#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2axd n LEU 2 N 0.00 0.94 0.00 4.03 4.77 -1.26 -4.05 117.00 121.43 2axd n LEU 2 Ca 0.00 -0.47 0.00 0.00 -0.03 0.00 0.00 56.01 55.51 2axd n LEU 2 Cb 0.00 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 2axd n LEU 2 CO 0.00 0.16 0.00 0.29 -1.33 0.00 0.00 177.39 176.51 2axd n LYS 3 N 0.73 0.00 0.00 3.23 4.76 -1.26 -4.88 118.16 120.74 2axd n LYS 3 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2axd n LYS 3 Cb 0.16 -0.20 0.00 0.00 -1.84 0.00 0.00 35.03 33.15 2axd n LYS 3 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2axd n ASN 4 N -0.22 0.00 -0.24 4.39 2.85 -1.26 -4.46 115.26 116.33 2axd n ASN 4 Ca 0.00 0.00 0.28 0.00 -0.11 0.00 0.00 54.58 54.75 2axd n ASN 4 Cb 0.00 0.00 0.66 0.00 1.24 0.00 0.00 39.78 41.68 2axd n ASN 4 CO 0.00 0.00 0.00 0.17 -2.11 0.00 0.00 177.26 175.32 2axd h LEU 5 N 0.00 0.14 0.00 1.20 -0.00 -1.94 0.22 115.31 114.93 2axd h LEU 5 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.90 2axd h LEU 5 Cb 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 2axd h LEU 5 CO 0.00 0.04 0.06 0.00 -0.00 0.00 0.00 178.44 178.54 2axd n ALA 6 N -2.66 0.94 0.18 0.17 0.00 -1.26 -1.41 120.51 116.48 2axd n ALA 6 Ca 0.21 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.71 2axd n ALA 6 Cb 0.97 -0.82 0.29 0.00 0.00 0.00 0.00 19.45 19.88 2axd n ALA 6 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2axd h LYS 7 N 0.00 0.00 -2.60 0.00 2.10 -1.33 -3.45 116.57 111.29 2axd h LYS 7 Ca 0.00 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 58.40 2axd h LYS 7 Cb 0.13 0.00 -0.33 0.00 -0.90 0.00 0.00 32.23 31.12 2axd h LYS 7 CO 0.00 0.37 -0.56 -0.51 -2.00 0.00 0.00 179.45 176.75 2axd s LEU 8 N -6.84 -0.27 0.00 7.07 1.43 -0.50 -5.08 118.68 114.49 2axd s LEU 8 Ca 0.01 0.23 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 2axd s LEU 8 Cb 0.10 0.63 0.00 0.00 0.03 0.00 0.00 46.19 46.95 2axd s LEU 8 CO 0.69 -0.28 0.00 -0.67 0.23 0.00 0.00 176.35 176.32 2axd n ASP 9 N 5.34 0.00 -0.21 2.29 2.03 -1.26 -4.98 116.55 119.76 2axd n ASP 9 Ca -0.05 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.26 2axd n ASP 9 Cb 0.50 0.00 0.12 0.00 -0.72 0.00 0.00 41.12 41.02 2axd n ASP 9 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 2axd h GLN 10 N 0.00 0.36 -0.16 -0.67 -0.00 -1.99 -0.48 115.11 112.17 2axd h GLN 10 Ca 0.00 -0.02 0.03 0.00 -0.00 0.00 0.00 58.65 58.66 2axd h GLN 10 Cb 0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 27.48 27.39 2axd h GLN 10 CO 0.00 0.24 0.11 0.00 0.00 0.00 0.00 178.83 179.18 2axd h THR 11 N 0.37 0.96 -0.45 2.39 1.03 -1.98 0.41 112.91 115.63 2axd h THR 11 Ca 0.32 -0.02 -0.00 0.00 -0.01 0.00 0.00 66.41 66.70 2axd h THR 11 Cb 0.44 0.89 -0.02 0.00 -1.07 0.00 0.00 68.15 68.38 2axd h THR 11 CO -0.35 0.01 0.26 -0.33 -0.01 0.00 0.00 175.52 175.11 2axd h GLU 12 N 0.06 0.60 0.04 0.00 4.39 -1.41 0.26 114.58 118.52 2axd h GLU 12 Ca 0.07 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.67 2axd h GLU 12 Cb 0.20 -0.13 0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2axd h GLU 12 CO -0.01 0.43 -0.24 0.52 -1.16 0.00 0.00 179.01 178.55 2axd h MET 13 N 0.62 0.08 -0.52 2.33 2.86 -1.06 -2.64 114.93 116.60 2axd h MET 13 Ca 0.16 -0.14 0.05 0.00 -2.06 0.00 0.00 59.70 57.71 2axd h MET 13 Cb -0.01 0.05 -0.05 0.00 0.06 0.00 0.00 31.60 31.65 2axd h MET 13 CO -0.03 1.07 0.26 0.22 1.06 0.00 0.00 176.91 179.49 2axd h ASP 14 N -0.83 0.37 -0.92 1.22 1.82 -0.72 -0.77 116.42 116.58 2axd h ASP 14 Ca -0.04 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.62 2axd h ASP 14 Cb 1.18 -0.03 -0.04 0.00 0.68 0.00 0.00 39.33 41.11 2axd h ASP 14 CO 0.04 0.25 0.55 0.11 -1.61 0.00 0.00 179.24 178.58 2axd h LYS 15 N 0.50 1.25 -0.86 0.28 1.79 -0.61 -2.09 116.57 116.83 2axd h LYS 15 Ca 0.23 -0.12 -0.03 0.00 -2.18 0.00 0.00 60.65 58.55 2axd h LYS 15 Cb 0.15 -0.26 -0.04 0.00 -1.58 0.00 0.00 32.23 30.51 2axd h LYS 15 CO -0.17 0.88 0.42 -0.24 -1.08 0.00 0.00 179.45 179.26 2axd h VAL 16 N 1.27 1.26 -0.61 0.50 3.04 -0.81 -2.61 116.25 118.29 2axd h VAL 16 Ca 0.33 -0.73 -0.01 0.00 -1.01 0.00 0.00 66.70 65.28 2axd h VAL 16 Cb -0.04 0.15 -0.03 0.00 -2.01 0.00 0.00 31.29 29.36 2axd h VAL 16 CO -0.06 0.31 0.35 -1.13 -1.01 0.00 0.00 177.57 176.03 2axd h ASN 17 N 1.23 0.75 -0.97 3.17 -0.73 -0.62 -0.02 115.58 118.38 2axd h ASN 17 Ca 0.30 -0.08 0.12 0.00 1.87 0.00 0.00 56.30 58.51 2axd h ASN 17 Cb 0.11 -0.19 -0.08 0.00 0.27 0.00 0.00 38.32 38.43 2axd h ASN 17 CO -0.04 0.61 0.62 0.58 -0.37 0.00 0.00 177.43 178.83 2axd h VAL 18 N 0.82 0.91 -0.33 2.57 2.07 -1.17 -2.33 116.25 118.79 2axd h VAL 18 Ca 0.21 -0.32 -0.12 0.00 0.82 0.00 0.00 66.70 67.30 2axd h VAL 18 Cb 0.02 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.68 2axd h VAL 18 CO -0.04 0.17 -0.26 0.44 0.02 0.00 0.00 177.57 177.90 2axd h ASP 19 N 0.93 0.79 -0.57 0.57 3.32 -0.70 -0.95 116.42 119.81 2axd h ASP 19 Ca 0.48 -0.45 0.11 0.00 0.02 0.00 0.00 57.03 57.19 2axd h ASP 19 Cb 0.53 -0.22 -0.09 0.00 0.22 0.00 0.00 39.33 39.77 2axd h ASP 19 CO -0.25 1.07 0.05 0.25 -1.72 0.00 0.00 179.24 178.65 2axd h LEU 20 N 0.52 -0.14 -0.38 1.55 6.46 -0.64 0.13 115.31 122.81 2axd h LEU 20 Ca 0.06 0.12 -0.01 0.00 -0.12 0.00 0.00 57.88 57.93 2axd h LEU 20 Cb 0.82 0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 40.94 2axd h LEU 20 CO 0.07 -0.05 0.19 0.00 -0.62 0.00 0.00 178.44 178.02 2axd h ALA 21 N 1.49 0.49 -0.83 1.25 0.00 -1.08 -1.05 119.26 119.53 2axd h ALA 21 Ca 0.30 -0.10 0.08 0.00 0.00 0.00 0.00 54.91 55.18 2axd h ALA 21 Cb 0.46 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 2axd h ALA 21 CO -0.44 0.04 0.49 0.00 0.00 0.00 0.00 179.25 179.35 2axd h ALA 22 N 1.04 1.16 -0.76 0.00 0.00 -0.26 -0.62 119.26 119.82 2axd h ALA 22 Ca 0.13 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2axd h ALA 22 Cb 0.11 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2axd h ALA 22 CO -0.02 0.17 0.35 0.00 0.00 0.00 0.00 179.25 179.76 2axd h ALA 23 N 1.43 1.18 -0.60 0.00 0.00 -0.30 -1.22 119.26 119.75 2axd h ALA 23 Ca 0.38 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 55.28 2axd h ALA 23 Cb 0.27 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2axd h ALA 23 CO -0.21 0.61 0.42 0.78 0.00 0.00 0.00 179.25 180.85 2axd h GLY 24 N 1.13 0.29 2.00 0.00 0.00 0.19 0.19 103.07 106.87 2axd h GLY 24 Ca 0.26 -0.08 -0.07 0.00 0.00 0.00 0.00 47.33 47.44 2axd h GLY 24 CO -0.03 0.03 -0.34 -2.08 0.00 0.00 0.00 176.54 174.12 2axd h VAL 25 N 0.18 0.82 0.00 4.60 2.07 -0.70 -2.13 116.25 121.09 2axd h VAL 25 Ca 0.29 -1.41 -0.05 0.00 0.82 0.00 0.00 66.70 66.34 2axd h VAL 25 Cb 0.89 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.53 2axd h VAL 25 CO -0.05 0.33 -0.24 0.00 0.02 0.00 0.00 177.57 177.63 2axd h ALA 26 N 1.66 1.19 0.00 1.67 0.00 -0.52 0.13 119.26 123.39 2axd h ALA 26 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2axd h ALA 26 Cb 0.85 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2axd h ALA 26 CO 0.04 0.30 0.00 0.34 0.00 0.00 0.00 179.25 179.94 2axd n PHE 27 N -3.66 0.00 -0.02 0.00 7.35 -0.80 -2.41 117.46 117.92 2axd n PHE 27 Ca -0.01 0.00 0.23 0.00 -0.76 0.00 0.00 57.45 56.91 2axd n PHE 27 Cb 0.37 -0.20 0.72 0.00 0.35 0.00 0.00 39.48 40.72 2axd n PHE 27 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 2axd h LYS 28 N 0.00 0.00 -0.23 -4.13 3.64 -1.07 0.28 116.57 115.06 2axd h LYS 28 Ca 0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 2axd h LYS 28 Cb 0.