.01 0.89 0.00 0.00 -0.53 0.00 0.00 54.79 55.16 1k0t n ASP 23 Cb 0.11 -5.12 0.00 0.00 -0.64 0.00 0.00 41.12 35.46 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 0.17 0.00 -1.51 2.53 0.31 -1.26 -4.95 118.33 113.62 1k0t n VAL 24 Ca 0.06 0.03 -0.35 0.00 -0.01 0.00 0.00 64.34 64.06 1k0t n VAL 24 Cb 0.28 -0.90 -0.14 0.00 -0.91 0.00 0.00 33.84 32.17 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 -2.08 0.33 0.00 7.52 4.32 -1.26 -4.54 117.00 121.29 1k0t n LEU 25 Ca 0.00 -0.14 -0.00 0.00 -0.02 0.00 0.00 56.01 55.85 1k0t n LEU 25 Cb 0.00 -0.98 -0.00 0.00 -1.62 0.00 0.00 43.42 40.82 1k0t n LEU 25 CO 0.00 -1.07 -0.00 -0.62 -1.22 0.00 0.00 177.39 174.48 1k0t n GLU 26 N 8.02 1.91 -2.87 3.23 -0.58 0.13 -4.76 120.64 125.73 1k0t n GLU 26 Ca 0.61 -0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.94 1k0t n GLU 26 Cb 0.15 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 30.98 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 -2.00 4.52 0.44 3.49 0.23 -1.26 0.96 119.30 125.67 1k0t s MET 27 Ca 0.00 1.18 0.05 0.00 -1.03 0.00 0.00 55.69 55.89 1k0t s MET 27 Cb -0.00 -3.44 -0.06 0.00 -1.53 0.00 0.00 34.83 29.80 1k0t s MET 27 CO 0.00 0.05 0.01 0.14 -2.03 0.00 0.00 175.02 173.19 1k0t s VAL 28 N 0.73 1.76 -0.39 5.16 -7.23 0.15 -4.88 120.40 115.70 1k0t s VAL 28 Ca 0.45 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.33 1k0t s VAL 28 Cb -0.20 -2.77 0.01 0.00 0.56 0.00 0.00 36.38 33.98 1k0t s VAL 28 CO 0.24 0.00 1.39 -2.16 -0.31 0.00 0.00 175.10 174.26 1k0t s PRO 29 N -3.76 3.64 0.33 4.82 0.04 -1.26 -2.02 135.00 136.79 1k0t s PRO 29 Ca 0.27 1.01 0.03 0.00 0.04 0.00 0.00 61.00 62.35 1k0t s PRO 29 Cb 0.08 -4.00 -0.04 0.00 0.04 0.00 0.00 34.50 30.58 1k0t s PRO 29 CO 0.14 -1.48 0.13 -0.46 0.04 0.00 0.00 177.00 175.37 1k0t s TRP 30 N 5.23 1.70 -0.37 0.56 -0.00 -0.37 -4.75 118.94 120.94 1k0t s TRP 30 Ca 0.60 -1.26 0.12 0.00 -0.00 0.00 0.00 56.10 55.56 1k0t s TRP 30 Cb -0.14 -1.01 0.34 0.00 -0.00 0.00 0.00 33.47 32.66 1k0t s TRP 30 CO 0.31 -0.36 0.72 -3.47 -0.00 0.00 0.00 176.95 174.15 1k0t n ASP 31 N -0.93 0.81 0.00 5.86 2.03 -1.26 -3.68 116.55 119.38 1k0t n ASP 31 Ca -0.01 -3.00 0.00 0.00 0.52 0.00 0.00 54.79 52.30 1k0t n ASP 31 Cb 0.65 -0.62 0.00 0.00 -0.72 0.00 0.00 41.12 40.43 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 0.34 0.09 3.76 0.27 0.00 -1.26 -5.02 105.19 103.37 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 -1.49 0.00 -0.21 0.00 1.63 -2.00 -0.59 116.57 113.91 1k0t h LYS 34 Ca -0.50 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.24 1k0t h LYS 34 Cb 1.31 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.90 1k0t h LYS 34 CO 0.60 0.09 -0.07 0.00 -3.45 0.00 0.00 179.45 176.61 1k0t n ALA 35 N -2.33 3.35 -4.22 5.00 0.00 -1.26 -4.97 120.51 116.07 1k0t n ALA 35 Ca -0.02 -2.75 -0.32 0.00 0.00 0.00 0.00 53.44 50.34 1k0t n ALA 35 Cb 0.18 -0.62 -0.07 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.25 3.14 0.00 0.00 -0.23 -4.89 105.19 101.99 1k0t n GLY 36 Ca 0.24 0.20 -0.11 0.00 0.00 0.00 0.00 46.02 46.35 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 -7.25 0.24 -0.12 1.61 1.03 -1.24 -1.24 119.66 112.69 1k0t s GLN 37 Ca 0.08 0.90 -0.11 0.00 0.04 0.00 0.00 55.36 56.27 1k0t s GLN 37 Cb -0.04 0.16 -0.05 0.00 0.03 0.00 0.00 33.01 33.11 1k0t