#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 0.00 -3.97 -0.89 4.77 -1.26 -5.18 117.00 110.47 2axd n LEU 2 Ca 0.00 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.99 2axd n LEU 2 Cb 0.00 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.11 2axd n LEU 2 CO 0.00 0.00 1.01 -0.54 -1.33 0.00 0.00 177.39 176.53 2axd s LYS 3 N 0.00 0.69 0.39 3.23 1.02 -1.26 -5.10 119.74 118.71 2axd s LYS 3 Ca 0.00 -0.45 0.00 0.00 0.02 0.00 0.00 55.97 55.54 2axd s LYS 3 Cb 0.00 0.19 0.00 0.00 -0.52 0.00 0.00 37.83 37.50 2axd s LYS 3 CO 0.00 -0.32 0.00 -1.71 -0.92 0.00 0.00 175.35 172.40 2axd n ASN 4 N -1.15 -3.26 0.00 2.83 2.85 -1.26 -4.98 115.26 110.30 2axd n ASN 4 Ca 0.02 0.73 0.00 0.00 -0.11 0.00 0.00 54.58 55.22 2axd n ASN 4 Cb 0.59 3.11 0.00 0.00 1.24 0.00 0.00 39.78 44.72 2axd n ASN 4 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2axd n LEU 5 N -3.30 0.00 0.14 1.20 -0.00 -1.26 0.61 117.00 114.39 2axd n LEU 5 Ca 0.00 0.24 0.13 0.00 -0.00 0.00 0.00 56.01 56.38 2axd n LEU 5 Cb 0.00 -0.07 0.40 0.00 -0.00 0.00 0.00 43.42 43.75 2axd n LEU 5 CO 0.00 -0.07 0.88 0.00 -0.00 0.00 0.00 177.39 178.20 2axd h ALA 6 N -0.57 1.00 0.00 1.96 0.00 -2.03 -3.21 119.26 116.41 2axd h ALA 6 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2axd h ALA 6 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2axd h ALA 6 CO 0.00 0.00 -1.02 0.87 0.00 0.00 0.00 179.25 179.10 2axd h LYS 7 N 0.00 0.00 -1.94 0.00 1.79 -0.75 -3.43 116.57 112.24 2axd h LYS 7 Ca 0.00 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.14 2axd h LYS 7 Cb 0.70 0.00 -0.31 0.00 -1.58 0.00 0.00 32.23 31.04 2axd h LYS 7 CO 0.00 0.17 -0.65 -0.51 -1.08 0.00 0.00 179.45 177.38 2axd s LEU 8 N -5.73 -0.21 0.00 2.94 1.02 0.20 -4.86 118.68 112.04 2axd s LEU 8 Ca -0.00 -1.25 0.00 0.00 0.02 0.00 0.00 54.13 52.89 2axd s LEU 8 Cb 0.09 0.64 0.00 0.00 0.02 0.00 0.00 46.19 46.94 2axd s LEU 8 CO 0.78 -0.30 0.00 -0.67 0.02 0.00 0.00 176.35 176.19 2axd n ASP 9 N 4.60 0.00 -0.24 2.29 2.03 -1.25 -4.45 116.55 119.53 2axd n ASP 9 Ca 0.07 0.00 0.04 0.00 0.52 0.00 0.00 54.79 55.42 2axd n ASP 9 Cb 0.46 0.00 0.16 0.00 -0.72 0.00 0.00 41.12 41.03 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 0.32 -0.09 -0.67 4.15 -1.95 0.60 115.11 117.46 2axd h GLN 10 Ca 0.00 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.44 2axd h GLN 10 Cb 0.00 -0.07 -0.06 0.00 0.21 0.00 0.00 27.48 27.56 2axd h GLN 10 CO 0.00 0.21 -0.40 1.15 -1.93 0.00 0.00 178.83 177.86 2axd h THR 11 N 0.33 0.17 -0.33 2.39 2.02 -1.93 0.13 112.91 115.69 2axd h THR 11 Ca 0.39 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.54 