#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 4.06 0.82 4.31 1.43 -1.26 -5.07 118.68 122.97 2no8 s LEU 3 Ca 0.00 -0.00 -0.10 0.00 -1.03 0.00 0.00 54.13 53.00 2no8 s LEU 3 Cb 0.00 -2.17 0.13 0.00 0.03 0.00 0.00 46.19 44.18 2no8 s LEU 3 CO 0.00 -0.09 1.15 -1.59 0.23 0.00 0.00 176.35 176.06 2no8 s LYS 4 N 1.81 1.46 -0.00 1.70 -2.85 -1.26 -5.01 119.74 115.58 2no8 s LYS 4 Ca 0.08 -0.43 0.12 0.00 -1.00 0.00 0.00 55.97 54.75 2no8 s LYS 4 Cb -0.16 -2.04 -0.15 0.00 -2.06 0.00 0.00 37.83 33.42 2no8 s LYS 4 CO 0.11 -1.79 0.46 -2.39 0.10 0.00 0.00 175.35 171.84 2no8 n HIS 5 N -3.29 0.00 -3.98 1.78 1.44 -1.26 -5.08 115.22 104.83 2no8 n HIS 5 Ca 0.12 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.85 2no8 n HIS 5 Cb 0.60 -0.07 0.00 0.00 0.12 0.00 0.00 29.99 30.64 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 -1.45 -0.43 0.24 4.39 3.41 -1.26 -4.97 113.62 113.55 2no8 n SER 6 Ca 0.01 -1.04 0.10 0.00 -0.26 0.00 0.00 58.87 57.69 2no8 n SER 6 Cb 0.22 0.66 0.62 0.00 -0.26 0.00 0.00 64.21 65.45 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 1.40 0.68 0.00 -1.33 2.10 -1.94 -2.65 117.51 115.77 2no8 h ILE 7 Ca -0.08 -0.75 0.00 0.00 1.08 0.00 0.00 64.86 65.11 2no8 h ILE 7 Cb 0.47 1.47 0.00 0.00 -1.09 0.00 0.00 36.82 37.67 2no8 h ILE 7 CO 0.12 0.17 0.00 -0.24 -1.08 0.00 0.00 178.15 177.12 2no8 n SER 8 N -3.68 0.00 0.19 2.19 2.88 -1.26 -1.97 113.62 111.97 2no8 n SER 8 Ca -0.01 0.47 0.07 0.00 -1.33 0.00 0.00 58.87 58.07 2no8 n SER 8 Cb 0.30 -0.49 0.23 0.00 -0.75 0.00 0.00 64.21 63.50 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 -3.86 -3.46 1.82 -1.77 -3.23 116.42 105.93 2no8 h ASP 9 Ca 0.00 0.00 -0.48 0.00 -0.39 0.00 0.00 57.03 56.16 2no8 h ASP 9 Cb 0.44 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.43 2no8 h ASP 9 CO 0.00 0.30 0.36 -0.31 -1.61 0.00 0.00 179.24 177.99 2no8 s TYR 10 N -3.29 3.70 0.68 0.28 1.51 -0.83 -4.81 117.35 114.60 2no8 s TYR 10 Ca 0.03 1.79 -0.04 0.00 -1.01 0.00 0.00 57.07 57.84 2no8 s TYR 10 Cb 0.08 -2.98 0.08 0.00 -0.11 0.00 0.00 41.96 39.03 2no8 s TYR 10 CO 0.69 0.12 0.97 0.95 -1.11 0.00 0.00 175.55 177.17 2no8 s THR 11 N -1.50 2.33 0.17 -0.71 -4.23 -1.26 -0.14 115.64 110.30 2no8 s THR 11 Ca 0.49 -0.41 -0.14 0.00 -1.18 0.00 0.00 61.69 60.44 2no8 s THR 11 Cb -0.21 -2.92 0.06 0.00 1.34 0.00 0.00 72.50 70.76 2no8 s THR 11 CO 0.27 0.00 1.79 -0.08 -0.54 0.00 0.00 174.62 176.06 2no8 h GLU 12 N -0.48 0.71 -0.22 3.99 4.81 -1.85 -0.71 114.58 120.83 2no8 h GLU 12 Ca -0.42 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2no8 h GLU 12 Cb 1.30 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2no8 h GLU 12 CO 0.53 0.53 0.15 0.00 -0.73 0.00 0.00 179.01 179.49 2no8 h ALA 13 N 1.14 0.28 0.00 2.92 0.00 -1.94 0.43 119.26 122.10 2no8 h ALA 13 Ca 0.19 