#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qff h TYR 10 N 0.00 0.43 -0.75 -1.84 5.03 -2.05 -2.14 116.97 115.64 2qff h TYR 10 Ca 0.00 -0.04 -0.02 0.00 2.58 0.00 0.00 58.73 61.25 2qff h TYR 10 Cb 0.00 -0.12 -0.03 0.00 1.55 0.00 0.00 36.73 38.12 2qff h TYR 10 CO 0.00 0.45 0.37 1.96 -1.32 0.00 0.00 178.16 179.63 2qff h GLN 11 N 0.28 1.08 -0.57 1.82 4.20 -2.05 0.22 115.11 120.09 2qff h GLN 11 Ca 0.09 -0.15 -0.06 0.00 0.06 0.00 0.00 58.65 58.58 2qff h GLN 11 Cb 0.22 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 2qff h GLN 11 CO -0.00 0.83 0.11 -0.97 -0.67 0.00 0.00 178.83 178.13 2qff h ASN 12 N 1.06 0.90 -0.11 1.46 -0.73 -1.98 -0.43 115.58 115.75 2qff h ASN 12 Ca 0.26 -0.25 -0.16 0.00 1.87 0.00 0.00 56.30 58.02 2qff h ASN 12 Cb 0.10 -0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.45 2qff h ASN 12 CO -0.04 0.92 -0.50 -0.08 -0.37 0.00 0.00 177.43 177.36 2qff h GLU 13 N 0.84 0.69 -0.18 6.67 4.81 -1.13 -1.87 114.58 124.41 2qff h GLU 13 Ca 0.18 -0.41 -0.01 0.00 -0.13 0.00 0.00 59.36 58.98 2qff h GLU 13 Cb 0.39 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 2qff h GLU 13 CO 0.01 1.03 0.06 -0.22 -0.73 0.00 0.00 179.01 179.16 2qff h LYS 14 N 0.54 0.28 -0.57 1.92 3.64 -0.41 -1.69 116.57 120.27 2qff h LYS 14 Ca 0.02 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2qff h LYS 14 Cb 1.06 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.82 2qff h LYS 14 CO 0.10 0.38 0.25 1.25 -2.27 0.00 0.00 179.45 179.16 2qff h LEU 15 N 0.12 0.77 -0.58 5.20 5.85 -1.07 -0.59 115.31 125.01 2qff h LEU 15 Ca 0.06 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.65 2qff h LEU 15 Cb 0.21 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2qff h LEU 15 CO -0.00 0.71 0.35 0.00 -0.34 0.00 0.00 178.44 179.16 2qff h ALA 16 N 1.09 0.75 -0.61 1.25 0.00 -1.28 0.10 119.26 120.56 2qff h ALA 16 Ca 0.19 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 2qff h ALA 16 Cb 0.17 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2qff h ALA 16 CO -0.02 0.07 0.21 -0.91 0.00 0.00 0.00 179.25 178.60 2qff h ASN 17 N 0.68 0.88 -0.13 0.00 2.35 -1.05 -1.09 115.58 117.22 2qff h ASN 17 Ca 0.24 -0.19 -0.01 0.00 -0.55 0.00 0.00 56.30 55.78 2qff h ASN 17 Cb 0.04 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 2qff h ASN 17 CO -0.11 0.84 0.05 -0.33 -1.65 0.00 0.00 177.43 176.22 2qff h GLU 18 N 0.87 0.19 -0.46 0.81 5.08 -0.66 -1.95 114.58 118.46 2qff h GLU 18 Ca 0.20 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.47 2qff h GLU 18 Cb 0.26 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2qff h GLU 18 CO -0.01 0.31 0.08 1.25 -1.00 0.00 0.00 179.01 179.64 2qff h LEU 19 N 0.04 0.66 -0.75 1.33 5.85 -0.77 -1.75 115.31 119.92 2qff h LEU 19 Ca 0.04 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 2qff h LEU 19 Cb 0.19 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2qff