#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 0.38 1.09 3.32 -2.05 -2.21 116.42 116.95 3d5s h ASP 12 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 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 0.17 -0.06 0.00 -1.72 0.00 0.00 179.24 177.64 3d5s h ALA 13 N 1.83 1.17 0.10 3.45 0.00 -2.05 0.33 119.26 124.09 3d5s h ALA 13 Ca -0.00 -0.05 -0.27 0.00 0.00 0.00 0.00 54.91 54.59 3d5s h ALA 13 Cb 0.79 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3d5s h ALA 13 CO 0.02 0.07 -1.23 1.15 0.00 0.00 0.00 179.25 179.27 3d5s h THR 14 N 0.00 1.50 -0.21 0.00 2.02 -1.83 -2.93 112.91 111.46 3d5s h THR 14 Ca -0.00 -3.11 -0.19 0.00 0.77 0.00 0.00 66.41 63.88 3d5s h THR 14 Cb 0.27 2.91 0.00 0.00 -1.74 0.00 0.00 68.15 69.58 3d5s h THR 14 CO 0.01 0.90 -0.61 0.40 0.37 0.00 0.00 175.52 176.58 3d5s h ILE 15 N 0.06 1.30 0.13 3.11 2.04 -1.28 -0.59 117.51 122.28 3d5s h ILE 15 Ca -0.12 -1.84 -0.01 0.00 1.00 0.00 0.00 64.86 63.90 3d5s h ILE 15 Cb 1.94 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 39.80 3d5s h ILE 15 CO 0.18 0.58 -0.06 0.11 0.00 0.00 0.00 178.15 178.97 3d5s h LYS 16 N 0.54 -0.17 -0.89 2.37 1.57 -1.05 0.20 116.57 119.14 3d5s h LYS 16 Ca -0.01 0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3d5s h LYS 16 Cb 1.20 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.51 3d5s h LYS 16 CO 0.13 -0.02 0.52 0.87 -0.57 0.00 0.00 179.45 180.38 3d5s h LYS 17 N -0.28 1.22 -0.44 3.15 1.57 -1.51 0.41 116.57 120.69 3d5s h LYS 17 Ca -0.02 -0.12 -0.08 0.00 -1.87 0.00 0.00 60.65 58.56 3d5s h LYS 17 Cb 0.22 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 3d5s h LYS 17 CO 0.03 0.86 -0.07 0.93 -0.57 0.00 0.00 179.45 180.63 3d5s h GLU 18 N 1.24 0.76 -0.35 3.15 5.08 -0.76 -2.36 114.58 121.33 3d5s h GLU 18 Ca 0.32 -0.23 -0.15 0.00 -1.00 0.00 0.00 59.36 58.30 3d5s h GLU 18 Cb -0.03 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 3d5s h GLU 18 CO -0.06 0.81 -0.36 1.96 -1.00 0.00 0.00 179.01 180.36 3d5s h GLN 19 N 0.69 0.82 -0.62 2.33 1.08 0.23 -2.13 115.11 117.51 3d5s h GLN 19 Ca 0.13 -0.41 0.01 0.00 -1.45 0.00 0.00 58.65 56.92 3d5s h GLN 19 Cb 0.53 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.93 3d5s h GLN 19 CO 0.03 1.05 0.41 0.87 -0.95 0.00 0.00 178.83 180.24 3d5s h LYS 20 N 0.68 0.81 -0.51 1.46 1.79 -0.76 0.66 116.57 120.70 3d5s h LYS 20 Ca 0.06 -0.05 0.01 0.00 -2.18 0.00 0.00 60.65 58.50 3d5s h LYS 20 Cb 0.93 -0.18 -0.03 0.00 -1.58 0.00 0.00 32.23 31.36 3d5s h LYS 20 CO 0.09 0.53 0.32 1.25 -1.08 0.00 0.00 179.45 180.56 3d5s h LEU 21 N 0.83 0.54 -0.05 2.94 7.12 -1.26 0.56 115.31 126.00 3d5s h LEU 21 Ca 0.23 -0.01 -0.01 0.00 0.13 0.00 0.00 57.88 58.23 3d5s h LEU 21 Cb -0.08 -0.13 -0.00 0.00 -0.53 0.00 0.00 40.66 39.92 3d5s h LEU 21 CO -0.06 0.39 0.01 0.40 -0.13 0.00 0.00 178.44 179.05 3d5s h ILE 22 N 0.65 1.22 -0.60 4.05 2.04 -0.87 -0.72 117.51 123.29 3d5s h ILE 22 Ca 0.19 -0.68 0.12 0.00 1.00 0.00 0.00 64.86 65.49 3d5s h ILE 22 