#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 2.51 0.84 4.31 1.43 -1.26 -5.12 118.68 121.39 2no8 s LEU 3 Ca 0.00 -0.29 -0.10 0.00 -1.03 0.00 0.00 54.13 52.71 2no8 s LEU 3 Cb 0.00 -1.49 0.14 0.00 0.03 0.00 0.00 46.19 44.88 2no8 s LEU 3 CO 0.00 0.33 1.17 -1.59 0.23 0.00 0.00 176.35 176.49 2no8 s LYS 4 N -0.66 1.34 0.00 1.70 0.00 -1.26 -5.03 119.74 115.83 2no8 s LYS 4 Ca 0.10 -0.46 0.00 0.00 0.00 0.00 0.00 55.97 55.61 2no8 s LYS 4 Cb -0.11 -2.03 0.00 0.00 0.00 0.00 0.00 37.83 35.70 2no8 s LYS 4 CO 0.00 -1.87 0.00 -2.39 0.00 0.00 0.00 175.35 171.09 2no8 n HIS 5 N -3.34 0.00 -4.24 1.78 1.44 -1.26 -5.10 115.22 104.49 2no8 n HIS 5 Ca 0.13 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.70 2no8 n HIS 5 Cb 0.60 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.61 2no8 n HIS 5 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 2no8 s SER 6 N -1.76 0.62 0.34 4.39 1.04 -1.26 -5.03 113.70 112.04 2no8 s SER 6 Ca 0.00 -1.43 0.09 0.00 0.48 0.00 0.00 55.95 55.09 2no8 s SER 6 Cb 0.00 0.35 0.62 0.00 0.10 0.00 0.00 66.02 67.09 2no8 s SER 6 CO 0.00 -0.84 1.79 -0.29 0.98 0.00 0.00 173.24 174.89 2no8 h ILE 7 N 2.49 1.26 -0.03 -1.02 2.10 -1.92 -2.55 117.51 117.85 2no8 h ILE 7 Ca -0.35 -1.26 0.00 0.00 1.08 0.00 0.00 64.86 64.33 2no8 h ILE 7 Cb 1.25 1.56 0.00 0.00 -1.09 0.00 0.00 36.82 38.54 2no8 h ILE 7 CO 0.53 0.37 0.00 -0.24 -1.08 0.00 0.00 178.15 177.74 2no8 n SER 8 N -4.11 0.47 0.10 2.19 2.88 -1.26 -1.49 113.62 112.40 2no8 n SER 8 Ca -0.01 -1.39 0.12 0.00 -1.33 0.00 0.00 58.87 56.25 2no8 n SER 8 Cb 0.40 -0.02 0.07 0.00 -0.75 0.00 0.00 64.21 63.92 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 0.65 0.00 -3.50 -3.46 3.58 -1.81 -3.19 116.42 108.69 2no8 h ASP 9 Ca 0.00 -0.07 -0.53 0.00 0.42 0.00 0.00 57.03 56.85 2no8 h ASP 9 Cb 0.14 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.16 2no8 h ASP 9 CO 0.00 0.04 0.13 -0.31 -2.88 0.00 0.00 179.24 176.22 2no8 s TYR 10 N -3.28 3.82 0.89 0.28 1.51 -0.55 -4.79 117.35 115.23 2no8 s TYR 10 Ca 0.03 1.52 -0.13 0.00 -1.01 0.00 0.00 57.07 57.47 2no8 s TYR 10 Cb 0.10 -2.69 0.13 0.00 -0.11 0.00 0.00 41.96 39.40 2no8 s TYR 10 CO 0.75 0.47 1.19 0.95 -1.11 0.00 0.00 175.55 177.80 2no8 s THR 11 N -1.25 1.98 0.25 -0.71 -4.23 -1.26 0.27 115.64 110.68 2no8 s THR 11 Ca 0.37 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.83 2no8 s THR 11 Cb -0.21 -2.88 0.23 0.00 1.34 0.00 0.00 72.50 70.98 2no8 s THR 11 CO 0.24 0.00 1.88 -0.08 -0.54 0.00 0.00 174.62 176.11 2no8 h GLU 12 N -1.40 1.07 -0.35 3.99 4.81 -1.88 -0.87 114.58 119.94 2no8 h GLU 12 Ca -0.47 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 58.69 2no8 h GLU 12 Cb 1.31 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 30.43 2no8 h GLU 12 CO 0.58 0.71 0.20 0.00 -0.73 0.00 0.00 179.01 179.77 2no8 h ALA 13 N 1.40 0.45 -0.30 2.92 