#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2no8 n LEU 3 N 0.00 -0.89 -5.00 -1.84 4.32 -1.26 -5.03 117.00 107.30 2no8 n LEU 3 Ca 0.00 1.69 -0.18 0.00 -0.02 0.00 0.00 56.01 57.50 2no8 n LEU 3 Cb 0.00 -1.75 0.02 0.00 -1.62 0.00 0.00 43.42 40.06 2no8 n LEU 3 CO 0.00 -0.88 0.21 -1.59 -1.22 0.00 0.00 177.39 173.91 2no8 s LYS 4 N -4.44 2.74 -0.05 3.23 0.00 -1.26 -5.04 119.74 114.92 2no8 s LYS 4 Ca 0.00 -1.14 0.12 0.00 0.00 0.00 0.00 55.97 54.95 2no8 s LYS 4 Cb 0.00 -2.69 -0.18 0.00 0.00 0.00 0.00 37.83 34.96 2no8 s LYS 4 CO 0.00 -0.40 0.20 -2.39 0.00 0.00 0.00 175.35 172.76 2no8 n HIS 5 N -1.99 0.00 -3.51 1.78 1.44 -1.26 -5.08 115.22 106.60 2no8 n HIS 5 Ca 0.08 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.77 2no8 n HIS 5 Cb 0.59 -0.38 0.01 0.00 0.12 0.00 0.00 29.99 30.33 2no8 n HIS 5 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 2no8 n SER 6 N -2.09 -0.72 0.22 4.39 3.41 -1.26 -5.00 113.62 112.57 2no8 n SER 6 Ca -0.08 -1.42 0.09 0.00 -0.26 0.00 0.00 58.87 57.21 2no8 n SER 6 Cb 0.50 1.17 0.44 0.00 -0.26 0.00 0.00 64.21 66.06 2no8 n SER 6 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 2no8 h ILE 7 N 1.37 0.61 -0.00 -1.33 2.10 -1.87 -2.83 117.51 115.55 2no8 h ILE 7 Ca -0.11 -1.18 0.00 0.00 1.08 0.00 0.00 64.86 64.65 2no8 h ILE 7 Cb 0.45 1.79 0.00 0.00 -1.09 0.00 0.00 36.82 37.97 2no8 h ILE 7 CO 0.14 0.24 -0.01 -0.24 -1.08 0.00 0.00 178.15 177.21 2no8 n SER 8 N -3.42 0.02 0.09 2.19 2.88 -1.24 -1.83 113.62 112.30 2no8 n SER 8 Ca 0.00 -0.17 -0.06 0.00 -1.33 0.00 0.00 58.87 57.31 2no8 n SER 8 Cb 0.44 -0.27 0.07 0.00 -0.75 0.00 0.00 64.21 63.70 2no8 n SER 8 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2no8 h ASP 9 N 0.02 0.24 -4.09 -3.46 1.82 -1.84 -2.91 116.42 106.20 2no8 h ASP 9 Ca 0.00 -0.16 -0.45 0.00 -0.39 0.00 0.00 57.03 56.03 2no8 h ASP 9 Cb 0.28 -0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.21 2no8 h ASP 9 CO 0.00 0.88 0.35 -0.31 -1.61 0.00 0.00 179.24 178.55 2no8 s TYR 10 N -3.51 3.30 0.43 0.28 1.51 -0.76 -4.74 117.35 113.86 2no8 s TYR 10 Ca -0.03 1.58 -0.01 0.00 -1.01 0.00 0.00 57.07 57.60 2no8 s TYR 10 Cb 0.11 -2.86 0.09 0.00 -0.11 0.00 0.00 41.96 39.19 2no8 s TYR 10 CO 0.81 -0.23 0.59 0.25 -1.11 0.00 0.00 175.55 175.86 2no8 n THR 11 N -0.85 0.00 -0.18 -0.71 -2.24 -1.26 0.01 114.28 109.05 2no8 n THR 11 Ca 0.07 -0.90 -0.10 0.00 -2.27 0.00 0.00 64.05 60.85 2no8 n THR 11 Cb 0.54 -1.13 0.01 0.00 -2.10 0.00 0.00 70.33 67.65 2no8 n THR 11 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2no8 h GLU 12 N 0.00 0.95 -0.01 -0.78 4.81 -0.07 -2.25 114.58 117.23 2no8 h GLU 12 Ca -0.20 -0.33 -0.00 0.00 -0.13 0.00 0.00 59.36 58.71 2no8 h GLU 12 Cb 0.71 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.02 2no8 h GLU 12 CO 0.21 0.99 0.00 0.00 -0.73 0.00 0.00 179.01 179.48 2no8 h ALA 13 N 0.93 0.01 0.00 