#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 2.12 0.92 4.31 1.43 -1.26 -5.13 118.68 121.06 2no8 s LEU 3 Ca 0.00 -1.00 -0.10 0.00 -1.03 0.00 0.00 54.13 52.00 2no8 s LEU 3 Cb 0.00 -1.02 0.15 0.00 0.03 0.00 0.00 46.19 45.34 2no8 s LEU 3 CO 0.00 -0.23 1.12 -1.59 0.23 0.00 0.00 176.35 175.88 2no8 s LYS 4 N 1.53 1.02 0.02 1.70 0.00 -1.26 -4.98 119.74 117.77 2no8 s LYS 4 Ca -0.03 1.38 0.03 0.00 0.00 0.00 0.00 55.97 57.35 2no8 s LYS 4 Cb -0.18 -1.74 -0.25 0.00 0.00 0.00 0.00 37.83 35.66 2no8 s LYS 4 CO -0.07 -2.57 0.91 1.12 0.00 0.00 0.00 175.35 174.74 2no8 h HIS 5 N -1.82 0.23 -3.35 1.78 2.07 -2.00 -3.49 115.15 108.58 2no8 h HIS 5 Ca -0.45 -0.17 -0.07 0.00 -2.85 0.00 0.00 60.37 56.82 2no8 h HIS 5 Cb 1.27 -0.01 -0.04 0.00 2.57 0.00 0.00 27.41 31.20 2no8 h HIS 5 CO 0.49 1.21 0.11 -1.54 -3.07 0.00 0.00 177.93 175.12 2no8 s SER 6 N -6.71 0.17 0.46 3.10 1.04 -1.26 -5.01 113.70 105.49 2no8 s SER 6 Ca -0.06 -1.12 0.21 0.00 0.48 0.00 0.00 55.95 55.47 2no8 s SER 6 Cb 0.08 0.75 1.10 0.00 0.10 0.00 0.00 66.02 68.05 2no8 s SER 6 CO 0.84 -1.47 1.95 -0.29 0.98 0.00 0.00 173.24 175.24 2no8 h ILE 7 N 2.06 0.82 0.00 -1.02 2.10 -1.86 -2.05 117.51 117.57 2no8 h ILE 7 Ca -0.28 -0.88 0.00 0.00 1.08 0.00 0.00 64.86 64.78 2no8 h ILE 7 Cb 1.25 1.53 0.00 0.00 -1.09 0.00 0.00 36.82 38.50 2no8 h ILE 7 CO 0.37 0.22 0.00 -1.20 -1.08 0.00 0.00 178.15 176.45 2no8 n SER 8 N -3.78 0.00 0.14 2.19 7.64 -1.16 -0.97 113.62 117.67 2no8 n SER 8 Ca -0.02 -0.49 0.11 0.00 1.01 0.00 0.00 58.87 59.48 2no8 n SER 8 Cb 0.32 -0.12 0.05 0.00 -1.01 0.00 0.00 64.21 63.45 2no8 n SER 8 CO 0.00 0.00 0.00 -0.78 -3.01 0.00 0.00 175.04 171.25 2no8 h ASP 9 N 0.00 0.00 -3.55 6.43 3.58 -1.66 -2.39 116.42 118.83 2no8 h ASP 9 Ca 0.00 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.93 2no8 h ASP 9 Cb 0.10 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.12 2no8 h ASP 9 CO 0.00 0.01 0.29 -0.31 -2.88 0.00 0.00 179.24 176.36 2no8 s TYR 10 N -3.31 3.83 0.87 0.28 1.51 -0.15 -4.67 117.35 115.70 2no8 s TYR 10 Ca 0.02 1.72 -0.12 0.00 -1.01 0.00 0.00 57.07 57.68 2no8 s TYR 10 Cb 0.08 -2.96 0.11 0.00 -0.11 0.00 0.00 41.96 39.08 2no8 s TYR 10 CO 0.76 0.29 1.12 0.95 -1.11 0.00 0.00 175.55 177.55 2no8 s THR 11 N -0.29 2.48 0.33 -0.71 -4.23 -1.26 0.43 115.64 112.39 2no8 s THR 11 Ca 0.43 0.16 0.01 0.00 -1.18 0.00 0.00 61.69 61.11 2no8 s THR 11 Cb -0.23 -2.88 0.23 0.00 1.34 0.00 0.00 72.50 70.97 2no8 s THR 11 CO 0.28 -0.20 1.96 -0.08 -0.54 0.00 0.00 174.62 176.04 2no8 h GLU 12 N -1.35 0.83 -0.31 3.99 4.81 -1.90 -1.26 114.58 119.40 2no8 h GLU 12 Ca -0.49 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 58.61 2no8 h GLU 12 Cb 1.30 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 2no8 h GLU 12 CO 0.60 0.61 0.03 0.00 -0.73 0.00 0.00 179.01 179.52 2no8 