2axd h THR 11 Cb 0.62 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 2axd h THR 11 CO -0.44 0.00 0.08 1.05 0.37 0.00 0.00 175.52 176.58 2axd h GLU 12 N -0.50 0.53 -0.26 6.66 -0.00 -1.31 -1.80 114.58 117.90 2axd h GLU 12 Ca 0.07 -0.13 -0.18 0.00 -0.00 0.00 0.00 59.36 59.12 2axd h GLU 12 Cb 0.62 -0.07 -0.00 0.00 -0.00 0.00 0.00 28.75 29.30 2axd h GLU 12 CO -0.36 0.59 -0.55 1.98 -0.00 0.00 0.00 179.01 180.67 2axd h MET 13 N 0.38 0.79 -0.59 1.06 4.05 -0.92 -2.09 114.93 117.61 2axd h MET 13 Ca 0.10 -0.50 0.06 0.00 -0.28 0.00 0.00 59.70 59.09 2axd h MET 13 Cb 0.29 0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.10 2axd h MET 13 CO 0.00 1.13 0.30 0.22 0.23 0.00 0.00 176.91 178.79 2axd h ASP 14 N 0.60 0.42 -0.46 1.39 -0.00 -0.62 0.23 116.42 117.98 2axd h ASP 14 Ca 0.01 0.04 0.07 0.00 -0.00 0.00 0.00 57.03 57.15 2axd h ASP 14 Cb 1.14 -0.04 -0.03 0.00 -0.00 0.00 0.00 39.33 40.40 2axd h ASP 14 CO 0.12 0.27 0.31 0.11 -0.00 0.00 0.00 179.24 180.05 2axd h LYS 15 N 0.56 0.34 0.10 0.28 6.56 -0.94 -1.87 116.57 121.60 2axd h LYS 15 Ca 0.27 -0.02 -0.29 0.00 -1.06 0.00 0.00 60.65 59.54 2axd h LYS 15 Cb 0.20 -0.08 0.03 0.00 -0.57 0.00 0.00 32.23 31.81 2axd h LYS 15 CO -0.19 0.22 -1.22 0.28 -2.06 0.00 0.00 179.45 176.48 2axd h VAL 16 N 0.35 1.29 -0.40 0.50 2.07 -0.36 -3.31 116.25 116.38 2axd h VAL 16 Ca 0.20 -2.44 0.08 0.00 0.82 0.00 0.00 66.70 65.35 2axd h VAL 16 Cb 0.35 2.65 -0.07 0.00 -1.52 0.00 0.00 31.29 32.71 2axd h VAL 16 CO -0.05 0.75 -0.03 -1.13 0.02 0.00 0.00 177.57 177.13 2axd h ASN 17 N 0.29 -0.22 0.20 0.57 -1.24 0.19 0.25 115.58 115.63 2axd h ASN 17 Ca -0.18 0.10 -0.00 0.00 0.71 0.00 0.00 56.30 56.93 2axd h ASN 17 Cb 1.89 0.19 -0.00 0.00 0.73 0.00 0.00 38.32 41.12 2axd h ASN 17 CO 0.23 -0.07 -0.01 0.58 -1.29 0.00 0.00 177.43 176.87 2axd h VAL 18 N 0.08 0.12 0.00 2.57 2.07 -1.61 -1.90 116.25 117.58 2axd h VAL 18 Ca 0.20 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 2axd h VAL 18 Cb 0.29 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2axd h VAL 18 CO -0.35 0.01 -0.00 -0.78 0.02 0.00 0.00 177.57 176.47 2axd h ASP 19 N 0.00 -0.00 -0.57 0.57 3.58 -0.58 -0.74 116.42 118.67 2axd h ASP 19 Ca -0.00 -0.30 -0.03 0.00 0.42 0.00 0.00 57.03 57.12 2axd h ASP 19 Cb 0.12 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.14 2axd h ASP 19 CO 0.00 0.30 0.24 -0.07 -2.88 0.00 0.00 179.24 176.83 2axd h LEU 20 N -0.30 0.77 -0.23 2.28 4.07 -1.11 0.25 115.31 121.04 2axd h LEU 20 Ca -0.00 -0.16 0.04 0.00 0.08 0.00 0.00 57.88 57.84 2axd h LEU 20 Cb 0.30 -0.20 -0.04 0.00 1.08 0.00 0.00 40.66 