#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 0.55 0.83 -1.84 1.43 -1.26 -5.14 118.68 113.25 2no8 s LEU 3 Ca 0.00 -0.27 -0.13 0.00 -1.03 0.00 0.00 54.13 52.70 2no8 s LEU 3 Cb 0.00 -0.36 0.08 0.00 0.03 0.00 0.00 46.19 45.93 2no8 s LEU 3 CO 0.00 -0.25 1.06 2.29 0.23 0.00 0.00 176.35 179.68 2no8 n LYS 4 N 5.19 0.08 -0.00 1.70 -0.00 -1.26 -4.95 118.16 118.91 2no8 n LYS 4 Ca -0.06 0.10 0.09 0.00 -0.00 0.00 0.00 58.31 58.44 2no8 n LYS 4 Cb 0.49 -2.32 -0.12 0.00 -0.00 0.00 0.00 35.03 33.08 2no8 n LYS 4 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 2no8 n HIS 5 N -3.35 0.00 -3.88 5.58 1.44 -1.26 -5.04 115.22 108.72 2no8 n HIS 5 Ca 0.12 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.79 2no8 n HIS 5 Cb 0.51 -0.18 0.02 0.00 0.12 0.00 0.00 29.99 30.46 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 -3.32 0.02 0.36 4.39 1.04 -1.26 -5.00 113.70 109.93 2no8 s SER 6 Ca 0.01 -0.83 0.16 0.00 0.48 0.00 0.00 55.95 55.77 2no8 s SER 6 Cb 0.13 0.60 0.65 0.00 0.10 0.00 0.00 66.02 67.50 2no8 s SER 6 CO 0.77 -1.19 1.74 -0.29 0.98 0.00 0.00 173.24 175.24 2no8 h ILE 7 N 2.00 1.08 0.00 -1.02 2.10 -1.88 -2.92 117.51 116.86 2no8 h ILE 7 Ca -0.29 -1.58 0.00 0.00 1.08 0.00 0.00 64.86 64.07 2no8 h ILE 7 Cb 1.23 1.91 0.00 0.00 -1.09 0.00 0.00 36.82 38.86 2no8 h ILE 7 CO 0.38 0.42 0.00 -0.24 -1.08 0.00 0.00 178.15 177.63 2no8 n SER 8 N -3.71 0.00 0.09 2.19 2.88 -1.22 -1.93 113.62 111.93 2no8 n SER 8 Ca -0.01 -1.23 -0.12 0.00 -1.33 0.00 0.00 58.87 56.18 2no8 n SER 8 Cb 0.50 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.89 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 0.35 -4.17 -3.46 1.82 -1.82 -3.04 116.42 106.10 2no8 h ASP 9 Ca 0.00 -0.32 -0.47 0.00 -0.39 0.00 0.00 57.03 55.86 2no8 h ASP 9 Cb 0.00 -0.11 0.01 0.00 0.68 0.00 0.00 39.33 39.91 2no8 h ASP 9 CO 0.00 1.17 0.37 -0.31 -1.61 0.00 0.00 179.24 178.86 2no8 s TYR 10 N -3.00 3.41 0.66 0.28 2.02 -0.81 -4.71 117.35 115.20 2no8 s TYR 10 Ca -0.04 1.49 0.05 0.00 -0.37 0.00 0.00 57.07 58.21 2no8 s TYR 10 Cb 0.09 -2.81 0.11 0.00 -0.40 0.00 0.00 41.96 38.95 2no8 s TYR 10 CO 0.85 -0.34 0.90 0.95 -1.57 0.00 0.00 175.55 176.34 2no8 s THR 11 N -2.54 2.07 0.18 -0.71 -4.23 -1.26 0.04 115.64 109.19 2no8 s THR 11 Ca 0.60 -0.82 -0.13 0.00 -1.18 0.00 0.00 61.69 60.15 2no8 s THR 11 Cb -0.10 -2.25 0.08 0.00 1.34 0.00 0.00 72.50 71.57 2no8 s THR 11 CO 0.28 0.00 1.80 -0.08 -0.54 0.00 0.00 174.62 176.08 2no8 h GLU 12 N -0.19 0.55 -0.30 3.99 4.81 -1.77 -1.51 114.58 120.16 2no8 h GLU 12 Ca -0.32 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.85 2no8 h GLU 12 Cb 1.28 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2no8 h GLU 12 CO 0.39 0.36 0.08 0.00 -0.73 0.00 0.00 179.01 179.11 2no8 h ALA 13 N 1.26 0.40 -0.06 2.92 