#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2no8 s LEU 3 N 0.00 4.03 0.38 4.31 1.43 -1.26 -5.10 118.68 122.47 2no8 s LEU 3 Ca 0.00 0.29 0.07 0.00 -1.03 0.00 0.00 54.13 53.46 2no8 s LEU 3 Cb 0.00 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 44.14 2no8 s LEU 3 CO 0.00 0.36 0.46 -1.59 0.23 0.00 0.00 176.35 175.81 2no8 s LYS 4 N -1.19 2.83 -0.01 1.70 0.00 -1.26 -5.04 119.74 116.77 2no8 s LYS 4 Ca 0.17 -1.25 0.05 0.00 0.00 0.00 0.00 55.97 54.94 2no8 s LYS 4 Cb -0.12 -2.65 -0.07 0.00 0.00 0.00 0.00 37.83 34.99 2no8 s LYS 4 CO 0.06 -0.10 0.12 -2.39 0.00 0.00 0.00 175.35 173.05 2no8 n HIS 5 N -1.65 0.00 -3.64 1.78 1.44 -1.26 -5.09 115.22 106.80 2no8 n HIS 5 Ca 0.03 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.69 2no8 n HIS 5 Cb 0.59 -0.10 0.02 0.00 0.12 0.00 0.00 29.99 30.62 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 -1.60 -1.57 0.22 4.39 3.41 -1.26 -5.00 113.62 112.20 2no8 n SER 6 Ca -0.01 -2.02 0.10 0.00 -0.26 0.00 0.00 58.87 56.68 2no8 n SER 6 Cb 0.12 2.60 0.44 0.00 -0.26 0.00 0.00 64.21 67.11 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 1.73 0.56 0.00 -1.33 2.10 -1.89 -2.84 117.51 115.83 2no8 h ILE 7 Ca -0.23 -1.15 0.00 0.00 1.08 0.00 0.00 64.86 64.56 2no8 h ILE 7 Cb 0.90 1.79 0.00 0.00 -1.09 0.00 0.00 36.82 38.42 2no8 h ILE 7 CO 0.30 0.23 0.00 -0.24 -1.08 0.00 0.00 178.15 177.36 2no8 n SER 8 N -3.38 0.70 0.16 2.19 2.88 -1.26 -1.18 113.62 113.74 2no8 n SER 8 Ca 0.00 0.66 0.09 0.00 -1.33 0.00 0.00 58.87 58.29 2no8 n SER 8 Cb 0.44 -0.81 0.08 0.00 -0.75 0.00 0.00 64.21 63.17 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 0.00 0.00 -3.51 -3.46 3.58 -1.85 -3.09 116.42 108.08 2no8 h ASP 9 Ca 0.00 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 2no8 h ASP 9 Cb 0.42 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.44 2no8 h ASP 9 CO 0.00 0.15 0.24 -0.31 -2.88 0.00 0.00 179.24 176.43 2no8 s TYR 10 N -3.18 3.82 0.77 0.28 1.51 -0.32 -4.77 117.35 115.45 2no8 s TYR 10 Ca 0.04 1.64 -0.10 0.00 -1.01 0.00 0.00 57.07 57.63 2no8 s TYR 10 Cb 0.07 -2.89 0.07 0.00 -0.11 0.00 0.00 41.96 39.10 2no8 s TYR 10 CO 0.73 0.32 1.12 0.95 -1.11 0.00 0.00 175.55 177.56 2no8 s THR 11 N -0.37 2.27 0.22 -0.71 -4.23 -1.26 -0.18 115.64 111.39 2no8 s THR 11 Ca 0.40 -0.02 -0.08 0.00 -1.18 0.00 0.00 61.69 60.82 2no8 s THR 11 Cb -0.22 -3.06 0.17 0.00 1.34 0.00 0.00 72.50 70.72 2no8 s THR 11 CO 0.26 -0.08 1.82 -0.08 -0.54 0.00 0.00 174.62 176.00 2no8 h GLU 12 N -0.87 0.74 -0.30 3.99 4.81 -1.71 0.11 114.58 121.35 2no8 h GLU 12 Ca -0.45 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 58.66 2no8 h GLU 12 Cb 1.32 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2no8 h GLU 12 CO 0.64 0.49 -0.08 0.00 -0.73 0.00 0.00 179.01 179.33 2no8 h ALA 13 N 1.37 0.41 -0.17 2.92 0.00 -1.92 0.18 119.26 122.06 2no8 h ALA 13 Ca 0.33 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2no8 h ALA 13 Cb 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2no8 h ALA 13 CO -0.19 0.25 -0.32 0.93 0.00 0.00 0.00 179.25 179.92 2no8 h GLU 14 N 0.35 0.33 -0.01 0.00 4.39 -1.82 -0.15 114.58 117.67 2no8 h GLU 14 Ca 0.07 -0.14 -0.19 0.00 0.34 0.00 0.00 59.36 59.45 2no8 h GLU 14 Cb 0.57 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.20 2no8 h GLU 14 CO 0.03 0.62 -0.84 0.35 -1.16 0.00 0.00 179.01 178.02 2no8 h PHE 15 N 0.29 0.31 0.00 4.33 3.57 -0.67 -2.63 116.94 122.13 2no8 h PHE 15 Ca 0.04 -0.16 -0.05 0.00 3.53 0.00 0.00 57.97 61.32 2no8 h PHE 15 Cb 0.72 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.41 2no8 h PHE 15 CO 0.02 0.95 -0.26 1.25 -2.23 0.00 0.00 178.31 178.04 2no8 h LEU 16 N 0.12 0.00 -0.95 0.59 6.46 -0.02 0.29 115.31 121.81 2no8 h LEU 16 Ca -0.04 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.71 2no8 h LEU 16 Cb 1.45 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.37 2no8 h LEU 16 CO 0.13 0.26 -0.04 -0.33 -0.62 0.00 0.00 178.44 177.84 2no8 h GLU 17 N 0.00 0.00 -0.20 1.25 4.39 -0.81 -3.22 114.58 115.99 2no8 h GLU 17 Ca -0.00 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.75 2no8 h GLU 17 Cb 0.71 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.31 2no8 h GLU 17 CO 0.03 0.04 -0.11 0.27 -1.16 0.00 0.00 179.01 178.08 2no8 h PHE 18 N 0.00 -0.26 -0.19 4.33 -0.00 -0.05 0.32 116.94 121.09 2no8 h PHE 18 Ca -0.00 0.02 -0.20 0.00 -0.00 0.00 0.00 57.97 57.80 2no8 h PHE 18 Cb 0.71 0.15 0.00 0.00 -0.00 0.00 0.00 35.95 36.81 2no8 h PHE 18 CO 0.00 -0.17 -0.67 -0.24 -0.00 0.00 0.00 178.31 177.24 2no8 h VAL 19 N -0.09 1.30 -0.52 0.88 3.04 -1.61 0.04 116.25 119.29 2no8 h VAL 19 Ca 0.11 -1.90 -0.07 0.00 -1.01 0.00 0.00 66.70 63.84 2no8 h VAL 19 Cb 0.26 1.86 -0.02 0.00 -2.01 0.00 0.00 31.29 31.38 2no8 h VAL 19 CO -0.26 0.60 0.06 0.11 -1.01 0.00 0.00 177.57 177.07 2no8 h LYS 20 N 0.52 0.87 -0.67 4.17 1.57 -1.49 -1.03 116.57 120.50 2no8 h LYS 20 Ca -0.02 -0.25 -0.02 0.00 -1.87 0.00 0.00 60.65 58.49 2no8 h LYS 20 Cb 1.27 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.45 2no8 h LYS 20 CO 0.13 0.87 0.33 -0.22 -0.57 0.00 0.00 179.45 180.00 2no8 h LYS 21 N 0.75 0.95 -0.36 3.15 3.64 0.05 -1.09 116.57 123.66 2no8 h LYS 21 Ca 0.15 -0.12 -0.15 0.00 -1.27 0.00 0.00 60.65 59.26 2no8 h LYS 21 Cb 0.44 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 2no8 h LYS 21 CO 0.01 0.73 -0.36 0.82 -2.27 0.00 0.00 179.45 178.38 2no8 h ILE 22 N 0.95 1.28 -0.13 2.00 2.04 -0.68 -0.03 117.51 122.94 2no8 h ILE 22 Ca 0.24 -1.54 -0.03 0.00 1.00 0.00 0.00 64.86 64.52 2no8 h ILE 22 Cb 0.09 1.44 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 2no8 