#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2no8 n LEU 3 N 0.00 0.38 -4.33 -1.84 -0.00 -1.26 -5.10 117.00 104.85 2no8 n LEU 3 Ca 0.00 -0.38 -0.18 0.00 -0.00 0.00 0.00 56.01 55.46 2no8 n LEU 3 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.32 2no8 n LEU 3 CO 0.00 0.09 -0.23 -1.59 -0.00 0.00 0.00 177.39 175.66 2no8 s LYS 4 N -0.15 1.49 -0.03 1.47 0.00 -1.26 -5.05 119.74 116.21 2no8 s LYS 4 Ca 0.00 -1.83 0.06 0.00 0.00 0.00 0.00 55.97 54.20 2no8 s LYS 4 Cb 0.00 -0.21 -0.09 0.00 0.00 0.00 0.00 37.83 37.53 2no8 s LYS 4 CO 0.00 -0.36 0.08 -2.39 0.00 0.00 0.00 175.35 172.68 2no8 n HIS 5 N -0.52 0.00 -3.83 1.78 1.44 -1.26 -5.10 115.22 107.73 2no8 n HIS 5 Ca 0.00 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.62 2no8 n HIS 5 Cb 0.66 -0.23 0.02 0.00 0.12 0.00 0.00 29.99 30.56 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 -3.26 0.04 0.52 4.39 1.04 -1.26 -5.01 113.70 110.15 2no8 s SER 6 Ca -0.03 -1.12 0.31 0.00 0.48 0.00 0.00 55.95 55.59 2no8 s SER 6 Cb 0.03 0.83 1.17 0.00 0.10 0.00 0.00 66.02 68.16 2no8 s SER 6 CO 0.26 -1.64 1.91 -0.29 0.98 0.00 0.00 173.24 174.46 2no8 h ILE 7 N 2.01 0.11 0.00 -1.02 2.10 -1.89 -2.32 117.51 116.50 2no8 h ILE 7 Ca -0.31 -0.68 0.00 0.00 1.08 0.00 0.00 64.86 64.95 2no8 h ILE 7 Cb 1.25 1.61 0.00 0.00 -1.09 0.00 0.00 36.82 38.59 2no8 h ILE 7 CO 0.39 0.04 0.00 -0.24 -1.08 0.00 0.00 178.15 177.27 2no8 n SER 8 N -3.15 0.00 0.08 2.19 2.88 -1.26 -1.43 113.62 112.92 2no8 n SER 8 Ca 0.01 0.22 0.12 0.00 -1.33 0.00 0.00 58.87 57.89 2no8 n SER 8 Cb 0.35 -0.40 0.10 0.00 -0.75 0.00 0.00 64.21 63.52 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 -3.21 -3.46 3.58 -1.78 -3.20 116.42 108.35 2no8 h ASP 9 Ca 0.00 -0.16 -0.58 0.00 0.42 0.00 0.00 57.03 56.71 2no8 h ASP 9 Cb 0.33 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.33 2no8 h ASP 9 CO 0.00 0.08 -0.07 -0.31 -2.88 0.00 0.00 179.24 176.06 2no8 s TYR 10 N -3.23 3.77 0.68 0.28 1.51 -0.52 -4.79 117.35 115.04 2no8 s TYR 10 Ca 0.04 1.20 -0.06 0.00 -1.01 0.00 0.00 57.07 57.24 2no8 s TYR 10 Cb 0.12 -2.47 0.05 0.00 -0.11 0.00 0.00 41.96 39.55 2no8 s TYR 10 CO 0.75 0.56 0.98 0.95 -1.11 0.00 0.00 175.55 177.68 2no8 s THR 11 N -0.94 2.45 0.34 -0.71 -4.23 -1.26 0.27 115.64 111.57 2no8 s THR 11 Ca 0.28 -0.27 0.02 0.00 -1.18 0.00 0.00 61.69 60.54 2no8 s THR 11 Cb -0.19 -3.05 0.24 0.00 1.34 0.00 0.00 72.50 70.84 2no8 s THR 11 CO 0.17 -0.05 1.97 -0.08 -0.54 0.00 0.00 174.62 176.10 2no8 h GLU 12 N -0.50 0.78 -0.30 3.99 4.81 -1.93 0.10 114.58 121.52 2no8 h GLU 12 Ca -0.44 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 58.67 2no8 h GLU 12 Cb 1.31 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2no8 h GLU 12 CO 0.60 0.57 0.02 0.00 -0.73 0.00 0.00 179.01 179.46 2no8 h ALA 13 N 1.56 0.41 -0.37 2.92 0.00 -1.94 0.27 119.26 122.11 