41.80 2axd h LEU 20 CO 0.00 0.72 -0.04 0.00 -1.08 0.00 0.00 178.44 178.05 2axd h ALA 21 N 1.08 0.17 -0.60 1.53 0.00 -1.37 0.20 119.26 120.26 2axd h ALA 21 Ca 0.19 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.21 2axd h ALA 21 Cb 0.18 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2axd h ALA 21 CO -0.02 -0.46 0.36 0.00 0.00 0.00 0.00 179.25 179.13 2axd h ALA 22 N 1.22 0.78 -0.90 0.00 0.00 -0.57 -0.94 119.26 118.86 2axd h ALA 22 Ca 0.11 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.06 2axd h ALA 22 Cb 0.16 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.73 2axd h ALA 22 CO -0.22 0.07 0.57 0.00 0.00 0.00 0.00 179.25 179.68 2axd h ALA 23 N 1.28 1.20 -0.89 0.00 0.00 -0.59 -0.56 119.26 119.70 2axd h ALA 23 Ca 0.25 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.25 2axd h ALA 23 Cb 0.06 -0.29 -0.08 0.00 0.00 0.00 0.00 17.79 17.47 2axd h ALA 23 CO -0.12 0.40 0.51 0.78 0.00 0.00 0.00 179.25 180.82 2axd h GLY 24 N 1.10 1.43 2.00 0.00 0.00 0.32 0.44 103.07 108.37 2axd h GLY 24 Ca 0.37 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.35 2axd h GLY 24 CO -0.13 0.07 -0.10 -2.08 0.00 0.00 0.00 176.54 174.30 2axd h VAL 25 N 0.78 0.20 0.00 4.60 2.07 -0.10 -1.81 116.25 121.99 2axd h VAL 25 Ca 0.45 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 2axd h VAL 25 Cb 0.52 1.82 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 2axd h VAL 25 CO -0.30 0.09 -0.08 0.00 0.02 0.00 0.00 177.57 177.31 2axd h ALA 26 N 1.90 1.16 0.00 1.67 0.00 0.33 -0.21 119.26 124.12 2axd h ALA 26 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2axd h ALA 26 Cb 0.82 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2axd h ALA 26 CO 0.01 0.10 0.00 0.34 0.00 0.00 0.00 179.25 179.70 2axd n PHE 27 N -3.42 0.00 0.24 0.00 7.35 -0.68 -1.98 117.46 118.97 2axd n PHE 27 Ca -0.01 0.00 0.18 0.00 -0.76 0.00 0.00 57.45 56.85 2axd n PHE 27 Cb 0.23 -0.03 0.88 0.00 0.35 0.00 0.00 39.48 40.91 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 -0.05 -4.13 3.11 -1.18 0.33 116.57 114.65 2axd h LYS 28 Ca 0.00 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 2axd h LYS 28 Cb 0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 32.23 31.23 2axd h LYS 28 CO 0.00 0.00 -0.05 0.93 -2.81 0.00 0.00 179.45 177.52 2axd h GLU 29 N 0.00 0.07 -0.14 1.90 4.39 -1.66 -1.18 114.58 117.97 2axd h GLU 29 Ca 0.07 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2axd h GLU 29 Cb 0.49 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 2axd h GLU 29 CO -0.00 0.13 0.00 0.54 -1.16 0.00 0.00 179.01 178.52 2axd n ARG 30 N -4.44 1.51 