2.92 0.00 -1.92 0.24 119.26 121.44 2no8 h ALA 13 Ca 0.14 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2no8 h ALA 13 Cb 0.59 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2no8 h ALA 13 CO 0.04 -0.38 -0.44 0.93 0.00 0.00 0.00 179.25 179.40 2no8 h GLU 14 N -0.19 0.00 0.03 0.00 4.39 -1.89 -1.14 114.58 115.77 2no8 h GLU 14 Ca 0.00 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.49 2no8 h GLU 14 Cb 0.22 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2no8 h GLU 14 CO -0.00 0.44 -0.99 0.35 -1.16 0.00 0.00 179.01 177.64 2no8 h PHE 15 N 0.00 0.24 0.00 4.33 3.57 -1.29 -2.92 116.94 120.87 2no8 h PHE 15 Ca -0.00 -0.15 -0.03 0.00 3.53 0.00 0.00 57.97 61.32 2no8 h PHE 15 Cb 0.86 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.58 2no8 h PHE 15 CO 0.00 1.04 -0.14 1.25 -2.23 0.00 0.00 178.31 178.24 2no8 h LEU 16 N 0.06 0.00 -0.68 0.59 6.46 0.14 0.34 115.31 122.22 2no8 h LEU 16 Ca -0.05 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.70 2no8 h LEU 16 Cb 1.68 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.61 2no8 h LEU 16 CO 0.15 0.14 -0.04 -0.33 -0.62 0.00 0.00 178.44 177.73 2no8 h GLU 17 N 0.00 0.00 -0.33 1.25 4.39 -1.05 -3.25 114.58 115.59 2no8 h GLU 17 Ca -0.00 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.76 2no8 h GLU 17 Cb 0.45 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.04 2no8 h GLU 17 CO 0.02 0.04 -0.04 0.27 -1.16 0.00 0.00 179.01 178.14 2no8 h PHE 18 N 0.00 -0.10 -0.18 4.33 -0.00 -0.16 0.26 116.94 121.09 2no8 h PHE 18 Ca -0.00 0.03 -0.21 0.00 -0.00 0.00 0.00 57.97 57.79 2no8 h PHE 18 Cb 0.80 0.10 0.00 0.00 -0.00 0.00 0.00 35.95 36.85 2no8 h PHE 18 CO 0.00 -0.11 -0.70 -0.24 -0.00 0.00 0.00 178.31 177.26 2no8 h VAL 19 N 0.04 1.29 -0.58 0.88 3.04 -1.63 0.57 116.25 119.86 2no8 h VAL 19 Ca 0.16 -1.92 -0.09 0.00 -1.01 0.00 0.00 66.70 63.84 2no8 h VAL 19 Cb 0.24 1.90 -0.02 0.00 -2.01 0.00 0.00 31.29 31.39 2no8 h VAL 19 CO -0.31 0.61 0.01 0.11 -1.01 0.00 0.00 177.57 176.98 2no8 h LYS 20 N 0.53 0.99 -0.55 4.17 1.57 -1.48 0.01 116.57 121.81 2no8 h LYS 20 Ca -0.03 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.40 2no8 h LYS 20 Cb 1.31 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 2no8 h LYS 20 CO 0.14 0.96 0.12 -0.22 -0.57 0.00 0.00 179.45 179.89 2no8 h LYS 21 N 0.91 0.89 -0.48 3.15 3.64 -0.20 -2.23 116.57 122.25 2no8 h LYS 21 Ca 0.17 -0.22 -0.06 0.00 -1.27 0.00 0.00 60.65 59.27 2no8 h LYS 21 Cb 0.51 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 2no8 h LYS 21 CO 0.02 0.84 0.05 0.82 -2.27 0.00 0.00 179.45 178.92 2no8 h ILE 22 N 0.78 1.23 0.00 2.00 2.04 -0.46 -1.14 117.51 121.97 2no8 h ILE 22 Ca 0.17 -0.90 -0.04 0.00 1.00 0.00 0.00 64.86 65.09 2no8 h ILE 22 Cb 0.36 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 2no8 h ILE 22 CO 0.00 0.32 -0.21 0.00 0.00 0.00 0.00 178.15 