#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bcb n SER 2 N 0.00 0.00 -0.34 4.39 3.41 -1.26 -4.80 113.62 115.02 2bcb n SER 2 Ca 0.00 0.00 0.25 0.00 -0.26 0.00 0.00 58.87 58.86 2bcb n SER 2 Cb 0.00 0.00 0.54 0.00 -0.26 0.00 0.00 64.21 64.49 2bcb n SER 2 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2bcb h PRO 3 N 0.00 0.32 -0.99 4.33 0.11 -2.03 0.14 132.00 133.88 2bcb h PRO 3 Ca 0.00 -0.02 0.19 0.00 0.11 0.00 0.00 66.00 66.28 2bcb h PRO 3 Cb 0.00 -0.07 -0.11 0.00 0.11 0.00 0.00 31.00 30.93 2bcb h PRO 3 CO 0.00 0.21 0.59 1.49 -0.21 0.00 0.00 178.00 180.08 2bcb h GLU 4 N 0.33 0.72 -0.62 1.05 4.22 -2.03 0.51 114.58 118.76 2bcb h GLU 4 Ca 0.64 -0.04 0.18 0.00 0.08 0.00 0.00 59.36 60.21 2bcb h GLU 4 Cb 1.71 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 30.78 2bcb h GLU 4 CO -0.33 0.47 0.52 1.05 -2.18 0.00 0.00 179.01 178.55 2bcb h GLU 5 N 0.74 0.00 -0.02 1.92 4.11 -1.03 0.79 114.58 121.08 2bcb h GLU 5 Ca 0.57 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.98 2bcb h GLU 5 Cb 0.89 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 2bcb h GLU 5 CO -0.39 0.00 -0.10 -0.07 0.07 0.00 0.00 179.01 178.53 2bcb h LEU 6 N 0.00 0.03 -0.24 3.06 3.38 -1.03 0.76 115.31 121.27 2bcb h LEU 6 Ca 0.29 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.22 2bcb h LEU 6 Cb 1.33 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.06 2bcb h LEU 6 CO -0.00 0.13 0.01 0.50 0.09 0.00 0.00 178.44 179.17 2bcb h LYS 7 N 0.03 0.42 0.20 1.13 3.64 -0.98 0.17 116.57 121.18 2bcb h LYS 7 Ca 0.01 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 2bcb h LYS 7 Cb 0.19 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2bcb h LYS 7 CO 0.01 0.58 -0.10 0.78 -2.27 0.00 0.00 179.45 178.45 2bcb h GLY 8 N 0.20 -0.28 0.53 5.01 0.00 -1.25 -0.55 103.07 106.72 2bcb h GLY 8 Ca 0.07 0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.53 2bcb h GLY 8 CO 0.01 -0.10 -0.20 -2.22 0.00 0.00 0.00 176.54 174.03 2bcb h ILE 9 N -0.28 0.53 -0.28 2.60 1.08 -0.86 0.15 117.51 120.45 2bcb h ILE 9 Ca -0.03 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.51 2bcb h ILE 9 Cb 0.22 0.53 -0.08 0.00 -3.07 0.00 0.00 36.82 34.42 2bcb h ILE 9 CO 0.05 0.00 -0.28 0.15 -0.69 0.00 0.00 178.15 177.37 2bcb h PHE 10 N -0.32 -0.77 -0.22 1.37 3.04 -0.49 0.09 116.94 119.64 2bcb h PHE 10 Ca 0.06 0.05 0.02 0.00 3.98 0.00 0.00 57.97 62.07 2bcb h PHE 10 Cb 0.40 0.38 -0.02 0.00 2.56 0.00 0.00 35.95 39.27 2bcb h PHE 10 CO -0.24 -0.36 0.09 1.49 -2.02 0.00 0.00 178.31 177.27 2bcb h GLU 11 N -0.28 0.19 -0.33 1.11 4.22 -0.66 0.18 114.58 119.01 2bcb h GLU 11 Ca 0.14 -0.01 0.07 0.00 0.08 0.00 0.00 59.36 59.65 2bcb h GLU 11 Cb 0.50 -0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.64 2bcb h GLU 11 CO -0.44 0.13 -0.17 -0.22 -2.18 0.00 0.00 179.01 176.14 2bcb h LYS 12 N 0.20 -0.11 -0.05 1.92 3.11 0.15 0.17 116.57 121.96 2bcb h LYS 12 Ca 0.10 0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.92 2bcb h LYS 12 Cb 0.05 0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.30 2bcb h LYS 12 CO -0.09 -0.07 -0.04 1.88 -2.81 0.00 0.00 179.45 178.32 2bcb h TYR 13 N -0.11 0.14 -0.95 1.91 0.05 -0.72 -3.11 116.97 114.18 2bcb h TYR 13 Ca 0.17 -0.04 0.22 0.00 0.05 0.00 0.00 58.73 59.14 2bcb h TYR 13 Cb 0.37 -0.03 -0.07 0.00 1.01 0.00 0.00 36.73 38.01 2bcb h TYR 13 CO -0.38 0.55 0.63 0.00 -1.05 0.00 0.00 178.16 177.91 2bcb h ALA 14 N 0.56 2.25 0.00 3.88 0.00 -0.15 0.47 119.26 126.28 2bcb h ALA 14 Ca 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2bcb h ALA 14 Cb 0.53 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2bcb h ALA 14 CO 0.01 -0.56 -0.07 0.00 0.00 0.00 0.00 179.25 178.63 2bcb h ALA 15 N 1.60 1.55 0.32 0.00 0.00 -0.61 -3.07 119.26 119.05 2bcb h ALA 15 Ca 0.50 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.34 2bcb h ALA 15 Cb 1.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2bcb h ALA 15 CO -0.20 0.09 -0.15 0.87 0.00 0.00 0.00 179.25 179.85 2bcb h LYS 16 N 0.00 -0.41 -2.36 0.00 6.56 -0.96 -3.44 116.57 115.95 2bcb h LYS 16 Ca -0.00 0.03 -0.08 0.00 -1.06 0.00 0.00 60.65 59.54 2bcb h LYS 16 Cb 0.16 0.09 -0.22 0.00 -0.57 0.00 0.00 32.23 31.69 2bcb h LYS 16 CO 0.01 -0.10 -0.04 -2.00 -2.06 0.00 0.00 179.45 175.26 2bcb s GLU 17 N -4.64 0.69 0.00 3.15 2.56 -1.16 -4.92 118.70 114.38 2bcb s GLU 17 Ca -0.14 0.72 0.00 0.00 0.00 0.00 0.00 54.97 55.55 2bcb s GLU 17 Cb 0.02 0.34 0.00 0.00 2.00 0.00 0.00 34.13 36.49 2bcb s GLU 17 CO 0.54 -0.10 0.00 0.41 -0.56 0.00 0.00 175.26 175.55 2bcb n GLY 18 N 2.58 0.92 0.62 -1.50 0.00 -1.26 -3.47 105.19 103.10 2bcb n GLY 18 Ca -0.14 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2bcb n GLY 18 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2bcb n ASP 19 N 0.18 -4.12 0.26 1.61 -0.08 -1.22 -3.74 116.55 109.44 2bcb n ASP 19 Ca 0.00 0.48 0.09 0.00 -1.51 0.00 0.00 54.79 53.85 2bcb n ASP 19 Cb 0.00 -1.21 0.48 0.00 2.34 0.00 0.00 41.12 42.73 2bcb n ASP 19 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2bcb h PRO 20 N 0.75 0.00 0.00 -0.67 0.13 -1.84 0.79 132.00 131.16 2bcb h PRO 