0.00 -1.92 0.31 119.26 122.12 2no8 h ALA 13 Ca 0.38 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 2no8 h ALA 13 Cb 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2no8 h ALA 13 CO -0.15 -0.03 -0.20 0.93 0.00 0.00 0.00 179.25 179.80 2no8 h GLU 14 N 0.45 0.55 -0.03 0.00 5.08 -1.78 0.25 114.58 119.10 2no8 h GLU 14 Ca 0.13 -0.19 -0.18 0.00 -1.00 0.00 0.00 59.36 58.11 2no8 h GLU 14 Cb 0.04 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2no8 h GLU 14 CO -0.02 0.72 -0.78 0.35 -1.00 0.00 0.00 179.01 178.28 2no8 h PHE 15 N 0.49 0.37 0.00 4.33 3.57 -0.88 -2.45 116.94 122.38 2no8 h PHE 15 Ca 0.08 -0.18 -0.04 0.00 3.53 0.00 0.00 57.97 61.36 2no8 h PHE 15 Cb 0.62 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 2no8 h PHE 15 CO 0.02 0.94 -0.18 1.25 -2.23 0.00 0.00 178.31 178.11 2no8 h LEU 16 N 0.17 0.00 -0.33 0.59 6.46 0.31 0.24 115.31 122.75 2no8 h LEU 16 Ca -0.03 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 2no8 h LEU 16 Cb 1.36 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.29 2no8 h LEU 16 CO 0.12 0.18 0.00 -0.33 -0.62 0.00 0.00 178.44 177.80 2no8 h GLU 17 N 0.00 0.00 -0.30 1.25 5.08 -0.68 -3.02 114.58 116.91 2no8 h GLU 17 Ca -0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2no8 h GLU 17 Cb 0.63 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 2no8 h GLU 17 CO 0.02 0.00 -0.06 0.27 -1.00 0.00 0.00 179.01 178.24 2no8 h PHE 18 N 0.00 -0.13 -0.12 4.33 -0.00 -0.04 0.36 116.94 121.34 2no8 h PHE 18 Ca 0.00 0.03 -0.13 0.00 -0.00 0.00 0.00 57.97 57.87 2no8 h PHE 18 Cb 0.84 0.10 0.00 0.00 -0.00 0.00 0.00 35.95 36.90 2no8 h PHE 18 CO 0.00 -0.11 -0.42 -0.24 -0.00 0.00 0.00 178.31 177.54 2no8 h VAL 19 N 0.02 1.37 -0.94 0.88 3.04 -1.60 -1.01 116.25 117.99 2no8 h VAL 19 Ca 0.14 -1.72 0.06 0.00 -1.01 0.00 0.00 66.70 64.17 2no8 h VAL 19 Cb 0.21 2.11 -0.06 0.00 -2.01 0.00 0.00 31.29 31.54 2no8 h VAL 19 CO -0.29 0.52 0.60 0.11 -1.01 0.00 0.00 177.57 177.50 2no8 h LYS 20 N 0.11 1.08 -0.18 4.17 1.57 -1.35 0.16 116.57 122.13 2no8 h LYS 20 Ca -0.02 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2no8 h LYS 20 Cb 1.05 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 2no8 h LYS 20 CO 0.09 0.71 0.11 -0.22 -0.57 0.00 0.00 179.45 179.57 2no8 h LYS 21 N 1.11 0.24 -0.72 3.15 3.64 -0.06 -0.70 116.57 123.23 2no8 h LYS 21 Ca 0.40 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.76 2no8 h LYS 21 Cb 0.14 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.87 2no8 h LYS 21 CO -0.16 0.21 0.43 0.82 -2.27 0.00 0.00 179.45 178.47 2no8 h ILE 22 N 0.20 1.21 -0.54 2.00 2.04 -0.16 0.45 117.51 122.71 2no8 h ILE 22 Ca 0.06 -0.46 0.06 0.00 1.00 0.00 0.00 64.86 65.53 2no8 h ILE 22 Cb 0.03 0.21 -0.06 0.00 -0.74 0.00 0.00 36.82 36.27 2no8 h ILE 22 CO -0.01 0.21 0.23 0.00 0.00 0.00 0.00 178.15 178.59 2no8 h ARG 24 N 0.44 