178.27 2no8 n ARG 24 N -3.97 2.34 -0.27 0.00 1.85 -0.88 -4.61 116.66 111.11 2no8 n ARG 24 Ca -0.02 -1.96 0.01 0.00 -1.00 0.00 0.00 57.85 54.88 2no8 n ARG 24 Cb 0.29 -1.47 0.11 0.00 -1.05 0.00 0.00 32.46 30.34 2no8 n ARG 24 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2no8 n ALA 25 N 1.36 2.98 -0.30 2.89 0.00 -0.48 -4.46 120.51 122.49 2no8 n ALA 25 Ca 0.15 -0.59 0.11 0.00 0.00 0.00 0.00 53.44 53.10 2no8 n ALA 25 Cb 0.60 -1.05 0.25 0.00 0.00 0.00 0.00 19.45 19.25 2no8 n ALA 25 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2no8 h GLU 26 N 1.02 0.10 0.00 0.00 5.08 -1.82 -3.33 114.58 115.63 2no8 h GLU 26 Ca 0.03 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2no8 h GLU 26 Cb 1.02 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.25 2no8 h GLU 26 CO 0.17 0.06 0.00 0.41 -1.00 0.00 0.00 179.01 178.65 2no8 n GLY 27 N -1.43 2.27 0.07 -3.84 0.00 -1.26 -3.12 105.19 97.88 2no8 n GLY 27 Ca 0.19 0.40 -0.04 0.00 0.00 0.00 0.00 46.02 46.57 2no8 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2no8 h ALA 28 N -0.28 0.00 -2.87 4.61 0.00 -1.93 -3.50 119.26 115.29 2no8 h ALA 28 Ca 0.00 -0.47 -0.36 0.00 0.00 0.00 0.00 54.91 54.08 2no8 h ALA 28 Cb 0.00 0.47 -0.11 0.00 0.00 0.00 0.00 17.79 18.15 2no8 h ALA 28 CO 0.00 0.47 -0.39 0.95 0.00 0.00 0.00 179.25 180.29 2no8 s THR 29 N -2.19 0.00 0.34 0.00 -4.23 -1.18 -4.99 115.64 103.38 2no8 s THR 29 Ca -0.14 -1.84 0.04 0.00 -1.18 0.00 0.00 61.69 58.57 2no8 s THR 29 Cb 0.02 -2.54 0.19 0.00 1.34 0.00 0.00 72.50 71.51 2no8 s THR 29 CO 0.20 0.00 1.91 -0.08 -0.54 0.00 0.00 174.62 176.12 2no8 h GLU 30 N 2.19 0.62 0.00 3.99 4.57 -1.96 -0.27 114.58 123.72 2no8 h GLU 30 Ca -0.27 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 57.80 2no8 h GLU 30 Cb 1.24 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 2no8 h GLU 30 CO 0.39 0.55 0.00 1.05 -1.18 0.00 0.00 179.01 179.82 2no8 h GLU 31 N 0.61 0.00 -0.00 1.92 4.11 -1.96 0.15 114.58 119.41 2no8 h GLU 31 Ca 0.14 0.00 -0.19 0.00 0.07 0.00 0.00 59.36 59.39 2no8 h GLU 31 Cb 0.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2no8 h GLU 31 CO -0.01 0.00 -0.84 0.22 0.07 0.00 0.00 179.01 178.45 2no8 h ASP 32 N 0.00 0.19 0.09 3.06 3.58 -1.38 0.20 116.42 122.16 2no8 h ASP 32 Ca 0.00 -0.15 -0.00 0.00 0.42 0.00 0.00 57.03 57.29 2no8 h ASP 32 Cb 0.64 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2no8 h ASP 32 CO 0.00 0.94 -0.04 0.44 -2.88 0.00 0.00 179.24 177.70 2no8 h ASP 33 N 0.08 -0.10 -0.42 2.28 3.32 -1.02 -3.32 116.42 117.24 2no8 h ASP 33 Ca -0.03 -0.42 0.06 0.00 0.02 0.00 0.00 57.03 56.65 2no8 h ASP 33 Cb 1.46 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 41.01 2no8 h ASP 33 CO 0.12 0.40 0.29 -1.13 -1.72 0.00 0.00 179.24 177.20 2no8 h ASN 34 N -0.65 0.29 -0.69 6.45 -0.73 -0.86 -0.56 115.58 118.83 2no8 h ASN 34 Ca -0.01 -0.00 0.03 0.00 1.87 