#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5e s THR 2 N 0.00 1.59 0.43 2.03 -1.32 -1.26 -5.03 115.64 112.08 2k5e s THR 2 Ca 0.00 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.50 2k5e s THR 2 Cb 0.00 -2.01 -0.00 0.00 -1.51 0.00 0.00 72.50 68.97 2k5e s THR 2 CO 0.00 0.00 0.63 -1.10 -2.21 0.00 0.00 174.62 171.94 2k5e s GLN 3 N -4.70 3.05 -0.13 7.08 -0.21 -1.26 -5.05 119.66 118.44 2k5e s GLN 3 Ca 0.69 -0.63 -0.19 0.00 0.02 0.00 0.00 55.36 55.25 2k5e s GLN 3 Cb -0.20 -2.62 -0.17 0.00 1.00 0.00 0.00 33.01 31.02 2k5e s GLN 3 CO 0.62 -0.22 0.49 0.87 -2.12 0.00 0.00 175.29 174.93 2k5e h LYS 4 N 0.49 0.00 -6.29 2.91 1.57 -1.97 -3.43 116.57 109.85 2k5e h LYS 4 Ca -0.46 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 57.74 2k5e h LYS 4 Cb 1.26 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.48 2k5e h LYS 4 CO 0.56 0.66 0.71 -0.06 -0.57 0.00 0.00 179.45 180.75 2k5e s PHE 5 N -2.01 2.98 0.35 -1.35 0.40 -1.26 -5.04 117.98 112.05 2k5e s PHE 5 Ca -0.13 0.72 0.09 0.00 -0.60 0.00 0.00 56.93 57.00 2k5e s PHE 5 Cb -0.02 -3.93 -0.06 0.00 0.51 0.00 0.00 43.02 39.53 2k5e s PHE 5 CO 0.46 -1.00 0.01 -0.08 0.70 0.00 0.00 175.22 175.31 2k5e s THR 6 N 3.81 2.56 -0.13 0.64 -1.32 -1.26 -4.86 115.64 115.08 2k5e s THR 6 Ca 0.41 -1.98 0.30 0.00 -1.21 0.00 0.00 61.69 59.21 2k5e s THR 6 Cb -0.10 -2.80 0.33 0.00 -1.51 0.00 0.00 72.50 68.42 2k5e s THR 6 CO 0.23 -0.18 1.88 0.07 -2.21 0.00 0.00 174.62 174.41 2k5e h LYS 7 N 1.81 0.00 0.00 7.08 2.10 -1.96 -3.00 116.57 122.60 2k5e h LYS 7 Ca -0.43 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.09 2k5e h LYS 7 Cb 1.25 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.56 2k5e h LYS 7 CO 0.68 0.00 -0.63 0.22 -2.00 0.00 0.00 179.45 177.72 2k5e h ASP 8 N 0.00 0.00 -4.08 7.07 3.58 -1.95 -2.95 116.42 118.09 2k5e h ASP 8 Ca 0.00 0.00 -0.45 0.00 0.42 0.00 0.00 57.03 57.00 2k5e h ASP 8 Cb 0.44 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.49 2k5e h ASP 8 CO 0.00 0.63 0.36 0.00 -2.88 0.00 0.00 179.24 177.34 2k5e s MET 9 N -2.95 4.04 0.54 0.28 0.23 -1.14 -4.68 119.30 115.63 2k5e s MET 9 Ca 0.03 1.18 -0.10 0.00 -1.03 0.00 0.00 55.69 55.77 2k5e s MET 9 Cb 0.08 -2.14 -0.05 0.00 -1.53 0.00 0.00 34.83 31.19 2k5e s MET 9 CO 0.76 -0.20 0.93 0.95 -2.03 0.00 0.00 175.02 175.43 2k5e s THR 10 N -2.16 4.75 0.25 3.16 -4.23 -1.26 -1.34 115.64 114.80 2k5e s THR 10 Ca 0.63 0.71 -0.03 0.00 -1.18 0.00 0.00 61.69 61.82 2k5e s THR 10 Cb -0.12 -3.83 0.22 0.00 1.34 0.00 0.00 72.50 70.12 2k5e s THR 10 CO 0.17 -0.93 1.78 -0.26 -0.54 0.00 0.00 174.62 174.85 2k5e h PHE 11 N 0.19 0.78 -0.34 3.99 0.04 -1.60 -1.72 116.94 118.27 2k5e h PHE 11 Ca -0.46 0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.39 2k5e h PHE 11 