0.00 -0.56 0.00 0.11 -0.60 -3.36 114.38 110.42 2no8 h ARG 24 Ca 0.25 0.00 -0.11 0.00 0.10 0.00 0.00 59.98 60.23 2no8 h ARG 24 Cb 0.24 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.25 2no8 h ARG 24 CO -0.22 0.33 0.11 0.00 0.10 0.00 0.00 179.97 180.30 2no8 n ALA 25 N -2.37 4.02 -0.32 0.08 0.00 0.15 -4.65 120.51 117.42 2no8 n ALA 25 Ca -0.08 -2.30 0.34 0.00 0.00 0.00 0.00 53.44 51.41 2no8 n ALA 25 Cb 0.83 -1.05 0.73 0.00 0.00 0.00 0.00 19.45 19.96 2no8 n ALA 25 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2no8 h GLU 26 N 2.68 0.03 0.00 0.00 4.11 -1.57 -3.40 114.58 116.43 2no8 h GLU 26 Ca 0.13 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.56 2no8 h GLU 26 Cb 1.99 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.23 2no8 h GLU 26 CO 0.53 0.02 0.00 0.41 0.07 0.00 0.00 179.01 180.04 2no8 n GLY 27 N -1.74 -0.72 0.08 1.06 0.00 -1.26 -2.56 105.19 100.05 2no8 n GLY 27 Ca 0.25 -1.23 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 2no8 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2no8 n ALA 28 N 3.79 0.57 -2.74 4.61 0.00 -1.26 -4.92 120.51 120.56 2no8 n ALA 28 Ca 0.00 -0.46 -0.27 0.00 0.00 0.00 0.00 53.44 52.71 2no8 n ALA 28 Cb 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 19.45 19.23 2no8 n ALA 28 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2no8 s THR 29 N -2.30 4.21 -1.12 0.00 -4.23 -1.26 -5.00 115.64 105.94 2no8 s THR 29 Ca -0.20 -1.13 0.10 0.00 -1.18 0.00 0.00 61.69 59.29 2no8 s THR 29 Cb 0.03 -3.11 0.11 0.00 1.34 0.00 0.00 72.50 70.88 2no8 s THR 29 CO 0.34 -0.05 1.28 -1.84 -0.54 0.00 0.00 174.62 173.81 2no8 n GLU 30 N -0.05 0.04 0.19 3.99 0.28 -1.26 -1.12 120.64 122.70 2no8 n GLU 30 Ca -0.09 0.29 0.03 0.00 -0.16 0.00 0.00 57.16 57.23 2no8 n GLU 30 Cb 0.54 -1.50 0.41 0.00 1.43 0.00 0.00 31.44 32.32 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 0.04 0.00 3.44 4.11 -1.94 0.44 114.58 120.67 2no8 h GLU 31 Ca 0.00 -0.01 -0.07 0.00 0.07 0.00 0.00 59.36 59.35 2no8 h GLU 31 Cb 0.15 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2no8 h GLU 31 CO 0.00 0.31 -0.32 0.22 0.07 0.00 0.00 179.01 179.29 2no8 h ASP 32 N 0.04 0.00 0.00 3.06 3.58 -1.32 0.27 116.42 122.05 2no8 h ASP 32 Ca 0.01 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.45 2no8 h ASP 32 Cb 0.49 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.54 2no8 h ASP 32 CO 0.04 0.32 -0.07 -0.78 -2.88 0.00 0.00 179.24 175.87 2no8 h ASP 33 N 0.00 0.00 -0.85 2.28 1.82 -1.17 -3.37 116.42 115.13 2no8 h ASP 33 Ca -0.00 -0.32 0.10 0.00 -0.39 0.00 0.00 57.03 56.42 2no8 h ASP 33 Cb 1.04 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.99 2no8 h ASP 33 CO 0.04 0.70 0.55 -1.13 -1.61 0.00 0.00 179.24 177.79 2no8 h ASN 34 N -1.00 0.72 -0.80 2.28 -1.24 -0.03 -0.85 115.58 114.66 2no8 h ASN 34 Ca -0.01 0.02 0.08 0.00 0.71 0.00 