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 2no8 h ALA 13 Cb 0.01 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2no8 h ALA 13 CO -0.03 -0.24 -0.53 0.93 0.00 0.00 0.00 179.25 179.37 2no8 h GLU 14 N 0.30 0.00 0.03 0.00 4.39 -1.90 -0.79 114.58 116.61 2no8 h GLU 14 Ca 0.08 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.57 2no8 h GLU 14 Cb -0.03 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 2no8 h GLU 14 CO -0.02 0.53 -0.99 0.35 -1.16 0.00 0.00 179.01 177.73 2no8 h PHE 15 N 0.00 0.21 0.00 4.33 3.57 -0.82 -2.70 116.94 121.53 2no8 h PHE 15 Ca -0.01 -0.13 -0.02 0.00 3.53 0.00 0.00 57.97 61.34 2no8 h PHE 15 Cb 1.08 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.81 2no8 h PHE 15 CO 0.00 1.03 -0.09 1.25 -2.23 0.00 0.00 178.31 178.27 2no8 h LEU 16 N 0.05 0.00 -0.98 0.59 6.46 0.27 0.38 115.31 122.08 2no8 h LEU 16 Ca -0.05 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.70 2no8 h LEU 16 Cb 1.68 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.61 2no8 h LEU 16 CO 0.14 0.09 -0.04 -0.33 -0.62 0.00 0.00 178.44 177.69 2no8 h GLU 17 N 0.00 0.00 0.01 1.25 4.39 -0.83 -3.07 114.58 116.33 2no8 h GLU 17 Ca -0.00 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.72 2no8 h GLU 17 Cb 0.46 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.09 2no8 h GLU 17 CO 0.01 0.04 -0.11 0.27 -1.16 0.00 0.00 179.01 178.06 2no8 h PHE 18 N 0.00 -0.29 -0.18 4.33 -0.00 -0.05 0.43 116.94 121.17 2no8 h PHE 18 Ca -0.00 0.01 -0.19 0.00 -0.00 0.00 0.00 57.97 57.79 2no8 h PHE 18 Cb 0.70 0.13 -0.00 0.00 -0.00 0.00 0.00 35.95 36.77 2no8 h PHE 18 CO 0.00 -0.17 -0.64 -0.24 -0.00 0.00 0.00 178.31 177.26 2no8 h VAL 19 N -0.20 1.31 -0.39 0.88 3.04 -1.61 0.31 116.25 119.59 2no8 h VAL 19 Ca 0.04 -1.89 -0.10 0.00 -1.01 0.00 0.00 66.70 63.74 2no8 h VAL 19 Cb 0.25 1.85 -0.02 0.00 -2.01 0.00 0.00 31.29 31.36 2no8 h VAL 19 CO -0.11 0.59 -0.16 0.11 -1.01 0.00 0.00 177.57 177.00 2no8 h LYS 20 N 0.48 0.73 -0.30 4.17 1.57 -1.40 0.16 116.57 121.97 2no8 h LYS 20 Ca -0.01 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.42 2no8 h LYS 20 Cb 1.23 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.47 2no8 h LYS 20 CO 0.13 0.84 -0.19 -0.22 -0.57 0.00 0.00 179.45 179.44 2no8 h LYS 21 N 0.65 0.55 -0.07 3.15 3.64 0.37 -1.28 116.57 123.59 2no8 h LYS 21 Ca 0.10 -0.19 -0.17 0.00 -1.27 0.00 0.00 60.65 59.12 2no8 h LYS 21 Cb 0.63 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 2no8 h LYS 21 CO 0.04 0.72 -0.70 0.82 -2.27 0.00 0.00 179.45 178.06 2no8 h ILE 22 N 0.50 1.39 -0.12 2.00 2.04 -0.43 -0.34 117.51 122.54 2no8 h ILE 22 Ca 0.08 -2.13 -0.07 0.00 1.00 0.00 0.00 64.86 63.74 2no8 h ILE 22 Cb 0.61 2.10 -0.01 0.00 -0.74 0.00 0.00 36.82 38.79 2no8 h ILE 22 CO 0.04 0.64 -0.22 0.00 0.00 0.00 0.00 