Cb 1.19 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 39.07 2k5e h PHE 11 CO 0.63 0.25 0.08 0.00 -0.60 0.00 0.00 178.31 178.66 2k5e h ALA 12 N 1.50 0.37 -0.30 2.45 0.00 -1.83 -1.55 119.26 119.89 2k5e h ALA 12 Ca 0.42 0.06 0.02 0.00 0.00 0.00 0.00 54.91 55.42 2k5e h ALA 12 Cb 0.51 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2k5e h ALA 12 CO -0.31 -0.33 0.15 1.96 0.00 0.00 0.00 179.25 180.72 2k5e h GLN 13 N 0.20 0.30 -0.19 0.00 4.20 -1.65 -1.47 115.11 116.50 2k5e h GLN 13 Ca 0.16 -0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.90 2k5e h GLN 13 Cb 0.17 -0.07 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 2k5e h GLN 13 CO -0.20 0.20 -0.12 0.00 -0.67 0.00 0.00 178.83 178.04 2k5e h ALA 14 N 1.16 0.04 -0.98 3.87 0.00 -0.92 0.47 119.26 122.90 2k5e h ALA 14 Ca 0.13 0.08 0.02 0.00 0.00 0.00 0.00 54.91 55.13 2k5e h ALA 14 Cb 0.05 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 2k5e h ALA 14 CO -0.09 -0.55 0.64 -0.07 0.00 0.00 0.00 179.25 179.19 2k5e h LEU 15 N -0.11 1.10 -0.21 0.00 3.38 -1.13 -1.51 115.31 116.83 2k5e h LEU 15 Ca 0.11 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2k5e h LEU 15 Cb 0.27 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2k5e h LEU 15 CO -0.26 0.78 0.00 0.00 0.09 0.00 0.00 178.44 179.05 2k5e n GLN 16 N -4.41 1.14 -0.12 1.13 1.13 -0.57 -3.54 117.38 112.14 2k5e n GLN 16 Ca 0.12 -0.21 -0.18 0.00 -1.94 0.00 0.00 57.00 54.79 2k5e n GLN 16 Cb 0.05 -1.48 -0.11 0.00 0.11 0.00 0.00 30.24 28.81 2k5e n GLN 16 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 2k5e n THR 17 N -0.73 1.41 -3.47 5.09 -1.04 0.08 -4.96 114.28 110.66 2k5e n THR 17 Ca 0.22 -0.52 -0.12 0.00 -2.04 0.00 0.00 64.05 61.59 2k5e n THR 17 Cb 0.16 -1.41 -0.10 0.00 -1.82 0.00 0.00 70.33 67.16 2k5e n THR 17 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 2k5e s HIS 18 N -2.49 -0.63 0.44 -1.42 3.76 -0.72 -5.04 115.29 109.19 2k5e s HIS 18 Ca -0.33 0.79 0.25 0.00 -0.15 0.00 0.00 55.06 55.62 2k5e s HIS 18 Cb 0.09 -0.04 1.27 0.00 1.11 0.00 0.00 32.58 35.00 2k5e s HIS 18 CO 0.56 -0.61 1.76 -1.35 -0.85 0.00 0.00 174.74 174.25 2k5e h PRO 19 N 8.23 0.24 -0.21 8.40 0.11 -1.84 -0.34 132.00 146.60 2k5e h PRO 19 Ca -0.18 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 65.98 2k5e h PRO 19 Cb 1.14 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2k5e h PRO 19 CO 0.24 0.16 0.24 0.78 -0.21 0.00 0.00 178.00 179.20 2k5e h GLY 20 N 0.25 0.00 0.86 -0.55 0.00 -1.94 -1.45 103.07 100.24 2k5e h GLY 20 Ca 0.61 0.00 0.14 0.00 0.00 0.00 0.00 47.33 48.08 2k5e h GLY 20 CO -0.23 0.00 0.44 -2.08 0.00 0.00 0.00 176.54 174.67 2k5e h VAL 21 N 0.00 0.81 -0.58 4.60 2.07 -1.36 -1.92 116.25 119.86 2k5e h VAL 21 Ca 0.10 -0.10 0.09 0.00 0.82 