#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 4.32 0.23 -4.62 1.43 -1.26 -5.11 118.68 113.68 2no8 s LEU 3 Ca 0.00 0.15 0.08 0.00 -1.03 0.00 0.00 54.13 53.33 2no8 s LEU 3 Cb 0.00 -2.91 -0.05 0.00 0.03 0.00 0.00 46.19 43.26 2no8 s LEU 3 CO 0.00 0.00 -0.14 -1.59 0.23 0.00 0.00 176.35 174.85 2no8 s LYS 4 N -3.50 1.44 0.04 1.70 0.00 -1.26 -5.04 119.74 113.12 2no8 s LYS 4 Ca 0.35 -1.67 -0.02 0.00 0.00 0.00 0.00 55.97 54.63 2no8 s LYS 4 Cb -0.10 -1.26 -0.27 0.00 0.00 0.00 0.00 37.83 36.20 2no8 s LYS 4 CO 0.29 0.18 0.99 1.12 0.00 0.00 0.00 175.35 177.93 2no8 h HIS 5 N 2.44 0.41 -2.44 1.78 2.07 -1.99 -3.49 115.15 113.93 2no8 h HIS 5 Ca -0.39 -0.30 -0.00 0.00 -2.85 0.00 0.00 60.37 56.83 2no8 h HIS 5 Cb 1.23 -0.02 0.00 0.00 2.57 0.00 0.00 27.41 31.20 2no8 h HIS 5 CO 0.73 1.29 0.16 -1.13 -3.07 0.00 0.00 177.93 175.92 2no8 n SER 6 N -3.46 -1.13 0.23 3.10 3.41 -1.26 -5.00 113.62 109.52 2no8 n SER 6 Ca -0.12 -1.76 0.11 0.00 -0.26 0.00 0.00 58.87 56.84 2no8 n SER 6 Cb 1.03 1.87 0.54 0.00 -0.26 0.00 0.00 64.21 67.39 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 1.50 0.54 0.00 -1.33 2.10 -1.85 -2.45 117.51 116.03 2no8 h ILE 7 Ca -0.17 -0.95 0.00 0.00 1.08 0.00 0.00 64.86 64.83 2no8 h ILE 7 Cb 0.62 1.64 0.00 0.00 -1.09 0.00 0.00 36.82 38.00 2no8 h ILE 7 CO 0.21 0.19 0.00 -1.20 -1.08 0.00 0.00 178.15 176.27 2no8 n SER 8 N -3.45 0.00 0.08 2.19 7.64 -1.15 -1.40 113.62 117.53 2no8 n SER 8 Ca -0.00 0.37 -0.11 0.00 1.01 0.00 0.00 58.87 60.14 2no8 n SER 8 Cb 0.37 -0.45 -0.04 0.00 -1.01 0.00 0.00 64.21 63.08 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 0.38 -3.94 6.43 3.58 -1.74 -2.69 116.42 118.44 2no8 h ASP 9 Ca 0.00 -0.32 -0.49 0.00 0.42 0.00 0.00 57.03 56.63 2no8 h ASP 9 Cb 0.30 -0.12 0.03 0.00 1.72 0.00 0.00 39.33 41.26 2no8 h ASP 9 CO 0.00 1.14 0.45 -0.31 -2.88 0.00 0.00 179.24 177.64 2no8 s TYR 10 N -3.14 3.23 0.82 0.28 1.51 -0.49 -4.60 117.35 114.95 2no8 s TYR 10 Ca -0.04 1.62 -0.09 0.00 -1.01 0.00 0.00 57.07 57.55 2no8 s TYR 10 Cb 0.09 -3.23 0.14 0.00 -0.11 0.00 0.00 41.96 38.85 2no8 s TYR 10 CO 0.85 -0.85 1.14 0.95 -1.11 0.00 0.00 175.55 176.53 2no8 s THR 11 N -1.52 2.11 0.23 -0.71 -4.23 -1.26 0.43 115.64 110.68 2no8 s THR 11 Ca 0.56 -0.24 -0.07 0.00 -1.18 0.00 0.00 61.69 60.76 2no8 s THR 11 Cb -0.26 -2.87 0.20 0.00 1.34 0.00 0.00 72.50 70.92 2no8 s THR 11 CO 0.33 0.00 1.85 -0.08 -0.54 0.00 0.00 174.62 176.18 2no8 h GLU 12 N -1.03 1.24 -0.37 3.99 4.81 -1.88 -1.41 114.58 119.92 2no8 h GLU 12 Ca -0.42 -0.15 -0.07 0.00 -0.13 0.00 0.00 59.36 58.60 2no8 h GLU 12 Cb 1.27 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.39 2no8 h GLU 12 CO 0.46 0.91 -0.02 0.00 -0.73 0.00 0.00 179.01 179.62 2no8 h ALA 13 N 1.26 0.51 -0.46 2.92 0.00 -1.92 0.19 119.26 121.76 