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2axd h LYS 28 CO 0.00 0.00 -0.16 0.93 -2.27 0.00 0.00 179.45 177.95 2axd h GLU 29 N 0.00 0.39 -1.99 1.90 5.08 -1.73 -1.87 114.58 116.36 2axd h GLU 29 Ca 0.29 -0.11 -0.11 0.00 -1.00 0.00 0.00 59.36 58.42 2axd h GLU 29 Cb 1.35 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.52 2axd h GLU 29 CO -0.00 0.55 -0.18 0.54 -1.00 0.00 0.00 179.01 178.92 2axd n ARG 30 N -4.20 1.54 0.00 2.33 5.12 0.97 -4.34 116.66 118.08 2axd n ARG 30 Ca -0.00 -0.57 0.08 0.00 -1.93 0.00 0.00 57.85 55.43 2axd n ARG 30 Cb 0.32 -1.53 0.48 0.00 -1.16 0.00 0.00 32.46 30.57 2axd n ARG 30 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 2axd n TYR 31 N 1.96 0.00 0.30 -1.55 4.19 -0.71 -0.65 117.16 120.70 2axd n TYR 31 Ca 0.23 0.00 0.13 0.00 3.31 0.00 0.00 57.90 61.57 2axd n TYR 31 Cb 0.71 0.00 0.60 0.00 0.49 0.00 0.00 39.34 41.15 2axd n TYR 31 CO 0.00 0.00 0.00 -2.95 0.91 0.00 0.00 176.86 174.82 2axd h ASN 32 N 0.00 0.00 -1.69 2.98 -1.07 -1.87 -3.44 115.58 110.49 2axd h ASN 32 Ca 0.00 0.00 -0.62 0.00 0.07 0.00 0.00 56.30 55.75 2axd h ASN 32 Cb 0.00 0.00 -0.13 0.00 -2.07 0.00 0.00 38.32 36.12 2axd h ASN 32 CO 0.00 0.00 -0.59 -0.04 0.07 0.00 0.00 177.43 176.87 2axd s MET 33 N -3.50 1.96 -0.07 4.14 -1.94 0.17 -5.12 119.30 114.94 2axd s MET 33 Ca 0.01 -2.13 -0.30 0.00 -1.71 0.00 0.00 55.69 51.56 2axd s MET 33 Cb 0.08 -1.52 -0.03 0.00 2.01 0.00 0.00 34.83 35.38 2axd s MET 33 CO 0.34 -0.12 1.13 -1.25 -0.01 0.00 0.00 175.02 175.11 2axd s PRO 34 N -3.75 4.38 -0.02 2.03 0.04 -1.26 -4.95 135.00 131.46 2axd s PRO 34 Ca 0.31 1.57 -0.02 0.00 0.04 0.00 0.00 61.00 62.90 2axd s PRO 34 Cb 0.09 -3.55 0.01 0.00 0.04 0.00 0.00 34.50 31.09 2axd s PRO 34 CO 0.16 -0.39 0.06 0.08 0.04 0.00 0.00 177.00 176.94 2axd s VAL 35 N 2.10 -0.00 -0.34 -0.36 1.01 -1.26 -5.02 120.40 116.52 2axd s VAL 35 Ca 0.53 0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.54 2axd s VAL 35 Cb -0.22 -0.09 0.10 0.00 0.00 0.00 0.00 36.38 36.17 2axd s VAL 35 CO 0.21 0.01 0.09 -0.63 0.00 0.00 0.00 175.10 174.77 2axd s ILE 36 N 0.11 1.60 -0.05 2.22 1.01 -1.26 -4.95 121.20 119.87 2axd s ILE 36 Ca -0.01 -1.97 0.30 0.00 0.00 0.00 0.00 60.65 58.97 2axd s ILE 36 Cb -0.01 -2.18 0.32 0.00 0.01 0.00 0.00 42.46 40.59 2axd s ILE 36 CO -0.00 -0.66 1.89 0.00 0.00 0.00 0.00 174.94 176.17 2axd h ALA 37 N 7.73 1.00 -0.17 9.38 0.00 -1.96 0.31 119.26 135.55 2axd h ALA 37 Ca -0.08 0.00 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 2axd h ALA 37 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2axd h ALA 37 CO 0.50 0.00 -0.70 1.49 0.00 0.00 0.00 179.25 180.54 2axd h GLU 38 N 0.00 0.72 -0.45 0.00 4.81 -1.99 -3.28 114.58 114.39 2axd h GLU 38 Ca 0.00 -0.54 -0.08 0.00 -0.13 0.00 0.00 59.36 58.61 2axd h GLU 38 Cb 0.25 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 2axd h GLU 38 CO 0.00 1.16 -0.03 0.00 -0.73 0.00 0.00 179.01 179.41 2axd h ALA 