h LEU 19 CO -0.00 0.68 0.40 0.50 -0.34 0.00 0.00 178.44 179.67 2qff h LYS 20 N 0.68 1.06 -0.64 1.25 1.63 -1.08 -1.47 116.57 118.01 2qff h LYS 20 Ca 0.15 -0.14 -0.09 0.00 -0.85 0.00 0.00 60.65 59.73 2qff h LYS 20 Cb 0.30 -0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 31.70 2qff h LYS 20 CO 0.00 0.80 0.07 0.77 -3.45 0.00 0.00 179.45 177.64 2qff h SER 21 N 1.05 1.04 -0.52 4.20 0.02 -0.84 -1.44 113.55 117.07 2qff h SER 21 Ca 0.26 -0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 2qff h SER 21 Cb 0.06 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 2qff h SER 21 CO -0.04 1.06 0.16 -0.07 -1.14 0.00 0.00 176.83 176.80 2qff h LEU 22 N 0.99 0.75 -1.70 5.07 3.38 -1.20 -2.81 115.31 119.80 2qff h LEU 22 Ca 0.19 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2qff h LEU 22 Cb 0.49 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2qff h LEU 22 CO 0.02 0.76 -0.16 -0.07 0.09 0.00 0.00 178.44 179.08 2qff h LEU 23 N 0.71 0.00 -2.00 1.67 3.38 -1.04 -2.42 115.31 115.60 2qff h LEU 23 Ca 0.17 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.14 2qff h LEU 23 Cb 0.28 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2qff h LEU 23 CO -0.01 0.16 -0.00 0.44 0.09 0.00 0.00 178.44 179.12 2qff h ASP 24 N 0.00 0.00 -0.34 -0.43 3.32 -0.99 -2.17 116.42 115.81 2qff h ASP 24 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qff h ASP 24 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 2qff h ASP 24 CO 0.02 0.00 0.00 -1.84 -1.72 0.00 0.00 179.24 175.70 2qff n GLU 25 N -3.10 3.00 0.00 3.56 0.28 -0.92 -4.67 120.64 118.80 2qff n GLU 25 Ca -0.01 -2.47 -0.12 0.00 -0.16 0.00 0.00 57.16 54.40 2qff n GLU 25 Cb 0.22 -1.58 -0.07 0.00 1.43 0.00 0.00 31.44 31.45 2qff n GLU 25 CO 0.00 0.00 0.00 1.25 -0.16 0.00 0.00 177.13 178.22 2qff h LEU 26 N 2.15 0.07 -0.72 -1.84 5.85 -1.33 -2.15 115.31 117.33 2qff h LEU 26 Ca 0.00 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.57 2qff h LEU 26 Cb 1.11 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.09 2qff h LEU 26 CO 0.12 0.19 0.40 0.78 -0.34 0.00 0.00 178.44 179.58 2qff h ASN 27 N -0.05 0.90 -0.36 1.25 2.35 -1.83 0.89 115.58 118.73 2qff h ASN 27 Ca 0.02 -0.09 -0.13 0.00 -0.55 0.00 0.00 56.30 55.54 2qff h ASN 27 Cb 0.14 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 2qff h ASN 27 CO -0.00 0.74 -0.27 1.62 -1.65 0.00 0.00 177.43 177.86 2qff h VAL 28 N 1.00 1.27 -0.32 2.81 3.04 -1.87 -1.66 116.25 120.52 2qff h VAL 28 Ca 0.26 -1.42 -0.14 0.00 -1.01 0.00 0.00 66.70 64.39 2qff h VAL 28 Cb 0.03 1.24 -0.01 0.00 -2.01 0.00 0.00 31.29 30.54 2qff h VAL 28 CO -0.04 0.48 -0.36 0.78 -1.01 0.00 0.00 177.57 177.41 2qff h ASN 29 N 0.74 0.77 -0.67 3.17 2.35 -1.13 -1.69 115.58 119.12 2qff h ASN 29 Ca 0.09 -0.34 -0.05 0.00 -0.55 0.00 0.00 56.30 55.45 2qff h ASN 29 Cb 0.82 