2no8 h ALA 13 Ca 0.31 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2no8 h ALA 13 Cb 0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2no8 h ALA 13 CO -0.05 0.30 -0.04 0.93 0.00 0.00 0.00 179.25 180.39 2no8 h GLU 14 N 0.49 0.77 -0.01 0.00 4.39 -1.86 -0.15 114.58 118.21 2no8 h GLU 14 Ca 0.10 -0.22 -0.19 0.00 0.34 0.00 0.00 59.36 59.39 2no8 h GLU 14 Cb 0.50 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2no8 h GLU 14 CO 0.02 0.81 -0.82 0.35 -1.16 0.00 0.00 179.01 178.22 2no8 h PHE 15 N 0.72 0.30 0.00 4.33 3.57 -1.07 -2.54 116.94 122.25 2no8 h PHE 15 Ca 0.13 -0.16 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 2no8 h PHE 15 Cb 0.49 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.20 2no8 h PHE 15 CO 0.03 0.94 -0.01 1.25 -2.23 0.00 0.00 178.31 178.28 2no8 h LEU 16 N 0.13 0.00 -0.17 0.59 6.46 -0.05 0.30 115.31 122.57 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 1.42 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.35 2no8 h LEU 16 CO 0.13 0.01 0.00 -0.33 -0.62 0.00 0.00 178.44 177.62 2no8 h GLU 17 N 0.00 0.00 -0.28 1.25 5.08 -0.65 -3.17 114.58 116.81 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 0.53 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.72 2no8 h GLU 17 CO 0.00 0.00 -0.11 0.27 -1.00 0.00 0.00 179.01 178.17 2no8 h PHE 18 N 0.00 -0.25 -0.18 4.33 -0.00 -0.00 0.51 116.94 121.34 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 0.93 0.16 0.01 0.00 -0.00 0.00 0.00 35.95 37.04 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 -0.06 1.29 -0.59 0.88 3.04 -1.66 -0.35 116.25 118.80 2no8 h VAL 19 Ca 0.14 -1.85 -0.05 0.00 -1.01 0.00 0.00 66.70 63.93 2no8 h VAL 19 Cb 0.27 1.92 -0.03 0.00 -2.01 0.00 0.00 31.29 31.45 2no8 h VAL 19 CO -0.32 0.59 0.18 0.11 -1.01 0.00 0.00 177.57 177.11 2no8 h LYS 20 N 0.48 0.90 -0.04 4.17 1.57 -1.43 -1.04 116.57 121.17 2no8 h LYS 20 Ca -0.03 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2no8 h LYS 20 Cb 1.26 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 2no8 h LYS 20 CO 0.14 0.78 0.01 -0.22 -0.57 0.00 0.00 179.45 179.58 2no8 h LYS 21 N 0.87 0.06 -0.92 3.15 3.64 0.25 -2.55 116.57 121.07 2no8 h LYS 21 Ca 0.19 -0.02 0.10 0.00 -1.27 0.00 0.00 60.65 59.66 2no8 h LYS 21 Cb 0.26 -0.01 -0.08 0.00 -0.41 0.00 0.00 32.23 32.00 2no8 h LYS 21 CO -0.01 0.30 0.56 0.82 -2.27 0.00 0.00 179.45 178.86 2no8 h ILE 22 N -0.19 0.95 -0.67 2.00 2.04 -0.70 0.80 117.51 121.74 2no8 h ILE 22 Ca 0.01 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.59 2no8 h ILE 22 Cb 0.27 -0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.24 2no8 h ILE 22 CO 0.00 0.17 0.44 0.00 0.00 0.00 0.00 178.15 178.76 2no8 n ARG 24 N -4.47 0.65 -0.28 0.00 1.85 -0.32 -4.50 116.66 109.59 2no8 n ARG 24 Ca 0.09 