#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 0.00 3.17 4.32 -1.26 -5.04 117.00 118.19 2axd n LEU 2 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 2axd n LEU 2 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 2axd n LEU 2 CO 0.00 0.00 0.00 0.29 -1.22 0.00 0.00 177.39 176.46 2axd n LYS 3 N 0.00 0.00 0.23 3.23 5.02 -1.26 -4.56 118.16 120.83 2axd n LYS 3 Ca 0.00 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.36 2axd n LYS 3 Cb 0.00 0.00 0.55 0.00 -0.02 0.00 0.00 35.03 35.56 2axd n LYS 3 CO 0.00 0.00 0.00 -0.91 -0.52 0.00 0.00 177.40 175.97 2axd h ASN 4 N 0.00 0.00 0.31 4.39 4.21 -2.01 0.10 115.58 122.59 2axd h ASN 4 Ca 0.00 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.50 2axd h ASN 4 Cb 0.00 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.20 2axd h ASN 4 CO 0.00 0.16 -0.05 -0.07 -1.29 0.00 0.00 177.43 176.18 2axd h LEU 5 N 0.00 0.00 -0.95 1.61 -0.00 -1.90 0.70 115.31 114.77 2axd h LEU 5 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2axd h LEU 5 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.95 2axd h LEU 5 CO 0.02 0.05 0.00 0.00 -0.00 0.00 0.00 178.44 178.51 2axd h ALA 6 N 1.95 1.00 -0.80 1.53 0.00 -1.03 -3.26 119.26 118.65 2axd h ALA 6 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2axd h ALA 6 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2axd h ALA 6 CO 0.01 0.00 0.00 1.17 0.00 0.00 0.00 179.25 180.43 2axd n LYS 7 N -2.32 0.00 -2.81 0.00 4.81 0.21 -4.84 118.16 113.21 2axd n LYS 7 Ca 0.01 0.21 -0.43 0.00 -0.87 0.00 0.00 58.31 57.24 2axd n LYS 7 Cb 0.19 -0.66 -0.03 0.00 0.02 0.00 0.00 35.03 34.55 2axd n LYS 7 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2axd s LEU 8 N -3.73 4.32 -0.17 3.14 1.02 -1.03 -4.61 118.68 117.63 2axd s LEU 8 Ca 0.00 -1.27 -0.31 0.00 0.02 0.00 0.00 54.13 52.57 2axd s LEU 8 Cb 0.00 -2.45 0.14 0.00 0.02 0.00 0.00 46.19 43.90 2axd s LEU 8 CO 0.00 -1.39 1.10 -1.81 0.02 0.00 0.00 176.35 174.26 2axd s ASP 9 N 3.83 -0.25 0.14 2.29 -0.00 -1.26 -4.78 116.67 116.64 2axd s ASP 9 Ca 0.29 0.19 -0.16 0.00 -0.00 0.00 0.00 52.55 52.87 2axd s ASP 9 Cb -0.11 0.23 0.01 0.00 -0.00 0.00 0.00 42.92 43.05 2axd s ASP 9 CO 0.03 -0.30 1.73 1.56 -0.00 0.00 0.00 175.17 178.20 2axd h GLN 10 N 2.26 0.59 -0.51 8.23 1.08 -1.96 0.06 115.11 124.86 2axd h GLN 10 Ca -0.15 -0.08 0.12 0.00 -1.45 0.00 0.00 58.65 57.09 2axd h GLN 10 Cb 1.18 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 28.47 2axd h GLN 10 CO 0.28 0.49 0.36 1.15 -0.95 0.00 0.00 178.83 180.15 2axd h THR 11 N 0.53 0.83 -0.00 -0.54 2.02 -1.97 0.50 112.91 114.27 2axd h THR 