0.00 -1.94 0.27 119.26 122.10 2no8 h ALA 13 Ca 0.22 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2no8 h ALA 13 Cb 0.08 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2no8 h ALA 13 CO -0.13 0.06 -0.51 0.93 0.00 0.00 0.00 179.25 179.60 2no8 h GLU 14 N 0.33 0.17 0.03 0.00 4.39 -1.91 -1.87 114.58 115.71 2no8 h GLU 14 Ca 0.10 -0.10 -0.22 0.00 0.34 0.00 0.00 59.36 59.48 2no8 h GLU 14 Cb 0.28 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 2no8 h GLU 14 CO 0.00 0.64 -0.99 0.35 -1.16 0.00 0.00 179.01 177.85 2no8 h PHE 15 N 0.14 0.23 0.00 4.33 3.57 -1.05 -2.87 116.94 121.29 2no8 h PHE 15 Ca 0.00 -0.15 -0.02 0.00 3.53 0.00 0.00 57.97 61.34 2no8 h PHE 15 Cb 0.95 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.67 2no8 h PHE 15 CO 0.01 1.04 -0.08 1.25 -2.23 0.00 0.00 178.31 178.30 2no8 h LEU 16 N 0.06 0.00 -0.22 0.59 6.46 -0.05 0.40 115.31 122.54 2no8 h LEU 16 Ca -0.05 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 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 0.15 0.08 0.00 -0.33 -0.62 0.00 0.00 178.44 177.72 2no8 h GLU 17 N 0.00 0.00 -0.32 1.25 5.08 -1.13 -3.08 114.58 116.38 2no8 h GLU 17 Ca -0.00 0.00 0.07 0.00 -1.00 0.00 0.00 59.36 58.42 2no8 h GLU 17 Cb 0.25 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.43 2no8 h GLU 17 CO 0.01 0.00 -0.09 0.27 -1.00 0.00 0.00 179.01 178.20 2no8 h PHE 18 N 0.00 -0.19 -0.09 4.33 -0.00 -0.10 0.28 116.94 121.17 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 0.90 0.13 -0.00 0.00 -0.00 0.00 0.00 35.95 36.99 2no8 h PHE 18 CO 0.00 -0.15 -0.74 -0.24 -0.00 0.00 0.00 178.31 177.18 2no8 h VAL 19 N -0.01 1.36 -0.73 0.88 3.04 -1.61 -0.75 116.25 118.43 2no8 h VAL 19 Ca 0.16 -2.11 -0.06 0.00 -1.01 0.00 0.00 66.70 63.68 2no8 h VAL 19 Cb 0.25 2.08 -0.03 0.00 -2.01 0.00 0.00 31.29 31.58 2no8 h VAL 19 CO -0.34 0.64 0.22 0.11 -1.01 0.00 0.00 177.57 177.19 2no8 h LYS 20 N 0.33 1.14 -0.33 4.17 1.57 -1.36 0.92 116.57 123.01 2no8 h LYS 20 Ca -0.04 -0.25 0.01 0.00 -1.87 0.00 0.00 60.65 58.50 2no8 h LYS 20 Cb 1.33 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.46 2no8 h LYS 20 CO 0.13 0.97 0.21 -0.22 -0.57 0.00 0.00 179.45 179.98 2no8 h LYS 21 N 1.09 0.42 -0.54 3.15 3.64 -0.13 -2.02 116.57 122.19 2no8 h LYS 21 Ca 0.23 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.53 2no8 h LYS 21 Cb 0.32 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 2no8 h LYS 21 CO -0.01 0.28 0.09 0.82 -2.27 0.00 0.00 179.45 178.37 2no8 h ILE 22 N 0.44 1.24 -0.94 2.00 2.04 -0.66 0.12 117.51 121.74 2no8 h ILE 22 Ca 0.12 -0.90 0.06 0.00 1.00 0.00 0.00 64.86 65.14 2no8 h ILE 22 Cb -0.04 0.72 -0.06 0.00 -0.74 0.00 0.00 36.82 36.70 2no8 h ILE 22 CO -0.03 0.33 0.61 0.00 0.00 0.00 0.00 178.15 179.06 2no8 n ARG 24 N -4.49 2.56 