#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 3.00 0.38 -1.84 1.43 -1.26 -5.14 118.68 115.25 2no8 s LEU 3 Ca 0.00 -0.87 0.06 0.00 -1.03 0.00 0.00 54.13 52.28 2no8 s LEU 3 Cb 0.00 -1.45 -0.02 0.00 0.03 0.00 0.00 46.19 44.75 2no8 s LEU 3 CO 0.00 -0.12 0.21 -1.59 0.23 0.00 0.00 176.35 175.08 2no8 s LYS 4 N -3.67 1.88 -0.18 1.70 0.00 -1.26 -5.07 119.74 113.14 2no8 s LYS 4 Ca 0.33 -2.13 0.18 0.00 0.00 0.00 0.00 55.97 54.35 2no8 s LYS 4 Cb -0.03 -0.14 -0.25 0.00 0.00 0.00 0.00 37.83 37.40 2no8 s LYS 4 CO 0.19 -0.59 0.12 -2.39 0.00 0.00 0.00 175.35 172.68 2no8 n HIS 5 N -0.80 0.04 -3.51 1.78 1.44 -1.26 -5.07 115.22 107.83 2no8 n HIS 5 Ca 0.00 0.01 -0.04 0.00 -2.01 0.00 0.00 57.72 55.68 2no8 n HIS 5 Cb 0.63 -0.98 0.02 0.00 0.12 0.00 0.00 29.99 29.78 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 -2.73 -1.25 0.22 4.39 3.41 -1.26 -5.00 113.62 111.40 2no8 n SER 6 Ca -0.30 -1.83 0.08 0.00 -0.26 0.00 0.00 58.87 56.56 2no8 n SER 6 Cb 1.12 2.08 0.50 0.00 -0.26 0.00 0.00 64.21 67.65 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 1.57 0.77 -0.00 -1.33 2.10 -1.87 -2.42 117.51 116.33 2no8 h ILE 7 Ca -0.19 -1.04 0.00 0.00 1.08 0.00 0.00 64.86 64.71 2no8 h ILE 7 Cb 0.71 1.64 0.00 0.00 -1.09 0.00 0.00 36.82 38.08 2no8 h ILE 7 CO 0.24 0.25 -0.00 -1.20 -1.08 0.00 0.00 178.15 176.35 2no8 n SER 8 N -3.64 0.01 0.01 2.19 7.64 -1.16 -1.21 113.62 117.46 2no8 n SER 8 Ca -0.01 -0.59 0.12 0.00 1.01 0.00 0.00 58.87 59.40 2no8 n SER 8 Cb 0.38 -0.14 0.22 0.00 -1.01 0.00 0.00 64.21 63.66 2no8 n SER 8 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2no8 n ASP 9 N -1.13 0.55 -4.82 6.43 2.03 -0.91 -2.41 116.55 116.29 2no8 n ASP 9 Ca 0.19 -0.17 -0.38 0.00 0.52 0.00 0.00 54.79 54.96 2no8 n ASP 9 Cb 0.17 0.28 -0.06 0.00 -0.72 0.00 0.00 41.12 40.79 2no8 n ASP 9 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2no8 s TYR 10 N -3.05 3.72 0.67 -0.67 1.51 -0.35 -4.76 117.35 114.42 2no8 s TYR 10 Ca 0.09 1.01 -0.11 0.00 -1.01 0.00 0.00 57.07 57.05 2no8 s TYR 10 Cb 0.16 -2.33 -0.01 0.00 -0.11 0.00 0.00 41.96 39.68 2no8 s TYR 10 CO 0.71 0.60 1.06 0.95 -1.11 0.00 0.00 175.55 177.76 2no8 s THR 11 N -0.95 4.14 0.22 -0.71 -4.23 -1.26 0.35 115.64 113.21 2no8 s THR 11 Ca 0.24 0.70 -0.08 0.00 -1.18 0.00 0.00 61.69 61.37 2no8 s THR 11 Cb -0.17 -3.61 0.18 0.00 1.34 0.00 0.00 72.50 70.24 2no8 s THR 11 CO 0.14 -0.91 1.84 -0.08 -0.54 0.00 0.00 174.62 175.07 2no8 h GLU 12 N -0.55 0.84 -0.25 3.99 4.81 -1.92 -0.22 114.58 121.28 2no8 h GLU 12 Ca -0.44 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2no8 h GLU 12 Cb 1.22 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.39 2no8 h GLU 12 CO 0.61 0.56 0.16 0.00 -0.73 0.00 0.00 179.01 179.61 2no8 h ALA 13 N 1.36 0.32 -0.26 2.92 0.00 -1.94 0.48 119.26 122.13 2no8 h ALA 13 Ca 0.33 