178.15 178.61 2no8 n ARG 24 N -4.20 2.61 -0.15 0.00 1.85 -0.54 -4.57 116.66 111.66 2no8 n ARG 24 Ca -0.01 -2.47 0.01 0.00 -1.00 0.00 0.00 57.85 54.38 2no8 n ARG 24 Cb 0.33 -1.54 0.06 0.00 -1.05 0.00 0.00 32.46 30.26 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 1.57 2.74 -0.29 2.89 0.00 -0.15 -4.31 120.51 122.95 2no8 n ALA 25 Ca 0.22 -0.32 0.09 0.00 0.00 0.00 0.00 53.44 53.44 2no8 n ALA 25 Cb 0.61 -1.02 0.32 0.00 0.00 0.00 0.00 19.45 19.36 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 0.61 0.80 0.00 0.00 4.11 -1.81 -3.18 114.58 115.12 2no8 h GLU 26 Ca 0.01 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.39 2no8 h GLU 26 Cb 0.77 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2no8 h GLU 26 CO 0.08 0.53 0.00 0.41 0.07 0.00 0.00 179.01 180.11 2no8 n GLY 27 N -1.40 0.45 1.45 1.06 0.00 -1.26 -3.58 105.19 101.92 2no8 n GLY 27 Ca 0.17 0.71 0.00 0.00 0.00 0.00 0.00 46.02 46.90 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 7.25 3.00 -2.31 4.61 0.00 -1.26 -5.12 120.51 126.68 2no8 n ALA 28 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2no8 n ALA 28 Cb 0.00 0.22 -0.10 0.00 0.00 0.00 0.00 19.45 19.57 2no8 n ALA 28 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2no8 s THR 29 N -2.00 0.89 -0.09 0.00 2.01 -1.23 -5.03 115.64 110.18 2no8 s THR 29 Ca 0.00 -2.02 0.29 0.00 0.31 0.00 0.00 61.69 60.27 2no8 s THR 29 Cb 0.00 -2.34 0.30 0.00 0.01 0.00 0.00 72.50 70.47 2no8 s THR 29 CO 0.00 -0.31 1.87 1.05 -0.69 0.00 0.00 174.62 176.54 2no8 h GLU 30 N 2.50 0.00 0.00 4.92 9.09 -1.94 -0.76 114.58 128.39 2no8 h GLU 30 Ca -0.38 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 58.98 2no8 h GLU 30 Cb 1.22 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.32 2no8 h GLU 30 CO 0.64 0.00 -0.22 1.05 0.05 0.00 0.00 179.01 180.52 2no8 h GLU 31 N 0.00 0.00 0.00 1.06 -0.00 -1.95 0.62 114.58 114.31 2no8 h GLU 31 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 59.36 59.27 2no8 h GLU 31 Cb 0.24 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.98 2no8 h GLU 31 CO 0.00 0.22 -0.42 0.22 -0.00 0.00 0.00 179.01 179.04 2no8 h ASP 32 N 0.00 0.00 0.11 3.06 3.58 -1.42 -1.00 116.42 120.76 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 0.63 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.68 2no8 h ASP 32 CO 0.03 0.42 -0.05 0.44 -2.88 0.00 0.00 179.24 177.19 2no8 h ASP 33 N 0.00 -0.13 -0.15 2.28 5.19 -1.40 -3.36 116.42 118.85 2no8 h ASP 33 Ca -0.00 -0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.35 2no8 h ASP 33 Cb 1.10 0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.63 2no8 h ASP 33 CO 0.05 0.38 0.08 -0.55 -3.12 0.00 0.00 179.24 176.08 2no8 h ASN 34 N -1.03 0.23 -0.13 6.45 7.08 -0.87 -1.13 115.58 126.17 2no8 h ASN 34 Ca -0.02 -0.01 -0.06 0.00 -3.08 0.00 0.00 56.30 53.13 2no8 h ASN 34 Cb 0.17 -0.06 -0.02 0.00 -2.08 0.00 0.00 38.32 36.34 2no8 h ASN 34 CO 0.03 0.21 -0.09 0.07 -2.08 0.00 0.00 177.43 175.56 2no8 h LYS 35 N 0.26 0.44 -0.13 4.14 2.10 -1.36 0.13 116.57 122.16 2no8 h LYS 35 Ca 0.07 -0.11 -0.05 0.00 -2.00 0.00 0.00 60.65 58.55 2no8 h LYS 35 Cb 0.05 -0.06 -0.00 0.00 -0.90 0.00 0.00 32.23 31.32 2no8 h LYS 35 CO -0.01 0.55 -0.12 -0.07 -2.00 0.00 0.00 179.45 177.80 2no8 h LEU 36 N 0.42 0.32 -0.34 7.07 3.38 -1.36 -2.79 115.31 122.01 2no8 h LEU 36 Ca 0.08 -0.47 0.07 0.00 0.09 0.00 0.00 57.88 57.65 2no8 h LEU 36 Cb 0.42 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 2no8 h LEU 36 CO 0.02 0.73 -0.05 0.58 0.09 0.00 0.00 178.44 179.81 2no8 h VAL 37 N -0.08 0.70 -0.99 1.22 2.07 -1.10 -2.13 116.25 115.94 2no8 h VAL 37 Ca 0.02 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.61 2no8 h VAL 37 Cb 0.63 0.66 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 2no8 h VAL 37 CO 0.03 0.01 0.64 0.03 0.02 0.00 0.00 177.57 178.29 2no8 h ARG 38 N 0.04 1.06 -0.02 1.57 3.08 -0.72 0.44 114.38 119.82 2no8 h ARG 38 Ca 0.16 -0.06 -0.23 0.00 0.07 0.00 0.00 59.98 59.92 2no8 h ARG 38 Cb 0.24 -0.24 0.01 0.00 0.08 0.00 0.00 29.97 30.06 2no8 h ARG 38 CO -0.32 0.70 -0.92 1.05 -1.07 0.00 0.00 179.97 179.41 2no8 h GLU 39 N 1.09 0.50 -0.29 0.04 4.11 -1.16 -2.94 114.58 115.93 2no8 h GLU 39 Ca 0.45 -0.51 -0.12 0.00 0.07 0.00 0.00 59.36 59.25 2no8 h GLU 39 Cb 0.28 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2no8 h GLU 39 CO -0.20 1.14 -0.33 0.74 0.07 0.00 0.00 179.01 180.43 2no8 h PHE 40 N 0.30 0.72 -0.53 2.06 0.04 -0.69 -1.26 116.94 117.59 2no8 h PHE 40 Ca -0.08 -0.19 0.09 0.00 2.80 0.00 0.00 57.97 60.59 2no8 h PHE 40 Cb 1.55 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 39.51 2no8 h PHE 40 CO 0.07 0.88 0.36 0.93 -0.60 0.00 0.00 178.31 179.94 2no8 h GLU 41 N 0.53 0.32 0.13 1.51 5.08 -0.12 0.22 114.58 122.24 2no8 h GLU 41 Ca 0.06 -0.02 -0.28 0.00 -1.00 0.00 0.00 59.36 58.12 2no8 h GLU 41 Cb 0.83 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.01 2no8 h GLU 41 CO 0.07 0.21 -1.28 0.00 -1.00 0.00 0.00 179.01 177.01 2no8 h ARG 42 N 0.33 0.28 -0.40 2.33 3.08 -1.19 0.23 114.38 119.04 2no8 h ARG 42 Ca 0.24 -0.48 -0.14 0.00 0.07 0.00 0.00 59.98 59.67 2no8 h ARG 42 Cb 0.52 0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 2no8 h ARG 42 CO -0.06 1.22 -0.29 -0.07 -1.07 0.00 0.00 179.97 179.71 2no8 h LEU 43 N 0.08 0.94 0.00 3.04 3.38 -0.48 -3.09 115.31 119.18 2no8 h LEU 43 Ca -0.15 -0.44 -0.17 0.00 0.09 0.00 0.00 57.88 57.22 2no8 h LEU 43 Cb 1.99 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 42.45 2no8 h LEU 43 CO 0.20 1.18 -0.92 0.71 0.09 0.00 0.00 178.44 179.70 2no8 h THR 44 N 0.72 1.11 -3.44 0.22 1.35 -0.68 -3.43 