Cb -0.04 1.59 -0.09 0.00 -0.74 0.00 0.00 36.82 37.54 3d5s h ILE 22 CO -0.06 0.19 0.11 1.56 0.00 0.00 0.00 178.15 179.94 3d5s h GLN 23 N -0.18 0.23 0.24 2.37 1.08 -0.66 0.16 115.11 118.35 3d5s h GLN 23 Ca 0.01 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3d5s h GLN 23 Cb 0.29 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.67 3d5s h GLN 23 CO 0.00 0.15 -0.11 0.00 -0.95 0.00 0.00 178.83 177.92 3d5s h ALA 24 N 1.49 -0.32 -0.82 3.87 0.00 -0.66 -0.95 119.26 121.88 3d5s h ALA 24 Ca 0.32 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 55.24 3d5s h ALA 24 Cb 0.48 0.12 -0.08 0.00 0.00 0.00 0.00 17.79 18.32 3d5s h ALA 24 CO -0.42 -0.65 0.45 1.96 0.00 0.00 0.00 179.25 180.59 3d5s h GLN 25 N -0.38 0.72 -0.10 0.00 4.20 -0.40 0.15 115.11 119.30 3d5s h GLN 25 Ca -0.03 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.62 3d5s h GLN 25 Cb 0.29 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.90 3d5s h GLN 25 CO 0.05 0.48 -0.01 -0.91 -0.67 0.00 0.00 178.83 177.77 3d5s h ASN 26 N 0.74 0.18 0.03 1.46 4.21 -0.52 -1.82 115.58 119.86 3d5s h ASN 26 Ca 0.40 -0.34 -0.11 0.00 1.21 0.00 0.00 56.30 57.47 3d5s h ASN 26 Cb 0.41 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 37.55 3d5s h ASN 26 CO -0.27 0.47 -0.33 -0.07 -1.29 0.00 0.00 177.43 175.95 3d5s h LEU 27 N -0.13 0.44 -0.25 1.61 3.38 -0.80 -0.29 115.31 119.27 3d5s h LEU 27 Ca 0.03 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 3d5s h LEU 27 Cb 0.39 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3d5s h LEU 27 CO 0.01 0.75 -0.03 0.58 0.09 0.00 0.00 178.44 179.83 3d5s h VAL 28 N 0.37 1.27 -0.96 1.22 2.07 -0.72 0.17 116.25 119.67 3d5s h VAL 28 Ca 0.04 -1.00 0.01 0.00 0.82 0.00 0.00 66.70 66.58 3d5s h VAL 28 Cb 0.76 1.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.91 3d5s h VAL 28 CO 0.06 0.31 0.64 -0.09 0.02 0.00 0.00 177.57 178.51 3d5s h ARG 29 N 0.22 1.26 -0.46 1.57 2.43 -1.09 -1.41 114.38 116.90 3d5s h ARG 29 Ca 0.07 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 3d5s h ARG 29 Cb 0.48 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 3d5s h ARG 29 CO 0.02 0.83 -0.09 1.49 -1.51 0.00 0.00 179.97 180.71 3d5s h GLU 30 N 1.29 0.82 -0.61 0.20 4.22 -0.70 -2.65 114.58 117.14 3d5s h GLU 30 Ca 0.35 -0.27 -0.02 0.00 0.08 0.00 0.00 59.36 59.51 3d5s h GLU 30 Cb -0.14 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.01 3d5s h GLU 30 CO -0.08 0.88 0.32 0.35 -2.18 0.00 0.00 179.01 178.31 3d5s h PHE 31 N 0.74 0.86 0.00 0.92 3.57 0.21 -0.26 116.94 122.97 3d5s h PHE 31 Ca 0.13 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.60 3d5s h PHE 31 Cb 0.58 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.05 3d5s h PHE 31 CO 0.03 0.63 0.00 0.93 -2.23 0.00 0.00 178.31 177.67 3d5s h GLU 32 N 0.84 0.00 0.08 1.11 5.08 -0.96 -0.49 114.58 120.24 3d5s h GLU 32 Ca 0.21 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.22 3d5s h GLU 32 Cb 0.07 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3d5s