#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1e9j n PRO 2 N 0.00 1.08 0.00 0.00 -0.04 -1.26 -4.88 135.00 129.89 1e9j n PRO 2 Ca 0.00 -0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1e9j n PRO 2 Cb 0.00 -1.07 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 1e9j n PRO 2 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1e9j n ASP 3 N 1.53 -0.11 0.00 3.54 5.75 -1.26 -4.54 116.55 121.46 1e9j n ASP 3 Ca 0.03 -0.82 0.00 0.00 -0.01 0.00 0.00 54.79 54.00 1e9j n ASP 3 Cb 0.53 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.62 1e9j n ASP 3 CO 0.00 0.00 0.00 1.33 -0.11 0.00 0.00 177.20 178.42 1e9j n VAL 4 N -1.81 0.00 0.00 2.12 0.24 -1.26 -4.35 118.33 113.27 1e9j n VAL 4 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 1e9j n VAL 4 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1e9j n VAL 4 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1e9j n GLN 5 N 0.00 0.00 -1.13 7.34 10.64 -1.26 -5.16 117.38 127.81 1e9j n GLN 5 Ca 0.00 0.00 -0.31 0.00 -1.83 0.00 0.00 57.00 54.86 1e9j n GLN 5 Cb 0.00 0.00 0.11 0.00 -0.86 0.00 0.00 30.24 29.49 1e9j n GLN 5 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1e9j s ASP 6 N 0.00 4.03 -0.31 2.61 -1.08 -1.26 -4.88 116.67 115.77 1e9j s ASP 6 Ca 0.00 1.98 -0.28 0.00 -0.52 0.00 0.00 52.55 53.73 1e9j s ASP 6 Cb 0.00 -2.54 -0.04 0.00 -1.46 0.00 0.00 42.92 38.87 1e9j s ASP 6 CO 0.00 -2.36 2.15 0.00 0.52 0.00 0.00 175.17 175.48 1e9j s PRO 8 N 6.60 4.34 0.37 0.00 0.04 -1.26 -4.97 135.00 140.11 1e9j s PRO 8 Ca 0.94 2.05 -0.04 0.00 0.04 0.00 0.00 61.00 63.99 1e9j s PRO 8 Cb -0.27 -3.25 0.06 0.00 0.04 0.00 0.00 34.50 31.08 1e9j s PRO 8 CO 0.32 -0.40 0.13 0.39 0.04 0.00 0.00 177.00 177.48 1e9j n GLU 9 N 3.75 0.22 -1.29 4.56 4.71 -1.25 -4.21 120.64 127.12 1e9j n GLU 9 Ca 0.10 -0.22 -0.09 0.00 -0.01 0.00 0.00 57.16 56.94 1e9j n GLU 9 Cb 0.43 -0.57 -0.09 0.00 -1.01 0.00 0.00 31.44 30.20 1e9j n GLU 9 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1e9j n THR 11 N 6.13 0.00 -4.32 0.00 5.66 -1.26 -4.54 114.28 115.96 1e9j n THR 11 Ca 0.29 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 61.08 1e9j n THR 11 Cb 0.40 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 69.02 1e9j n THR 11 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1e9j s LEU 12 N 0.00 1.49 -0.77 1.09 1.02 -1.26 0.09 118.68 120.33 1e9j s LEU 12 Ca 0.00 -0.18 0.00 0.00 0.02 0.00 0.00 54.13 53.97 1e9j s LEU 12 Cb 0.00 -0.56 0.36 0.00 0.02 0.00 0.00 46.19 46.01 1e9j s LEU 12 CO 0.00 -0.01 1.72 0.00 0.02 0.00 0.00 176.35 178.08 1e9j n GLN 13 N 3.86 3.40 0.00 1.70 6.02 -1.26 -4.40 117.38 126.69 1e9j n GLN 13 Ca -0.24 -4.03 0.00 0.00 -0.01 0.00 0.00 57.00 52.72 1e9j n GLN 13 Cb 0.52 -2.30 0.00 0.00 1.02 0.00 0.00 30.24 29.48 1e9j n GLN 13 