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.13 2no8 h ALA 13 Cb 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2no8 h ALA 13 CO -0.15 -0.22 -0.25 0.93 0.00 0.00 0.00 179.25 179.56 2no8 h GLU 14 N 0.33 0.50 -0.00 0.00 4.39 -1.82 -1.52 114.58 116.46 2no8 h GLU 14 Ca 0.09 -0.19 -0.19 0.00 0.34 0.00 0.00 59.36 59.42 2no8 h GLU 14 Cb -0.03 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 2no8 h GLU 14 CO -0.03 0.71 -0.84 0.35 -1.16 0.00 0.00 179.01 178.04 2no8 h PHE 15 N 0.44 0.22 0.00 4.33 3.57 -0.74 -2.65 116.94 122.11 2no8 h PHE 15 Ca 0.06 -0.12 -0.03 0.00 3.53 0.00 0.00 57.97 61.42 2no8 h PHE 15 Cb 0.67 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 2no8 h PHE 15 CO 0.02 0.92 -0.13 1.25 -2.23 0.00 0.00 178.31 178.15 2no8 h LEU 16 N 0.08 0.00 -0.78 0.59 6.46 0.42 0.26 115.31 122.35 2no8 h LEU 16 Ca -0.03 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.72 2no8 h LEU 16 Cb 1.46 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.39 2no8 h LEU 16 CO 0.12 0.13 -0.05 -0.33 -0.62 0.00 0.00 178.44 177.69 2no8 h GLU 17 N 0.00 0.00 -0.17 1.25 4.39 -0.94 -3.22 114.58 115.90 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 0.48 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.07 2no8 h GLU 17 CO 0.02 0.05 -0.18 0.27 -1.16 0.00 0.00 179.01 178.01 2no8 h PHE 18 N 0.00 -0.46 -0.12 4.33 -0.00 -0.30 0.11 116.94 120.51 2no8 h PHE 18 Ca -0.00 0.03 -0.17 0.00 -0.00 0.00 0.00 57.97 57.83 2no8 h PHE 18 Cb 0.77 0.23 -0.01 0.00 -0.00 0.00 0.00 35.95 36.95 2no8 h PHE 18 CO 0.00 -0.25 -0.65 -0.24 -0.00 0.00 0.00 178.31 177.17 2no8 h VAL 19 N -0.20 1.35 -0.50 0.88 3.04 -1.62 -0.51 116.25 118.69 2no8 h VAL 19 Ca 0.11 -1.98 -0.08 0.00 -1.01 0.00 0.00 66.70 63.75 2no8 h VAL 19 Cb 0.37 1.96 -0.02 0.00 -2.01 0.00 0.00 31.29 31.59 2no8 h VAL 19 CO -0.29 0.60 0.02 0.11 -1.01 0.00 0.00 177.57 177.00 2no8 h LYS 20 N 0.33 0.87 -0.65 4.17 1.57 -1.48 0.29 116.57 121.68 2no8 h LYS 20 Ca -0.01 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.45 2no8 h LYS 20 Cb 1.20 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.40 2no8 h LYS 20 CO 0.11 0.90 0.23 -0.22 -0.57 0.00 0.00 179.45 179.90 2no8 h LYS 21 N 0.73 0.98 -0.37 3.15 3.64 -0.41 -2.27 116.57 122.02 2no8 h LYS 21 Ca 0.14 -0.18 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 2no8 h LYS 21 Cb 0.49 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 2no8 h LYS 21 CO 0.02 0.82 -0.11 0.82 -2.27 0.00 0.00 179.45 178.72 2no8 h ILE 22 N 0.95 1.28 -0.75 2.00 2.04 -0.74 -0.82 117.51 121.48 2no8 h ILE 22 Ca 0.22 -1.21 0.09 0.00 1.00 0.00 0.00 64.86 64.96 2no8 h ILE 22 Cb 0.23 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 2no8 h ILE 22 CO -0.01 0.40 0.49 0.00 0.00 0.00 0.00 178.15 179.03 2no8 n ARG 24 N -4.49 2.39 0.00 0.00 1.85 -0.89 -4.56 116.66 