s GLN 37 CO 0.98 -0.27 0.24 -1.50 -2.54 0.00 0.00 175.29 172.20 1k0t s ILE 38 N 2.52 5.33 -0.50 3.63 1.10 -0.86 -4.66 121.20 127.77 1k0t s ILE 38 Ca -0.00 0.45 -0.28 0.00 -0.51 0.00 0.00 60.65 60.31 1k0t s ILE 38 Cb -0.12 -3.55 0.00 0.00 0.15 0.00 0.00 42.46 38.94 1k0t s ILE 38 CO -0.11 0.51 1.54 0.00 -2.11 0.00 0.00 174.94 174.78 1k0t s ALA 39 N -0.38 2.78 0.37 1.50 0.00 -1.26 -0.68 121.76 124.09 1k0t s ALA 39 Ca 0.16 -0.40 -0.04 0.00 0.00 0.00 0.00 51.96 51.69 1k0t s ALA 39 Cb -0.13 -4.08 0.01 0.00 0.00 0.00 0.00 23.12 18.92 1k0t s ALA 39 CO 0.05 -2.90 0.55 -1.12 0.00 0.00 0.00 175.76 172.34 1k0t s SER 40 N 5.12 0.91 -0.05 0.00 0.01 0.27 -4.88 113.70 115.08 1k0t s SER 40 Ca 0.61 -1.50 -0.25 0.00 1.31 0.00 0.00 55.95 56.12 1k0t s SER 40 Cb -0.14 0.72 -0.03 0.00 0.21 0.00 0.00 66.02 66.78 1k0t s SER 40 CO 0.28 -1.41 0.79 -0.94 0.41 0.00 0.00 173.24 172.36 1k0t s SER 41 N -3.24 7.10 -0.07 2.44 1.04 -1.26 0.20 113.70 119.92 1k0t s SER 41 Ca 0.28 1.33 -0.16 0.00 0.48 0.00 0.00 55.95 57.88 1k0t s SER 41 Cb -0.01 -2.46 -0.12 0.00 0.10 0.00 0.00 66.02 63.53 1k0t s SER 41 CO 0.20 -0.17 0.62 1.55 0.98 0.00 0.00 173.24 176.43 1k0t h PRO 42 N 6.79 -0.21 0.00 4.02 0.13 -1.88 -3.45 132.00 137.40 1k0t h PRO 42 Ca -0.41 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1k0t h PRO 42 Cb 1.20 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1k0t h PRO 42 CO 0.76 0.14 -0.41 0.54 -0.23 0.00 0.00 178.00 178.80 1k0t n ARG 43 N -4.90 0.96 -1.08 0.86 5.12 -1.26 -5.00 116.66 111.36 1k0t n ARG 43 Ca -0.06 0.00 -0.03 0.00 -1.93 0.00 0.00 57.85 55.83 1k0t n ARG 43 Cb 0.22 -0.70 -0.01 0.00 -1.16 0.00 0.00 32.46 30.81 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 -1.44 0.00 0.22 0.55 -1.04 -1.26 -4.78 114.28 106.53 1k0t n THR 44 Ca 0.00 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.16 1k0t n THR 44 Cb 0.20 -0.98 0.63 0.00 -1.82 0.00 0.00 70.33 68.36 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 0.13 0.00 -3.92 -2.82 4.11 -2.01 -3.14 114.58 106.93 1k0t h GLU 45 Ca -0.06 0.00 -0.64 0.00 0.07 0.00 0.00 59.36 58.73 1k0t h GLU 45 Cb 0.89 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.73 1k0t h GLU 45 CO 0.08 0.00 -0.68 -0.51 0.07 0.00 0.00 179.01 177.97 1k0t s ASP 46 N -4.33 4.45 0.00 3.06 1.11 -1.26 -5.03 116.67 114.66 1k0t s ASP 46 Ca -0.03 -2.55 0.00 0.00 0.18 0.00 0.00 52.55 50.15 1k0t s ASP 46 Cb 0.10 -1.55 0.00 0.00 1.07 0.00 0.00 42.92 42.53 1k0t s ASP 46 CO 0.32 -0.31 0.00 0.00 1.18 0.00 0.00 175.17 176.36 1k0t n VAL 48 N -0.59 0.00 -2.67 0.00 3.14 -1.26 -5.08 118.33 111.87 1k0t n VAL 48 Ca 0.00 -0.58 -0.03 0.00 -2.96 0.00 0.00 64.34 60.77 1k0t n VAL 48 Cb 0.00 0.84 -0.03 0.00 -1.06 0.00 0.00 33.84 33.59 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 2.50 -3.43 3.45 7.55 0.00 -1.26 -5.06 105.19 108.94 1k0t n GLY 49 Ca 0.12 0.96 -0.14 0.00 0.00 0.00 0.00 46.02 46.96 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 0.06 0.00 0.00 0.00 0.00 -1.26 -4.38 118.16 112.57 1k0t n LYS 51 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.13 1k0t n LYS 51 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.65 1k0t n LYS 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1k0t n ARG 52 N 0.00 0.00 -4.20 1.64 1.74 -1.26 -5.02 116.66 109.55 1k0t n ARG 52 Ca 