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.95 2qff h ASN 29 CO 0.07 1.06 0.23 -0.08 -1.65 0.00 0.00 177.43 177.06 2qff h GLU 30 N 0.61 1.03 -0.60 0.81 4.81 -0.66 -2.41 114.58 118.18 2qff h GLU 30 Ca 0.06 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 59.03 2qff h GLU 30 Cb 0.90 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.10 2qff h GLU 30 CO 0.08 0.89 0.21 -0.07 -0.73 0.00 0.00 179.01 179.39 2qff h LEU 31 N 0.97 0.82 -1.68 1.64 3.38 -1.22 -2.74 115.31 116.48 2qff h LEU 31 Ca 0.22 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2qff h LEU 31 Cb 0.27 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2qff h LEU 31 CO -0.01 0.76 -0.14 0.00 0.09 0.00 0.00 178.44 179.13 2qff h ALA 32 N 1.36 1.74 0.00 1.53 0.00 -0.83 -2.54 119.26 120.51 2qff h ALA 32 Ca 0.20 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2qff h ALA 32 Cb 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2qff h ALA 32 CO -0.01 0.20 0.00 0.25 0.00 0.00 0.00 179.25 179.69 2qff n THR 33 N -4.36 1.08 0.28 0.00 -2.24 -0.99 -2.89 114.28 105.17 2qff n THR 33 Ca -0.02 0.28 0.15 0.00 -2.27 0.00 0.00 64.05 62.19 2qff n THR 33 Cb 0.22 -1.07 0.88 0.00 -2.10 0.00 0.00 70.33 68.26 2qff n THR 33 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2qff h GLY 34 N 2.21 0.00 -1.09 3.38 0.00 -1.57 -0.89 103.07 105.10 2qff h GLY 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2qff h GLY 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 2qff n SER 35 N -3.88 2.12 -4.81 0.19 3.41 -1.14 -4.97 113.62 104.55 2qff n SER 35 Ca -0.02 -1.71 -0.26 0.00 -0.26 0.00 0.00 58.87 56.62 2qff n SER 35 Cb 0.13 -0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.01 2qff n SER 35 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qff s LEU 36 N -1.92 2.90 0.28 1.04 1.43 -0.34 -5.09 118.68 116.97 2qff s LEU 36 Ca 0.34 -1.18 -0.28 0.00 -1.03 0.00 0.00 54.13 51.98 2qff s LEU 36 Cb 0.20 -1.32 -0.14 0.00 0.03 0.00 0.00 46.19 44.96 2qff s LEU 36 CO 0.32 -0.78 1.01 -3.20 0.23 0.00 0.00 176.35 173.92 2qff n ASN 37 N -1.45 1.23 0.16 2.29 2.85 -1.26 -4.84 115.26 114.24 2qff n ASN 37 Ca -0.03 1.17 0.11 0.00 -0.11 0.00 0.00 54.58 55.72 2qff n ASN 37 Cb 0.65 -1.27 0.59 0.00 1.24 0.00 0.00 39.78 40.98 2qff n ASN 37 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2qff n THR 38 N 0.33 1.01 -0.25 -0.44 -2.24 -1.26 -1.57 114.28 109.85 2qff n THR 38 Ca 0.10 0.70 0.06 0.00 -2.27 0.00 0.00 64.05 62.63 2qff n THR 38 Cb 0.31 -1.69 0.18 0.00 -2.10 0.00 0.00 70.33 67.03 2qff n THR 38 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2qff h TYR 39 N 0.00 0.33 -0.43 4.78 3.20 -1.96 -2.18 116.97 120.70 2qff h TYR 39 Ca 0.00 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 2qff h TYR 39 Cb 0.03 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2qff h TYR 39 CO 0.00 -0.05 -0.16 1.88 -1.64 0.00 