112.91 108.76 2no8 h THR 44 Ca 0.08 -2.66 -0.40 0.00 -0.55 0.00 0.00 66.41 62.88 2no8 h THR 44 Cb 0.87 2.52 -0.00 0.00 -1.73 0.00 0.00 68.15 69.80 2no8 h THR 44 CO 0.08 0.63 -0.53 -0.62 -0.25 0.00 0.00 175.52 174.83 2no8 n GLU 45 N -3.20 -2.44 -3.28 4.72 1.02 0.79 -4.92 120.64 113.32 2no8 n GLU 45 Ca -0.02 0.94 -0.38 0.00 -0.02 0.00 0.00 57.16 57.68 2no8 n GLU 45 Cb 0.85 -5.65 -0.06 0.00 -0.02 0.00 0.00 31.44 26.56 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 -3.03 3.45 0.42 -0.32 2.46 -1.05 -4.96 115.29 112.27 2no8 s HIS 46 Ca 0.07 0.84 0.10 0.00 0.47 0.00 0.00 55.06 56.54 2no8 s HIS 46 Cb -0.03 -2.60 0.90 0.00 -0.13 0.00 0.00 32.58 30.71 2no8 s HIS 46 CO 0.09 0.05 1.99 -1.00 -2.47 0.00 0.00 174.74 173.40 2no8 h PRO 47 N 7.05 0.25 -0.39 2.88 0.13 -1.91 -0.85 132.00 139.17 2no8 h PRO 47 Ca -0.38 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2no8 h PRO 47 Cb 1.17 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2no8 h PRO 47 CO 0.75 0.30 0.00 -0.25 -0.23 0.00 0.00 178.00 178.57 2no8 n ASP 48 N -4.37 3.68 -0.34 1.44 9.92 -1.26 -4.70 116.55 120.92 2no8 n ASP 48 Ca -0.00 -2.45 0.18 0.00 -0.53 0.00 0.00 54.79 51.98 2no8 n ASP 48 Cb 0.19 -0.42 0.40 0.00 -0.64 0.00 0.00 41.12 40.65 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 2.43 1.77 0.44 0.44 0.00 -1.53 0.66 103.07 107.27 2no8 h GLY 49 Ca 0.00 -0.30 -0.21 0.00 0.00 0.00 0.00 47.33 46.82 2no8 h GLY 49 CO 0.13 -0.19 -1.04 1.48 0.00 0.00 0.00 176.54 176.92 2no8 h SER 50 N 0.58 0.30 -0.86 0.19 4.64 -1.84 -3.37 113.55 113.20 2no8 h SER 50 Ca 0.63 -0.86 0.10 0.00 -0.47 0.00 0.00 61.79 61.18 2no8 h SER 50 Cb 1.22 -0.10 -0.07 0.00 -0.31 0.00 0.00 62.40 63.14 2no8 h SER 50 CO -0.43 1.46 0.50 0.44 -0.87 0.00 0.00 176.83 177.93 2no8 h ASP 51 N -0.51 0.73 -0.96 4.97 5.19 -1.57 -2.44 116.42 121.82 2no8 h ASP 51 Ca -0.22 0.05 0.12 0.00 -0.62 0.00 0.00 57.03 56.36 2no8 h ASP 51 Cb 1.56 -0.10 -0.08 0.00 0.18 0.00 0.00 39.33 40.90 2no8 h ASP 51 CO 0.04 0.41 0.61 -0.07 -3.12 0.00 0.00 179.24 177.11 2no8 h LEU 52 N 0.84 0.85 -0.81 1.55 3.38 0.21 0.99 115.31 122.31 2no8 h LEU 52 Ca 0.41 0.04 -0.12 0.00 0.09 0.00 0.00 57.88 58.30 2no8 h LEU 52 Cb 0.37 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2no8 h LEU 52 CO -0.25 0.45 -0.45 0.40 0.09 0.00 0.00 178.44 178.68 2no8 h ILE 53 N 0.91 1.32 0.08 1.22 2.04 -1.60 -2.37 117.51 119.10 2no8 h ILE 53 Ca 0.48 -1.63 -0.37 0.00 1.00 0.00 0.00 64.86 64.34 2no8 h ILE 53 Cb 0.54 1.72 -0.04 0.00 -0.74 0.00 0.00 36.82 38.31 2no8 h ILE 53 CO -0.24 0.49 -2.12 -1.22 0.00 0.00 0.00 178.15 175.06 2no8 n TYR 54 N -3.99 0.85 -3.43 1.37 4.01 -0.76 -4.81 117.16 110.39 2no8 n TYR 54 Ca -0.02 0.19 -0.23 0.00 -0.16 0.00 0.00 57.90 57.69 2no8 n TYR 54 Cb 0.52 -1.12 -0.11 0.00 -0.31 0.00 0.00 39.34 