0.00 0.00 1.85 -0.75 -4.65 116.66 111.19 2no8 n ARG 24 Ca 0.14 -2.39 0.00 0.00 -1.00 0.00 0.00 57.85 54.60 2no8 n ARG 24 Cb 0.19 -1.53 0.00 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 1.52 2.42 -0.36 2.89 0.00 0.33 -4.52 120.51 122.79 2no8 n ALA 25 Ca 0.21 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.71 2no8 n ALA 25 Cb 0.60 -1.00 0.13 0.00 0.00 0.00 0.00 19.45 19.19 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 0.10 -0.10 0.00 0.00 1.02 -1.26 -3.81 120.64 116.60 2no8 n GLU 26 Ca 0.00 1.54 0.00 0.00 -0.02 0.00 0.00 57.16 58.68 2no8 n GLU 26 Cb 0.27 -2.30 0.00 0.00 -0.02 0.00 0.00 31.44 29.39 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 -1.61 3.12 0.09 0.62 0.00 -1.26 -2.88 105.19 103.26 2no8 n GLY 27 Ca 0.16 -0.03 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.52 0.04 -2.91 4.61 0.00 -2.00 -3.49 119.26 114.99 2no8 h ALA 28 Ca 0.00 -0.71 0.06 0.00 0.00 0.00 0.00 54.91 54.26 2no8 h ALA 28 Cb 0.00 0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.91 2no8 h ALA 28 CO 0.00 0.27 0.26 0.99 0.00 0.00 0.00 179.25 180.77 2no8 s THR 29 N -2.31 0.00 -0.55 0.00 2.01 -1.14 -5.03 115.64 108.63 2no8 s THR 29 Ca -0.20 -0.71 0.07 0.00 0.31 0.00 0.00 61.69 61.17 2no8 s THR 29 Cb -0.00 -1.74 0.07 0.00 0.01 0.00 0.00 72.50 70.84 2no8 s THR 29 CO 0.71 0.00 1.16 -1.84 -0.69 0.00 0.00 174.62 173.95 2no8 n GLU 30 N -0.44 0.05 0.26 4.92 0.28 -1.26 -0.77 120.64 123.68 2no8 n GLU 30 Ca -0.07 0.49 0.09 0.00 -0.16 0.00 0.00 57.16 57.51 2no8 n GLU 30 Cb 0.61 -1.76 0.66 0.00 1.43 0.00 0.00 31.44 32.38 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 0.00 -0.12 3.44 4.11 -1.94 0.12 114.58 120.18 2no8 h GLU 31 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.36 59.32 2no8 h GLU 31 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2no8 h GLU 31 CO 0.00 0.06 -0.36 0.22 0.07 0.00 0.00 179.01 178.99 2no8 h ASP 32 N 0.00 0.54 0.25 3.06 3.58 -1.25 -0.36 116.42 122.24 2no8 h ASP 32 Ca -0.00 -0.60 -0.00 0.00 0.42 0.00 0.00 57.03 56.85 2no8 h ASP 32 Cb 0.11 -0.16 -0.01 0.00 1.72 0.00 0.00 39.33 40.98 2no8 h ASP 32 CO 0.01 1.04 -0.21 0.44 -2.88 0.00 0.00 179.24 177.63 2no8 h ASP 33 N 0.06 -0.56 -1.00 2.28 5.19 -1.52 -2.68 116.42 118.19 2no8 h ASP 33 Ca -0.01 0.05 0.02 0.00 -0.62 0.00 0.00 57.03 56.46 2no8 h ASP 33 Cb 0.98 0.19 -0.05 0.00 0.18 0.00 0.00 39.33 40.63 2no8 h ASP 33 CO 0.08 -0.32 0.66 -1.13 -3.12 0.00 0.00 179.24 175.40 2no8 h ASN 34 N -0.48 1.13 0.42 6.45 -1.24 -0.73 0.11 115.58 121.24 2no8 h ASN 34 Ca -0.01 -0.03 -0.11 0.00 0.71 0.00 0.00 56.30 56.86 2no8 h ASN 34 Cb 0.43 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 2no8 h ASN 34 CO -0.03 0.81 -0.49 0.07 -1.29 0.00 0.00 177.43 176.50 2no8 h LYS 35 N 1.33 0.09 0.03 6.67 2.10 -0.98 0.29 116.57 126.10 2no8 h LYS 35 Ca 0.37 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 58.97 2no8 h LYS 35 Cb -0.