h GLU 32 CO -0.03 0.00 -1.99 1.63 -1.00 0.00 0.00 179.01 177.61 3d5s n LYS 33 N -3.05 0.72 -0.05 2.33 5.02 -0.20 -4.68 118.16 118.25 3d5s n LYS 33 Ca -0.03 0.25 -0.02 0.00 -2.02 0.00 0.00 58.31 56.50 3d5s n LYS 33 Cb 0.08 -1.70 -0.11 0.00 -0.02 0.00 0.00 35.03 33.28 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 -3.35 0.60 -2.60 -0.18 -2.24 -0.68 -5.02 114.28 100.81 3d5s n THR 34 Ca -0.30 -0.49 -0.19 0.00 -2.27 0.00 0.00 64.05 60.80 3d5s n THR 34 Cb 1.05 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.92 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 -2.32 -1.35 -2.96 4.78 8.25 -0.21 -4.78 115.22 116.63 3d5s n HIS 35 Ca -0.15 0.14 -0.23 0.00 -0.26 0.00 0.00 57.72 57.22 3d5s n HIS 35 Cb 0.74 -3.74 0.01 0.00 1.12 0.00 0.00 29.99 28.12 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 -2.96 3.98 0.19 1.59 -4.23 -1.26 -1.97 115.64 110.98 3d5s s THR 36 Ca 0.09 -0.47 -0.07 0.00 -1.18 0.00 0.00 61.69 60.05 3d5s s THR 36 Cb -0.04 -3.48 0.05 0.00 1.34 0.00 0.00 72.50 70.37 3d5s s THR 36 CO 0.11 -0.34 1.63 0.58 -0.54 0.00 0.00 174.62 176.06 3d5s h VAL 37 N 0.38 1.27 0.03 2.29 2.07 -1.80 -1.30 116.25 119.18 3d5s h VAL 37 Ca -0.46 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 65.82 3d5s h VAL 37 Cb 1.25 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 3d5s h VAL 37 CO 0.57 0.44 -0.04 -1.28 0.02 0.00 0.00 177.57 177.28 3d5s h SER 38 N 0.85 -0.12 -0.05 0.57 0.87 -1.94 -1.57 113.55 112.16 3d5s h SER 38 Ca 0.13 0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.66 3d5s h SER 38 Cb 0.65 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.65 3d5s h SER 38 CO 0.05 -0.07 -0.10 0.00 -0.53 0.00 0.00 176.83 176.18 3d5s h ALA 39 N 0.88 1.44 -0.01 6.23 0.00 -1.93 -2.50 119.26 123.38 3d5s h ALA 39 Ca 0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 3d5s h ALA 39 Cb 0.10 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3d5s h ALA 39 CO -0.02 0.39 0.01 1.25 0.00 0.00 0.00 179.25 180.87 3d5s h HIS 40 N 0.31 0.02 -0.28 0.00 2.76 -0.76 -1.73 115.15 115.46 3d5s h HIS 40 Ca 0.06 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.27 3d5s h HIS 40 Cb 0.38 -0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.30 3d5s h HIS 40 CO 0.01 0.12 0.08 0.00 -1.30 0.00 0.00 177.93 176.84 3d5s h ALA 41 N 0.89 0.31 -0.51 5.26 0.00 -0.99 0.13 119.26 124.35 3d5s h ALA 41 Ca 0.00 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3d5s h ALA 41 Cb 0.11 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3d5s h ALA 41 CO -0.00 -0.33 0.25 0.87 0.00 0.00 0.00 179.25 180.04 3d5s h LYS 42 N 0.19 0.73 0.08 0.00 1.57 -1.43 -1.07 116.57 116.65 3d5s h LYS 42 Ca 0.13 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3d5s h LYS 42 Cb 0.11 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3d5s h LYS 42 CO -0.15 0.60 -0.04 0.00 -0.57 0.00 0.00 179.45 179.29 3d5s h ALA 43 N 1.09 -0.10 -0.16 3.86 0.00 -1.00 -1.30 119.26 121.65 3d5s