#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 -0.29 0.36 4.39 1.04 -1.26 -5.02 113.70 112.92 2bcb s SER 2 Ca 0.00 -0.25 0.14 0.00 0.48 0.00 0.00 55.95 56.32 2bcb s SER 2 Cb 0.00 0.49 1.01 0.00 0.10 0.00 0.00 66.02 67.62 2bcb s SER 2 CO 0.00 -0.87 1.74 -0.65 0.98 0.00 0.00 173.24 174.45 2bcb h PRO 3 N 2.00 0.46 -0.99 4.02 0.11 -2.05 0.45 132.00 136.00 2bcb h PRO 3 Ca -0.24 -0.03 0.16 0.00 0.11 0.00 0.00 66.00 66.01 2bcb h PRO 3 Cb 1.24 -0.10 -0.10 0.00 0.11 0.00 0.00 31.00 32.15 2bcb h PRO 3 CO 0.28 0.30 0.60 1.49 -0.21 0.00 0.00 178.00 180.46 2bcb h GLU 4 N 0.47 0.79 -0.14 1.05 4.81 -1.98 0.23 114.58 119.82 2bcb h GLU 4 Ca 0.63 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.80 2bcb h GLU 4 Cb 1.41 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 2bcb h GLU 4 CO -0.40 0.53 0.02 0.93 -0.73 0.00 0.00 179.01 179.36 2bcb h GLU 5 N 0.82 0.23 -0.58 1.92 4.39 -1.30 0.12 114.58 120.17 2bcb h GLU 5 Ca 0.54 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 60.16 2bcb h GLU 5 Cb 0.75 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.34 2bcb h GLU 5 CO -0.35 0.42 0.27 -0.07 -1.16 0.00 0.00 179.01 178.13 2bcb h LEU 6 N 0.01 0.74 -0.41 1.33 3.38 -1.20 0.48 115.31 119.64 2bcb h LEU 6 Ca 0.04 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2bcb h LEU 6 Cb 0.30 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2bcb h LEU 6 CO 0.00 0.64 0.10 0.50 0.09 0.00 0.00 178.44 179.77 2bcb h LYS 7 N 0.82 0.65 -0.18 1.13 3.64 -0.27 0.14 116.57 122.50 2bcb h LYS 7 Ca 0.20 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2bcb h LYS 7 Cb 0.10 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2bcb h LYS 7 CO -0.03 0.66 0.11 0.78 -2.27 0.00 0.00 179.45 178.71 2bcb h GLY 8 N 0.52 0.26 0.96 5.01 0.00 0.24 0.56 103.07 110.61 2bcb h GLY 8 Ca 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 2bcb h GLY 8 CO 0.00 0.10 0.16 -2.22 0.00 0.00 0.00 176.54 174.58 2bcb h ILE 9 N 0.22 1.13 0.00 2.60 1.08 -0.81 0.29 117.51 122.02 2bcb h ILE 9 Ca 0.06 -0.33 0.03 0.00 -0.39 0.00 0.00 64.86 64.23 2bcb h ILE 9 Cb 0.01 0.82 -0.04 0.00 -3.07 0.00 0.00 36.82 34.54 2bcb h ILE 9 CO -0.01 0.13 -0.24 0.15 -0.69 0.00 0.00 178.15 177.49 2bcb h PHE 10 N 0.36 -0.63 -0.74 1.37 3.04 -0.51 -2.27 116.94 117.56 2bcb h PHE 10 Ca 0.10 0.02 0.07 0.00 3.98 0.00 0.00 57.97 62.14 2bcb h PHE 10 Cb 0.06 0.28 -0.06 0.00 2.56 0.00 0.00 35.95 38.79 2bcb h PHE 10 CO -0.03 -0.32 0.42 1.49 -2.02 0.00 0.00 178.31 177.85 2bcb h GLU 11 