0.23 -0.00 0.00 -1.00 0.00 0.00 57.85 57.17 2no8 n ARG 24 Cb 0.16 -1.57 0.10 0.00 -1.05 0.00 0.00 32.46 30.10 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 -3.43 3.02 0.33 2.89 0.00 0.26 -4.32 120.51 119.27 2no8 n ALA 25 Ca -0.44 -0.62 0.16 0.00 0.00 0.00 0.00 53.44 52.54 2no8 n ALA 25 Cb 0.96 -1.06 0.85 0.00 0.00 0.00 0.00 19.45 20.20 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 0.94 0.00 0.00 0.00 4.11 -1.64 -3.42 114.58 114.57 2no8 h GLU 26 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2no8 h GLU 26 Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 2no8 h GLU 26 CO 0.19 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.68 2no8 n GLY 27 N -1.21 1.94 1.37 1.06 0.00 -1.26 -2.51 105.19 104.58 2no8 n GLY 27 Ca -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 4.91 1.91 -1.82 4.61 0.00 -1.26 -5.08 120.51 123.77 2no8 n ALA 28 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 2no8 n ALA 28 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 -0.68 4.42 0.53 0.00 -4.23 -1.26 -4.92 115.64 109.50 2no8 s THR 29 Ca 0.00 1.25 0.35 0.00 -1.18 0.00 0.00 61.69 62.12 2no8 s THR 29 Cb 0.00 -3.66 0.55 0.00 1.34 0.00 0.00 72.50 70.73 2no8 s THR 29 CO 0.00 -0.57 1.79 1.05 -0.54 0.00 0.00 174.62 176.35 2no8 h GLU 30 N 1.15 0.04 -0.79 3.99 4.11 -2.00 -1.32 114.58 119.76 2no8 h GLU 30 Ca -0.47 -0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.00 2no8 h GLU 30 Cb 1.19 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.38 2no8 h GLU 30 CO 0.61 0.02 0.49 1.05 0.07 0.00 0.00 179.01 181.26 2no8 h GLU 31 N 0.04 0.91 0.00 1.06 4.11 -1.91 0.32 114.58 119.11 2no8 h GLU 31 Ca 0.59 -0.05 -0.04 0.00 0.07 0.00 0.00 59.36 59.92 2no8 h GLU 31 Cb 2.26 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 31.30 2no8 h GLU 31 CO -0.04 0.60 -0.21 0.22 0.07 0.00 0.00 179.01 179.65 2no8 h ASP 32 N 0.94 0.00 0.01 3.06 3.58 -1.42 -0.99 116.42 121.60 2no8 h ASP 32 Ca 0.33 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.78 2no8 h ASP 32 Cb 0.08 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.13 2no8 h ASP 32 CO -0.14 0.21 -0.01 -0.78 -2.88 0.00 0.00 179.24 175.64 2no8 h ASP 33 N 0.00 -0.01 -0.25 2.28 1.82 -1.10 -3.35 116.42 115.80 2no8 h ASP 33 Ca -0.00 -0.55 -0.04 0.00 -0.39 0.00 0.00 57.03 56.04 2no8 h ASP 33 Cb 0.97 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.97 2no8 h ASP 33 CO 0.03 0.75 0.04 -1.13 -1.61 0.00 0.00 179.24 177.32 2no8 h ASN 34 N -0.99 0.49 0.49 2.28 -1.24 -0.32 -1.53 115.58 114.76 2no8 h ASN 34 Ca -0.00 -0.08 -0.03 0.00 0.71 0.00 0.00 56.30 56.90 2no8 h ASN 34 Cb 0.56 -0.13 -0.00 0.00 0.73 0.00 0.00 38.32 39.48 2no8 h ASN 34 CO 0.00 0.53 -0.14 0.07 -1.29 0.00 0.00 177.43 176.60 2no8 h LYS 35 N 0.51 0.00 -0.01 6.67 2.10 -1.33 0.17 116.57 124.68 2no8 h LYS 35 Ca 0.11 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.69 2no8 h LYS 35 Cb 0.27 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.60 2no8 h LYS 35 CO 0.00 0.14 -0.28 -0.07 -2.00 0.00 0.00 179.45 177.24 2no8 h LEU 36 N 0.00 0.26 -0.44 7.07 3.38 -1.41 -3.25 115.31 120.92 2no8 h LEU 36 Ca -0.00 -0.76 0.07 0.00 0.09 0.00 0.00 57.88 57.29 2no8 h LEU 36 Cb 0.42 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.03 2no8 h LEU 36 CO 0.02 0.98 0.06 0.58 0.09 0.00 0.00 178.44 180.17 2no8 h VAL 37 N -0.43 0.73 -0.93 1.22 2.07 -0.92 -2.17 116.25 115.82 2no8 h VAL 37 Ca -0.03 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.49 2no8 h VAL 37 Cb 1.02 0.54 -0.06 0.00 -1.52 0.00 0.00 31.29 31.26 2no8 h VAL 37 CO 0.06 0.03 0.60 0.03 0.02 0.00 0.00 177.57 178.31 2no8 h ARG 38 N 0.18 1.04 -0.18 1.57 3.08 -0.81 0.16 114.38 119.43 2no8 h ARG 38 Ca 0.21 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 59.99 2no8 h ARG 38 Cb 0.29 -0.23 0.01 0.00 0.08 0.00 0.00 29.97 30.11 2no8 h ARG 38 CO -0.31 0.69 -0.70 1.05 -1.07 0.00 0.00 179.97 179.63 2no8 h GLU 39 N 1.07 0.80 -0.56 0.04 4.11 -1.44 -2.76 114.58 115.84 2no8 h GLU 39 Ca 0.40 -0.62 -0.08 0.00 0.07 0.00 0.00 59.36 59.14 2no8 h GLU 39 Cb 0.18 0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2no8 h GLU 39 CO -0.15 1.23 0.05 0.74 0.07 0.00 0.00 179.01 180.95 2no8 h PHE 40 N 0.54 1.03 0.00 2.06 0.04 -0.97 -2.32 116.94 117.31 2no8 h PHE 40 Ca -0.04 -0.16 0.00 0.00 2.80 0.00 0.00 57.97 60.57 2no8 h PHE 40 Cb 1.33 -0.27 0.00 0.00 2.20 0.00 0.00 35.95 39.21 2no8 h PHE 40 CO 0.09 0.92 0.00 0.93 -0.60 0.00 0.00 178.31 179.64 2no8 h GLU 41 N 0.84 0.00 0.03 1.51 4.39 -0.67 -0.51 114.58 120.17 2no8 h GLU 41 Ca 0.16 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.58 2no8 h GLU 41 Cb 0.47 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.09 2no8 h GLU 41 CO 0.02 0.00 -1.52 -0.09 -1.16 0.00 0.00 179.01 176.26 2no8 h ARG 42 N 0.00 0.07 -0.44 2.33 9.65 -1.12 -1.24 114.38 123.63 2no8 h ARG 42 Ca 0.00 -0.12 -0.14 0.00 -1.10 0.00 0.00 59.98 58.61 2no8 h ARG 42 Cb 0.23 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.85 2no8 h ARG 42 CO 0.00 0.80 -0.29 -0.07 2.80 0.00 0.00 179.97 183.21 2no8 h LEU 43 N 0.02 1.01 0.03 3.80 3.38 -0.85 -3.09 115.31 119.60 2no8 h LEU 43 Ca -0.22 -0.42 -0.25 0.00 0.09 0.00 0.00 57.88 57.08 2no8 h LEU 43 Cb 1.96 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 42.43 2no8 h LEU 43 CO 0.11 1.22 -1.14 0.71 0.09 0.00 0.00 178.44 179.43 2no8 h THR 44 N 0.81 1.51 -1.30 0.22 1.35 -1.26 -3.42 112.91 110.82 2no8 h THR 44 Ca 0.09 -2.97 -0.34 0.00 -0.55 0.00 0.00 66.41 62.65 2no8 h THR 44 Cb 0.88 2.81 -0.10 0.00 -1.73 0.00 0.00 68.15 70.01 2no8 h THR 44 