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 1e9j n GLU 14 N -0.42 0.00 -1.93 -1.09 2.13 -1.25 -4.41 120.64 113.67 1e9j n GLU 14 Ca 0.48 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.88 1e9j n GLU 14 Cb 0.34 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.02 1e9j n GLU 14 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 1e9j s ASN 15 N 0.00 5.72 0.00 4.31 3.84 1.07 -4.71 114.94 125.17 1e9j s ASN 15 Ca 0.00 1.29 0.14 0.00 0.21 0.00 0.00 52.86 54.49 1e9j s ASN 15 Cb 0.00 -2.52 0.74 0.00 -0.55 0.00 0.00 41.25 38.92 1e9j s ASN 15 CO 0.00 -1.84 1.49 -0.81 -2.79 0.00 0.00 177.10 173.14 1e9j n PRO 16 N 8.56 1.12 -0.11 0.43 -0.04 -1.26 -1.40 135.00 142.30 1e9j n PRO 16 Ca 0.24 -0.19 -0.19 0.00 -0.04 0.00 0.00 63.50 63.32 1e9j n PRO 16 Cb 0.47 -1.23 -0.07 0.00 -0.04 0.00 0.00 33.50 32.63 1e9j n PRO 16 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1e9j n PHE 17 N -0.52 0.41 1.46 0.54 -0.00 -1.26 -4.39 117.46 113.69 1e9j n PHE 17 Ca 0.10 0.18 0.13 0.00 -0.00 0.00 0.00 57.45 57.87 1e9j n PHE 17 Cb 0.09 -0.88 0.51 0.00 -0.00 0.00 0.00 39.48 39.19 1e9j n PHE 17 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1e9j n PHE 18 N -4.40 0.04 -1.52 -5.13 3.72 -1.21 -4.91 117.46 104.05 1e9j n PHE 18 Ca -0.33 -0.02 -0.50 0.00 -0.05 0.00 0.00 57.45 56.55 1e9j n PHE 18 Cb 0.66 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 39.13 1e9j n PHE 18 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1e9j n SER 19 N 0.17 2.49 -4.45 4.37 3.41 -0.49 -4.48 113.62 114.63 1e9j n SER 19 Ca 0.19 0.51 -0.23 0.00 -0.26 0.00 0.00 58.87 59.08 1e9j n SER 19 Cb 0.34 -1.31 -0.10 0.00 -0.26 0.00 0.00 64.21 62.88 1e9j n SER 19 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1e9j s GLN 20 N 5.75 1.61 -0.22 4.33 -1.52 0.33 -4.95 119.66 125.00 1e9j s GLN 20 Ca 1.05 -1.77 -0.28 0.00 -1.95 0.00 0.00 55.36 52.41 1e9j s GLN 20 Cb -0.78 -1.51 -0.32 0.00 -0.22 0.00 0.00 33.01 30.18 1e9j s GLN 20 CO 0.49 0.21 1.62 -2.30 -0.25 0.00 0.00 175.29 175.06 1e9j n PRO 21 N -0.60 0.02 0.00 2.91 -0.02 -1.26 -0.09 135.00 135.96 1e9j n PRO 21 Ca -0.06 -1.07 0.00 0.00 -2.02 0.00 0.00 63.50 60.35 1e9j n PRO 21 Cb 0.61 -2.68 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 1e9j n PRO 21 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1e9j n GLY 22 N 5.13 0.29 2.98 -1.23 0.00 -1.26 -5.09 105.19 106.02 1e9j n GLY 22 Ca 0.42 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.39 1e9j n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1e9j s ALA 23 N -1.15 -1.56 -1.03 4.61 0.00 0.87 -5.07 121.76 118.43 1e9j s ALA 23 Ca 0.00 0.39 -0.05 0.00 0.00 0.00 0.00 51.96 52.30 1e9j s ALA 23 Cb 0.00 -2.24 0.28 0.00 0.00 0.00 0.00 23.12 21.15 1e9j s ALA 23 CO 0.00 -1.82 1.15 -0.35 0.00 0.00 0.00 175.76 174.74 1e9j n PRO 24 N 5.28 3.60 -0.43 0.00 -0.04 -1.26 0.12 135.00 142.28 1e9j n PRO 24 Ca 0.03 -4.51 0.00 0.00 -0.04 0.00 0.00 63.50 58.98 1e9j n PRO 24 Cb 0.51 -2.