20 Ca 0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 2bcb h PRO 20 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2bcb h PRO 20 CO 0.00 0.00 -0.97 -0.97 -0.23 0.00 0.00 178.00 175.83 2bcb h ASN 21 N 0.00 0.00 -4.05 1.44 -1.24 -1.86 -3.42 115.58 106.46 2bcb h ASN 21 Ca 0.00 0.00 -0.59 0.00 0.71 0.00 0.00 56.30 56.42 2bcb h ASN 21 Cb 0.91 0.00 -0.31 0.00 0.73 0.00 0.00 38.32 39.66 2bcb h ASN 21 CO 0.00 0.12 -0.85 -1.10 -1.29 0.00 0.00 177.43 174.31 2bcb s GLN 22 N -3.26 1.86 -0.50 6.67 1.11 0.27 -3.79 119.66 122.02 2bcb s GLN 22 Ca -0.00 -0.68 -0.23 0.00 0.01 0.00 0.00 55.36 54.46 2bcb s GLN 22 Cb 0.09 -1.65 0.04 0.00 -1.01 0.00 0.00 33.01 30.48 2bcb s GLN 22 CO 0.78 0.31 0.83 -0.51 0.01 0.00 0.00 175.29 176.72 2bcb s LEU 23 N -0.13 4.28 0.75 2.90 1.43 0.13 -4.12 118.68 123.91 2bcb s LEU 23 Ca -0.01 -0.29 -0.13 0.00 -1.03 0.00 0.00 54.13 52.67 2bcb s LEU 23 Cb -0.11 -2.86 0.05 0.00 0.03 0.00 0.00 46.19 43.30 2bcb s LEU 23 CO 0.02 -1.04 1.14 -0.94 0.23 0.00 0.00 176.35 175.76 2bcb s SER 24 N 2.48 4.32 0.22 2.29 1.04 -1.23 -0.11 113.70 122.71 2bcb s SER 24 Ca 0.28 2.11 -0.11 0.00 0.48 0.00 0.00 55.95 58.71 2bcb s SER 24 Cb -0.13 -2.56 0.29 0.00 0.10 0.00 0.00 66.02 63.72 2bcb s SER 24 CO 0.20 -2.16 1.64 0.50 0.98 0.00 0.00 173.24 174.40 2bcb h LYS 25 N -0.63 0.06 0.20 4.02 3.64 -1.92 0.33 116.57 122.27 2bcb h LYS 25 Ca -0.46 -0.00 0.01 0.00 -1.27 0.00 0.00 60.65 58.93 2bcb h LYS 25 Cb 1.26 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 2bcb h LYS 25 CO 0.50 0.04 -0.34 1.49 -2.27 0.00 0.00 179.45 178.87 2bcb h GLU 26 N 0.06 -0.59 -0.88 1.90 4.22 -1.92 -2.99 114.58 114.37 2bcb h GLU 26 Ca 0.33 0.04 0.16 0.00 0.08 0.00 0.00 59.36 59.96 2bcb h GLU 26 Cb 0.52 0.13 -0.10 0.00 0.50 0.00 0.00 28.75 29.81 2bcb h GLU 26 CO -0.60 -0.39 0.47 1.49 -2.18 0.00 0.00 179.01 177.80 2bcb h GLU 27 N -0.61 0.64 -0.92 1.92 4.57 -1.28 -2.25 114.58 116.65 2bcb h GLU 27 Ca 0.01 -0.04 0.22 0.00 -1.18 0.00 0.00 59.36 58.37 2bcb h GLU 27 Cb 0.61 -0.14 -0.12 0.00 -0.16 0.00 0.00 28.75 28.94 2bcb h GLU 27 CO -0.15 0.42 0.45 1.25 -1.18 0.00 0.00 179.01 179.80 2bcb h LEU 28 N 0.66 0.45 0.01 1.64 5.85 -1.00 -2.03 115.31 120.87 2bcb h LEU 28 Ca 0.49 0.14 0.00 0.00 0.84 0.00 0.00 57.88 59.35 2bcb h LEU 28 Cb 0.70 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.81 2bcb h LEU 28 CO -0.37 0.06 -0.12 0.50 -0.34 0.00 0.00 178.44 178.17 2bcb h LYS 29 N 0.48 -0.15 -0.72 1.25 1.63 -1.51 -0.80 116.57 116.75 2bcb h LYS 29 Ca 0.57 0.01 0.15 0.00 -0.85 0.00 0.00 60.65 