0.00 178.16 178.19 2qff h TYR 40 N 0.31 1.00 -0.10 -3.82 0.05 -1.64 -0.62 116.97 112.14 2qff h TYR 40 Ca 0.42 -0.23 0.00 0.00 0.05 0.00 0.00 58.73 58.97 2qff h TYR 40 Cb 0.70 -0.24 -0.01 0.00 1.01 0.00 0.00 36.73 38.19 2qff h TYR 40 CO -0.24 1.00 0.05 -0.22 -1.05 0.00 0.00 178.16 177.70 2qff h LYS 41 N 0.70 0.10 -0.51 4.88 1.63 -1.66 -0.04 116.57 121.67 2qff h LYS 41 Ca 0.10 -0.01 -0.04 0.00 -0.85 0.00 0.00 60.65 59.86 2qff h LYS 41 Cb 0.71 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.30 2qff h LYS 41 CO 0.05 0.07 0.18 -0.09 -3.45 0.00 0.00 179.45 176.21 2qff h ARG 42 N 0.11 0.78 -0.38 1.90 2.43 -1.29 -2.66 114.38 115.27 2qff h ARG 42 Ca 0.04 -0.16 -0.14 0.00 -0.81 0.00 0.00 59.98 58.91 2qff h ARG 42 Cb 0.00 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 2qff h ARG 42 CO -0.03 0.71 -0.33 1.15 -1.51 0.00 0.00 179.97 179.97 2qff h THR 43 N 0.69 1.28 -0.26 0.20 2.02 -0.96 -2.64 112.91 113.25 2qff h THR 43 Ca 0.17 -1.50 -0.09 0.00 0.77 0.00 0.00 66.41 65.76 2qff h THR 43 Cb 0.24 1.39 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 2qff h THR 43 CO -0.01 0.50 -0.24 -0.29 0.37 0.00 0.00 175.52 175.85 2qff h ILE 44 N 0.69 1.26 -0.31 3.11 2.10 -0.98 -0.88 117.51 122.51 2qff h ILE 44 Ca 0.07 -1.25 -0.01 0.00 1.08 0.00 0.00 64.86 64.75 2qff h ILE 44 Cb 0.92 1.32 -0.01 0.00 -1.09 0.00 0.00 36.82 37.96 2qff h ILE 44 CO 0.08 0.40 0.15 0.11 -1.08 0.00 0.00 178.15 177.82 2qff h LYS 45 N 0.44 0.44 0.04 2.19 1.57 -1.37 0.38 116.57 120.26 2qff h LYS 45 Ca 0.07 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qff h LYS 45 Cb 0.66 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.89 2qff h LYS 45 CO 0.05 0.40 -0.02 0.82 -0.57 0.00 0.00 179.45 180.13 2qff h ILE 46 N 0.36 1.03 -0.52 1.86 2.04 -1.26 -0.46 117.51 120.56 2qff h ILE 46 Ca 0.11 -0.24 -0.10 0.00 1.00 0.00 0.00 64.86 65.63 2qff h ILE 46 Cb 0.10 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 2qff h ILE 46 CO -0.01 0.06 -0.07 0.28 0.00 0.00 0.00 178.15 178.41 2qff h SER 47 N -0.16 0.93 -0.47 1.72 0.02 -1.11 -2.04 113.55 112.44 2qff h SER 47 Ca -0.01 -0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 60.65 2qff h SER 47 Cb 0.14 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 2qff h SER 47 CO 0.01 1.02 0.21 1.23 -1.14 0.00 0.00 176.83 178.17 2qff h GLY 48 N 0.97 0.73 0.95 -3.77 0.00 -0.13 -0.91 103.07 100.91 2qff h GLY 48 Ca 0.14 -0.37 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 2qff h GLY 48 CO 0.04 0.35 0.17 1.46 0.00 0.00 0.00 176.54 178.56 2qff h GLN 49 N 0.61 0.51 -0.76 4.80 4.20 -0.94 -2.97 115.11 120.56 2qff h GLN 49 Ca 0.16 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 2qff h GLN 49 Cb 0.14 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 2qff h GLN 49 CO -0.02 0.46 0.31 0.87 -0.67 0.00 0.00 178.83 179.78 2qff h LYS 50 N 0.44 1.14 -1.23 1.46 1.57 -1.27 -1.96 116.57 116.71 2qff h LYS 50 Ca 0.12 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2qff h LYS 50 Cb 0.12 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2qff h LYS 50 CO -0.02 0.92 0.00 0.00 -0.57 0.00 0.00 179.45 179.78 2qff n ALA 51 N -2.44 1.66 0.00 3.86 0.00 -0.36 -1.40 120.51 121.83 2qff n ALA 51 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2qff n ALA 51 Cb 0.18 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2qff n ALA 51 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2qff n TYR 53 N 0.69 0.00 -0.15 0.00 9.36 -0.74 -1.50 117.16 124.82 2qff n TYR 53 Ca 0.00 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 61.16 2qff n TYR 53 Cb 0.12 0.00 0.03 0.00 -0.63 0.00 0.00 39.34 38.85 2qff n TYR 53 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2qff h ALA 54 N 0.00 0.60 -0.62 2.98 0.00 -1.50 -0.08 119.26 120.64 2qff h ALA 54 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2qff h ALA 54 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2qff h ALA 54 CO 0.00 -0.03 0.23 1.25 0.00 0.00 0.00 179.25 180.69 2qff h LEU 55 N 0.56 0.84 -0.01 0.00 5.85 -1.54 -1.51 115.31 119.49 2qff h LEU 55 Ca 0.19 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2qff h LEU 55 Cb 0.02 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.84 2qff h LEU 55 CO -0.09 0.76 0.00 0.07 -0.34 0.00 0.00 178.44 178.84 2qff h LYS 56 N 0.89 0.00 -0.02 1.25 2.10 -1.76 -3.08 116.57 115.94 2qff h LYS 56 Ca 0.21 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.70 2qff h LYS 56 Cb 0.20 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.52 2qff h LYS 56 CO -0.02 0.00 -0.69 0.66 -2.00 0.00 0.00 179.45 177.41 2qff h SER 57 N 0.00 0.12 -0.54 7.07 4.64 -0.30 -3.47 113.55 121.08 2qff h SER 57 Ca 0.00 -0.08 -0.23 0.00 -0.47 0.00 0.00 61.79 61.01 2qff h SER 57 Cb 0.99 -0.04 -0.09 0.00 -0.31 0.00 0.00 62.40 62.95 2qff h SER 57 CO 0.00 0.77 -0.21 0.29 -0.87 0.00 0.00 176.83 176.81 2qff n LYS 58 N -3.76 -1.66 -2.85 4.77 4.76 -0.64 -4.97 118.16 113.81 2qff n LYS 58 Ca -0.02 0.89 -0.41 0.00 -2.87 0.00 0.00 58.31 55.90 2qff n LYS 58 Cb 0.67 -5.30 -0.04 0.00 -1.84 0.00 0.00 35.03 28.53 2qff n LYS 58 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2qff s ASP 59 N -2.43 7.10 0.16 4.39 2.15 -1.26 -4.98 116.67 121.80 2qff s ASP 59 Ca 0.00 1.34 -0.18 0.00 0.43 0.00 0.00 52.55 54.14 2qff s ASP 59 Cb 0.00 -2.49 0.06 0.00 -0.30 0.00 0.00 42.92 40.19 2qff s ASP 59 CO 0.00 -0.32 1.68 0.15 -0.17 0.00 0.00 175.17 176.51 2qff h PHE 60 N 7.05 -0.18 -0.53 -5.34 3.57 -1.94 -2.80 116.94 116.78 2qff h PHE 60 Ca -0.35 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.15 2qff h PHE 60 Cb 1.17 0.13 -0.02 0.00 2.79 0.00 0.00 35.95 40.02 2qff h PHE 60 CO 0.69 -0.15 0.20 0.87 -2.23 0.00 0.00 178.31 177.70 2qff h LYS 61 N 0.00 0.80 -0.69 