11 Ca 0.14 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.26 2axd h THR 11 Cb 0.09 0.63 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 2axd h THR 11 CO -0.02 0.03 -0.10 -0.62 0.37 0.00 0.00 175.52 175.18 2axd n GLU 12 N -4.44 0.67 0.09 6.66 4.71 -0.11 -2.78 120.64 125.43 2axd n GLU 12 Ca 0.09 -0.22 0.13 0.00 -0.01 0.00 0.00 57.16 57.14 2axd n GLU 12 Cb 0.46 -1.50 0.46 0.00 -1.01 0.00 0.00 31.44 29.85 2axd n GLU 12 CO 0.00 0.00 0.00 -1.33 0.09 0.00 0.00 177.13 175.89 2axd n MET 13 N -0.97 0.19 -0.35 3.49 2.81 0.17 -3.88 117.12 118.57 2axd n MET 13 Ca 0.14 0.22 0.23 0.00 -1.81 0.00 0.00 57.70 56.49 2axd n MET 13 Cb 0.27 -1.75 0.47 0.00 -0.71 0.00 0.00 33.22 31.51 2axd n MET 13 CO 0.00 0.00 0.00 0.38 1.51 0.00 0.00 175.97 177.86 2axd h ASP 14 N 0.00 0.53 -0.76 7.83 3.04 -1.61 0.22 116.42 125.65 2axd h ASP 14 Ca 0.00 0.15 0.05 0.00 -3.24 0.00 0.00 57.03 53.99 2axd h ASP 14 Cb 0.59 0.08 -0.05 0.00 -1.04 0.00 0.00 39.33 38.90 2axd h ASP 14 CO 0.00 -0.03 0.47 0.11 -2.04 0.00 0.00 179.24 177.75 2axd h LYS 15 N 0.39 0.85 -0.42 4.15 6.56 -1.85 0.07 116.57 126.33 2axd h LYS 15 Ca 0.69 -0.05 -0.15 0.00 -1.06 0.00 0.00 60.65 60.08 2axd h LYS 15 Cb 1.60 -0.19 -0.01 0.00 -0.57 0.00 0.00 32.23 33.06 2axd h LYS 15 CO -0.49 0.56 -0.32 -0.24 -2.06 0.00 0.00 179.45 176.90 2axd h VAL 16 N 0.88 1.27 -0.52 0.50 3.04 -0.85 0.20 116.25 120.77 2axd h VAL 16 Ca 0.32 -1.49 0.05 0.00 -1.01 0.00 0.00 66.70 64.57 2axd h VAL 16 Cb 0.11 1.28 -0.05 0.00 -2.01 0.00 0.00 31.29 30.63 2axd h VAL 16 CO -0.15 0.51 0.26 0.78 -1.01 0.00 0.00 177.57 177.96 2axd h ASN 17 N 0.80 0.37 -0.27 3.17 4.21 -1.09 0.79 115.58 123.56 2axd h ASN 17 Ca 0.08 0.03 -0.05 0.00 1.21 0.00 0.00 56.30 57.57 2axd h ASN 17 Cb 0.91 -0.04 -0.02 0.00 -1.12 0.00 0.00 38.32 38.05 2axd h ASN 17 CO 0.08 0.26 0.01 0.58 -1.29 0.00 0.00 177.43 177.07 2axd h VAL 18 N 0.51 1.20 -0.69 2.81 2.07 -0.69 0.11 116.25 121.56 2axd h VAL 18 Ca 0.23 -0.81 -0.05 0.00 0.82 0.00 0.00 66.70 66.89 2axd h VAL 18 Cb 0.14 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 2axd h VAL 18 CO -0.16 0.28 0.25 -0.78 0.02 0.00 0.00 177.57 177.18 2axd h ASP 19 N 0.55 0.98 -0.45 0.57 3.58 0.74 -0.59 116.42 121.80 2axd h ASP 19 Ca 0.12 -0.19 -0.09 0.00 0.42 0.00 0.00 57.03 57.29 2axd h ASP 19 Cb 0.34 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 2axd h ASP 19 CO 0.01 0.90 -0.04 -0.07 -2.88 0.00 0.00 179.24 177.16 2axd h LEU 20 N 0.99 0.86 -1.20 2.28 4.07 -0.18 -2.08 115.31 120.06 2axd h LEU 20 Ca 0.23 -0.24 0.09 0.00 0.08 0.00 0.00 57.88 58.04 2axd h LEU 20 Cb 0.25 -0.23 -0.06 0.00 