#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 2.87 0.98 -1.84 1.43 -1.26 -5.11 118.68 115.75 2no8 s LEU 3 Ca 0.00 -0.25 -0.16 0.00 -1.03 0.00 0.00 54.13 52.69 2no8 s LEU 3 Cb 0.00 -1.65 0.22 0.00 0.03 0.00 0.00 46.19 44.79 2no8 s LEU 3 CO 0.00 0.20 1.33 -1.59 0.23 0.00 0.00 176.35 176.52 2no8 s LYS 4 N 0.18 0.42 -0.01 1.70 -2.85 -1.26 -5.03 119.74 112.90 2no8 s LYS 4 Ca -0.06 -0.60 0.01 0.00 -1.00 0.00 0.00 55.97 54.33 2no8 s LYS 4 Cb -0.15 -1.86 -0.02 0.00 -2.06 0.00 0.00 37.83 33.74 2no8 s LYS 4 CO 0.04 -2.52 0.02 -2.39 0.10 0.00 0.00 175.35 170.60 2no8 n HIS 5 N -3.79 0.00 -4.01 1.78 1.44 -1.26 -5.10 115.22 104.27 2no8 n HIS 5 Ca 0.17 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.74 2no8 n HIS 5 Cb 0.59 -0.04 -0.02 0.00 0.12 0.00 0.00 29.99 30.64 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 -2.53 0.80 0.28 4.39 1.04 -1.26 -5.03 113.70 111.39 2no8 s SER 6 Ca -0.01 -1.47 0.04 0.00 0.48 0.00 0.00 55.95 55.00 2no8 s SER 6 Cb 0.01 0.74 0.39 0.00 0.10 0.00 0.00 66.02 67.26 2no8 s SER 6 CO 0.06 -1.45 1.67 -0.29 0.98 0.00 0.00 173.24 174.21 2no8 h ILE 7 N 2.04 1.31 0.00 -1.02 2.10 -1.88 -2.93 117.51 117.13 2no8 h ILE 7 Ca -0.30 -1.52 0.00 0.00 1.08 0.00 0.00 64.86 64.12 2no8 h ILE 7 Cb 1.24 1.64 0.00 0.00 -1.09 0.00 0.00 36.82 38.61 2no8 h ILE 7 CO 0.40 0.46 0.00 -1.20 -1.08 0.00 0.00 178.15 176.73 2no8 n SER 8 N -4.03 0.00 0.11 2.19 7.64 -1.17 -1.42 113.62 116.94 2no8 n SER 8 Ca -0.01 -0.84 0.12 0.00 1.01 0.00 0.00 58.87 59.15 2no8 n SER 8 Cb 0.48 -0.05 0.12 0.00 -1.01 0.00 0.00 64.21 63.75 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 -4.08 6.43 3.58 -1.80 -3.18 116.42 117.36 2no8 h ASP 9 Ca 0.00 -0.07 -0.49 0.00 0.42 0.00 0.00 57.03 56.89 2no8 h ASP 9 Cb 0.05 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.13 2no8 h ASP 9 CO 0.00 0.04 0.31 -0.31 -2.88 0.00 0.00 179.24 176.40 2no8 s TYR 10 N -3.25 3.53 0.54 0.28 2.02 -0.51 -4.81 117.35 115.14 2no8 s TYR 10 Ca 0.04 1.26 -0.02 0.00 -0.37 0.00 0.00 57.07 57.97 2no8 s TYR 10 Cb 0.10 -2.65 0.01 0.00 -0.40 0.00 0.00 41.96 39.02 2no8 s TYR 10 CO 0.73 -0.41 0.80 0.95 -1.57 0.00 0.00 175.55 176.05 2no8 s THR 11 N -2.77 3.56 0.25 -0.71 -4.23 -1.26 -0.02 115.64 110.46 2no8 s THR 11 Ca 0.55 -0.30 -0.05 0.00 -1.18 0.00 0.00 61.69 60.70 2no8 s THR 11 Cb -0.10 -3.37 0.24 0.00 1.34 0.00 0.00 72.50 70.61 2no8 s THR 11 CO 0.40 -0.32 1.89 -0.08 -0.54 0.00 0.00 174.62 175.97 2no8 h GLU 12 N 0.06 1.15 -0.17 3.99 4.81 -1.78 -0.13 114.58 122.50 2no8 h GLU 12 Ca -0.45 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 58.67 2no8 h GLU 12 Cb 1.26 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 2no8 h GLU 12 CO 0.58 0.76 -0.05 0.00 -0.73 0.00 0.00 179.01 179.57 2no8 h ALA 13 N 1.40 0.23 -0.04 2.92 0.00 -1.93 -0.98 119.26 120.86 