h ILE 22 CO -0.03 0.51 -0.07 0.00 0.00 0.00 0.00 178.15 178.56 2no8 n ARG 24 N -4.35 2.62 0.00 0.00 1.85 -0.49 -4.66 116.66 111.63 2no8 n ARG 24 Ca -0.01 -2.48 0.00 0.00 -1.00 0.00 0.00 57.85 54.36 2no8 n ARG 24 Cb 0.21 -1.55 0.00 0.00 -1.05 0.00 0.00 32.46 30.07 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 1.58 2.08 0.14 2.89 0.00 -0.04 -3.96 120.51 123.21 2no8 n ALA 25 Ca 0.22 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.52 2no8 n ALA 25 Cb 0.61 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.99 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 0.32 -0.66 0.00 0.00 4.39 -1.83 -3.16 114.58 113.65 2no8 h GLU 26 Ca 0.00 0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.75 2no8 h GLU 26 Cb 0.40 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 2no8 h GLU 26 CO 0.00 -0.44 0.00 0.41 -1.16 0.00 0.00 179.01 177.82 2no8 n GLY 27 N -1.47 1.62 0.31 -3.84 0.00 -1.25 -1.24 105.19 99.32 2no8 n GLY 27 Ca -0.08 0.54 -0.11 0.00 0.00 0.00 0.00 46.02 46.36 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 0.00 -0.72 -2.56 4.61 0.00 -1.97 -3.48 119.26 115.13 2no8 h ALA 28 Ca 0.00 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.86 2no8 h ALA 28 Cb 0.00 0.28 -0.09 0.00 0.00 0.00 0.00 17.79 17.98 2no8 h ALA 28 CO 0.00 -0.68 0.39 0.99 0.00 0.00 0.00 179.25 179.96 2no8 s THR 29 N -3.96 0.00 -2.00 0.00 2.01 -0.37 -5.02 115.64 106.30 2no8 s THR 29 Ca -0.11 -0.51 0.04 0.00 0.31 0.00 0.00 61.69 61.42 2no8 s THR 29 Cb 0.01 -1.65 0.11 0.00 0.01 0.00 0.00 72.50 70.98 2no8 s THR 29 CO 0.33 0.00 0.62 -1.84 -0.69 0.00 0.00 174.62 173.04 2no8 n GLU 30 N -0.41 0.35 0.24 4.92 0.28 -1.24 -1.00 120.64 123.78 2no8 n GLU 30 Ca -0.08 0.00 0.10 0.00 -0.16 0.00 0.00 57.16 57.02 2no8 n GLU 30 Cb 0.61 -1.18 0.59 0.00 1.43 0.00 0.00 31.44 32.89 2no8 n GLU 30 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2no8 h GLU 31 N 0.00 0.00 -0.12 3.44 4.11 -1.88 -1.30 114.58 118.83 2no8 h GLU 31 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.37 2no8 h GLU 31 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2no8 h GLU 31 CO 0.00 0.20 -0.16 0.22 0.07 0.00 0.00 179.01 179.33 2no8 h ASP 32 N 0.00 0.35 -0.05 3.06 3.58 -1.28 -2.43 116.42 119.64 2no8 h ASP 32 Ca -0.00 -0.52 0.04 0.00 0.42 0.00 0.00 57.03 56.97 2no8 h ASP 32 Cb 0.50 -0.10 -0.06 0.00 1.72 0.00 0.00 39.33 41.39 2no8 h ASP 32 CO 0.03 0.80 -0.32 -0.78 -2.88 0.00 0.00 179.24 176.08 2no8 h ASP 33 N -0.09 -0.99 0.20 2.28 1.82 -1.43 -1.71 116.42 116.50 2no8 h ASP 33 Ca 0.01 0.13 -0.06 0.00 -0.39 0.00 0.00 57.03 56.73 2no8 h ASP 33 Cb 0.72 0.41 -0.01 0.00 0.68 0.00 0.00 39.33 41.12 2no8 h ASP 33 CO 0.04 -0.38 -0.26 -0.55 -1.61 0.00 0.00 179.24 176.49 2no8 h ASN 34 N -0.45 0.09 0.43 2.28 7.08 -1.24 -1.73 115.58 122.05 2no8 