2no8 h ALA 13 Ca 0.20 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2no8 h ALA 13 Cb 0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2no8 h ALA 13 CO -0.03 0.14 -0.18 0.93 0.00 0.00 0.00 179.25 180.11 2no8 h GLU 14 N 0.33 0.69 -0.10 0.00 4.39 -1.81 -1.65 114.58 116.43 2no8 h GLU 14 Ca 0.09 -0.25 -0.13 0.00 0.34 0.00 0.00 59.36 59.41 2no8 h GLU 14 Cb 0.40 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 2no8 h GLU 14 CO 0.01 0.83 -0.51 0.35 -1.16 0.00 0.00 179.01 178.53 2no8 h PHE 15 N 0.62 0.33 0.00 4.33 3.57 -0.83 -2.23 116.94 122.72 2no8 h PHE 15 Ca 0.10 -0.11 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 2no8 h PHE 15 Cb 0.64 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 2no8 h PHE 15 CO 0.03 0.72 -0.10 1.25 -2.23 0.00 0.00 178.31 177.98 2no8 h LEU 16 N 0.21 0.00 -0.45 0.59 6.46 0.23 0.27 115.31 122.61 2no8 h LEU 16 Ca 0.01 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 2no8 h LEU 16 Cb 0.97 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.90 2no8 h LEU 16 CO 0.08 0.10 -0.03 -0.33 -0.62 0.00 0.00 178.44 177.64 2no8 h GLU 17 N 0.00 0.00 -0.24 1.25 5.08 -0.73 -3.14 114.58 116.80 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 0.59 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.78 2no8 h GLU 17 CO 0.01 0.03 -0.13 0.27 -1.00 0.00 0.00 179.01 178.19 2no8 h PHE 18 N 0.00 -0.32 -0.20 4.33 -0.00 -0.11 0.38 116.94 121.01 2no8 h PHE 18 Ca -0.00 0.03 -0.21 0.00 -0.00 0.00 0.00 57.97 57.79 2no8 h PHE 18 Cb 0.87 0.18 0.01 0.00 -0.00 0.00 0.00 35.95 37.01 2no8 h PHE 18 CO 0.00 -0.20 -0.69 -0.24 -0.00 0.00 0.00 178.31 177.18 2no8 h VAL 19 N -0.11 1.28 -0.74 0.88 3.04 -1.63 -0.19 116.25 118.77 2no8 h VAL 19 Ca 0.13 -1.88 -0.03 0.00 -1.01 0.00 0.00 66.70 63.91 2no8 h VAL 19 Cb 0.30 1.85 -0.03 0.00 -2.01 0.00 0.00 31.29 31.40 2no8 h VAL 19 CO -0.31 0.60 0.34 0.11 -1.01 0.00 0.00 177.57 177.31 2no8 h LYS 20 N 0.59 1.08 -0.33 4.17 1.57 -1.42 -1.41 116.57 120.82 2no8 h LYS 20 Ca -0.03 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 2no8 h LYS 20 Cb 1.32 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 33.42 2no8 h LYS 20 CO 0.15 0.85 0.18 -0.22 -0.57 0.00 0.00 179.45 179.84 2no8 h LYS 21 N 1.05 0.46 -0.81 3.15 3.64 0.04 -1.19 116.57 122.91 2no8 h LYS 21 Ca 0.25 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 2no8 h LYS 21 Cb 0.14 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.83 2no8 h LYS 21 CO -0.03 0.38 0.53 0.82 -2.27 0.00 0.00 179.45 178.89 2no8 h ILE 22 N 0.41 1.19 -0.72 2.00 2.04 -0.69 0.66 117.51 122.39 2no8 h ILE 22 Ca 0.11 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 2no8 h ILE 22 Cb 0.06 0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.12 2no8 h ILE 22 CO -0.02 0.20 0.28 0.00 0.00 0.00 0.00 178.15 178.61 2no8 n ARG 24 N -4.29 