0.24 2.33 5.12 0.11 -4.58 116.66 116.96 2axd n ARG 30 Ca -0.02 -0.77 0.04 0.00 -1.93 0.00 0.00 57.85 55.17 2axd n ARG 30 Cb 0.16 -1.33 0.20 0.00 -1.16 0.00 0.00 32.46 30.33 2axd n ARG 30 CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 2axd h TYR 31 N 1.50 0.00 -0.69 -1.55 3.20 -1.12 0.17 116.97 118.48 2axd h TYR 31 Ca 0.00 0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.07 2axd h TYR 31 Cb 0.33 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 2axd h TYR 31 CO 0.09 0.00 0.67 -0.91 -1.64 0.00 0.00 178.16 176.37 2axd h ASN 32 N 0.00 0.00 -2.25 -2.11 4.21 -1.84 -3.39 115.58 110.19 2axd h ASN 32 Ca 0.00 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.96 2axd h ASN 32 Cb 1.34 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 38.45 2axd h ASN 32 CO 0.00 0.00 -0.63 -0.04 -1.29 0.00 0.00 177.43 175.47 2axd s MET 33 N -4.65 2.41 0.24 0.81 -1.94 0.58 -5.10 119.30 111.65 2axd s MET 33 Ca -0.04 -1.33 -0.31 0.00 -1.71 0.00 0.00 55.69 52.30 2axd s MET 33 Cb 0.17 -2.24 -0.11 0.00 2.01 0.00 0.00 34.83 34.65 2axd s MET 33 CO 0.59 0.38 1.63 -2.14 -0.01 0.00 0.00 175.02 175.47 2axd s PRO 34 N -3.65 4.14 -0.05 2.03 0.02 -1.26 -4.93 135.00 131.30 2axd s PRO 34 Ca 0.31 2.55 -0.02 0.00 0.02 0.00 0.00 61.00 63.86 2axd s PRO 34 Cb -0.07 -3.06 0.04 0.00 0.02 0.00 0.00 34.50 31.42 2axd s PRO 34 CO 0.21 -0.66 0.11 0.08 -0.33 0.00 0.00 177.00 176.40 2axd s VAL 35 N 0.59 -0.07 -1.19 3.83 1.01 -1.26 -4.98 120.40 118.33 2axd s VAL 35 Ca 0.68 0.21 -0.16 0.00 0.00 0.00 0.00 61.98 62.71 2axd s VAL 35 Cb -0.48 -0.19 0.12 0.00 0.00 0.00 0.00 36.38 35.84 2axd s VAL 35 CO 0.39 0.09 1.50 -0.63 0.00 0.00 0.00 175.10 176.45 2axd s ILE 36 N 1.25 4.61 0.25 2.22 1.01 -1.26 -4.81 121.20 124.47 2axd s ILE 36 Ca -0.08 -2.13 -0.06 0.00 0.00 0.00 0.00 60.65 58.38 2axd s ILE 36 Cb -0.12 -5.00 0.25 0.00 0.01 0.00 0.00 42.46 37.59 2axd s ILE 36 CO -0.05 -1.77 1.92 0.00 0.00 0.00 0.00 174.94 175.04 2axd h ALA 37 N 7.69 1.26 -0.75 9.38 0.00 -1.98 -1.41 119.26 133.45 2axd h ALA 37 Ca 0.33 -0.06 0.18 0.00 0.00 0.00 0.00 54.91 55.37 2axd h ALA 37 Cb 0.90 -0.38 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2axd h ALA 37 CO 1.31 0.59 0.52 1.05 0.00 0.00 0.00 179.25 182.72 2axd h GLU 38 N 1.29 0.20 0.00 0.00 4.11 -2.03 0.94 114.58 119.09 2axd h GLU 38 Ca 0.37 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.77 2axd h GLU 38 Cb -0.10 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 2axd h GLU 38 CO -0.09 0.13 -0.07 0.00 0.07 0.00 0.00 179.01 179.05 2axd h ALA 39 N 1.65 1.44 -0.92 1.06 0.00 -1.66 -1.82 119.26 119.01 2axd