N -0.37 0.74 -0.55 1.11 4.81 -0.55 0.64 114.58 120.40 2bcb h GLU 11 Ca 0.06 -0.04 0.11 0.00 -0.13 0.00 0.00 59.36 59.36 2bcb h GLU 11 Cb 0.45 -0.17 -0.11 0.00 0.63 0.00 0.00 28.75 29.56 2bcb h GLU 11 CO -0.21 0.49 -0.18 -0.22 -0.73 0.00 0.00 179.01 178.16 2bcb h LYS 12 N 0.76 -0.05 0.19 1.92 3.64 0.16 0.16 116.57 123.35 2bcb h LYS 12 Ca 0.34 0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.45 2bcb h LYS 12 Cb 0.23 0.01 0.02 0.00 -0.41 0.00 0.00 32.23 32.08 2bcb h LYS 12 CO -0.20 -0.03 -1.20 1.88 -2.27 0.00 0.00 179.45 177.63 2bcb h TYR 13 N -0.05 0.72 -1.02 1.91 -1.99 -1.24 -3.31 116.97 111.99 2bcb h TYR 13 Ca 0.26 -0.52 0.26 0.00 2.00 0.00 0.00 58.73 60.73 2bcb h TYR 13 Cb 0.45 -0.03 -0.08 0.00 2.00 0.00 0.00 36.73 39.07 2bcb h TYR 13 CO -0.50 1.46 0.67 0.00 -0.00 0.00 0.00 178.16 179.79 2bcb h ALA 14 N 0.09 2.29 0.00 3.88 0.00 -0.26 -0.24 119.26 125.04 2bcb h ALA 14 Ca -0.22 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2bcb h ALA 14 Cb 1.89 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.70 2bcb h ALA 14 CO 0.19 -0.66 0.00 0.00 0.00 0.00 0.00 179.25 178.78 2bcb h ALA 15 N 1.60 1.00 0.56 0.00 0.00 -0.80 -3.24 119.26 118.38 2bcb h ALA 15 Ca 0.56 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.44 2bcb h ALA 15 Cb 1.48 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.28 2bcb h ALA 15 CO -0.24 0.00 -0.27 0.87 0.00 0.00 0.00 179.25 179.61 2bcb h LYS 16 N 0.00 -0.72 -3.57 0.00 6.56 -1.22 -3.44 116.57 114.18 2bcb h LYS 16 Ca 0.00 0.05 -0.15 0.00 -1.06 0.00 0.00 60.65 59.49 2bcb h LYS 16 Cb 0.03 0.16 -0.21 0.00 -0.57 0.00 0.00 32.23 31.65 2bcb h LYS 16 CO 0.00 -0.42 -0.51 -1.21 -2.06 0.00 0.00 179.45 175.25 2bcb s GLU 17 N -4.60 0.47 -0.77 3.15 2.02 -1.22 -4.93 118.70 112.82 2bcb s GLU 17 Ca -0.14 -0.43 -0.03 0.00 0.02 0.00 0.00 54.97 54.39 2bcb s GLU 17 Cb 0.02 0.19 0.00 0.00 0.10 0.00 0.00 34.13 34.44 2bcb s GLU 17 CO 0.45 -0.11 0.39 0.41 0.02 0.00 0.00 175.26 176.43 2bcb n GLY 18 N 1.46 0.10 0.89 -1.39 0.00 -1.26 -4.53 105.19 100.46 2bcb n GLY 18 Ca -0.23 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.53 -5.38 0.00 1.61 -0.08 -1.26 -4.12 116.55 106.79 2bcb n ASP 19 Ca -0.04 0.68 0.00 0.00 -1.51 0.00 0.00 54.79 53.91 2bcb n ASP 19 Cb 0.55 -2.10 0.00 0.00 2.34 0.00 0.00 41.12 41.91 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 -0.55 0.00 0.15 -0.67 -0.04 -1.24 -1.06 135.00 131.59 2bcb n PRO 20 Ca 0.00 0.33 0.09 0.00 -0.04 0.00 0.00 63.50 63.88 2bcb n PRO 20 