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 1e9j n PRO 24 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1e9j n ILE 25 N 2.01 0.00 -2.59 0.52 2.08 -1.25 -4.11 119.36 116.02 1e9j n ILE 25 Ca 0.25 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.56 1e9j n ILE 25 Cb 0.37 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 39.26 1e9j n ILE 25 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1e9j n LEU 26 N 0.00 0.00 0.00 1.39 4.77 -1.26 0.35 117.00 122.24 1e9j n LEU 26 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1e9j n LEU 26 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1e9j n LEU 26 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.39 177.73 1e9j n GLN 27 N 0.00 0.00 -0.81 3.23 0.00 -1.26 -4.22 117.38 114.32 1e9j n GLN 27 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 1e9j n GLN 27 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1e9j n GLN 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1e9j n MET 29 N 0.98 0.00 0.00 0.00 1.56 0.11 -4.41 117.12 115.36 1e9j n MET 29 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1e9j n MET 29 Cb 0.00 -0.43 0.00 0.00 2.15 0.00 0.00 33.22 34.94 1e9j n MET 29 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1e9j n GLY 30 N 0.00 3.13 2.69 -5.12 0.00 -1.26 -4.78 105.19 99.85 1e9j n GLY 30 Ca 0.00 -0.62 -0.05 0.00 0.00 0.00 0.00 46.02 45.34 1e9j n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1e9j n PHE 33 N 0.00 -2.49 0.00 0.00 3.72 -1.26 -4.91 117.46 112.53 1e9j n PHE 33 Ca 0.00 -2.35 0.00 0.00 -0.05 0.00 0.00 57.45 55.05 1e9j n PHE 33 Cb 0.00 1.36 0.00 0.00 -0.94 0.00 0.00 39.48 39.90 1e9j n PHE 33 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1e9j n SER 34 N 0.38 0.00 0.00 4.37 7.64 -1.26 -3.94 113.62 120.82 1e9j n SER 34 Ca 0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.97 1e9j n SER 34 Cb 0.69 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.89 1e9j n SER 34 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1e9j n ARG 35 N 0.00 0.00 -0.49 1.43 1.85 -1.26 -5.17 116.66 113.02 1e9j n ARG 35 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1e9j n ARG 35 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1e9j n ARG 35 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1e9j n ALA 36 N 0.00 0.00 0.00 2.89 0.00 -1.25 -5.13 120.51 117.02 1e9j n ALA 36 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1e9j n ALA 36 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1e9j n ALA 36 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1e9j n TYR 37 N -0.47 0.00 -0.35 0.00 