0.00 0.00 56.30 58.19 2no8 h ASN 34 Cb 0.52 -0.06 -0.04 0.00 0.27 0.00 0.00 38.32 39.01 2no8 h ASN 34 CO 0.02 0.19 0.46 0.07 -0.37 0.00 0.00 177.43 177.80 2no8 h LYS 35 N 0.34 0.81 -0.10 6.67 2.10 -0.69 0.29 116.57 125.99 2no8 h LYS 35 Ca 0.19 -0.05 -0.08 0.00 -2.00 0.00 0.00 60.65 58.70 2no8 h LYS 35 Cb 0.31 -0.18 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 2no8 h LYS 35 CO -0.04 0.54 -0.26 -0.07 -2.00 0.00 0.00 179.45 177.62 2no8 h LEU 36 N 0.84 0.40 -0.79 7.07 3.38 -1.26 -3.15 115.31 121.79 2no8 h LEU 36 Ca 0.28 -0.59 0.08 0.00 0.09 0.00 0.00 57.88 57.74 2no8 h LEU 36 Cb 0.06 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 40.63 2no8 h LEU 36 CO -0.08 0.92 0.45 0.58 0.09 0.00 0.00 178.44 180.40 2no8 h VAL 37 N -0.10 0.93 -0.56 1.22 2.07 -0.84 -2.27 116.25 116.71 2no8 h VAL 37 Ca -0.00 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2no8 h VAL 37 Cb 0.87 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 2no8 h VAL 37 CO 0.06 0.14 0.35 0.03 0.02 0.00 0.00 177.57 178.17 2no8 h ARG 38 N 0.78 0.75 -0.38 1.57 3.08 -0.49 0.26 114.38 119.96 2no8 h ARG 38 Ca 0.37 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 60.26 2no8 h ARG 38 Cb 0.30 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 2no8 h ARG 38 CO -0.23 0.52 -0.20 1.05 -1.07 0.00 0.00 179.97 180.04 2no8 h GLU 39 N 0.76 0.80 -0.51 0.04 4.11 -1.39 -1.52 114.58 116.87 2no8 h GLU 39 Ca 0.20 -0.36 -0.07 0.00 0.07 0.00 0.00 59.36 59.21 2no8 h GLU 39 Cb -0.05 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 2no8 h GLU 39 CO -0.04 0.98 0.04 0.74 0.07 0.00 0.00 179.01 180.80 2no8 h PHE 40 N 0.59 0.94 0.00 2.06 0.04 -1.20 -2.39 116.94 116.98 2no8 h PHE 40 Ca 0.08 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2no8 h PHE 40 Cb 0.75 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.65 2no8 h PHE 40 CO 0.06 0.86 0.00 0.93 -0.60 0.00 0.00 178.31 179.56 2no8 h GLU 41 N 0.74 0.00 0.00 1.51 4.39 -0.30 -0.48 114.58 120.44 2no8 h GLU 41 Ca 0.15 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 2no8 h GLU 41 Cb 0.46 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2no8 h GLU 41 CO 0.02 0.00 -0.65 0.00 -1.16 0.00 0.00 179.01 177.22 2no8 h ARG 42 N 0.00 0.00 0.00 2.33 -0.00 -0.90 -0.39 114.38 115.42 2no8 h ARG 42 Ca 0.00 0.00 -0.19 0.00 -0.50 0.00 0.00 59.98 59.29 2no8 h ARG 42 Cb 0.36 0.00 -0.03 0.00 0.00 0.00 0.00 29.97 30.30 2no8 h ARG 42 CO 0.00 0.02 -0.93 -0.07 0.00 0.00 0.00 179.97 178.99 2no8 h LEU 43 N 0.00 0.00 0.09 3.04 3.38 -0.64 -3.34 115.31 117.84 2no8 h LEU 43 Ca -0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 2no8 h LEU 43 Cb 1.02 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 2no8 h LEU 43 CO 0.00 0.93 -2.03 0.35 0.09 0.00 0.00 178.44 177.78 2no8 n THR 44 N -3.36 1.70 -2.17 0.22 -2.24 -0.54 -4.66 114.28 103.23 2no8 n THR 44 