#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 1.03 0.55 4.31 1.43 -1.26 -5.15 118.68 119.60 2no8 s LEU 3 Ca 0.00 0.46 -0.21 0.00 -1.03 0.00 0.00 54.13 53.35 2no8 s LEU 3 Cb 0.00 0.76 -0.05 0.00 0.03 0.00 0.00 46.19 46.93 2no8 s LEU 3 CO 0.00 -0.09 1.28 2.29 0.23 0.00 0.00 176.35 180.06 2no8 n LYS 4 N 3.17 1.52 -0.01 1.70 -0.00 -1.26 -4.96 118.16 118.32 2no8 n LYS 4 Ca -0.15 0.56 -0.09 0.00 -0.00 0.00 0.00 58.31 58.64 2no8 n LYS 4 Cb 0.57 -2.49 -0.14 0.00 -0.00 0.00 0.00 35.03 32.98 2no8 n LYS 4 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.40 178.52 2no8 h HIS 5 N 1.24 0.02 -2.86 5.58 2.07 -2.00 -3.49 115.15 115.71 2no8 h HIS 5 Ca -0.50 -0.02 -0.10 0.00 -2.85 0.00 0.00 60.37 56.90 2no8 h HIS 5 Cb 1.32 -0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.27 2no8 h HIS 5 CO 0.44 1.03 -0.01 -1.13 -3.07 0.00 0.00 177.93 175.19 2no8 n SER 6 N -3.09 -0.82 0.17 3.10 3.41 -1.26 -5.02 113.62 110.11 2no8 n SER 6 Ca -0.16 -1.91 0.03 0.00 -0.26 0.00 0.00 58.87 56.57 2no8 n SER 6 Cb 1.04 1.47 0.26 0.00 -0.26 0.00 0.00 64.21 66.72 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 1.51 1.10 0.00 -1.33 2.10 -1.91 -3.13 117.51 115.85 2no8 h ILE 7 Ca -0.15 -1.78 0.00 0.00 1.08 0.00 0.00 64.86 64.02 2no8 h ILE 7 Cb 0.60 2.03 0.00 0.00 -1.09 0.00 0.00 36.82 38.36 2no8 h ILE 7 CO 0.19 0.46 0.00 -0.24 -1.08 0.00 0.00 178.15 177.49 2no8 n SER 8 N -3.63 0.00 0.02 2.19 2.88 -1.24 -1.32 113.62 112.52 2no8 n SER 8 Ca -0.01 0.16 -0.11 0.00 -1.33 0.00 0.00 58.87 57.58 2no8 n SER 8 Cb 0.56 -0.36 0.02 0.00 -0.75 0.00 0.00 64.21 63.67 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 0.64 -3.94 -3.46 1.82 -1.85 -3.12 116.42 106.51 2no8 h ASP 9 Ca 0.00 -0.39 -0.48 0.00 -0.39 0.00 0.00 57.03 55.77 2no8 h ASP 9 Cb 0.28 -0.19 0.01 0.00 0.68 0.00 0.00 39.33 40.11 2no8 h ASP 9 CO 0.00 1.13 0.40 -0.31 -1.61 0.00 0.00 179.24 178.85 2no8 s TYR 10 N -3.79 3.38 0.71 0.28 1.51 -0.43 -4.74 117.35 114.27 2no8 s TYR 10 Ca -0.07 1.68 -0.04 0.00 -1.01 0.00 0.00 57.07 57.62 2no8 s TYR 10 Cb 0.10 -3.08 0.10 0.00 -0.11 0.00 0.00 41.96 38.97 2no8 s TYR 10 CO 0.86 -0.41 1.00 0.95 -1.11 0.00 0.00 175.55 176.83 2no8 s THR 11 N -1.64 2.26 0.21 -0.71 -4.23 -1.26 -0.11 115.64 110.17 2no8 s THR 11 Ca 0.55 -0.42 -0.09 0.00 -1.18 0.00 0.00 61.69 60.55 2no8 s THR 11 Cb -0.21 -2.84 0.16 0.00 1.34 0.00 0.00 72.50 70.94 2no8 s THR 11 CO 0.27 0.00 1.85 -0.08 -0.54 0.00 0.00 174.62 176.12 2no8 h GLU 12 N -0.58 0.87 -0.31 3.99 4.81 -1.91 -1.00 114.58 120.44 2no8 h GLU 12 Ca -0.41 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 58.60 2no8 h GLU 12 Cb 1.28 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 2no8 h GLU 12 CO 0.49 0.58 -0.46 0.00 -0.73 0.00 0.00 179.01 178.89 2no8 h ALA 13 N 1.31 0.48 -0.47 2.92 0.00 -1.93 0.58 119.26 