39 N 0.69 0.61 0.11 2.92 0.00 -1.34 0.26 119.26 122.51 2axd h ALA 39 Ca -0.03 -0.29 0.02 0.00 0.00 0.00 0.00 54.91 54.61 2axd h ALA 39 Cb 1.31 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2axd h ALA 39 CO 0.14 0.43 -0.24 -0.39 0.00 0.00 0.00 179.25 179.19 2axd h VAL 40 N 0.65 0.46 -0.37 0.00 -1.51 -1.72 0.83 116.25 114.60 2axd h VAL 40 Ca 0.12 0.00 0.01 0.00 -1.23 0.00 0.00 66.70 65.61 2axd h VAL 40 Cb 0.54 0.46 -0.02 0.00 -2.13 0.00 0.00 31.29 30.14 2axd h VAL 40 CO 0.03 0.00 0.24 -0.08 -1.23 0.00 0.00 177.57 176.53 2axd h GLU 41 N -0.44 0.44 0.00 5.19 4.81 -1.35 0.15 114.58 123.37 2axd h GLU 41 Ca 0.03 -0.03 -0.21 0.00 -0.13 0.00 0.00 59.36 59.02 2axd h GLU 41 Cb 0.47 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.72 2axd h GLU 41 CO -0.14 0.29 -1.11 0.07 -0.73 0.00 0.00 179.01 177.39 2axd h ARG 42 N 0.45 0.00 0.02 1.92 0.11 -0.32 -3.35 114.38 113.21 2axd h ARG 42 Ca 0.14 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.12 2axd h ARG 42 Cb 0.02 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.11 2axd h ARG 42 CO -0.03 0.82 -0.40 1.49 0.10 0.00 0.00 179.97 181.95 2axd h GLU 43 N 0.00 0.24 -6.24 0.08 4.81 0.12 -3.44 114.58 110.15 2axd h GLU 43 Ca -0.07 -0.28 -0.56 0.00 -0.13 0.00 0.00 59.36 58.32 2axd h GLU 43 Cb 1.77 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 31.20 2axd h GLU 43 CO 0.11 1.02 0.70 -0.65 -0.73 0.00 0.00 179.01 179.46 2axd s GLN 44 N -2.96 4.35 0.26 1.92 -1.52 0.42 -4.97 119.66 117.15 2axd s GLN 44 Ca -0.15 1.53 -0.30 0.00 -1.95 0.00 0.00 55.36 54.49 2axd s GLN 44 Cb 0.01 -3.59 -0.10 0.00 -0.22 0.00 0.00 33.01 29.11 2axd s GLN 44 CO 0.77 -0.47 1.32 -1.25 -0.25 0.00 0.00 175.29 175.42 2axd s PRO 45 N 2.47 4.37 0.58 2.91 0.04 -1.26 -4.86 135.00 139.25 2axd s PRO 45 Ca 0.51 2.15 0.30 0.00 0.04 0.00 0.00 61.00 64.00 2axd s PRO 45 Cb -0.21 -3.13 1.39 0.00 0.04 0.00 0.00 34.50 32.59 2axd s PRO 45 CO 0.17 -0.24 1.77 0.93 0.04 0.00 0.00 177.00 179.67 2axd h GLU 46 N 4.52 0.00 -0.35 4.56 4.39 -1.93 -0.58 114.58 125.19 2axd h GLU 46 Ca -0.47 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.34 2axd h GLU 46 Cb 1.22 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.85 2axd h GLU 46 CO 0.73 0.00 0.37 0.45 -1.16 0.00 0.00 179.01 179.39 2axd h HIS 47 N 0.00 0.00 0.00 4.33 3.86 -2.02 -1.26 115.15 120.05 2axd h HIS 47 Ca 0.33 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.52 2axd h HIS 47 Cb 1.71 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 30.13 2axd h HIS 47 CO 0.00 0.00 -0.42 1.47 0.86 0.00 0.00 177.93 179.84 2axd n LEU 48 N -3.79 2.14 -0.32 2.43 -0.00 -0.23 -4.86 117.00 112.38 2axd n LEU 48 Ca 0.06 -3.16 0.14 0.00 -0.00 0.00 0.00 56.01 53.05 2axd n LEU 48 Cb 0.53 -0.38 0.33 0.00 -0.00 0.00 0.00 43.42 43.90 2axd n LEU 48 CO 0.28 0.98 1.10 0.03 -0.00 0.00 0.00 177.39 179.79 2axd h ARG 49 N 0.62 0.50 -0.58 1.47 2.47 -1.29 0.23 114.38 117.80 2axd h ARG 49 Ca -0.03 -0.03 0.08 0.00 -1.26 0.00 0.00 59.98 58.74 2axd h ARG 49 Cb 1.15 -0.11 -0.06 0.00 -1.65 0.00 0.00 29.97 29.30 2axd h ARG 49 CO 0.01 0.33 0.23 1.03 0.56 0.00 0.00 179.97 182.14 2axd h SER 50 N 0.51 0.26 0.17 7.04 0.87 -1.89 0.42 113.55 120.93 2axd h SER 50 Ca 0.58 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 61.20 2axd h SER 50 Cb 1.07 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 2axd h SER 50 CO -0.48 0.17 -0.08 -0.25 -0.53 0.00 0.00 176.83 175.66 2axd h TRP 51 N 0.43 -0.21 -0.53 2.24 2.91 -0.97 0.77 115.95 120.61 2axd h TRP 51 Ca 0.28 -0.00 0.07 0.00 1.13 0.00 0.00 58.89 60.37 2axd h TRP 51 Cb 0.31 0.07 -0.06 0.00 -0.51 0.00 0.00 29.16 28.97 2axd h TRP 51 CO -0.15 0.02 0.20 0.35 -1.03 0.00 0.00 178.44 177.83 2axd h PHE 52 N -0.40 0.36 -0.10 2.65 3.57 -1.11 0.16 116.94 122.07 2axd h PHE 52 Ca -0.02 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2axd h PHE 52 Cb 0.32 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.97 2axd h PHE 52 CO -0.01 0.12 0.01 -0.09 -2.23 0.00 0.00 178.31 176.12 2axd h ARG 53 N 0.39 0.17 -0.23 1.11 9.65 -0.76 0.90 114.38 125.61 2axd h ARG 53 Ca 0.25 -0.05 0.05 0.00 -1.10 0.00 0.00 59.98 59.14 2axd h ARG 53 Cb 0.26 -0.02 -0.05 0.00 -1.39 0.00 0.00 29.97 28.77 2axd h ARG 53 CO -0.24 0.38 -0.10 1.49 2.80 0.00 0.00 179.97 184.29 2axd h GLU 54 N -0.07 -0.07 -0.85 0.20 4.81 -0.52 -1.29 114.58 116.79 2axd h GLU 54 Ca 0.03 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 2axd h GLU 54 Cb 0.29 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.65 2axd h GLU 54 CO 0.00 -0.05 0.46 0.00 -0.73 0.00 0.00 179.01 178.70 2axd h ARG 55 N -0.07 1.18 -0.68 1.92 2.47 -0.88 -2.18 114.38 116.14 2axd h ARG 55 Ca 0.12 -0.14 0.14 0.00 -1.26 0.00 0.00 59.98 58.84 2axd h ARG 55 Cb 0.25 -0.23 -0.10 0.00 -1.65 0.00 0.00 29.97 28.24 2axd h ARG 55 CO -0.27 0.87 0.14 1.25 0.56 0.00 0.00 179.97 182.51 2axd h LEU 56 N 1.19 -0.03 -0.33 3.04 7.12 0.34 0.30 115.31 126.95 2axd h LEU 56 Ca 0.30 0.14 0.03 0.00 0.13 0.00 0.00 57.88 58.48 2axd h LEU 56 Cb 0.03 0.19 -0.03 0.00 -0.53 0.00 0.00 40.66 40.32 2axd h LEU 56 CO -0.05 -0.03 0.13 0.40 -0.13 0.00 0.00 178.44 178.77 2axd h ILE 57 N 0.25 0.94 -1.01 4.05 5.03 -0.88 -0.35 117.51 125.54 2axd h ILE 57 Ca 