110.95 2no8 n ARG 24 Ca 0.12 -2.12 0.00 0.00 -1.00 0.00 0.00 57.85 54.85 2no8 n ARG 24 Cb 0.31 -1.49 0.00 0.00 -1.05 0.00 0.00 32.46 30.23 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 1.28 2.26 -0.76 2.89 0.00 0.10 -4.02 120.51 122.26 2no8 n ALA 25 Ca 0.20 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.57 2no8 n ALA 25 Cb 0.54 -1.00 -0.09 0.00 0.00 0.00 0.00 19.45 18.90 2no8 n ALA 25 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2no8 n GLU 26 N -0.25 1.52 0.00 0.00 0.28 -1.26 -3.01 120.64 117.92 2no8 n GLU 26 Ca 0.00 -0.54 0.00 0.00 -0.16 0.00 0.00 57.16 56.46 2no8 n GLU 26 Cb 0.08 -1.56 0.00 0.00 1.43 0.00 0.00 31.44 31.40 2no8 n GLU 26 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2no8 n GLY 27 N 2.07 1.20 0.07 -1.84 0.00 -1.26 -4.73 105.19 100.71 2no8 n GLY 27 Ca 0.23 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.00 0.01 -2.94 4.61 0.00 -1.96 -3.48 119.26 113.49 2no8 h ALA 28 Ca 0.00 -0.42 -0.21 0.00 0.00 0.00 0.00 54.91 54.28 2no8 h ALA 28 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 2no8 h ALA 28 CO 0.00 -0.05 -0.08 0.95 0.00 0.00 0.00 179.25 180.08 2no8 s THR 29 N -2.99 0.00 -0.57 0.00 -4.23 -1.26 -5.00 115.64 101.60 2no8 s THR 29 Ca -0.17 -1.45 0.24 0.00 -1.18 0.00 0.00 61.69 59.13 2no8 s THR 29 Cb -0.01 -2.68 0.15 0.00 1.34 0.00 0.00 72.50 71.31 2no8 s THR 29 CO 0.70 0.00 1.45 -0.08 -0.54 0.00 0.00 174.62 176.15 2no8 h GLU 30 N 2.09 0.00 0.00 3.99 4.81 -1.91 -2.98 114.58 120.57 2no8 h GLU 30 Ca -0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 2no8 h GLU 30 Cb 1.24 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.62 2no8 h GLU 30 CO 0.39 0.00 -0.01 1.05 -0.73 0.00 0.00 179.01 179.71 2no8 h GLU 31 N 0.00 0.00 0.00 1.92 4.11 -1.95 -2.44 114.58 116.21 2no8 h GLU 31 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2no8 h GLU 31 Cb 0.83 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.07 2no8 h GLU 31 CO 0.00 0.00 -0.16 0.22 0.07 0.00 0.00 179.01 179.14 2no8 h ASP 32 N 0.00 0.00 0.19 3.06 3.58 -1.77 0.11 116.42 121.59 2no8 h ASP 32 Ca 0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 2no8 h ASP 32 Cb 0.87 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.92 2no8 h ASP 32 CO 0.00 0.16 -0.09 -0.78 -2.88 0.00 0.00 179.24 175.65 2no8 h ASP 33 N 0.00 -0.21 -0.98 2.28 1.82 -1.38 -3.34 116.42 114.61 2no8 h ASP 33 Ca -0.00 -0.23 0.09 0.00 -0.39 0.00 0.00 57.03 56.50 2no8 h ASP 33 Cb 0.31 0.05 -0.08 0.00 0.68 0.00 0.00 39.33 40.30 2no8 h ASP 33 CO 0.02 0.33 0.62 -1.13 -1.61 0.00 0.00 179.24 177.47 2no8 h ASN 34 N -0.98 0.94 -0.22 2.28 -1.24 -1.06 -1.34 115.58 113.96 2no8 h ASN 34 Ca -0.03 0.03 -0.04 0.00 0.71 0.00 0.00 56.30 56.98 2no8 h ASN 34 Cb 0.43 -0.16 -0.02 0.00 0.73 0.00 0.00 38.32 39.30 2no8 h ASN 34 CO 0.04 0.55 0.04 0.07 -1.29 