122.14 2no8 h ALA 13 Ca 0.29 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.65 2no8 h ALA 13 Cb 0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2no8 h ALA 13 CO -0.11 0.63 -0.02 0.93 0.00 0.00 0.00 179.25 180.68 2no8 h GLU 14 N 0.65 0.80 0.01 0.00 4.39 -1.84 -0.57 114.58 118.01 2no8 h GLU 14 Ca 0.03 -0.23 -0.20 0.00 0.34 0.00 0.00 59.36 59.31 2no8 h GLU 14 Cb 1.06 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.61 2no8 h GLU 14 CO 0.11 0.82 -0.88 0.35 -1.16 0.00 0.00 179.01 178.24 2no8 h PHE 15 N 0.74 0.25 0.00 4.33 3.04 -1.11 -2.48 116.94 121.70 2no8 h PHE 15 Ca 0.14 -0.14 -0.02 0.00 3.98 0.00 0.00 57.97 61.93 2no8 h PHE 15 Cb 0.48 -0.03 -0.00 0.00 2.56 0.00 0.00 35.95 38.96 2no8 h PHE 15 CO 0.03 0.96 -0.12 1.25 -2.02 0.00 0.00 178.31 178.41 2no8 h LEU 16 N 0.09 0.00 -0.55 0.59 6.46 -0.33 0.32 115.31 121.88 2no8 h LEU 16 Ca -0.04 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.72 2no8 h LEU 16 Cb 1.52 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.45 2no8 h LEU 16 CO 0.13 0.12 0.00 -0.33 -0.62 0.00 0.00 178.44 177.74 2no8 h GLU 17 N 0.00 0.00 -0.37 1.25 5.08 -0.69 -3.24 114.58 116.60 2no8 h GLU 17 Ca -0.00 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 2no8 h GLU 17 Cb 0.45 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.64 2no8 h GLU 17 CO 0.02 0.00 -0.01 0.27 -1.00 0.00 0.00 179.01 178.28 2no8 h PHE 18 N 0.00 -0.05 -0.19 4.33 -0.00 0.08 0.42 116.94 121.53 2no8 h PHE 18 Ca 0.00 0.03 -0.19 0.00 -0.00 0.00 0.00 57.97 57.80 2no8 h PHE 18 Cb 0.79 0.08 0.00 0.00 -0.00 0.00 0.00 35.95 36.82 2no8 h PHE 18 CO 0.00 -0.09 -0.66 -0.24 -0.00 0.00 0.00 178.31 177.32 2no8 h VAL 19 N 0.08 1.30 -0.61 0.88 3.04 -1.64 0.16 116.25 119.47 2no8 h VAL 19 Ca 0.18 -1.90 -0.08 0.00 -1.01 0.00 0.00 66.70 63.89 2no8 h VAL 19 Cb 0.26 1.86 -0.02 0.00 -2.01 0.00 0.00 31.29 31.37 2no8 h VAL 19 CO -0.32 0.60 0.05 0.11 -1.01 0.00 0.00 177.57 177.00 2no8 h LYS 20 N 0.52 1.03 -0.45 4.17 1.57 -1.48 0.30 116.57 122.23 2no8 h LYS 20 Ca -0.02 -0.29 -0.03 0.00 -1.87 0.00 0.00 60.65 58.44 2no8 h LYS 20 Cb 1.26 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 33.44 2no8 h LYS 20 CO 0.13 0.98 0.16 -0.22 -0.57 0.00 0.00 179.45 179.93 2no8 h LYS 21 N 0.96 0.68 -0.39 3.15 3.64 0.20 0.30 116.57 125.11 2no8 h LYS 21 Ca 0.18 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2no8 h LYS 21 Cb 0.49 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.18 2no8 h LYS 21 CO 0.02 0.64 0.18 0.82 -2.27 0.00 0.00 179.45 178.85 2no8 h ILE 22 N 0.58 1.17 -0.99 2.00 2.04 -0.73 -0.04 117.51 121.54 2no8 h ILE 22 Ca 0.15 -0.49 0.02 0.00 1.00 0.00 0.00 64.86 65.54 2no8 h ILE 22 Cb 0.24 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.05 2no8 h ILE 22 CO -0.01 0.18 0.65 0.00 0.00 0.00 0.00 178.15 