1.08 0.00 0.00 40.66 41.70 2axd h LEU 20 CO -0.01 0.94 0.57 0.00 -1.08 0.00 0.00 178.44 178.86 2axd h ALA 21 N 1.14 1.61 -0.13 1.53 0.00 -0.24 0.17 119.26 123.35 2axd h ALA 21 Ca 0.14 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.08 2axd h ALA 21 Cb 0.54 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2axd h ALA 21 CO 0.03 0.22 0.12 0.00 0.00 0.00 0.00 179.25 179.61 2axd h ALA 22 N 1.55 1.92 -0.09 0.00 0.00 -0.40 0.11 119.26 122.34 2axd h ALA 22 Ca 0.40 -0.00 -0.22 0.00 0.00 0.00 0.00 54.91 55.09 2axd h ALA 22 Cb 0.36 0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.16 2axd h ALA 22 CO -0.17 -0.19 -0.83 0.00 0.00 0.00 0.00 179.25 178.07 2axd h ALA 23 N 1.89 0.36 -0.88 0.00 0.00 -0.56 -1.08 119.26 118.99 2axd h ALA 23 Ca 0.06 -0.63 0.12 0.00 0.00 0.00 0.00 54.91 54.47 2axd h ALA 23 Cb 0.30 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.99 2axd h ALA 23 CO -0.00 0.72 0.50 0.78 0.00 0.00 0.00 179.25 181.25 2axd h GLY 24 N 0.80 1.42 0.83 0.00 0.00 -0.23 0.10 103.07 105.99 2axd h GLY 24 Ca -0.06 -0.32 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 2axd h GLY 24 CO 0.16 0.07 0.00 -2.08 0.00 0.00 0.00 176.54 174.69 2axd h VAL 25 N 0.78 1.14 -0.86 4.60 2.07 -0.79 -2.93 116.25 120.26 2axd h VAL 25 Ca 0.45 -0.42 0.21 0.00 0.82 0.00 0.00 66.70 67.76 2axd h VAL 25 Cb 0.52 1.41 -0.12 0.00 -1.52 0.00 0.00 31.29 31.57 2axd h VAL 25 CO -0.30 0.11 0.33 0.00 0.02 0.00 0.00 177.57 177.74 2axd h ALA 26 N 0.83 1.32 0.00 1.67 0.00 -0.28 -0.63 119.26 122.17 2axd h ALA 26 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2axd h ALA 26 Cb 0.18 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2axd h ALA 26 CO -0.00 -0.35 0.01 0.34 0.00 0.00 0.00 179.25 179.25 2axd n PHE 27 N -5.09 0.00 0.21 0.00 7.35 -0.07 -1.21 117.46 118.65 2axd n PHE 27 Ca 0.20 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 57.01 2axd n PHE 27 Cb 0.62 -0.24 0.62 0.00 0.35 0.00 0.00 39.48 40.83 2axd n PHE 27 CO 0.00 0.00 0.00 1.57 -0.76 0.00 0.00 176.76 177.57 2axd h LYS 28 N 0.00 0.00 0.00 -4.13 5.09 -1.19 0.18 116.57 116.52 2axd h LYS 28 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.74 2axd h LYS 28 Cb 0.02 0.00 -0.00 0.00 0.10 0.00 0.00 32.23 32.35 2axd h LYS 28 CO 0.00 0.00 -0.02 1.49 -2.09 0.00 0.00 179.45 178.83 2axd h GLU 29 N 0.00 0.00 -0.93 0.07 4.57 -1.41 -1.14 114.58 115.73 2axd h GLU 29 Ca 0.00 0.00 -0.59 0.00 -1.18 0.00 0.00 59.36 57.59 2axd h GLU 29 Cb 0.30 0.00 -0.29 0.00 -0.16 0.00 0.00 28.75 28.60 2axd h GLU 29 CO 0.00 0.02 0.60 0.54 -1.18 0.00 0.00 179.01 178.99 2axd n ARG 30 N -4.30 