#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bcb s SER 2 N 0.00 5.81 0.19 4.39 1.04 -1.26 -4.73 113.70 119.15 2bcb s SER 2 Ca 0.00 1.70 -0.24 0.00 0.48 0.00 0.00 55.95 57.90 2bcb s SER 2 Cb 0.00 -2.52 0.10 0.00 0.10 0.00 0.00 66.02 63.70 2bcb s SER 2 CO 0.00 -1.15 1.55 -0.65 0.98 0.00 0.00 173.24 173.98 2bcb h PRO 3 N 0.13 -0.05 -0.94 4.02 0.11 -1.98 0.81 132.00 134.10 2bcb h PRO 3 Ca -0.46 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.69 2bcb h PRO 3 Cb 1.21 0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 2bcb h PRO 3 CO 0.58 -0.03 0.62 1.49 -0.21 0.00 0.00 178.00 180.45 2bcb h GLU 4 N -0.05 1.16 -0.36 1.05 4.57 -1.98 0.24 114.58 119.21 2bcb h GLU 4 Ca 0.25 -0.07 -0.04 0.00 -1.18 0.00 0.00 59.36 58.32 2bcb h GLU 4 Cb 0.53 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 2bcb h GLU 4 CO -0.91 0.77 0.08 0.93 -1.18 0.00 0.00 179.01 178.69 2bcb h GLU 5 N 1.19 0.58 -0.34 1.92 4.39 -1.36 0.46 114.58 121.42 2bcb h GLU 5 Ca 0.37 -0.15 -0.05 0.00 0.34 0.00 0.00 59.36 59.87 2bcb h GLU 5 Cb -0.01 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 2bcb h GLU 5 CO -0.11 0.64 -0.00 -0.07 -1.16 0.00 0.00 179.01 178.30 2bcb h LEU 6 N 0.43 0.49 -0.04 1.33 3.38 -0.12 0.68 115.31 121.45 2bcb h LEU 6 Ca 0.11 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2bcb h LEU 6 Cb 0.32 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2bcb h LEU 6 CO 0.00 0.56 0.02 0.50 0.09 0.00 0.00 178.44 179.61 2bcb h LYS 7 N 0.50 0.06 0.07 1.13 3.64 -0.06 0.18 116.57 122.10 2bcb h LYS 7 Ca 0.11 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 2bcb h LYS 7 Cb 0.33 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 2bcb h LYS 7 CO 0.01 0.22 -0.14 0.78 -2.27 0.00 0.00 179.45 178.04 2bcb h GLY 8 N -0.11 -0.24 0.43 5.01 0.00 -0.31 -0.10 103.07 107.75 2bcb h GLY 8 Ca 0.01 0.17 0.03 0.00 0.00 0.00 0.00 47.33 47.54 2bcb h GLY 8 CO -0.00 -0.14 -0.25 -2.22 0.00 0.00 0.00 176.54 173.93 2bcb h ILE 9 N -0.28 0.43 -0.29 2.60 1.08 -0.83 0.13 117.51 120.35 2bcb h ILE 9 Ca 0.03 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.57 2bcb h ILE 9 Cb 0.30 0.43 -0.08 0.00 -3.07 0.00 0.00 36.82 34.40 2bcb h ILE 9 CO -0.09 0.00 -0.27 0.15 -0.69 0.00 0.00 178.15 177.24 2bcb h PHE 10 N -0.39 -0.74 -0.22 1.37 3.04 -0.38 -0.38 116.94 119.23 2bcb h PHE 10 Ca 0.06 0.04 0.01 0.00 3.98 0.00 0.00 57.97 62.06 2bcb h PHE 10 Cb 0.47 0.37 -0.01 0.00 2.56 0.00 0.00 35.95 39.34 2bcb h PHE 10 CO -0.29 -0.35 0.14 1.49 -2.02 0.00 0.00 178.31 177.28 2bcb h GLU 11 N -0.26 