2no8 h ALA 13 Ca 0.38 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 2no8 h ALA 13 Cb 0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2no8 h ALA 13 CO -0.13 0.01 -0.46 0.93 0.00 0.00 0.00 179.25 179.60 2no8 h GLU 14 N 0.03 0.09 -0.09 0.00 4.39 -1.84 -1.07 114.58 116.09 2no8 h GLU 14 Ca 0.04 -0.04 -0.14 0.00 0.34 0.00 0.00 59.36 59.56 2no8 h GLU 14 Cb 0.49 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2no8 h GLU 14 CO 0.02 0.53 -0.55 0.35 -1.16 0.00 0.00 179.01 178.20 2no8 h PHE 15 N 0.07 0.35 0.00 4.33 3.57 -0.99 -2.16 116.94 122.11 2no8 h PHE 15 Ca 0.00 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.38 2no8 h PHE 15 Cb 0.84 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.52 2no8 h PHE 15 CO 0.01 0.77 0.00 1.25 -2.23 0.00 0.00 178.31 178.11 2no8 h LEU 16 N 0.22 0.00 -0.02 0.59 6.46 -0.29 0.30 115.31 122.57 2no8 h LEU 16 Ca 0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2no8 h LEU 16 Cb 1.04 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.97 2no8 h LEU 16 CO 0.09 0.00 -0.01 -0.33 -0.62 0.00 0.00 178.44 177.57 2no8 h GLU 17 N 0.00 0.00 -0.48 1.25 4.39 -0.60 -3.30 114.58 115.84 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 0.52 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.10 2no8 h GLU 17 CO 0.00 0.01 0.08 0.27 -1.16 0.00 0.00 179.01 178.21 2no8 h PHE 18 N 0.00 0.13 -0.19 4.33 -0.00 0.01 0.36 116.94 121.57 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 1.00 0.01 0.01 0.00 -0.00 0.00 0.00 35.95 36.97 2no8 h PHE 18 CO 0.00 -0.02 -0.63 -0.24 -0.00 0.00 0.00 178.31 177.42 2no8 h VAL 19 N 0.21 1.29 -0.38 0.88 3.04 -1.68 -1.14 116.25 118.48 2no8 h VAL 19 Ca 0.24 -1.84 -0.09 0.00 -1.01 0.00 0.00 66.70 64.00 2no8 h VAL 19 Cb 0.32 1.89 -0.02 0.00 -2.01 0.00 0.00 31.29 31.47 2no8 h VAL 19 CO -0.32 0.59 -0.13 0.11 -1.01 0.00 0.00 177.57 176.81 2no8 h LYS 20 N 0.50 0.68 -0.39 4.17 1.57 -1.44 0.26 116.57 121.92 2no8 h LYS 20 Ca -0.02 -0.22 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 2no8 h LYS 20 Cb 1.26 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 2no8 h LYS 20 CO 0.13 0.78 0.03 -0.22 -0.57 0.00 0.00 179.45 179.61 2no8 h LYS 21 N 0.62 0.60 -0.03 3.15 3.64 -0.06 -1.42 116.57 123.07 2no8 h LYS 21 Ca 0.11 -0.13 -0.20 0.00 -1.27 0.00 0.00 60.65 59.16 2no8 h LYS 21 Cb 0.57 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2no8 h LYS 21 CO 0.04 0.60 -0.85 0.82 -2.27 0.00 0.00 179.45 177.79 2no8 h ILE 22 N 0.58 1.41 -0.13 2.00 2.04 -0.49 -1.75 117.51 121.17 2no8 h ILE 22 Ca 0.13 -2.37 -0.02 0.00 1.00 0.00 0.00 64.86 63.60 2no8 h ILE 22 Cb 0.32 2.31 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 2no8 h ILE 22 CO 0.01 0.70 -0.02 0.00 0.00 0.00 0.00 178.15 178.84 2no8 n ARG 24 N -4.40 2.59 -0.44 0.00 1.85 -0.61 -4.47 116.66 111.18 