CO 0.08 0.87 -0.35 -0.62 -0.25 0.00 0.00 175.52 175.25 2no8 n GLU 45 N -3.56 -1.21 -2.69 4.72 1.02 -0.48 -4.91 120.64 113.53 2no8 n GLU 45 Ca -0.07 1.00 -0.37 0.00 -0.02 0.00 0.00 57.16 57.70 2no8 n GLU 45 Cb 0.97 -5.27 -0.06 0.00 -0.02 0.00 0.00 31.44 27.06 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 -2.69 3.50 -0.04 -0.32 2.46 -1.16 -4.99 115.29 112.05 2no8 s HIS 46 Ca 0.00 1.72 -0.15 0.00 0.47 0.00 0.00 55.06 57.09 2no8 s HIS 46 Cb 0.00 -3.00 -0.09 0.00 -0.13 0.00 0.00 32.58 29.36 2no8 s HIS 46 CO 0.00 -0.14 0.64 -1.00 -2.47 0.00 0.00 174.74 171.77 2no8 h PRO 47 N 2.84 -0.50 -0.50 2.88 0.13 -1.93 -3.38 132.00 131.54 2no8 h PRO 47 Ca -0.47 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2no8 h PRO 47 Cb 1.20 0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2no8 h PRO 47 CO 0.64 -0.32 0.00 -0.25 -0.23 0.00 0.00 178.00 177.84 2no8 n ASP 48 N -5.12 5.05 -0.31 1.44 8.00 -1.26 -4.49 116.55 119.86 2no8 n ASP 48 Ca -0.07 -2.87 -0.02 0.00 0.71 0.00 0.00 54.79 52.55 2no8 n ASP 48 Cb 0.22 -0.62 0.15 0.00 -0.02 0.00 0.00 41.12 40.84 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 3.38 1.28 0.88 0.44 0.00 -1.97 0.38 103.07 107.45 2no8 h GLY 49 Ca 0.00 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 46.82 2no8 h GLY 49 CO 0.37 0.49 -0.08 1.48 0.00 0.00 0.00 176.54 178.81 2no8 h SER 50 N 1.22 -0.18 0.06 0.19 4.64 -1.89 -2.68 113.55 114.91 2no8 h SER 50 Ca 0.32 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 2no8 h SER 50 Cb -0.10 0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.04 2no8 h SER 50 CO -0.07 -0.02 -0.03 0.44 -0.87 0.00 0.00 176.83 176.28 2no8 h ASP 51 N -0.34 0.00 -0.86 4.97 5.19 -1.57 -1.95 116.42 121.86 2no8 h ASP 51 Ca -0.02 0.00 0.12 0.00 -0.62 0.00 0.00 57.03 56.51 2no8 h ASP 51 Cb 0.27 0.00 -0.06 0.00 0.18 0.00 0.00 39.33 39.71 2no8 h ASP 51 CO 0.04 0.03 0.56 -0.07 -3.12 0.00 0.00 179.24 176.67 2no8 h LEU 52 N 0.00 0.68 0.23 1.55 3.38 0.07 0.50 115.31 121.71 2no8 h LEU 52 Ca -0.00 0.03 -0.34 0.00 0.09 0.00 0.00 57.88 57.66 2no8 h LEU 52 Cb 0.07 -0.11 0.03 0.00 0.09 0.00 0.00 40.66 40.74 2no8 h LEU 52 CO 0.00 0.37 -1.55 0.40 0.09 0.00 0.00 178.44 177.76 2no8 h ILE 53 N 0.74 1.20 0.11 1.22 2.04 -1.39 -3.39 117.51 118.04 2no8 h ILE 53 Ca 0.41 -2.68 -0.18 0.00 1.00 0.00 0.00 64.86 63.41 2no8 h ILE 53 Cb 0.58 2.95 0.01 0.00 -0.74 0.00 0.00 36.82 39.62 2no8 h ILE 53 CO -0.18 0.83 -0.86 1.88 0.00 0.00 0.00 178.15 179.82 2no8 h TYR 54 N 0.13 0.44 -3.25 1.37 0.05 -1.25 -3.45 116.97 111.00 2no8 h TYR 54 Ca -0.27 -0.32 -0.49 0.00 0.05 0.00 0.00 58.73 57.70 2no8 h TYR 54 Cb 2.14 -0.02 -0.37 0.00 1.01 0.00 0.00 36.73 39.49 2no8 h TYR 54 CO 0.11 1.33 -0.79 0.71 -1.05 0.00 0.00 178.16 178.48 2no8 s TYR 55 N -2.41 1.15 0.52 4.88 