Ca 0.00 -0.57 -0.17 0.00 -2.27 0.00 0.00 64.05 61.04 2no8 n THR 44 Cb 0.90 -1.72 -0.02 0.00 -2.10 0.00 0.00 70.33 67.39 2no8 n THR 44 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2no8 n GLU 45 N -3.56 -1.33 -2.71 -0.78 1.02 -0.16 -4.95 120.64 108.18 2no8 n GLU 45 Ca -0.35 0.88 -0.42 0.00 -0.02 0.00 0.00 57.16 57.25 2no8 n GLU 45 Cb 1.00 -5.29 -0.03 0.00 -0.02 0.00 0.00 31.44 27.10 2no8 n GLU 45 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2no8 s HIS 46 N -2.81 3.58 0.21 -0.32 2.46 -1.25 -4.93 115.29 112.23 2no8 s HIS 46 Ca 0.00 1.63 -0.09 0.00 0.47 0.00 0.00 55.06 57.07 2no8 s HIS 46 Cb 0.00 -3.15 0.25 0.00 -0.13 0.00 0.00 32.58 29.55 2no8 s HIS 46 CO 0.00 -0.12 1.82 -1.00 -2.47 0.00 0.00 174.74 172.96 2no8 h PRO 47 N 6.96 0.71 -0.27 2.88 0.13 -1.94 -1.94 132.00 138.53 2no8 h PRO 47 Ca -0.36 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2no8 h PRO 47 Cb 1.18 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2no8 h PRO 47 CO 0.81 0.47 0.00 -0.25 -0.23 0.00 0.00 178.00 178.80 2no8 n ASP 48 N -4.76 3.51 0.06 1.44 8.00 -1.26 -4.66 116.55 118.88 2no8 n ASP 48 Ca 0.09 -2.70 -0.11 0.00 0.71 0.00 0.00 54.79 52.78 2no8 n ASP 48 Cb 0.17 -0.44 -0.05 0.00 -0.02 0.00 0.00 41.12 40.78 2no8 n ASP 48 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2no8 h GLY 49 N 1.77 -0.15 1.60 0.44 0.00 -1.74 0.57 103.07 105.56 2no8 h GLY 49 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2no8 h GLY 49 CO 0.14 -0.12 0.00 -1.14 0.00 0.00 0.00 176.54 175.43 2no8 n SER 50 N -5.24 0.00 -0.00 0.19 3.41 -1.26 -2.26 113.62 108.46 2no8 n SER 50 Ca -0.06 0.01 -0.22 0.00 -0.26 0.00 0.00 58.87 58.35 2no8 n SER 50 Cb 0.16 -0.30 -0.14 0.00 -0.26 0.00 0.00 64.21 63.67 2no8 n SER 50 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2no8 h ASP 51 N 0.00 0.37 -0.95 4.04 3.32 -1.33 -3.40 116.42 118.47 2no8 h ASP 51 Ca 0.00 -0.87 0.27 0.00 0.02 0.00 0.00 57.03 56.45 2no8 h ASP 51 Cb 0.22 -0.12 -0.14 0.00 0.22 0.00 0.00 39.33 39.50 2no8 h ASP 51 CO 0.00 1.77 0.45 -0.07 -1.72 0.00 0.00 179.24 179.66 2no8 h LEU 52 N -0.14 0.35 -0.13 1.55 3.38 0.50 0.69 115.31 121.51 2no8 h LEU 52 Ca -0.39 0.18 -0.24 0.00 0.09 0.00 0.00 57.88 57.53 2no8 h LEU 52 Cb 1.90 0.16 0.01 0.00 0.09 0.00 0.00 40.66 42.81 2no8 h LEU 52 CO 0.05 -0.09 -0.97 0.40 0.09 0.00 0.00 178.44 177.91 2no8 h ILE 53 N 0.33 1.38 0.04 1.22 2.04 -1.78 -3.34 117.51 117.40 2no8 h ILE 53 Ca 0.64 -2.43 -0.36 0.00 1.00 0.00 0.00 64.86 63.72 2no8 h ILE 53 Cb 1.36 2.43 -0.05 0.00 -0.74 0.00 0.00 36.82 39.82 2no8 h ILE 53 CO -0.59 0.73 -2.13 -1.22 0.00 0.00 0.00 178.15 174.93 2no8 n TYR 54 N -3.76 0.63 -4.66 1.37 4.01 -0.19 -4.93 117.16 109.62 2no8 n TYR 54 Ca -0.08 0.17 -0.23 0.00 -0.16 0.00 0.00 57.90 57.60 2no8 n TYR 54 Cb 0.85 -1.09 -0.15 0.00 -0.31 0.00 0.00 39.34 38.64 2no8 n TYR 54 