2.58 0.25 1.92 5.12 0.63 -4.72 116.66 118.13 2axd n ARG 30 Ca -0.03 -3.28 0.14 0.00 -1.93 0.00 0.00 57.85 52.75 2axd n ARG 30 Cb 0.11 -2.22 0.73 0.00 -1.16 0.00 0.00 32.46 29.91 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 1.65 0.00 -0.44 -1.55 3.20 -1.28 -2.66 116.97 115.89 2axd h TYR 31 Ca 0.57 0.00 -0.61 0.00 3.14 0.00 0.00 58.73 61.83 2axd h TYR 31 Cb 1.53 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.76 2axd h TYR 31 CO 1.41 0.00 2.19 -1.71 -1.64 0.00 0.00 178.16 178.41 2axd n ASN 32 N -2.55 3.92 0.00 -2.11 5.15 -1.26 -4.54 115.26 113.87 2axd n ASN 32 Ca -0.02 -2.82 0.00 0.00 -0.60 0.00 0.00 54.58 51.15 2axd n ASN 32 Cb 0.21 -1.63 0.00 0.00 -0.53 0.00 0.00 39.78 37.82 2axd n ASN 32 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 2axd n MET 33 N 7.62 0.00 -2.15 1.20 2.81 -1.00 -5.12 117.12 120.47 2axd n MET 33 Ca 0.49 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.95 2axd n MET 33 Cb 0.44 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.92 2axd n MET 33 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2axd s PRO 34 N -2.72 4.22 -0.17 0.03 0.04 -1.26 -4.99 135.00 130.15 2axd s PRO 34 Ca 0.00 2.02 -0.01 0.00 0.04 0.00 0.00 61.00 63.05 2axd s PRO 34 Cb 0.00 -3.80 0.05 0.00 0.04 0.00 0.00 34.50 30.78 2axd s PRO 34 CO 0.00 -0.74 -0.01 0.08 0.04 0.00 0.00 177.00 176.37 2axd s VAL 35 N 3.40 0.82 -1.33 -0.36 1.01 -1.26 -5.06 120.40 117.61 2axd s VAL 35 Ca 0.67 -0.55 -0.14 0.00 0.00 0.00 0.00 61.98 61.96 2axd s VAL 35 Cb -0.31 -1.13 0.10 0.00 0.00 0.00 0.00 36.38 35.05 2axd s VAL 35 CO 0.26 -0.01 1.87 -0.38 0.00 0.00 0.00 175.10 176.84 2axd n ILE 36 N 4.96 3.94 -0.18 2.22 5.41 -1.26 -4.78 119.36 129.67 2axd n ILE 36 Ca -0.10 -3.95 0.19 0.00 1.00 0.00 0.00 62.75 59.89 2axd n ILE 36 Cb 0.47 -2.45 0.55 0.00 -0.71 0.00 0.00 39.64 37.50 2axd n ILE 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2axd h ALA 37 N 6.58 2.28 -0.30 -1.39 0.00 -1.97 0.24 119.26 124.70 2axd h ALA 37 Ca 0.45 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 55.27 2axd h ALA 37 Cb 0.74 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 2axd h ALA 37 CO 1.59 -0.51 -0.19 1.05 0.00 0.00 0.00 179.25 181.20 2axd h GLU 38 N 0.32 0.54 0.00 0.00 4.11 -2.04 -3.17 114.58 114.33 2axd h GLU 38 Ca 0.40 -0.18 -0.02 0.00 0.07 0.00 0.00 59.36 59.63 2axd h GLU 38 Cb 1.09 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 2axd h GLU 38 CO -0.11 0.70 -0.08 0.00 0.07 0.00 0.00 179.01 179.58 2axd h ALA 39 N 1.32 1.15 -0.03 1.06 0.00 -1.34 -2.69 119.26 118.72 2axd h ALA 39 Ca 0.08 