4.02 -1.26 -5.18 117.16 113.91 1e9j n TYR 37 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.85 1e9j n TYR 37 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.35 1e9j n TYR 37 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1e9j n PRO 38 N 0.00 -1.67 -4.22 -0.72 -0.04 -1.26 -5.03 135.00 122.06 1e9j n PRO 38 Ca 0.00 -0.19 -0.34 0.00 -0.04 0.00 0.00 63.50 62.93 1e9j n PRO 38 Cb 0.00 -0.20 -0.14 0.00 -0.04 0.00 0.00 33.50 33.12 1e9j n PRO 38 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1e9j s THR 39 N -1.19 3.16 -0.02 0.52 2.01 -1.26 -5.03 115.64 113.83 1e9j s THR 39 Ca 0.08 -0.59 -0.01 0.00 0.31 0.00 0.00 61.69 61.49 1e9j s THR 39 Cb -0.01 -2.39 -0.00 0.00 0.01 0.00 0.00 72.50 70.11 1e9j s THR 39 CO 0.06 0.47 -0.01 1.55 -0.69 0.00 0.00 174.62 176.00 1e9j h PRO 40 N 7.60 0.00 -4.94 4.92 0.14 -2.01 -3.50 132.00 134.21 1e9j h PRO 40 Ca -0.37 0.00 0.00 0.00 0.14 0.00 0.00 66.00 65.77 1e9j h PRO 40 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 31.00 32.32 1e9j h PRO 40 CO 0.59 0.00 -0.45 -0.11 0.14 0.00 0.00 178.00 178.18 1e9j n LEU 41 N -2.48 -3.08 -4.47 1.56 0.00 -1.26 -4.23 117.00 103.04 1e9j n LEU 41 Ca -0.01 0.48 -0.18 0.00 0.00 0.00 0.00 56.01 56.30 1e9j n LEU 41 Cb 0.02 -1.19 -0.18 0.00 0.00 0.00 0.00 43.42 42.07 1e9j n LEU 41 CO 0.01 -1.53 1.82 -1.14 0.00 0.00 0.00 177.39 176.55 1e9j n ARG 42 N 1.55 0.10 -0.02 1.96 0.63 -1.26 -4.64 116.66 114.99 1e9j n ARG 42 Ca 0.00 -0.19 -0.02 0.00 -0.92 0.00 0.00 57.85 56.72 1e9j n ARG 42 Cb 0.22 -1.55 -0.01 0.00 0.45 0.00 0.00 32.46 31.58 1e9j n ARG 42 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 1e9j n SER 43 N 8.10 0.36 0.00 6.15 7.64 -1.26 -5.02 113.62 129.59 1e9j n SER 43 Ca 0.58 0.07 0.00 0.00 1.01 0.00 0.00 58.87 60.53 1e9j n SER 43 Cb 0.23 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.88 1e9j n SER 43 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1e9j n LYS 44 N -2.86 0.00 -3.41 1.43 0.00 -1.26 -5.09 118.16 106.97 1e9j n LYS 44 Ca -0.03 0.00 -0.27 0.00 0.00 0.00 0.00 58.31 58.01 1e9j n LYS 44 Cb 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 35.03 35.02 1e9j n LYS 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 1e9j s LYS 45 N 0.00 0.82 -0.08 1.64 0.00 -1.26 -4.91 119.74 115.95 1e9j s LYS 45 Ca 0.00 -1.93 0.11 0.00 0.00 0.00 0.00 55.97 54.15 1e9j s LYS 45 Cb 0.00 -1.39 0.17 0.00 0.00 0.00 0.00 37.83 36.61 1e9j s LYS 45 CO 0.00 -1.35 1.06 0.25 0.00 0.00 0.00 175.35 175.31 1e9j n THR 46 N 3.11 1.25 0.00 3.79 -2.24 -1.26 -4.82 114.28 114.12 1e9j n THR 46 Ca 0.26 -1.48 0.00 0.00 -2.27 0.00 0.00 64.05 60.56 1e9j n THR 46 Cb 0.45 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1e9j n THR 46 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1e9j n MET 47 