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2no8 s TYR 55 N -2.54 1.32 0.77 -0.72 2.02 0.22 -5.11 117.35 113.30 2no8 s TYR 55 Ca -0.19 -0.26 -0.11 0.00 -0.37 0.00 0.00 57.07 56.14 2no8 s TYR 55 Cb 0.07 -0.85 0.05 0.00 -0.40 0.00 0.00 41.96 40.84 2no8 s TYR 55 CO 0.75 -0.02 1.08 -1.25 -1.57 0.00 0.00 175.55 174.55 2no8 s PRO 56 N -0.41 2.32 0.00 -1.71 0.04 -1.26 -3.92 135.00 130.06 2no8 s PRO 56 Ca 0.05 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.11 2no8 s PRO 56 Cb -0.06 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2no8 s PRO 56 CO -0.00 -1.55 0.00 0.54 0.04 0.00 0.00 177.00 176.02 2no8 n ARG 57 N -3.44 0.00 0.05 4.56 1.74 -1.24 -4.99 116.66 113.34 2no8 n ARG 57 Ca 0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 2no8 n ARG 57 Cb 0.54 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.98 2no8 n ARG 57 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2no8 n ASP 58 N 0.00 0.91 0.01 0.55 2.03 -1.26 -4.84 116.55 113.95 2no8 n ASP 58 Ca 0.00 0.15 0.03 0.00 0.52 0.00 0.00 54.79 55.49 2no8 n ASP 58 Cb 0.00 -0.25 -0.10 0.00 -0.72 0.00 0.00 41.12 40.04 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2no8 n ASP 59 N -3.39 0.49 -4.73 1.67 2.03 -1.26 -4.91 116.55 106.46 2no8 n ASP 59 Ca 0.00 0.21 -0.41 0.00 0.52 0.00 0.00 54.79 55.11 2no8 n ASP 59 Cb 0.00 0.81 -0.04 0.00 -0.72 0.00 0.00 41.12 41.17 2no8 n ASP 59 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 2no8 s ARG 60 N -3.07 4.67 0.44 -0.67 6.06 -1.26 -5.01 118.95 120.11 2no8 s ARG 60 Ca -0.05 1.47 -0.23 0.00 -2.50 0.00 0.00 55.73 54.42 2no8 s ARG 60 Cb 0.10 -3.38 -0.08 0.00 0.06 0.00 0.00 34.95 31.65 2no8 s ARG 60 CO 0.84 0.17 1.09 -2.00 -2.50 0.00 0.00 175.30 172.90 2no8 s GLU 61 N 0.08 3.95 -0.96 5.12 2.56 -1.26 -3.62 118.70 124.56 2no8 s GLU 61 Ca 0.48 1.58 -0.14 0.00 0.00 0.00 0.00 54.97 56.89 2no8 s GLU 61 Cb -0.24 -2.41 0.21 0.00 2.00 0.00 0.00 34.13 33.70 2no8 s GLU 61 CO 0.30 -0.35 1.00 0.34 -0.56 0.00 0.00 175.26 176.00 2no8 s ASP 62 N -1.57 6.91 -0.00 -1.70 2.15 -1.26 -4.12 116.67 117.07 2no8 s ASP 62 Ca 0.62 -2.81 -0.10 0.00 0.43 0.00 0.00 52.55 50.69 2no8 s ASP 62 Cb -0.23 -2.27 0.01 0.00 -0.30 0.00 0.00 42.92 40.12 2no8 s ASP 62 CO 0.29 -0.63 0.20 -0.44 -0.17 0.00 0.00 175.17 174.42 2no8 s SER 63 N 2.35 -0.06 0.29 -0.34 0.01 -1.26 -4.98 113.70 109.71 2no8 s SER 63 Ca 0.27 -0.09 0.04 0.00 1.31 0.00 0.00 55.95 57.48 2no8 s SER 63 Cb -0.08 0.25 0.72 0.00 0.21 0.00 0.00 66.02 67.12 2no8 s SER 63 CO -0.08 -0.40 1.73 -0.65 0.41 0.00 0.00 173.24 174.26 2no8 h PRO 64 N 4.13 0.54 -0.31 12.44 0.11 -1.93 0.25 132.00 147.23 2no8 h PRO 64 Ca -0.30 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.63 2no8 h PRO 64 Cb 1.19 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2no8 h PRO 64 CO 0.40 0.36 -0.39 0.93 -0.21 0.00 0.00 178.00 179.09 2no8 h GLU 65 N 0.56 