0.68 -0.90 0.00 1.85 -0.49 -4.48 116.66 109.03 2no8 n ARG 24 Ca 0.06 0.10 -0.01 0.00 -1.00 0.00 0.00 57.85 57.01 2no8 n ARG 24 Cb 0.18 -1.58 0.32 0.00 -1.05 0.00 0.00 32.46 30.33 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 -2.87 4.18 0.21 2.89 0.00 0.22 -4.71 120.51 120.43 2no8 n ALA 25 Ca -0.34 -2.29 0.11 0.00 0.00 0.00 0.00 53.44 50.92 2no8 n ALA 25 Cb 1.09 -1.11 0.35 0.00 0.00 0.00 0.00 19.45 19.78 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 2.77 0.00 0.00 0.00 4.11 -1.66 -3.45 114.58 116.35 2no8 h GLU 26 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.59 2no8 h GLU 26 Cb 2.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.34 2no8 h GLU 26 CO 0.59 0.00 0.00 0.41 0.07 0.00 0.00 179.01 180.08 2no8 n GLY 27 N -1.47 -0.86 0.14 1.06 0.00 -1.26 -1.66 105.19 101.14 2no8 n GLY 27 Ca 0.04 -1.56 -0.23 0.00 0.00 0.00 0.00 46.02 44.28 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 0.08 -2.31 4.61 0.00 -1.97 -3.48 119.26 116.20 2no8 h ALA 28 Ca 0.00 -1.06 -0.29 0.00 0.00 0.00 0.00 54.91 53.56 2no8 h ALA 28 Cb 0.00 0.39 -0.15 0.00 0.00 0.00 0.00 17.79 18.04 2no8 h ALA 28 CO 0.00 0.90 -0.65 0.99 0.00 0.00 0.00 179.25 180.49 2no8 s THR 29 N -2.56 0.60 -1.18 0.00 2.01 -1.26 -5.02 115.64 108.23 2no8 s THR 29 Ca -0.15 -1.98 0.08 0.00 0.31 0.00 0.00 61.69 59.95 2no8 s THR 29 Cb 0.05 -2.24 0.10 0.00 0.01 0.00 0.00 72.50 70.41 2no8 s THR 29 CO 0.86 -0.36 1.20 -1.84 -0.69 0.00 0.00 174.62 173.79 2no8 n GLU 30 N -0.28 0.05 0.09 4.92 0.28 -1.26 -1.65 120.64 122.78 2no8 n GLU 30 Ca -0.05 0.30 -0.05 0.00 -0.16 0.00 0.00 57.16 57.21 2no8 n GLU 30 Cb 0.64 -1.50 0.13 0.00 1.43 0.00 0.00 31.44 32.14 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 0.23 0.02 3.44 -0.00 -1.95 0.82 114.58 117.14 2no8 h GLU 31 Ca 0.00 -0.15 -0.24 0.00 -0.00 0.00 0.00 59.36 58.96 2no8 h GLU 31 Cb 0.11 0.02 0.01 0.00 -0.00 0.00 0.00 28.75 28.89 2no8 h GLU 31 CO 0.00 0.75 -1.01 0.22 -0.00 0.00 0.00 179.01 178.97 2no8 h ASP 32 N 0.17 0.64 0.43 3.06 3.58 -1.52 -1.95 116.42 120.83 2no8 h ASP 32 Ca -0.00 -0.53 -0.01 0.00 0.42 0.00 0.00 57.03 56.91 2no8 h ASP 32 Cb 1.08 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.92 2no8 h ASP 32 CO 0.09 1.33 -0.42 -0.78 -2.88 0.00 0.00 179.24 176.58 2no8 h ASP 33 N 0.26 -1.15 0.25 2.28 1.82 -1.19 -2.43 116.42 116.27 2no8 h ASP 33 Ca -0.10 0.09 -0.02 0.00 -0.39 0.00 0.00 57.03 56.61 2no8 h ASP 33 Cb 1.66 0.38 -0.00 0.00 0.68 0.00 0.00 39.33 42.05 2no8 h ASP 33 CO 0.18 -0.58 -0.11 -1.13 -1.61 0.00 0.00 179.24 176.00 2no8 h ASN 34 N -0.87 0.00 -0.26 2.28 -1.24 -0.88 -1.44 115.58 113.17 2no8 h ASN 34 Ca -0.04 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.90 2no8 h ASN 34 Cb 0.77 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.80 2no8 h ASN 34 CO -0.06 0.11 -0.06 0.50 -1.29 