Cb 0.00 -1.66 0.06 0.00 -0.04 0.00 0.00 33.50 31.86 2bcb n PRO 20 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 2bcb h ASN 21 N 0.00 0.00 -4.14 3.54 -1.24 -1.84 -3.41 115.58 108.49 2bcb h ASN 21 Ca 0.00 0.00 -0.62 0.00 0.71 0.00 0.00 56.30 56.39 2bcb h ASN 21 Cb 0.32 0.00 -0.23 0.00 0.73 0.00 0.00 38.32 39.13 2bcb h ASN 21 CO 0.00 0.16 -0.85 -1.10 -1.29 0.00 0.00 177.43 174.35 2bcb s GLN 22 N -3.18 1.36 -0.41 6.67 1.11 -0.22 -3.98 119.66 121.01 2bcb s GLN 22 Ca 0.03 -1.16 -0.14 0.00 0.01 0.00 0.00 55.36 54.10 2bcb s GLN 22 Cb 0.07 -1.65 0.03 0.00 -1.01 0.00 0.00 33.01 30.46 2bcb s GLN 22 CO 0.74 0.40 0.29 -0.51 0.01 0.00 0.00 175.29 176.21 2bcb s LEU 23 N -1.70 5.08 0.69 2.90 1.43 0.72 -4.35 118.68 123.45 2bcb s LEU 23 Ca 0.10 -1.02 -0.15 0.00 -1.03 0.00 0.00 54.13 52.03 2bcb s LEU 23 Cb -0.10 -2.12 0.02 0.00 0.03 0.00 0.00 46.19 44.02 2bcb s LEU 23 CO 0.04 -0.47 1.14 -0.44 0.23 0.00 0.00 176.35 176.85 2bcb s SER 24 N 1.79 4.77 0.17 2.29 0.01 -1.26 0.01 113.70 121.48 2bcb s SER 24 Ca 0.04 2.11 -0.23 0.00 1.31 0.00 0.00 55.95 59.18 2bcb s SER 24 Cb -0.20 -2.56 0.07 0.00 0.21 0.00 0.00 66.02 63.54 2bcb s SER 24 CO 0.08 -1.86 1.60 0.50 0.41 0.00 0.00 173.24 173.97 2bcb h LYS 25 N -0.13 -0.23 0.00 12.44 3.64 -1.96 0.31 116.57 130.63 2bcb h LYS 25 Ca -0.47 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 58.92 2bcb h LYS 25 Cb 1.26 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.13 2bcb h LYS 25 CO 0.52 -0.15 -0.04 1.49 -2.27 0.00 0.00 179.45 179.00 2bcb h GLU 26 N -0.24 0.00 0.06 1.90 4.81 -1.95 -2.95 114.58 116.21 2bcb h GLU 26 Ca 0.18 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.26 2bcb h GLU 26 Cb 0.54 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.93 2bcb h GLU 26 CO -0.56 0.04 -0.63 1.49 -0.73 0.00 0.00 179.01 178.62 2bcb h GLU 27 N 0.00 0.32 -0.81 1.92 4.81 -0.86 -3.26 114.58 116.71 2bcb h GLU 27 Ca -0.00 -0.43 0.13 0.00 -0.13 0.00 0.00 59.36 58.93 2bcb h GLU 27 Cb 0.08 0.14 -0.09 0.00 0.63 0.00 0.00 28.75 29.52 2bcb h GLU 27 CO 0.00 1.14 0.41 1.25 -0.73 0.00 0.00 179.01 181.08 2bcb h LEU 28 N -0.29 0.51 -0.02 1.64 5.85 -0.67 -1.46 115.31 120.86 2bcb h LEU 28 Ca -0.10 0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.71 2bcb h LEU 28 Cb 1.41 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.42 2bcb h LEU 28 CO 0.12 0.24 -0.18 0.50 -0.34 0.00 0.00 178.44 178.78 2bcb h LYS 29 N 0.62 -0.20 -0.74 1.25 1.63 -1.57 0.15 116.57 117.71 2bcb h LYS 29 Ca 0.42 0.01 