0.75 -0.11 1.05 5.08 -1.96 -2.88 114.58 117.06 2no8 h GLU 65 Ca 0.56 -0.39 -0.18 0.00 -1.00 0.00 0.00 59.36 58.35 2no8 h GLU 65 Cb 0.97 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.23 2no8 h GLU 65 CO -0.45 1.01 -0.69 0.78 -1.00 0.00 0.00 179.01 178.65 2no8 h GLY 66 N 0.93 0.53 0.93 -3.84 0.00 -1.15 -1.07 103.07 99.40 2no8 h GLY 66 Ca 0.05 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.65 2no8 h GLY 66 CO 0.09 0.64 0.11 -2.22 0.00 0.00 0.00 176.54 175.16 2no8 h ILE 67 N 0.34 1.13 -0.76 2.60 2.04 -0.61 -1.52 117.51 120.72 2no8 h ILE 67 Ca -0.02 -0.36 -0.04 0.00 1.00 0.00 0.00 64.86 65.44 2no8 h ILE 67 Cb 1.27 0.96 -0.03 0.00 -0.74 0.00 0.00 36.82 38.27 2no8 h ILE 67 CO 0.12 0.12 0.31 0.58 0.00 0.00 0.00 178.15 179.29 2no8 h VAL 68 N 0.24 1.25 -0.79 1.67 2.07 -1.45 -2.42 116.25 116.82 2no8 h VAL 68 Ca 0.08 -0.79 0.07 0.00 0.82 0.00 0.00 66.70 66.87 2no8 h VAL 68 Cb 0.10 0.35 -0.06 0.00 -1.52 0.00 0.00 31.29 30.16 2no8 h VAL 68 CO -0.01 0.32 0.47 0.50 0.02 0.00 0.00 177.57 178.87 2no8 h LYS 69 N 1.10 0.82 0.39 1.57 1.63 -0.85 0.21 116.57 121.44 2no8 h LYS 69 Ca 0.25 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.99 2no8 h LYS 69 Cb 0.20 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2no8 h LYS 69 CO -0.02 0.54 -0.19 1.49 -3.45 0.00 0.00 179.45 177.82 2no8 h GLU 70 N 0.84 -0.50 -0.79 1.90 4.57 -0.79 0.28 114.58 120.09 2no8 h GLU 70 Ca 0.35 0.03 0.09 0.00 -1.18 0.00 0.00 59.36 58.65 2no8 h GLU 70 Cb 0.20 0.11 -0.07 0.00 -0.16 0.00 0.00 28.75 28.84 2no8 h GLU 70 CO -0.19 -0.34 0.45 0.82 -1.18 0.00 0.00 179.01 178.58 2no8 h ILE 71 N -0.52 0.92 0.65 2.32 2.04 -1.18 0.16 117.51 121.91 2no8 h ILE 71 Ca -0.05 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.51 2no8 h ILE 71 Cb 0.40 0.08 0.01 0.00 -0.74 0.00 0.00 36.82 36.57 2no8 h ILE 71 CO 0.09 0.14 -0.31 0.50 0.00 0.00 0.00 178.15 178.56 2no8 h LYS 72 N 0.77 -0.84 -0.23 2.37 3.11 -0.20 -1.47 116.57 120.08 2no8 h LYS 72 Ca 0.38 0.06 -0.10 0.00 -2.81 0.00 0.00 60.65 58.17 2no8 h LYS 72 Cb 0.32 0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.73 2no8 h LYS 72 CO -0.23 -0.52 -0.28 0.93 -2.81 0.00 0.00 179.45 176.53 2no8 h GLU 73 N -1.10 0.45 0.10 1.90 5.08 -0.23 -2.05 114.58 118.73 2no8 h GLU 73 Ca -0.09 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.09 2no8 h GLU 73 Cb 0.71 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2no8 h GLU 73 CO 0.15 0.69 -0.05 2.35 -1.00 0.00 0.00 179.01 181.15 2no8 h TRP 74 N 0.39 -0.13 -0.37 4.33 7.01 -0.70 -2.27 115.95 124.21 2no8 h TRP 74 Ca 0.05 -0.00 -0.07 0.00 2.11 0.00 0.00 58.89 60.98 2no8 h TRP 74 Cb 0.70 0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.78 2no8 h TRP 74 CO 0.02 0.11 -0.07 0.00 -2.79 0.00 0.00 178.44 175.71 2no8 h ARG 75 N -0.36 0.62 -0.08 2.65 3.08 -1.09 0.13 114.38 119.33 2no8 h ARG 75 Ca -0.01 -0.17 -0.08 0.00 0.07 0.00 0.00 59.98 59.78 2no8 h ARG 75 Cb 0.30 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2no8 h ARG 75 CO 0.02 0.69 -0.31 0.00 -1.07 0.00 0.00 179.97 179.31 2no8 h ALA 76 N 1.35 1.33 0.11 0.04 0.00 -1.33 0.75 119.26 121.50 2no8 h ALA 76 Ca 0.11 -0.32 -0.30 0.00 0.00 0.00 0.00 54.91 54.40 2no8 h ALA 76 Cb 0.47 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2no8 h ALA 76 CO 0.03 0.47 -1.50 0.00 0.00 0.00 0.00 179.25 178.24 2no8 h ALA 77 N 1.55 0.29 -0.06 0.00 0.00 -0.72 -3.27 119.26 117.06 2no8 h ALA 77 Ca 0.02 -1.11 0.00 0.00 0.00 0.00 0.00 54.91 53.82 2no8 h ALA 77 Cb 0.62 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2no8 h ALA 77 CO 0.04 1.16 0.00 0.09 0.00 0.00 0.00 179.25 180.54 2no8 n ASN 78 N -3.43 0.74 -2.76 0.00 3.02 0.36 -4.90 115.26 108.29 2no8 n ASN 78 Ca -0.15 -1.48 -0.17 0.00 -0.03 0.00 0.00 54.58 52.75 2no8 n ASN 78 Cb 1.04 -0.04 0.06 0.00 -0.61 0.00 0.00 39.78 40.23 2no8 n ASN 78 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2no8 n GLY 79 N 0.98 -0.14 0.00 7.41 0.00 -0.73 -5.02 105.19 107.68 2no8 n GLY 79 Ca 0.16 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2no8 n GLY 79 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2no8 n LYS 80 N -3.79 2.85 -2.09 1.61 4.76 0.18 -5.05 118.16 116.63 2no8 n LYS 80 Ca 0.00 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.16 2no8 n LYS 80 Cb 0.54 0.00 0.16 0.00 -1.84 0.00 0.00 35.03 33.90 2no8 n LYS 80 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2no8 s SER 81 N -1.00 3.46 0.00 4.39 0.15 -1.26 -4.82 113.70 114.61 2no8 s SER 81 Ca 0.00 0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.79 2no8 s SER 81 Cb 0.00 -0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 2no8 s SER 81 CO 0.00 -2.50 0.00 0.61 1.20 0.00 0.00 173.24 172.55 2no8 n GLY 82 N -3.53 5.28 3.65 9.45 0.00 -1.26 -4.46 105.19 114.32 2no8 n GLY 82 Ca 0.15 -1.45 -0.30 0.00 0.00 0.00 0.00 46.02 44.41 2no8 n GLY 82 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2no8 n PHE 83 N 0.00 0.64 -2.92 1.61 3.72 -1.26 -3.72 117.46 115.53 2no8 n PHE 83 Ca 0.00 -2.43 -0.34 0.00 -0.05 0.00 0.00 57.45 54.63 2no8 n PHE 83 Cb 0.00 -0.37 -0.07 0.00 -0.94 0.00 0.00 39.48 38.11 2no8 n PHE 83 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2no8 s LYS 84 N -3.94 4.23 -0.46 -1.08 2.20 0.10 -4.87 119.74 115.92 2no8 s LYS 84 Ca 0.09 1.02 -0.27 0.00 -0.36 0.00 0.00 55.97 56.45 2no8 s LYS 84 Cb -0.01 -2.41 -0.04 0.00 -1.51 0.00 0.00 37.83 33.86 2no8 s LYS 84 CO 0.06 0.11 2.07 1.14 -0.36 0.00 0.00 175.35 178.36 2no8 s GLN 85 N -2.83 2.67 0.00 4.03 1.03 -1.26 -3.85 119.66 119.46 2no8 s GLN 85 Ca 0.56 1.21 0.00 0.00 0.04 0.00 0.00 55.36 57.18 2no8 s GLN 85 Cb -0.12 -4.41 0.00 0.00 0.03 0.00 0.00 33.01 28.52 2no8 s GLN 85 CO 0.17 -2.64 0.00 0.41 -2.54 0.00 0.00 175.29 170.68