0.00 0.00 177.43 176.63 2no8 h LYS 35 N 0.00 0.62 -0.09 6.67 3.64 -0.88 0.40 116.57 126.94 2no8 h LYS 35 Ca -0.00 -0.17 -0.06 0.00 -1.27 0.00 0.00 60.65 59.15 2no8 h LYS 35 Cb 0.26 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 2no8 h LYS 35 CO 0.01 0.69 -0.17 -0.07 -2.27 0.00 0.00 179.45 177.64 2no8 h LEU 36 N 0.58 0.30 -0.90 5.20 3.38 -0.96 -3.17 115.31 119.74 2no8 h LEU 36 Ca 0.11 -0.56 0.13 0.00 0.09 0.00 0.00 57.88 57.65 2no8 h LEU 36 Cb 0.46 -0.09 -0.09 0.00 0.09 0.00 0.00 40.66 41.04 2no8 h LEU 36 CO 0.02 0.80 0.52 0.58 0.09 0.00 0.00 178.44 180.46 2no8 h VAL 37 N -0.19 0.83 -0.17 1.22 2.07 -0.89 -2.24 116.25 116.89 2no8 h VAL 37 Ca 0.00 -0.27 0.05 0.00 0.82 0.00 0.00 66.70 67.30 2no8 h VAL 37 Cb 0.75 -0.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.44 2no8 h VAL 37 CO 0.04 0.14 -0.15 0.03 0.02 0.00 0.00 177.57 177.66 2no8 h ARG 38 N 0.79 -0.16 -0.59 1.57 2.47 -0.21 0.26 114.38 118.53 2no8 h ARG 38 Ca 0.47 0.01 -0.10 0.00 -1.26 0.00 0.00 59.98 59.10 2no8 h ARG 38 Cb 0.55 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.88 2no8 h ARG 38 CO -0.30 -0.10 -0.03 1.05 0.56 0.00 0.00 179.97 181.14 2no8 h GLU 39 N -0.16 1.05 -0.34 0.04 4.11 -1.41 -2.13 114.58 115.74 2no8 h GLU 39 Ca 0.11 -0.35 -0.15 0.00 0.07 0.00 0.00 59.36 59.03 2no8 h GLU 39 Cb 0.32 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2no8 h GLU 39 CO -0.26 1.05 -0.40 0.74 0.07 0.00 0.00 179.01 180.21 2no8 h PHE 40 N 0.95 0.98 0.00 2.06 0.04 -1.13 -2.20 116.94 117.64 2no8 h PHE 40 Ca 0.16 -0.29 0.00 0.00 2.80 0.00 0.00 57.97 60.64 2no8 h PHE 40 Cb 0.59 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 38.54 2no8 h PHE 40 CO 0.04 1.08 0.00 0.93 -0.60 0.00 0.00 178.31 179.76 2no8 h GLU 41 N 0.67 0.00 -0.02 1.51 4.39 -0.24 -0.43 114.58 120.45 2no8 h GLU 41 Ca 0.05 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.61 2no8 h GLU 41 Cb 0.96 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.63 2no8 h GLU 41 CO 0.09 0.00 -0.55 0.00 -1.16 0.00 0.00 179.01 177.39 2no8 h ARG 42 N 0.00 0.41 -0.89 2.33 3.08 -0.99 -1.29 114.38 117.03 2no8 h ARG 42 Ca 0.00 -0.41 0.01 0.00 0.07 0.00 0.00 59.98 59.65 2no8 h ARG 42 Cb 0.44 0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.56 2no8 h ARG 42 CO 0.00 1.07 0.59 -0.07 -1.07 0.00 0.00 179.97 180.49 2no8 h LEU 43 N -0.10 1.02 0.15 3.04 3.38 -0.70 -3.04 115.31 119.05 2no8 h LEU 43 Ca -0.06 -0.02 -0.34 0.00 0.09 0.00 0.00 57.88 57.54 2no8 h LEU 43 Cb 1.25 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.74 2no8 h LEU 43 CO 0.11 0.73 -1.75 0.71 0.09 0.00 0.00 178.44 178.33 2no8 h THR 44 N 1.20 0.91 -1.39 0.22 1.35 -1.19 -3.42 112.91 110.59 2no8 h THR 44 Ca 0.33 -2.56 -0.32 0.00 -0.55 0.00 0.00 66.41 63.32 2no8 h THR 44 Cb -0.12 2.69 -0.08 0.00 -1.73 0.00 0.00 68.15 68.90 2no8 h THR 44 