0.00 0.00 66.70 67.60 2k5e h VAL 21 Cb 0.57 0.48 -0.07 0.00 -1.52 0.00 0.00 31.29 30.75 2k5e h VAL 21 CO -0.00 0.05 0.22 0.00 0.02 0.00 0.00 177.57 177.87 2k5e h ALA 22 N 1.69 0.75 -0.43 1.67 0.00 -1.46 0.19 119.26 121.66 2k5e h ALA 22 Ca 0.31 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 55.20 2k5e h ALA 22 Cb 0.81 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2k5e h ALA 22 CO -0.08 -0.19 -0.11 0.78 0.00 0.00 0.00 179.25 179.66 2k5e h GLY 23 N 0.41 0.90 0.82 0.00 0.00 -1.54 -2.21 103.07 101.45 2k5e h GLY 23 Ca 0.29 -0.75 0.01 0.00 0.00 0.00 0.00 47.33 46.88 2k5e h GLY 23 CO -0.28 0.68 -0.13 -2.08 0.00 0.00 0.00 176.54 174.73 2k5e h VAL 24 N 0.66 0.70 -0.37 4.60 2.07 -1.23 -0.77 116.25 121.91 2k5e h VAL 24 Ca 0.11 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.68 2k5e h VAL 24 Cb 0.65 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 31.08 2k5e h VAL 24 CO 0.04 0.00 0.11 -0.07 0.02 0.00 0.00 177.57 177.67 2k5e h LEU 25 N -0.28 0.09 -1.31 2.57 3.38 -0.98 -1.66 115.31 117.12 2k5e h LEU 25 Ca 0.01 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.08 2k5e h LEU 25 Cb 0.28 0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 2k5e h LEU 25 CO -0.04 0.09 0.50 0.03 0.09 0.00 0.00 178.44 179.11 2k5e h ARG 26 N 0.25 0.83 -0.78 1.13 3.08 -1.21 0.30 114.38 117.98 2k5e h ARG 26 Ca 0.17 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.14 2k5e h ARG 26 Cb 0.17 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 29.99 2k5e h ARG 26 CO -0.19 0.55 0.38 1.03 -1.07 0.00 0.00 179.97 180.67 2k5e h SER 27 N 0.86 1.02 -0.04 7.04 0.87 -0.20 -2.01 113.55 121.09 2k5e h SER 27 Ca 0.32 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2k5e h SER 27 Cb 0.18 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 2k5e h SER 27 CO -0.11 0.86 0.00 -1.22 -0.53 0.00 0.00 176.83 175.84 2k5e n TYR 28 N -4.37 0.05 -2.43 2.24 4.01 -0.91 -4.94 117.16 110.80 2k5e n TYR 28 Ca 0.07 -0.02 -0.04 0.00 -0.16 0.00 0.00 57.90 57.74 2k5e n TYR 28 Cb 0.13 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.18 2k5e n TYR 28 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2k5e n ASN 29 N -0.24 -4.91 0.00 7.72 2.85 -0.67 -5.00 115.26 115.00 2k5e n ASN 29 Ca 0.19 -0.23 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 2k5e n ASN 29 Cb 0.24 -3.27 0.00 0.00 1.24 0.00 0.00 39.78 37.99 2k5e n ASN 29 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2k5e n LEU 30 N -1.98 0.96 0.28 1.20 4.77 0.96 -4.78 117.00 118.42 2k5e n LEU 30 Ca -0.02 -0.96 0.16 0.00 -0.03 0.00 0.00 56.01 55.16 2k5e n LEU 30 Cb 0.54 0.00 0.83 0.00 -2.33 0.00 0.00 43.42 42.46 2k5e n LEU 30 CO 0.31 0.24 1.03 1.23 -1.33 0.00 0.00 177.39 178.88 2k5e h GLY 31 N 0.00 0.00 1.21 -0.72 