0.00 56.30 57.11 2no8 h ASN 34 Cb 0.38 -0.13 -0.05 0.00 0.73 0.00 0.00 38.32 39.25 2no8 h ASN 34 CO -0.01 0.42 0.53 0.07 -1.29 0.00 0.00 177.43 177.14 2no8 h LYS 35 N 0.79 0.77 0.05 6.67 2.10 -0.62 0.71 116.57 127.04 2no8 h LYS 35 Ca 0.40 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 59.00 2no8 h LYS 35 Cb 0.47 -0.17 0.00 0.00 -0.90 0.00 0.00 32.23 31.63 2no8 h LYS 35 CO -0.17 0.51 -0.02 -0.07 -2.00 0.00 0.00 179.45 177.70 2no8 h LEU 36 N 0.80 -0.05 -0.66 7.07 3.38 -1.33 -3.23 115.31 121.29 2no8 h LEU 36 Ca 0.36 -0.50 0.14 0.00 0.09 0.00 0.00 57.88 57.96 2no8 h LEU 36 Cb 0.36 0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.02 2no8 h LEU 36 CO -0.14 0.50 0.09 0.58 0.09 0.00 0.00 178.44 179.56 2no8 h VAL 37 N -0.63 0.53 -0.82 1.22 2.07 -0.81 -1.78 116.25 116.03 2no8 h VAL 37 Ca -0.01 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 2no8 h VAL 37 Cb 0.55 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 2no8 h VAL 37 CO 0.01 0.04 0.49 0.03 0.02 0.00 0.00 177.57 178.16 2no8 h ARG 38 N 0.20 1.12 -0.11 1.57 2.47 -0.98 0.27 114.38 118.92 2no8 h ARG 38 Ca 0.35 -0.11 -0.08 0.00 -1.26 0.00 0.00 59.98 58.89 2no8 h ARG 38 Cb 0.58 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 28.65 2no8 h ARG 38 CO -0.50 0.80 -0.28 1.05 0.56 0.00 0.00 179.97 181.60 2no8 h GLU 39 N 1.13 0.21 0.04 0.04 4.11 -1.34 -0.69 114.58 118.08 2no8 h GLU 39 Ca 0.29 -0.07 -0.27 0.00 0.07 0.00 0.00 59.36 59.39 2no8 h GLU 39 Cb -0.03 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 29.22 2no8 h GLU 39 CO -0.05 0.48 -1.08 0.74 0.07 0.00 0.00 179.01 179.17 2no8 h PHE 40 N 0.19 0.89 -0.36 2.06 0.04 -1.03 -2.02 116.94 116.70 2no8 h PHE 40 Ca 0.03 -0.51 0.00 0.00 2.80 0.00 0.00 57.97 60.28 2no8 h PHE 40 Cb 0.61 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.65 2no8 h PHE 40 CO 0.01 1.35 0.23 0.93 -0.60 0.00 0.00 178.31 180.23 2no8 h GLU 41 N 0.31 0.48 0.00 1.51 5.08 -0.08 -0.75 114.58 121.13 2no8 h GLU 41 Ca -0.13 -0.03 -0.14 0.00 -1.00 0.00 0.00 59.36 58.05 2no8 h GLU 41 Cb 1.74 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.86 2no8 h GLU 41 CO 0.20 0.33 -0.69 0.00 -1.00 0.00 0.00 179.01 177.85 2no8 h ARG 42 N 0.49 0.00 -0.05 2.33 3.08 -1.00 0.52 114.38 119.75 2no8 h ARG 42 Ca 0.13 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.97 2no8 h ARG 42 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2no8 h ARG 42 CO -0.03 0.69 -0.84 -0.07 -1.07 0.00 0.00 179.97 178.65 2no8 h LEU 43 N 0.00 0.58 0.04 3.04 3.38 -0.59 -3.33 115.31 118.43 2no8 h LEU 43 Ca -0.01 -0.42 -0.30 0.00 0.09 0.00 0.00 57.88 57.25 2no8 h LEU 43 Cb 1.26 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.80 2no8 h LEU 43 CO 0.09 1.19 -1.66 0.71 0.09 0.00 0.00 178.44 178.86 2no8 h THR 44 N 0.29 0.94 -1.06 0.22 1.35 -1.13 -3.42 112.91 110.11 2no8 h THR 44 Ca -0.06 -2.73 -0.24 0.00 -0.55 0.00 0.00 66.41 62.83 2no8 h THR 44 Cb 1.45 2.53 -0.06 0.00 -1.73 0.00 0.00 68.15 70.34 2no8 h THR 44 CO 0.15 0.66 -0.26 1.21 -0.25 0.00 0.00 175.52 177.03 2no8 n GLU 45 N -3.22 -0.89 -2.97 4.72 2.13 0.16 -4.99 120.64 115.59 2no8 n GLU 45 Ca -0.18 0.78 -0.41 0.00 0.66 0.00 0.00 57.16 58.02 2no8 n GLU 45 Cb 1.04 -4.86 -0.05 0.00 0.27 0.00 0.00 31.44 27.84 2no8 n GLU 45 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2no8 s HIS 46 N -2.51 3.39 0.07 4.31 2.46 -1.14 -4.95 115.29 116.93 2no8 s HIS 46 Ca 0.00 1.13 -0.25 0.00 0.47 0.00 0.00 55.06 56.40 2no8 s HIS 46 Cb 0.00 -2.94 -0.16 0.00 -0.13 0.00 0.00 32.58 29.35 2no8 s HIS 46 CO 0.00 -0.23 1.65 -1.00 -2.47 0.00 0.00 174.74 172.69 2no8 h PRO 47 N 7.42 -0.19 -0.65 2.88 0.13 -1.94 -2.63 132.00 137.03 2no8 h PRO 47 Ca -0.29 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2no8 h PRO 47 Cb 1.13 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2no8 h PRO 47 CO 0.82 -0.07 0.00 -0.25 -0.23 0.00 0.00 178.00 178.26 2no8 n ASP 48 N -5.15 5.01 -0.09 1.44 8.00 -1.26 -4.39 116.55 120.11 2no8 n ASP 48 Ca -0.09 -2.78 0.19 0.00 0.71 0.00 0.00 54.79 52.82 2no8 n ASP 48 Cb 0.13 -0.66 0.62 0.00 -0.02 0.00 0.00 41.12 41.18 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 4.19 0.30 0.61 0.44 0.00 -1.86 0.25 103.07 107.00 2no8 h GLY 49 Ca 0.00 -0.08 -0.18 0.00 0.00 0.00 0.00 47.33 47.07 2no8 h GLY 49 CO 0.42 0.02 -0.82 1.48 0.00 0.00 0.00 176.54 177.64 2no8 h SER 50 N 0.17 0.42 -0.12 0.19 4.64 -1.83 -3.34 113.55 113.68 2no8 h SER 50 Ca 0.32 -0.94 0.00 0.00 -0.47 0.00 0.00 61.79 60.70 2no8 h SER 50 Cb 1.02 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.97 2no8 h SER 50 CO -0.05 1.39 0.08 0.44 -0.87 0.00 0.00 176.83 177.82 2no8 h ASP 51 N -0.42 0.13 -0.45 4.97 5.19 -1.22 -0.11 116.42 124.51 2no8 h ASP 51 Ca -0.15 -0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.25 2no8 h ASP 51 Cb 1.60 -0.03 -0.02 0.00 0.18 0.00 0.00 39.33 41.06 2no8 h ASP 51 CO 0.12 0.09 0.27 -0.07 -3.12 0.00 0.00 179.24 176.54 2no8 h LEU 52 N 0.15 0.55 0.08 1.55 3.38 -0.73 0.61 115.31 120.90 2no8 h LEU 52 Ca 0.05 -0.03 -0.33 0.00 0.09 0.00 0.00 57.88 57.66 2no8 h LEU 52 Cb -0.00 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 2no8 h LEU 52 CO -0.01 0.43 -1.82 0.40 0.09 0.00 0.00 178.44 177.52 2no8 h ILE 53 N 0.63 0.78 0.04 1.22 2.04 -1.22 -3.39 117.51 117.61 2no8 h ILE 53 Ca 0.17 -2.54 -0.30 0.00 1.00 0.00 0.00 64.86 63.18 2no8 h ILE 53 Cb -0.02 2.51 -0.04 0.00 -0.74 0.00 0.00 36.82 38.53 2no8 h ILE 53 CO -0.03 0.73 -1.71 1.88 0.00 0.00 0.00 178.15 179.02 2no8 h TYR 54 N 0.04 0.15 -3.52 1.37 0.05 -0.90 -3.43 116.97 110.73 2no8 h TYR 54 Ca -0.35 -0.11 -0.63 0.00 0.05 0.00 0.00 58.73 57.70 2no8 h TYR 54 Cb 2.03 -0.01 -0.40 0.00 1.01 0.00 0.00 36.73 39.36 2no8 h TYR 54 CO 