h ALA 43 Ca 0.18 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.01 3d5s h ALA 43 Cb 0.11 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3d5s h ALA 43 CO -0.02 -0.47 -0.01 0.37 0.00 0.00 0.00 179.25 179.12 3d5s h GLN 44 N -0.28 0.04 -0.23 0.00 5.75 -0.64 0.21 115.11 119.96 3d5s h GLN 44 Ca -0.01 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 3d5s h GLN 44 Cb 0.24 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 28.77 3d5s h GLN 44 CO 0.02 0.03 0.15 -0.22 -2.65 0.00 0.00 178.83 176.15 3d5s h LYS 45 N 0.04 0.31 -0.42 1.69 3.64 -1.20 -1.04 116.57 119.59 3d5s h LYS 45 Ca 0.07 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.50 3d5s h LYS 45 Cb 0.10 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.79 3d5s h LYS 45 CO -0.13 0.22 0.10 0.00 -2.27 0.00 0.00 179.45 177.37 3d5s h ALA 46 N 1.07 0.47 -0.48 5.00 0.00 -0.88 -2.03 119.26 122.42 3d5s h ALA 46 Ca 0.08 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3d5s h ALA 46 Cb -0.02 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3d5s h ALA 46 CO -0.02 -0.30 0.24 0.28 0.00 0.00 0.00 179.25 179.45 3d5s h VAL 47 N 0.23 1.18 0.00 0.00 2.07 -0.66 -1.64 116.25 117.43 3d5s h VAL 47 Ca 0.21 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.24 3d5s h VAL 47 Cb 0.24 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 3d5s h VAL 47 CO -0.26 0.20 0.00 0.78 0.02 0.00 0.00 177.57 178.31 3d5s h ASN 48 N 0.63 0.00 0.81 0.57 2.35 -0.51 -1.32 115.58 118.10 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 0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.46 3d5s h ASN 48 CO -0.02 0.00 -0.69 -0.07 -1.65 0.00 0.00 177.43 174.99 3d5s h LEU 49 N 0.00 0.00 -9.57 1.61 3.38 -0.67 -3.47 115.31 106.59 3d5s h LEU 49 Ca 0.00 -0.23 -0.53 0.00 0.09 0.00 0.00 57.88 57.21 3d5s h LEU 49 Cb 0.00 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.78 3d5s h LEU 49 CO 0.00 0.11 0.78 -0.69 0.09 0.00 0.00 178.44 178.74 3d5s s VAL 50 N -3.18 3.04 0.66 1.22 1.01 -0.50 -4.96 120.40 117.68 3d5s s VAL 50 Ca 0.06 0.75 -0.17 0.00 0.00 0.00 0.00 61.98 62.61 3d5s s VAL 50 Cb 0.13 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.02 3d5s s VAL 50 CO 0.73 0.06 1.16 -0.24 0.00 0.00 0.00 175.10 176.82 3d5s n SER 51 N 3.92 1.47 0.00 3.32 2.88 -1.26 -4.84 113.62 119.11 3d5s n SER 51 Ca 0.12 0.79 0.04 0.00 -1.33 0.00 0.00 58.87 58.49 3d5s n SER 51 Cb 0.41 -1.49 0.19 0.00 -0.75 0.00 0.00 64.21 62.56 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 -2.04 0.00 0.01 0.66 3.01 -1.26 -1.32 117.46 116.53 3d5s n PHE 52 Ca 0.15 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.64 3d5s n PHE 52 Cb 0.48 -0.40 0.40 0.00 -0.01 0.00 0.00 39.48 39.95 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 0.51 -0.77 -1.08 5.08 -2.02 -0.95 114.58 115.35 3d5s h GLU 53 Ca 0.00 -0.05 -0.47 0.00 -1.00 0.00 0.00 59.36 57.84 3d5s h GLU 53 Cb 0.11 -0.11 -0.26 0.00 0.50 0.00 0.00 28.75 28.99 3d5s h GLU 53 CO 0.00 0.39 0.28 