38.33 2no8 n TYR 54 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2no8 s TYR 55 N -2.55 0.08 0.03 -0.72 2.02 0.33 -5.12 117.35 111.42 2no8 s TYR 55 Ca -0.24 -0.93 -0.30 0.00 -0.37 0.00 0.00 57.07 55.23 2no8 s TYR 55 Cb 0.07 -0.66 -0.08 0.00 -0.40 0.00 0.00 41.96 40.90 2no8 s TYR 55 CO 0.73 -0.89 1.74 -1.25 -1.57 0.00 0.00 175.55 174.30 2no8 s PRO 56 N 1.65 4.18 0.00 -1.71 0.04 -0.90 -3.62 135.00 134.63 2no8 s PRO 56 Ca 0.14 2.37 0.00 0.00 0.04 0.00 0.00 61.00 63.55 2no8 s PRO 56 Cb -0.17 -3.85 0.00 0.00 0.04 0.00 0.00 34.50 30.52 2no8 s PRO 56 CO -0.15 -0.83 0.00 0.54 0.04 0.00 0.00 177.00 176.61 2no8 n ARG 57 N 6.53 0.00 0.02 4.56 1.74 -1.26 -4.58 116.66 123.66 2no8 n ARG 57 Ca 0.17 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.25 2no8 n ARG 57 Cb 0.41 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.85 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 0.31 -0.17 0.55 2.03 -1.26 -4.82 116.55 113.19 2no8 n ASP 58 Ca 0.00 0.06 0.12 0.00 0.52 0.00 0.00 54.79 55.49 2no8 n ASP 58 Cb 0.00 -0.08 0.30 0.00 -0.72 0.00 0.00 41.12 40.62 2no8 n ASP 58 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2no8 n ASP 59 N -3.12 0.90 -4.78 1.67 8.00 -1.26 -4.90 116.55 113.06 2no8 n ASP 59 Ca 0.00 -0.71 -0.38 0.00 0.71 0.00 0.00 54.79 54.41 2no8 n ASP 59 Cb 0.31 0.22 -0.06 0.00 -0.02 0.00 0.00 41.12 41.57 2no8 n ASP 59 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 2no8 s ARG 60 N -2.68 4.62 0.37 -1.24 6.06 -1.26 -4.99 118.95 119.82 2no8 s ARG 60 Ca 0.19 1.32 -0.28 0.00 -2.50 0.00 0.00 55.73 54.46 2no8 s ARG 60 Cb 0.18 -2.94 -0.11 0.00 0.06 0.00 0.00 34.95 32.14 2no8 s ARG 60 CO 0.59 0.36 1.46 -1.91 -2.50 0.00 0.00 175.30 173.30 2no8 n GLU 61 N 0.84 2.59 -2.80 5.12 4.07 -1.26 -4.83 120.64 124.38 2no8 n GLU 61 Ca 0.00 0.91 -0.44 0.00 -0.06 0.00 0.00 57.16 57.57 2no8 n GLU 61 Cb 0.49 -2.62 0.00 0.00 -0.06 0.00 0.00 31.44 29.26 2no8 n GLU 61 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 2no8 n ASP 62 N 0.57 5.16 -3.82 4.31 -0.08 -1.26 -4.36 116.55 117.06 2no8 n ASP 62 Ca 0.02 -2.99 -0.10 0.00 -1.51 0.00 0.00 54.79 50.21 2no8 n ASP 62 Cb 0.38 -1.57 -0.07 0.00 2.34 0.00 0.00 41.12 42.20 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 2.63 0.03 0.46 1.67 1.04 -1.26 -4.97 113.70 113.30 2no8 s SER 63 Ca 0.43 -0.48 0.19 0.00 0.48 0.00 0.00 55.95 56.57 2no8 s SER 63 Cb 0.00 0.34 1.17 0.00 0.10 0.00 0.00 66.02 67.63 2no8 s SER 63 CO 0.01 -0.69 1.95 -0.65 0.98 0.00 0.00 173.24 174.84 2no8 h PRO 64 N 2.94 0.27 -0.06 4.02 0.11 -1.95 -1.12 132.00 136.21 2no8 h PRO 64 Ca -0.33 -0.02 -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 0.52 0.18 -0.00 0.93 -0.21 0.00 0.00 178.00 179.42 2no8 h GLU 65 N 0.28 0.12 -0.56 1.05 5.08 -1.93 -2.36 114.58 116.25 2no8 h GLU 65 Ca 