#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d5s h ASP 12 N 0.00 0.00 0.64 1.09 3.32 -2.05 -2.41 116.42 117.01 3d5s h ASP 12 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3d5s h ASP 12 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 3d5s h ASP 12 CO 0.00 0.01 -0.08 0.00 -1.72 0.00 0.00 179.24 177.45 3d5s h ALA 13 N 1.99 1.09 0.07 3.45 0.00 -2.05 -0.07 119.26 123.74 3d5s h ALA 13 Ca -0.00 -0.07 -0.26 0.00 0.00 0.00 0.00 54.91 54.58 3d5s h ALA 13 Cb 0.80 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3d5s h ALA 13 CO 0.00 0.10 -1.24 1.15 0.00 0.00 0.00 179.25 179.26 3d5s h THR 14 N 0.00 1.46 -0.09 0.00 2.02 -1.87 -2.94 112.91 111.50 3d5s h THR 14 Ca -0.00 -3.12 -0.18 0.00 0.77 0.00 0.00 66.41 63.87 3d5s h THR 14 Cb 0.42 2.83 -0.00 0.00 -1.74 0.00 0.00 68.15 69.66 3d5s h THR 14 CO 0.01 0.88 -0.72 0.40 0.37 0.00 0.00 175.52 176.46 3d5s h ILE 15 N 0.04 1.37 0.23 3.11 1.08 -1.39 -0.85 117.51 121.10 3d5s h ILE 15 Ca -0.12 -2.10 -0.01 0.00 -0.39 0.00 0.00 64.86 62.24 3d5s h ILE 15 Cb 1.91 2.07 0.00 0.00 -3.07 0.00 0.00 36.82 37.73 3d5s h ILE 15 CO 0.16 0.63 -0.11 0.11 -0.69 0.00 0.00 178.15 178.25 3d5s h LYS 16 N 0.31 -0.30 -0.92 2.37 1.57 -1.11 0.51 116.57 119.00 3d5s h LYS 16 Ca -0.03 0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 3d5s h LYS 16 Cb 1.29 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.62 3d5s h LYS 16 CO 0.13 -0.03 0.61 0.87 -0.57 0.00 0.00 179.45 180.46 3d5s h LYS 17 N -0.55 1.14 -0.49 3.15 1.57 -1.52 0.23 116.57 120.09 3d5s h LYS 17 Ca -0.03 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.59 3d5s h LYS 17 Cb 0.41 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 3d5s h LYS 17 CO 0.05 0.75 -0.07 0.93 -0.57 0.00 0.00 179.45 180.55 3d5s h GLU 18 N 1.17 0.87 -0.41 3.15 5.08 -0.95 -2.46 114.58 121.04 3d5s h GLU 18 Ca 0.36 -0.28 -0.13 0.00 -1.00 0.00 0.00 59.36 58.31 3d5s h GLU 18 Cb -0.01 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3d5s h GLU 18 CO -0.10 0.91 -0.26 1.96 -1.00 0.00 0.00 179.01 180.52 3d5s h GLN 19 N 0.79 0.85 -0.50 2.33 1.08 0.09 -2.08 115.11 117.67 3d5s h GLN 19 Ca 0.14 -0.37 0.01 0.00 -1.45 0.00 0.00 58.65 56.98 3d5s h GLN 19 Cb 0.57 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.95 3d5s h GLN 19 CO 0.03 1.01 0.32 0.87 -0.95 0.00 0.00 178.83 180.12 3d5s h LYS 20 N 0.73 0.64 -0.70 1.46 1.79 -0.84 0.12 116.57 119.77 3d5s h LYS 20 Ca 0.09 -0.04 0.03 0.00 -2.18 0.00 0.00 60.65 58.55 3d5s h LYS 20 Cb 0.80 -0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 31.26 3d5s h LYS 20 CO 0.07 0.42 0.43 1.25 -1.08 0.00 0.00 179.45 180.54 3d5s h LEU 21 N 0.66 0.71 -0.08 2.94 7.12 -1.24 0.12 115.31 125.54 3d5s h LEU 21 Ca 0.19 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 58.18 3d5s h LEU 21 Cb -0.05 -0.15 -0.00 0.00 -0.53 0.00 0.00 40.66 39.93 3d5s h LEU 21 CO -0.05 0.49 -0.02 0.40 -0.13 0.00 0.00 178.44 179.13 3d5s h ILE 22 N 0.85 1.29 -0.52 4.05 2.04 -0.80 -0.65 117.51 123.77 3d5s h ILE 22 Ca 0.28 -0.93 0.10 0.00 1.00 0.00 