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.21 2no8 h LYS 35 CO -0.09 0.56 -0.02 -0.07 -2.00 0.00 0.00 179.45 177.84 2no8 h LEU 36 N 0.07 -0.04 -0.32 7.07 3.38 -0.94 -1.82 115.31 122.71 2no8 h LEU 36 Ca 0.00 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.80 2no8 h LEU 36 Cb 0.89 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.58 2no8 h LEU 36 CO 0.07 0.22 -0.18 0.58 0.09 0.00 0.00 178.44 179.22 2no8 h VAL 37 N -0.30 0.48 0.00 1.22 2.07 -0.36 -0.20 116.25 119.16 2no8 h VAL 37 Ca -0.00 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 2no8 h VAL 37 Cb 0.28 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2no8 h VAL 37 CO 0.01 0.00 -0.14 0.03 0.02 0.00 0.00 177.57 177.49 2no8 h ARG 38 N -0.13 0.00 0.21 1.57 3.08 -0.36 0.57 114.38 119.32 2no8 h ARG 38 Ca 0.17 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.88 2no8 h ARG 38 Cb 0.39 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.46 2no8 h ARG 38 CO -0.41 0.14 -1.59 1.05 -1.07 0.00 0.00 179.97 178.09 2no8 h GLU 39 N 0.00 0.45 -0.44 0.04 4.11 -0.38 -2.81 114.58 115.55 2no8 h GLU 39 Ca -0.00 -0.77 -0.10 0.00 0.07 0.00 0.00 59.36 58.56 2no8 h GLU 39 Cb 0.37 0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 2no8 h GLU 39 CO 0.02 1.37 -0.11 0.74 0.07 0.00 0.00 179.01 181.09 2no8 h PHE 40 N 0.08 0.96 0.00 2.06 0.04 -0.60 -1.91 116.94 117.57 2no8 h PHE 40 Ca -0.30 -0.21 0.00 0.00 2.80 0.00 0.00 57.97 60.26 2no8 h PHE 40 Cb 2.10 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 40.01 2no8 h PHE 40 CO 0.12 0.96 0.00 0.93 -0.60 0.00 0.00 178.31 179.72 2no8 h GLU 41 N 0.69 0.00 0.12 1.51 4.39 0.01 0.61 114.58 121.91 2no8 h GLU 41 Ca 0.11 0.00 -0.29 0.00 0.34 0.00 0.00 59.36 59.53 2no8 h GLU 41 Cb 0.65 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.30 2no8 h GLU 41 CO 0.04 0.00 -1.35 -0.09 -1.16 0.00 0.00 179.01 176.46 2no8 h ARG 42 N 0.00 0.26 -0.33 2.33 9.65 -1.14 -0.66 114.38 124.49 2no8 h ARG 42 Ca 0.00 -0.45 -0.09 0.00 -1.10 0.00 0.00 59.98 58.34 2no8 h ARG 42 Cb 0.36 0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 29.10 2no8 h ARG 42 CO 0.00 1.18 -0.13 -0.07 2.80 0.00 0.00 179.97 183.74 2no8 h LEU 43 N 0.07 0.69 -0.18 3.80 3.38 -0.41 -3.12 115.31 119.54 2no8 h LEU 43 Ca -0.17 -0.39 -0.21 0.00 0.09 0.00 0.00 57.88 57.19 2no8 h LEU 43 Cb 1.99 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.54 2no8 h LEU 43 CO 0.19 0.93 -0.95 0.71 0.09 0.00 0.00 178.44 179.41 2no8 h THR 44 N 0.44 1.53 -2.29 0.22 1.35 -1.04 -3.42 112.91 109.70 2no8 h THR 44 Ca 0.08 -2.82 -0.42 0.00 -0.55 0.00 0.00 66.41 62.69 2no8 h THR 44 Cb 0.66 2.60 -0.07 0.00 -1.73 