1.11 1.57 -2.00 0.25 116.57 117.60 2qff h LYS 61 Ca 0.17 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2qff h LYS 61 Cb 0.25 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2qff h LYS 61 CO -0.35 0.70 0.00 1.63 -0.57 0.00 0.00 179.45 180.86 2qff n LYS 62 N -4.52 0.26 0.00 3.15 5.02 -1.06 -1.91 118.16 119.11 2qff n LYS 62 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2qff n LYS 62 Cb 0.17 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 2qff n LYS 62 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2qff n SER 64 N 0.52 0.00 -0.35 4.39 2.88 0.88 -1.34 113.62 120.60 2qff n SER 64 Ca 0.00 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.51 2qff n SER 64 Cb 0.08 0.00 0.09 0.00 -0.75 0.00 0.00 64.21 63.64 2qff n SER 64 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2qff h GLU 65 N 0.00 1.25 -0.51 -1.46 4.57 -1.63 -1.64 114.58 115.16 2qff h GLU 65 Ca 0.00 -0.10 -0.10 0.00 -1.18 0.00 0.00 59.36 57.98 2qff h GLU 65 Cb 0.00 -0.27 -0.02 0.00 -0.16 0.00 0.00 28.75 28.30 2qff h GLU 65 CO 0.00 0.86 -0.08 0.00 -1.18 0.00 0.00 179.01 178.61 2qff h ALA 66 N 1.32 0.90 -0.26 2.92 0.00 -1.47 -1.08 119.26 121.59 2qff h ALA 66 Ca 0.34 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2qff h ALA 66 Cb -0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2qff h ALA 66 CO -0.07 0.64 0.14 -0.22 0.00 0.00 0.00 179.25 179.74 2qff h LYS 67 N 0.83 0.36 -0.08 0.00 3.64 -1.74 -0.29 116.57 119.30 2qff h LYS 67 Ca 0.14 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2qff h LYS 67 Cb 0.60 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 2qff h LYS 67 CO 0.04 0.33 -0.05 -0.92 -2.27 0.00 0.00 179.45 176.58 2qff h TYR 68 N 0.30 -0.11 -0.44 1.91 3.20 -1.15 0.24 116.97 120.93 2qff h TYR 68 Ca 0.09 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.85 2qff h TYR 68 Cb 0.07 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 2qff h TYR 68 CO -0.03 -0.08 -0.19 1.96 -1.64 0.00 0.00 178.16 178.18 2qff h GLN 69 N -0.05 0.87 -0.22 1.82 1.08 -1.08 -1.40 115.11 116.14 2qff h GLN 69 Ca 0.05 -0.34 -0.18 0.00 -1.45 0.00 0.00 58.65 56.73 2qff h GLN 69 Cb 0.12 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 2qff h GLN 69 CO -0.11 0.98 -0.56 1.25 -0.95 0.00 0.00 178.83 179.44 2qff h LEU 70 N 0.76 0.87 -1.03 1.46 5.85 -0.91 -2.70 115.31 119.61 2qff h LEU 70 Ca 0.11 -0.57 -0.01 0.00 0.84 0.00 0.00 57.88 58.25 2qff h LEU 70 Cb 0.72 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 2qff h LEU 70 CO 0.06 1.28 0.52 -0.61 -0.34 0.00 0.00 178.44 179.35 2qff h GLN 71 N 0.49 1.19 0.16 1.25 5.75 -0.87 -1.35 115.11 121.74 2qff h GLN 71 Ca -0.01 -0.11 0.01 0.00 -0.15 0.00 0.00 58.65 58.40 2qff h GLN 71 Cb 1.18 -0.25 -0.03 0.00 1.07 0.00 0.00 27.48 29.45 2qff h GLN 71 CO 0.12 0.84 -0.29 -0.22 -2.65 0.00 0.00 178.83 176.63 2qff h LYS 72 N 1.21 -0.51 -0.31 1.69 3.64 -1.12 0.52 116.57 121.68 2qff h LYS 72 Ca 0.31 0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.63 2qff h LYS 72 Cb -0.04 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 2qff h LYS 72 CO -0.06 -0.34 -0.22 0.97 -2.27 0.00 0.00 179.45 177.53 2qff h ILE 73 N -0.53 1.26 -0.52 2.00 6.09 -1.37 -1.27 117.51 123.17 2qff h ILE 73 Ca 0.02 -1.26 0.02 0.00 -1.37 0.00 0.00 64.86 62.27 2qff h ILE 73 Cb 0.54 1.27 -0.03 0.00 0.47 0.00 0.00 36.82 39.07 2qff h ILE 73 CO -0.14 0.41 0.32 1.88 -3.07 0.00 0.00 178.15 177.55 2qff h TYR 74 N 0.52 0.61 -0.60 2.19 -1.99 -1.01 0.67 116.97 117.37 2qff h TYR 74 Ca 0.08 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.82 2qff h TYR 74 Cb 0.66 -0.20 -0.03 0.00 2.00 0.00 0.00 36.73 39.17 2qff h TYR 74 CO 0.03 0.36 0.34 -0.91 -0.00 0.00 0.00 178.16 177.98 2qff h ASN 75 N 0.65 0.73 -0.62 3.88 2.35 -0.55 -0.98 115.58 121.04 2qff h ASN 75 Ca 0.20 -0.08 -0.07 0.00 -0.55 0.00 0.00 56.30 55.81 2qff h ASN 75 Cb -0.02 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.14 2qff h ASN 75 CO -0.07 0.59 0.13 -0.33 -1.65 0.00 0.00 177.43 176.11 2qff h GLU 76 N 0.81 1.01 -0.26 0.81 5.08 -0.90 -1.69 114.58 119.42 2qff h GLU 76 Ca 0.21 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2qff h GLU 76 Cb 0.01 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.12 2qff h GLU 76 CO -0.04 0.93 0.14 0.82 -1.00 0.00 0.00 179.01 179.86 2qff h ILE 77 N 0.92 1.12 -0.74 3.13 2.04 -0.71 -1.14 117.51 122.13 2qff h ILE 77 Ca 0.19 -0.33 0.03 0.00 1.00 0.00 0.00 64.86 65.75 2qff h ILE 77 Cb 0.38 0.86 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 2qff h ILE 77 CO 0.01 0.12 0.47 0.44 0.00 0.00 0.00 178.15 179.19 2qff h ASP 78 N 0.31 0.77 -0.54 1.72 3.32 -0.93 -0.39 116.42 120.67 2qff h ASP 78 Ca 0.09 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 2qff h ASP 78 Cb 0.07 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 2qff h ASP 78 CO -0.01 0.53 0.15 -0.33 -1.72 0.00 0.00 179.24 177.86 2qff h GLU 79 N 0.91 0.86 0.00 3.56 4.39 -1.20 -3.02 114.58 120.08 2qff h GLU 79 Ca 0.30 -0.19 -0.06 0.00 0.34 0.00 0.00 59.36 59.75 2qff h GLU 79 Cb 0.02 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 2qff h GLU 79 CO -0.11 0.79 -0.28 0.00 -1.16 0.00 0.00 179.01 178.25 2qff h ALA 80 N 1.02 1.52 0.00 3.43 0.00 -0.45 -2.84 119.26 121.95 2qff h ALA 80 Ca 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2qff h ALA 80 Cb 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2qff h ALA 80 CO -0.00 0.35 0.00 -0.07 0.00 0.00 0.00 179.25 179.53 2qff h LEU 81 N 0.00 0.00 0.00 0.00 3.38 -0.97 -3.50 115.31 114.22 2qff h LEU 81 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qff h LEU 81 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2qff h LEU 81 CO 0.04 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.86