0.27 -0.37 1.11 4.57 -0.53 0.18 114.58 119.56 2bcb h GLU 11 Ca 0.15 -0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.37 2bcb h GLU 11 Cb 0.50 -0.06 -0.05 0.00 -0.16 0.00 0.00 28.75 28.97 2bcb h GLU 11 CO -0.44 0.18 0.06 0.87 -1.18 0.00 0.00 179.01 178.50 2bcb h LYS 12 N 0.28 0.17 0.07 1.92 1.57 -0.14 0.12 116.57 120.57 2bcb h LYS 12 Ca 0.08 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2bcb h LYS 12 Cb -0.02 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.25 2bcb h LYS 12 CO -0.03 0.11 -0.04 1.88 -0.57 0.00 0.00 179.45 180.81 2bcb h TYR 13 N 0.18 -0.09 -1.01 -1.35 -1.99 -0.85 -3.17 116.97 108.69 2bcb h TYR 13 Ca 0.18 -0.00 0.26 0.00 2.00 0.00 0.00 58.73 61.17 2bcb h TYR 13 Cb 0.21 0.03 -0.13 0.00 2.00 0.00 0.00 36.73 38.84 2bcb h TYR 13 CO -0.20 0.35 0.60 0.00 -0.00 0.00 0.00 178.16 178.90 2bcb h ALA 14 N 0.29 1.85 -0.30 3.88 0.00 -0.33 -0.87 119.26 123.78 2bcb h ALA 14 Ca -0.01 0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.12 2bcb h ALA 14 Cb 0.48 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2bcb h ALA 14 CO 0.02 -0.35 0.44 0.00 0.00 0.00 0.00 179.25 179.36 2bcb h ALA 15 N 1.75 1.92 -0.15 0.00 0.00 -0.73 -1.88 119.26 120.16 2bcb h ALA 15 Ca 0.66 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.53 2bcb h ALA 15 Cb 1.33 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 2bcb h ALA 15 CO -0.49 -0.59 -0.03 0.87 0.00 0.00 0.00 179.25 179.00 2bcb h LYS 16 N 0.00 0.28 -7.38 0.00 6.56 -1.29 -3.45 116.57 111.30 2bcb h LYS 16 Ca 0.14 -0.10 -0.50 0.00 -1.06 0.00 0.00 60.65 59.13 2bcb h LYS 16 Cb 1.02 -0.02 0.11 0.00 -0.57 0.00 0.00 32.23 32.77 2bcb h LYS 16 CO -0.00 0.55 0.34 -2.00 -2.06 0.00 0.00 179.45 176.28 2bcb s GLU 17 N -4.78 2.25 0.22 3.15 2.56 -0.71 -4.99 118.70 116.40 2bcb s GLU 17 Ca -0.14 0.79 -0.31 0.00 0.00 0.00 0.00 54.97 55.31 2bcb s GLU 17 Cb 0.05 -1.93 -0.10 0.00 2.00 0.00 0.00 34.13 34.16 2bcb s GLU 17 CO 0.72 -1.54 1.52 0.20 -0.56 0.00 0.00 175.26 175.61 2bcb s GLY 18 N -3.79 1.94 -0.05 -1.50 0.00 -1.26 -4.29 107.32 98.37 2bcb s GLY 18 Ca 0.60 1.39 -0.02 0.00 0.00 0.00 0.00 44.72 46.69 2bcb s GLY 18 CO 0.55 2.48 0.04 1.34 0.00 0.00 0.00 173.10 177.51 2bcb n ASP 19 N 3.03 -2.08 0.00 1.64 -0.08 -1.26 -4.75 116.55 113.05 2bcb n ASP 19 Ca 0.10 0.31 0.02 0.00 -1.51 0.00 0.00 54.79 53.71 2bcb n ASP 19 Cb 0.39 -1.96 0.10 0.00 2.34 0.00 0.00 41.12 41.98 2bcb n ASP 19 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2bcb n PRO 20 N 0.32 0.07 0.07 -0.67 -0.04 -1.26 -1.39 135.00 132.10 2bcb n