0.66 -1.00 0.00 0.00 179.01 179.34 3d5s n TYR 54 N -4.43 2.47 -0.39 4.33 4.01 -0.43 -4.78 117.16 117.95 3d5s n TYR 54 Ca 0.02 -2.17 0.35 0.00 -0.16 0.00 0.00 57.90 55.94 3d5s n TYR 54 Cb 0.11 -0.87 0.61 0.00 -0.31 0.00 0.00 39.34 38.88 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 -1.01 -0.04 -0.01 -0.72 2.85 -0.36 -1.05 118.16 117.81 3d5s n LYS 55 Ca 0.50 1.24 -0.13 0.00 -1.05 0.00 0.00 58.31 58.87 3d5s n LYS 55 Cb 1.09 -2.34 -0.10 0.00 -0.65 0.00 0.00 35.03 33.03 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 1.36 0.00 0.58 2.07 -1.86 -2.55 116.25 115.85 3d5s h VAL 56 Ca 0.82 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 66.85 3d5s h VAL 56 Cb 2.45 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 34.54 3d5s h VAL 56 CO -0.56 0.37 0.00 0.50 0.02 0.00 0.00 177.57 177.89 3d5s h LYS 57 N -0.73 0.00 -0.25 1.57 1.63 -1.64 -2.17 116.57 114.99 3d5s h LYS 57 Ca -0.01 0.00 -0.11 0.00 -0.85 0.00 0.00 60.65 59.69 3d5s h LYS 57 Cb 0.64 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.26 3d5s h LYS 57 CO 0.01 0.00 -0.27 -0.22 -3.45 0.00 0.00 179.45 175.52 3d5s h LYS 58 N 0.00 0.62 -0.55 1.90 3.64 -1.12 -0.48 116.57 120.58 3d5s h LYS 58 Ca 0.00 -0.34 -0.02 0.00 -1.27 0.00 0.00 60.65 59.03 3d5s h LYS 58 Cb 0.55 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 3d5s h LYS 58 CO 0.00 0.94 0.27 0.52 -2.27 0.00 0.00 179.45 178.91 3d5s h MET 59 N 0.33 0.79 -0.65 1.90 2.86 -1.00 -0.18 114.93 118.99 3d5s h MET 59 Ca 0.04 -0.11 -0.07 0.00 -2.06 0.00 0.00 59.70 57.49 3d5s h MET 59 Cb 0.84 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.33 3d5s h MET 59 CO 0.07 0.64 0.12 0.28 1.06 0.00 0.00 176.91 179.07 3d5s h VAL 60 N 0.75 1.26 -0.34 -2.22 2.07 -1.29 0.76 116.25 117.23 3d5s h VAL 60 Ca 0.19 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.67 3d5s h VAL 60 Cb 0.10 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 3d5s h VAL 60 CO -0.03 0.38 0.07 -0.07 0.02 0.00 0.00 177.57 177.94 3d5s h LEU 61 N 0.98 0.53 -0.58 2.57 3.38 -0.83 -0.93 115.31 120.43 3d5s h LEU 61 Ca 0.20 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 3d5s h LEU 61 Cb 0.42 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 3d5s h LEU 61 CO 0.01 0.64 0.28 -0.61 0.09 0.00 0.00 178.44 178.84 3d5s h GLN 62 N 0.40 0.84 -0.51 1.13 5.75 -0.86 -1.26 115.11 120.60 3d5s h GLN 62 Ca 0.11 -0.13 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 3d5s h GLN 62 Cb 0.32 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.70 3d5s h GLN 62 CO 0.00 0.69 0.26 1.49 -2.65 0.00 0.00 178.83 178.62 3d5s h GLU 63 N 0.80 0.70 -0.37 1.69 4.57 -0.66 -0.14 114.58 121.16 3d5s h GLU 63 Ca 0.20 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.22 3d5s h GLU 63 Cb 0.13 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 3d5s h GLU 63 CO -0.02 0.53 -0.11 0.00 -1.18 0.00 0.00 179.01 178.23 3d5s h ARG 64 N 0.70 0.64 -0.00 1.92 3.08 -0.25 -1.92 114.38 118.55 3d5s h ARG 64 Ca 