178.98 2no8 h ARG 24 N 1.30 0.24 -0.93 0.00 0.11 -0.77 -3.28 114.38 111.05 2no8 h ARG 24 Ca 0.38 -0.40 -0.02 0.00 0.10 0.00 0.00 59.98 60.04 2no8 h ARG 24 Cb -0.08 0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.14 2no8 h ARG 24 CO -0.10 1.15 0.02 0.00 0.10 0.00 0.00 179.97 181.14 2no8 n ALA 25 N -2.56 2.85 -0.19 0.08 0.00 -0.05 -4.61 120.51 116.03 2no8 n ALA 25 Ca -0.10 -0.44 0.30 0.00 0.00 0.00 0.00 53.44 53.20 2no8 n ALA 25 Cb 1.02 -1.04 0.70 0.00 0.00 0.00 0.00 19.45 20.14 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 0.74 0.00 -2.05 0.00 4.11 -1.56 -3.38 114.58 112.44 2no8 h GLU 26 Ca 0.02 0.00 -0.42 0.00 0.07 0.00 0.00 59.36 59.03 2no8 h GLU 26 Cb 0.91 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 29.83 2no8 h GLU 26 CO 0.12 0.00 -0.74 0.20 0.07 0.00 0.00 179.01 178.66 2no8 s GLY 27 N -3.85 0.22 -0.12 1.06 0.00 -1.26 -4.65 107.32 98.72 2no8 s GLY 27 Ca -0.04 -1.31 0.10 0.00 0.00 0.00 0.00 44.72 43.46 2no8 s GLY 27 CO 0.68 2.60 0.03 0.00 0.00 0.00 0.00 173.10 176.41 2no8 n ALA 28 N 3.93 1.71 -3.61 3.20 0.00 -1.26 -5.05 120.51 119.43 2no8 n ALA 28 Ca 0.14 -0.76 -0.02 0.00 0.00 0.00 0.00 53.44 52.81 2no8 n ALA 28 Cb 0.45 0.01 -0.01 0.00 0.00 0.00 0.00 19.45 19.90 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 -2.28 0.00 0.30 0.00 -4.23 -1.26 -4.95 115.64 103.22 2no8 s THR 29 Ca -0.07 -0.14 0.09 0.00 -1.18 0.00 0.00 61.69 60.40 2no8 s THR 29 Cb 0.04 -1.47 0.02 0.00 1.34 0.00 0.00 72.50 72.43 2no8 s THR 29 CO 0.46 0.00 1.69 1.05 -0.54 0.00 0.00 174.62 177.29 2no8 h GLU 30 N 2.00 0.09 -0.12 3.99 9.09 -1.97 -2.52 114.58 125.15 2no8 h GLU 30 Ca -0.20 -0.05 -0.08 0.00 0.05 0.00 0.00 59.36 59.09 2no8 h GLU 30 Cb 1.19 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.28 2no8 h GLU 30 CO 0.26 0.56 -0.28 1.05 0.05 0.00 0.00 179.01 180.65 2no8 h GLU 31 N 0.07 0.23 -0.09 1.06 4.11 -1.96 0.01 114.58 118.00 2no8 h GLU 31 Ca 0.00 -0.08 -0.08 0.00 0.07 0.00 0.00 59.36 59.27 2no8 h GLU 31 Cb 0.89 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 2no8 h GLU 31 CO 0.07 0.50 -0.31 0.22 0.07 0.00 0.00 179.01 179.56 2no8 h ASP 32 N 0.20 0.18 0.28 3.06 3.58 -1.82 0.24 116.42 122.14 2no8 h ASP 32 Ca 0.03 -0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.41 2no8 h ASP 32 Cb 0.61 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.62 2no8 h ASP 32 CO 0.04 0.49 -0.14 -0.78 -2.88 0.00 0.00 179.24 175.97 2no8 h ASP 33 N 0.16 -0.32 -0.94 2.28 1.82 -1.35 -3.31 116.42 114.75 2no8 h ASP 33 Ca 0.02 -0.18 0.09 0.00 -0.39 0.00 0.00 57.03 56.57 2no8 h ASP 33 Cb 0.63 0.08 -0.07 0.00 0.68 0.00 0.00 39.33 40.65 2no8 h ASP 33 CO 0.05 0.16 0.58 -1.13 -1.61 0.00 0.00 179.24 177.29 2no8 h ASN 34 N -0.97 0.89 0.17 2.28 -1.24 -0.75 -1.36 115.58 114.60 2no8 h ASN 34 Ca -0.04 0.03 -0.03 0.00 0.71 