PRO 20 Ca -0.07 0.18 0.12 0.00 -0.04 0.00 0.00 63.50 63.69 2bcb n PRO 20 Cb 0.11 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.29 2bcb n PRO 20 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2bcb n ASN 21 N -1.20 0.71 -4.49 3.54 5.15 -1.26 -4.23 115.26 113.48 2bcb n ASN 21 Ca 0.02 0.21 -0.32 0.00 -0.60 0.00 0.00 54.58 53.89 2bcb n ASN 21 Cb 0.02 -0.04 -0.12 0.00 -0.53 0.00 0.00 39.78 39.11 2bcb n ASN 21 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2bcb s GLN 22 N -3.15 2.31 -0.38 1.20 1.11 -0.49 -3.63 119.66 116.64 2bcb s GLN 22 Ca 0.07 -0.84 -0.12 0.00 0.01 0.00 0.00 55.36 54.49 2bcb s GLN 22 Cb 0.13 -2.31 0.02 0.00 -1.01 0.00 0.00 33.01 29.84 2bcb s GLN 22 CO 0.69 0.58 0.23 -0.51 0.01 0.00 0.00 175.29 176.29 2bcb s LEU 23 N -1.20 4.75 0.75 2.90 1.43 0.58 -4.46 118.68 123.43 2bcb s LEU 23 Ca 0.14 -0.89 -0.11 0.00 -1.03 0.00 0.00 54.13 52.24 2bcb s LEU 23 Cb -0.11 -2.06 0.04 0.00 0.03 0.00 0.00 46.19 44.09 2bcb s LEU 23 CO 0.04 -0.38 1.10 -0.94 0.23 0.00 0.00 176.35 176.40 2bcb s SER 24 N 1.60 5.04 0.14 2.29 1.04 -1.26 -0.41 113.70 122.14 2bcb s SER 24 Ca 0.03 1.22 -0.26 0.00 0.48 0.00 0.00 55.95 57.42 2bcb s SER 24 Cb -0.19 -1.99 -0.01 0.00 0.10 0.00 0.00 66.02 63.93 2bcb s SER 24 CO 0.08 -1.61 1.60 0.50 0.98 0.00 0.00 173.24 174.78 2bcb h LYS 25 N -0.84 -0.38 -0.81 4.02 3.64 -1.98 0.19 116.57 120.42 2bcb h LYS 25 Ca -0.46 0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.01 2bcb h LYS 25 Cb 1.26 0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 33.10 2bcb h LYS 25 CO 0.62 -0.25 0.49 1.49 -2.27 0.00 0.00 179.45 179.53 2bcb h GLU 26 N -0.39 0.87 -0.52 1.90 4.81 -1.97 -2.54 114.58 116.74 2bcb h GLU 26 Ca 0.11 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2bcb h GLU 26 Cb 0.57 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 2bcb h GLU 26 CO -0.43 0.57 0.21 1.49 -0.73 0.00 0.00 179.01 180.13 2bcb h GLU 27 N 0.89 0.78 -0.73 1.92 4.81 -1.55 -2.54 114.58 118.16 2bcb h GLU 27 Ca 0.36 -0.14 0.07 0.00 -0.13 0.00 0.00 59.36 59.51 2bcb h GLU 27 Cb 0.18 -0.13 -0.06 0.00 0.63 0.00 0.00 28.75 29.37 2bcb h GLU 27 CO -0.18 0.68 0.42 1.25 -0.73 0.00 0.00 179.01 180.45 2bcb h LEU 28 N 0.70 0.63 0.06 1.64 5.85 -0.30 -1.84 115.31 122.06 2bcb h LEU 28 Ca 0.17 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2bcb h LEU 28 Cb 0.19 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2bcb h LEU 28 CO -0.02 0.40 -0.23 0.50 -0.34 0.00 0.00 178.44 178.75 2bcb h LYS 29 N 0.76 -0.33 -0.79 1.25 1.63 -1.06 0.20 116.57 118.23 