2.02 0.17 -5.09 117.35 118.59 2no8 s TYR 55 Ca -0.16 -0.49 -0.21 0.00 -0.37 0.00 0.00 57.07 55.84 2no8 s TYR 55 Cb 0.01 -1.02 -0.06 0.00 -0.40 0.00 0.00 41.96 40.49 2no8 s TYR 55 CO 0.79 -0.40 1.23 -1.25 -1.57 0.00 0.00 175.55 174.35 2no8 s PRO 56 N 1.63 3.35 0.00 -1.71 0.04 -1.26 -4.33 135.00 132.71 2no8 s PRO 56 Ca 0.02 1.92 0.00 0.00 0.04 0.00 0.00 61.00 62.98 2no8 s PRO 56 Cb -0.13 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.19 2no8 s PRO 56 CO -0.05 -0.93 0.00 0.54 0.04 0.00 0.00 177.00 176.59 2no8 n ARG 57 N -0.98 0.00 0.01 4.56 1.74 -1.26 -5.06 116.66 115.68 2no8 n ARG 57 Ca 0.10 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 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 0.25 -1.09 0.55 2.03 -1.26 -4.84 116.55 112.18 2no8 n ASP 58 Ca 0.00 0.04 0.11 0.00 0.52 0.00 0.00 54.79 55.46 2no8 n ASP 58 Cb 0.00 -0.07 0.21 0.00 -0.72 0.00 0.00 41.12 40.54 2no8 n ASP 58 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2no8 n ASP 59 N -2.74 3.40 -4.87 1.67 5.75 -1.26 -4.93 116.55 113.56 2no8 n ASP 59 Ca 0.00 -1.96 -0.31 0.00 -0.01 0.00 0.00 54.79 52.51 2no8 n ASP 59 Cb 0.00 -0.26 -0.04 0.00 -1.03 0.00 0.00 41.12 39.79 2no8 n ASP 59 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2no8 s ARG 60 N -1.35 3.85 -0.26 0.11 1.81 -1.26 -5.03 118.95 116.82 2no8 s ARG 60 Ca 0.37 0.53 -0.27 0.00 -1.72 0.00 0.00 55.73 54.64 2no8 s ARG 60 Cb 0.21 -2.41 0.01 0.00 -0.45 0.00 0.00 34.95 32.31 2no8 s ARG 60 CO 0.29 0.04 0.97 -2.00 -0.68 0.00 0.00 175.30 173.92 2no8 s GLU 61 N -3.53 4.17 -1.21 3.54 2.12 -1.26 -4.73 118.70 117.80 2no8 s GLU 61 Ca 0.52 1.11 -0.18 0.00 0.36 0.00 0.00 54.97 56.79 2no8 s GLU 61 Cb -0.10 -3.67 0.10 0.00 0.26 0.00 0.00 34.13 30.71 2no8 s GLU 61 CO 0.26 -0.67 1.58 0.34 -0.54 0.00 0.00 175.26 176.24 2no8 s ASP 62 N 1.37 6.83 0.08 -1.70 2.15 -1.26 -4.01 116.67 120.13 2no8 s ASP 62 Ca 0.41 -2.41 -0.08 0.00 0.43 0.00 0.00 52.55 50.89 2no8 s ASP 62 Cb -0.14 -2.52 -0.00 0.00 -0.30 0.00 0.00 42.92 39.95 2no8 s ASP 62 CO 0.09 -1.11 0.18 -0.94 -0.17 0.00 0.00 175.17 173.22 2no8 s SER 63 N 3.96 0.13 0.48 -0.34 1.04 -1.26 -4.96 113.70 112.75 2no8 s SER 63 Ca 0.49 -0.62 0.23 0.00 0.48 0.00 0.00 55.95 56.53 2no8 s SER 63 Cb 0.01 0.32 1.28 0.00 0.10 0.00 0.00 66.02 67.73 2no8 s SER 63 CO 0.02 -0.69 1.91 -0.65 0.98 0.00 0.00 173.24 174.81 2no8 h PRO 64 N 2.90 0.18 -0.11 4.02 0.11 -1.93 0.81 132.00 137.99 2no8 h PRO 64 Ca -0.34 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.67 2no8 h PRO 64 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2no8 h PRO 64 CO 0.55 0.12 -0.28 0.93 -0.21 0.00 0.00 178.00 179.12 2no8 h GLU 65 N 0.19 0.38 -0.04 1.05 5.08 -1.91 -2.54 114.58 116.78 2no8 h GLU 65 Ca 0.39 -0.26 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 