h ASN 34 Ca 0.07 -0.02 -0.27 0.00 -3.08 0.00 0.00 56.30 53.00 2no8 h ASN 34 Cb 0.56 -0.02 0.01 0.00 -2.08 0.00 0.00 38.32 36.78 2no8 h ASN 34 CO -0.30 0.35 -1.17 0.07 -2.08 0.00 0.00 177.43 174.30 2no8 h LYS 35 N 0.09 0.39 0.02 4.14 2.10 -1.23 -2.79 116.57 119.29 2no8 h LYS 35 Ca 0.01 -0.56 0.01 0.00 -2.00 0.00 0.00 60.65 58.12 2no8 h LYS 35 Cb 0.51 0.19 -0.01 0.00 -0.90 0.00 0.00 32.23 32.01 2no8 h LYS 35 CO 0.04 1.23 -0.06 -0.07 -2.00 0.00 0.00 179.45 178.59 2no8 h LEU 36 N 0.16 -0.16 -0.61 7.07 3.38 -0.79 0.56 115.31 124.93 2no8 h LEU 36 Ca -0.14 0.02 0.08 0.00 0.09 0.00 0.00 57.88 57.94 2no8 h LEU 36 Cb 1.85 0.06 -0.07 0.00 0.09 0.00 0.00 40.66 42.60 2no8 h LEU 36 CO 0.20 -0.09 0.26 0.58 0.09 0.00 0.00 178.44 179.49 2no8 h VAL 37 N -0.11 0.83 -0.04 1.22 2.07 -1.39 0.59 116.25 119.43 2no8 h VAL 37 Ca 0.02 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 2no8 h VAL 37 Cb 0.13 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 2no8 h VAL 37 CO -0.04 0.09 0.01 0.03 0.02 0.00 0.00 177.57 177.68 2no8 h ARG 38 N 0.48 0.05 -0.09 1.57 3.08 -1.12 0.24 114.38 118.59 2no8 h ARG 38 Ca 0.30 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 60.24 2no8 h ARG 38 Cb 0.32 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 2no8 h ARG 38 CO -0.26 0.21 -0.41 1.05 -1.07 0.00 0.00 179.97 179.49 2no8 h GLU 39 N -0.11 0.19 0.00 0.04 4.11 -0.51 -2.69 114.58 115.61 2no8 h GLU 39 Ca 0.01 -0.09 -0.24 0.00 0.07 0.00 0.00 59.36 59.12 2no8 h GLU 39 Cb 0.18 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.43 2no8 h GLU 39 CO -0.00 0.57 -0.97 0.74 0.07 0.00 0.00 179.01 179.42 2no8 h PHE 40 N 0.16 0.71 0.00 2.06 0.04 -0.74 -3.25 116.94 115.93 2no8 h PHE 40 Ca 0.01 -0.39 0.00 0.00 2.80 0.00 0.00 57.97 60.39 2no8 h PHE 40 Cb 0.79 -0.08 0.00 0.00 2.20 0.00 0.00 35.95 38.86 2no8 h PHE 40 CO 0.01 1.22 0.00 0.93 -0.60 0.00 0.00 178.31 179.87 2no8 h GLU 41 N 0.27 0.00 0.06 1.51 4.39 -0.20 -1.24 114.58 119.37 2no8 h GLU 41 Ca -0.09 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.35 2no8 h GLU 41 Cb 1.61 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.25 2no8 h GLU 41 CO 0.17 0.00 -1.25 -0.09 -1.16 0.00 0.00 179.01 176.69 2no8 h ARG 42 N 0.00 0.13 -0.05 2.33 2.43 -1.53 0.40 114.38 118.10 2no8 h ARG 42 Ca 0.00 -0.22 -0.06 0.00 -0.81 0.00 0.00 59.98 58.88 2no8 h ARG 42 Cb 0.29 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2no8 h ARG 42 CO 0.00 1.04 -0.27 -0.07 -1.51 0.00 0.00 179.97 179.16 2no8 h LEU 43 N 0.04 0.08 0.03 3.80 3.38 -1.28 -3.06 115.31 118.30 2no8 h LEU 43 Ca -0.12 -0.02 -0.35 0.00 0.09 0.00 0.00 57.88 57.48 2no8 h LEU 43 Cb 1.90 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 42.58 2no8 h LEU 43 CO 0.15 0.35 -2.10 0.35 0.09 0.00 0.00 178.44 177.29 2no8 n THR 44 