2bcb h LYS 29 Ca 0.33 0.02 0.18 0.00 -0.85 0.00 0.00 60.65 60.34 2bcb h LYS 29 Cb 0.21 0.07 -0.12 0.00 -0.60 0.00 0.00 32.23 31.80 2bcb h LYS 29 CO -0.19 -0.22 0.21 1.37 -3.45 0.00 0.00 179.45 177.17 2bcb h LEU 30 N -0.34 0.03 0.18 5.20 -0.00 -1.46 0.67 115.31 119.60 2bcb h LEU 30 Ca -0.00 0.16 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 2bcb h LEU 30 Cb 0.34 0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 41.17 2bcb h LEU 30 CO -0.12 -0.06 -0.44 0.25 -0.00 0.00 0.00 178.44 178.07 2bcb h LEU 31 N 0.27 -1.29 -0.73 0.17 6.46 -0.55 0.52 115.31 120.16 2bcb h LEU 31 Ca 0.46 0.13 0.03 0.00 -0.12 0.00 0.00 57.88 58.38 2bcb h LEU 31 Cb 0.83 0.46 -0.04 0.00 -0.73 0.00 0.00 40.66 41.19 2bcb h LEU 31 CO -0.55 -0.49 0.47 -0.07 -0.62 0.00 0.00 178.44 177.18 2bcb h LEU 32 N -0.68 0.78 -0.82 2.25 3.38 -0.35 -0.43 115.31 119.43 2bcb h LEU 32 Ca -0.02 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.01 2bcb h LEU 32 Cb 0.66 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 2bcb h LEU 32 CO -0.19 0.54 0.49 1.56 0.09 0.00 0.00 178.44 180.93 2bcb h GLN 33 N 0.92 0.86 -0.02 1.13 4.20 -0.57 0.21 115.11 121.85 2bcb h GLN 33 Ca 0.29 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.90 2bcb h GLN 33 Cb -0.01 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 27.58 2bcb h GLN 33 CO -0.10 0.57 -0.17 1.15 -0.67 0.00 0.00 178.83 179.61 2bcb h THR 34 N 0.89 1.51 0.13 -0.54 2.02 -0.14 -3.36 112.91 113.43 2bcb h THR 34 Ca 0.36 -1.75 -0.20 0.00 0.77 0.00 0.00 66.41 65.60 2bcb h THR 34 Cb 0.20 2.59 0.02 0.00 -1.74 0.00 0.00 68.15 69.22 2bcb h THR 34 CO -0.19 0.48 -0.90 -0.33 0.37 0.00 0.00 175.52 174.96 2bcb h GLU 35 N -0.47 0.27 -1.08 6.66 4.39 -0.95 -3.45 114.58 119.95 2bcb h GLU 35 Ca -0.02 -0.47 -0.16 0.00 0.34 0.00 0.00 59.36 59.05 2bcb h GLU 35 Cb 0.87 0.17 -0.18 0.00 -0.10 0.00 0.00 28.75 29.52 2bcb h GLU 35 CO 0.04 1.22 -0.51 -0.59 -1.16 0.00 0.00 179.01 178.01 2bcb s PHE 36 N -2.43 -1.49 0.14 4.33 -0.12 0.71 -5.00 117.98 114.13 2bcb s PHE 36 Ca -0.15 -0.54 0.18 0.00 -0.05 0.00 0.00 56.93 56.37 2bcb s PHE 36 Cb 0.01 0.25 0.98 0.00 -0.63 0.00 0.00 43.02 43.63 2bcb s PHE 36 CO 0.81 -1.24 1.48 -1.00 -0.05 0.00 0.00 175.22 175.23 2bcb h PRO 37 N 5.35 0.00 -0.86 1.99 0.13 -1.61 -1.24 132.00 135.76 2bcb h PRO 37 Ca 0.07 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.19 2bcb h PRO 37 Cb 1.11 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.20 2bcb h PRO 37 CO 0.04 0.00 0.49 0.66 -0.23 0.00 0.00 178.00 178.97 2bcb h SER 38 N 0.00 