0.00 0.00 68.15 69.61 2no8 h THR 44 CO 0.04 0.82 -0.49 1.21 -0.25 0.00 0.00 175.52 176.86 2no8 n GLU 45 N -3.59 -1.60 -2.82 4.72 4.07 -0.26 -4.91 120.64 116.25 2no8 n GLU 45 Ca -0.04 1.10 -0.40 0.00 -0.06 0.00 0.00 57.16 57.75 2no8 n GLU 45 Cb 0.86 -5.67 -0.05 0.00 -0.06 0.00 0.00 31.44 26.53 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 -2.95 3.84 0.15 4.31 2.46 -1.21 -4.96 115.29 116.93 2no8 s HIS 46 Ca 0.00 1.73 -0.12 0.00 0.47 0.00 0.00 55.06 57.14 2no8 s HIS 46 Cb 0.00 -2.96 0.03 0.00 -0.13 0.00 0.00 32.58 29.53 2no8 s HIS 46 CO 0.00 0.30 1.64 -1.00 -2.47 0.00 0.00 174.74 173.22 2no8 h PRO 47 N 5.19 0.85 -0.21 2.88 0.13 -1.92 -3.18 132.00 135.74 2no8 h PRO 47 Ca -0.44 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 2no8 h PRO 47 Cb 1.21 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2no8 h PRO 47 CO 0.70 0.84 0.00 -0.25 -0.23 0.00 0.00 178.00 179.06 2no8 n ASP 48 N -4.40 3.35 -0.06 1.44 8.00 -1.26 -4.68 116.55 118.95 2no8 n ASP 48 Ca 0.02 -2.82 -0.11 0.00 0.71 0.00 0.00 54.79 52.59 2no8 n ASP 48 Cb 0.26 -0.45 -0.04 0.00 -0.02 0.00 0.00 41.12 40.87 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 1.41 0.32 1.25 0.44 0.00 -1.95 0.37 103.07 104.90 2no8 h GLY 49 Ca 0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 47.33 47.07 2no8 h GLY 49 CO 0.14 0.15 -0.08 1.76 0.00 0.00 0.00 176.54 178.51 2no8 h SER 50 N 0.19 0.88 -0.74 0.19 0.02 -1.83 -2.54 113.55 109.72 2no8 h SER 50 Ca 0.07 -0.26 0.09 0.00 -0.84 0.00 0.00 61.79 60.85 2no8 h SER 50 Cb 0.13 -0.24 -0.07 0.00 0.14 0.00 0.00 62.40 62.37 2no8 h SER 50 CO -0.01 0.98 0.39 0.44 -1.14 0.00 0.00 176.83 177.49 2no8 h ASP 51 N 0.81 0.52 -0.91 3.07 5.19 -1.67 -2.07 116.42 121.36 2no8 h ASP 51 Ca 0.14 0.06 0.15 0.00 -0.62 0.00 0.00 57.03 56.75 2no8 h ASP 51 Cb 0.59 -0.04 -0.07 0.00 0.18 0.00 0.00 39.33 39.98 2no8 h ASP 51 CO 0.04 0.30 0.59 -0.07 -3.12 0.00 0.00 179.24 176.97 2no8 h LEU 52 N 0.66 0.68 0.23 1.55 3.38 0.15 0.64 115.31 122.60 2no8 h LEU 52 Ca 0.36 0.05 -0.32 0.00 0.09 0.00 0.00 57.88 58.05 2no8 h LEU 52 Cb 0.36 -0.09 0.03 0.00 0.09 0.00 0.00 40.66 41.05 2no8 h LEU 52 CO -0.26 0.33 -1.44 0.40 0.09 0.00 0.00 178.44 177.56 2no8 h ILE 53 N 0.71 1.26 0.17 1.22 2.04 -1.37 -3.18 117.51 118.37 2no8 h ILE 53 Ca 0.46 -2.65 -0.27 0.00 1.00 0.00 0.00 64.86 63.40 2no8 h ILE 53 Cb 0.73 3.03 0.03 0.00 -0.74 0.00 0.00 36.82 39.87 2no8 h ILE 53 CO -0.22 0.80 -1.15 1.88 0.00 0.00 0.00 178.15 179.46 2no8 h TYR 54 N 0.08 0.84 -2.80 1.37 0.05 -0.99 -3.43 116.97 112.09 2no8 h TYR 54 Ca -0.26 -0.58 -0.53 0.00 0.05 0.00 0.00 58.73 57.41 2no8 h TYR 54 Cb 2.10 -0.05 -0.40 0.00 1.01 0.00 0.00 36.73 39.39 2no8 h TYR 54 CO 0.13 1.44 -0.78 0.71 -1.05 0.00 0.00 178.16 178.61 2no8 s TYR 55 N -2.71 0.36 0.28 