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2axd h ALA 39 Cb 0.60 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2axd h ALA 39 CO 0.04 0.11 0.02 -0.39 0.00 0.00 0.00 179.25 179.03 2axd h VAL 40 N 0.00 0.96 0.00 0.00 -1.51 -1.63 0.15 116.25 114.22 2axd h VAL 40 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 2axd h VAL 40 Cb 0.36 0.98 0.00 0.00 -2.13 0.00 0.00 31.29 30.50 2axd h VAL 40 CO 0.01 0.00 -0.55 -0.62 -1.23 0.00 0.00 177.57 175.18 2axd n GLU 41 N -4.50 0.16 -0.13 5.19 -0.58 -1.01 -3.33 120.64 116.44 2axd n GLU 41 Ca -0.02 0.05 -0.18 0.00 -0.42 0.00 0.00 57.16 56.59 2axd n GLU 41 Cb 0.12 -1.60 -0.12 0.00 -0.57 0.00 0.00 31.44 29.27 2axd n GLU 41 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2axd n ARG 42 N -1.84 0.65 -0.10 3.49 1.74 0.07 -4.41 116.66 116.26 2axd n ARG 42 Ca 0.04 0.15 -0.10 0.00 -0.77 0.00 0.00 57.85 57.17 2axd n ARG 42 Cb 0.39 -1.52 -0.02 0.00 -1.02 0.00 0.00 32.46 30.29 2axd n ARG 42 CO 0.00 0.00 0.00 1.49 -1.52 0.00 0.00 177.63 177.60 2axd h GLU 43 N 0.00 0.47 -6.18 5.56 4.22 -0.98 -3.41 114.58 114.25 2axd h GLU 43 Ca -0.58 -0.09 -0.58 0.00 0.08 0.00 0.00 59.36 58.20 2axd h GLU 43 Cb 1.91 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 31.06 2axd h GLU 43 CO -0.09 0.48 1.34 -1.14 -2.18 0.00 0.00 179.01 177.42 2axd s GLN 44 N -5.55 3.26 0.25 1.92 0.74 -1.21 -4.99 119.66 114.08 2axd s GLN 44 Ca -0.13 1.58 -0.30 0.00 0.05 0.00 0.00 55.36 56.56 2axd s GLN 44 Cb 0.09 -4.25 -0.09 0.00 1.10 0.00 0.00 33.01 29.86 2axd s GLN 44 CO 0.73 -1.95 0.99 -1.25 -0.55 0.00 0.00 175.29 173.26 2axd s PRO 45 N 5.89 4.80 0.44 1.67 0.04 -1.26 -4.89 135.00 141.69 2axd s PRO 45 Ca 0.85 1.58 0.32 0.00 0.04 0.00 0.00 61.00 63.79 2axd s PRO 45 Cb -0.25 -3.25 1.47 0.00 0.04 0.00 0.00 34.50 32.50 2axd s PRO 45 CO 0.34 0.43 1.60 1.05 0.04 0.00 0.00 177.00 180.46 2axd h GLU 46 N 4.06 0.04 -0.59 4.56 9.09 -1.94 -2.08 114.58 127.73 2axd h GLU 46 Ca -0.45 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.95 2axd h GLU 46 Cb 1.20 -0.01 0.00 0.00 -1.65 0.00 0.00 28.75 28.29 2axd h GLU 46 CO 0.68 0.03 0.00 -2.39 0.05 0.00 0.00 179.01 177.38 2axd n HIS 47 N -4.71 0.00 -2.24 2.06 1.44 -1.26 -2.44 115.22 108.07 2axd n HIS 47 Ca 0.39 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 56.08 2axd n HIS 47 Cb 1.51 -0.06 -0.03 0.00 0.12 0.00 0.00 29.99 31.53 2axd n HIS 47 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 2axd n LEU 48 N 0.03 -0.05 -0.33 2.39 -0.00 -0.78 -4.94 117.00 113.32 2axd n LEU 48 Ca 0.00 -2.00 0.13 0.00 -0.00 0.00 0.00 56.01 54.14 2axd n LEU 48 Cb 0.15 0.00 0.35 0.00 -0.00 0.00 