60.53 2bcb h LYS 29 Cb 1.04 0.03 -0.10 0.00 -0.60 0.00 0.00 32.23 32.60 2bcb h LYS 29 CO -0.49 -0.10 0.19 -0.07 -3.45 0.00 0.00 179.45 175.53 2bcb h LEU 30 N -0.15 0.05 0.04 5.20 3.38 -1.61 0.35 115.31 122.56 2bcb h LEU 30 Ca 0.00 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2bcb h LEU 30 Cb 0.16 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2bcb h LEU 30 CO -0.08 -0.01 -0.16 0.25 0.09 0.00 0.00 178.44 178.54 2bcb h LEU 31 N 0.29 -0.47 -0.27 1.67 6.46 -0.86 0.45 115.31 122.58 2bcb h LEU 31 Ca 0.40 0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 58.19 2bcb h LEU 31 Cb 0.67 0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 2bcb h LEU 31 CO -0.48 -0.17 0.08 -0.07 -0.62 0.00 0.00 178.44 177.18 2bcb h LEU 32 N -0.23 0.40 -1.22 2.25 3.38 -0.90 -0.07 115.31 118.92 2bcb h LEU 32 Ca -0.00 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 2bcb h LEU 32 Cb 0.22 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 2bcb h LEU 32 CO -0.08 0.51 0.45 0.06 0.09 0.00 0.00 178.44 179.47 2bcb h GLN 33 N 0.28 0.98 0.05 1.13 3.07 -0.90 0.11 115.11 119.82 2bcb h GLN 33 Ca 0.09 -0.08 -0.09 0.00 0.09 0.00 0.00 58.65 58.66 2bcb h GLN 33 Cb 0.25 -0.21 0.00 0.00 0.08 0.00 0.00 27.48 27.61 2bcb h GLN 33 CO -0.00 0.67 -0.43 1.15 0.09 0.00 0.00 178.83 180.31 2bcb h THR 34 N 1.00 1.59 0.05 1.86 2.02 -0.77 -3.28 112.91 115.38 2bcb h THR 34 Ca 0.26 -2.39 -0.28 0.00 0.77 0.00 0.00 66.41 64.78 2bcb h THR 34 Cb -0.07 3.20 0.02 0.00 -1.74 0.00 0.00 68.15 69.57 2bcb h THR 34 CO -0.05 0.62 -1.12 -0.33 0.37 0.00 0.00 175.52 175.01 2bcb h GLU 35 N -0.77 0.64 -0.85 6.66 4.39 -0.95 -3.42 114.58 120.28 2bcb h GLU 35 Ca -0.09 -0.75 -0.29 0.00 0.34 0.00 0.00 59.36 58.56 2bcb h GLU 35 Cb 1.26 0.23 -0.21 0.00 -0.10 0.00 0.00 28.75 29.93 2bcb h GLU 35 CO 0.03 1.33 -0.64 1.97 -1.16 0.00 0.00 179.01 180.54 2bcb n PHE 36 N -3.81 -2.77 -0.21 4.33 1.16 0.34 -5.01 117.46 111.49 2bcb n PHE 36 Ca -0.12 -2.09 0.17 0.00 -1.87 0.00 0.00 57.45 53.55 2bcb n PHE 36 Cb 0.92 1.10 0.51 0.00 -1.61 0.00 0.00 39.48 40.40 2bcb n PHE 36 CO 0.00 0.00 0.00 -1.00 -1.87 0.00 0.00 176.76 173.89 2bcb h PRO 37 N 4.45 0.40 0.00 3.97 0.13 -1.55 -1.24 132.00 138.17 2bcb h PRO 37 Ca -0.01 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2bcb h PRO 37 Cb 1.02 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2bcb h PRO 37 CO 0.26 0.27 0.00 0.66 -0.23 0.00 0.00 178.00 178.96 2bcb h SER 38 N 0.41 0.00 0.38 1.44 4.64 -1.91 -3.26 113.55 115.26 2bcb h SER 38 Ca 0.42 