0.05 1.21 -0.74 0.71 -1.05 0.00 0.00 178.16 178.33 2no8 s TYR 55 N -2.60 2.93 0.28 4.88 2.02 0.21 -5.05 117.35 120.02 2no8 s TYR 55 Ca -0.09 -2.43 -0.27 0.00 -0.37 0.00 0.00 57.07 53.92 2no8 s TYR 55 Cb 0.08 -2.34 -0.15 0.00 -0.40 0.00 0.00 41.96 39.14 2no8 s TYR 55 CO 0.82 -0.90 0.68 -2.30 -1.57 0.00 0.00 175.55 172.27 2no8 n PRO 56 N 4.50 0.58 -1.49 -1.71 -0.02 -1.26 -4.33 135.00 131.27 2no8 n PRO 56 Ca -0.00 0.21 -0.34 0.00 -2.02 0.00 0.00 63.50 61.34 2no8 n PRO 56 Cb 0.42 -1.39 0.05 0.00 -0.02 0.00 0.00 33.50 32.56 2no8 n PRO 56 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2no8 n ARG 57 N 0.84 2.59 0.00 -0.52 5.12 -1.26 -4.71 116.66 118.72 2no8 n ARG 57 Ca 0.13 -3.10 0.00 0.00 -1.93 0.00 0.00 57.85 52.96 2no8 n ARG 57 Cb 0.31 -2.20 0.00 0.00 -1.16 0.00 0.00 32.46 29.41 2no8 n ARG 57 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2no8 n ASP 58 N -0.51 0.00 0.10 0.55 2.03 -1.26 -0.12 116.55 117.34 2no8 n ASP 58 Ca 0.55 0.07 -0.05 0.00 0.52 0.00 0.00 54.79 55.89 2no8 n ASP 58 Cb 0.50 -0.07 0.06 0.00 -0.72 0.00 0.00 41.12 40.89 2no8 n ASP 58 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2no8 h ASP 59 N 0.00 0.10 -1.15 1.67 5.19 -2.01 -3.45 116.42 116.77 2no8 h ASP 59 Ca 0.00 -0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 2no8 h ASP 59 Cb 0.05 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.53 2no8 h ASP 59 CO 0.00 0.82 0.00 -2.11 -3.12 0.00 0.00 179.24 174.83 2no8 n ARG 60 N -3.69 3.67 -2.47 3.56 1.85 0.83 -5.06 116.66 115.36 2no8 n ARG 60 Ca -0.02 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.41 2no8 n ARG 60 Cb 0.73 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 32.11 2no8 n ARG 60 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 2no8 s GLU 61 N 0.72 4.29 -0.80 2.89 2.56 -1.26 -4.91 118.70 122.18 2no8 s GLU 61 Ca 0.00 1.63 -0.12 0.00 0.00 0.00 0.00 54.97 56.48 2no8 s GLU 61 Cb 0.00 -3.67 0.21 0.00 2.00 0.00 0.00 34.13 32.68 2no8 s GLU 61 CO 0.00 -0.59 0.72 0.34 -0.56 0.00 0.00 175.26 175.18 2no8 s ASP 62 N 1.69 6.54 0.21 -1.70 2.15 -1.26 -3.90 116.67 120.40 2no8 s ASP 62 Ca 0.54 -2.73 -0.09 0.00 0.43 0.00 0.00 52.55 50.69 2no8 s ASP 62 Cb -0.22 -2.16 -0.01 0.00 -0.30 0.00 0.00 42.92 40.23 2no8 s ASP 62 CO 0.17 -0.54 0.35 -0.94 -0.17 0.00 0.00 175.17 174.04 2no8 s SER 63 N 1.91 -0.01 0.58 -0.34 1.04 -1.26 -4.94 113.70 110.69 2no8 s SER 63 Ca 0.18 -0.98 0.29 0.00 0.48 0.00 0.00 55.95 55.92 2no8 s SER 63 Cb -0.12 0.50 1.45 0.00 0.10 0.00 0.00 66.02 67.95 2no8 s SER 63 CO -0.08 -1.00 1.86 -0.65 0.98 0.00 0.00 173.24 174.35 2no8 h PRO 64 N 2.42 0.00 0.00 4.02 0.11 -1.93 0.24 132.00 136.86 2no8 h PRO 64 Ca -0.30 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 2no8 h PRO 64 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2no8 h PRO 64 CO 0.43 0.00 -0.15 0.93 -0.21 0.00 0.00 178.00 179.00 2no8 h GLU 65 N 0.00 0.00 0.00 1.05 5.08 -1.93 -3.23 114.58 115.56 2no8 h GLU 65 Ca 0.26 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.54 2no8 h GLU 65 Cb 1.