0.00 43.42 43.91 2axd n LEU 48 CO 0.00 1.03 1.21 0.03 -0.00 0.00 0.00 177.39 179.66 2axd h ARG 49 N 0.47 0.71 0.11 1.47 2.47 -1.65 0.34 114.38 118.32 2axd h ARG 49 Ca -0.41 -0.04 0.02 0.00 -1.26 0.00 0.00 59.98 58.29 2axd h ARG 49 Cb 1.64 -0.16 -0.04 0.00 -1.65 0.00 0.00 29.97 29.76 2axd h ARG 49 CO -0.11 0.47 -0.31 0.66 0.56 0.00 0.00 179.97 181.24 2axd h SER 50 N 0.73 -0.90 0.07 7.04 4.64 -1.92 0.34 113.55 123.55 2axd h SER 50 Ca 0.54 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.97 2axd h SER 50 Cb 0.87 0.34 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2axd h SER 50 CO -0.31 -0.40 -0.07 -0.25 -0.87 0.00 0.00 176.83 174.93 2axd h TRP 51 N -0.53 -0.17 -0.58 4.77 2.91 -1.64 0.03 115.95 120.73 2axd h TRP 51 Ca 0.03 0.00 -0.07 0.00 1.13 0.00 0.00 58.89 59.99 2axd h TRP 51 Cb 0.56 0.07 -0.03 0.00 -0.51 0.00 0.00 29.16 29.26 2axd h TRP 51 CO -0.28 -0.10 0.10 0.35 -1.03 0.00 0.00 178.44 177.47 2axd h PHE 52 N -0.15 0.99 -0.17 2.65 3.57 -0.85 0.97 116.94 123.95 2axd h PHE 52 Ca 0.00 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.39 2axd h PHE 52 Cb 0.14 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 2axd h PHE 52 CO -0.10 0.84 0.08 -0.09 -2.23 0.00 0.00 178.31 176.82 2axd h ARG 53 N 0.89 0.18 -0.33 1.11 2.43 -0.75 0.52 114.38 118.43 2axd h ARG 53 Ca 0.18 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.40 2axd h ARG 53 Cb 0.39 -0.04 -0.06 0.00 -0.42 0.00 0.00 29.97 29.84 2axd h ARG 53 CO 0.01 0.12 -0.04 1.49 -1.51 0.00 0.00 179.97 180.03 2axd h GLU 54 N 0.18 0.04 0.00 0.20 4.81 -0.25 -0.41 114.58 119.16 2axd h GLU 54 Ca 0.07 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 2axd h GLU 54 Cb 0.01 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 2axd h GLU 54 CO -0.05 0.03 -0.33 0.00 -0.73 0.00 0.00 179.01 177.92 2axd h ARG 55 N 0.04 0.00 -0.32 1.92 2.47 -0.54 -0.95 114.38 117.00 2axd h ARG 55 Ca 0.16 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.85 2axd h ARG 55 Cb 0.23 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.54 2axd h ARG 55 CO -0.30 0.33 0.09 -0.07 0.56 0.00 0.00 179.97 180.58 2axd h LEU 56 N 0.00 0.48 0.13 3.04 3.38 0.13 0.37 115.31 122.84 2axd h LEU 56 Ca -0.00 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.76 2axd h LEU 56 Cb 0.76 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 2axd h LEU 56 CO 0.04 0.57 -0.16 0.40 0.09 0.00 0.00 178.44 179.38 2axd h ILE 57 N 0.36 0.63 -0.68 1.22 2.04 -0.65 0.41 117.51 120.84 2axd h ILE 57 Ca 0.10 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.01 2axd h ILE 57 Cb 0.27 