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.51 2bcb h SER 38 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 2bcb h SER 38 CO -0.15 0.00 -1.01 -0.07 -0.87 0.00 0.00 176.83 174.73 2bcb h LEU 39 N 0.00 0.53 -4.46 5.97 3.38 -1.57 -3.35 115.31 115.80 2bcb h LEU 39 Ca 0.00 -0.45 -0.26 0.00 0.09 0.00 0.00 57.88 57.26 2bcb h LEU 39 Cb 0.53 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2bcb h LEU 39 CO 0.00 1.26 0.74 0.00 0.09 0.00 0.00 178.44 180.53 2bcb n LEU 40 N -3.71 5.00 0.18 1.67 -0.00 -1.23 -4.46 117.00 114.46 2bcb n LEU 40 Ca -0.07 -2.95 -0.14 0.00 -0.00 0.00 0.00 56.01 52.84 2bcb n LEU 40 Cb 0.87 -1.20 -0.08 0.00 -0.00 0.00 0.00 43.42 43.01 2bcb n LEU 40 CO 0.52 1.32 0.68 0.11 -0.00 0.00 0.00 177.39 180.02 2bcb h LYS 41 N 4.12 -0.42 -3.09 1.47 1.57 -1.84 -2.71 116.57 115.68 2bcb h LYS 41 Ca 0.30 0.03 -0.68 0.00 -1.87 0.00 0.00 60.65 58.43 2bcb h LYS 41 Cb 0.95 0.09 0.01 0.00 0.08 0.00 0.00 32.23 33.37 2bcb h LYS 41 CO 0.65 -0.19 3.68 0.41 -0.57 0.00 0.00 179.45 183.43 2bcb n GLY 42 N -0.89 4.33 2.65 3.86 0.00 -1.26 -4.11 105.19 109.77 2bcb n GLY 42 Ca -0.10 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.37 2bcb n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bcb n GLY 43 N 3.52 1.70 0.31 -0.02 0.00 -1.02 -4.67 105.19 105.01 2bcb n GLY 43 Ca 0.75 -0.96 -0.04 0.00 0.00 0.00 0.00 46.02 45.76 2bcb n GLY 43 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2bcb h SER 44 N 2.28 0.89 -3.38 1.61 4.64 -1.82 -3.41 113.55 114.36 2bcb h SER 44 Ca -0.18 -0.16 -0.48 0.00 -0.47 0.00 0.00 61.79 60.50 2bcb h SER 44 Cb 1.35 -0.23 -0.34 0.00 -0.31 0.00 0.00 62.40 62.86 2bcb h SER 44 CO 0.14 0.85 -0.80 0.42 -0.87 0.00 0.00 176.83 176.57 2bcb s THR 45 N -5.27 0.89 0.10 2.95 -4.23 -1.26 -5.06 115.64 103.75 2bcb s THR 45 Ca -0.11 -0.30 -0.28 0.00 -1.18 0.00 0.00 61.69 59.83 2bcb s THR 45 Cb 0.15 -0.86 -0.12 0.00 1.34 0.00 0.00 72.50 73.00 2bcb s THR 45 CO 0.82 0.31 1.66 0.25 -0.54 0.00 0.00 174.62 177.11 2bcb h LEU 46 N 7.33 -0.59 -0.36 4.79 5.85 -1.98 -1.89 115.31 128.46 2bcb h LEU 46 Ca -0.32 0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.52 2bcb h LEU 46 Cb 1.16 0.20 -0.07 0.00 0.37 0.00 0.00 40.66 42.33 2bcb h LEU 46 CO 0.45 -0.33 -0.08 -0.78 -0.34 0.00 0.00 178.44 177.35 2bcb h ASP 47 N -0.49 -0.32 0.21 1.25 3.58 -1.97 0.22 116.42 118.90 2bcb h ASP 47 Ca -0.01 0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.55 2bcb h ASP 47 Cb 0.45 0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.70 2bcb h ASP 47 CO -0.04 -0.11 -0.20 -0.33 -2.88 0.00 0.00 179.24 175.68 2bcb h GLU 48 N 0.01 -0.42 0.43 0.28 4.39 -1.95 0.53 114.58 117.85 2bcb h GLU 48 Ca 0.17 0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.89 2bcb h GLU 48 Cb 0.26 0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 2bcb h GLU 48 CO -0.36 -0.28 -0.31 1.25 -1.16 0.00 0.00 179.01 178.15 2bcb h LEU 49 N -0.43 -0.80 -1.24 1.33 5.85 -0.85 -0.23 115.31 118.93 2bcb h LEU 49 Ca -0.00 0.06 0.11 0.00 0.84 0.00 0.00 57.88 58.89 2bcb h LEU 49 Cb 0.40 0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.62 2bcb h LEU 49 CO -0.04 -0.47 0.57 0.15 -0.34 0.00 0.00 178.44 178.31 2bcb h PHE 50 N -0.72 0.89 -0.44 1.25 3.57 -0.51 -1.00 116.94 119.99 2bcb h PHE 50 Ca -0.04 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.43 2bcb h PHE 50 Cb 0.61 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 2bcb h PHE 50 CO -0.13 0.38 0.05 0.93 -2.23 0.00 0.00 178.31 177.31 2bcb h GLU 51 N 0.80 0.73 -0.58 1.11 5.08 0.81 0.46 114.58 123.00 2bcb h GLU 51 Ca 0.42 -0.21 0.07 0.00 -1.00 0.00 0.00 59.36 58.64 2bcb h GLU 51 Cb 0.52 -0.08 -0.06 0.00 0.50 0.00 0.00 28.75 29.64 2bcb h GLU 51 CO -0.19 0.77 0.27 1.49 -1.00 0.00 0.00 179.01 180.36 2bcb h GLU 52 N 0.59 0.50 -0.23 2.33 4.81 0.02 -2.68 114.58 119.92 2bcb h GLU 52 Ca 0.13 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2bcb h GLU 52 Cb 0.41 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 2bcb h GLU 52 CO 0.01 0.33 0.08 -0.07 -0.73 0.00 0.00 179.01 178.63 2bcb h LEU 53 N 0.51 0.32 -5.14 1.64 3.38 -0.78 -3.31 115.31 111.92 2bcb h LEU 53 Ca 0.27 -0.18 -0.68 0.00 0.09 0.00 0.00 57.88 57.39 2bcb h LEU 53 Cb 0.24 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.92 2bcb h LEU 53 CO -0.22 0.41 3.72 -0.67 0.09 0.00 0.00 178.44 181.77 2bcb n ASP 54 N -4.80 8.22 0.17 -0.43 2.03 0.16 -4.64 116.55 117.26 2bcb n ASP 54 Ca -0.03 -2.63 0.14 0.00 0.52 0.00 0.00 54.79 52.79 2bcb n ASP 54 Cb 0.13 -1.56 0.71 0.00 -0.72 0.00 0.00 41.12 39.68 2bcb n ASP 54 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2bcb h LYS 55 N 5.09 0.00 0.00 -0.67 1.57 -1.69 0.16 116.57 121.03 2bcb h LYS 55 Ca 0.84 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.53 2bcb h LYS 55 Cb 0.32 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2bcb h LYS 55 CO 1.79 0.00 -0.41 -0.97 -0.57 0.00 0.00 179.45 179.29 2bcb h ASN 56 N 0.00 0.00 -5.06 0.86 -0.00 -1.92 -3.47 115.58 105.98 2bcb h ASN 56 Ca 0.10 0.00 -0.27 0.00 -0.00 0.00 0.00 56.30 56.13 2bcb h ASN 56 Cb 0.41 0.00 0.15 0.00 -0.00 0.00 0.00 38.32 