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 2no8 h GLU 65 CO -0.00 0.93 -0.35 0.78 -1.00 0.00 0.00 179.01 179.37 2no8 h GLY 66 N -1.00 0.00 0.96 -3.84 0.00 -1.49 -2.09 103.07 95.62 2no8 h GLY 66 Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 2no8 h GLY 66 CO -0.02 0.00 0.20 -2.22 0.00 0.00 0.00 176.54 174.49 2no8 h ILE 67 N 0.00 1.15 -0.41 2.60 2.04 -0.67 -2.10 117.51 120.12 2no8 h ILE 67 Ca -0.00 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.42 2no8 h ILE 67 Cb 0.78 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 2no8 h ILE 67 CO 0.05 0.16 0.14 0.58 0.00 0.00 0.00 178.15 179.08 2no8 h VAL 68 N 0.48 1.17 -0.34 1.67 2.07 -1.44 -0.52 116.25 119.33 2no8 h VAL 68 Ca 0.13 -0.55 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 2no8 h VAL 68 Cb 0.08 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2no8 h VAL 68 CO -0.02 0.21 0.14 0.50 0.02 0.00 0.00 177.57 178.42 2no8 h LYS 69 N 0.58 0.47 0.01 1.57 1.63 -0.94 0.28 116.57 120.18 2no8 h LYS 69 Ca 0.14 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.89 2no8 h LYS 69 Cb 0.16 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.70 2no8 h LYS 69 CO -0.01 0.38 -0.01 1.49 -3.45 0.00 0.00 179.45 177.86 2no8 h GLU 70 N 0.47 -0.02 -0.58 1.90 4.57 -0.43 0.20 114.58 120.68 2no8 h GLU 70 Ca 0.12 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.32 2no8 h GLU 70 Cb 0.09 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.64 2no8 h GLU 70 CO -0.01 0.21 0.36 0.82 -1.18 0.00 0.00 179.01 179.21 2no8 h ILE 71 N -0.25 1.08 0.43 2.32 5.03 -1.18 -0.22 117.51 124.72 2no8 h ILE 71 Ca -0.00 -0.25 -0.01 0.00 -0.12 0.00 0.00 64.86 64.48 2no8 h ILE 71 Cb 0.24 0.30 -0.03 0.00 -3.03 0.00 0.00 36.82 34.31 2no8 h ILE 71 CO 0.00 0.13 -0.46 0.50 -0.68 0.00 0.00 178.15 177.64 2no8 h LYS 72 N 0.72 -0.88 -0.39 2.37 1.63 -0.20 0.16 116.57 119.97 2no8 h LYS 72 Ca 0.23 0.06 -0.07 0.00 -0.85 0.00 0.00 60.65 60.02 2no8 h LYS 72 Cb 0.00 0.20 -0.02 0.00 -0.60 0.00 0.00 32.23 31.82 2no8 h LYS 72 CO -0.09 -0.59 -0.06 0.93 -3.45 0.00 0.00 179.45 176.20 2no8 h GLU 73 N -0.91 0.66 0.26 1.90 4.39 -0.44 0.18 114.58 120.62 2no8 h GLU 73 Ca -0.04 -0.18 -0.01 0.00 0.34 0.00 0.00 59.36 59.46 2no8 h GLU 73 Cb 0.81 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 2no8 h GLU 73 CO -0.08 0.72 -0.13 2.35 -1.16 0.00 0.00 179.01 180.71 2no8 h TRP 74 N 0.61 -0.33 -0.22 4.33 7.01 -0.87 -0.91 115.95 125.58 2no8 h TRP 74 Ca 0.12 -0.01 -0.07 0.00 2.11 0.00 0.00 58.89 61.04 2no8 h TRP 74 Cb 0.47 0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.62 2no8 h TRP 74 CO 0.02 0.01 -0.19 0.00 -2.79 0.00 0.00 178.44 175.49 