CO -0.07 0.84 -0.34 1.21 -0.25 0.00 0.00 175.52 176.90 2no8 n GLU 45 N -3.50 -1.16 -2.78 4.72 2.13 -0.49 -4.97 120.64 114.60 2no8 n GLU 45 Ca -0.24 0.92 -0.40 0.00 0.66 0.00 0.00 57.16 58.10 2no8 n GLU 45 Cb 1.06 -5.18 -0.05 0.00 0.27 0.00 0.00 31.44 27.54 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 -2.67 3.90 0.22 4.31 2.46 -1.25 -4.96 115.29 117.31 2no8 s HIS 46 Ca 0.00 1.82 -0.01 0.00 0.47 0.00 0.00 55.06 57.33 2no8 s HIS 46 Cb 0.00 -2.98 0.22 0.00 -0.13 0.00 0.00 32.58 29.70 2no8 s HIS 46 CO 0.00 0.36 1.60 -1.00 -2.47 0.00 0.00 174.74 173.23 2no8 h PRO 47 N 4.80 0.58 -0.00 2.88 0.13 -1.94 -3.22 132.00 135.22 2no8 h PRO 47 Ca -0.44 -0.28 0.00 0.00 -0.87 0.00 0.00 66.00 64.40 2no8 h PRO 47 Cb 1.20 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2no8 h PRO 47 CO 0.69 0.87 0.00 -0.25 -0.23 0.00 0.00 178.00 179.08 2no8 n ASP 48 N -4.04 2.32 -0.10 1.44 9.92 -1.26 -4.77 116.55 120.06 2no8 n ASP 48 Ca -0.01 -2.93 -0.06 0.00 -0.53 0.00 0.00 54.79 51.26 2no8 n ASP 48 Cb 0.50 -0.37 0.01 0.00 -0.64 0.00 0.00 41.12 40.62 2no8 n ASP 48 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 2no8 h GLY 49 N 0.03 0.28 0.98 0.44 0.00 -1.96 0.57 103.07 103.41 2no8 h GLY 49 Ca 0.00 0.09 -0.05 0.00 0.00 0.00 0.00 47.33 47.37 2no8 h GLY 49 CO 0.00 -0.12 0.14 1.76 0.00 0.00 0.00 176.54 178.32 2no8 h SER 50 N 0.03 0.78 0.72 0.19 0.02 -1.86 -2.55 113.55 110.89 2no8 h SER 50 Ca 0.17 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2no8 h SER 50 Cb 0.25 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.58 2no8 h SER 50 CO -0.33 0.80 0.00 0.44 -1.14 0.00 0.00 176.83 176.60 2no8 h ASP 51 N 0.72 0.00 -0.31 3.07 3.32 -1.47 -2.13 116.42 119.62 2no8 h ASP 51 Ca 0.17 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.12 2no8 h ASP 51 Cb 0.32 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 2no8 h ASP 51 CO -0.00 0.00 -0.12 -0.07 -1.72 0.00 0.00 179.24 177.33 2no8 h LEU 52 N 0.00 0.73 -0.04 1.55 3.38 0.51 0.63 115.31 122.06 2no8 h LEU 52 Ca 0.00 -0.22 -0.25 0.00 0.09 0.00 0.00 57.88 57.50 2no8 h LEU 52 Cb 0.36 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.93 2no8 h LEU 52 CO 0.00 0.87 -1.07 0.40 0.09 0.00 0.00 178.44 178.73 2no8 h ILE 53 N 0.67 1.38 0.08 1.22 2.04 -1.43 -3.34 117.51 118.14 2no8 h ILE 53 Ca 0.11 -2.54 -0.11 0.00 1.00 0.00 0.00 64.86 63.32 2no8 h ILE 53 Cb 0.59 2.57 0.01 0.00 -0.74 0.00 0.00 36.82 39.25 2no8 h ILE 53 CO 0.04 0.76 -0.47 1.88 0.00 0.00 0.00 178.15 180.36 2no8 h TYR 54 N 0.23 0.32 -2.80 1.37 0.05 -1.23 -3.45 116.97 111.45 2no8 h TYR 54 Ca -0.12 -0.23 -0.43 0.00 0.05 0.00 0.00 58.73 58.00 2no8 h TYR 54 Cb 1.73 -0.01 -0.39 0.00 1.01 0.00 0.00 36.73 39.07 2no8 h TYR 54 CO 0.08 1.17 -0.72 0.71 -1.05 0.00 0.00 178.16 178.35 2no8 s TYR 55 N -2.36 0.06 0.65 4.88 2.02 0.22 -5.08 117.35 