38.88 2bcb h ASN 56 CO -0.00 0.41 -0.65 0.61 -0.00 0.00 0.00 177.43 177.79 2bcb n GLY 57 N 0.02 -0.30 0.06 1.57 0.00 0.57 -4.95 105.19 102.16 2bcb n GLY 57 Ca -0.01 0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.15 2bcb n GLY 57 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bcb n ASP 58 N -2.80 0.95 0.00 1.61 5.68 -1.26 -4.98 116.55 115.74 2bcb n ASP 58 Ca -0.22 -0.98 0.00 0.00 -0.50 0.00 0.00 54.79 53.09 2bcb n ASP 58 Cb 0.64 0.92 0.00 0.00 -1.14 0.00 0.00 41.12 41.53 2bcb n ASP 58 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2bcb n GLY 59 N 1.37 2.50 1.19 6.12 0.00 -1.26 -5.02 105.19 110.09 2bcb n GLY 59 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 2bcb n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bcb n GLU 60 N -0.53 0.74 -4.47 1.61 1.02 -1.26 -3.91 120.64 113.83 2bcb n GLU 60 Ca 0.00 -1.22 -0.28 0.00 -0.02 0.00 0.00 57.16 55.64 2bcb n GLU 60 Cb 0.00 0.70 -0.09 0.00 -0.02 0.00 0.00 31.44 32.03 2bcb n GLU 60 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2bcb s VAL 61 N -2.12 1.90 0.20 2.62 1.01 0.84 -4.75 120.40 120.10 2bcb s VAL 61 Ca 0.08 -1.89 -0.08 0.00 0.00 0.00 0.00 61.98 60.09 2bcb s VAL 61 Cb 0.00 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.58 2bcb s VAL 61 CO 0.06 0.00 0.32 -0.94 0.00 0.00 0.00 175.10 174.53 2bcb s SER 62 N -3.83 0.02 0.57 3.32 1.04 -1.26 0.17 113.70 113.74 2bcb s SER 62 Ca 0.31 -1.01 0.26 0.00 0.48 0.00 0.00 55.95 55.99 2bcb s SER 62 Cb 0.06 0.47 1.66 0.00 0.10 0.00 0.00 66.02 68.31 2bcb s SER 62 CO 0.16 -0.97 2.20 0.15 0.98 0.00 0.00 173.24 175.77 2bcb h PHE 63 N 2.46 0.00 0.44 5.02 3.57 -1.95 0.14 116.94 126.63 2bcb h PHE 63 Ca -0.31 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.17 2bcb h PHE 63 Cb 1.24 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.98 2bcb h PHE 63 CO 0.39 0.00 -0.21 1.49 -2.23 0.00 0.00 178.31 177.75 2bcb h GLU 64 N 0.00 -0.57 -0.30 1.11 4.81 -1.95 -2.59 114.58 115.09 2bcb h GLU 64 Ca 0.02 0.04 0.07 0.00 -0.13 0.00 0.00 59.36 59.36 2bcb h GLU 64 Cb 0.11 0.13 -0.07 0.00 0.63 0.00 0.00 28.75 29.55 2bcb h GLU 64 CO -0.00 -0.38 -0.19 1.49 -0.73 0.00 0.00 179.01 179.20 2bcb h GLU 65 N -0.70 -0.15 -0.78 1.92 4.57 -1.91 -1.08 114.58 116.45 2bcb h GLU 65 Ca -0.06 0.01 0.23 0.00 -1.18 0.00 0.00 59.36 58.36 2bcb h GLU 65 Cb 0.45 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 29.04 2bcb h GLU 65 CO 0.10 -0.10 0.66 0.35 -1.18 0.00 0.00 179.01 178.84 2bcb h PHE 66 N -0.16 0.00 -0.27 0.92 3.57 -0.69 -0.42 116.94 119.89 2bcb h PHE 