h ALA 39 Ca 0.37 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.33 2axd h ALA 39 Cb 1.14 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.85 2axd h ALA 39 CO -0.07 0.09 0.59 -0.24 0.00 0.00 0.00 179.25 179.61 2axd h VAL 40 N 0.00 0.91 0.14 0.00 3.04 -0.89 0.29 116.25 119.74 2axd h VAL 40 Ca -0.00 -0.29 -0.25 0.00 -1.01 0.00 0.00 66.70 65.15 2axd h VAL 40 Cb 0.18 -0.01 0.01 0.00 -2.01 0.00 0.00 31.29 29.46 2axd h VAL 40 CO 0.01 0.16 -1.19 -0.08 -1.01 0.00 0.00 177.57 175.45 2axd h GLU 41 N 0.85 0.30 0.00 4.17 4.81 -1.49 -3.24 114.58 119.98 2axd h GLU 41 Ca 0.45 -0.52 -0.08 0.00 -0.13 0.00 0.00 59.36 59.08 2axd h GLU 41 Cb 0.53 0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2axd h GLU 41 CO -0.21 1.25 -0.36 0.00 -0.73 0.00 0.00 179.01 178.96 2axd h ARG 42 N -0.27 0.00 -0.22 1.92 3.08 -1.10 -1.29 114.38 116.50 2axd h ARG 42 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.81 2axd h ARG 42 Cb 1.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.82 2axd h ARG 42 CO 0.12 0.36 0.00 0.39 -1.07 0.00 0.00 179.97 179.77 2axd n GLU 43 N -4.10 1.57 -3.63 0.04 4.71 0.97 -4.60 120.64 115.59 2axd n GLU 43 Ca -0.02 -0.87 -0.40 0.00 -0.01 0.00 0.00 57.16 55.86 2axd n GLU 43 Cb 0.40 -1.23 -0.11 0.00 -1.01 0.00 0.00 31.44 29.48 2axd n GLU 43 CO 0.00 0.00 0.00 -1.14 0.09 0.00 0.00 177.13 176.08 2axd s GLN 44 N -1.71 2.74 0.06 3.49 0.74 -0.49 -4.86 119.66 119.63 2axd s GLN 44 Ca 0.20 -1.17 -0.31 0.00 0.05 0.00 0.00 55.36 54.13 2axd s GLN 44 Cb 0.10 -3.69 -0.07 0.00 1.10 0.00 0.00 33.01 30.46 2axd s GLN 44 CO 0.14 -0.74 1.37 -1.25 -0.55 0.00 0.00 175.29 174.27 2axd s PRO 45 N 1.50 4.32 0.43 1.67 0.04 -1.26 -4.88 135.00 136.82 2axd s PRO 45 Ca 0.01 1.99 0.22 0.00 0.04 0.00 0.00 61.00 63.27 2axd s PRO 45 Cb -0.20 -3.41 1.20 0.00 0.04 0.00 0.00 34.50 32.14 2axd s PRO 45 CO 0.05 -0.48 1.80 0.93 0.04 0.00 0.00 177.00 179.34 2axd h GLU 46 N 7.28 0.29 -1.75 4.56 5.08 -1.96 -0.26 114.58 127.81 2axd h GLU 46 Ca -0.40 -0.02 0.51 0.00 -1.00 0.00 0.00 59.36 58.45 2axd h GLU 46 Cb 1.20 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 30.31 2axd h GLU 46 CO 0.88 0.19 1.28 0.45 -1.00 0.00 0.00 179.01 180.81 2axd h HIS 47 N 0.30 0.00 -1.67 4.33 3.86 -2.05 -1.54 115.15 118.38 2axd h HIS 47 Ca 0.56 0.00 -0.44 0.00 -1.16 0.00 0.00 60.37 59.33 2axd h HIS 47 Cb 1.60 0.00 -0.36 0.00 1.06 0.00 0.00 27.41 29.71 2axd h HIS 47 CO -0.00 0.00 -1.08 1.47 0.86 0.00 0.00 177.93 179.18 2axd n LEU 48 N -3.96 0.31 0.27 2.43 -0.00 -0.11 -4.96 117.00 110.97 2axd n LEU 48 Ca 0.39 -4.80 0.09 0.00 -0.00 0.00 0.00 56.01 51.70 2axd n LEU 