0.00 -1.87 -2.39 103.07 99.30 2k5e h GLY 31 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2k5e h GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2k5e h ILE 33 N 0.00 0.76 -0.32 0.00 3.07 -1.81 0.83 117.51 120.03 2k5e h ILE 33 Ca 0.00 -0.09 -0.08 0.00 1.55 0.00 0.00 64.86 66.23 2k5e h ILE 33 Cb 0.06 0.47 -0.02 0.00 -0.27 0.00 0.00 36.82 37.07 2k5e h ILE 33 CO 0.00 0.05 -0.15 1.23 -1.05 0.00 0.00 178.15 178.22 2k5e h GLY 34 N 0.27 0.62 0.36 0.16 0.00 -1.84 0.12 103.07 102.76 2k5e h GLY 34 Ca 0.34 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 2k5e h GLY 34 CO -0.08 0.43 -0.15 0.00 0.00 0.00 0.00 176.54 176.73 2k5e n MET 36 N -4.58 0.18 -2.34 0.00 0.00 -0.48 -4.90 117.12 104.99 2k5e n MET 36 Ca -0.10 0.09 -0.09 0.00 0.00 0.00 0.00 57.70 57.60 2k5e n MET 36 Cb 0.46 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 32.18 2k5e n MET 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2k5e n GLY 37 N 0.76 0.09 0.90 3.17 0.00 -0.38 -4.92 105.19 104.80 2k5e n GLY 37 Ca 0.08 -0.47 0.01 0.00 0.00 0.00 0.00 46.02 45.64 2k5e n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k5e n ALA 38 N -1.89 2.89 -0.04 4.61 0.00 0.27 -4.29 120.51 122.06 2k5e n ALA 38 Ca -0.08 -0.51 -0.00 0.00 0.00 0.00 0.00 53.44 52.85 2k5e n ALA 38 Cb 0.57 -1.04 0.28 0.00 0.00 0.00 0.00 19.45 19.26 2k5e n ALA 38 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2k5e h GLN 39 N 0.96 0.63 -0.30 0.00 1.08 -1.92 -2.13 115.11 113.44 2k5e h GLN 39 Ca 0.01 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 2k5e h GLN 39 Cb 0.93 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.26 2k5e h GLN 39 CO 0.14 0.59 0.00 0.09 -0.95 0.00 0.00 178.83 178.70 2k5e n ASN 40 N -4.31 2.45 -4.91 1.46 3.02 -1.26 -2.99 115.26 108.72 2k5e n ASN 40 Ca 0.03 -1.86 -0.32 0.00 -0.03 0.00 0.00 54.58 52.39 2k5e n ASN 40 Cb 0.21 -0.19 -0.04 0.00 -0.61 0.00 0.00 39.78 39.14 2k5e n ASN 40 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2k5e s GLU 41 N -1.62 3.49 0.63 3.52 2.12 -0.80 -4.90 118.70 121.14 2k5e s GLU 41 Ca 0.34 -0.30 -0.15 0.00 0.36 0.00 0.00 54.97 55.22 2k5e s GLU 41 Cb 0.19 -3.03 -0.02 0.00 0.26 0.00 0.00 34.13 31.53 2k5e s GLU 41 CO 0.27 0.61 1.09 -1.54 -0.54 0.00 0.00 175.26 175.15 2k5e s SER 42 N -2.22 5.41 0.20 -1.70 1.04 -1.26 -2.29 113.70 112.88 2k5e s SER 42 Ca 0.33 1.93 -0.11 0.00 0.48 0.00 0.00 55.95 58.59 2k5e s SER 42 Cb -0.13 -2.55 0.26 0.00 0.10 0.00 0.00 66.02 63.71 2k5e s SER 42 CO 0.23 -1.42 1.72 -0.07 0.98 0.00 0.00 173.24 174.67 2k5e h LEU 43 N 0.25 0.05 -0.35 2.42 3.38 -1.04 -2.58 115.31 117.44 2k5e h LEU 43 Ca -0.47 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.56 2k5e h LEU 43 Cb 1.24 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 