0.00 64.86 65.31 3d5s h ILE 22 Cb 0.03 1.76 -0.08 0.00 -0.74 0.00 0.00 36.82 37.79 3d5s h ILE 22 CO -0.11 0.26 0.04 1.56 0.00 0.00 0.00 178.15 179.89 3d5s h GLN 23 N -0.19 0.15 0.26 2.37 1.08 -0.46 0.21 115.11 118.54 3d5s h GLN 23 Ca 0.02 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3d5s h GLN 23 Cb 0.42 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 3d5s h GLN 23 CO 0.01 0.10 -0.12 0.00 -0.95 0.00 0.00 178.83 177.86 3d5s h ALA 24 N 1.44 -0.35 -0.74 3.87 0.00 -0.62 -0.66 119.26 122.21 3d5s h ALA 24 Ca 0.26 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.20 3d5s h ALA 24 Cb 0.39 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 18.23 3d5s h ALA 24 CO -0.40 -0.68 0.35 1.96 0.00 0.00 0.00 179.25 180.48 3d5s h GLN 25 N -0.38 0.54 -0.03 0.00 4.20 -0.43 0.22 115.11 119.22 3d5s h GLN 25 Ca -0.04 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.64 3d5s h GLN 25 Cb 0.29 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 3d5s h GLN 25 CO 0.06 0.36 0.00 -0.91 -0.67 0.00 0.00 178.83 177.67 3d5s h ASN 26 N 0.55 0.06 0.03 1.46 4.21 -0.36 -1.72 115.58 119.81 3d5s h ASN 26 Ca 0.38 -0.29 -0.09 0.00 1.21 0.00 0.00 56.30 57.52 3d5s h ASN 26 Cb 0.48 -0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 37.65 3d5s h ASN 26 CO -0.32 0.33 -0.26 -0.07 -1.29 0.00 0.00 177.43 175.82 3d5s h LEU 27 N -0.22 0.38 -0.31 1.61 3.38 -0.73 -0.22 115.31 119.19 3d5s h LEU 27 Ca 0.01 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 3d5s h LEU 27 Cb 0.30 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3d5s h LEU 27 CO 0.00 0.64 -0.04 0.58 0.09 0.00 0.00 178.44 179.70 3d5s h VAL 28 N 0.34 1.27 -0.70 1.22 2.07 -0.53 0.11 116.25 120.02 3d5s h VAL 28 Ca 0.05 -1.05 -0.02 0.00 0.82 0.00 0.00 66.70 66.50 3d5s h VAL 28 Cb 0.64 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 3d5s h VAL 28 CO 0.05 0.34 0.37 -0.09 0.02 0.00 0.00 177.57 178.25 3d5s h ARG 29 N 0.36 0.98 -0.56 1.57 2.43 -0.96 -1.87 114.38 116.33 3d5s h ARG 29 Ca 0.08 -0.12 -0.10 0.00 -0.81 0.00 0.00 59.98 59.03 3d5s h ARG 29 Cb 0.51 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 3d5s h ARG 29 CO 0.02 0.74 -0.06 1.49 -1.51 0.00 0.00 179.97 180.65 3d5s h GLU 30 N 0.99 1.02 -0.65 0.20 4.22 -0.64 -2.76 114.58 116.95 3d5s h GLU 30 Ca 0.25 -0.35 -0.00 0.00 0.08 0.00 0.00 59.36 59.34 3d5s h GLU 30 Cb 0.06 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 3d5s h GLU 30 CO -0.04 1.03 0.41 0.35 -2.18 0.00 0.00 179.01 178.58 3d5s h PHE 31 N 0.92 0.85 0.00 0.92 3.57 -0.15 0.54 116.94 123.59 3d5s h PHE 31 Ca 0.15 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.66 3d5s h PHE 31 Cb 0.61 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 39.07 3d5s h PHE 31 CO 0.04 0.56 0.00 0.93 -2.23 0.00 0.00 178.31 177.61 3d5s h GLU 32 N 0.89 0.00 0.09 1.11 5.08 -1.10 -0.32 114.58 120.33 3d5s h GLU 32 Ca 0.24 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 58.23 3d5s h GLU 32 Cb -0.05 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 3d5s h