h ALA 13 N 1.53 0.41 -0.37 2.92 0.00 -1.91 0.64 119.26 122.49 2no8 h ALA 13 Ca 0.22 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2no8 h ALA 13 Cb 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2no8 h ALA 13 CO -0.04 0.14 -0.05 0.93 0.00 0.00 0.00 179.25 180.23 2no8 h GLU 14 N 0.34 0.60 -0.02 0.00 5.08 -1.78 0.21 114.58 119.02 2no8 h GLU 14 Ca 0.09 -0.16 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 2no8 h GLU 14 Cb 0.39 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 2no8 h GLU 14 CO 0.01 0.66 -0.79 0.35 -1.00 0.00 0.00 179.01 178.24 2no8 h PHE 15 N 0.57 0.26 0.00 4.33 3.57 -1.11 -2.59 116.94 121.96 2no8 h PHE 15 Ca 0.11 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2no8 h PHE 15 Cb 0.43 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.14 2no8 h PHE 15 CO 0.02 0.90 0.00 1.25 -2.23 0.00 0.00 178.31 178.24 2no8 h LEU 16 N 0.11 0.00 -0.52 0.59 6.46 0.08 0.29 115.31 122.32 2no8 h LEU 16 Ca -0.03 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.63 2no8 h LEU 16 Cb 1.38 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.30 2no8 h LEU 16 CO 0.12 0.00 -0.46 -0.33 -0.62 0.00 0.00 178.44 177.15 2no8 h GLU 17 N 0.00 0.00 -0.42 1.25 4.39 -0.61 -3.27 114.58 115.93 2no8 h GLU 17 Ca 0.00 0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.78 2no8 h GLU 17 Cb 0.50 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.08 2no8 h GLU 17 CO 0.00 0.46 -0.01 0.27 -1.16 0.00 0.00 179.01 178.57 2no8 h PHE 18 N 0.00 -0.04 -0.18 4.33 -0.00 -0.15 0.30 116.94 121.19 2no8 h PHE 18 Ca -0.00 0.03 -0.19 0.00 -0.00 0.00 0.00 57.97 57.81 2no8 h PHE 18 Cb 1.14 0.08 0.00 0.00 -0.00 0.00 0.00 35.95 37.17 2no8 h PHE 18 CO 0.00 -0.09 -0.65 -0.24 -0.00 0.00 0.00 178.31 177.32 2no8 h VAL 19 N 0.10 1.31 -0.60 0.88 3.04 -1.67 -0.78 116.25 118.53 2no8 h VAL 19 Ca 0.21 -1.90 -0.05 0.00 -1.01 0.00 0.00 66.70 63.94 2no8 h VAL 19 Cb 0.30 1.87 -0.03 0.00 -2.01 0.00 0.00 31.29 31.42 2no8 h VAL 19 CO -0.35 0.60 0.18 0.11 -1.01 0.00 0.00 177.57 177.10 2no8 h LYS 20 N 0.49 0.93 0.04 4.17 1.57 -1.36 -1.23 116.57 121.18 2no8 h LYS 20 Ca -0.02 -0.20 0.01 0.00 -1.87 0.00 0.00 60.65 58.57 2no8 h LYS 20 Cb 1.25 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2no8 h LYS 20 CO 0.13 0.84 -0.07 0.87 -0.57 0.00 0.00 179.45 180.64 2no8 h LYS 21 N 0.85 -0.14 -0.78 3.15 1.57 -0.06 -1.97 116.57 119.19 2no8 h LYS 21 Ca 0.19 0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.04 2no8 h LYS 21 Cb 0.30 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.58 2no8 h LYS 21 CO -0.00 -0.09 0.47 0.82 -0.57 0.00 0.00 179.45 180.07 2no8 h ILE 22 N -0.15 1.03 -0.55 1.86 2.04 -0.91 0.78 117.51 121.62 2no8 h ILE 22 Ca 0.02 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.57 2no8 h ILE 22 Cb 0.16 0.08 -0.03 0.00 -0.74 0.00 0.00 36.82 36.29 2no8 h ILE 22 CO -0.04 0.16 0.32 0.00 0.00 0.00 0.00 178.15 178.58 2no8 n ARG 24 N -4.42 0.65 -0.31 0.00 1.85 -0.51 -4.61 116.66 109.31 2no8 n ARG 24 Ca 0.05 0.17 -0.02 0.00 -1.00 0.00 0.00 57.85 57.06 2no8 n ARG 24 Cb 0.08 -1.53 0.10 0.00 -1.05 0.00 0.00 32.46 30.06 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 -3.36 3.12 -0.41 2.89 0.00 0.26 -4.63 120.51 118.39 2no8 n ALA 25 Ca -0.46 -0.69 0.36 0.00 0.00 0.00 0.00 53.44 52.64 2no8 n ALA 25 Cb 0.98 -1.08 0.61 0.00 0.00 0.00 0.00 19.45 19.97 2no8 n ALA 25 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2no8 n GLU 26 N 0.12 -0.04 0.00 0.00 1.02 -1.24 -4.72 120.64 115.78 2no8 n GLU 26 Ca 0.12 1.21 0.00 0.00 -0.02 0.00 0.00 57.16 58.47 2no8 n GLU 26 Cb 0.66 -2.32 0.00 0.00 -0.02 0.00 0.00 31.44 29.76 2no8 n GLU 26 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2no8 n GLY 27 N -1.42 2.03 1.20 0.62 0.00 -1.26 -2.19 105.19 104.16 2no8 n GLY 27 Ca 0.37 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 0.08 0.78 -2.86 4.61 0.00 -1.26 -5.10 120.51 116.76 2no8 n ALA 28 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2no8 n ALA 28 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 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 -0.60 5.14 0.53 0.00 -4.23 -1.26 -4.99 115.64 110.24 2no8 s THR 29 Ca 0.00 -0.85 0.31 0.00 -1.18 0.00 0.00 61.69 59.97 2no8 s THR 29 Cb 0.00 -3.83 0.48 0.00 1.34 0.00 0.00 72.50 70.48 2no8 s THR 29 CO 0.00 -0.38 1.89 1.05 -0.54 0.00 0.00 174.62 176.64 2no8 h GLU 30 N 1.04 0.01 -0.25 3.99 9.09 -2.01 -0.21 114.58 126.24 2no8 h GLU 30 Ca -0.51 -0.00 -0.03 0.00 0.05 0.00 0.00 59.36 58.86 2no8 h GLU 30 Cb 1.23 -0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.31 2no8 h GLU 30 CO 0.61 0.01 0.01 1.05 0.05 0.00 0.00 179.01 180.73 2no8 h GLU 31 N 0.01 0.37 0.00 1.06 4.11 -1.94 0.93 114.58 119.13 2no8 h GLU 31 Ca 0.42 -0.06 -0.19 0.00 0.07 0.00 0.00 59.36 59.60 2no8 h GLU 31 Cb 1.66 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.83 2no8 h GLU 31 CO -0.01 0.40 -0.84 0.22 0.07 0.00 0.00 179.01 178.84 2no8 h ASP 32 N 0.36 0.17 0.05 3.06 1.82 -1.21 0.17 116.42 120.84 2no8 h ASP 32 Ca 0.08 -0.13 -0.00 0.00 -0.39 0.00 0.00 57.03 56.59 2no8 h ASP 32 Cb 0.24 -0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.20 2no8 h ASP 32 CO 0.01 0.93 -0.02 -0.78 -1.61 0.00 0.00 179.24 177.77 2no8 h ASP 33 N 0.07 -0.05 -0.30 2.28 1.82 -1.15 -3.03 116.42 116.05 2no8 h ASP 33 Ca -0.03 -0.25 0.02 0.00 -0.39 0.00 0.00 57.03 56.39 2no8 h ASP 33 Cb 1.47 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 41.47 2no8 h ASP 33 CO 0.12 0.22 0.20 -1.13 -1.61 0.00 0.00 179.24 177.05 2no8 h ASN 34 N -0.33 0.27 -0.79 2.28 -0.73 -0.55 -1.52 115.58 114.21 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 