2no8 n ARG 24 Ca -0.01 -2.44 0.01 0.00 -1.00 0.00 0.00 57.85 54.41 2no8 n ARG 24 Cb 0.17 -1.54 0.17 0.00 -1.05 0.00 0.00 32.46 30.21 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 1.56 3.25 -0.29 2.89 0.00 -0.24 -4.45 120.51 123.24 2no8 n ALA 25 Ca 0.22 -0.94 0.11 0.00 0.00 0.00 0.00 53.44 52.82 2no8 n ALA 25 Cb 0.61 -1.08 0.25 0.00 0.00 0.00 0.00 19.45 19.23 2no8 n ALA 25 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2no8 h GLU 26 N 1.65 0.18 0.00 0.00 4.39 -1.78 -2.60 114.58 116.41 2no8 h GLU 26 Ca 0.04 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2no8 h GLU 26 Cb 1.28 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2no8 h GLU 26 CO 0.27 0.12 0.00 0.41 -1.16 0.00 0.00 179.01 178.64 2no8 n GLY 27 N -1.39 0.86 2.09 -3.84 0.00 -1.26 -3.93 105.19 97.72 2no8 n GLY 27 Ca 0.19 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.63 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 6.39 1.65 -2.77 4.61 0.00 -1.26 -5.10 120.51 124.03 2no8 n ALA 28 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 2no8 n ALA 28 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 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 -2.00 4.34 -0.22 0.00 -4.23 -1.25 -5.00 115.64 107.28 2no8 s THR 29 Ca 0.00 -1.10 0.24 0.00 -1.18 0.00 0.00 61.69 59.65 2no8 s THR 29 Cb 0.00 -3.19 0.24 0.00 1.34 0.00 0.00 72.50 70.89 2no8 s THR 29 CO 0.00 -0.07 1.72 1.05 -0.54 0.00 0.00 174.62 176.78 2no8 h GLU 30 N 2.60 0.00 0.00 3.99 4.11 -1.94 -1.10 114.58 122.24 2no8 h GLU 30 Ca -0.47 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 58.93 2no8 h GLU 30 Cb 1.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 2no8 h GLU 30 CO 0.62 0.00 -0.14 1.05 0.07 0.00 0.00 179.01 180.61 2no8 h GLU 31 N 0.00 0.00 -0.39 1.06 4.11 -1.94 0.18 114.58 117.59 2no8 h GLU 31 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 59.31 2no8 h GLU 31 Cb 0.11 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2no8 h GLU 31 CO 0.00 0.14 -0.22 0.22 0.07 0.00 0.00 179.01 179.22 2no8 h ASP 32 N 0.00 0.88 0.43 3.06 1.82 -1.47 0.32 116.42 121.46 2no8 h ASP 32 Ca -0.00 -0.42 -0.02 0.00 -0.39 0.00 0.00 57.03 56.20 2no8 h ASP 32 Cb 0.40 -0.24 0.00 0.00 0.68 0.00 0.00 39.33 40.18 2no8 h ASP 32 CO 0.02 1.10 -0.21 -0.78 -1.61 0.00 0.00 179.24 177.76 2no8 h ASP 33 N 0.65 -0.49 -0.98 2.28 1.82 -1.04 -3.27 116.42 115.38 2no8 h ASP 33 Ca 0.08 -0.10 0.07 0.00 -0.39 0.00 0.00 57.03 56.69 2no8 h ASP 33 Cb 0.79 0.13 -0.07 0.00 0.68 0.00 0.00 39.33 40.86 2no8 h ASP 33 CO 0.06 -0.12 0.63 -1.13 -1.61 0.00 0.00 179.24 177.08 2no8 h ASN 34 N -0.92 0.99 0.11 2.28 -1.24 -0.57 -1.52 115.58 114.71 2no8 h ASN 34 Ca -0.06 0.01 -0.02 0.00 0.71 0.00 0.00 56.30 56.94 2no8 h ASN 34 Cb 0.57 -0.20 -0.00 0.00 0.73 0.00 0.00 38.32 39.42 2no8 h ASN 34 CO 0.10 0.62 -0.09 0.07 -1.29 0.00 0.00 177.43 176.84 2no8 h LYS 35 N 1.12 0.00 -0.02 6.67 2.10 -0.43 -0.21 116.57 125.80 2no8 h LYS 35 Ca 0.43 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 59.05 2no8 h LYS 35 Cb 0.