0.00 0.00 56.30 56.97 2no8 h ASN 34 Cb 0.48 -0.15 -0.00 0.00 0.73 0.00 0.00 38.32 39.38 2no8 h ASN 34 CO 0.06 0.52 -0.15 0.07 -1.29 0.00 0.00 177.43 176.64 2no8 h LYS 35 N 0.99 0.00 -0.01 6.67 2.10 -0.65 0.12 116.57 125.80 2no8 h LYS 35 Ca 0.44 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 59.08 2no8 h LYS 35 Cb 0.32 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.65 2no8 h LYS 35 CO -0.22 0.15 -0.01 -0.07 -2.00 0.00 0.00 179.45 177.30 2no8 h LEU 36 N 0.00 0.03 -0.48 7.07 3.38 -1.35 -2.95 115.31 121.01 2no8 h LEU 36 Ca -0.00 -0.50 0.10 0.00 0.09 0.00 0.00 57.88 57.56 2no8 h LEU 36 Cb 0.28 -0.01 -0.09 0.00 0.09 0.00 0.00 40.66 40.93 2no8 h LEU 36 CO 0.02 0.53 -0.07 0.58 0.09 0.00 0.00 178.44 179.59 2no8 h VAL 37 N -0.46 0.56 -0.46 1.22 2.07 -1.02 -1.63 116.25 116.53 2no8 h VAL 37 Ca 0.00 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.46 2no8 h VAL 37 Cb 0.52 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2no8 h VAL 37 CO 0.00 0.01 0.09 0.03 0.02 0.00 0.00 177.57 177.72 2no8 h ARG 38 N 0.05 0.70 -0.08 1.57 2.47 -0.83 0.26 114.38 118.52 2no8 h ARG 38 Ca 0.24 -0.14 -0.17 0.00 -1.26 0.00 0.00 59.98 58.65 2no8 h ARG 38 Cb 0.36 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.57 2no8 h ARG 38 CO -0.46 0.66 -0.67 1.05 0.56 0.00 0.00 179.97 181.11 2no8 h GLU 39 N 0.68 0.33 -0.12 0.04 4.11 -1.14 -1.35 114.58 117.13 2no8 h GLU 39 Ca 0.15 -0.25 -0.13 0.00 0.07 0.00 0.00 59.36 59.19 2no8 h GLU 39 Cb 0.29 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 2no8 h GLU 39 CO 0.00 0.88 -0.51 0.74 0.07 0.00 0.00 179.01 180.20 2no8 h PHE 40 N 0.23 0.39 -0.02 2.06 0.04 -0.71 -0.63 116.94 118.30 2no8 h PHE 40 Ca -0.02 -0.13 -0.04 0.00 2.80 0.00 0.00 57.97 60.59 2no8 h PHE 40 Cb 1.22 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 39.29 2no8 h PHE 40 CO 0.03 0.76 -0.16 0.93 -0.60 0.00 0.00 178.31 179.27 2no8 h GLU 41 N 0.25 0.04 0.03 1.51 5.08 -0.17 -0.88 114.58 120.43 2no8 h GLU 41 Ca 0.01 -0.01 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 2no8 h GLU 41 Cb 0.98 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 2no8 h GLU 41 CO 0.08 0.20 -0.98 0.00 -1.00 0.00 0.00 179.01 177.31 2no8 h ARG 42 N 0.03 0.23 -0.65 2.33 3.08 -0.39 0.58 114.38 119.59 2no8 h ARG 42 Ca 0.01 -0.29 -0.09 0.00 0.07 0.00 0.00 59.98 59.68 2no8 h ARG 42 Cb 0.31 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 2no8 h ARG 42 CO 0.02 1.04 0.06 -0.07 -1.07 0.00 0.00 179.97 179.96 2no8 h LEU 43 N 0.11 1.07 0.05 3.04 3.38 -0.77 -3.22 115.31 118.98 2no8 h LEU 43 Ca -0.07 -0.28 -0.30 0.00 0.09 0.00 0.00 57.88 57.33 2no8 h LEU 43 Cb 1.64 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 42.07 2no8 h LEU 43 CO 0.15 1.08 -1.65 0.71 0.09 0.00 0.00 178.44 178.83 2no8 h THR 44 N 1.02 0.96 -2.36 0.22 1.35 -1.15 -3.42 112.91 109.54 2no8 h THR 44 Ca 0.19 -2.74 -0.35 0.00 -0.55 0.00 0.00 66.41 62.97 2no8 h THR 44 Cb 0.50 2.55 -0.03 0.00 -1.73 0.00 0.00 68.15 69.44 2no8 h THR 44 CO 0.02 0.68 -0.44 -0.62 -0.25 0.00 0.00 175.52 174.91 2no8 n GLU 45 N -3.24 -1.38 -3.02 4.72 1.02 0.20 -4.97 120.64 113.98 2no8 n GLU 45 Ca -0.18 0.86 -0.40 0.00 -0.02 0.00 0.00 57.16 57.43 2no8 n GLU 45 Cb 1.04 -5.32 -0.05 0.00 -0.02 0.00 0.00 31.44 27.09 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 -2.85 3.46 0.22 -0.32 2.46 -1.08 -4.95 115.29 112.24 2no8 s HIS 46 Ca 0.00 1.15 -0.05 0.00 0.47 0.00 0.00 55.06 56.62 2no8 s HIS 46 Cb 0.00 -2.87 0.21 0.00 -0.13 0.00 0.00 32.58 29.79 2no8 s HIS 46 CO 0.00 -0.10 1.71 -1.00 -2.47 0.00 0.00 174.74 172.89 2no8 h PRO 47 N 7.16 0.95 -0.41 2.88 0.13 -1.93 -2.62 132.00 138.16 2no8 h PRO 47 Ca -0.34 -0.27 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2no8 h PRO 47 Cb 1.16 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2no8 h PRO 47 CO 0.79 0.92 0.00 -0.25 -0.23 0.00 0.00 178.00 179.23 2no8 n ASP 48 N -4.20 4.18 -0.30 1.44 8.00 -1.26 -4.61 116.55 119.80 2no8 n ASP 48 Ca 0.03 -2.69 0.09 0.00 0.71 0.00 0.00 54.79 52.93 2no8 n ASP 48 Cb 0.31 -0.51 0.25 0.00 -0.02 0.00 0.00 41.12 41.15 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 2.67 1.45 0.84 0.44 0.00 -1.86 0.23 103.07 106.84 2no8 h GLY 49 Ca 0.00 -0.24 -0.11 0.00 0.00 0.00 0.00 47.33 46.97 2no8 h GLY 49 CO 0.22 -0.09 -0.36 1.76 0.00 0.00 0.00 176.54 178.08 2no8 h SER 50 N 0.59 0.57 -0.45 0.19 0.02 -1.83 -3.23 113.55 109.40 2no8 h SER 50 Ca 0.49 -0.57 0.02 0.00 -0.84 0.00 0.00 61.79 60.89 2no8 h SER 50 Cb 0.76 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.12 2no8 h SER 50 CO -0.40 1.04 0.30 0.44 -1.14 0.00 0.00 176.83 177.07 2no8 h ASP 51 N 0.12 0.47 -0.94 3.07 3.32 -1.21 -0.55 116.42 120.70 2no8 h ASP 51 Ca -0.00 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.06 2no8 h ASP 51 Cb 0.96 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.35 2no8 h ASP 51 CO 0.08 0.33 0.62 -0.07 -1.72 0.00 0.00 179.24 178.48 2no8 h LEU 52 N 0.55 1.06 -0.07 1.55 3.38 -0.69 0.48 115.31 121.57 2no8 h LEU 52 Ca 0.18 -0.02 -0.21 0.00 0.09 0.00 0.00 57.88 57.91 2no8 h LEU 52 Cb 0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 2no8 h LEU 52 CO -0.04 0.75 -0.99 0.40 0.09 0.00 0.00 178.44 178.65 2no8 h ILE 53 N 1.25 1.64 0.14 1.22 2.04 -1.21 -3.33 117.51 119.26 2no8 h ILE 53 Ca 0.36 -3.19 -0.36 0.00 1.00 0.00 0.00 64.86 62.66 2no8 h ILE 53 Cb -0.09 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 38.75 2no8 h ILE 53 CO -0.09 0.92 -1.92 1.88 0.00 0.00 0.00 178.15 178.93 2no8 h TYR 54 N 0.02 0.53 -3.58 1.37 0.05 -0.98 -3.47 116.97 110.92 2no8 h TYR 54 Ca -0.03 -0.38 -0.42 0.00 0.05 0.00 0.00 58.73 57.94 2no8 