0.00 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.79 1k0t n ARG 52 Cb 0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.37 1k0t n ARG 52 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1k0t n GLU 54 N -4.53 2.79 -0.01 0.00 0.28 -1.26 -4.47 120.64 113.43 1k0t n GLU 54 Ca -0.32 -3.47 -0.04 0.00 -0.16 0.00 0.00 57.16 53.17 1k0t n GLU 54 Cb 0.70 -2.23 -0.01 0.00 1.43 0.00 0.00 31.44 31.32 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 -0.91 0.48 -3.96 3.84 5.66 -1.26 -4.49 114.28 113.63 1k0t n THR 55 Ca 0.55 0.03 -0.38 0.00 -3.05 0.00 0.00 64.05 61.21 1k0t n THR 55 Cb 0.88 -1.60 0.01 0.00 -1.55 0.00 0.00 70.33 68.08 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 -3.30 -2.49 -1.53 1.79 0.00 -1.26 0.26 120.51 113.97 1k0t n ALA 56 Ca -0.08 -0.47 0.11 0.00 0.00 0.00 0.00 53.44 53.00 1k0t n ALA 56 Cb 0.46 -1.85 -0.06 0.00 0.00 0.00 0.00 19.45 18.00 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 -3.70 0.00 0.00 0.00 -0.04 -1.26 -2.75 135.00 127.25 1k0t n PRO 58 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1k0t n PRO 58 Cb 0.62 -0.08 0.00 0.00 -0.04 0.00 0.00 33.50 34.00 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 0.00 0.00 -0.18 0.52 -1.04 -1.26 -4.04 114.28 108.27 1k0t n THR 59 Ca 0.00 -0.20 0.30 0.00 -2.04 0.00 0.00 64.05 62.10 1k0t n THR 59 Cb 0.00 1.45 0.67 0.00 -1.82 0.00 0.00 70.33 70.63 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 3.32 -1.96 -3.41 116.42 122.37 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 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1k0t h ASP 60 CO 0.00 0.00 0.00 0.49 -1.72 0.00 0.00 179.24 178.01 1k0t n PHE 61 N -3.74 0.00 -3.00 4.55 3.72 -1.26 -5.02 117.46 112.71 1k0t n PHE 61 Ca 0.20 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.60 1k0t n PHE 61 Cb 1.18 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.71 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 -0.08 -5.01 0.00 4.37 4.77 -1.26 -4.96 117.00 114.83 1k0t n LEU 62 Ca 0.00 1.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.98 1k0t n LEU 62 Cb 0.00 -2.10 0.00 0.00 -2.33 0.00 0.00 43.42 38.99 1k0t n LEU 62 CO 0.00 -2.50 0.00 -0.24 -1.33 0.00 0.00 177.39 173.32 1k0t n SER 63 N 1.63 0.00 -3.63 -1.43 2.88 -1.26 -4.94 113.62 106.87 1k0t n SER 63 Ca -0.06 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.21 1k0t n SER 63 Cb 0.29 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.65 1k0t n SER 63 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1k0t n ILE 64 N 0.00 1.21 -4.05 2.46 -5.35 -1.26 -5.07 119.36 107.31 1k0t n ILE 64 Ca 0.00 -4.68 -0.08 0.00 -0.27 0.00 0.00 62.75 57.73 1k0t n ILE 64 Cb 0.00 -2.06 -0.09 0.00 -1.74 0.00 0.00 39.64 35.74 1k0t n ILE 64 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1k0t s ARG 65 N -1.51 0.68 -0.06 6.28 1.81 -1.26 -5.15 118.95 119.75 1k0t s ARG 65 Ca 0.31 -1.19 -0.01 0.00 -1.72 0.00 0.00 55.73 53.12 1k0t s ARG 65 Cb 0.04 0.24 0.03 0.00 -0.45 0.00 0.00 34.95 34.81 1k0t s ARG 65 CO -0.12 -0.15 0.03 0.14 -0.68 0.00 0.00 175.30 174.51 1k0t s VAL 66 N -3.92 0.16 0.25 3.52 -7.23 -1.26 -4.64 120.40 107.29 1k0t s VAL 66 Ca 0.08 0.25 0.00 0.00 -1.81 0.00 0.00 61.98 60.50 1k0t s VAL 66 Cb 0.07 -0.36 0.00 0.00 0.56 0.00 0.00 36.38 36.66 1k0t s VAL 66 CO -0.09 