0.00 0.00 177.43 176.85 2no8 h LYS 35 N 1.05 0.46 0.17 6.67 2.10 -0.94 0.42 116.57 126.49 2no8 h LYS 35 Ca 0.45 -0.08 -0.01 0.00 -2.00 0.00 0.00 60.65 59.02 2no8 h LYS 35 Cb 0.33 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 2no8 h LYS 35 CO -0.22 0.46 -0.08 -0.07 -2.00 0.00 0.00 179.45 177.54 2no8 h LEU 36 N 0.45 -0.19 -0.59 7.07 3.38 -1.38 -1.96 115.31 122.09 2no8 h LEU 36 Ca 0.10 -0.21 0.09 0.00 0.09 0.00 0.00 57.88 57.96 2no8 h LEU 36 Cb 0.23 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 2no8 h LEU 36 CO 0.00 0.11 0.21 0.58 0.09 0.00 0.00 178.44 179.43 2no8 h VAL 37 N -0.50 0.77 -0.55 1.22 2.07 -0.89 -0.10 116.25 118.25 2no8 h VAL 37 Ca -0.02 -0.13 -0.09 0.00 0.82 0.00 0.00 66.70 67.27 2no8 h VAL 37 Cb 0.39 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 2no8 h VAL 37 CO 0.04 0.07 -0.03 0.03 0.02 0.00 0.00 177.57 177.70 2no8 h ARG 38 N 0.38 0.97 -0.15 1.57 2.47 -0.87 -0.08 114.38 118.67 2no8 h ARG 38 Ca 0.30 -0.31 -0.19 0.00 -1.26 0.00 0.00 59.98 58.52 2no8 h ARG 38 Cb 0.37 -0.09 0.00 0.00 -1.65 0.00 0.00 29.97 28.60 2no8 h ARG 38 CO -0.31 0.97 -0.68 1.05 0.56 0.00 0.00 179.97 181.57 2no8 h GLU 39 N 0.89 0.61 -0.54 0.04 4.11 -0.50 -2.72 114.58 116.48 2no8 h GLU 39 Ca 0.16 -0.46 -0.08 0.00 0.07 0.00 0.00 59.36 59.05 2no8 h GLU 39 Cb 0.56 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.87 2no8 h GLU 39 CO 0.03 1.08 0.00 0.74 0.07 0.00 0.00 179.01 180.93 2no8 h PHE 40 N 0.44 0.99 0.00 2.06 0.04 -0.88 -1.74 116.94 117.85 2no8 h PHE 40 Ca -0.02 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 60.60 2no8 h PHE 40 Cb 1.27 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 39.15 2no8 h PHE 40 CO 0.06 0.89 0.00 0.93 -0.60 0.00 0.00 178.31 179.59 2no8 h GLU 41 N 0.85 0.00 0.00 1.51 4.39 -0.85 0.05 114.58 120.53 2no8 h GLU 41 Ca 0.16 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.66 2no8 h GLU 41 Cb 0.50 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 2no8 h GLU 41 CO 0.02 0.00 -1.06 0.00 -1.16 0.00 0.00 179.01 176.81 2no8 h ARG 42 N 0.00 0.00 0.22 2.33 3.08 -1.01 -2.76 114.38 116.24 2no8 h ARG 42 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.71 2no8 h ARG 42 Cb 0.22 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.29 2no8 h ARG 42 CO 0.00 0.73 -1.54 -0.07 -1.07 0.00 0.00 179.97 178.02 2no8 h LEU 43 N 0.00 0.74 -0.25 3.04 3.38 -0.90 -3.34 115.31 117.98 2no8 h LEU 43 Ca -0.07 -0.87 -0.21 0.00 0.09 0.00 0.00 57.88 56.82 2no8 h LEU 43 Cb 1.71 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 42.23 2no8 h LEU 43 CO 0.10 1.70 -0.78 0.71 0.09 0.00 0.00 178.44 180.26 2no8 h THR 44 N 0.13 1.32 -1.59 0.22 1.35 -1.16 -3.40 112.91 109.78 2no8 h THR 44 Ca -0.27 -2.07 -0.32 0.00 -0.55 0.00 0.00 66.41 63.20 2no8 h THR 44 Cb 2.14 2.07 -0.06 0.00 -1.73 0.00 0.00 