66 Ca 0.16 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.74 2bcb h PHE 66 Cb 0.40 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 2bcb h PHE 66 CO -0.38 0.00 0.26 1.96 -2.23 0.00 0.00 178.31 177.92 2bcb h GLN 67 N 0.00 0.00 -0.65 1.11 1.08 -0.78 0.30 115.11 116.18 2bcb h GLN 67 Ca 0.37 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.54 2bcb h GLN 67 Cb 1.70 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 29.10 2bcb h GLN 67 CO -0.00 0.00 0.31 0.28 -0.95 0.00 0.00 178.83 178.47 2bcb h VAL 68 N 0.00 1.22 0.09 -0.54 2.07 -1.25 0.17 116.25 118.01 2bcb h VAL 68 Ca 0.13 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 2bcb h VAL 68 Cb 0.64 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 2bcb h VAL 68 CO -0.00 0.26 -0.04 0.25 0.02 0.00 0.00 177.57 178.06 2bcb h LEU 69 N 0.90 -0.10 -1.03 2.57 7.12 -0.65 0.27 115.31 124.39 2bcb h LEU 69 Ca 0.22 -0.23 0.16 0.00 0.13 0.00 0.00 57.88 58.16 2bcb h LEU 69 Cb 0.12 0.03 -0.10 0.00 -0.53 0.00 0.00 40.66 40.18 2bcb h LEU 69 CO -0.03 0.18 0.62 0.58 -0.13 0.00 0.00 178.44 179.66 2bcb h VAL 70 N -0.38 0.80 0.12 1.05 2.07 -0.80 -0.92 116.25 118.19 2bcb h VAL 70 Ca -0.01 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2bcb h VAL 70 Cb 0.32 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 2bcb h VAL 70 CO 0.02 0.16 -0.06 0.50 0.02 0.00 0.00 177.57 178.21 2bcb h LYS 71 N 0.85 -0.15 -0.04 1.57 1.63 -0.45 -3.34 116.57 116.65 2bcb h LYS 71 Ca 0.54 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.36 2bcb h LYS 71 Cb 0.73 0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.39 2bcb h LYS 71 CO -0.32 0.31 0.03 1.57 -3.45 0.00 0.00 179.45 177.59 2bcb h LYS 72 N -0.72 0.00 0.00 1.90 5.09 -0.06 0.62 116.57 123.39 2bcb h LYS 72 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 60.65 60.72 2bcb h LYS 72 Cb 0.53 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 32.86 2bcb h LYS 72 CO 0.03 0.00 -0.03 -0.84 -2.09 0.00 0.00 179.45 176.52 2bcb h ILE 73 N 0.00 0.98 -0.54 0.07 3.07 -1.32 -0.11 117.51 119.67 2bcb h ILE 73 Ca 0.02 -0.11 -0.25 0.00 1.55 0.00 0.00 64.86 66.07 2bcb h ILE 73 Cb 0.08 1.06 -0.15 0.00 -0.27 0.00 0.00 36.82 37.54 2bcb h ILE 73 CO -0.00 0.03 0.14 -1.54 -1.05 0.00 0.00 178.15 175.73 2bcb n SER 74 N -4.44 3.14 0.00 2.16 3.41 0.14 -5.15 113.62 112.89 2bcb n SER 74 Ca -0.03 -3.61 0.00 0.00 -0.26 0.00 0.00 58.87 54.97 2bcb n SER 74 Cb 0.12 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.38 2bcb n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88