0.37 -0.10 0.10 0.00 -0.12 0.00 0.00 64.86 65.11 2axd h ILE 57 Cb 0.60 0.62 -0.08 0.00 -3.03 0.00 0.00 36.82 34.93 2axd h ILE 57 CO -0.48 0.05 0.64 0.00 -0.68 0.00 0.00 178.15 177.69 2axd h ALA 58 N 1.20 1.47 0.00 1.87 0.00 -0.77 0.93 119.26 123.96 2axd h ALA 58 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 2axd h ALA 58 Cb 0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2axd h ALA 58 CO -0.13 0.31 -0.19 0.45 0.00 0.00 0.00 179.25 179.70 2axd h HIS 59 N 1.07 0.00 -0.39 0.00 3.86 0.59 -0.72 115.15 119.56 2axd h HIS 59 Ca 0.47 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.61 2axd h HIS 59 Cb 0.36 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.82 2axd h HIS 59 CO -0.00 0.19 -0.04 0.00 0.86 0.00 0.00 177.93 178.93 2axd h ARG 60 N 0.00 0.72 -0.03 2.45 2.47 0.83 0.30 114.38 121.11 2axd h ARG 60 Ca -0.00 -0.25 0.00 0.00 -1.26 0.00 0.00 59.98 58.47 2axd h ARG 60 Cb 0.56 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.83 2axd h ARG 60 CO 0.02 0.84 0.02 -0.07 0.56 0.00 0.00 179.97 181.34 2axd h LEU 61 N 0.53 0.03 -1.09 3.04 4.07 -1.10 -0.57 115.31 120.23 2axd h LEU 61 Ca 0.11 -0.03 0.15 0.00 0.08 0.00 0.00 57.88 58.18 2axd h LEU 61 Cb 0.54 -0.01 -0.09 0.00 1.08 0.00 0.00 40.66 42.18 2axd h LEU 61 CO 0.03 0.05 0.62 0.00 -1.08 0.00 0.00 178.44 178.06 2axd h ALA 62 N 0.98 1.66 -0.57 1.53 0.00 -1.02 -0.31 119.26 121.52 2axd h ALA 62 Ca 0.01 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2axd h ALA 62 Cb 0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2axd h ALA 62 CO -0.00 0.06 -0.01 0.66 0.00 0.00 0.00 179.25 179.96 2axd h SER 63 N 0.85 0.98 -0.13 0.00 4.64 0.62 0.79 113.55 121.31 2axd h SER 63 Ca 0.51 -0.28 -0.19 0.00 -0.47 0.00 0.00 61.79 61.36 2axd h SER 63 Cb 0.68 -0.26 0.01 0.00 -0.31 0.00 0.00 62.40 62.52 2axd h SER 63 CO -0.28 1.04 -0.67 1.62 -0.87 0.00 0.00 176.83 177.67 2axd h VAL 64 N 0.92 1.32 -0.19 0.95 3.04 -0.19 -3.07 116.25 119.03 2axd h VAL 64 Ca 0.16 -1.92 0.00 0.00 -1.01 0.00 0.00 66.70 63.93 2axd h VAL 64 Cb 0.55 2.09 0.00 0.00 -2.01 0.00 0.00 31.29 31.92 2axd h VAL 64 CO 0.03 0.60 0.00 -0.46 -1.01 0.00 0.00 177.57 176.73 2axd n ASN 65 N -4.06 1.37 0.25 3.17 2.04 -0.22 -4.16 115.26 113.65 2axd n ASN 65 Ca -0.08 -2.06 0.08 0.00 -0.44 0.00 0.00 54.58 52.07 2axd n ASN 65 Cb 0.69 -0.24 0.62 0.00 -2.53 0.00 0.00 39.78 38.32 2axd n ASN 65 CO 0.00 0.00 0.00 0.17 -0.44 0.00 0.00 177.26 176.99 2axd h LEU 66 N 1.13 0.00 -6.67 -4.53 -0.00 -0.74 -3.00 115.31 101.50 2axd h LEU 66 Ca 0.00 0.00 -0.68 0.00 -0.00 0.00 0.00 57.88 57.20 2axd h LEU 66 Cb 0.43 0.00 -0.37 0.00 -0.00 0.00 0.00 40.66 40.72 2axd h LEU 66 CO 0.03 0.05 -0.09 -0.24 -0.00 0.00 0.00 178.44 178.19 2axd n SER 67 N -4.45 4.60 0.00 0.17 2.88 -1.26 -4.94 113.62 110.62 2axd n SER 67 Ca -0.03 -3.36 0.00 0.00 -1.33 0.00 0.00 58.87 54.15 2axd n SER 67 Cb 0.13 -0.92 0.00 0.00 -0.75 0.00 0.00 64.21 62.66 2axd n SER 67 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2axd n ARG 68 N 1.32 0.00 0.00 -1.46 1.74 -1.14 -5.06 116.66 112.07 2axd n ARG 68 Ca 0.27 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.35 2axd n ARG 68 Cb 0.38 -0.39 0.00 0.00 -1.02 0.00 0.00 32.46 31.43 2axd n ARG 68 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2axd n LEU 69 N -0.06 0.00 0.00 0.55 7.94 -1.26 -5.16 117.00 119.00 2axd n LEU 69 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2axd n LEU 69 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 2axd n LEU 69 CO 0.00 0.00 0.00 -2.65 -1.11 0.00 0.00 177.39 173.63 2axd n PRO 70 N 0.00 -0.52 0.00 1.96 -0.02 -1.26 -4.95 135.00 130.21 2axd n PRO 70 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.61 2axd n PRO 70 Cb 0.00 0.00 0.46 0.00 -0.02 0.00 0.00 33.50 33.94 2axd n PRO 70 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2axd n TYR 71 N -2.12 0.00 -1.88 6.00 0.18 -1.26 -5.02 117.16 113.05 2axd n TYR 71 Ca 0.00 0.00 -0.01 0.00 1.88 0.00 0.00 57.90 59.77 2axd n TYR 71 Cb 0.00 -0.30 -0.01 0.00 -0.38 0.00 0.00 39.34 38.65 2axd n TYR 71 CO 0.00 0.00 0.00 -1.91 -2.08 0.00 0.00 176.86 172.87 2axd n GLU 72 N -1.31 -3.02 -2.56 -3.48 2.13 -1.26 -4.98 120.64 106.15 2axd n GLU 72 Ca 0.09 2.41 -0.40 0.00 0.66 0.00 0.00 57.16 59.92 2axd n GLU 72 Cb 0.32 -3.12 -0.05 0.00 0.27 0.00 0.00 31.44 28.87 2axd n GLU 72 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 2axd s PRO 73 N -1.10 4.67 -0.39 5.31 0.04 -1.26 -4.96 135.00 137.31 2axd s PRO 73 Ca -0.04 1.68 0.10 0.00 0.04 0.00 0.00 61.00 62.79 2axd s PRO 73 Cb 0.00 -3.16 0.39 0.00 0.04 0.00 0.00 34.50 31.77 2axd s PRO 73 CO 0.11 0.28 1.21 0.36 0.04 0.00 0.00 177.00 179.00 2axd n LYS 74 N 1.18 1.15 -2.44 4.56 -0.00 -1.26 -5.12 118.16 116.22 2axd n LYS 74 Ca -0.01 -2.20 -0.05 0.00 -0.00 0.00 0.00 58.31 56.05 2axd n LYS 74 Cb 0.46 -0.51 -0.01 0.00 -0.00 0.00 0.00 35.03 34.96 2axd n LYS 74 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 2axd n LEU 75 N -0.30 0.00 -0.34 -5.58 -0.00 -1.26 -5.34 117.00 104.18 2axd n LEU 75 Ca 0.02 -0.55 0.04 0.00 -0.00 0.00 0.00 56.01 55.53 2axd n LEU 75 Cb 0.81 0.11 0.04 0.00 -0.00 0.00 0.00 43.42 44.38 2axd n LEU 75 CO 0.02 -0.08 0.39 1.17 -0.00 0.00 0.00 177.39 178.89