48 Cb 1.82 0.76 0.69 0.00 -0.00 0.00 0.00 43.42 46.68 2axd n LEU 48 CO 0.43 2.26 1.08 -0.09 -0.00 0.00 0.00 177.39 181.06 2axd h ARG 49 N 3.00 0.00 0.00 1.47 9.65 -1.33 -0.58 114.38 126.59 2axd h ARG 49 Ca 0.07 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.86 2axd h ARG 49 Cb 0.99 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.56 2axd h ARG 49 CO 0.44 0.00 -0.42 1.03 2.80 0.00 0.00 179.97 183.82 2axd h SER 50 N 0.00 0.00 0.16 -3.80 0.87 -1.92 -3.26 113.55 105.61 2axd h SER 50 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2axd h SER 50 Cb 0.01 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 2axd h SER 50 CO -0.00 0.42 -0.08 -0.25 -0.53 0.00 0.00 176.83 176.39 2axd h TRP 51 N 0.00 -0.20 -0.48 2.24 -0.00 -1.49 0.17 115.95 116.19 2axd h TRP 51 Ca -0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.88 2axd h TRP 51 Cb 1.00 0.07 -0.02 0.00 -0.00 0.00 0.00 29.16 30.21 2axd h TRP 51 CO 0.00 0.14 0.28 0.35 -0.00 0.00 0.00 178.44 179.21 2axd h PHE 52 N -0.57 0.65 0.38 2.65 3.04 -1.70 -0.03 116.94 121.35 2axd h PHE 52 Ca -0.02 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 61.90 2axd h PHE 52 Cb 0.43 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.74 2axd h PHE 52 CO 0.04 0.46 -0.18 -0.09 -2.02 0.00 0.00 178.31 176.52 2axd h ARG 53 N 0.64 -0.49 -0.21 1.11 9.65 -1.54 0.87 114.38 124.41 2axd h ARG 53 Ca 0.17 0.03 0.04 0.00 -1.10 0.00 0.00 59.98 59.12 2axd h ARG 53 Cb 0.02 0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.67 2axd h ARG 53 CO -0.03 -0.31 -0.01 1.49 2.80 0.00 0.00 179.97 183.91 2axd h GLU 54 N -0.54 0.05 0.00 0.20 4.81 -0.66 -2.32 114.58 116.12 2axd h GLU 54 Ca -0.05 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 2axd h GLU 54 Cb 0.41 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 2axd h GLU 54 CO 0.09 0.03 -0.14 0.07 -0.73 0.00 0.00 179.01 178.33 2axd h ARG 55 N 0.05 0.00 -0.74 1.92 0.11 -0.69 -2.25 114.38 112.78 2axd h ARG 55 Ca 0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.18 2axd h ARG 55 Cb 0.13 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.18 2axd h ARG 55 CO -0.18 0.14 0.48 1.37 0.10 0.00 0.00 179.97 181.88 2axd h LEU 56 N 0.00 0.86 -1.00 0.08 8.10 -0.24 0.19 115.31 123.29 2axd h LEU 56 Ca -0.00 -0.03 -0.06 0.00 0.11 0.00 0.00 57.88 57.90 2axd h LEU 56 Cb 0.46 -0.21 -0.02 0.00 -0.44 0.00 0.00 40.66 40.44 2axd h LEU 56 CO 0.02 0.63 0.08 0.40 -4.11 0.00 0.00 178.44 175.45 2axd h ILE 57 N 1.01 1.23 -0.42 0.15 2.04 -1.44 -0.27 117.51 119.82 2axd h ILE 57 Ca 0.27 -0.88 -0.15 0.00 1.00 0.00 0.00 64.86 65.11 2axd h ILE 57 Cb -0.10 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 2axd h ILE 57 CO -0.06 0.32 -0.32 0.00 0.00 0.00 0.00 178.15 178.09 2axd h ALA 58 N 1.32 0.60 -0.24 1.87 0.00 -1.16 -2.79 119.26 118.86 2axd h ALA 58 Ca 0.16 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 2axd h ALA 58 Cb 0.35 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2axd h ALA 58 CO 0.01 0.66 -0.09 0.45 0.00 0.00 0.00 179.25 180.28 2axd h HIS 59 N 0.79 0.56 -0.71 0.00 3.86 -0.07 0.02 115.15 119.61 2axd h HIS 59 Ca 0.08 -0.13 0.02 0.00 -1.16 0.00 0.00 60.37 59.17 2axd h HIS 59 Cb 0.91 -0.13 -0.04 0.00 1.06 0.00 0.00 27.41 29.21 2axd h HIS 59 CO 0.06 0.74 0.47 0.07 0.86 0.00 0.00 177.93 180.13 2axd h ARG 60 N 0.22 0.90 -0.58 2.45 0.11 -1.14 -0.50 114.38 115.84 2axd h ARG 60 Ca 0.06 -0.05 0.02 0.00 0.10 0.00 0.00 59.98 60.10 2axd h ARG 60 Cb 0.58 -0.20 -0.03 0.00 1.11 0.00 0.00 29.97 31.42 2axd h ARG 60 CO 0.03 0.59 0.37 1.25 0.10 0.00 0.00 179.97 182.31 2axd h LEU 61 N 0.92 0.61 -0.11 0.08 7.12 -1.17 -0.06 115.31 122.70 2axd h LEU 61 Ca 0.27 -0.00 0.03 0.00 0.13 0.00 0.00 57.88 58.31 2axd h LEU 61 Cb -0.05 -0.14 -0.03 0.00 -0.53 0.00 0.00 40.66 39.92 2axd h LEU 61 CO -0.07 0.43 -0.08 0.00 -0.13 0.00 0.00 178.44 178.59 2axd h ALA 62 N 1.24 0.00 -0.38 1.25 0.00 0.50 0.37 119.26 122.23 2axd h ALA 62 Ca 0.23 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.26 2axd h ALA 62 Cb -0.01 0.18 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 2axd h ALA 62 CO -0.08 -0.54 -0.12 0.77 0.00 0.00 0.00 179.25 179.28 2axd h SER 63 N -0.10 -0.43 -0.96 0.00 0.02 -0.73 0.37 113.55 111.73 2axd h SER 63 Ca 0.07 0.12 0.10 0.00 -0.84 0.00 0.00 61.79 61.25 2axd h SER 63 Cb 0.20 0.27 -0.07 0.00 0.14 0.00 0.00 62.40 62.93 2axd h SER 63 CO -0.17 -0.15 0.61 0.58 -1.14 0.00 0.00 176.83 176.56 2axd h VAL 64 N -0.03 0.96 -0.04 2.27 2.07 -0.45 -1.32 116.25 119.71 2axd h VAL 64 Ca 0.19 -0.33 -0.12 0.00 0.82 0.00 0.00 66.70 67.25 2axd h VAL 64 Cb 0.32 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 2axd h VAL 64 CO -0.41 0.18 -0.53 0.78 0.02 0.00 0.00 177.57 177.60 2axd h ASN 65 N 0.97 0.12 0.00 0.57 -0.26 0.51 -3.46 115.58 114.02 2axd h ASN 65 Ca 0.46 -0.06 0.00 0.00 -0.56 0.00 0.00 56.30 56.14 2axd h ASN 65 Cb 0.42 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.65 2axd h ASN 65 CO -0.22 0.63 0.00 0.00 -1.06 0.00 0.00 177.43 176.78 2axd n LEU 66 N -3.91 0.00 -1.30 1.61 -0.00 -0.34 -4.91 117.00 108.15 2axd n LEU 66 Ca -0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 55.98 2axd n LEU 66 Cb 0.55 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.98 