0.18 -0.20 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3d5s h ARG 64 Cb 0.05 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 3d5s h ARG 64 CO -0.03 0.74 -0.00 0.82 -1.07 0.00 0.00 179.97 180.43 3d5s h ILE 65 N 0.59 1.29 -0.74 2.04 2.04 -0.12 -2.68 117.51 119.94 3d5s h ILE 65 Ca 0.11 -0.87 0.14 0.00 1.00 0.00 0.00 64.86 65.24 3d5s h ILE 65 Cb 0.53 1.88 -0.05 0.00 -0.74 0.00 0.00 36.82 38.44 3d5s h ILE 65 CO 0.03 0.22 0.49 0.44 0.00 0.00 0.00 178.15 179.34 3d5s h ASP 66 N -0.37 0.42 -0.27 1.72 3.32 -0.88 -1.59 116.42 118.78 3d5s h ASP 66 Ca 0.00 0.02 -0.17 0.00 0.02 0.00 0.00 57.03 56.90 3d5s h ASP 66 Cb 0.37 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.85 3d5s h ASP 66 CO 0.00 0.23 -0.50 0.78 -1.72 0.00 0.00 179.24 178.03 3d5s h ASN 67 N 0.45 0.90 -0.51 6.45 2.35 -1.18 -1.99 115.58 122.05 3d5s h ASN 67 Ca 0.36 -0.54 -0.04 0.00 -0.55 0.00 0.00 56.30 55.54 3d5s h ASN 67 Cb 0.76 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.84 3d5s h ASN 67 CO -0.12 1.27 0.20 0.58 -1.65 0.00 0.00 177.43 177.71 3d5s h VAL 68 N 0.57 1.21 -0.17 2.81 2.07 -1.03 -1.21 116.25 120.50 3d5s h VAL 68 Ca 0.01 -0.69 -0.07 0.00 0.82 0.00 0.00 66.70 66.77 3d5s h VAL 68 Cb 1.11 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 3d5s h VAL 68 CO 0.11 0.27 -0.23 -0.07 0.02 0.00 0.00 177.57 177.67 3d5s h LEU 69 N 0.80 0.30 -0.94 2.57 3.38 -1.12 -2.18 115.31 118.12 3d5s h LEU 69 Ca 0.19 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 3d5s h LEU 69 Cb 0.20 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3d5s h LEU 69 CO -0.01 0.54 -0.39 0.11 0.09 0.00 0.00 178.44 178.77 3d5s h LYS 70 N 0.28 0.28 -0.27 1.13 1.57 -0.48 -2.93 116.57 116.14 3d5s h LYS 70 Ca 0.05 -0.13 -0.16 0.00 -1.87 0.00 0.00 60.65 58.54 3d5s h LYS 70 Cb 0.56 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 3d5s h LYS 70 CO 0.04 0.63 -0.46 1.96 -0.57 0.00 0.00 179.45 181.05 3d5s h GLN 71 N 0.23 0.70 0.00 3.15 4.20 -0.75 -3.50 115.11 119.15 3d5s h GLN 71 Ca 0.02 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.34 3d5s h GLN 71 Cb 0.80 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.61 3d5s h GLN 71 CO 0.06 1.01 0.00 0.41 -0.67 0.00 0.00 178.83 179.65 3d5s n GLY 72 N 0.15 3.31 3.99 3.46 0.00 -0.90 -5.11 105.19 110.09 3d5s n GLY 72 Ca -0.03 -1.66 -0.19 0.00 0.00 0.00 0.00 46.02 44.14 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 3.99 -0.38 0.99 1.43 -1.26 -4.88 118.68 118.56 3d5s s LEU 73 Ca 0.00 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 52.99 3d5s s LEU 73 Cb 0.00 -2.79 0.15 0.00 0.03 0.00 0.00 46.19 43.59 3d5s s LEU 73 CO 0.00 -0.41 0.31 0.68 0.23 0.00 0.00 176.35 177.15 3d5s s VAL 74 N -2.18 0.03 0.00 -1.59 -7.23 -0.83 -5.05 120.40 103.55 3d5s s VAL 74 Ca 0.44 -1.77 0.00 0.00 -1.81 0.00 0.00 61.98 58.84 3d5s s VAL 74 Cb -0.09 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.85 3d5s s VAL 74 CO 0.31 -0.93 0.00 -2.11 -0.31 0.00 0.00 175.10 172.07