0.30 -0.06 -0.04 0.00 0.27 0.00 0.00 38.32 38.78 2no8 h ASN 34 CO 0.01 0.19 0.52 0.50 -0.37 0.00 0.00 177.43 178.28 2no8 h LYS 35 N 0.31 0.95 -0.03 6.67 3.64 -0.54 0.17 116.57 127.75 2no8 h LYS 35 Ca 0.12 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.42 2no8 h LYS 35 Cb 0.10 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 2no8 h LYS 35 CO -0.03 0.63 -0.09 -0.07 -2.27 0.00 0.00 179.45 177.62 2no8 h LEU 36 N 0.98 0.13 -0.67 5.20 3.38 -1.29 -3.24 115.31 119.79 2no8 h LEU 36 Ca 0.31 -0.62 0.12 0.00 0.09 0.00 0.00 57.88 57.79 2no8 h LEU 36 Cb 0.03 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 40.65 2no8 h LEU 36 CO -0.09 0.72 0.22 0.58 0.09 0.00 0.00 178.44 179.96 2no8 h VAL 37 N -0.46 0.67 -0.44 1.22 2.07 -0.96 -2.20 116.25 116.15 2no8 h VAL 37 Ca -0.00 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 67.42 2no8 h VAL 37 Cb 0.71 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 2no8 h VAL 37 CO 0.02 0.07 0.24 0.03 0.02 0.00 0.00 177.57 177.94 2no8 h ARG 38 N 0.37 0.46 -0.13 1.57 3.08 -0.76 0.25 114.38 119.22 2no8 h ARG 38 Ca 0.36 -0.03 -0.16 0.00 0.07 0.00 0.00 59.98 60.22 2no8 h ARG 38 Cb 0.52 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2no8 h ARG 38 CO -0.39 0.30 -0.60 1.05 -1.07 0.00 0.00 179.97 179.26 2no8 h GLU 39 N 0.47 0.43 -0.15 0.04 4.11 -1.45 -2.55 114.58 115.49 2no8 h GLU 39 Ca 0.19 -0.30 -0.18 0.00 0.07 0.00 0.00 59.36 59.14 2no8 h GLU 39 Cb 0.07 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 2no8 h GLU 39 CO -0.12 0.91 -0.64 0.74 0.07 0.00 0.00 179.01 179.97 2no8 h PHE 40 N 0.32 0.74 0.00 2.06 0.04 -1.02 -2.74 116.94 116.34 2no8 h PHE 40 Ca -0.00 -0.29 0.00 0.00 2.80 0.00 0.00 57.97 60.48 2no8 h PHE 40 Cb 1.14 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 39.16 2no8 h PHE 40 CO 0.04 1.05 0.00 0.93 -0.60 0.00 0.00 178.31 179.73 2no8 h GLU 41 N 0.41 0.00 0.00 1.51 4.39 -0.35 -0.93 114.58 119.61 2no8 h GLU 41 Ca -0.01 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.57 2no8 h GLU 41 Cb 1.21 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 2no8 h GLU 41 CO 0.12 0.00 -0.96 0.00 -1.16 0.00 0.00 179.01 177.01 2no8 h ARG 42 N 0.00 0.00 -0.12 2.33 3.08 -1.27 0.67 114.38 119.07 2no8 h ARG 42 Ca 0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 2no8 h ARG 42 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 2no8 h ARG 42 CO 0.00 0.31 -0.67 -0.07 -1.07 0.00 0.00 179.97 178.47 2no8 h LEU 43 N 0.00 0.56 0.03 3.04 3.38 -0.95 -3.28 115.31 118.09 2no8 h LEU 43 Ca -0.08 -0.34 -0.31 0.00 0.09 0.00 0.00 57.88 57.25 2no8 h LEU 43 Cb 1.40 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.95 2no8 h LEU 43 CO 0.04 1.07 -1.77 0.35 0.09 0.00 0.00 178.44 178.23 2no8 n THR 44 N -3.89 1.66 -2.27 0.22 -2.24 -0.47 -4.68 