2axd n LEU 66 CO 0.42 0.00 0.01 -0.24 -0.00 0.00 0.00 177.39 177.58 2axd n SER 67 N 0.00 -2.09 -1.93 1.45 2.88 0.12 -4.90 113.62 109.15 2axd n SER 67 Ca 0.00 -0.05 -0.13 0.00 -1.33 0.00 0.00 58.87 57.36 2axd n SER 67 Cb 0.00 -0.86 -0.03 0.00 -0.75 0.00 0.00 64.21 62.57 2axd n SER 67 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 2axd n ARG 68 N -1.34 1.75 -3.59 -1.46 1.85 -1.26 -4.87 116.66 107.73 2axd n ARG 68 Ca -0.02 -1.20 -0.16 0.00 -1.00 0.00 0.00 57.85 55.47 2axd n ARG 68 Cb 0.51 -1.63 0.01 0.00 -1.05 0.00 0.00 32.46 30.30 2axd n ARG 68 CO 0.00 0.00 0.00 1.47 -0.01 0.00 0.00 177.63 179.09 2axd n LEU 69 N 1.17 -0.25 -4.79 2.89 -0.00 -1.26 -4.88 117.00 109.87 2axd n LEU 69 Ca 0.28 -0.48 -0.30 0.00 -0.00 0.00 0.00 56.01 55.52 2axd n LEU 69 Cb 0.62 -0.62 0.10 0.00 -0.00 0.00 0.00 43.42 43.52 2axd n LEU 69 CO 0.22 0.28 0.71 -2.16 -0.00 0.00 0.00 177.39 176.43 2axd s PRO 70 N -5.06 1.83 0.21 1.47 0.04 -1.26 -5.08 135.00 127.14 2axd s PRO 70 Ca 0.13 0.60 0.10 0.00 0.04 0.00 0.00 61.00 61.87 2axd s PRO 70 Cb -0.07 -1.89 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 2axd s PRO 70 CO 0.38 -1.79 -0.20 -0.47 0.04 0.00 0.00 177.00 174.95 2axd s TYR 71 N -3.15 2.11 0.08 0.56 6.14 -1.26 -5.07 117.35 116.75 2axd s TYR 71 Ca 0.62 -0.40 0.00 0.00 0.64 0.00 0.00 57.07 57.92 2axd s TYR 71 Cb -0.15 -1.00 0.00 0.00 0.42 0.00 0.00 41.96 41.23 2axd s TYR 71 CO 0.54 0.50 0.00 0.39 0.64 0.00 0.00 175.55 177.62 2axd n GLU 72 N -0.02 0.00 0.00 4.97 -0.58 -1.26 -5.06 120.64 118.69 2axd n GLU 72 Ca -0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 2axd n GLU 72 Cb 0.58 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.45 2axd n GLU 72 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 2axd n PRO 73 N -2.74 1.49 -1.44 3.49 -0.04 -1.26 -4.72 135.00 129.77 2axd n PRO 73 Ca 0.00 0.00 -0.48 0.00 -0.04 0.00 0.00 63.50 62.98 2axd n PRO 73 Cb 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 33.50 33.38 2axd n PRO 73 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2axd n LYS 74 N 0.00 0.81 -1.68 0.54 4.01 -1.26 -4.76 118.16 115.81 2axd n LYS 74 Ca 0.00 0.18 -0.45 0.00 -0.51 0.00 0.00 58.31 57.53 2axd n LYS 74 Cb 0.00 -2.35 -0.04 0.00 -0.51 0.00 0.00 35.03 32.13 2axd n LYS 74 CO 0.00 0.00 0.00 -0.11 -1.11 0.00 0.00 177.40 176.18 2axd n LEU 75 N 10.46 3.43 0.00 -0.35 0.00 -1.26 -5.16 117.00 124.12 2axd n LEU 75 Ca 0.46 1.04 0.00 0.00 0.00 0.00 0.00 56.01 57.51 2axd n LEU 75 Cb 0.21 -1.45 0.00 0.00 0.00 0.00 0.00 43.42 42.18 2axd n LEU 75 CO 0.79 -0.11 0.23 1.17 0.00 0.00 0.00 177.39 179.47