2no8 h GLU 65 Cb 1.26 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.54 2no8 h GLU 65 CO -0.08 0.88 -0.33 0.78 -1.00 0.00 0.00 179.01 179.26 2no8 h GLY 66 N -0.06 0.08 1.02 -3.84 0.00 -1.43 0.28 103.07 99.12 2no8 h GLY 66 Ca -0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 47.33 47.17 2no8 h GLY 66 CO 0.06 0.06 -0.04 -2.22 0.00 0.00 0.00 176.54 174.41 2no8 h ILE 67 N 0.07 1.27 -0.25 2.60 2.04 -0.88 -0.69 117.51 121.66 2no8 h ILE 67 Ca 0.01 -1.13 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 2no8 h ILE 67 Cb 0.63 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 2no8 h ILE 67 CO 0.05 0.39 0.07 0.58 0.00 0.00 0.00 178.15 179.24 2no8 h VAL 68 N 0.74 1.20 -0.89 1.67 2.07 -0.94 -2.84 116.25 117.27 2no8 h VAL 68 Ca 0.13 -0.66 0.06 0.00 0.82 0.00 0.00 66.70 67.05 2no8 h VAL 68 Cb 0.56 1.17 -0.06 0.00 -1.52 0.00 0.00 31.29 31.45 2no8 h VAL 68 CO 0.03 0.21 0.58 0.50 0.02 0.00 0.00 177.57 178.92 2no8 h LYS 69 N 0.23 1.00 0.49 1.57 3.64 -0.28 0.40 116.57 123.62 2no8 h LYS 69 Ca 0.08 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 2no8 h LYS 69 Cb 0.26 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2no8 h LYS 69 CO -0.00 0.66 -0.45 0.93 -2.27 0.00 0.00 179.45 178.32 2no8 h GLU 70 N 1.03 -0.90 -0.96 1.90 4.39 -1.00 0.19 114.58 119.23 2no8 h GLU 70 Ca 0.38 0.06 0.04 0.00 0.34 0.00 0.00 59.36 60.18 2no8 h GLU 70 Cb 0.17 0.20 -0.06 0.00 -0.10 0.00 0.00 28.75 28.97 2no8 h GLU 70 CO -0.14 -0.60 0.63 0.82 -1.16 0.00 0.00 179.01 178.56 2no8 h ILE 71 N -0.93 1.15 0.63 3.13 2.04 -1.07 0.49 117.51 122.95 2no8 h ILE 71 Ca -0.05 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.37 2no8 h ILE 71 Cb 0.81 -0.15 0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2no8 h ILE 71 CO -0.04 0.22 -0.30 0.50 0.00 0.00 0.00 178.15 178.52 2no8 h LYS 72 N 1.20 -0.82 -0.70 2.37 3.11 -0.06 -1.47 116.57 120.19 2no8 h LYS 72 Ca 0.39 0.06 -0.03 0.00 -2.81 0.00 0.00 60.65 58.25 2no8 h LYS 72 Cb 0.04 0.19 -0.03 0.00 -1.00 0.00 0.00 32.23 31.43 2no8 h LYS 72 CO -0.13 -0.51 0.31 0.93 -2.81 0.00 0.00 179.45 177.25 2no8 h GLU 73 N -1.11 1.03 0.21 1.90 4.39 -0.42 -1.98 114.58 118.61 2no8 h GLU 73 Ca -0.09 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.43 2no8 h GLU 73 Cb 0.69 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2no8 h GLU 73 CO 0.14 0.84 -0.10 2.35 -1.16 0.00 0.00 179.01 181.08 2no8 h TRP 74 N 0.99 -0.26 -0.29 4.33 7.01 -0.95 -2.50 115.95 124.28 2no8 h TRP 74 Ca 0.24 -0.01 -0.09 0.00 2.11 0.00 0.00 58.89 61.14 2no8 h TRP 74 Cb 0.16 0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.30 2no8 h TRP 74 CO 0.01 -0.03 -0.20 0.00 -2.79 0.00 0.00 178.44 175.43 2no8 h ARG 75 N -0.45 0.53 -0.19 2.65 3.08 -1.13 -0.82 114.38 118.04 