0.16 0.00 -0.85 0.00 0.00 60.65 60.40 2bcb h LYS 29 Cb 0.55 0.05 -0.11 0.00 -0.60 0.00 0.00 32.23 32.12 2bcb h LYS 29 CO -0.33 -0.14 0.21 -0.07 -3.45 0.00 0.00 179.45 175.67 2bcb h LEU 30 N -0.21 0.07 0.37 5.20 3.38 -1.57 0.39 115.31 122.95 2bcb h LEU 30 Ca 0.01 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2bcb h LEU 30 Cb 0.23 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2bcb h LEU 30 CO -0.13 -0.01 -0.29 0.25 0.09 0.00 0.00 178.44 178.35 2bcb h LEU 31 N 0.30 -0.78 -0.94 1.67 5.85 -0.60 -0.83 115.31 119.98 2bcb h LEU 31 Ca 0.42 0.05 0.14 0.00 0.84 0.00 0.00 57.88 59.34 2bcb h LEU 31 Cb 0.70 0.24 -0.09 0.00 0.37 0.00 0.00 40.66 41.89 2bcb h LEU 31 CO -0.49 -0.41 0.56 -0.07 -0.34 0.00 0.00 178.44 177.69 2bcb h LEU 32 N -0.64 0.76 -0.86 2.25 3.38 -0.44 0.10 115.31 119.86 2bcb h LEU 32 Ca -0.05 0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2bcb h LEU 32 Cb 0.54 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 2bcb h LEU 32 CO 0.01 0.35 0.26 1.56 0.09 0.00 0.00 178.44 180.71 2bcb h GLN 33 N 0.82 1.10 0.06 1.13 4.20 -0.70 0.14 115.11 121.86 2bcb h GLN 33 Ca 0.50 -0.21 -0.09 0.00 0.06 0.00 0.00 58.65 58.91 2bcb h GLN 33 Cb 0.63 -0.17 0.01 0.00 0.30 0.00 0.00 27.48 28.24 2bcb h GLN 33 CO -0.32 0.91 -0.41 1.15 -0.67 0.00 0.00 178.83 179.49 2bcb h THR 34 N 1.06 1.63 0.19 -0.54 2.02 -0.05 -3.37 112.91 113.86 2bcb h THR 34 Ca 0.24 -2.42 -0.35 0.00 0.77 0.00 0.00 66.41 64.65 2bcb h THR 34 Cb 0.25 3.26 0.01 0.00 -1.74 0.00 0.00 68.15 69.93 2bcb h THR 34 CO -0.01 0.64 -1.74 -0.33 0.37 0.00 0.00 175.52 174.45 2bcb h GLU 35 N -0.74 0.40 -0.35 6.66 4.39 -0.84 -3.42 114.58 120.69 2bcb h GLU 35 Ca -0.08 -0.68 -0.27 0.00 0.34 0.00 0.00 59.36 58.67 2bcb h GLU 35 Cb 1.28 0.25 -0.33 0.00 -0.10 0.00 0.00 28.75 29.86 2bcb h GLU 35 CO 0.05 1.33 -0.89 1.19 -1.16 0.00 0.00 179.01 179.53 2bcb n PHE 36 N -3.61 1.20 -0.12 4.33 3.72 0.46 -4.89 117.46 118.56 2bcb n PHE 36 Ca -0.25 -1.70 -0.05 0.00 -0.05 0.00 0.00 57.45 55.40 2bcb n PHE 36 Cb 1.07 -0.25 0.03 0.00 -0.94 0.00 0.00 39.48 39.39 2bcb n PHE 36 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2bcb h PRO 37 N 1.83 0.23 0.14 -1.08 0.13 -1.62 -0.45 132.00 131.18 2bcb h PRO 37 Ca 0.02 -0.01 -0.20 0.00 -0.87 0.00 0.00 66.00 64.94 2bcb h PRO 37 Cb 1.42 -0.05 0.02 0.00 0.13 0.00 0.00 31.00 32.52 2bcb h PRO 37 CO 0.30 0.15 -0.87 0.66 -0.23 0.00 0.00 178.00 178.01 2bcb h SER 38 N 0.23 0.53 0.00 1.44 4.64 -1.91 -3.35 113.55 115.13 2bcb h SER 38 Ca 