68.15 70.56 2no8 h THR 44 CO 0.24 0.64 -0.35 1.21 -0.25 0.00 0.00 175.52 177.01 2no8 n GLU 45 N -3.88 -1.18 -3.32 4.72 2.13 -1.04 -4.98 120.64 113.09 2no8 n GLU 45 Ca -0.06 0.88 -0.33 0.00 0.66 0.00 0.00 57.16 58.31 2no8 n GLU 45 Cb 0.74 -5.16 -0.06 0.00 0.27 0.00 0.00 31.44 27.23 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 -2.69 3.48 -0.05 4.31 2.46 -1.25 -5.01 115.29 116.53 2no8 s HIS 46 Ca 0.00 1.04 -0.24 0.00 0.47 0.00 0.00 55.06 56.33 2no8 s HIS 46 Cb 0.00 -2.38 -0.24 0.00 -0.13 0.00 0.00 32.58 29.84 2no8 s HIS 46 CO 0.00 0.28 1.02 -1.00 -2.47 0.00 0.00 174.74 172.57 2no8 h PRO 47 N 2.84 0.18 -0.31 2.88 0.13 -1.93 -3.38 132.00 132.41 2no8 h PRO 47 Ca -0.48 -0.19 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 2no8 h PRO 47 Cb 1.18 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2no8 h PRO 47 CO 0.67 0.93 0.00 -3.47 -0.23 0.00 0.00 178.00 175.90 2no8 n ASP 48 N -4.49 3.81 -0.33 1.44 2.03 -1.26 -4.65 116.55 113.10 2no8 n ASP 48 Ca -0.10 -2.78 0.08 0.00 0.52 0.00 0.00 54.79 52.52 2no8 n ASP 48 Cb 0.51 -0.49 0.28 0.00 -0.72 0.00 0.00 41.12 40.71 2no8 n ASP 48 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 2no8 h GLY 49 N 2.05 1.47 0.68 0.27 0.00 -1.97 0.59 103.07 106.15 2no8 h GLY 49 Ca 0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.93 2no8 h GLY 49 CO 0.19 0.16 -0.01 1.48 0.00 0.00 0.00 176.54 178.36 2no8 h SER 50 N 0.91 0.08 0.89 0.19 4.64 -1.88 -3.17 113.55 115.22 2no8 h SER 50 Ca 0.47 -0.35 -0.04 0.00 -0.47 0.00 0.00 61.79 61.39 2no8 h SER 50 Cb 0.52 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 2no8 h SER 50 CO -0.23 0.41 -0.21 0.44 -0.87 0.00 0.00 176.83 176.38 2no8 h ASP 51 N -0.26 0.00 -0.74 4.97 5.19 -1.32 -2.02 116.42 122.25 2no8 h ASP 51 Ca 0.01 0.00 0.06 0.00 -0.62 0.00 0.00 57.03 56.48 2no8 h ASP 51 Cb 0.38 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.84 2no8 h ASP 51 CO 0.00 0.21 0.48 -0.07 -3.12 0.00 0.00 179.24 176.74 2no8 h LEU 52 N 0.00 0.71 0.22 1.55 3.38 0.10 0.42 115.31 121.69 2no8 h LEU 52 Ca -0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.67 2no8 h LEU 52 Cb 0.71 -0.15 0.03 0.00 0.09 0.00 0.00 40.66 41.34 2no8 h LEU 52 CO 0.03 0.47 -1.31 0.40 0.09 0.00 0.00 178.44 178.11 2no8 h ILE 53 N 0.81 1.32 0.21 1.22 2.04 -1.43 -3.36 117.51 118.33 2no8 h ILE 53 Ca 0.31 -2.63 -0.32 0.00 1.00 0.00 0.00 64.86 63.22 2no8 h ILE 53 Cb 0.20 3.06 0.03 0.00 -0.74 0.00 0.00 36.82 39.37 2no8 h ILE 53 CO -0.10 0.78 -1.45 1.88 0.00 0.00 0.00 178.15 179.27 2no8 h TYR 54 N -0.02 0.82 -3.20 1.37 0.05 -1.30 -3.45 116.97 111.25 2no8 h TYR 54 Ca -0.23 -0.60 -0.52 0.00 0.05 0.00 0.00 58.73 57.43 2no8 h TYR 54 Cb 2.00 -0.03 -0.37 0.00 1.01 0.00 0.00 36.73 39.34 2no8 h TYR 54 CO 0.15 1.49 -0.80 0.71 -1.05 0.00 0.00 178.16 178.66 2no8 s TYR 55 N -2.61 1.44 