N -0.92 0.00 -2.67 -0.78 1.56 -1.26 -5.10 117.12 107.95 1e9j n MET 47 Ca 0.09 0.00 -0.03 0.00 -0.27 0.00 0.00 57.70 57.49 1e9j n MET 47 Cb 0.59 0.00 0.04 0.00 2.15 0.00 0.00 33.22 35.99 1e9j n MET 47 CO 0.00 0.00 0.00 -0.11 -0.73 0.00 0.00 175.97 175.13 1e9j n LEU 48 N 0.00 -1.51 -4.07 -0.89 7.94 -1.26 -5.16 117.00 112.05 1e9j n LEU 48 Ca 0.00 -1.03 -0.37 0.00 -1.11 0.00 0.00 56.01 53.50 1e9j n LEU 48 Cb 0.00 0.55 0.07 0.00 0.53 0.00 0.00 43.42 44.57 1e9j n LEU 48 CO 0.00 1.21 -1.64 1.33 -1.11 0.00 0.00 177.39 177.18 1e9j n VAL 49 N 2.56 0.00 -3.17 1.96 0.24 -1.26 -4.97 118.33 113.69 1e9j n VAL 49 Ca 0.11 -0.14 -0.15 0.00 -2.04 0.00 0.00 64.34 62.13 1e9j n VAL 49 Cb 0.65 -0.15 -0.05 0.00 -1.47 0.00 0.00 33.84 32.82 1e9j n VAL 49 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1e9j s GLN 50 N -2.37 0.87 0.16 7.34 0.74 -1.26 -5.13 119.66 120.02 1e9j s GLN 50 Ca 0.42 -1.28 0.00 0.00 0.05 0.00 0.00 55.36 54.54 1e9j s GLN 50 Cb 0.01 -0.67 0.00 0.00 1.10 0.00 0.00 33.01 33.45 1e9j s GLN 50 CO 0.68 -1.30 0.00 1.17 -0.55 0.00 0.00 175.29 175.29 1e9j n LYS 51 N 3.40 -1.29 -0.75 1.67 3.00 -1.26 -4.89 118.16 118.04 1e9j n LYS 51 Ca 0.19 0.88 -0.24 0.00 -0.00 0.00 0.00 58.31 59.14 1e9j n LYS 51 Cb 0.50 -1.56 0.09 0.00 0.00 0.00 0.00 35.03 34.06 1e9j n LYS 51 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1e9j n ASN 52 N -2.62 -2.67 -0.50 3.14 3.02 -1.26 -4.80 115.26 109.57 1e9j n ASN 52 Ca -0.00 -0.13 0.06 0.00 -0.03 0.00 0.00 54.58 54.48 1e9j n ASN 52 Cb 0.29 -0.67 -0.03 0.00 -0.61 0.00 0.00 39.78 38.76 1e9j n ASN 52 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1e9j n VAL 53 N -3.85 -0.17 -2.18 2.41 0.31 -1.26 -4.82 118.33 108.77 1e9j n VAL 53 Ca 0.01 0.25 -0.09 0.00 -0.01 0.00 0.00 64.34 64.50 1e9j n VAL 53 Cb 0.47 -0.42 -0.01 0.00 -0.91 0.00 0.00 33.84 32.97 1e9j n VAL 53 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1e9j n THR 54 N -2.97 -0.33 0.00 2.52 -1.04 -1.26 -4.86 114.28 106.33 1e9j n THR 54 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 1e9j n THR 54 Cb 0.24 -1.21 0.00 0.00 -1.82 0.00 0.00 70.33 67.54 1e9j n THR 54 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1e9j n SER 55 N -1.33 0.00 -4.77 8.00 2.88 -1.26 -5.00 113.62 112.14 1e9j n SER 55 Ca -0.11 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.13 1e9j n SER 55 Cb 0.52 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.91 1e9j n SER 55 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1e9j s GLU 56 N 0.00 2.18 0.00 -1.46 2.02 -1.26 -5.09 118.70 115.09 1e9j s GLU 56 Ca 0.00 -2.25 0.00 0.00 0.02 0.00 0.00 54.97 52.74 1e9j s GLU 56 Cb 0.00 -1.68 0.00 0.00 0.10 0.00 0.00 34.13 32.55 1e9j s GLU 56 CO 0.00 -0.34 0.00 0.45 0.02 0.00 0.00 175.26 175.39 1e9j n SER 57 N -1.31 