1.05 0.12 1.44 4.64 -1.94 -2.83 113.55 116.03 2bcb h SER 38 Ca 0.00 -0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 2bcb h SER 38 Cb 0.55 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2bcb h SER 38 CO 0.00 0.83 -0.02 -0.07 -0.87 0.00 0.00 176.83 176.70 2bcb h LEU 39 N 1.19 0.00 -0.13 5.97 3.38 -1.53 0.26 115.31 124.46 2bcb h LEU 39 Ca 0.31 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.27 2bcb h LEU 39 Cb -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2bcb h LEU 39 CO -0.05 0.02 0.06 -0.07 0.09 0.00 0.00 178.44 178.49 2bcb h LEU 40 N 0.00 0.18 -0.32 1.67 4.07 -1.68 -2.25 115.31 116.98 2bcb h LEU 40 Ca -0.00 -0.13 -0.08 0.00 0.08 0.00 0.00 57.88 57.75 2bcb h LEU 40 Cb 0.08 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.77 2bcb h LEU 40 CO 0.00 0.25 -0.11 0.11 -1.08 0.00 0.00 178.44 177.62 2bcb h LYS 41 N 0.09 0.64 -2.37 1.13 6.56 -1.43 0.20 116.57 121.39 2bcb h LYS 41 Ca 0.05 -0.26 -0.09 0.00 -1.06 0.00 0.00 60.65 59.29 2bcb h LYS 41 Cb 0.13 -0.03 -0.03 0.00 -0.57 0.00 0.00 32.23 31.72 2bcb h LYS 41 CO -0.01 0.83 0.00 0.41 -2.06 0.00 0.00 179.45 178.63 2bcb n GLY 42 N -0.12 2.04 0.00 3.86 0.00 -0.02 -2.26 105.19 108.69 2bcb n GLY 42 Ca -0.03 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 2.56 0.25 5.00 -0.02 0.00 -1.04 -4.78 105.19 107.16 2bcb n GLY 43 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2bcb n GLY 43 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bcb n SER 44 N 0.00 0.00 -4.11 1.61 3.41 0.70 -4.62 113.62 110.62 2bcb n SER 44 Ca 0.00 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.33 2bcb n SER 44 Cb 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 63.78 2bcb n SER 44 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2bcb s THR 45 N 0.00 1.57 0.13 6.66 -4.23 -1.26 -4.88 115.64 113.63 2bcb s THR 45 Ca 0.00 -0.72 -0.19 0.00 -1.18 0.00 0.00 61.69 59.59 2bcb s THR 45 Cb 0.00 -1.40 -0.03 0.00 1.34 0.00 0.00 72.50 72.42 2bcb s THR 45 CO 0.00 0.45 1.71 0.25 -0.54 0.00 0.00 174.62 176.50 2bcb h LEU 46 N 6.97 -0.11 0.37 4.79 5.85 -1.92 -0.27 115.31 130.99 2bcb h LEU 46 Ca -0.27 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 2bcb h LEU 46 Cb 1.20 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 2bcb h LEU 46 CO 0.48 -0.03 -0.37 0.44 -0.34 0.00 0.00 178.44 178.62 2bcb h ASP 47 N 0.05 -1.01 -0.18 1.25 5.19 -1.97 0.21 116.42 119.96 2bcb h ASP 47 Ca 0.10 0.09 0.04 0.00 -0.62 0.00 0.00 57.03 56.64 2bcb h ASP 47 Cb 0.14 0.34 -0.04 0.00 0.18 0.00 0.00 39.33 39.95 2bcb