0.18 -0.93 -0.00 0.00 -0.47 0.00 0.00 61.79 60.58 2bcb h SER 38 Cb 0.20 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2bcb h SER 38 CO -0.22 1.41 -0.00 -0.07 -0.87 0.00 0.00 176.83 177.08 2bcb h LEU 39 N -0.27 0.00 -2.48 5.97 3.38 -1.84 -0.48 115.31 119.58 2bcb h LEU 39 Ca -0.15 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.83 2bcb h LEU 39 Cb 1.67 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.42 2bcb h LEU 39 CO 0.16 0.00 0.03 -0.07 0.09 0.00 0.00 178.44 178.66 2bcb h LEU 40 N 0.00 0.00 -1.45 1.67 3.38 -1.22 -3.39 115.31 114.30 2bcb h LEU 40 Ca -0.00 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.37 2bcb h LEU 40 Cb 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 40.66 40.48 2bcb h LEU 40 CO 0.00 0.00 -0.90 0.29 0.09 0.00 0.00 178.44 177.92 2bcb n LYS 41 N -3.76 -1.59 -3.80 1.13 5.02 -0.19 -4.71 118.16 110.26 2bcb n LYS 41 Ca -0.02 0.21 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2bcb n LYS 41 Cb 0.12 -4.53 0.00 0.00 -0.02 0.00 0.00 35.03 30.59 2bcb n LYS 41 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2bcb n GLY 42 N -1.58 -1.03 0.00 0.72 0.00 -1.26 -5.06 105.19 96.98 2bcb n GLY 42 Ca -0.03 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.89 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 0.00 0.76 3.90 -0.02 0.00 -1.26 -5.05 105.19 103.53 2bcb n GLY 43 Ca 0.00 -0.71 -0.02 0.00 0.00 0.00 0.00 46.02 45.29 2bcb n GLY 43 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2bcb s SER 44 N 0.00 0.00 0.29 1.61 0.15 -1.26 -5.13 113.70 109.37 2bcb s SER 44 Ca 0.00 -0.57 -0.29 0.00 0.70 0.00 0.00 55.95 55.79 2bcb s SER 44 Cb 0.00 0.42 -0.10 0.00 -1.71 0.00 0.00 66.02 64.63 2bcb s SER 44 CO 0.00 -0.83 1.42 0.42 1.20 0.00 0.00 173.24 175.45 2bcb s THR 45 N -2.13 2.54 0.21 6.45 -4.23 -1.26 -4.81 115.64 112.41 2bcb s THR 45 Ca 0.24 0.49 -0.18 0.00 -1.18 0.00 0.00 61.69 61.05 2bcb s THR 45 Cb -0.02 -3.31 0.19 0.00 1.34 0.00 0.00 72.50 70.70 2bcb s THR 45 CO 0.04 0.09 1.58 0.25 -0.54 0.00 0.00 174.62 176.04 2bcb h LEU 46 N 4.30 -1.13 0.59 4.79 5.85 -2.01 0.61 115.31 128.31 2bcb h LEU 46 Ca -0.47 0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.47 2bcb h LEU 46 Cb 1.22 0.60 -0.01 0.00 0.37 0.00 0.00 40.66 42.84 2bcb h LEU 46 CO 0.73 -0.29 -0.40 -0.78 -0.34 0.00 0.00 178.44 177.36 2bcb h ASP 47 N -0.09 -1.03 -0.48 1.25 3.58 -1.98 0.15 116.42 117.83 2bcb h ASP 47 Ca 0.29 0.07 0.09 0.00 0.42 0.00 0.00 57.03 57.89 2bcb h ASP 47 Cb 0.57 0.31 -0.08 