0.22 0.00 -1.22 -0.31 0.00 0.00 175.10 173.70 1k0t n TYR 67 N 5.14 -2.05 -1.29 2.82 4.02 -1.26 -4.94 117.16 119.60 1k0t n TYR 67 Ca -0.07 0.36 -0.58 0.00 -0.01 0.00 0.00 57.90 57.61 1k0t n TYR 67 Cb 0.50 0.46 -0.11 0.00 -0.02 0.00 0.00 39.34 40.17 1k0t n TYR 67 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1k0t n LEU 68 N -3.49 0.93 -2.38 7.72 4.77 -1.26 -1.82 117.00 121.46 1k0t n LEU 68 Ca 0.00 0.62 -0.03 0.00 -0.03 0.00 0.00 56.01 56.57 1k0t n LEU 68 Cb 0.00 -0.95 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 1k0t n LEU 68 CO 0.00 -0.77 0.11 0.61 -1.33 0.00 0.00 177.39 176.02 1k0t n GLY 69 N 7.33 -0.98 0.00 -0.72 0.00 -1.26 -4.79 105.19 104.77 1k0t n GLY 69 Ca 0.53 0.49 0.00 0.00 0.00 0.00 0.00 46.02 47.05 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 -0.87 0.00 -1.00 4.61 0.00 -0.76 -5.14 120.51 117.36 1k0t n ALA 70 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1k0t n ALA 70 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 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 -0.69 2.19 -2.78 0.00 4.71 -1.24 -4.08 120.64 118.74 1k0t n GLU 71 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.16 57.06 1k0t n GLU 71 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 31.44 30.41 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 0.00 0.00 -0.11 2.62 -2.24 -1.26 -4.69 114.28 108.60 1k0t n THR 72 Ca 0.00 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.56 1k0t n THR 72 Cb 0.00 -0.11 -0.07 0.00 -2.10 0.00 0.00 70.33 68.05 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 -2.62 1.37 -0.02 4.28 -1.04 -1.26 -4.51 114.28 110.48 1k0t n THR 73 Ca 0.03 -0.22 -0.02 0.00 -2.04 0.00 0.00 64.05 61.79 1k0t n THR 73 Cb 0.44 -1.93 -0.02 0.00 -1.82 0.00 0.00 70.33 67.00 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 -4.15 2.44 -0.65 -2.82 0.00 -1.26 -4.58 116.66 105.63 1k0t n ARG 74 Ca -0.40 0.01 0.01 0.00 -0.00 0.00 0.00 57.85 57.47 1k0t n ARG 74 Cb 0.75 -1.08 0.25 0.00 -0.00 0.00 0.00 32.46 32.38 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 -2.27 4.12 -0.34 2.89 2.88 -1.26 -4.55 113.62 115.09 1k0t n SER 75 Ca -0.06 -2.71 0.11 0.00 -1.33 0.00 0.00 58.87 54.88 1k0t n SER 75 Cb 0.60 -0.64 0.23 0.00 -0.75 0.00 0.00 64.21 63.64 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 0.26 -0.08 0.00 -1.46 2.81 -1.26 -4.62 117.12 112.76 1k0t n MET 76 Ca 0.22 1.46 0.00 0.00 -1.81 0.00 0.00 57.70 57.58 1k0t n MET 76 Cb 0.96 -2.27 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 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 -1.53 0.00 0.56 3.03 0.00 -1.26 -4.95 105.19 101.04 1k0t n GLY 77 Ca 0.20 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.20 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 0.70 0.04 0.99 4.77 -1.26 -4.83 117.00 117.42 1k0t n LEU 78 Ca 0.00 0.11 -0.20 0.00 -0.03 0.00 0.00 56.01 55.89 1k0t n LEU 78 Cb 0.00 -0.37 -0.14 0.00 -2.33 0.00 0.00 43.42 40.57 1k0t n LEU 78 CO 0.00 -0.51 -0.58 0.00 -1.33 0.00 0.00 177.39 174.96 1k0t h ALA 79 N -0.72 0.32 0.00 -1.18 0.00 -1.94 -3.53 119.26 112.20 1k0t h ALA 79 Ca 0.00 -1.24 0.00 0.00 0.00 0.00 0.00 54.91 53.67 1k0t h ALA 79 Cb 0.22 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.52 1k0t h ALA 79 CO 0.00 1.19 0.00 2.48 0.00 0.00 0.00 179.25 182.92