114.28 102.60 2no8 n THR 44 Ca -0.04 -0.76 -0.19 0.00 -2.27 0.00 0.00 64.05 60.78 2no8 n THR 44 Cb 0.67 -1.21 -0.02 0.00 -2.10 0.00 0.00 70.33 67.67 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 -3.15 -1.52 -3.03 -0.78 1.02 0.22 -4.93 120.64 108.47 2no8 n GLU 45 Ca -0.20 0.96 -0.40 0.00 -0.02 0.00 0.00 57.16 57.51 2no8 n GLU 45 Cb 1.05 -5.51 -0.05 0.00 -0.02 0.00 0.00 31.44 26.91 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 -2.93 3.79 0.15 -0.32 2.46 -1.22 -4.97 115.29 112.24 2no8 s HIS 46 Ca 0.00 1.48 -0.10 0.00 0.47 0.00 0.00 55.06 56.90 2no8 s HIS 46 Cb 0.00 -2.76 -0.02 0.00 -0.13 0.00 0.00 32.58 29.67 2no8 s HIS 46 CO 0.00 0.37 1.50 -1.00 -2.47 0.00 0.00 174.74 173.15 2no8 h PRO 47 N 5.19 0.96 -0.23 2.88 0.13 -1.93 -3.24 132.00 135.76 2no8 h PRO 47 Ca -0.45 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.20 2no8 h PRO 47 Cb 1.21 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2no8 h PRO 47 CO 0.69 1.14 0.00 -0.25 -0.23 0.00 0.00 178.00 179.35 2no8 n ASP 48 N -4.08 3.04 0.14 1.44 8.00 -1.26 -4.68 116.55 119.15 2no8 n ASP 48 Ca -0.01 -2.43 -0.14 0.00 0.71 0.00 0.00 54.79 52.92 2no8 n ASP 48 Cb 0.52 -0.32 -0.07 0.00 -0.02 0.00 0.00 41.12 41.23 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 1.45 -0.31 1.06 0.44 0.00 -1.97 0.33 103.07 104.08 2no8 h GLY 49 Ca 0.00 0.13 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 2no8 h GLY 49 CO 0.07 -0.12 0.41 1.48 0.00 0.00 0.00 176.54 178.38 2no8 h SER 50 N -0.30 1.10 0.15 0.19 4.64 -1.83 -1.88 113.55 115.61 2no8 h SER 50 Ca -0.02 -0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 61.15 2no8 h SER 50 Cb 0.24 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 2no8 h SER 50 CO 0.03 0.92 -0.11 0.44 -0.87 0.00 0.00 176.83 177.24 2no8 h ASP 51 N 1.21 0.00 -0.89 4.97 5.19 -1.64 -1.95 116.42 123.31 2no8 h ASP 51 Ca 0.29 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.70 2no8 h ASP 51 Cb 0.11 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.58 2no8 h ASP 51 CO -0.04 0.11 0.56 -0.07 -3.12 0.00 0.00 179.24 176.69 2no8 h LEU 52 N 0.00 1.04 0.13 1.55 3.38 0.49 0.61 115.31 122.51 2no8 h LEU 52 Ca -0.00 -0.04 -0.30 0.00 0.09 0.00 0.00 57.88 57.62 2no8 h LEU 52 Cb 0.22 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2no8 h LEU 52 CO 0.01 0.77 -1.49 0.40 0.09 0.00 0.00 178.44 178.23 2no8 h ILE 53 N 1.21 1.21 0.00 1.22 2.04 -1.41 -3.35 117.51 118.43 2no8 h ILE 53 Ca 0.32 -2.82 -0.10 0.00 1.00 0.00 0.00 64.86 63.26 2no8 h ILE 53 Cb -0.10 2.81 -0.02 0.00 -0.74 0.00 0.00 36.82 38.77 2no8 h ILE 53 CO -0.07 0.83 -0.89 1.88 0.00 0.00 0.00 178.15 179.90 2no8 h TYR 54 N 0.08 0.00 -2.55 1.37 0.05 -1.04 -3.44 116.97 111.43 2no8 h TYR 54 Ca -0.23 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.30 2no8 h TYR 54 Cb 