GLU 32 CO -0.05 0.00 -2.06 1.63 -1.00 0.00 0.00 179.01 177.53 3d5s n LYS 33 N -2.76 0.73 -0.03 2.33 5.02 0.08 -4.70 118.16 118.83 3d5s n LYS 33 Ca -0.02 0.24 0.02 0.00 -2.02 0.00 0.00 58.31 56.53 3d5s n LYS 33 Cb 0.08 -1.68 -0.11 0.00 -0.02 0.00 0.00 35.03 33.31 3d5s n LYS 33 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3d5s n THR 34 N -3.38 0.36 -3.02 -0.18 -2.24 -0.60 -5.02 114.28 100.20 3d5s n THR 34 Ca -0.33 -0.41 -0.21 0.00 -2.27 0.00 0.00 64.05 60.83 3d5s n THR 34 Cb 1.04 -0.16 0.01 0.00 -2.10 0.00 0.00 70.33 69.12 3d5s n THR 34 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3d5s n HIS 35 N -2.18 -1.74 -3.31 4.78 8.25 -0.16 -4.78 115.22 116.08 3d5s n HIS 35 Ca -0.10 0.38 -0.22 0.00 -0.26 0.00 0.00 57.72 57.52 3d5s n HIS 35 Cb 0.59 -3.54 -0.00 0.00 1.12 0.00 0.00 29.99 28.16 3d5s n HIS 35 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3d5s s THR 36 N -2.97 4.48 0.18 1.59 -4.23 -1.26 -1.82 115.64 111.61 3d5s s THR 36 Ca 0.27 -0.64 -0.09 0.00 -1.18 0.00 0.00 61.69 60.05 3d5s s THR 36 Cb -0.13 -3.62 0.08 0.00 1.34 0.00 0.00 72.50 70.17 3d5s s THR 36 CO 0.33 -0.37 1.67 0.58 -0.54 0.00 0.00 174.62 176.30 3d5s h VAL 37 N 0.69 1.26 -0.04 2.29 2.07 -1.80 -1.15 116.25 119.57 3d5s h VAL 37 Ca -0.48 -1.06 0.01 0.00 0.82 0.00 0.00 66.70 66.00 3d5s h VAL 37 Cb 1.24 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.70 3d5s h VAL 37 CO 0.58 0.39 -0.04 -1.28 0.02 0.00 0.00 177.57 177.24 3d5s h SER 38 N 0.99 -0.12 -0.03 0.57 0.87 -1.94 -1.14 113.55 112.74 3d5s h SER 38 Ca 0.19 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.73 3d5s h SER 38 Cb 0.47 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.48 3d5s h SER 38 CO 0.02 -0.06 -0.11 0.00 -0.53 0.00 0.00 176.83 176.15 3d5s h ALA 39 N 0.99 1.47 -0.14 6.23 0.00 -1.92 -2.43 119.26 123.46 3d5s h ALA 39 Ca 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 3d5s h ALA 39 Cb 0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3d5s h ALA 39 CO -0.08 0.38 0.05 1.25 0.00 0.00 0.00 179.25 180.85 3d5s h HIS 40 N 0.28 0.22 0.14 0.00 2.76 -0.60 -1.89 115.15 116.06 3d5s h HIS 40 Ca 0.06 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 3d5s h HIS 40 Cb 0.38 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.26 3d5s h HIS 40 CO 0.01 0.31 -0.14 0.00 -1.30 0.00 0.00 177.93 176.80 3d5s h ALA 41 N 0.89 -0.28 -0.66 5.26 0.00 -0.89 0.24 119.26 123.82 3d5s h ALA 41 Ca 0.05 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.97 3d5s h ALA 41 Cb 0.18 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 3d5s h ALA 41 CO -0.00 -0.68 0.37 0.87 0.00 0.00 0.00 179.25 179.82 3d5s h LYS 42 N -0.31 0.68 0.24 0.00 1.57 -1.44 -0.62 116.57 116.70 3d5s h LYS 42 Ca 0.00 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 3d5s h LYS 42 Cb 0.30 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3d5s h LYS 42 CO -0.04 0.45 -0.12 0.00 -0.57 0.00 0.00 179.45 179.18 3d5s h ALA 43 N 1.33 -0.33 -0.45 3.86 0.00 -1.11 -1.62 119.26 120.94 3d5s h ALA 43 Ca 0.29 