0.00 1.72 0.00 0.00 39.33 41.85 2bcb h ASP 47 CO -0.78 -0.60 -0.01 -0.33 -2.88 0.00 0.00 179.24 174.64 2bcb h GLU 48 N -0.95 0.10 0.91 0.28 4.39 -1.74 0.40 114.58 117.98 2bcb h GLU 48 Ca -0.07 -0.01 -0.04 0.00 0.34 0.00 0.00 59.36 59.58 2bcb h GLU 48 Cb 0.78 -0.02 0.01 0.00 -0.10 0.00 0.00 28.75 29.42 2bcb h GLU 48 CO 0.05 0.07 -0.44 1.25 -1.16 0.00 0.00 179.01 178.78 2bcb h LEU 49 N 0.11 -1.03 -1.28 1.33 5.85 -0.68 0.10 115.31 119.71 2bcb h LEU 49 Ca 0.24 0.04 0.06 0.00 0.84 0.00 0.00 57.88 59.05 2bcb h LEU 49 Cb 0.35 0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.60 2bcb h LEU 49 CO -0.40 -0.72 0.52 0.15 -0.34 0.00 0.00 178.44 177.65 2bcb h PHE 50 N -1.26 0.89 -0.38 1.25 3.04 -0.58 -0.44 116.94 119.46 2bcb h PHE 50 Ca -0.12 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 61.78 2bcb h PHE 50 Cb 0.94 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 39.14 2bcb h PHE 50 CO 0.02 0.48 -0.01 0.93 -2.02 0.00 0.00 178.31 177.71 2bcb h GLU 51 N 0.88 0.68 -0.41 1.11 4.39 0.02 0.52 114.58 121.78 2bcb h GLU 51 Ca 0.34 -0.22 0.05 0.00 0.34 0.00 0.00 59.36 59.86 2bcb h GLU 51 Cb 0.19 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 28.74 2bcb h GLU 51 CO -0.11 0.78 0.15 1.49 -1.16 0.00 0.00 179.01 180.16 2bcb h GLU 52 N 0.50 0.31 -0.59 2.33 4.81 0.08 -2.45 114.58 119.57 2bcb h GLU 52 Ca 0.11 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 2bcb h GLU 52 Cb 0.48 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.76 2bcb h GLU 52 CO 0.02 0.20 0.14 -0.07 -0.73 0.00 0.00 179.01 178.57 2bcb h LEU 53 N 0.32 0.86 -7.38 1.64 3.38 -0.75 -3.38 115.31 110.00 2bcb h LEU 53 Ca 0.19 -0.17 -0.47 0.00 0.09 0.00 0.00 57.88 57.52 2bcb h LEU 53 Cb 0.16 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2bcb h LEU 53 CO -0.18 0.84 1.61 -0.67 0.09 0.00 0.00 178.44 180.13 2bcb n ASP 54 N -4.26 2.96 -0.21 -0.43 -0.08 0.18 -4.64 116.55 110.07 2bcb n ASP 54 Ca 0.04 -2.70 -0.04 0.00 -1.51 0.00 0.00 54.79 50.58 2bcb n ASP 54 Cb 0.24 -1.50 0.07 0.00 2.34 0.00 0.00 41.12 42.27 2bcb n ASP 54 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2bcb h LYS 55 N 8.88 0.65 0.00 -0.67 1.79 -1.80 -3.39 116.57 122.02 2bcb h LYS 55 Ca 0.31 -0.04 -0.18 0.00 -2.18 0.00 0.00 60.65 58.56 2bcb h LYS 55 Cb 0.83 -0.15 -0.14 0.00 -1.58 0.00 0.00 32.23 31.20 2bcb h LYS 55 CO 1.53 0.43 -0.31 -1.71 -1.08 0.00 0.00 179.45 178.31 2bcb n ASN 56 N -4.78 -2.19 -0.05 0.86 4.05 -1.26 -5.00 115.26 106.89 2bcb n ASN 56 Ca 0.06 -2.94 -0.06 0.00 0.45 0.00 0.00 54.58 52.10 2bcb n ASN 56 Cb 0.12 1.56 -0.02 0.00 1.23 0.00 0.00 39.78 42.67 2bcb n ASN 56 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2bcb n GLY 57 N 1.05 -0.41 3.60 8.20 0.00 -1.26 -5.02 105.19 111.34 2bcb n GLY 57 Ca 0.04 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.88 -6.05 0.00 1.61 5.68 -1.26 -4.08 116.55 108.57 2bcb n ASP 58 Ca -0.09 -0.56 0.00 0.00 -0.50 0.00 0.00 54.79 53.65 2bcb n ASP 58 Cb 0.32 -4.78 0.00 0.00 -1.14 0.00 0.00 41.12 35.52 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 -1.89 0.33 3.28 6.12 0.00 -1.26 -5.14 105.19 106.63 2bcb n GLY 59 Ca 0.00 0.01 -0.12 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 0.00 0.86 0.94 1.61 2.02 -1.26 -4.31 118.70 118.57 2bcb s GLU 60 Ca 0.00 -0.48 -0.15 0.00 0.02 0.00 0.00 54.97 54.37 2bcb s GLU 60 Cb 0.00 0.38 0.20 0.00 0.10 0.00 0.00 34.13 34.80 2bcb s GLU 60 CO 0.00 -0.29 1.30 0.08 0.02 0.00 0.00 175.26 176.37 2bcb s VAL 61 N -2.63 2.01 0.18 2.63 1.01 0.10 -4.18 120.40 119.53 2bcb s VAL 61 Ca -0.04 -0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.72 2bcb s VAL 61 Cb -0.01 -2.96 0.02 0.00 0.00 0.00 0.00 36.38 33.44 2bcb s VAL 61 CO -0.04 0.00 0.48 -0.94 0.00 0.00 0.00 175.10 174.60 2bcb s SER 62 N -4.88 -0.22 0.27 3.32 1.04 -1.26 -0.20 113.70 111.77 2bcb s SER 62 Ca 0.73 -0.51 -0.01 0.00 0.48 0.00 0.00 55.95 56.65 2bcb s SER 62 Cb -0.04 0.55 0.60 0.00 0.10 0.00 0.00 66.02 67.23 2bcb s SER 62 CO 0.52 -1.01 1.67 0.15 0.98 0.00 0.00 173.24 175.56 2bcb h PHE 63 N 2.26 0.36 -1.00 5.02 3.04 -1.95 0.11 116.94 124.78 2bcb h PHE 63 Ca -0.30 0.05 0.10 0.00 3.98 0.00 0.00 57.97 61.80 2bcb h PHE 63 Cb 1.26 -0.03 -0.13 0.00 2.56 0.00 0.00 35.95 39.61 2bcb h PHE 63 CO 0.35 -0.13 -0.55 1.49 -2.02 0.00 0.00 178.31 177.45 2bcb h GLU 64 N 0.27 -0.00 0.15 1.11 4.81 -1.96 -1.80 114.58 117.16 2bcb h GLU 64 Ca 0.49 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 59.43 2bcb h GLU 64 Cb 0.92 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.31 2bcb h GLU 64 CO -0.57 -0.00 -1.37 1.05 -0.73 0.00 0.00 179.01 177.39 2bcb h GLU 65 N -0.00 0.31 -0.16 1.92 4.11 -1.68 -3.25 114.58 115.83 2bcb h GLU 65 Ca 0.20 -0.53 0.05 0.00 0.07 0.00 0.00 59.36 59.14 2bcb h GLU 65 Cb 0.45 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2bcb h GLU 65 CO -0.95 1.23 0.33 0.35 0.07 0.00 0.00 179.01 180.05 2bcb h PHE 66 N 0.09 0.00 -0.27 2.06 3.57 -0.04 0.02 116.94 122.36 2bcb h PHE 66 Ca -0.19 