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2axd h ILE 57 CO -0.00 0.00 0.45 0.00 0.00 0.00 0.00 178.15 178.59 2axd h ALA 58 N 0.49 1.69 0.00 1.87 0.00 -1.07 -1.52 119.26 120.72 2axd h ALA 58 Ca 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2axd h ALA 58 Cb 0.33 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2axd h ALA 58 CO -0.07 0.21 -0.29 0.45 0.00 0.00 0.00 179.25 179.56 2axd h HIS 59 N 0.74 0.00 -0.13 0.00 3.86 0.48 0.79 115.15 120.89 2axd h HIS 59 Ca 0.28 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.45 2axd h HIS 59 Cb 0.18 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.65 2axd h HIS 59 CO -0.00 0.00 -0.09 0.00 0.86 0.00 0.00 177.93 178.70 2axd h ARG 60 N 0.00 0.29 -0.98 2.45 3.08 0.76 0.14 114.38 120.12 2axd h ARG 60 Ca 0.00 -0.14 0.02 0.00 0.07 0.00 0.00 59.98 59.93 2axd h ARG 60 Cb 0.79 -0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.78 2axd h ARG 60 CO 0.00 0.65 0.64 -0.07 -1.07 0.00 0.00 179.97 180.12 2axd h LEU 61 N -0.07 1.10 -0.29 3.04 3.38 -1.16 -1.14 115.31 120.17 2axd h LEU 61 Ca 0.03 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.01 2axd h LEU 61 Cb 0.57 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 2axd h LEU 61 CO 0.02 0.78 0.09 0.00 0.09 0.00 0.00 178.44 179.43 2axd h ALA 62 N 1.41 0.32 -0.67 1.53 0.00 -0.71 -3.03 119.26 118.11 2axd h ALA 62 Ca 0.37 0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.46 2axd h ALA 62 Cb -0.09 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 17.62 2axd h ALA 62 CO -0.09 -0.31 0.11 0.77 0.00 0.00 0.00 179.25 179.72 2axd h SER 63 N 0.22 -0.09 -0.66 0.00 0.02 0.55 0.35 113.55 113.94 2axd h SER 63 Ca 0.13 0.14 -0.08 0.00 -0.84 0.00 0.00 61.79 61.15 2axd h SER 63 Cb 0.11 0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 2axd h SER 63 CO -0.14 -0.05 0.12 -0.37 -1.14 0.00 0.00 176.83 175.24 2axd h VAL 64 N 0.22 1.26 -0.14 2.27 -1.51 -1.34 -2.42 116.25 114.58 2axd h VAL 64 Ca 0.36 -1.02 0.00 0.00 -1.23 0.00 0.00 66.70 64.81 2axd h VAL 64 Cb 0.60 0.62 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 2axd h VAL 64 CO -0.50 0.38 0.00 -0.46 -1.23 0.00 0.00 177.57 175.77 2axd n ASN 65 N -4.22 1.94 0.24 4.19 0.23 -0.54 -4.12 115.26 112.99 2axd n ASN 65 Ca 0.05 -1.71 0.12 0.00 -0.53 0.00 0.00 54.58 52.51 2axd n ASN 65 Cb 0.29 -0.09 0.75 0.00 -2.08 0.00 0.00 39.78 38.65 2axd n ASN 65 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2axd h LEU 66 N 2.71 0.00 -3.68 -4.53 5.85 0.18 -0.37 115.31 115.46 2axd h LEU 66 Ca 0.00 0.00 -0.41 0.00 0.84 0.00 0.00 57.88 58.31 2axd h LEU 66 Cb 0.59 0.00 -0.24 0.00 