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 55.11 3d5s h ALA 43 Cb 0.14 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 3d5s h ALA 43 CO -0.16 -0.57 0.14 0.37 0.00 0.00 0.00 179.25 179.02 3d5s h GLN 44 N -0.55 0.29 -0.33 0.00 5.75 -0.73 0.86 115.11 120.40 3d5s h GLN 44 Ca -0.03 -0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.44 3d5s h GLN 44 Cb 0.41 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.88 3d5s h GLN 44 CO 0.06 0.19 0.16 -0.22 -2.65 0.00 0.00 178.83 176.36 3d5s h LYS 45 N 0.30 0.47 -0.55 1.69 3.64 -1.12 -1.02 116.57 119.97 3d5s h LYS 45 Ca 0.22 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.57 3d5s h LYS 45 Cb 0.24 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.93 3d5s h LYS 45 CO -0.24 0.44 0.31 0.00 -2.27 0.00 0.00 179.45 177.68 3d5s h ALA 46 N 1.01 0.72 -0.49 5.00 0.00 -0.64 -2.09 119.26 122.76 3d5s h ALA 46 Ca 0.11 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3d5s h ALA 46 Cb 0.12 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3d5s h ALA 46 CO -0.01 -0.01 0.17 0.28 0.00 0.00 0.00 179.25 179.67 3d5s h VAL 47 N 0.59 1.22 0.00 0.00 2.07 -0.58 -1.55 116.25 118.00 3d5s h VAL 47 Ca 0.24 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 67.03 3d5s h VAL 47 Cb 0.11 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 3d5s h VAL 47 CO -0.14 0.27 0.00 0.78 0.02 0.00 0.00 177.57 178.50 3d5s h ASN 48 N 0.65 0.00 0.88 0.57 2.35 -0.70 -1.54 115.58 117.80 3d5s h ASN 48 Ca 0.16 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 3d5s h ASN 48 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.62 3d5s h ASN 48 CO -0.01 0.00 -0.57 0.18 -1.65 0.00 0.00 177.43 175.38 3d5s n LEU 49 N -2.86 0.68 -4.73 1.61 4.77 -0.60 -4.89 117.00 110.99 3d5s n LEU 49 Ca -0.02 0.24 -0.42 0.00 -0.03 0.00 0.00 56.01 55.78 3d5s n LEU 49 Cb 0.08 -0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 40.94 3d5s n LEU 49 CO 0.18 -0.05 1.09 -0.69 -1.33 0.00 0.00 177.39 176.59 3d5s s VAL 50 N -3.15 2.99 0.69 4.08 1.01 -0.58 -4.97 120.40 120.47 3d5s s VAL 50 Ca 0.07 0.76 -0.17 0.00 0.00 0.00 0.00 61.98 62.64 3d5s s VAL 50 Cb 0.14 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 33.03 3d5s s VAL 50 CO 0.71 0.09 1.16 -0.24 0.00 0.00 0.00 175.10 176.81 3d5s n SER 51 N 3.27 1.35 0.00 3.32 2.88 -1.26 -4.85 113.62 118.32 3d5s n SER 51 Ca 0.10 0.75 0.05 0.00 -1.33 0.00 0.00 58.87 58.44 3d5s n SER 51 Cb 0.41 -1.49 0.27 0.00 -0.75 0.00 0.00 64.21 62.65 3d5s n SER 51 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 3d5s n PHE 52 N -2.26 0.00 -0.19 0.66 3.01 -1.26 -1.58 117.46 115.84 3d5s n PHE 52 Ca 0.15 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.58 3d5s n PHE 52 Cb 0.49 -0.29 0.17 0.00 -0.01 0.00 0.00 39.48 39.83 3d5s n PHE 52 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 3d5s h GLU 53 N 0.00 0.97 -0.93 -1.08 5.08 -2.02 -1.87 114.58 114.73 3d5s h GLU 53 Ca 0.00 -0.16 -0.53 0.00 -1.00 0.00 0.00 59.36 57.67 3d5s h GLU 53 Cb 0.10 -0.16 -0.29 0.00 0.50 0.00 0.00 28.75 