4.88 2.02 0.22 -5.10 117.35 117.30 2no8 s TYR 55 Ca -0.11 -0.90 -0.30 0.00 -0.37 0.00 0.00 57.07 55.40 2no8 s TYR 55 Cb 0.03 -0.92 -0.13 0.00 -0.40 0.00 0.00 41.96 40.54 2no8 s TYR 55 CO 0.90 -0.83 1.25 -2.30 -1.57 0.00 0.00 175.55 173.01 2no8 n PRO 56 N 5.24 1.82 0.00 -1.71 -0.02 -1.20 -4.06 135.00 135.07 2no8 n PRO 56 Ca -0.06 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 2no8 n PRO 56 Cb 0.42 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 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 1.23 0.00 0.00 -0.52 1.74 -1.26 -5.05 116.66 112.81 2no8 n ARG 57 Ca 0.09 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.17 2no8 n ARG 57 Cb 0.32 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.76 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 0.03 0.10 0.55 2.03 -1.26 -4.86 116.55 113.13 2no8 n ASP 58 Ca 0.00 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.37 2no8 n ASP 58 Cb 0.00 -0.01 -0.01 0.00 -0.72 0.00 0.00 41.12 40.39 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 -3.88 1.67 3.58 -2.05 -3.46 116.42 112.29 2no8 h ASP 59 Ca 0.00 0.00 -0.49 0.00 0.42 0.00 0.00 57.03 56.96 2no8 h ASP 59 Cb 0.00 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.06 2no8 h ASP 59 CO 0.00 0.33 0.41 -0.60 -2.88 0.00 0.00 179.24 176.50 2no8 s ARG 60 N -3.09 4.45 0.52 0.28 6.06 -1.26 -4.98 118.95 120.93 2no8 s ARG 60 Ca 0.00 1.57 -0.23 0.00 -2.50 0.00 0.00 55.73 54.58 2no8 s ARG 60 Cb 0.08 -2.86 -0.06 0.00 0.06 0.00 0.00 34.95 32.17 2no8 s ARG 60 CO 0.77 0.11 1.40 -2.00 -2.50 0.00 0.00 175.30 173.08 2no8 s GLU 61 N -1.96 3.28 -1.23 5.12 2.56 -1.26 -4.63 118.70 120.59 2no8 s GLU 61 Ca 0.51 2.33 -0.12 0.00 0.00 0.00 0.00 54.97 57.68 2no8 s GLU 61 Cb -0.25 -2.38 0.17 0.00 2.00 0.00 0.00 34.13 33.67 2no8 s GLU 61 CO 0.32 -1.11 1.58 -3.47 -0.56 0.00 0.00 175.26 172.02 2no8 n ASP 62 N -0.78 5.20 -3.83 -1.70 -0.08 -1.26 -4.38 116.55 109.71 2no8 n ASP 62 Ca 0.09 -3.03 -0.09 0.00 -1.51 0.00 0.00 54.79 50.25 2no8 n ASP 62 Cb 0.44 -1.54 -0.06 0.00 2.34 0.00 0.00 41.12 42.30 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 2.13 0.02 0.60 1.67 1.04 -1.26 -4.95 113.70 112.94 2no8 s SER 63 Ca 0.42 -0.63 0.30 0.00 0.48 0.00 0.00 55.95 56.52 2no8 s SER 63 Cb 0.01 0.40 1.74 0.00 0.10 0.00 0.00 66.02 68.27 2no8 s SER 63 CO 0.00 -0.81 2.12 -0.65 0.98 0.00 0.00 173.24 174.89 2no8 h PRO 64 N 2.60 0.00 0.09 4.02 0.11 -1.91 -1.12 132.00 135.78 2no8 h PRO 64 Ca -0.33 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.77 2no8 h PRO 64 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2no8 h PRO 64 CO 0.52 0.00 -0.04 0.93 -0.21 0.00 0.00 178.00 179.20 2no8 h GLU 65 N 0.00 -0.11 -0.56 1.05 5.08 -1.94 -3.14 114.58 114.97 2no8 h GLU 65 Ca 0.07 