117.73 2no8 s TYR 55 Ca -0.16 -0.30 -0.17 0.00 -0.37 0.00 0.00 57.07 56.07 2no8 s TYR 55 Cb -0.01 -0.64 -0.01 0.00 -0.40 0.00 0.00 41.96 40.90 2no8 s TYR 55 CO 0.77 -0.63 1.20 -1.25 -1.57 0.00 0.00 175.55 174.07 2no8 s PRO 56 N 2.19 2.68 0.00 -1.71 0.04 -1.26 -4.37 135.00 132.58 2no8 s PRO 56 Ca 0.05 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.85 2no8 s PRO 56 Cb -0.16 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2no8 s PRO 56 CO -0.18 -1.42 0.00 0.54 0.04 0.00 0.00 177.00 175.99 2no8 n ARG 57 N -2.05 0.00 0.01 4.56 1.74 -1.26 -4.96 116.66 114.70 2no8 n ARG 57 Ca 0.13 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.20 2no8 n ARG 57 Cb 0.50 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.94 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 0.59 0.12 0.55 2.03 -1.26 -4.69 116.55 113.89 2no8 n ASP 58 Ca 0.00 0.08 0.13 0.00 0.52 0.00 0.00 54.79 55.52 2no8 n ASP 58 Cb 0.00 -0.19 0.34 0.00 -0.72 0.00 0.00 41.12 40.54 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 -0.07 0.00 -3.61 1.67 3.58 -2.05 -3.45 116.42 112.49 2no8 h ASP 59 Ca -0.03 -0.02 -0.51 0.00 0.42 0.00 0.00 57.03 56.89 2no8 h ASP 59 Cb 0.63 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.68 2no8 h ASP 59 CO -0.02 0.01 0.43 -0.13 -2.88 0.00 0.00 179.24 176.65 2no8 s ARG 60 N -3.13 4.66 0.34 0.28 1.81 -1.26 -5.01 118.95 116.64 2no8 s ARG 60 Ca 0.09 1.63 -0.23 0.00 -1.72 0.00 0.00 55.73 55.50 2no8 s ARG 60 Cb 0.11 -3.29 -0.10 0.00 -0.45 0.00 0.00 34.95 31.22 2no8 s ARG 60 CO 0.62 0.18 0.92 -2.00 -0.68 0.00 0.00 175.30 174.34 2no8 s GLU 61 N -0.47 4.42 -1.32 3.54 2.56 -1.26 -4.53 118.70 121.65 2no8 s GLU 61 Ca 0.47 1.19 -0.08 0.00 0.00 0.00 0.00 54.97 56.56 2no8 s GLU 61 Cb -0.28 -2.61 0.14 0.00 2.00 0.00 0.00 34.13 33.38 2no8 s GLU 61 CO 0.34 0.20 2.11 -3.47 -0.56 0.00 0.00 175.26 173.87 2no8 n ASP 62 N 0.19 6.21 -4.04 -1.70 2.03 -1.26 -4.39 116.55 113.59 2no8 n ASP 62 Ca 0.03 -3.09 -0.14 0.00 0.52 0.00 0.00 54.79 52.11 2no8 n ASP 62 Cb 0.51 -1.45 -0.12 0.00 -0.72 0.00 0.00 41.12 39.35 2no8 n ASP 62 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2no8 s SER 63 N 0.81 0.84 0.38 1.67 1.04 -1.26 -4.99 113.70 112.20 2no8 s SER 63 Ca 0.46 -0.43 0.20 0.00 0.48 0.00 0.00 55.95 56.66 2no8 s SER 63 Cb 0.13 0.00 1.21 0.00 0.10 0.00 0.00 66.02 67.46 2no8 s SER 63 CO -0.03 -0.13 1.67 -0.65 0.98 0.00 0.00 173.24 175.08 2no8 h PRO 64 N 4.89 0.24 -0.05 4.02 0.11 -1.92 0.93 132.00 140.22 2no8 h PRO 64 Ca -0.34 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 2no8 h PRO 64 Cb 1.20 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2no8 h PRO 64 CO 0.43 0.16 -0.00 0.93 -0.21 0.00 0.00 178.00 179.31 2no8 h GLU 65 N 0.25 0.08 -0.85 1.05 5.08 -1.94 -2.36 114.58 115.89 2no8 h GLU 65 Ca 0.74 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 