0.33 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2no8 h GLU 65 Cb 0.90 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 2no8 h GLU 65 CO -0.08 0.40 0.34 0.78 -1.00 0.00 0.00 179.01 179.45 2no8 h GLY 66 N -0.18 0.80 0.91 -3.84 0.00 -1.46 0.24 103.07 99.55 2no8 h GLY 66 Ca 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.03 2no8 h GLY 66 CO 0.00 0.31 -0.05 -2.22 0.00 0.00 0.00 176.54 174.58 2no8 h ILE 67 N 0.76 0.95 -0.56 2.60 2.04 -1.09 0.21 117.51 122.42 2no8 h ILE 67 Ca 0.20 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.83 2no8 h ILE 67 Cb -0.04 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 2no8 h ILE 67 CO -0.04 0.05 0.19 0.58 0.00 0.00 0.00 178.15 178.93 2no8 h VAL 68 N -0.23 1.22 -0.23 1.67 2.07 -0.92 -1.87 116.25 117.96 2no8 h VAL 68 Ca -0.01 -0.72 -0.11 0.00 0.82 0.00 0.00 66.70 66.67 2no8 h VAL 68 Cb 0.19 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 2no8 h VAL 68 CO 0.02 0.28 -0.33 0.50 0.02 0.00 0.00 177.57 178.07 2no8 h LYS 69 N 0.82 0.48 -0.56 1.57 3.11 -0.27 -1.03 116.57 120.70 2no8 h LYS 69 Ca 0.19 -0.21 -0.05 0.00 -2.81 0.00 0.00 60.65 57.76 2no8 h LYS 69 Cb 0.22 -0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.41 2no8 h LYS 69 CO -0.01 0.75 0.14 1.49 -2.81 0.00 0.00 179.45 179.01 2no8 h GLU 70 N 0.41 0.89 0.01 1.90 4.57 0.10 -1.15 114.58 121.31 2no8 h GLU 70 Ca 0.05 -0.21 0.01 0.00 -1.18 0.00 0.00 59.36 58.02 2no8 h GLU 70 Cb 0.77 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.24 2no8 h GLU 70 CO 0.06 0.83 -0.04 0.82 -1.18 0.00 0.00 179.01 179.50 2no8 h ILE 71 N 0.79 0.89 -0.01 2.32 1.08 -0.78 -1.60 117.51 120.20 2no8 h ILE 71 Ca 0.18 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.64 2no8 h ILE 71 Cb 0.34 0.89 -0.00 0.00 -3.07 0.00 0.00 36.82 34.98 2no8 h ILE 71 CO 0.00 0.00 0.01 0.07 -0.69 0.00 0.00 178.15 177.54 2no8 h LYS 72 N -0.08 0.02 -0.09 2.37 2.10 -1.04 -0.50 116.57 119.34 2no8 h LYS 72 Ca 0.02 -0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.61 2no8 h LYS 72 Cb 0.10 -0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.42 2no8 h LYS 72 CO -0.04 0.11 -0.20 0.93 -2.00 0.00 0.00 179.45 178.24 2no8 h GLU 73 N -0.08 0.15 0.18 0.07 4.39 -1.07 0.64 114.58 118.86 2no8 h GLU 73 Ca 0.00 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2no8 h GLU 73 Cb 0.10 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 2no8 h GLU 73 CO -0.00 0.36 -0.09 2.35 -1.16 0.00 0.00 179.01 180.47 2no8 h TRP 74 N 0.14 -0.22 -0.24 4.33 7.01 -1.08 -1.99 115.95 123.90 2no8 h TRP 74 Ca 0.03 -0.01 -0.09 0.00 2.11 0.00 0.00 58.89 60.93 2no8 h TRP 74 Cb 0.44 0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.56 2no8 h TRP 74 CO 0.00 0.20 -0.22 0.00 -2.79 0.00 0.00 178.44 175.63 2no8 h ARG 75 N -0.83 0.44 0.00 2.65 