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 2no8 h LYS 35 CO -0.18 0.09 -0.09 -0.07 -2.00 0.00 0.00 179.45 177.20 2no8 h LEU 36 N 0.00 0.11 -0.45 7.07 3.38 -1.34 -3.30 115.31 120.79 2no8 h LEU 36 Ca -0.00 -0.68 0.09 0.00 0.09 0.00 0.00 57.88 57.38 2no8 h LEU 36 Cb 0.17 -0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.81 2no8 h LEU 36 CO 0.01 0.77 -0.05 0.58 0.09 0.00 0.00 178.44 179.84 2no8 h VAL 37 N -0.54 0.61 -0.99 1.22 2.07 -0.83 -1.92 116.25 115.87 2no8 h VAL 37 Ca -0.01 -0.02 0.11 0.00 0.82 0.00 0.00 66.70 67.60 2no8 h VAL 37 Cb 0.77 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 31.00 2no8 h VAL 37 CO 0.02 0.01 0.63 0.03 0.02 0.00 0.00 177.57 178.28 2no8 h ARG 38 N 0.06 1.00 -0.20 1.57 2.47 -1.20 0.15 114.38 118.23 2no8 h ARG 38 Ca 0.22 -0.06 -0.20 0.00 -1.26 0.00 0.00 59.98 58.68 2no8 h ARG 38 Cb 0.33 -0.23 0.00 0.00 -1.65 0.00 0.00 29.97 28.43 2no8 h ARG 38 CO -0.41 0.66 -0.68 1.05 0.56 0.00 0.00 179.97 181.15 2no8 h GLU 39 N 1.03 0.78 -0.37 0.04 4.11 -1.43 -2.81 114.58 115.92 2no8 h GLU 39 Ca 0.48 -0.57 -0.09 0.00 0.07 0.00 0.00 59.36 59.25 2no8 h GLU 39 Cb 0.40 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2no8 h GLU 39 CO -0.24 1.19 -0.14 0.74 0.07 0.00 0.00 179.01 180.63 2no8 h PHE 40 N 0.56 0.74 -0.17 2.06 0.04 -0.91 -0.80 116.94 118.46 2no8 h PHE 40 Ca -0.02 -0.13 0.03 0.00 2.80 0.00 0.00 57.97 60.64 2no8 h PHE 40 Cb 1.29 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 39.24 2no8 h PHE 40 CO 0.08 0.78 0.11 0.93 -0.60 0.00 0.00 178.31 179.61 2no8 h GLU 41 N 0.61 0.11 0.25 1.51 5.08 -0.62 0.13 114.58 121.64 2no8 h GLU 41 Ca 0.10 -0.01 -0.33 0.00 -1.00 0.00 0.00 59.36 58.12 2no8 h GLU 41 Cb 0.59 -0.02 0.04 0.00 0.50 0.00 0.00 28.75 29.85 2no8 h GLU 41 CO 0.04 0.07 -1.46 -0.09 -1.00 0.00 0.00 179.01 176.57 2no8 h ARG 42 N 0.11 0.52 -0.12 2.33 9.65 -0.95 0.96 114.38 126.88 2no8 h ARG 42 Ca 0.07 -0.89 -0.00 0.00 -1.10 0.00 0.00 59.98 58.06 2no8 h ARG 42 Cb 0.15 0.33 -0.01 0.00 -1.39 0.00 0.00 29.97 29.06 2no8 h ARG 42 CO -0.01 1.43 0.06 -0.07 2.80 0.00 0.00 179.97 184.18 2no8 h LEU 43 N 0.14 0.15 -0.48 3.80 3.38 -0.66 -2.91 115.31 118.73 2no8 h LEU 43 Ca -0.25 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.47 2no8 h LEU 43 Cb 2.16 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 42.86 2no8 h LEU 43 CO 0.27 0.19 -0.71 0.71 0.09 0.00 0.00 178.44 178.99 2no8 h THR 44 N 0.10 1.41 -1.90 0.22 1.35 -0.86 -3.42 112.91 109.81 2no8 h THR 44 Ca 0.04 -2.19 -0.34 0.00 -0.55 0.00 0.00 66.41 63.38 2no8 h THR 44 Cb 0.07 2.15 -0.05 0.00 -1.73 0.00 