59.07 2no8 h GLU 65 Cb 1.94 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 31.14 2no8 h GLU 65 CO -0.50 0.37 0.51 0.78 -1.00 0.00 0.00 179.01 179.17 2no8 h GLY 66 N -0.22 1.24 0.92 -3.84 0.00 -1.34 0.63 103.07 100.46 2no8 h GLY 66 Ca 0.01 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 2no8 h GLY 66 CO 0.00 0.50 0.08 -2.22 0.00 0.00 0.00 176.54 174.91 2no8 h ILE 67 N 1.18 1.12 -0.85 2.60 2.04 -0.89 -2.19 117.51 120.51 2no8 h ILE 67 Ca 0.31 -0.34 0.01 0.00 1.00 0.00 0.00 64.86 65.84 2no8 h ILE 67 Cb -0.04 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 2no8 h ILE 67 CO -0.06 0.11 0.56 0.58 0.00 0.00 0.00 178.15 179.35 2no8 h VAL 68 N 0.14 1.21 -0.66 1.67 2.07 -0.99 -2.51 116.25 117.19 2no8 h VAL 68 Ca 0.06 -0.39 0.04 0.00 0.82 0.00 0.00 66.70 67.23 2no8 h VAL 68 Cb 0.10 -0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 29.80 2no8 h VAL 68 CO -0.01 0.21 0.43 0.50 0.02 0.00 0.00 177.57 178.73 2no8 h LYS 69 N 1.15 0.72 0.41 1.57 3.64 -0.53 0.23 116.57 123.76 2no8 h LYS 69 Ca 0.31 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.63 2no8 h LYS 69 Cb -0.13 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.53 2no8 h LYS 69 CO -0.07 0.48 -0.20 1.49 -2.27 0.00 0.00 179.45 178.88 2no8 h GLU 70 N 0.74 -0.53 -0.78 1.90 4.57 -0.95 0.03 114.58 119.57 2no8 h GLU 70 Ca 0.27 0.04 0.06 0.00 -1.18 0.00 0.00 59.36 58.54 2no8 h GLU 70 Cb 0.14 0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 28.79 2no8 h GLU 70 CO -0.08 -0.26 0.47 0.82 -1.18 0.00 0.00 179.01 178.77 2no8 h ILE 71 N -0.71 1.02 0.73 2.32 2.04 -1.25 0.02 117.51 121.68 2no8 h ILE 71 Ca -0.06 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.47 2no8 h ILE 71 Cb 0.50 0.09 0.01 0.00 -0.74 0.00 0.00 36.82 36.68 2no8 h ILE 71 CO 0.09 0.16 -0.35 0.50 0.00 0.00 0.00 178.15 178.55 2no8 h LYS 72 N 0.86 -0.94 -0.63 2.37 3.11 -0.46 -1.28 116.57 119.60 2no8 h LYS 72 Ca 0.34 0.06 -0.02 0.00 -2.81 0.00 0.00 60.65 58.22 2no8 h LYS 72 Cb 0.16 0.21 -0.03 0.00 -1.00 0.00 0.00 32.23 31.57 2no8 h LYS 72 CO -0.17 -0.60 0.30 0.93 -2.81 0.00 0.00 179.45 177.09 2no8 h GLU 73 N -1.09 0.91 0.17 1.90 4.39 -0.81 -2.40 114.58 117.64 2no8 h GLU 73 Ca -0.10 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.46 2no8 h GLU 73 Cb 0.77 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 2no8 h GLU 73 CO 0.16 0.73 -0.08 2.35 -1.16 0.00 0.00 179.01 181.01 2no8 h TRP 74 N 0.87 -0.21 -0.14 4.33 7.01 -0.99 -1.98 115.95 124.84 2no8 h TRP 74 Ca 0.22 -0.00 -0.11 0.00 2.11 0.00 0.00 58.89 61.10 2no8 h TRP 74 Cb 0.13 0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.24 2no8 h TRP 74 CO 0.00 -0.02 -0.40 0.00 -2.79 0.00 0.00 178.44 175.23 2no8 h ARG 75 N -0.37 0.30 0.00 2.65 3.08 -1.17 -0.93 114.38 117.95 2no8 h ARG 75 Ca -0.02 