2.02 0.00 -0.34 0.00 1.01 0.00 0.00 36.73 39.42 2no8 h TYR 54 CO 0.07 0.38 -0.57 0.71 -1.05 0.00 0.00 178.16 177.70 2no8 s TYR 55 N -3.05 -0.42 0.32 4.88 2.02 0.21 -5.05 117.35 116.26 2no8 s TYR 55 Ca 0.01 0.59 -0.28 0.00 -0.37 0.00 0.00 57.07 57.02 2no8 s TYR 55 Cb 0.08 -0.18 -0.13 0.00 -0.40 0.00 0.00 41.96 41.33 2no8 s TYR 55 CO 0.77 -0.53 1.24 -2.30 -1.57 0.00 0.00 175.55 173.16 2no8 n PRO 56 N 5.34 1.95 0.00 -1.71 -0.02 -1.26 -4.24 135.00 135.05 2no8 n PRO 56 Ca -0.05 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2no8 n PRO 56 Cb 0.50 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 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 0.74 0.00 0.00 -0.52 1.74 -1.26 -5.07 116.66 112.29 2no8 n ARG 57 Ca 0.06 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 2no8 n ARG 57 Cb 0.35 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.79 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 0.08 0.00 0.55 2.03 -1.26 -4.88 116.55 113.07 2no8 n ASP 58 Ca 0.00 0.01 0.11 0.00 0.52 0.00 0.00 54.79 55.43 2no8 n ASP 58 Cb 0.00 -0.02 -0.12 0.00 -0.72 0.00 0.00 41.12 40.26 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 -2.58 0.44 -4.78 1.67 2.03 -1.26 -4.93 116.55 107.15 2no8 n ASP 59 Ca 0.00 -0.35 -0.37 0.00 0.52 0.00 0.00 54.79 54.59 2no8 n ASP 59 Cb 0.00 1.45 -0.03 0.00 -0.72 0.00 0.00 41.12 41.82 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 -3.30 4.12 0.64 -0.67 6.06 -1.26 -4.99 118.95 119.55 2no8 s ARG 60 Ca -0.01 1.64 -0.18 0.00 -2.50 0.00 0.00 55.73 54.69 2no8 s ARG 60 Cb 0.15 -2.60 -0.01 0.00 0.06 0.00 0.00 34.95 32.54 2no8 s ARG 60 CO 0.88 -0.20 1.22 -2.00 -2.50 0.00 0.00 175.30 172.69 2no8 s GLU 61 N -2.39 2.69 -1.12 5.12 2.56 -1.26 -4.65 118.70 119.65 2no8 s GLU 61 Ca 0.57 1.83 -0.07 0.00 0.00 0.00 0.00 54.97 57.31 2no8 s GLU 61 Cb -0.26 -1.89 0.28 0.00 2.00 0.00 0.00 34.13 34.26 2no8 s GLU 61 CO 0.32 -1.42 1.40 -3.47 -0.56 0.00 0.00 175.26 171.52 2no8 n ASP 62 N -1.95 5.93 -3.91 -1.70 -0.08 -1.26 -4.41 116.55 109.17 2no8 n ASP 62 Ca 0.14 -3.23 -0.10 0.00 -1.51 0.00 0.00 54.79 50.09 2no8 n ASP 62 Cb 0.50 -1.35 -0.06 0.00 2.34 0.00 0.00 41.12 42.55 2no8 n ASP 62 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2no8 s SER 63 N -0.21 -0.04 0.51 1.67 1.04 -1.26 -4.96 113.70 110.45 2no8 s SER 63 Ca 0.33 -0.78 0.19 0.00 0.48 0.00 0.00 55.95 56.17 2no8 s SER 63 Cb -0.00 0.48 1.28 0.00 0.10 0.00 0.00 66.02 67.88 2no8 s SER 63 CO 0.03 -0.95 2.07 -0.65 0.98 0.00 0.00 173.24 174.72 2no8 h PRO 64 N 2.44 0.06 -0.14 4.02 0.11 -1.92 -1.84 132.00 134.73 2no8 h PRO 64 Ca -0.31 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.75 2no8 h PRO 64 Cb 1.24 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2no8 h PRO 64 CO 0.45 0.04 -0.11 0.93 -0.21 0.00 0.00 178.00 179.10 