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 2no8 h GLU 65 Cb 0.43 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 2no8 h GLU 65 CO -0.00 0.43 0.37 0.78 -1.00 0.00 0.00 179.01 179.59 2no8 h GLY 66 N -0.84 0.75 0.96 -3.84 0.00 -1.56 0.49 103.07 99.02 2no8 h GLY 66 Ca -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 2no8 h GLY 66 CO 0.02 0.24 0.20 -2.22 0.00 0.00 0.00 176.54 174.77 2no8 h ILE 67 N 0.67 1.17 -0.09 2.60 2.04 -1.32 -0.97 117.51 121.61 2no8 h ILE 67 Ca 0.22 -0.48 -0.14 0.00 1.00 0.00 0.00 64.86 65.46 2no8 h ILE 67 Cb 0.05 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 2no8 h ILE 67 CO -0.06 0.18 -0.55 0.58 0.00 0.00 0.00 178.15 178.31 2no8 h VAL 68 N 0.51 1.36 -0.69 1.67 2.07 -1.31 -2.98 116.25 116.89 2no8 h VAL 68 Ca 0.14 -1.85 -0.02 0.00 0.82 0.00 0.00 66.70 65.78 2no8 h VAL 68 Cb 0.11 1.90 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2no8 h VAL 68 CO -0.02 0.55 0.35 0.50 0.02 0.00 0.00 177.57 178.97 2no8 h LYS 69 N 0.20 0.98 -0.12 1.57 1.63 -0.58 0.14 116.57 120.39 2no8 h LYS 69 Ca 0.00 -0.14 0.04 0.00 -0.85 0.00 0.00 60.65 59.70 2no8 h LYS 69 Cb 1.03 -0.18 -0.04 0.00 -0.60 0.00 0.00 32.23 32.44 2no8 h LYS 69 CO 0.09 0.76 -0.11 0.93 -3.45 0.00 0.00 179.45 177.67 2no8 h GLU 70 N 0.95 -0.13 -0.05 1.90 4.39 -1.04 0.19 114.58 120.80 2no8 h GLU 70 Ca 0.24 0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.96 2no8 h GLU 70 Cb 0.09 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2no8 h GLU 70 CO -0.03 -0.08 -0.02 0.82 -1.16 0.00 0.00 179.01 178.53 2no8 h ILE 71 N -0.13 0.93 -0.16 3.13 2.04 -1.31 -0.20 117.51 121.81 2no8 h ILE 71 Ca 0.08 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 2no8 h ILE 71 Cb 0.25 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2no8 h ILE 71 CO -0.20 0.00 -0.03 0.07 0.00 0.00 0.00 178.15 177.99 2no8 h LYS 72 N -0.01 0.31 -0.35 2.37 2.10 -0.53 -0.81 116.57 119.64 2no8 h LYS 72 Ca 0.03 -0.11 -0.11 0.00 -2.00 0.00 0.00 60.65 58.45 2no8 h LYS 72 Cb 0.05 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.35 2no8 h LYS 72 CO -0.06 0.57 -0.25 0.93 -2.00 0.00 0.00 179.45 178.65 2no8 h GLU 73 N 0.02 0.71 -0.18 0.07 4.39 -0.54 0.43 114.58 119.48 2no8 h GLU 73 Ca 0.04 -0.29 -0.02 0.00 0.34 0.00 0.00 59.36 59.43 2no8 h GLU 73 Cb 0.45 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2no8 h GLU 73 CO 0.01 0.88 0.02 2.35 -1.16 0.00 0.00 179.01 181.11 2no8 h TRP 74 N 0.62 0.32 -0.28 4.33 7.01 -0.98 0.30 115.95 127.27 2no8 h TRP 74 Ca 0.08 -0.05 -0.10 0.00 2.11 0.00 0.00 58.89 60.93 2no8 h TRP 74 Cb 0.74 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.70 2no8 h TRP 74 CO 0.04 0.48 -0.25 0.00 -2.79 0.00 0.00 178.44 175.92 2no8 h ARG 75 N 0.07 0.55 -0.63 2.65 3.08 -0.85 -1.27 114.38 117.98 2no8 h ARG 75 