2no8 h ARG 75 Ca -0.03 -0.19 -0.04 0.00 0.07 0.00 0.00 59.98 59.79 2no8 h ARG 75 Cb 0.35 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2no8 h ARG 75 CO 0.05 0.71 -0.07 0.00 -1.07 0.00 0.00 179.97 179.58 2no8 h ALA 76 N 1.31 1.53 0.00 0.04 0.00 -1.33 -0.04 119.26 120.76 2no8 h ALA 76 Ca 0.08 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2no8 h ALA 76 Cb 0.62 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2no8 h ALA 76 CO 0.04 0.34 -0.71 0.00 0.00 0.00 0.00 179.25 178.92 2no8 h ALA 77 N 1.65 0.70 -0.00 0.00 0.00 -0.84 -3.32 119.26 117.45 2no8 h ALA 77 Ca 0.06 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2no8 h ALA 77 Cb 0.31 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2no8 h ALA 77 CO 0.01 0.51 -0.69 0.09 0.00 0.00 0.00 179.25 179.17 2no8 n ASN 78 N -3.05 0.70 0.00 0.00 3.02 -0.41 -4.96 115.26 110.56 2no8 n ASN 78 Ca -0.01 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 54.00 2no8 n ASN 78 Cb 0.70 0.53 0.00 0.00 -0.61 0.00 0.00 39.78 40.40 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 1.50 0.53 0.08 7.41 0.00 -0.19 -5.04 105.19 109.48 2no8 n GLY 79 Ca 0.05 -0.84 -0.01 0.00 0.00 0.00 0.00 46.02 45.22 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 -1.60 0.31 -0.96 1.61 4.01 -0.30 -5.05 118.16 116.18 2no8 n LYS 80 Ca 0.00 -0.05 -0.18 0.00 -0.51 0.00 0.00 58.31 57.57 2no8 n LYS 80 Cb 0.30 -0.02 0.13 0.00 -0.51 0.00 0.00 35.03 34.93 2no8 n LYS 80 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 2no8 n SER 81 N -3.01 -0.54 0.00 4.39 7.64 -1.26 -4.83 113.62 116.01 2no8 n SER 81 Ca 0.00 -1.15 0.00 0.00 1.01 0.00 0.00 58.87 58.73 2no8 n SER 81 Cb 0.01 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.60 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 -0.82 5.50 3.46 0.23 0.00 -1.26 -4.67 105.19 107.63 2no8 n GLY 82 Ca 0.10 -1.17 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 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 2.34 2.03 0.24 1.61 0.08 -1.26 -2.93 117.98 120.10 2no8 s PHE 83 Ca 0.00 -0.73 -0.16 0.00 0.12 0.00 0.00 56.93 56.16 2no8 s PHE 83 Cb 0.00 -1.22 -0.08 0.00 -0.57 0.00 0.00 43.02 41.15 2no8 s PHE 83 CO 0.00 0.26 0.68 0.21 -0.10 0.00 0.00 175.22 176.28 2no8 s LYS 84 N -3.75 4.09 -0.55 0.44 2.20 0.17 -4.88 119.74 117.46 2no8 s LYS 84 Ca 0.31 0.69 -0.23 0.00 -0.36 0.00 0.00 55.97 56.38 2no8 s LYS 84 Cb 0.05 -2.72 0.05 0.00 -1.51 0.00 0.00 37.83 33.70 2no8 s LYS 84 CO 0.13 0.32 0.88 1.14 -0.36 0.00 0.00 175.35 177.46 2no8 s GLN 85 N -2.37 3.27 0.00 4.03 0.00 -1.26 -3.08 119.66 120.25 2no8 s GLN 85 Ca 0.46 -0.44 0.00 0.00 -0.00 0.00 0.00 55.36 55.38 2no8 s GLN 85 Cb -0.14 -4.08 0.00 0.00 0.00 0.00 0.00 33.01 28.79 2no8 s GLN 85 CO 0.20 -1.46 0.00 0.41 0.00 0.00 0.00 175.29 174.44