2no8 h GLU 65 N 0.06 0.32 -0.63 1.05 5.08 -1.95 -2.91 114.58 115.60 2no8 h GLU 65 Ca 0.13 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 2no8 h GLU 65 Cb 0.43 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 2no8 h GLU 65 CO -0.01 0.69 0.29 0.78 -1.00 0.00 0.00 179.01 179.75 2no8 h GLY 66 N -0.04 0.97 1.05 -3.84 0.00 -1.61 0.14 103.07 99.74 2no8 h GLY 66 Ca 0.03 -0.47 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 2no8 h GLY 66 CO 0.03 0.45 0.14 -2.22 0.00 0.00 0.00 176.54 174.94 2no8 h ILE 67 N 0.90 1.26 -0.59 2.60 2.04 -1.38 -2.43 117.51 119.91 2no8 h ILE 67 Ca 0.22 -0.97 -0.09 0.00 1.00 0.00 0.00 64.86 65.02 2no8 h ILE 67 Cb 0.12 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 2no8 h ILE 67 CO -0.03 0.37 0.03 0.58 0.00 0.00 0.00 178.15 179.10 2no8 h VAL 68 N 0.99 1.26 -0.89 1.67 2.07 -1.18 -3.05 116.25 117.12 2no8 h VAL 68 Ca 0.20 -1.10 0.11 0.00 0.82 0.00 0.00 66.70 66.73 2no8 h VAL 68 Cb 0.39 0.81 -0.08 0.00 -1.52 0.00 0.00 31.29 30.89 2no8 h VAL 68 CO 0.01 0.40 0.53 0.50 0.02 0.00 0.00 177.57 179.02 2no8 h LYS 69 N 0.92 0.83 0.55 1.57 1.63 -0.31 0.42 116.57 122.18 2no8 h LYS 69 Ca 0.17 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.90 2no8 h LYS 69 Cb 0.51 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.94 2no8 h LYS 69 CO 0.02 0.55 -0.40 0.93 -3.45 0.00 0.00 179.45 177.11 2no8 h GLU 70 N 0.86 -0.88 -0.93 1.90 4.39 -1.34 0.19 114.58 118.77 2no8 h GLU 70 Ca 0.44 0.06 0.03 0.00 0.34 0.00 0.00 59.36 60.23 2no8 h GLU 70 Cb 0.42 0.20 -0.05 0.00 -0.10 0.00 0.00 28.75 29.22 2no8 h GLU 70 CO -0.26 -0.59 0.61 0.82 -1.16 0.00 0.00 179.01 178.43 2no8 h ILE 71 N -0.92 1.16 0.42 3.13 2.04 -1.36 0.35 117.51 122.34 2no8 h ILE 71 Ca -0.06 -0.40 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 2no8 h ILE 71 Cb 0.77 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 2no8 h ILE 71 CO 0.02 0.21 -0.20 0.50 0.00 0.00 0.00 178.15 178.69 2no8 h LYS 72 N 1.17 -0.54 -0.07 2.37 3.11 0.10 -1.36 116.57 121.36 2no8 h LYS 72 Ca 0.37 0.04 -0.10 0.00 -2.81 0.00 0.00 60.65 58.15 2no8 h LYS 72 Cb 0.00 0.12 -0.01 0.00 -1.00 0.00 0.00 32.23 31.34 2no8 h LYS 72 CO -0.11 -0.23 -0.40 0.93 -2.81 0.00 0.00 179.45 176.83 2no8 h GLU 73 N -0.90 0.15 0.37 1.90 4.39 -0.50 -2.64 114.58 117.35 2no8 h GLU 73 Ca -0.06 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.56 2no8 h GLU 73 Cb 0.56 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2no8 h GLU 73 CO 0.09 0.53 -0.18 2.35 -1.16 0.00 0.00 179.01 180.65 2no8 h TRP 74 N 0.13 -0.46 -0.10 4.33 7.01 -0.92 -2.72 115.95 123.22 2no8 h TRP 74 Ca 0.01 -0.01 -0.08 0.00 2.11 0.00 0.00 58.89 60.92 2no8 h TRP 74 Cb 0.77 0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.97 2no8 h TRP 74 CO 0.01 -0.13 -0.31 0.00 -2.79 0.00 0.00 178.44 175.22 