0.50 4.88 2.02 0.15 -5.09 117.35 118.63 2no8 s TYR 55 Ca -0.08 -0.70 -0.22 0.00 -0.37 0.00 0.00 57.07 55.70 2no8 s TYR 55 Cb 0.05 -1.20 -0.07 0.00 -0.40 0.00 0.00 41.96 40.34 2no8 s TYR 55 CO 0.92 -0.49 1.16 -1.25 -1.57 0.00 0.00 175.55 174.32 2no8 s PRO 56 N 1.66 3.57 0.00 -1.71 0.04 -1.26 -4.31 135.00 132.99 2no8 s PRO 56 Ca 0.04 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.81 2no8 s PRO 56 Cb -0.13 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.17 2no8 s PRO 56 CO -0.07 -0.70 0.00 0.54 0.04 0.00 0.00 177.00 176.81 2no8 n ARG 57 N -0.82 0.00 0.02 4.56 1.74 -1.26 -5.09 116.66 115.81 2no8 n ARG 57 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 2no8 n ARG 57 Cb 0.49 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.93 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 0.46 0.12 0.55 -0.08 -1.26 -4.82 116.55 111.52 2no8 n ASP 58 Ca 0.00 0.06 0.13 0.00 -1.51 0.00 0.00 54.79 53.47 2no8 n ASP 58 Cb 0.00 -0.13 0.41 0.00 2.34 0.00 0.00 41.12 43.73 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.78 0.12 0.00 0.00 177.20 176.54 2no8 h ASP 59 N 0.00 0.00 -4.09 1.67 3.58 -2.05 -3.46 116.42 112.07 2no8 h ASP 59 Ca 0.00 0.00 -0.47 0.00 0.42 0.00 0.00 57.03 56.98 2no8 h ASP 59 Cb 0.00 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.08 2no8 h ASP 59 CO 0.00 0.00 0.38 -0.13 -2.88 0.00 0.00 179.24 176.61 2no8 s ARG 60 N -3.15 3.76 -0.05 0.28 1.81 -1.26 -5.03 118.95 115.32 2no8 s ARG 60 Ca 0.09 1.31 -0.12 0.00 -1.72 0.00 0.00 55.73 55.29 2no8 s ARG 60 Cb 0.11 -2.09 -0.05 0.00 -0.45 0.00 0.00 34.95 32.47 2no8 s ARG 60 CO 0.57 -0.46 0.31 -2.00 -0.68 0.00 0.00 175.30 173.05 2no8 s GLU 61 N -3.38 3.77 -1.13 3.54 2.56 -1.26 -4.85 118.70 117.95 2no8 s GLU 61 Ca 0.66 0.21 -0.19 0.00 0.00 0.00 0.00 54.97 55.66 2no8 s GLU 61 Cb -0.16 -3.22 0.10 0.00 2.00 0.00 0.00 34.13 32.85 2no8 s GLU 61 CO 0.22 0.70 1.47 0.34 -0.56 0.00 0.00 175.26 177.43 2no8 s ASP 62 N -0.99 6.75 0.03 -1.70 2.15 -1.26 -4.37 116.67 117.28 2no8 s ASP 62 Ca 0.20 -2.20 -0.03 0.00 0.43 0.00 0.00 52.55 50.95 2no8 s ASP 62 Cb -0.15 -2.50 -0.02 0.00 -0.30 0.00 0.00 42.92 39.95 2no8 s ASP 62 CO 0.10 -1.15 0.04 -0.94 -0.17 0.00 0.00 175.17 173.04 2no8 s SER 63 N 4.02 0.23 0.35 -0.34 1.04 -1.26 -4.97 113.70 112.77 2no8 s SER 63 Ca 0.45 -0.56 0.08 0.00 0.48 0.00 0.00 55.95 56.41 2no8 s SER 63 Cb -0.00 0.18 0.80 0.00 0.10 0.00 0.00 66.02 67.09 2no8 s SER 63 CO -0.02 -0.43 1.85 -0.65 0.98 0.00 0.00 173.24 174.97 2no8 h PRO 64 N 3.99 0.70 0.18 4.02 0.11 -1.92 -1.49 132.00 137.59 2no8 h PRO 64 Ca -0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2no8 h PRO 64 Cb 1.19 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2no8 h PRO 64 CO 0.48 0.46 -0.17 0.93 -0.21 0.00 0.00 178.00 179.50 2no8 h GLU 65 N 0.72 -0.36 -0.81 1.05 3.07 -1.94 -2.52 114.58 113.79 2no8 h GLU 65 Ca 0.47 0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 59.33 2no8 h GLU 65 Cb 0.74 0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.70 2no8 h GLU 65 CO -0.23 -0.24 0.42 0.78 -1.40 0.00 0.00 179.01 178.34 2no8 h GLY 66 N -0.38 1.21 1.00 -3.84 0.00 -1.52 0.02 103.07 99.57 2no8 h GLY 66 Ca 0.00 -0.56 -0.04 0.00 0.00 0.00 0.00 47.33 46.73 2no8 h GLY 66 CO -0.04 0.54 0.25 -2.22 0.00 0.00 0.00 176.54 175.07 2no8 h ILE 67 N 1.13 1.23 -0.10 2.60 2.04 -1.23 -1.75 117.51 121.43 2no8 h ILE 67 Ca 0.28 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.34 2no8 h ILE 67 Cb 0.06 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 2no8 h ILE 67 CO -0.04 0.28 -0.30 0.58 0.00 0.00 0.00 178.15 178.67 2no8 h VAL 68 N 0.87 1.25 -0.04 1.67 2.07 -0.98 -2.42 116.25 118.67 2no8 h VAL 68 Ca 0.21 -1.20 -0.11 0.00 0.82 0.00 0.00 66.70 66.41 2no8 h VAL 68 Cb 0.20 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 2no8 h VAL 68 CO -0.02 0.36 -0.51 0.50 0.02 0.00 0.00 177.57 177.93 2no8 h LYS 69 N 0.17 0.10 -0.27 1.57 3.64 -0.27 -0.47 116.57 121.04 2no8 h LYS 69 Ca 0.02 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 2no8 h LYS 69 Cb 0.62 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 2no8 h LYS 69 CO 0.04 0.59 0.10 1.49 -2.27 0.00 0.00 179.45 179.40 2no8 h GLU 70 N 0.08 0.41 -0.60 1.90 4.57 -0.84 0.22 114.58 120.33 2no8 h GLU 70 Ca 0.00 -0.08 0.03 0.00 -1.18 0.00 0.00 59.36 58.13 2no8 h GLU 70 Cb 0.92 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 29.41 2no8 h GLU 70 CO 0.07 0.45 0.36 0.82 -1.18 0.00 0.00 179.01 179.54 2no8 h ILE 71 N 0.28 1.06 0.29 2.32 2.04 -1.37 0.15 117.51 122.28 2no8 h ILE 71 Ca 0.09 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 2no8 h ILE 71 Cb 0.20 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 2no8 h ILE 71 CO -0.01 0.13 -0.14 0.07 0.00 0.00 0.00 178.15 178.21 2no8 h LYS 72 N 0.71 -0.37 -0.67 2.37 2.10 -0.70 -2.65 116.57 117.37 2no8 h LYS 72 Ca 0.25 0.03 -0.06 0.00 -2.00 0.00 0.00 60.65 58.86 2no8 h LYS 72 Cb 0.04 0.08 -0.03 0.00 -0.90 0.00 0.00 32.23 31.43 2no8 h LYS 72 CO -0.11 -0.11 0.17 0.93 -2.00 0.00 0.00 179.45 178.33 2no8 h GLU 73 N -0.60 1.05 0.07 0.07 4.39 -0.35 0.47 114.58 119.68 2no8 h GLU 73 Ca -0.04 -0.23 -0.00 0.00 0.34 0.00 0.00 59.36 59.42 2no8 h GLU 73 Cb 0.43 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2no8 h GLU 73 CO 0.06 0.92 -0.03 2.35 -1.16 0.00 0.00 179.01 181.15 2no8 h TRP 74 N 1.00 -0.09 -0.19 4.33 7.01 -1.04 -0.97 115.95 126.00 2no8 h TRP 74 Ca 0.21 -0.00 -0.10 0.00 2.11 0.00 0.00 58.89 61.11 2no8 h TRP 74 Cb 0.34 0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.41 2no8 h TRP 74 CO 0.02 0.20 -0.32 0.00 -2.79 0.00 0.00 178.44 175.56 2no8 h ARG 75 N -0.37 0.37 -0.50 2.65 3.08 -1.15 0.37 114.38 118.84 2no8 h ARG 75 Ca -0.01 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 2no8 h ARG 75 Cb 0.32 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 2no8 h ARG 75 CO 0.02 0.65 0.26 0.00 -1.07 0.00 0.00 179.97 179.83 2no8 h ALA 76 N 1.34 1.52 0.20 0.04 0.00 0.08 0.11 119.26 122.55 2no8 h ALA 76 Ca 0.04 -0.09 -0.34 0.00 0.00 0.00 0.00 54.91 54.52 2no8 h ALA 76 Cb 0.72 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.32 2no8 h ALA 76 CO 0.06 0.40 -1.66 0.00 0.00 0.00 0.00 179.25 178.04 2no8 h ALA 77 N 1.59 0.07 0.00 0.00 0.00 -0.48 -3.29 119.26 117.16 2no8 h ALA 77 Ca 0.18 -1.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.00 2no8 h ALA 77 Cb 0.05 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 2no8 h ALA 77 CO -0.03 0.94 -0.13 -0.91 0.00 0.00 0.00 179.25 179.12 2no8 h ASN 78 N 0.12 0.00 -0.49 0.00 -0.26 -0.65 -3.46 115.58 110.83 2no8 h ASN 78 Ca -0.31 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.43 2no8 h ASN 78 Cb 2.12 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.38 2no8 h ASN 78 CO 0.21 0.13 0.00 0.61 -1.06 0.00 0.00 177.43 177.31 2no8 n GLY 79 N -0.71 0.88 0.77 2.83 0.00 -0.14 -5.07 105.19 103.74 2no8 n GLY 79 Ca -0.02 -0.60 -0.04 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.62 0.83 -0.59 1.61 5.02 0.20 -5.05 118.16 119.57 2no8 n LYS 80 Ca 0.00 -0.60 -0.28 0.00 -2.02 0.00 0.00 58.31 55.41 2no8 n LYS 80 Cb 0.39 -0.07 0.25 0.00 -0.02 0.00 0.00 35.03 35.59 2no8 n LYS 80 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2no8 s SER 81 N -1.73 1.04 0.00 4.39 0.01 -1.26 -4.78 113.70 111.37 2no8 s SER 81 Ca 0.12 1.49 0.00 0.00 1.31 0.00 0.00 55.95 58.87 2no8 s SER 81 Cb -0.01 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 63.95 2no8 s SER 81 CO 0.08 -4.16 0.00 0.61 0.41 0.00 0.00 173.24 170.18 2no8 n GLY 82 N 0.67 5.39 3.82 3.44 0.00 -1.26 -4.62 105.19 112.64 2no8 n GLY 82 Ca 0.03 -1.30 -0.27 0.00 0.00 0.00 0.00 46.02 44.48 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 2.02 2.01 0.14 1.61 0.08 -1.26 -3.01 117.98 119.57 2no8 s PHE 83 Ca 0.00 -0.78 -0.31 0.00 0.12 0.00 0.00 56.93 55.96 2no8 s PHE 83 Cb 0.00 -1.87 -0.08 0.00 -0.57 0.00 0.00 43.02 40.50 2no8 s PHE 83 CO 0.00 -0.11 1.32 0.21 -0.10 0.00 0.00 175.22 176.54 2no8 s LYS 84 N -4.07 4.37 -1.29 0.44 2.47 0.16 -4.83 119.74 116.99 2no8 s LYS 84 Ca 0.30 2.00 -0.11 0.00 -1.56 0.00 0.00 55.97 56.60 2no8 s LYS 84 Cb 0.00 -3.24 0.15 0.00 -1.46 0.00 0.00 37.83 33.28 2no8 s LYS 84 CO 0.18 -0.32 1.83 0.00 0.16 0.00 0.00 175.35 177.20 2no8 n GLN 85 N 3.38 3.47 0.00 4.03 0.00 -1.26 -4.35 117.38 122.65 2no8 n GLN 85 Ca 0.09 -3.47 0.00 0.00 0.00 0.00 0.00 57.00 53.61 2no8 n GLN 85 Cb 0.43 -3.01 0.00 0.00 0.00 0.00 0.00 30.24 27.66 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47