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.39 2bcb h PHE 66 Cb 2.02 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.75 2bcb h PHE 66 CO 0.07 0.00 0.32 1.96 -2.23 0.00 0.00 178.31 178.43 2bcb h GLN 67 N 0.00 0.00 -0.86 1.11 1.08 -1.39 0.41 115.11 115.47 2bcb h GLN 67 Ca 0.08 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.25 2bcb h GLN 67 Cb 0.74 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.13 2bcb h GLN 67 CO -0.00 0.00 0.44 0.28 -0.95 0.00 0.00 178.83 178.60 2bcb h VAL 68 N 0.00 1.25 0.02 -0.54 2.07 -1.25 0.11 116.25 117.91 2bcb h VAL 68 Ca 0.13 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 2bcb h VAL 68 Cb 0.76 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2bcb h VAL 68 CO -0.00 0.30 -0.01 0.25 0.02 0.00 0.00 177.57 178.13 2bcb h LEU 69 N 1.21 -0.02 -1.33 2.57 7.12 -0.40 -0.16 115.31 124.31 2bcb h LEU 69 Ca 0.30 -0.22 0.22 0.00 0.13 0.00 0.00 57.88 58.31 2bcb h LEU 69 Cb 0.07 0.00 -0.09 0.00 -0.53 0.00 0.00 40.66 40.12 2bcb h LEU 69 CO -0.04 0.21 0.63 0.58 -0.13 0.00 0.00 178.44 179.69 2bcb h VAL 70 N -0.25 0.63 -0.05 1.05 2.07 -0.79 0.73 116.25 119.64 2bcb h VAL 70 Ca -0.00 -0.17 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 2bcb h VAL 70 Cb 0.24 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.10 2bcb h VAL 70 CO 0.00 0.09 -0.15 0.50 0.02 0.00 0.00 177.57 178.04 2bcb h LYS 71 N 0.49 0.18 0.00 1.57 3.64 -0.29 -3.32 116.57 118.84 2bcb h LYS 71 Ca 0.55 -0.13 0.00 0.00 -1.27 0.00 0.00 60.65 59.79 2bcb h LYS 71 Cb 1.23 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.08 2bcb h LYS 71 CO -0.27 0.76 0.00 0.87 -2.27 0.00 0.00 179.45 178.53 2bcb h LYS 72 N -0.36 0.00 0.00 1.90 1.57 0.85 -2.76 116.57 117.76 2bcb h LYS 72 Ca -0.01 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 2bcb h LYS 72 Cb 0.77 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 2bcb h LYS 72 CO 0.03 0.00 -0.05 -0.84 -0.57 0.00 0.00 179.45 178.02 2bcb h ILE 73 N 0.00 0.83 -0.63 1.86 3.07 -1.05 0.33 117.51 121.91 2bcb h ILE 73 Ca 0.00 -0.20 -0.30 0.00 1.55 0.00 0.00 64.86 65.91 2bcb h ILE 73 Cb 0.45 1.11 -0.18 0.00 -0.27 0.00 0.00 36.82 37.93 2bcb h ILE 73 CO 0.00 0.05 0.38 -1.54 -1.05 0.00 0.00 178.15 175.99 2bcb n SER 74 N -4.17 3.61 0.00 2.16 3.41 -1.04 -4.76 113.62 112.83 2bcb n SER 74 Ca -0.03 -3.02 0.00 0.00 -0.26 0.00 0.00 58.87 55.56 2bcb n SER 74 Cb 0.14 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 2bcb n SER 74 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55