Ca 0.05 -0.21 -0.04 0.00 0.07 0.00 0.00 59.98 59.84 2no8 h ARG 75 Cb 0.34 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 2no8 h ARG 75 CO 0.01 0.76 0.21 0.00 -1.07 0.00 0.00 179.97 179.88 2no8 h ALA 76 N 1.25 1.19 0.00 0.04 0.00 0.08 0.18 119.26 121.99 2no8 h ALA 76 Ca 0.07 -0.19 -0.21 0.00 0.00 0.00 0.00 54.91 54.58 2no8 h ALA 76 Cb 0.69 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2no8 h ALA 76 CO 0.05 0.58 -1.09 0.00 0.00 0.00 0.00 179.25 178.79 2no8 h ALA 77 N 1.31 0.48 -0.01 0.00 0.00 -0.64 -3.11 119.26 117.28 2no8 h ALA 77 Ca 0.21 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2no8 h ALA 77 Cb 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2no8 h ALA 77 CO -0.01 1.23 0.00 0.09 0.00 0.00 0.00 179.25 180.56 2no8 n ASN 78 N -3.26 0.55 -1.55 0.00 3.02 -0.50 -4.89 115.26 108.62 2no8 n ASN 78 Ca -0.03 -1.21 -0.12 0.00 -0.03 0.00 0.00 54.58 53.19 2no8 n ASN 78 Cb 0.93 -0.00 0.01 0.00 -0.61 0.00 0.00 39.78 40.11 2no8 n ASN 78 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2no8 n GLY 79 N 1.05 -0.04 3.90 7.41 0.00 -0.89 -5.01 105.19 111.61 2no8 n GLY 79 Ca 0.22 -0.34 -0.20 0.00 0.00 0.00 0.00 46.02 45.70 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 -4.89 2.81 0.63 1.61 1.02 0.58 -5.04 119.74 116.46 2no8 s LYS 80 Ca 0.09 -1.24 -0.17 0.00 0.02 0.00 0.00 55.97 54.66 2no8 s LYS 80 Cb -0.04 -2.58 -0.02 0.00 -0.52 0.00 0.00 37.83 34.68 2no8 s LYS 80 CO 0.11 0.02 1.16 -1.12 -0.92 0.00 0.00 175.35 174.60 2no8 s SER 81 N -4.09 5.10 0.00 2.83 0.01 -1.26 -4.38 113.70 111.91 2no8 s SER 81 Ca 0.44 2.21 0.00 0.00 1.31 0.00 0.00 55.95 59.91 2no8 s SER 81 Cb -0.07 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.59 2no8 s SER 81 CO 0.28 -1.65 0.00 0.61 0.41 0.00 0.00 173.24 172.90 2no8 n GLY 82 N 0.08 4.25 3.93 3.44 0.00 -1.26 -4.77 105.19 110.86 2no8 n GLY 82 Ca 0.12 -1.26 -0.23 0.00 0.00 0.00 0.00 46.02 44.64 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 4.07 1.85 0.44 1.61 0.08 -1.26 -3.37 117.98 121.40 2no8 s PHE 83 Ca 0.00 -0.72 -0.23 0.00 0.12 0.00 0.00 56.93 56.10 2no8 s PHE 83 Cb 0.00 -2.05 -0.08 0.00 -0.57 0.00 0.00 43.02 40.32 2no8 s PHE 83 CO 0.00 -0.54 1.07 0.21 -0.10 0.00 0.00 175.22 175.86 2no8 s LYS 84 N -4.33 3.97 -0.62 0.44 2.20 0.11 -4.90 119.74 116.60 2no8 s LYS 84 Ca 0.44 1.52 -0.27 0.00 -0.36 0.00 0.00 55.97 57.30 2no8 s LYS 84 Cb -0.03 -2.38 0.00 0.00 -1.51 0.00 0.00 37.83 33.91 2no8 s LYS 84 CO 0.27 -0.31 1.58 -0.65 -0.36 0.00 0.00 175.35 175.87 2no8 s GLN 85 N -2.76 3.00 0.00 4.03 1.11 -1.26 -4.41 119.66 119.37 2no8 s GLN 85 Ca 0.62 0.38 0.00 0.00 0.01 0.00 0.00 55.36 56.37 2no8 s GLN 85 Cb -0.22 -4.25 0.00 0.00 -1.01 0.00 0.00 33.01 27.54 2no8 s GLN 85 CO 0.27 -2.31 0.00 0.41 0.01 0.00 0.00 175.29 173.67