2k5e h LEU 43 CO 0.56 0.04 0.06 -0.08 0.09 0.00 0.00 178.44 179.10 2k5e h GLU 44 N 0.28 0.58 0.20 1.13 4.81 -1.85 -0.21 114.58 119.54 2k5e h GLU 44 Ca 0.30 -0.16 -0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2k5e h GLU 44 Cb 0.41 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2k5e h GLU 44 CO -0.36 0.66 -0.16 1.96 -0.73 0.00 0.00 179.01 180.37 2k5e h GLN 45 N 0.42 -0.36 -0.59 1.92 4.20 -1.78 -0.85 115.11 118.06 2k5e h GLN 45 Ca 0.11 0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 2k5e h GLN 45 Cb 0.35 0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 2k5e h GLN 45 CO 0.01 -0.24 0.18 0.78 -0.67 0.00 0.00 178.83 178.89 2k5e h GLY 46 N -0.37 0.96 1.00 3.46 0.00 -1.45 -1.18 103.07 105.48 2k5e h GLY 46 Ca -0.01 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.76 2k5e h GLY 46 CO -0.01 0.50 -0.31 0.00 0.00 0.00 0.00 176.54 176.72 2k5e h ALA 47 N 1.33 -0.85 -0.11 3.60 0.00 -0.72 -1.97 119.26 120.54 2k5e h ALA 47 Ca 0.19 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2k5e h ALA 47 Cb 0.26 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2k5e h ALA 47 CO -0.01 -0.98 -0.05 -0.91 0.00 0.00 0.00 179.25 177.31 2k5e h ASN 48 N -0.85 0.15 0.20 0.00 2.35 -1.13 0.22 115.58 116.52 2k5e h ASN 48 Ca -0.08 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 2k5e h ASN 48 Cb 0.65 -0.04 -0.00 0.00 0.05 0.00 0.00 38.32 38.98 2k5e h ASN 48 CO 0.14 0.23 -0.10 0.00 -1.65 0.00 0.00 177.43 176.04 2k5e h ALA 49 N 1.80 1.50 -0.66 -0.83 0.00 -0.95 -1.41 119.26 118.72 2k5e h ALA 49 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2k5e h ALA 49 Cb 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2k5e h ALA 49 CO 0.01 0.13 0.00 0.72 0.00 0.00 0.00 179.25 180.10 2k5e n HIS 50 N -3.94 1.02 -3.08 0.00 8.25 -0.19 -4.98 115.22 112.31 2k5e n HIS 50 Ca -0.02 -0.53 -0.13 0.00 -0.26 0.00 0.00 57.72 56.77 2k5e n HIS 50 Cb 0.19 -0.06 0.07 0.00 1.12 0.00 0.00 29.99 31.31 2k5e n HIS 50 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k5e n GLY 51 N 1.36 -0.37 3.40 -1.41 0.00 -0.53 -5.05 105.19 102.59 2k5e n GLY 51 Ca 0.23 0.12 -0.20 0.00 0.00 0.00 0.00 46.02 46.16 2k5e n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k5e s LEU 52 N -5.33 2.47 -0.53 0.99 1.43 -0.11 -4.97 118.68 112.63 2k5e s LEU 52 Ca 0.11 -1.16 -0.15 0.00 -1.03 0.00 0.00 54.13 51.90 2k5e s LEU 52 Cb -0.01 -0.61 0.13 0.00 0.03 0.00 0.00 46.19 45.72 2k5e s LEU 52 CO 0.59 -0.33 0.47 0.21 0.23 0.00 0.00 176.35 177.52 2k5e s ASN 53 N -3.41 6.11 0.49 2.29 2.47 -1.26 -3.99 114.94 117.65 2k5e s ASN 53 Ca 0.28 -1.79 0.17 0.00 0.42 0.00 0.00 52.86 51.94 2k5e s ASN 53 Cb 0.03 -2.18 1.20 0.00 -1.45 0.00 0.00 41.25 38.85 2k5e s ASN 53 CO 0.11 -0.83 2.06 1.62 -3.72 