0.00 -1.09 -0.19 2.88 -1.26 -5.14 113.62 107.51 1e9j n SER 57 Ca -0.13 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.55 1e9j n SER 57 Cb 0.66 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.08 1e9j n SER 57 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1e9j n THR 58 N 0.00 0.00 0.00 2.46 -2.24 -1.26 -4.97 114.28 108.27 1e9j n THR 58 Ca 0.00 0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1e9j n THR 58 Cb 0.00 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 1e9j n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1e9j n VAL 61 N -0.34 2.67 -1.82 0.00 0.31 -1.26 -4.66 118.33 113.23 1e9j n VAL 61 Ca 0.39 -1.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.28 1e9j n VAL 61 Cb 0.44 -2.05 0.00 0.00 -0.91 0.00 0.00 33.84 31.32 1e9j n VAL 61 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1e9j n ALA 62 N 3.05 -1.00 -0.33 3.52 0.00 -1.26 -4.72 120.51 119.77 1e9j n ALA 62 Ca 0.43 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.95 1e9j n ALA 62 Cb 0.53 -0.45 0.28 0.00 0.00 0.00 0.00 19.45 19.81 1e9j n ALA 62 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 1e9j h LYS 63 N 3.92 0.89 -2.71 0.00 3.64 1.84 -3.36 116.57 120.80 1e9j h LYS 63 Ca 0.00 -0.05 -0.46 0.00 -1.27 0.00 0.00 60.65 58.87 1e9j h LYS 63 Cb 0.00 -0.20 -0.39 0.00 -0.41 0.00 0.00 32.23 31.23 1e9j h LYS 63 CO 0.00 0.59 -0.73 -1.12 -2.27 0.00 0.00 179.45 175.92 1e9j s SER 64 N -5.75 2.72 0.45 4.20 0.01 -0.22 -4.89 113.70 110.22 1e9j s SER 64 Ca -0.11 -0.93 -0.02 0.00 1.31 0.00 0.00 55.95 56.20 1e9j s SER 64 Cb 0.22 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.33 1e9j s SER 64 CO 0.80 -0.40 0.70 -0.72 0.41 0.00 0.00 173.24 174.03 1e9j s TYR 65 N 2.18 3.40 -0.09 2.43 -0.85 -1.25 0.32 117.35 123.49 1e9j s TYR 65 Ca 0.07 0.48 0.18 0.00 -0.52 0.00 0.00 57.07 57.28 1e9j s TYR 65 Cb -0.16 -2.24 0.39 0.00 0.38 0.00 0.00 41.96 40.33 1e9j s TYR 65 CO -0.27 -0.26 1.18 -1.71 -1.52 0.00 0.00 175.55 172.96 1e9j n ASN 66 N -2.11 1.27 0.00 -0.18 5.15 0.27 -4.71 115.26 114.94 1e9j n ASN 66 Ca -0.00 -2.77 0.00 0.00 -0.60 0.00 0.00 54.58 51.20 1e9j n ASN 66 Cb 0.57 -0.39 0.00 0.00 -0.53 0.00 0.00 39.78 39.43 1e9j n ASN 66 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1e9j n ARG 67 N -0.24 0.00 -2.31 1.20 0.00 -1.22 -3.94 116.66 110.15 1e9j n ARG 67 Ca 0.11 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.83 1e9j n ARG 67 Cb 0.92 0.00 0.04 0.00 0.00 0.00 0.00 32.46 33.42 1e9j n ARG 67 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 1e9j n VAL 68 N 0.00 1.96 0.00 5.15 0.24 -1.26 -4.63 118.33 119.79 1e9j n VAL 68 Ca 0.00 -3.61 0.00 0.00 -2.04 0.00 0.00 64.34 58.69 1e9j n VAL 68 Cb 0.00 -0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.29 1e9j n VAL 68 