h ASP 47 CO -0.19 -0.52 -0.09 -0.33 -3.12 0.00 0.00 179.24 175.00 2bcb h GLU 48 N -0.77 -0.06 0.80 3.56 4.39 -1.87 0.42 114.58 121.04 2bcb h GLU 48 Ca -0.03 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 2bcb h GLU 48 Cb 0.69 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.35 2bcb h GLU 48 CO -0.07 -0.04 -0.49 1.25 -1.16 0.00 0.00 179.01 178.51 2bcb h LEU 49 N -0.07 -1.22 -1.29 1.33 5.85 -0.80 0.47 115.31 119.58 2bcb h LEU 49 Ca 0.10 0.07 0.11 0.00 0.84 0.00 0.00 57.88 58.99 2bcb h LEU 49 Cb 0.21 0.35 -0.06 0.00 0.37 0.00 0.00 40.66 41.54 2bcb h LEU 49 CO -0.23 -0.75 0.55 0.15 -0.34 0.00 0.00 178.44 177.82 2bcb h PHE 50 N -1.20 0.84 -0.42 1.25 3.57 -0.51 -0.04 116.94 120.43 2bcb h PHE 50 Ca -0.11 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.29 2bcb h PHE 50 Cb 0.96 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 2bcb h PHE 50 CO -0.10 0.37 -0.24 0.93 -2.23 0.00 0.00 178.31 177.04 2bcb h GLU 51 N 0.76 0.90 -0.23 1.11 4.39 0.29 0.55 114.58 122.35 2bcb h GLU 51 Ca 0.40 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2bcb h GLU 51 Cb 0.51 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2bcb h GLU 51 CO -0.17 1.06 0.15 1.49 -1.16 0.00 0.00 179.01 180.39 2bcb h GLU 52 N 0.72 0.31 -0.70 2.33 4.57 0.05 -2.95 114.58 118.91 2bcb h GLU 52 Ca 0.09 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.23 2bcb h GLU 52 Cb 0.82 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.31 2bcb h GLU 52 CO 0.07 0.21 0.36 -0.07 -1.18 0.00 0.00 179.01 178.40 2bcb h LEU 53 N 0.32 0.89 -8.29 1.64 3.38 -0.82 -3.40 115.31 109.03 2bcb h LEU 53 Ca 0.09 -0.11 -0.58 0.00 0.09 0.00 0.00 57.88 57.37 2bcb h LEU 53 Cb -0.03 -0.23 -0.10 0.00 0.09 0.00 0.00 40.66 40.39 2bcb h LEU 53 CO -0.02 0.74 0.95 -0.62 0.09 0.00 0.00 178.44 179.59 2bcb s ASP 54 N -6.05 6.21 0.48 -0.43 -1.08 0.19 -4.69 116.67 111.30 2bcb s ASP 54 Ca -0.13 -0.76 0.26 0.00 -0.52 0.00 0.00 52.55 51.40 2bcb s ASP 54 Cb 0.14 -2.52 1.31 0.00 -1.46 0.00 0.00 42.92 40.40 2bcb s ASP 54 CO 0.80 -1.67 1.84 0.07 0.52 0.00 0.00 175.17 176.73 2bcb h LYS 55 N 9.83 0.18 0.00 4.34 2.10 -1.80 0.27 116.57 131.50 2bcb h LYS 55 Ca -0.22 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.41 2bcb h LYS 55 Cb 1.05 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 32.34 2bcb h LYS 55 CO 1.26 0.12 -0.60 -0.97 -2.00 0.00 0.00 179.45 177.26 2bcb h ASN 56 N 0.19 0.00 -6.37 7.07 -0.73 -1.90 -3.49 115.58 110.35 2bcb h ASN 56 Ca 0.50 0.00 -0.47 0.00 1.87 0.00 0.00 56.30 58.20 2bcb h ASN 56 Cb 