0.00 0.00 177.10 176.34 2k5e h VAL 54 N 5.92 0.92 -0.50 -5.21 3.04 -1.92 -2.24 116.25 116.26 2k5e h VAL 54 Ca -0.29 -0.05 0.06 0.00 -1.01 0.00 0.00 66.70 65.41 2k5e h VAL 54 Cb 1.10 0.75 -0.05 0.00 -2.01 0.00 0.00 31.29 31.08 2k5e h VAL 54 CO 1.01 0.03 0.20 -0.33 -1.01 0.00 0.00 177.57 177.47 2k5e h GLU 55 N 0.15 0.39 -0.35 4.17 4.39 -2.00 0.14 114.58 121.48 2k5e h GLU 55 Ca 0.14 -0.02 -0.16 0.00 0.34 0.00 0.00 59.36 59.66 2k5e h GLU 55 Cb 0.37 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 2k5e h GLU 55 CO -0.02 0.26 -0.40 0.22 -1.16 0.00 0.00 179.01 177.91 2k5e h ASP 56 N 0.40 0.91 -0.31 1.42 3.58 -1.85 -2.80 116.42 117.78 2k5e h ASP 56 Ca 0.24 -0.42 0.00 0.00 0.42 0.00 0.00 57.03 57.27 2k5e h ASP 56 Cb 0.22 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 2k5e h ASP 56 CO -0.22 1.19 0.20 0.40 -2.88 0.00 0.00 179.24 177.94 2k5e h ILE 57 N 0.70 1.08 -0.78 2.25 2.04 -1.15 -2.33 117.51 119.31 2k5e h ILE 57 Ca 0.05 -0.14 0.08 0.00 1.00 0.00 0.00 64.86 65.85 2k5e h ILE 57 Cb 0.97 0.63 -0.07 0.00 -0.74 0.00 0.00 36.82 37.62 2k5e h ILE 57 CO 0.09 0.08 0.45 -0.07 0.00 0.00 0.00 178.15 178.70 2k5e h LEU 58 N 0.41 0.65 -0.05 1.44 3.38 -0.69 0.71 115.31 121.17 2k5e h LEU 58 Ca 0.11 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.16 2k5e h LEU 58 Cb -0.05 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.56 2k5e h LEU 58 CO -0.02 0.39 -0.31 -0.09 0.09 0.00 0.00 178.44 178.50 2k5e h ARG 59 N 0.78 -0.41 -0.17 1.13 2.43 -1.20 -0.73 114.38 116.21 2k5e h ARG 59 Ca 0.36 0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.49 2k5e h ARG 59 Cb 0.28 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2k5e h ARG 59 CO -0.22 -0.28 -0.22 0.22 -1.51 0.00 0.00 179.97 177.96 2k5e h ASP 60 N -0.43 0.29 0.07 -3.80 3.58 -0.82 -0.01 116.42 115.31 2k5e h ASP 60 Ca 0.07 -0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 2k5e h ASP 60 Cb 0.54 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2k5e h ASP 60 CO -0.29 0.53 -0.03 -0.07 -2.88 0.00 0.00 179.24 176.50 2k5e h LEU 61 N 0.27 -0.07 -1.32 2.28 3.38 -0.60 -3.10 115.31 116.15 2k5e h LEU 61 Ca 0.05 -0.33 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 2k5e h LEU 61 Cb 0.55 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 2k5e h LEU 61 CO 0.04 0.29 -0.31 0.78 0.09 0.00 0.00 178.44 179.33 2k5e h ASN 62 N -0.45 0.00 -0.42 -0.43 2.35 -1.02 -2.52 115.58 113.09 2k5e h ASN 62 Ca -0.01 0.00 0.12 0.00 -0.55 0.00 0.00 56.30 55.86 2k5e h ASN 62 Cb 0.40 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.75 2k5e h ASN 62 CO 0.01 0.31 0.32 0.00 -1.65 0.00 0.00 177.43 176.42 2k5e h ALA 63 N 1.69 2.34 0.00 -0.83 0.00 -0.92 0.65 119.26 122.19 2k5e h ALA 63 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2k5e