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 59.82 2no8 h ARG 75 Cb 0.29 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2no8 h ARG 75 CO 0.04 0.66 -0.29 0.00 -1.07 0.00 0.00 179.97 179.32 2no8 h ALA 76 N 1.32 1.14 0.02 0.04 0.00 -1.36 0.64 119.26 121.07 2no8 h ALA 76 Ca 0.02 -0.26 -0.24 0.00 0.00 0.00 0.00 54.91 54.43 2no8 h ALA 76 Cb 0.83 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 2no8 h ALA 76 CO 0.07 0.36 -1.25 0.00 0.00 0.00 0.00 179.25 178.42 2no8 h ALA 77 N 1.71 0.45 0.00 0.00 0.00 -0.48 -3.25 119.26 117.70 2no8 h ALA 77 Ca -0.00 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.83 2no8 h ALA 77 Cb 0.69 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2no8 h ALA 77 CO 0.04 1.32 -0.01 -0.91 0.00 0.00 0.00 179.25 179.69 2no8 h ASN 78 N 0.01 0.00 -0.13 0.00 -0.26 -0.82 -3.47 115.58 110.91 2no8 h ASN 78 Ca -0.11 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.63 2no8 h ASN 78 Cb 1.87 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 39.13 2no8 h ASN 78 CO 0.12 0.00 0.00 0.61 -1.06 0.00 0.00 177.43 177.10 2no8 n GLY 79 N 1.22 0.60 4.02 2.83 0.00 -0.69 -5.06 105.19 108.11 2no8 n GLY 79 Ca 0.05 -0.77 -0.22 0.00 0.00 0.00 0.00 46.02 45.08 2no8 n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2no8 s LYS 80 N -3.81 1.91 0.90 1.61 1.02 0.13 -5.04 119.74 116.47 2no8 s LYS 80 Ca 0.00 -1.52 -0.11 0.00 0.02 0.00 0.00 55.97 54.36 2no8 s LYS 80 Cb 0.00 -2.50 0.12 0.00 -0.52 0.00 0.00 37.83 34.93 2no8 s LYS 80 CO 0.00 -1.22 1.03 0.43 -0.92 0.00 0.00 175.35 174.67 2no8 n SER 81 N -2.56 0.07 0.00 2.83 7.64 -1.26 -4.67 113.62 115.67 2no8 n SER 81 Ca 0.17 0.44 0.00 0.00 1.01 0.00 0.00 58.87 60.49 2no8 n SER 81 Cb 0.62 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.38 2no8 n SER 81 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2no8 n GLY 82 N 0.54 4.38 3.67 0.23 0.00 -1.26 -4.64 105.19 108.11 2no8 n GLY 82 Ca 0.11 -1.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.18 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 4.12 1.88 -0.02 1.61 0.08 -1.26 -4.17 117.98 120.22 2no8 s PHE 83 Ca 0.00 -1.05 -0.30 0.00 0.12 0.00 0.00 56.93 55.71 2no8 s PHE 83 Cb 0.00 -1.47 -0.03 0.00 -0.57 0.00 0.00 43.02 40.95 2no8 s PHE 83 CO 0.00 0.07 1.04 0.21 -0.10 0.00 0.00 175.22 176.44 2no8 s LYS 84 N -3.82 4.49 -1.13 0.44 2.20 0.14 -4.87 119.74 117.19 2no8 s LYS 84 Ca 0.13 1.48 -0.11 0.00 -0.36 0.00 0.00 55.97 57.11 2no8 s LYS 84 Cb 0.02 -3.47 0.23 0.00 -1.51 0.00 0.00 37.83 33.10 2no8 s LYS 84 CO 0.08 -0.18 1.22 1.14 -0.36 0.00 0.00 175.35 177.25 2no8 s GLN 85 N 1.36 4.12 0.00 4.03 0.00 -1.26 -4.38 119.66 123.53 2no8 s GLN 85 Ca 0.52 -2.91 0.00 0.00 -0.00 0.00 0.00 55.36 52.97 2no8 s GLN 85 Cb -0.22 -4.75 0.00 0.00 0.00 0.00 0.00 33.01 28.04 2no8 s GLN 85 CO 0.25 -1.45 0.00 0.41 0.00 0.00 0.00 175.29 174.50