2no8 h ARG 75 N -0.94 0.20 -0.10 2.65 3.08 -1.25 -0.17 114.38 117.84 2no8 h ARG 75 Ca -0.05 -0.07 -0.11 0.00 0.07 0.00 0.00 59.98 59.82 2no8 h ARG 75 Cb 0.53 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 2no8 h ARG 75 CO 0.08 0.49 -0.42 0.00 -1.07 0.00 0.00 179.97 179.06 2no8 h ALA 76 N 1.51 1.12 0.00 0.04 0.00 -1.55 0.15 119.26 120.53 2no8 h ALA 76 Ca 0.02 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 54.42 2no8 h ALA 76 Cb 0.64 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2no8 h ALA 76 CO 0.05 0.59 -0.78 0.00 0.00 0.00 0.00 179.25 179.10 2no8 h ALA 77 N 1.39 0.68 0.00 0.00 0.00 -0.96 -3.15 119.26 117.22 2no8 h ALA 77 Ca 0.02 -0.50 -0.12 0.00 0.00 0.00 0.00 54.91 54.31 2no8 h ALA 77 Cb 0.82 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2no8 h ALA 77 CO 0.06 0.61 -0.61 -0.91 0.00 0.00 0.00 179.25 178.40 2no8 h ASN 78 N 0.00 0.00 -0.18 0.00 -0.26 -0.79 -3.47 115.58 110.88 2no8 h ASN 78 Ca -0.05 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.69 2no8 h ASN 78 Cb 1.38 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.64 2no8 h ASN 78 CO 0.05 0.54 0.00 0.61 -1.06 0.00 0.00 177.43 177.57 2no8 n GLY 79 N 1.25 0.85 0.82 2.83 0.00 -0.35 -5.07 105.19 105.52 2no8 n GLY 79 Ca 0.01 -0.61 -0.04 0.00 0.00 0.00 0.00 46.02 45.38 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 -0.85 0.80 -0.62 1.61 5.02 0.39 -5.04 118.16 119.47 2no8 n LYS 80 Ca 0.00 -0.64 -0.28 0.00 -2.02 0.00 0.00 58.31 55.37 2no8 n LYS 80 Cb 0.36 -0.07 0.24 0.00 -0.02 0.00 0.00 35.03 35.54 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 -1.79 1.23 0.00 4.39 0.01 -1.26 -4.72 113.70 111.56 2no8 s SER 81 Ca 0.13 1.52 0.00 0.00 1.31 0.00 0.00 55.95 58.91 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 -4.04 0.00 0.61 0.41 0.00 0.00 173.24 170.30 2no8 n GLY 82 N 0.56 5.54 3.42 3.44 0.00 -1.26 -4.57 105.19 112.31 2no8 n GLY 82 Ca 0.04 -1.10 -0.21 0.00 0.00 0.00 0.00 46.02 44.75 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 2.04 1.90 -0.11 1.61 0.08 -1.26 -2.98 117.98 119.26 2no8 s PHE 83 Ca 0.00 -0.76 -0.30 0.00 0.12 0.00 0.00 56.93 56.00 2no8 s PHE 83 Cb 0.00 -1.11 -0.02 0.00 -0.57 0.00 0.00 43.02 41.33 2no8 s PHE 83 CO 0.00 0.21 1.12 0.21 -0.10 0.00 0.00 175.22 176.65 2no8 s LYS 84 N -3.76 4.35 -0.00 0.44 2.20 0.17 -4.87 119.74 118.26 2no8 s LYS 84 Ca 0.30 1.53 0.00 0.00 -0.36 0.00 0.00 55.97 57.44 2no8 s LYS 84 Cb 0.05 -3.59 0.01 0.00 -1.51 0.00 0.00 37.83 32.79 2no8 s LYS 84 CO 0.12 -0.46 0.83 0.00 -0.36 0.00 0.00 175.35 175.48 2no8 n GLN 85 N 5.48 1.04 0.00 4.03 0.00 -1.26 -3.69 117.38 122.98 2no8 n GLN 85 Ca 0.11 -0.05 0.00 0.00 0.00 0.00 0.00 57.00 57.06 2no8 n GLN 85 Cb 0.47 -1.19 0.00 0.00 0.00 0.00 0.00 30.24 29.52 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47