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1e9j n THR 69 N -0.65 0.00 -3.10 3.34 -1.04 -1.25 -4.86 114.28 106.71 1e9j n THR 69 Ca 0.28 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.29 1e9j n THR 69 Cb 0.90 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.41 1e9j n THR 69 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1e9j n VAL 70 N 0.00 0.00 -0.06 12.58 0.31 -1.21 -4.79 118.33 125.16 1e9j n VAL 70 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 64.34 64.31 1e9j n VAL 70 Cb 0.00 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1e9j n VAL 70 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1e9j n MET 71 N 0.00 0.00 -1.84 5.55 -0.00 -1.26 0.14 117.12 119.71 1e9j n MET 71 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.70 57.54 1e9j n MET 71 Cb 0.00 -0.05 -0.04 0.00 -0.00 0.00 0.00 33.22 33.13 1e9j n MET 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1e9j n GLY 72 N 0.10 0.72 2.39 3.17 0.00 -1.26 -2.11 105.19 108.20 1e9j n GLY 72 Ca 0.01 -0.26 -0.16 0.00 0.00 0.00 0.00 46.02 45.61 1e9j n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1e9j n GLY 73 N -1.04 0.71 2.52 -0.02 0.00 0.37 -4.97 105.19 102.77 1e9j n GLY 73 Ca -0.17 -0.24 -0.10 0.00 0.00 0.00 0.00 46.02 45.52 1e9j n GLY 73 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1e9j n PHE 74 N -3.23 -1.99 -3.21 1.61 3.72 0.19 -4.58 117.46 109.96 1e9j n PHE 74 Ca -0.17 0.12 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 1e9j n PHE 74 Cb 0.58 -1.16 -0.01 0.00 -0.94 0.00 0.00 39.48 37.95 1e9j n PHE 74 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1e9j s LYS 75 N -2.83 0.77 -0.02 -1.08 3.01 -1.26 -3.33 119.74 115.01 1e9j s LYS 75 Ca 0.21 -0.19 0.06 0.00 -1.01 0.00 0.00 55.97 55.03 1e9j s LYS 75 Cb -0.04 0.06 0.19 0.00 -1.01 0.00 0.00 37.83 37.03 1e9j s LYS 75 CO 0.18 -1.17 1.08 1.33 0.51 0.00 0.00 175.35 177.28 1e9j n VAL 76 N 4.54 0.39 -2.80 3.17 0.24 -1.26 -4.81 118.33 117.80 1e9j n VAL 76 Ca 0.10 -0.30 -0.18 0.00 -2.04 0.00 0.00 64.34 61.92 1e9j n VAL 76 Cb 0.56 0.01 -0.03 0.00 -1.47 0.00 0.00 33.84 32.90 1e9j n VAL 76 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1e9j n GLU 77 N 0.12 -0.90 0.00 7.34 -0.58 -1.26 -1.52 120.64 123.85 1e9j n GLU 77 Ca 0.07 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 1e9j n GLU 77 Cb 0.25 -2.06 0.00 0.00 -0.57 0.00 0.00 31.44 29.06 1e9j n GLU 77 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1e9j n ASN 78 N -0.63 0.00 -4.44 1.62 5.15 -1.25 -0.61 115.26 115.10 1e9j n ASN 78 Ca 0.05 0.00 -0.63 0.00 -0.60 0.00 0.00 54.58 53.40 1e9j n ASN 78 Cb 0.20 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.36 1e9j n ASN 78 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1e9j n HIS 79 N 0.00 1.49 0.17 