0.00 68.15 68.59 2no8 h THR 44 CO -0.01 0.65 -0.39 1.21 -0.25 0.00 0.00 175.52 176.73 2no8 n GLU 45 N -3.81 -1.28 -3.12 4.72 4.07 0.30 -4.97 120.64 116.56 2no8 n GLU 45 Ca -0.03 0.89 -0.40 0.00 -0.06 0.00 0.00 57.16 57.56 2no8 n GLU 45 Cb 0.69 -5.25 -0.05 0.00 -0.06 0.00 0.00 31.44 26.77 2no8 n GLU 45 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 2no8 s HIS 46 N -2.77 3.48 0.22 4.31 2.46 -1.05 -4.95 115.29 116.99 2no8 s HIS 46 Ca 0.00 1.05 -0.07 0.00 0.47 0.00 0.00 55.06 56.51 2no8 s HIS 46 Cb 0.00 -2.76 0.19 0.00 -0.13 0.00 0.00 32.58 29.88 2no8 s HIS 46 CO 0.00 -0.01 1.83 -1.00 -2.47 0.00 0.00 174.74 173.09 2no8 h PRO 47 N 7.06 1.22 -0.42 2.88 0.13 -1.93 -1.65 132.00 139.29 2no8 h PRO 47 Ca -0.37 -0.16 -0.01 0.00 -0.87 0.00 0.00 66.00 64.59 2no8 h PRO 47 Cb 1.17 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 32.06 2no8 h PRO 47 CO 0.77 0.92 0.01 -0.25 -0.23 0.00 0.00 178.00 179.21 2no8 n ASP 48 N -4.33 4.73 -0.17 1.44 9.92 -1.26 -4.60 116.55 122.28 2no8 n ASP 48 Ca 0.09 -3.00 0.29 0.00 -0.53 0.00 0.00 54.79 51.63 2no8 n ASP 48 Cb 0.12 -0.62 0.73 0.00 -0.64 0.00 0.00 41.12 40.71 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 2.79 0.00 0.00 0.44 0.00 -1.67 0.29 103.07 104.93 2no8 h GLY 49 Ca 0.01 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.34 2no8 h GLY 49 CO 0.37 0.00 -0.05 1.48 0.00 0.00 0.00 176.54 178.34 2no8 h SER 50 N 0.00 0.00 -0.98 0.19 4.64 -1.82 -3.37 113.55 112.20 2no8 h SER 50 Ca 0.42 -0.02 0.26 0.00 -0.47 0.00 0.00 61.79 61.98 2no8 h SER 50 Cb 1.74 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.76 2no8 h SER 50 CO -0.00 0.53 0.67 0.44 -0.87 0.00 0.00 176.83 177.60 2no8 h ASP 51 N -1.00 0.24 -0.89 4.97 3.32 -1.49 0.12 116.42 121.69 2no8 h ASP 51 Ca -0.00 0.04 0.09 0.00 0.02 0.00 0.00 57.03 57.17 2no8 h ASP 51 Cb 0.07 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 39.55 2no8 h ASP 51 CO -0.00 0.07 0.58 -0.07 -1.72 0.00 0.00 179.24 178.10 2no8 h LEU 52 N 0.23 0.83 0.03 1.55 3.38 -0.64 0.46 115.31 121.15 2no8 h LEU 52 Ca 0.51 0.02 -0.25 0.00 0.09 0.00 0.00 57.88 58.25 2no8 h LEU 52 Cb 1.59 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.15 2no8 h LEU 52 CO -0.14 0.51 -1.27 0.40 0.09 0.00 0.00 178.44 178.03 2no8 h ILE 53 N 0.93 1.41 0.02 1.22 2.04 -0.94 -3.34 117.51 118.84 2no8 h ILE 53 Ca 0.40 -3.13 -0.30 0.00 1.00 0.00 0.00 64.86 62.83 2no8 h ILE 53 Cb 0.33 2.74 -0.05 0.00 -0.74 0.00 0.00 36.82 39.11 2no8 h ILE 53 CO -0.16 0.83 -1.74 -1.22 0.00 0.00 0.00 178.15 175.86 2no8 n TYR 54 N -3.31 1.04 -3.94 1.37 4.02 -0.92 -4.90 117.16 110.52 2no8 n TYR 54 Ca -0.07 0.35 -0.14 0.00 -0.01 0.00 0.00 57.90 58.03 2no8 n TYR 54 Cb 0.99 -1.18 -0.14 0.00 -0.02 0.00 0.00 39.34 38.98 2no8 n TYR 54 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2no8 s