28.90 3d5s h GLU 53 CO 0.00 0.79 0.61 0.66 -1.00 0.00 0.00 179.01 180.07 3d5s n TYR 54 N -4.30 2.92 -0.27 4.33 4.01 -0.62 -4.75 117.16 118.48 3d5s n TYR 54 Ca 0.06 -2.11 0.24 0.00 -0.16 0.00 0.00 57.90 55.92 3d5s n TYR 54 Cb 0.18 -1.01 0.45 0.00 -0.31 0.00 0.00 39.34 38.64 3d5s n TYR 54 CO 0.00 0.00 0.00 0.36 -0.46 0.00 0.00 176.86 176.76 3d5s n LYS 55 N -1.09 -0.05 0.10 -0.72 2.85 -0.71 -1.15 118.16 117.40 3d5s n LYS 55 Ca 0.58 1.17 -0.12 0.00 -1.05 0.00 0.00 58.31 58.88 3d5s n LYS 55 Cb 1.37 -2.05 -0.08 0.00 -0.65 0.00 0.00 35.03 33.62 3d5s n LYS 55 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 3d5s h VAL 56 N 0.00 0.82 0.00 0.58 2.07 -1.87 -2.25 116.25 115.61 3d5s h VAL 56 Ca 0.67 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3d5s h VAL 56 Cb 1.72 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.75 3d5s h VAL 56 CO -0.67 0.17 0.00 0.50 0.02 0.00 0.00 177.57 177.59 3d5s h LYS 57 N -0.75 0.00 -0.28 1.57 1.63 -1.61 -1.96 116.57 115.17 3d5s h LYS 57 Ca -0.03 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.67 3d5s h LYS 57 Cb 0.50 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.13 3d5s h LYS 57 CO 0.05 0.00 -0.22 -0.22 -3.45 0.00 0.00 179.45 175.61 3d5s h LYS 58 N 0.00 0.65 -0.37 1.90 3.64 -1.12 -0.07 116.57 121.20 3d5s h LYS 58 Ca 0.00 -0.32 -0.01 0.00 -1.27 0.00 0.00 60.65 59.05 3d5s h LYS 58 Cb 0.50 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 3d5s h LYS 58 CO 0.00 0.92 0.19 0.52 -2.27 0.00 0.00 179.45 178.81 3d5s h MET 59 N 0.39 0.52 -0.75 1.90 2.86 -0.81 -0.35 114.93 118.69 3d5s h MET 59 Ca 0.05 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 3d5s h MET 59 Cb 0.77 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.30 3d5s h MET 59 CO 0.06 0.44 0.36 0.28 1.06 0.00 0.00 176.91 179.11 3d5s h VAL 60 N 0.47 1.24 -0.55 -2.22 2.07 -1.24 0.62 116.25 116.65 3d5s h VAL 60 Ca 0.13 -0.67 -0.06 0.00 0.82 0.00 0.00 66.70 66.92 3d5s h VAL 60 Cb 0.08 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 3d5s h VAL 60 CO -0.02 0.28 0.11 -0.07 0.02 0.00 0.00 177.57 177.90 3d5s h LEU 61 N 1.05 0.85 -0.33 2.57 3.38 -0.75 -1.09 115.31 121.00 3d5s h LEU 61 Ca 0.26 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3d5s h LEU 61 Cb 0.12 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3d5s h LEU 61 CO -0.03 0.88 0.03 -0.61 0.09 0.00 0.00 178.44 178.79 3d5s h GLN 62 N 0.78 0.56 -0.54 1.13 5.75 -0.78 -1.89 115.11 120.12 3d5s h GLN 62 Ca 0.17 -0.16 0.04 0.00 -0.15 0.00 0.00 58.65 58.55 3d5s h GLN 62 Cb 0.37 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.83 3d5s h GLN 62 CO 0.01 0.66 0.36 1.49 -2.65 0.00 0.00 178.83 178.70 3d5s h GLU 63 N 0.38 0.57 -0.33 1.69 4.57 -0.68 0.23 114.58 121.00 3d5s h GLU 63 Ca 0.10 -0.03 -0.10 0.00 -1.18 0.00 0.00 59.36 58.14 3d5s h GLU 63 Cb 0.39 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 3d5s h GLU 63 CO 0.01 0.37 -0.22 0.00 -1.18 0.00 0.00 179.01 178.00 3d5s h ARG 64 N 0.58 0.64 0.23 1.92 3.08 -0.64 -2.01 114.38 118.19 3d5s h