0.37 0.00 0.00 40.66 41.38 2axd h LEU 66 CO 0.00 0.00 0.15 -0.24 -0.34 0.00 0.00 178.44 178.01 2axd n SER 67 N -4.22 4.17 -1.08 1.25 2.88 -1.26 -4.82 113.62 110.54 2axd n SER 67 Ca -0.01 -3.75 0.00 0.00 -1.33 0.00 0.00 58.87 53.78 2axd n SER 67 Cb 0.17 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 62.92 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 -1.03 0.80 -3.23 -1.46 1.85 -0.15 -4.85 116.66 108.60 2axd n ARG 68 Ca 0.47 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 57.30 2axd n ARG 68 Cb 1.09 -1.10 0.00 0.00 -1.05 0.00 0.00 32.46 31.40 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 0.73 -0.03 -4.76 2.89 -0.00 -1.26 -4.88 117.00 109.69 2axd n LEU 69 Ca 0.00 -0.05 -0.40 0.00 -0.00 0.00 0.00 56.01 55.57 2axd n LEU 69 Cb 0.40 -0.06 -0.05 0.00 -0.00 0.00 0.00 43.42 43.71 2axd n LEU 69 CO 0.00 0.03 0.73 -2.16 -0.00 0.00 0.00 177.39 175.99 2axd s PRO 70 N -3.82 4.66 0.02 1.47 0.04 -1.26 -4.84 135.00 131.27 2axd s PRO 70 Ca 0.01 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.69 2axd s PRO 70 Cb -0.01 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.41 2axd s PRO 70 CO 0.04 0.28 0.00 0.98 0.04 0.00 0.00 177.00 178.34 2axd n TYR 71 N 1.12 -0.16 -3.65 0.56 9.36 -1.26 -4.91 117.16 118.21 2axd n TYR 71 Ca -0.01 0.09 -0.39 0.00 3.32 0.00 0.00 57.90 60.91 2axd n TYR 71 Cb 0.46 -0.46 -0.11 0.00 -0.63 0.00 0.00 39.34 38.60 2axd n TYR 71 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 2axd s GLU 72 N -3.72 2.70 0.00 2.98 0.41 -1.26 -5.10 118.70 114.71 2axd s GLU 72 Ca 0.00 -1.20 0.00 0.00 -0.41 0.00 0.00 54.97 53.36 2axd s GLU 72 Cb 0.00 -3.65 0.00 0.00 -1.78 0.00 0.00 34.13 28.70 2axd s GLU 72 CO 0.00 -0.74 0.00 -2.30 -0.49 0.00 0.00 175.26 171.73 2axd n PRO 73 N 4.91 3.13 -0.16 0.39 -0.02 -1.26 -5.04 135.00 136.95 2axd n PRO 73 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.36 2axd n PRO 73 Cb 0.45 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.93 2axd n PRO 73 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2axd n LYS 74 N 0.00 -0.44 0.00 -0.52 4.76 -1.26 -4.85 118.16 115.85 2axd n LYS 74 Ca 0.00 0.33 0.00 0.00 -2.87 0.00 0.00 58.31 55.77 2axd n LYS 74 Cb 0.00 -0.40 0.00 0.00 -1.84 0.00 0.00 35.03 32.79 2axd n LYS 74 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2axd n LEU 75 N -1.33 0.00 0.00 -0.35 4.77 -1.26 -5.31 117.00 113.52 2axd n LEU 75 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2axd n LEU 75 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2axd n LEU 75 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.39 177.23