2no8 h ARG 75 N -0.72 0.38 -0.36 2.65 3.08 -0.48 0.31 114.38 119.23 2no8 h ARG 75 Ca -0.04 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 59.83 2no8 h ARG 75 Cb 0.49 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2no8 h ARG 75 CO 0.06 0.56 -0.05 0.00 -1.07 0.00 0.00 179.97 179.47 2no8 h ALA 76 N 1.46 1.23 0.00 0.04 0.00 -0.61 0.24 119.26 121.62 2no8 h ALA 76 Ca 0.06 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 2no8 h ALA 76 Cb 0.54 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2no8 h ALA 76 CO 0.04 0.50 -0.84 0.00 0.00 0.00 0.00 179.25 178.95 2no8 h ALA 77 N 1.39 0.64 0.00 0.00 0.00 -0.05 -2.94 119.26 118.30 2no8 h ALA 77 Ca 0.11 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2no8 h ALA 77 Cb 0.44 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2no8 h ALA 77 CO 0.02 0.78 -0.04 0.09 0.00 0.00 0.00 179.25 180.10 2no8 n ASN 78 N -3.13 0.32 -0.48 0.00 5.03 -0.01 -4.90 115.26 112.08 2no8 n ASN 78 Ca -0.02 0.48 -0.06 0.00 0.87 0.00 0.00 54.58 55.85 2no8 n ASN 78 Cb 0.79 -0.54 -0.02 0.00 -1.02 0.00 0.00 39.78 38.99 2no8 n ASN 78 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2no8 n GLY 79 N 1.43 0.65 1.98 7.41 0.00 -0.57 -5.01 105.19 111.07 2no8 n GLY 79 Ca 0.06 -0.77 -0.14 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.52 -0.35 -1.27 1.61 5.02 0.74 -5.01 118.16 116.38 2no8 n LYS 80 Ca -0.06 -1.17 -0.29 0.00 -2.02 0.00 0.00 58.31 54.77 2no8 n LYS 80 Cb 0.28 -0.58 0.19 0.00 -0.02 0.00 0.00 35.03 34.90 2no8 n LYS 80 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2no8 s SER 81 N -3.35 2.34 0.00 4.39 0.15 -1.26 -4.69 113.70 111.28 2no8 s SER 81 Ca 0.37 0.92 0.00 0.00 0.70 0.00 0.00 55.95 57.94 2no8 s SER 81 Cb -0.01 -1.42 0.00 0.00 -1.71 0.00 0.00 66.02 62.88 2no8 s SER 81 CO 0.25 -3.28 0.00 0.61 1.20 0.00 0.00 173.24 172.03 2no8 n GLY 82 N -1.44 5.21 3.52 9.45 0.00 -1.26 -4.66 105.19 116.01 2no8 n GLY 82 Ca 0.08 -1.45 -0.25 0.00 0.00 0.00 0.00 46.02 44.40 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 3.70 2.27 0.54 1.61 0.08 -1.26 -4.17 117.98 120.75 2no8 s PHE 83 Ca 0.00 -0.64 -0.17 0.00 0.12 0.00 0.00 56.93 56.24 2no8 s PHE 83 Cb 0.00 -1.40 -0.06 0.00 -0.57 0.00 0.00 43.02 40.98 2no8 s PHE 83 CO 0.00 0.42 1.03 0.21 -0.10 0.00 0.00 175.22 176.77 2no8 s LYS 84 N -3.69 3.63 -0.08 0.44 2.20 0.14 -4.85 119.74 117.53 2no8 s LYS 84 Ca 0.33 1.16 0.04 0.00 -0.36 0.00 0.00 55.97 57.14 2no8 s LYS 84 Cb 0.05 -2.08 -0.01 0.00 -1.51 0.00 0.00 37.83 34.28 2no8 s LYS 84 CO 0.16 -0.55 -0.20 1.14 -0.36 0.00 0.00 175.35 175.54 2no8 s GLN 85 N -3.86 2.80 0.00 4.03 0.00 -1.26 -3.43 119.66 117.93 2no8 s GLN 85 Ca 0.63 -0.80 0.25 0.00 -0.00 0.00 0.00 55.36 55.43 2no8 s GLN 85 Cb -0.14 -2.34 0.34 0.00 0.00 0.00 0.00 33.01 30.86 2no8 s GLN 85 CO 0.31 0.38 1.34 0.41 0.00 0.00 0.00 175.29 177.73