N -4.19 1.58 -2.89 0.22 -2.24 -0.91 -4.50 114.28 101.34 2no8 n THR 44 Ca -0.02 -0.73 -0.22 0.00 -2.27 0.00 0.00 64.05 60.81 2no8 n THR 44 Cb 0.34 -1.17 0.02 0.00 -2.10 0.00 0.00 70.33 67.42 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 -3.14 -4.08 -2.99 -0.78 1.02 0.13 -4.93 120.64 105.87 2no8 n GLU 45 Ca -0.30 0.90 -0.40 0.00 -0.02 0.00 0.00 57.16 57.34 2no8 n GLU 45 Cb 1.06 -5.71 -0.05 0.00 -0.02 0.00 0.00 31.44 26.71 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 -3.13 3.80 0.10 -0.32 2.46 -1.22 -4.97 115.29 112.01 2no8 s HIS 46 Ca 0.24 1.53 -0.22 0.00 0.47 0.00 0.00 55.06 57.08 2no8 s HIS 46 Cb -0.11 -2.79 -0.12 0.00 -0.13 0.00 0.00 32.58 29.43 2no8 s HIS 46 CO 0.29 0.37 1.74 -1.00 -2.47 0.00 0.00 174.74 173.67 2no8 h PRO 47 N 5.15 0.04 -0.22 2.88 0.13 -1.94 -3.08 132.00 134.96 2no8 h PRO 47 Ca -0.45 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 2no8 h PRO 47 Cb 1.21 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.29 2no8 h PRO 47 CO 0.69 0.03 -0.06 -0.25 -0.23 0.00 0.00 178.00 178.17 2no8 n ASP 48 N -5.09 2.94 -0.11 1.44 8.00 -1.26 -4.67 116.55 117.80 2no8 n ASP 48 Ca -0.06 -3.36 -0.08 0.00 0.71 0.00 0.00 54.79 52.00 2no8 n ASP 48 Cb 0.05 -0.55 0.01 0.00 -0.02 0.00 0.00 41.12 40.60 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 1.12 0.52 0.97 0.44 0.00 -1.94 0.54 103.07 104.72 2no8 h GLY 49 Ca 0.08 -0.17 -0.06 0.00 0.00 0.00 0.00 47.33 47.18 2no8 h GLY 49 CO 0.22 0.15 0.05 1.48 0.00 0.00 0.00 176.54 178.44 2no8 h SER 50 N 0.45 0.75 -0.87 0.19 4.64 -1.83 -2.55 113.55 114.33 2no8 h SER 50 Ca 0.15 -0.27 0.09 0.00 -0.47 0.00 0.00 61.79 61.29 2no8 h SER 50 Cb 0.00 -0.20 -0.06 0.00 -0.31 0.00 0.00 62.40 61.83 2no8 h SER 50 CO -0.07 0.84 0.56 0.44 -0.87 0.00 0.00 176.83 177.73 2no8 h ASP 51 N 0.64 0.78 -0.99 4.97 5.19 -1.66 -2.11 116.42 123.24 2no8 h ASP 51 Ca 0.14 0.02 0.16 0.00 -0.62 0.00 0.00 57.03 56.73 2no8 h ASP 51 Cb 0.42 -0.14 -0.10 0.00 0.18 0.00 0.00 39.33 39.69 2no8 h ASP 51 CO 0.01 0.46 0.60 -0.07 -3.12 0.00 0.00 179.24 177.13 2no8 h LEU 52 N 0.86 0.81 0.16 1.55 3.38 0.48 0.46 115.31 123.02 2no8 h LEU 52 Ca 0.40 0.08 -0.32 0.00 0.09 0.00 0.00 57.88 58.13 2no8 h LEU 52 Cb 0.40 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.08 2no8 h LEU 52 CO -0.17 0.35 -1.59 0.40 0.09 0.00 0.00 178.44 177.52 2no8 h ILE 53 N 0.83 1.00 0.00 1.22 2.04 -1.44 -3.38 117.51 117.79 2no8 h ILE 53 Ca 0.54 -2.48 -0.22 0.00 1.00 0.00 0.00 64.86 63.70 2no8 h ILE 53 Cb 0.73 2.77 -0.03 0.00 -0.74 0.00 0.00 36.82 39.55 2no8 h ILE 53 CO -0.34 0.80 -1.15 1.88 0.00 0.00 0.00 178.15 179.35 2no8 h TYR 54 N -0.05 0.00 -3.78 1.37 0.05 -0.90 -3.47 116.97 110.20 2no8 h TYR 54 Ca -0.32 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.34 2no8 h TYR 54 Cb 1.97 0.00 -0.17 0.00 1.01 0.00 0.00 36.73 39.54 2no8 h TYR 54 CO 0.12 0.92 -0.51 0.71 -1.05 0.00 0.00 178.16 178.35 2no8 s TYR 55 N -2.72 0.19 0.68 4.88 2.02 0.16 -5.07 117.35 117.48 2no8 s TYR 55 Ca -0.00 -0.48 -0.11 0.00 -0.37 0.00 0.00 57.07 56.10 2no8 s TYR 55 Cb 0.09 -0.13 -0.00 0.00 -0.40 0.00 0.00 41.96 41.52 2no8 s TYR 55 CO 0.81 -0.38 1.06 -1.25 -1.57 0.00 0.00 175.55 174.22 2no8 s PRO 56 N -2.65 3.02 0.00 -1.71 0.04 -1.26 -4.13 135.00 128.31 2no8 s PRO 56 Ca -0.05 0.98 0.00 0.00 0.04 0.00 0.00 61.00 61.97 2no8 s PRO 56 Cb -0.01 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2no8 s PRO 56 CO -0.05 -1.03 0.00 0.54 0.04 0.00 0.00 177.00 176.50 2no8 n ARG 57 N -2.97 0.00 0.01 4.56 1.74 -1.26 -4.99 116.66 113.75 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 0.53 0.00 -0.00 0.00 -1.02 0.00 0.00 32.46 31.97 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 0.20 -0.47 0.55 -0.08 -1.26 -4.86 116.55 110.63 2no8 n ASP 58 Ca 0.00 0.03 0.09 0.00 -1.51 0.00 0.00 54.79 53.40 2no8 n ASP 58 Cb 0.00 -0.07 0.01 0.00 2.34 0.00 0.00 41.12 43.39 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2no8 n ASP 59 N -2.68 1.92 -4.68 1.67 5.75 -1.26 -4.98 116.55 112.29 2no8 n ASP 59 Ca -0.00 -1.46 -0.46 0.00 -0.01 0.00 0.00 54.79 52.86 2no8 n ASP 59 Cb 0.00 0.42 -0.04 0.00 -1.03 0.00 0.00 41.12 40.47 2no8 n ASP 59 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 2no8 n ARG 60 N 0.06 2.35 -1.69 0.11 0.00 -1.26 -4.87 116.66 111.35 2no8 n ARG 60 Ca 0.08 0.85 -0.45 0.00 -0.00 0.00 0.00 57.85 58.34 2no8 n ARG 60 Cb 0.41 -2.69 -0.04 0.00 0.00 0.00 0.00 32.46 30.14 2no8 n ARG 60 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.63 175.72 2no8 n GLU 61 N 5.40 2.45 -2.92 -0.14 4.07 -1.26 -4.76 120.64 123.48 2no8 n GLU 61 Ca 0.20 0.89 -0.44 0.00 -0.06 0.00 0.00 57.16 57.75 2no8 n GLU 61 Cb 0.32 -2.72 0.00 0.00 -0.06 0.00 0.00 31.44 28.98 2no8 n GLU 61 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2no8 n ASP 62 N 4.55 5.33 -3.77 4.31 2.03 -1.26 -3.94 116.55 123.80 2no8 n ASP 62 Ca 0.18 -3.04 -0.12 0.00 0.52 0.00 0.00 54.79 52.33 2no8 n ASP 62 Cb 0.32 -1.50 -0.08 0.00 -0.72 0.00 0.00 41.12 39.14 2no8 n ASP 62 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2no8 s SER 63 N 1.93 -0.11 0.28 1.67 0.01 -1.26 -4.95 113.70 111.27 2no8 s SER 63 Ca 0.39 -0.17 0.02 0.00 1.31 0.00 0.00 55.95 57.50 2no8 s SER 63 Cb -0.02 0.33 0.61 0.00 0.21 0.00 0.00 66.02 67.16 2no8 s SER 63 CO -0.01 -0.57 1.79 -0.65 0.41 0.00 0.00 173.24 174.21 2no8 h PRO 64 N 3.39 0.75 -0.59 12.44 0.11 -1.94 0.08 132.00 146.24 2no8 h PRO 64 Ca -0.31 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.68 2no8 h PRO 64 Cb 1.19 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.11 2no8 h PRO 64 CO 0.45 0.50 0.09 1.49 -0.21 0.00 0.00 178.00 180.32 2no8 h GLU 65 N 0.77 0.95 0.00 1.05 4.81 -1.93 -2.78 114.58 117.45 2no8 h GLU 65 Ca 0.51 -0.23 -0.08 0.00 -0.13 0.00 0.00 59.36 59.43 2no8 h GLU 65 Cb 0.70 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2no8 h GLU 65 CO -0.34 0.88 -0.37 0.78 -0.73 0.00 0.00 179.01 179.23 2no8 h GLY 66 N 1.02 0.00 1.11 1.92 0.00 -1.22 0.32 103.07 106.22 2no8 h GLY 66 Ca 0.18 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.34 2no8 h GLY 66 CO 0.01 0.00 -0.51 -2.22 0.00 0.00 0.00 176.54 173.82 2no8 h ILE 67 N 0.00 1.28 -0.65 2.60 2.04 -1.05 -1.97 117.51 119.77 2no8 h ILE 67 Ca -0.00 -1.69 -0.06 0.00 1.00 0.00 0.00 64.86 64.11 2no8 h ILE 67 Cb 0.76 1.63 -0.03 0.00 -0.74 0.00 0.00 36.82 38.45 2no8 h ILE 67 CO 0.05 0.55 0.18 0.58 0.00 0.00 0.00 178.15 179.50 2no8 h VAL 68 N 0.63 1.25 -0.56 1.67 2.07 -1.12 -2.59 116.25 117.60 2no8 h VAL 68 Ca 0.02 -0.90 0.09 0.00 0.82 0.00 0.00 66.70 66.73 2no8 h VAL 68 Cb 1.12 0.61 -0.07 0.00 -1.52 0.00 0.00 31.29 31.42 2no8 h VAL 68 CO 0.11 0.34 0.17 0.50 0.02 0.00 0.00 177.57 178.72 2no8 h LYS 69 N 0.94 0.32 -0.22 1.57 1.63 -0.28 0.47 116.57 121.01 2no8 h LYS 69 Ca 0.20 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.98 2no8 h LYS 69 Cb 0.33 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.88 2no8 h LYS 69 CO -0.00 0.21 0.13 1.49 -3.45 0.00 0.00 179.45 177.83 2no8 h GLU 70 N 0.33 0.31 -0.70 1.90 4.57 -0.99 0.29 114.58 120.30 2no8 h GLU 70 Ca 0.28 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.45 2no8 h GLU 70 Cb 0.36 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.85 2no8 h GLU 70 CO -0.31 0.27 0.45 0.82 -1.18 0.00 0.00 179.01 179.05 2no8 h ILE 71 N 0.26 1.14 0.93 2.32 2.04 -1.06 -0.95 117.51 122.18 2no8 h ILE 71 Ca 0.08 -0.31 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 2no8 h ILE 71 Cb 0.05 0.16 0.01 0.00 -0.74 0.00 0.00 36.82 36.29 2no8 h ILE 71 CO -0.01 0.16 -0.48 0.50 0.00 0.00 0.00 178.15 178.32 2no8 h LYS 72 N 0.90 -1.24 -0.35 2.37 1.63 0.62 -0.50 116.57 120.00 2no8 h LYS 72 Ca 0.27 0.08 -0.06 0.00 -0.85 0.00 0.00 60.65 60.09 2no8 h LYS 72 Cb -0.04 0.28 -0.02 0.00 -0.60 0.00 0.00 32.23 31.85 2no8 h LYS 72 CO -0.08 -0.83 -0.06 0.93 -3.45 0.00 0.00 179.45 175.96 2no8 h GLU 73 N -1.29 0.57 0.02 1.90 4.39 -0.38 0.13 114.58 119.92 2no8 h GLU 73 Ca -0.13 -0.15 -0.00 0.00 0.34 0.00 0.00 59.36 59.43 2no8 h GLU 73 Cb 1.00 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.58 2no8 h GLU 73 CO 0.19 0.64 -0.01 2.35 -1.16 0.00 0.00 179.01 181.01 2no8 h TRP 74 N 0.54 -0.03 -0.28 4.33 7.01 -1.16 -1.88 115.95 124.48 2no8 h TRP 74 Ca 0.11 -0.00 -0.10 0.00 2.11 0.00 0.00 58.89 61.01 2no8 h TRP 74 Cb 0.43 0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.48 2no8 h TRP 74 CO 0.02 0.39 -0.24 0.00 -2.79 0.00 0.00 178.44 175.82 2no8 h ARG 75 N -0.45 0.53 -0.55 2.65 3.08 -0.73 0.83 114.38 119.75 2no8 h ARG 75 Ca -0.00 -0.20 -0.05 0.00 0.07 0.00 0.00 59.98 59.80 2no8 h ARG 75 Cb 0.43 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 2no8 h ARG 75 CO 0.00 0.74 0.14 0.00 -1.07 0.00 0.00 179.97 179.78 2no8 h ALA 76 N 1.27 1.22 0.10 0.04 0.00 -0.75 0.20 119.26 121.35 2no8 h ALA 76 Ca 0.07 -0.20 -0.28 0.00 0.00 0.00 0.00 54.91 54.50 2no8 h ALA 76 Cb 0.67 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2no8 h ALA 76 CO 0.05 0.54 -1.36 0.00 0.00 0.00 0.00 179.25 178.48 2no8 h ALA 77 N 1.35 0.24 0.00 0.00 0.00 -0.71 -3.19 119.26 116.96 2no8 h ALA 77 Ca 0.18 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 54.07 2no8 h ALA 77 Cb 0.28 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2no8 h ALA 77 CO -0.00 1.11 -0.14 0.09 0.00 0.00 0.00 179.25 180.31 2no8 n ASN 78 N -3.45 0.22 -1.66 0.00 3.02 0.23 -4.93 115.26 108.70 2no8 n ASN 78 Ca -0.11 0.32 -0.09 0.00 -0.03 0.00 0.00 54.58 54.67 2no8 n ASN 78 Cb 1.02 -0.33 0.03 0.00 -0.61 0.00 0.00 39.78 39.89 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 1.47 0.37 0.00 7.41 0.00 0.10 -5.04 105.19 109.51 2no8 n GLY 79 Ca 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.21 1.01 -1.13 1.61 4.76 0.49 -5.03 118.16 117.66 2no8 n LYS 80 Ca 0.00 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.15 2no8 n LYS 80 Cb 0.52 0.00 0.20 0.00 -1.84 0.00 0.00 35.03 33.91 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 2.10 0.00 4.39 0.15 -1.26 -4.84 113.70 113.23 2no8 s SER 81 Ca 0.00 1.04 0.00 0.00 0.70 0.00 0.00 55.95 57.69 2no8 s SER 81 Cb 0.00 -1.61 0.00 0.00 -1.71 0.00 0.00 66.02 62.70 2no8 s SER 81 CO 0.00 -3.44 0.00 0.61 1.20 0.00 0.00 173.24 171.61 2no8 n GLY 82 N -1.00 5.01 3.56 9.45 0.00 -1.26 -4.73 105.19 116.23 2no8 n GLY 82 Ca 0.07 -1.86 -0.26 0.00 0.00 0.00 0.00 46.02 43.97 2no8 n GLY 82 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2no8 s PHE 83 N 1.97 2.15 0.32 1.61 0.08 -1.26 -4.04 117.98 118.81 2no8 s PHE 83 Ca 0.00 -0.88 -0.14 0.00 0.12 0.00 0.00 56.93 56.03 2no8 s PHE 83 Cb 0.00 -1.51 -0.09 0.00 -0.57 0.00 0.00 43.02 40.86 2no8 s PHE 83 CO 0.00 0.18 0.72 0.21 -0.10 0.00 0.00 175.22 176.23 2no8 s LYS 84 N -3.80 3.96 0.00 0.44 2.20 0.75 -4.87 119.74 118.41 2no8 s LYS 84 Ca 0.31 0.61 0.14 0.00 -0.36 0.00 0.00 55.97 56.66 2no8 s LYS 84 Cb 0.08 -2.45 0.22 0.00 -1.51 0.00 0.00 37.83 34.17 2no8 s LYS 84 CO 0.15 0.16 1.09 0.00 -0.36 0.00 0.00 175.35 176.38 2no8 n GLN 85 N -0.43 0.00 0.00 4.03 10.64 -1.26 -1.88 117.38 128.48 2no8 n GLN 85 Ca 0.03 -1.52 0.00 0.00 -1.83 0.00 0.00 57.00 53.68 2no8 n GLN 85 Cb 0.53 -0.24 0.00 0.00 -0.86 0.00 0.00 30.24 29.67 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64