1.63 0.00 0.01 0.00 0.27 0.00 0.00 38.32 40.23 2bcb h ASN 56 CO -0.11 0.04 -0.91 0.61 -0.37 0.00 0.00 177.43 176.69 2bcb n GLY 57 N 1.16 -0.54 0.33 1.57 0.00 0.96 -4.74 105.19 103.91 2bcb n GLY 57 Ca 0.01 0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.30 2bcb n GLY 57 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2bcb n ASP 58 N -2.84 0.00 0.00 1.61 2.03 -1.26 -5.07 116.55 111.02 2bcb n ASP 58 Ca -0.22 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.09 2bcb n ASP 58 Cb 0.64 0.08 0.00 0.00 -0.72 0.00 0.00 41.12 41.13 2bcb n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2bcb n GLY 59 N -1.11 -0.14 3.69 0.27 0.00 -1.26 -5.06 105.19 101.59 2bcb n GLY 59 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2bcb n GLY 59 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bcb s GLU 60 N -0.25 1.85 0.56 1.61 8.01 -1.26 -4.49 118.70 124.72 2bcb s GLU 60 Ca 0.00 -1.33 0.07 0.00 0.01 0.00 0.00 54.97 53.72 2bcb s GLU 60 Cb 0.00 0.54 0.07 0.00 -4.31 0.00 0.00 34.13 30.43 2bcb s GLU 60 CO 0.00 -0.81 0.77 0.08 0.01 0.00 0.00 175.26 175.30 2bcb s VAL 61 N -3.39 2.38 0.22 2.63 1.01 0.46 -4.72 120.40 118.98 2bcb s VAL 61 Ca 0.19 -0.92 -0.17 0.00 0.00 0.00 0.00 61.98 61.09 2bcb s VAL 61 Cb -0.03 -2.46 0.02 0.00 0.00 0.00 0.00 36.38 33.91 2bcb s VAL 61 CO 0.11 0.00 0.53 -0.94 0.00 0.00 0.00 175.10 174.80 2bcb s SER 62 N -4.59 -0.21 0.23 3.32 1.04 -1.26 -0.31 113.70 111.92 2bcb s SER 62 Ca 0.61 -0.60 -0.07 0.00 0.48 0.00 0.00 55.95 56.36 2bcb s SER 62 Cb -0.07 0.59 0.40 0.00 0.10 0.00 0.00 66.02 67.04 2bcb s SER 62 CO 0.38 -1.10 1.68 0.15 0.98 0.00 0.00 173.24 175.33 2bcb h PHE 63 N 2.20 0.17 -0.92 5.02 3.57 -1.96 0.18 116.94 125.21 2bcb h PHE 63 Ca -0.27 0.04 0.10 0.00 3.53 0.00 0.00 57.97 61.37 2bcb h PHE 63 Cb 1.26 0.03 -0.12 0.00 2.79 0.00 0.00 35.95 39.90 2bcb h PHE 63 CO 0.37 -0.10 -0.48 -1.91 -2.23 0.00 0.00 178.31 173.96 2bcb n GLU 64 N -5.19 -0.34 0.09 1.11 2.13 -1.26 -1.57 120.64 115.61 2bcb n GLU 64 Ca 0.12 1.39 -0.19 0.00 0.66 0.00 0.00 57.16 59.15 2bcb n GLU 64 Cb 0.41 -2.05 -0.14 0.00 0.27 0.00 0.00 31.44 29.93 2bcb n GLU 64 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 2bcb h GLU 65 N 0.00 0.32 -0.13 5.31 4.11 -1.74 -3.26 114.58 119.19 2bcb h GLU 65 Ca 0.20 -0.54 0.04 0.00 0.07 0.00 0.00 59.36 59.13 2bcb h GLU 65 Cb 0.43 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2bcb h GLU 65 CO -0.88 1.22 0.28 0.35 0.07 0.00 0.00 179.01 180.05 2bcb h PHE 66 N 0.09 0.00 -0.49 2.06 3.57 0.29 -0.01 116.94 122.45 2bcb