h TYR 54 Cb 1.72 -0.02 -0.33 0.00 1.01 0.00 0.00 36.73 39.11 2no8 h TYR 54 CO 0.01 1.73 -0.78 0.71 -1.05 0.00 0.00 178.16 178.78 2no8 s TYR 55 N -2.57 0.87 0.56 4.88 2.02 0.16 -5.08 117.35 118.20 2no8 s TYR 55 Ca -0.20 -0.25 -0.20 0.00 -0.37 0.00 0.00 57.07 56.05 2no8 s TYR 55 Cb 0.06 -0.69 -0.04 0.00 -0.40 0.00 0.00 41.96 40.89 2no8 s TYR 55 CO 0.79 -0.16 1.26 -1.25 -1.57 0.00 0.00 175.55 174.62 2no8 s PRO 56 N 0.61 3.09 0.00 -1.71 0.04 -1.26 -4.25 135.00 131.53 2no8 s PRO 56 Ca -0.09 1.99 0.00 0.00 0.04 0.00 0.00 61.00 62.94 2no8 s PRO 56 Cb -0.12 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.32 2no8 s PRO 56 CO 0.01 -1.15 0.00 0.54 0.04 0.00 0.00 177.00 176.43 2no8 n ARG 57 N -1.27 0.00 0.00 4.56 1.74 -1.26 -5.07 116.66 115.35 2no8 n ARG 57 Ca 0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.20 2no8 n ARG 57 Cb 0.48 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.92 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 0.00 0.09 0.55 2.03 -1.26 -4.87 116.55 113.09 2no8 n ASP 58 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2no8 n ASP 58 Cb 0.00 -0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2no8 h ASP 59 N 0.00 0.00 -3.76 1.67 1.82 -2.05 -3.46 116.42 110.64 2no8 h ASP 59 Ca 0.00 0.00 -0.51 0.00 -0.39 0.00 0.00 57.03 56.13 2no8 h ASP 59 Cb 0.00 0.00 0.02 0.00 0.68 0.00 0.00 39.33 40.03 2no8 h ASP 59 CO 0.00 0.60 0.51 -0.60 -1.61 0.00 0.00 179.24 178.14 2no8 s ARG 60 N -2.91 4.57 0.26 0.28 6.06 -1.26 -4.97 118.95 120.99 2no8 s ARG 60 Ca 0.01 1.88 -0.30 0.00 -2.50 0.00 0.00 55.73 54.82 2no8 s ARG 60 Cb 0.08 -3.18 -0.10 0.00 0.06 0.00 0.00 34.95 31.81 2no8 s ARG 60 CO 0.78 0.10 1.46 -2.00 -2.50 0.00 0.00 175.30 173.15 2no8 s GLU 61 N -1.29 4.24 -1.25 5.12 2.56 -1.26 -4.42 118.70 122.40 2no8 s GLU 61 Ca 0.46 2.36 -0.18 0.00 0.00 0.00 0.00 54.97 57.62 2no8 s GLU 61 Cb -0.33 -3.09 0.09 0.00 2.00 0.00 0.00 34.13 32.80 2no8 s GLU 61 CO 0.42 -0.45 1.64 0.34 -0.56 0.00 0.00 175.26 176.65 2no8 s ASP 62 N 0.33 6.86 0.12 -1.70 2.15 -1.26 -4.25 116.67 118.91 2no8 s ASP 62 Ca 0.59 -2.47 -0.11 0.00 0.43 0.00 0.00 52.55 50.99 2no8 s ASP 62 Cb -0.43 -2.54 0.01 0.00 -0.30 0.00 0.00 42.92 39.66 2no8 s ASP 62 CO 0.45 -1.11 0.28 -0.94 -0.17 0.00 0.00 175.17 173.68 2no8 s SER 63 N 3.99 -0.01 0.53 -0.34 1.04 -1.26 -4.96 113.70 112.69 2no8 s SER 63 Ca 0.51 -0.59 0.22 0.00 0.48 0.00 0.00 55.95 56.56 2no8 s SER 63 Cb 0.02 0.41 1.35 0.00 0.10 0.00 0.00 66.02 67.89 2no8 s SER 63 CO 0.05 -0.81 2.05 -0.65 0.98 0.00 0.00 173.24 174.85 2no8 h PRO 64 N 2.58 0.01 -0.19 4.02 0.11 -1.94 -0.85 132.00 135.74 2no8 h PRO 64 Ca -0.33 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.74 2no8 h PRO 64 Cb 1.22 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2no8 h PRO 64 CO 0.51 0.01 -0.04 0.93 -0.21 0.00 0.00 178.00 179.20 2no8 h GLU 65 N 0.01 0.36 -0.63 1.05 5.08 -1.92 -2.56 114.58 115.96 2no8 h GLU 65 Ca 0.17 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 2no8 h GLU 65 Cb 0.67 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 2no8 h GLU 65 CO -0.00 0.60 0.16 0.78 -1.00 0.00 0.00 179.01 179.55 2no8 h GLY 66 N 0.08 1.06 0.81 -3.84 0.00 -1.43 0.75 103.07 100.50 2no8 h GLY 66 Ca 0.05 -0.63 0.04 0.00 0.00 0.00 0.00 47.33 46.78 2no8 h GLY 66 CO 0.02 0.59 0.35 -2.22 0.00 0.00 0.00 176.54 175.28 2no8 h ILE 67 N 0.94 1.03 -0.00 2.60 2.04 -1.15 -0.62 117.51 122.35 2no8 h ILE 67 Ca 0.20 -0.23 -0.13 0.00 1.00 0.00 0.00 64.86 65.70 2no8 h ILE 67 Cb 0.33 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.69 2no8 h ILE 67 CO -0.00 0.12 -0.62 0.58 0.00 0.00 0.00 178.15 178.24 2no8 h VAL 68 N 0.67 1.44 -0.24 1.67 2.07 -1.03 -3.03 116.25 117.80 2no8 h VAL 68 Ca 0.25 -2.10 -0.14 0.00 0.82 0.00 0.00 66.70 65.53 2no8 h VAL 68 Cb 0.07 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 2no8 h VAL 68 CO -0.13 0.60 -0.42 0.50 0.02 0.00 0.00 177.57 178.14 2no8 h LYS 69 N 0.01 0.60 -0.33 1.57 3.64 0.07 0.89 116.57 123.02 2no8 h LYS 69 Ca -0.01 -0.31 0.05 0.00 -1.27 0.00 0.00 60.65 59.11 2no8 h LYS 69 Cb 1.09 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.87 2no8 h LYS 69 CO 0.08 0.91 0.03 0.93 -2.27 0.00 0.00 179.45 179.13 2no8 h GLU 70 N 0.49 0.13 -0.32 1.90 4.39 -1.03 0.29 114.58 120.43 2no8 h GLU 70 Ca 0.04 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2no8 h GLU 70 Cb 0.94 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.54 2no8 h GLU 70 CO 0.08 0.09 0.15 0.82 -1.16 0.00 0.00 179.01 178.99 2no8 h ILE 71 N 0.14 1.16 0.20 3.13 2.04 -1.41 -0.39 117.51 122.38 2no8 h ILE 71 Ca 0.16 -0.47 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 2no8 h ILE 71 Cb 0.20 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2no8 h ILE 71 CO -0.24 0.17 -0.10 0.07 0.00 0.00 0.00 178.15 178.06 2no8 h LYS 72 N 0.38 -0.26 -0.26 2.37 2.10 -0.30 -2.20 116.57 118.40 2no8 h LYS 72 Ca 0.11 0.02 -0.09 0.00 -2.00 0.00 0.00 60.65 58.69 2no8 h LYS 72 Cb 0.13 0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.50 2no8 h LYS 72 CO -0.01 -0.04 -0.23 0.93 -2.00 0.00 0.00 179.45 178.10 2no8 h GLU 73 N -0.45 0.48 0.71 0.07 4.39 -0.42 0.82 114.58 120.18 2no8 h GLU 73 Ca -0.03 -0.17 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 2no8 h GLU 73 Cb 0.34 -0.03 0.01 0.00 -0.10 0.00 0.00 28.75 28.97 2no8 h GLU 73 CO 0.05 0.68 -0.34 2.35 -1.16 0.00 0.00 179.01 180.59 2no8 h TRP 74 N 0.43 -0.88 -0.49 4.33 7.01 -1.05 -0.28 115.95 125.02 2no8 h TRP 74 Ca 0.07 -0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.00 2no8 h TRP 74 Cb 0.64 0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 27.96 2no8 h