h ALA 63 Cb 0.65 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 2k5e h ALA 63 CO 0.04 -0.53 -0.07 -0.07 0.00 0.00 0.00 179.25 178.62 2k5e h LEU 64 N 0.00 0.00 0.00 0.00 3.38 -1.41 -1.34 115.31 115.94 2k5e h LEU 64 Ca 0.20 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.92 2k5e h LEU 64 Cb 0.83 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.53 2k5e h LEU 64 CO -0.00 0.07 -2.15 0.00 0.09 0.00 0.00 178.44 176.45 2k5e n ALA 65 N -2.27 1.84 0.32 1.53 0.00 0.10 -4.45 120.51 117.59 2k5e n ALA 65 Ca -0.02 -1.01 0.12 0.00 0.00 0.00 0.00 53.44 52.53 2k5e n ALA 65 Cb 0.18 -0.27 0.21 0.00 0.00 0.00 0.00 19.45 19.58 2k5e n ALA 65 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2k5e h LEU 66 N 0.00 0.00 0.00 0.00 3.38 -1.05 -3.48 115.31 114.16 2k5e h LEU 66 Ca -0.37 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2k5e h LEU 66 Cb 1.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.56 2k5e h LEU 66 CO 0.02 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.93 2k5e n GLU 67 N -2.82 0.00 -0.69 1.13 1.02 -0.52 -4.78 120.64 113.98 2k5e n GLU 67 Ca 0.04 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.17 2k5e n GLU 67 Cb 0.50 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.92 2k5e n GLU 67 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 2k5e n HIS 68 N 0.00 -0.62 0.00 -0.32 1.44 -1.22 -4.55 115.22 109.95 2k5e n HIS 68 Ca 0.00 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.69 2k5e n HIS 68 Cb 0.00 -0.93 -0.01 0.00 0.12 0.00 0.00 29.99 29.17 2k5e n HIS 68 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 2k5e n HIS 69 N -0.73 0.00 0.29 -1.40 8.25 -1.26 -4.61 115.22 115.76 2k5e n HIS 69 Ca -0.01 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.56 2k5e n HIS 69 Cb 0.03 -0.11 0.49 0.00 1.12 0.00 0.00 29.99 31.52 2k5e n HIS 69 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k5e n HIS 70 N -3.35 0.69 -3.39 4.41 -0.00 -1.26 -4.40 115.22 107.92 2k5e n HIS 70 Ca -0.03 0.31 -0.14 0.00 -0.00 0.00 0.00 57.72 57.86 2k5e n HIS 70 Cb 0.11 -0.99 -0.09 0.00 -0.00 0.00 0.00 29.99 29.02 2k5e n HIS 70 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2k5e s HIS 71 N -3.37 -0.61 -0.27 1.57 5.04 -1.26 -5.12 115.29 111.26 2k5e s HIS 71 Ca 0.02 0.26 -0.07 0.00 -1.54 0.00 0.00 55.06 53.73 2k5e s HIS 71 Cb 0.08 -0.26 0.13 0.00 0.04 0.00 0.00 32.58 32.57 2k5e s HIS 71 CO 0.29 -0.82 0.55 -1.58 -2.34 0.00 0.00 174.74 170.85 2k5e s HIS 72 N 2.43 -1.20 -2.61 3.88 2.46 -1.26 -3.42 115.29 115.57 2k5e s HIS 72 Ca 0.10 1.85 0.27 0.00 0.47 0.00 0.00 55.06 57.75 2k5e s HIS 72 Cb -0.14 0.55 0.86 0.00 -0.13 0.00 0.00 32.58 33.72 2k5e s HIS 72 CO -0.24 -0.67 1.64 0.72 -2.47 0.00 0.00 174.74 173.72