h PHE 66 Ca -0.23 0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.41 2bcb h PHE 66 Cb 2.04 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.76 2bcb h PHE 66 CO 0.08 0.00 0.44 1.96 -2.23 0.00 0.00 178.31 178.56 2bcb h GLN 67 N 0.00 0.00 -0.77 1.11 1.08 -1.33 0.43 115.11 115.63 2bcb h GLN 67 Ca 0.06 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.26 2bcb h GLN 67 Cb 0.62 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.01 2bcb h GLN 67 CO -0.00 0.00 0.47 0.28 -0.95 0.00 0.00 178.83 178.63 2bcb h VAL 68 N 0.00 1.22 -0.00 -0.54 2.07 -1.26 0.13 116.25 117.87 2bcb h VAL 68 Ca 0.23 -0.47 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 2bcb h VAL 68 Cb 1.11 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 2bcb h VAL 68 CO -0.00 0.22 0.00 0.25 0.02 0.00 0.00 177.57 178.06 2bcb h LEU 69 N 1.05 0.00 -1.08 2.57 7.12 -0.38 0.12 115.31 124.71 2bcb h LEU 69 Ca 0.28 -0.28 0.20 0.00 0.13 0.00 0.00 57.88 58.20 2bcb h LEU 69 Cb -0.04 -0.00 -0.10 0.00 -0.53 0.00 0.00 40.66 39.98 2bcb h LEU 69 CO -0.05 0.29 0.61 0.58 -0.13 0.00 0.00 178.44 179.74 2bcb h VAL 70 N -0.28 0.69 -0.02 1.05 2.07 -0.76 0.16 116.25 119.15 2bcb h VAL 70 Ca 0.00 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2bcb h VAL 70 Cb 0.28 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.98 2bcb h VAL 70 CO 0.00 0.13 -0.12 0.50 0.02 0.00 0.00 177.57 178.10 2bcb h LYS 71 N 0.70 0.12 0.00 1.57 3.64 -0.48 -3.34 116.57 118.78 2bcb h LYS 71 Ca 0.57 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.84 2bcb h LYS 71 Cb 0.98 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.82 2bcb h LYS 71 CO -0.36 0.77 -0.04 -0.22 -2.27 0.00 0.00 179.45 177.34 2bcb h LYS 72 N -0.49 0.00 -0.09 1.90 3.11 0.85 0.37 116.57 122.22 2bcb h LYS 72 Ca -0.01 0.00 0.03 0.00 -2.81 0.00 0.00 60.65 57.86 2bcb h LYS 72 Cb 0.80 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 32.02 2bcb h LYS 72 CO 0.03 0.04 0.07 -0.84 -2.81 0.00 0.00 179.45 175.93 2bcb h ILE 73 N 0.00 0.86 -0.41 2.00 3.07 -1.16 0.51 117.51 122.37 2bcb h ILE 73 Ca -0.00 0.00 -0.17 0.00 1.55 0.00 0.00 64.86 66.24 2bcb h ILE 73 Cb 0.10 0.95 -0.10 0.00 -0.27 0.00 0.00 36.82 37.49 2bcb h ILE 73 CO 0.00 0.00 0.03 -1.54 -1.05 0.00 0.00 178.15 175.60 2bcb n SER 74 N -4.37 3.09 0.00 2.16 3.41 0.07 -5.15 113.62 112.83 2bcb n SER 74 Ca -0.01 -3.53 0.00 0.00 -0.26 0.00 0.00 58.87 55.07 2bcb n SER 74 Cb 0.19 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.50 2bcb n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88