TYR 55 N -2.59 0.15 0.68 -0.72 2.02 0.16 -5.08 117.35 111.97 2no8 s TYR 55 Ca -0.07 -0.01 -0.11 0.00 -0.37 0.00 0.00 57.07 56.51 2no8 s TYR 55 Cb 0.08 -0.13 0.00 0.00 -0.40 0.00 0.00 41.96 41.51 2no8 s TYR 55 CO 0.82 -0.02 1.06 -1.25 -1.57 0.00 0.00 175.55 174.58 2no8 s PRO 56 N 0.15 3.00 0.00 -1.71 0.04 -1.26 -4.14 135.00 131.08 2no8 s PRO 56 Ca -0.01 0.96 0.00 0.00 0.04 0.00 0.00 61.00 61.98 2no8 s PRO 56 Cb -0.03 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.51 2no8 s PRO 56 CO -0.00 -1.05 0.00 0.54 0.04 0.00 0.00 177.00 176.53 2no8 n ARG 57 N -3.04 0.00 0.01 4.56 5.12 -1.26 -5.06 116.66 116.99 2no8 n ARG 57 Ca 0.07 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 2no8 n ARG 57 Cb 0.53 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.83 2no8 n ARG 57 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2no8 n ASP 58 N 0.00 0.11 0.14 0.55 2.03 -1.26 -4.87 116.55 113.24 2no8 n ASP 58 Ca 0.00 0.03 0.12 0.00 0.52 0.00 0.00 54.79 55.46 2no8 n ASP 58 Cb 0.00 -0.02 0.18 0.00 -0.72 0.00 0.00 41.12 40.55 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 -4.08 1.67 3.58 -2.05 -3.46 116.42 112.08 2no8 h ASP 59 Ca 0.00 -0.04 -0.55 0.00 0.42 0.00 0.00 57.03 56.86 2no8 h ASP 59 Cb 0.00 0.00 0.14 0.00 1.72 0.00 0.00 39.33 41.19 2no8 h ASP 59 CO 0.00 0.02 0.55 -0.13 -2.88 0.00 0.00 179.24 176.80 2no8 s ARG 60 N -3.22 2.93 -0.01 0.28 1.81 -1.26 -4.96 118.95 114.52 2no8 s ARG 60 Ca 0.06 2.09 -0.30 0.00 -1.72 0.00 0.00 55.73 55.86 2no8 s ARG 60 Cb 0.09 -2.06 -0.04 0.00 -0.45 0.00 0.00 34.95 32.49 2no8 s ARG 60 CO 0.69 -1.31 1.20 -2.00 -0.68 0.00 0.00 175.30 173.20 2no8 s GLU 61 N -3.13 4.38 -1.07 3.54 2.56 -1.26 -4.83 118.70 118.90 2no8 s GLU 61 Ca 0.76 1.71 -0.14 0.00 0.00 0.00 0.00 54.97 57.31 2no8 s GLU 61 Cb -0.37 -3.48 0.20 0.00 2.00 0.00 0.00 34.13 32.47 2no8 s GLU 61 CO 0.42 -0.37 1.18 0.34 -0.56 0.00 0.00 175.26 176.27 2no8 s ASP 62 N 1.34 7.00 0.12 -1.70 2.15 -1.26 -3.90 116.67 120.42 2no8 s ASP 62 Ca 0.57 -2.91 -0.07 0.00 0.43 0.00 0.00 52.55 50.57 2no8 s ASP 62 Cb -0.27 -2.32 -0.01 0.00 -0.30 0.00 0.00 42.92 40.02 2no8 s ASP 62 CO 0.25 -0.67 0.19 -0.94 -0.17 0.00 0.00 175.17 173.84 2no8 s SER 63 N 2.50 0.14 0.31 -0.34 1.04 -1.26 -4.96 113.70 111.13 2no8 s SER 63 Ca 0.34 -0.84 0.07 0.00 0.48 0.00 0.00 55.95 56.00 2no8 s SER 63 Cb -0.06 0.36 0.83 0.00 0.10 0.00 0.00 66.02 67.24 2no8 s SER 63 CO -0.05 -0.78 1.71 -0.65 0.98 0.00 0.00 173.24 174.44 2no8 h PRO 64 N 2.72 0.47 -0.03 4.02 0.11 -1.92 -0.60 132.00 136.77 2no8 h PRO 64 Ca -0.33 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.75 2no8 h PRO 64 Cb 1.21 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2no8 h PRO 64 CO 0.54 0.31 0.01 1.49 -0.21 0.00 0.00 178.00 180.15 2no8 h GLU 65 N 0.48 0.04 -0.48 1.05 4.81 -1.91 -2.56 