ARG 64 Ca 0.22 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3d5s h ARG 64 Cb 0.15 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.17 3d5s h ARG 64 CO -0.06 0.81 -0.11 0.82 -1.07 0.00 0.00 179.97 180.36 3d5s h ILE 65 N 0.56 0.84 -0.91 2.04 2.04 -0.26 -2.60 117.51 119.22 3d5s h ILE 65 Ca 0.08 -0.60 0.21 0.00 1.00 0.00 0.00 64.86 65.55 3d5s h ILE 65 Cb 0.68 1.17 -0.07 0.00 -0.74 0.00 0.00 36.82 37.87 3d5s h ILE 65 CO 0.05 0.13 0.60 0.44 0.00 0.00 0.00 178.15 179.37 3d5s h ASP 66 N -0.63 0.41 -0.27 1.72 3.32 -0.95 -1.15 116.42 118.88 3d5s h ASP 66 Ca -0.03 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 56.93 3d5s h ASP 66 Cb 0.45 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 3d5s h ASP 66 CO 0.05 0.16 -0.36 0.78 -1.72 0.00 0.00 179.24 178.15 3d5s h ASN 67 N 0.41 0.78 -0.49 6.45 2.35 -1.18 -1.95 115.58 121.96 3d5s h ASN 67 Ca 0.48 -0.50 -0.04 0.00 -0.55 0.00 0.00 56.30 55.69 3d5s h ASN 67 Cb 1.18 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 39.30 3d5s h ASN 67 CO -0.18 1.13 0.19 0.58 -1.65 0.00 0.00 177.43 177.49 3d5s h VAL 68 N 0.45 1.21 -0.23 2.81 2.07 -0.87 -1.42 116.25 120.27 3d5s h VAL 68 Ca 0.03 -0.68 -0.07 0.00 0.82 0.00 0.00 66.70 66.81 3d5s h VAL 68 Cb 0.95 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 3d5s h VAL 68 CO 0.08 0.26 -0.16 -0.07 0.02 0.00 0.00 177.57 177.71 3d5s h LEU 69 N 0.78 0.38 -0.76 2.57 3.38 -1.08 -2.17 115.31 118.41 3d5s h LEU 69 Ca 0.18 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 3d5s h LEU 69 Cb 0.20 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 3d5s h LEU 69 CO -0.01 0.56 -0.20 0.11 0.09 0.00 0.00 178.44 178.99 3d5s h LYS 70 N 0.36 0.73 -0.36 1.13 1.57 -0.48 -2.82 116.57 116.70 3d5s h LYS 70 Ca 0.07 -0.28 -0.10 0.00 -1.87 0.00 0.00 60.65 58.47 3d5s h LYS 70 Cb 0.49 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 3d5s h LYS 70 CO 0.03 0.87 -0.18 1.96 -0.57 0.00 0.00 179.45 181.57 3d5s h GLN 71 N 0.64 0.67 0.00 3.15 4.20 -0.82 -3.49 115.11 119.46 3d5s h GLN 71 Ca 0.09 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.57 3d5s h GLN 71 Cb 0.69 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.42 3d5s h GLN 71 CO 0.05 0.81 0.00 0.41 -0.67 0.00 0.00 178.83 179.43 3d5s n GLY 72 N -0.39 3.13 3.98 3.46 0.00 -0.87 -5.11 105.19 109.39 3d5s n GLY 72 Ca 0.01 -1.70 -0.20 0.00 0.00 0.00 0.00 46.02 44.13 3d5s n GLY 72 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d5s s LEU 73 N 0.00 4.05 -0.37 0.99 1.43 -1.26 -4.87 118.68 118.65 3d5s s LEU 73 Ca 0.00 -0.13 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 3d5s s LEU 73 Cb 0.00 -2.76 0.15 0.00 0.03 0.00 0.00 46.19 43.61 3d5s s LEU 73 CO 0.00 -0.32 0.27 0.68 0.23 0.00 0.00 176.35 177.21 3d5s s VAL 74 N -2.12 0.12 0.00 -1.59 -7.23 -0.76 -5.05 120.40 103.77 3d5s s VAL 74 Ca 0.42 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.74 3d5s s VAL 74 Cb -0.09 -1.08 0.00 0.00 0.56 0.00 0.00 36.38 35.77 3d5s s VAL 74 CO 0.30 -1.00 0.00 -2.11 -0.31 0.00 0.00 175.10 171.99