TRP 74 CO 0.02 -0.52 0.10 0.00 -2.79 0.00 0.00 178.44 175.25 2no8 h ARG 75 N -1.14 0.75 -0.24 2.65 3.08 -1.28 0.30 114.38 118.50 2no8 h ARG 75 Ca -0.10 -0.15 -0.04 0.00 0.07 0.00 0.00 59.98 59.76 2no8 h ARG 75 Cb 0.76 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 2no8 h ARG 75 CO 0.16 0.70 -0.04 0.00 -1.07 0.00 0.00 179.97 179.72 2no8 h ALA 76 N 1.39 1.49 0.21 0.04 0.00 -0.78 0.41 119.26 122.01 2no8 h ALA 76 Ca 0.16 -0.18 -0.35 0.00 0.00 0.00 0.00 54.91 54.54 2no8 h ALA 76 Cb 0.30 -0.11 0.02 0.00 0.00 0.00 0.00 17.79 17.99 2no8 h ALA 76 CO 0.00 0.37 -1.69 0.00 0.00 0.00 0.00 179.25 177.93 2no8 h ALA 77 N 1.61 0.07 -0.53 0.00 0.00 0.24 -3.33 119.26 117.32 2no8 h ALA 77 Ca 0.08 -1.07 -0.07 0.00 0.00 0.00 0.00 54.91 53.85 2no8 h ALA 77 Cb 0.30 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 2no8 h ALA 77 CO 0.01 0.94 0.05 -0.91 0.00 0.00 0.00 179.25 179.34 2no8 h ASN 78 N 0.12 0.87 0.00 0.00 -0.26 -0.82 -3.47 115.58 112.02 2no8 h ASN 78 Ca -0.32 -0.28 0.00 0.00 -0.56 0.00 0.00 56.30 55.14 2no8 h ASN 78 Cb 2.12 -0.23 0.00 0.00 -1.06 0.00 0.00 38.32 39.15 2no8 h ASN 78 CO 0.21 0.93 0.00 0.61 -1.06 0.00 0.00 177.43 178.12 2no8 n GLY 79 N -0.47 1.79 0.00 2.83 0.00 -0.06 -5.09 105.19 104.19 2no8 n GLY 79 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -0.61 1.26 -1.00 1.61 5.02 -0.10 -5.05 118.16 119.29 2no8 n LYS 80 Ca 0.00 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 56.00 2no8 n LYS 80 Cb 0.00 0.00 0.19 0.00 -0.02 0.00 0.00 35.03 35.20 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 -1.00 2.42 0.07 4.39 0.15 -1.26 -4.77 113.70 113.69 2no8 s SER 81 Ca 0.00 1.40 0.01 0.00 0.70 0.00 0.00 55.95 58.06 2no8 s SER 81 Cb 0.00 -2.08 -0.00 0.00 -1.71 0.00 0.00 66.02 62.22 2no8 s SER 81 CO 0.00 -3.29 0.03 0.61 1.20 0.00 0.00 173.24 171.79 2no8 n GLY 82 N -0.55 3.94 3.97 9.45 0.00 -1.26 -4.57 105.19 116.17 2no8 n GLY 82 Ca 0.05 -1.91 -0.22 0.00 0.00 0.00 0.00 46.02 43.94 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 -1.86 2.64 0.01 1.61 0.08 -1.26 -3.67 117.98 115.53 2no8 s PHE 83 Ca 0.04 0.02 -0.30 0.00 0.12 0.00 0.00 56.93 56.81 2no8 s PHE 83 Cb 0.00 -2.88 -0.07 0.00 -0.57 0.00 0.00 43.02 39.51 2no8 s PHE 83 CO 0.03 -1.12 1.58 0.21 -0.10 0.00 0.00 175.22 175.82 2no8 s LYS 84 N -4.91 4.22 -0.26 0.44 2.47 0.85 -4.86 119.74 117.69 2no8 s LYS 84 Ca 0.59 2.18 0.13 0.00 -1.56 0.00 0.00 55.97 57.31 2no8 s LYS 84 Cb -0.10 -3.71 0.67 0.00 -1.46 0.00 0.00 37.83 33.24 2no8 s LYS 84 CO 0.41 -0.72 1.64 0.00 0.16 0.00 0.00 175.35 176.83 2no8 n GLN 85 N 6.00 3.54 -0.82 4.03 0.00 -1.26 -3.97 117.38 124.90 2no8 n GLN 85 Ca 0.15 -3.04 0.00 0.00 0.00 0.00 0.00 57.00 54.11 2no8 n GLN 85 Cb 0.42 -2.07 0.00 0.00 0.00 0.00 0.00 30.24 28.59 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47