114.58 116.01 2no8 h GLU 65 Ca 0.61 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.81 2no8 h GLU 65 Cb 1.18 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.52 2no8 h GLU 65 CO -0.51 0.16 0.22 0.78 -0.73 0.00 0.00 179.01 178.93 2no8 h GLY 66 N -0.08 0.72 1.01 1.92 0.00 -1.44 0.27 103.07 105.47 2no8 h GLY 66 Ca 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2no8 h GLY 66 CO -0.00 0.32 0.45 -2.22 0.00 0.00 0.00 176.54 175.09 2no8 h ILE 67 N 0.68 1.20 -0.35 2.60 2.04 -1.02 -0.47 117.51 122.18 2no8 h ILE 67 Ca 0.17 -0.40 -0.04 0.00 1.00 0.00 0.00 64.86 65.59 2no8 h ILE 67 Cb 0.10 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.33 2no8 h ILE 67 CO -0.02 0.20 0.05 0.58 0.00 0.00 0.00 178.15 178.96 2no8 h VAL 68 N 0.98 1.24 -0.50 1.67 2.07 -0.84 -2.99 116.25 117.88 2no8 h VAL 68 Ca 0.26 -0.85 0.01 0.00 0.82 0.00 0.00 66.70 66.94 2no8 h VAL 68 Cb -0.07 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 2no8 h VAL 68 CO -0.05 0.28 0.33 0.50 0.02 0.00 0.00 177.57 178.65 2no8 h LYS 69 N 0.42 0.64 -0.12 1.57 3.64 0.10 0.38 116.57 123.19 2no8 h LYS 69 Ca 0.11 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2no8 h LYS 69 Cb 0.37 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 2no8 h LYS 69 CO 0.01 0.42 0.07 1.49 -2.27 0.00 0.00 179.45 179.17 2no8 h GLU 70 N 0.65 0.16 -0.64 1.90 4.57 -0.96 0.13 114.58 120.39 2no8 h GLU 70 Ca 0.19 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.31 2no8 h GLU 70 Cb -0.04 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 2no8 h GLU 70 CO -0.04 0.14 0.23 0.82 -1.18 0.00 0.00 179.01 178.98 2no8 h ILE 71 N 0.13 1.24 0.48 2.32 2.04 -1.09 -2.12 117.51 120.52 2no8 h ILE 71 Ca 0.04 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.09 2no8 h ILE 71 Cb 0.02 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2no8 h ILE 71 CO -0.01 0.31 -0.23 0.50 0.00 0.00 0.00 178.15 178.72 2no8 h LYS 72 N 0.90 -0.62 -0.43 2.37 3.11 -0.06 -1.33 116.57 120.51 2no8 h LYS 72 Ca 0.21 0.04 -0.06 0.00 -2.81 0.00 0.00 60.65 58.03 2no8 h LYS 72 Cb 0.25 0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.60 2no8 h LYS 72 CO -0.01 -0.32 0.02 0.93 -2.81 0.00 0.00 179.45 177.26 2no8 h GLU 73 N -0.88 0.69 0.47 1.90 4.39 -0.78 -2.03 114.58 118.34 2no8 h GLU 73 Ca -0.07 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 59.45 2no8 h GLU 73 Cb 0.58 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2no8 h GLU 73 CO 0.11 0.69 -0.23 2.35 -1.16 0.00 0.00 179.01 180.77 2no8 h TRP 74 N 0.65 -0.58 -0.40 4.33 7.01 -1.36 -2.59 115.95 123.01 2no8 h TRP 74 Ca 0.14 -0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.10 2no8 h TRP 74 Cb 0.38 0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.61 2no8 h TRP 74 CO 0.02 -0.26 0.17 0.00 -2.79 0.00 0.00 178.44 175.58 2no8 h