3.08 -0.66 0.09 114.38 119.14 2no8 h ARG 75 Ca -0.02 -0.15 -0.06 0.00 0.07 0.00 0.00 59.98 59.81 2no8 h ARG 75 Cb 0.52 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 2no8 h ARG 75 CO 0.04 0.64 -0.29 0.00 -1.07 0.00 0.00 179.97 179.29 2no8 h ALA 76 N 1.37 1.38 0.20 0.04 0.00 0.22 0.12 119.26 122.59 2no8 h ALA 76 Ca 0.06 -0.26 -0.34 0.00 0.00 0.00 0.00 54.91 54.37 2no8 h ALA 76 Cb 0.61 -0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.37 2no8 h ALA 76 CO 0.04 0.36 -1.67 0.00 0.00 0.00 0.00 179.25 177.99 2no8 h ALA 77 N 1.71 0.08 -0.47 0.00 0.00 -0.51 -3.31 119.26 116.75 2no8 h ALA 77 Ca -0.00 -1.07 -0.08 0.00 0.00 0.00 0.00 54.91 53.76 2no8 h ALA 77 Cb 0.56 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2no8 h ALA 77 CO 0.04 0.93 -0.03 -0.91 0.00 0.00 0.00 179.25 179.28 2no8 h ASN 78 N 0.09 0.77 0.00 0.00 -0.26 -0.80 -3.47 115.58 111.92 2no8 h ASN 78 Ca -0.32 -0.20 0.00 0.00 -0.56 0.00 0.00 56.30 55.22 2no8 h ASN 78 Cb 2.09 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 39.15 2no8 h ASN 78 CO 0.19 0.86 0.00 0.61 -1.06 0.00 0.00 177.43 178.03 2no8 n GLY 79 N -0.58 1.05 3.90 2.83 0.00 0.07 -5.08 105.19 107.38 2no8 n GLY 79 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.32 2.27 0.40 1.61 1.02 0.18 -5.02 119.74 119.88 2no8 s LYS 80 Ca 0.00 0.13 -0.26 0.00 0.02 0.00 0.00 55.97 55.86 2no8 s LYS 80 Cb 0.00 -2.02 -0.09 0.00 -0.52 0.00 0.00 37.83 35.20 2no8 s LYS 80 CO 0.00 -1.35 1.26 -1.12 -0.92 0.00 0.00 175.35 173.22 2no8 s SER 81 N -4.50 6.43 0.49 2.83 0.01 -1.26 -4.54 113.70 113.15 2no8 s SER 81 Ca 0.60 2.56 0.02 0.00 1.31 0.00 0.00 55.95 60.44 2no8 s SER 81 Cb -0.11 -2.63 -0.01 0.00 0.21 0.00 0.00 66.02 63.47 2no8 s SER 81 CO 0.49 -0.76 0.03 -0.83 0.41 0.00 0.00 173.24 172.58 2no8 s GLY 82 N -0.84 2.94 0.78 3.44 0.00 -1.26 -4.88 107.32 107.50 2no8 s GLY 82 Ca 0.56 -0.56 -0.11 0.00 0.00 0.00 0.00 44.72 44.61 2no8 s GLY 82 CO 0.46 -2.11 1.08 -1.36 0.00 0.00 0.00 173.10 171.17 2no8 s PHE 83 N -2.95 2.70 -0.13 1.90 0.08 -1.26 -4.07 117.98 114.25 2no8 s PHE 83 Ca 0.10 1.43 -0.29 0.00 0.12 0.00 0.00 56.93 58.28 2no8 s PHE 83 Cb 0.02 -3.03 -0.01 0.00 -0.57 0.00 0.00 43.02 39.43 2no8 s PHE 83 CO 0.06 -1.75 1.04 0.21 -0.10 0.00 0.00 175.22 174.68 2no8 s LYS 84 N -4.97 4.38 0.00 0.44 2.20 0.81 -4.85 119.74 117.75 2no8 s LYS 84 Ca 0.61 1.42 0.00 0.00 -0.36 0.00 0.00 55.97 57.64 2no8 s LYS 84 Cb -0.16 -3.57 0.00 0.00 -1.51 0.00 0.00 37.83 32.59 2no8 s LYS 84 CO 0.56 -0.41 0.52 0.00 -0.36 0.00 0.00 175.35 175.67 2no8 n GLN 85 N 5.34 0.82 0.00 4.03 0.00 -1.26 -2.80 117.38 123.51 2no8 n GLN 85 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.10 2no8 n GLN 85 Cb 0.48 -1.29 0.00 0.00 0.00 0.00 0.00 30.24 29.42 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47