1.20 8.25 -0.57 0.94 115.22 126.70 1e9j n HIS 79 Ca 0.00 1.07 0.04 0.00 -0.26 0.00 0.00 57.72 58.57 1e9j n HIS 79 Cb 0.00 -2.08 -0.05 0.00 1.12 0.00 0.00 29.99 28.98 1e9j n HIS 79 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1e9j n THR 80 N 3.40 0.00 -3.65 1.59 -2.24 0.97 -4.80 114.28 109.56 1e9j n THR 80 Ca 0.28 -0.25 -0.09 0.00 -2.27 0.00 0.00 64.05 61.72 1e9j n THR 80 Cb -0.04 0.67 -0.07 0.00 -2.10 0.00 0.00 70.33 68.79 1e9j n THR 80 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1e9j s ALA 81 N -2.10 -1.75 -0.09 6.98 0.00 0.25 -4.80 121.76 120.25 1e9j s ALA 81 Ca 0.00 2.23 0.01 0.00 0.00 0.00 0.00 51.96 54.21 1e9j s ALA 81 Cb 0.05 -1.31 0.02 0.00 0.00 0.00 0.00 23.12 21.87 1e9j s ALA 81 CO 0.30 -0.36 -0.13 0.00 0.00 0.00 0.00 175.76 175.58 1e9j s HIS 83 N 1.02 1.99 -0.29 0.00 -3.43 -1.26 -4.70 115.29 108.61 1e9j s HIS 83 Ca -0.07 -1.39 -0.11 0.00 -0.80 0.00 0.00 55.06 52.69 1e9j s HIS 83 Cb -0.15 -1.43 -0.04 0.00 -1.43 0.00 0.00 32.58 29.54 1e9j s HIS 83 CO -0.01 -0.69 0.19 0.00 -2.00 0.00 0.00 174.74 172.22 1e9j n SER 85 N 5.05 0.00 -3.98 0.00 2.88 -0.97 -4.68 113.62 111.92 1e9j n SER 85 Ca -0.14 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.00 1e9j n SER 85 Cb 0.51 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.99 1e9j n SER 85 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1e9j n THR 86 N 1.95 -3.53 -2.13 2.46 -1.04 -1.26 -4.71 114.28 106.02 1e9j n THR 86 Ca 0.00 -0.70 -0.41 0.00 -2.04 0.00 0.00 64.05 60.90 1e9j n THR 86 Cb 0.00 -2.82 -0.01 0.00 -1.82 0.00 0.00 70.33 65.68 1e9j n THR 86 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1e9j s TYR 88 N 4.50 1.46 0.00 0.00 2.02 -1.26 -4.95 117.35 119.12 1e9j s TYR 88 Ca 0.53 0.72 0.00 0.00 -0.37 0.00 0.00 57.07 57.95 1e9j s TYR 88 Cb 0.08 -3.98 0.00 0.00 -0.40 0.00 0.00 41.96 37.66 1e9j s TYR 88 CO 0.03 -3.28 0.00 0.66 -1.57 0.00 0.00 175.55 171.38 1e9j n TYR 89 N 11.73 -1.52 0.00 2.71 4.02 -1.26 -5.06 117.16 127.78 1e9j n TYR 89 Ca 0.27 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.16 1e9j n TYR 89 Cb 0.47 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.79 1e9j n TYR 89 CO 0.00 0.00 0.00 -2.39 -1.01 0.00 0.00 176.86 173.46 1e9j n HIS 90 N -0.51 0.00 -2.65 -0.72 1.44 -1.26 -4.85 115.22 106.68 1e9j n HIS 90 Ca 0.00 0.00 -0.04 0.00 -2.01 0.00 0.00 57.72 55.67 1e9j n HIS 90 Cb 0.00 -0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.15 1e9j n HIS 90 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 1e9j n LYS 91 N -1.04 0.60 0.00 -1.40 4.81 -1.26 -5.37 118.16 114.50 1e9j n LYS 91 Ca 0.00 -0.97 0.00 0.00 -0.87 0.00 0.00 58.31 56.47 1e9j n LYS 91 Cb 0.00 0.05 0.00 0.00 0.02 0.00 0.00 35.03 35.10 1e9j n LYS 91 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00