ARG 75 N -0.89 0.56 0.00 2.65 3.08 -1.16 -0.60 114.38 118.01 2no8 h ARG 75 Ca -0.06 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 59.86 2no8 h ARG 75 Cb 0.58 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 2no8 h ARG 75 CO 0.11 0.45 -0.27 0.00 -1.07 0.00 0.00 179.97 179.19 2no8 h ALA 76 N 1.64 1.17 0.09 0.04 0.00 -1.35 0.13 119.26 120.97 2no8 h ALA 76 Ca 0.14 -0.24 -0.29 0.00 0.00 0.00 0.00 54.91 54.52 2no8 h ALA 76 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2no8 h ALA 76 CO -0.02 0.33 -1.45 0.00 0.00 0.00 0.00 179.25 178.12 2no8 h ALA 77 N 1.73 0.32 -0.04 0.00 0.00 -0.73 -3.34 119.26 117.21 2no8 h ALA 77 Ca -0.00 -1.10 -0.15 0.00 0.00 0.00 0.00 54.91 53.66 2no8 h ALA 77 Cb 0.65 0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.66 2no8 h ALA 77 CO 0.03 1.19 -0.54 -0.91 0.00 0.00 0.00 179.25 179.02 2no8 h ASN 78 N 0.05 0.54 0.00 0.00 -0.26 -1.06 -3.48 115.58 111.37 2no8 h ASN 78 Ca -0.20 -0.71 0.00 0.00 -0.56 0.00 0.00 56.30 54.82 2no8 h ASN 78 Cb 1.98 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 39.07 2no8 h ASN 78 CO 0.15 1.18 0.00 0.61 -1.06 0.00 0.00 177.43 178.31 2no8 n GLY 79 N 0.92 1.13 3.18 2.83 0.00 0.28 -5.10 105.19 108.43 2no8 n GLY 79 Ca -0.09 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.09 0.51 -1.43 1.61 5.02 -0.17 -5.05 118.16 118.57 2no8 n LYS 80 Ca 0.00 -2.46 -0.35 0.00 -2.02 0.00 0.00 58.31 53.48 2no8 n LYS 80 Cb 0.00 -0.29 0.10 0.00 -0.02 0.00 0.00 35.03 34.82 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 -4.03 4.13 0.00 4.39 0.01 -1.26 -4.78 113.70 112.16 2no8 s SER 81 Ca 0.51 2.44 0.00 0.00 1.31 0.00 0.00 55.95 60.21 2no8 s SER 81 Cb -0.04 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.60 2no8 s SER 81 CO 0.33 -2.31 0.00 0.61 0.41 0.00 0.00 173.24 172.28 2no8 n GLY 82 N 0.58 4.00 3.63 3.44 0.00 -1.26 -4.82 105.19 110.75 2no8 n GLY 82 Ca 0.14 -1.81 -0.29 0.00 0.00 0.00 0.00 46.02 44.07 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 2.66 2.04 -0.13 1.61 0.08 -1.26 -3.02 117.98 119.95 2no8 s PHE 83 Ca 0.00 -0.94 -0.15 0.00 0.12 0.00 0.00 56.93 55.96 2no8 s PHE 83 Cb 0.00 -1.52 -0.05 0.00 -0.57 0.00 0.00 43.02 40.89 2no8 s PHE 83 CO 0.00 0.15 0.34 0.21 -0.10 0.00 0.00 175.22 175.83 2no8 s LYS 84 N -3.80 4.20 -0.04 0.44 2.20 0.97 -4.88 119.74 118.83 2no8 s LYS 84 Ca 0.21 0.21 0.12 0.00 -0.36 0.00 0.00 55.97 56.15 2no8 s LYS 84 Cb 0.05 -3.39 0.40 0.00 -1.51 0.00 0.00 37.83 33.38 2no8 s LYS 84 CO 0.11 0.29 1.29 0.00 -0.36 0.00 0.00 175.35 176.68 2no8 n GLN 85 N 3.33 2.32 0.00 4.03 0.00 -1.26 -2.20 117.38 123.60 2no8 n GLN 85 Ca -0.11 -1.60 0.00 0.00 0.00 0.00 0.00 57.00 55.28 2no8 n GLN 85 Cb 0.52 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 29.26 2no8 n GLN 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47