#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5j n ASN 2 N 0.00 -5.50 -0.17 7.83 5.15 -1.26 -4.88 115.26 116.43 2k5j n ASN 2 Ca 0.00 -0.48 -0.08 0.00 -0.60 0.00 0.00 54.58 53.42 2k5j n ASN 2 Cb 0.00 -4.41 0.01 0.00 -0.53 0.00 0.00 39.78 34.85 2k5j n ASN 2 CO 0.00 0.00 0.00 -1.28 1.40 0.00 0.00 177.26 177.38 2k5j h SER 3 N -1.82 0.65 0.00 1.20 0.87 -2.09 -3.40 113.55 108.98 2k5j h SER 3 Ca -0.54 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 59.90 2k5j h SER 3 Cb 1.36 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 2k5j h SER 3 CO 0.59 0.60 -0.03 0.00 -0.53 0.00 0.00 176.83 177.45 2k5j n LEU 4 N -4.61 0.00 0.00 2.23 -0.00 -1.26 -5.04 117.00 108.32 2k5j n LEU 4 Ca 0.02 -0.62 0.00 0.00 -0.00 0.00 0.00 56.01 55.41 2k5j n LEU 4 Cb 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.53 2k5j n LEU 4 CO 0.37 0.57 0.00 0.00 -0.00 0.00 0.00 177.39 178.33 2k5j n ALA 5 N 0.00 1.20 -0.75 1.47 0.00 -1.26 -4.94 120.51 116.23 2k5j n ALA 5 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k5j n ALA 5 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 2k5j n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k5j n GLY 6 N 0.19 0.85 0.32 0.00 0.00 -1.26 -3.54 105.19 101.76 2k5j n GLY 6 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.62 2k5j n GLY 6 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2k5j n ILE 7 N 0.00 0.00 -2.39 -0.61 -5.35 -1.26 -4.76 119.36 104.99 2k5j n ILE 7 Ca 0.00 0.00 -0.14 0.00 -0.27 0.00 0.00 62.75 62.34 2k5j n ILE 7 Cb 0.00 -0.26 -0.01 0.00 -1.74 0.00 0.00 39.64 37.63 2k5j n ILE 7 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2k5j n ASP 8 N -0.05 -4.35 -0.08 7.28 8.00 -1.23 -4.69 116.55 121.42 2k5j n ASP 8 Ca 0.00 0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.65 2k5j n ASP 8 Cb 0.10 -3.68 0.00 0.00 -0.02 0.00 0.00 41.12 37.51 2k5j n ASP 8 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2k5j n MET 9 N -2.82 0.00 -3.10 -1.24 2.81 -1.26 -4.84 117.12 106.67 2k5j n MET 9 Ca -0.17 0.00 -0.19 0.00 -1.81 0.00 0.00 57.70 55.53 2k5j n MET 9 Cb 0.62 0.00 0.02 0.00 -0.71 0.00 0.00 33.22 33.15 2k5j n MET 9 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2k5j n GLY 10 N 0.00 2.55 2.98 3.03 0.00 -1.26 -5.13 105.19 107.36 2k5j n GLY 10 Ca 0.00 -2.25 -0.14 0.00 0.00 0.00 0.00 46.02 43.63 2k5j n GLY 10 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k5j s ARG 11 N -3.87 0.13 0.01 1.61 3.52 -1.26 -5.15 118.95 113.94 2k5j s ARG 11 Ca 0.32 0.69 -0.01 0.00 -0.13 0.00 0.00 55.73 56.60 2k5j s ARG 11 Cb -0.03 -0.09 -0.01 0.00 -1.56 0.00 0.00 34.95 33.26 2k5j s ARG 11 CO 0.20 -0.28 -0.01 0.42 -0.81 0.00 0.00 175.30 174.83 2k5j s ILE 12 N 2.27 0.07 -0.25 4.11 1.01 -1.26 -5.14 121.20 122.02 2k5j s ILE 12 Ca 0.00 -0.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.91 2k5j s ILE 12 Cb -0.12 -0.20 -0.05 0.00 0.01 0.00 0.00 42.46 42.11 2k5j s ILE 12 CO -0.08 -0.34 0.26 -0.76 0.00 0.00 0.00 174.94 174.02 2k5j s LEU 13 N -1.00 4.08 -0.22 2.97 1.02 -1.26 -5.07 118.68 119.21 2k5j s LEU 13 Ca -0.11 0.19 -0.08 0.00 0.02 0.00 0.00 54.13 54.15 2k5j s LEU 13 Cb -0.07 -2.25 -0.04 0.00 0.02 0.00 0.00 46.19 43.86 2k5j s LEU 13 CO -0.01 -0.04 0.08 -0.22 0.02 0.00 0.00 176.35 176.18 2k5j s LEU 14 N 1.50 3.71 -0.34 1.79 2.96 -1.26 -5.07 118.68 121.96 2k5j s LEU 14 Ca 0.11 -0.03 -0.09 0.00 -0.22 0.00 0.00 54.13 53.90 2k5j s LEU 14 Cb -0.15 -1.97 0.02 0.00 0.50 0.00 0.00 46.19 44.59 2k5j s LEU 14 CO 0.08 0.08 0.16 -1.81 -1.32 0.00 0.00 176.35 173.54 2k5j s ASP 15 N 0.94 5.55 0.03 3.68 -0.00 -1.26 -5.07 116.67 120.53 2k5j s ASP 15 Ca 0.04 -0.82 0.04 0.00 -0.00 0.00 0.00 52.55 51.81 2k5j s ASP 15 Cb -0.14 -1.98 -0.02 0.00 -0.00 0.00 0.00 42.92 40.78 2k5j s ASP 15 CO 0.03 -0.29 -0.12 -0.76 -0.00 0.00 0.00 175.17 174.03 2k5j s LEU 16 N 1.55 2.14 0.62 1.23 2.01 -1.26 -5.13 118.68 119.84 2k5j s LEU 16 Ca 0.03 -0.39 -0.19 0.00 0.01 0.00 0.00 54.13 53.59 2k5j s LEU 16 Cb -0.18 -0.51 -0.03 0.00 0.01 0.00 0.00 46.19 45.48 2k5j s LEU 16 CO 0.06 0.02 1.17 -1.20 1.01 0.00 0.00 176.35 177.41 2k5j n SER 17 N 2.09 1.63 -0.21 2.29 7.64 -1.26 -4.87 113.62 120.93 2k5j n SER 17 Ca -0.17 0.83 -0.00 0.00 1.01 0.00 0.00 58.87 60.54 2k5j n SER 17 Cb 0.55 -1.49 0.23 0.00 -1.01 0.00 0.00 64.21 62.49 2k5j n SER 17 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2k5j h ASN 18 N 0.60 0.86 -0.54 6.43 2.35 -2.00 -1.55 115.58 121.72 2k5j h ASN 18 Ca -0.50 -0.04 0.11 0.00 -0.55 0.00 0.00 56.30 55.32 2k5j h ASN 18 Cb 1.35 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 39.47 2k5j h ASN 18 CO 0.53 0.65 0.37 -0.08 -1.65 0.00 0.00 177.43 177.25 2k5j h GLU 19 N 1.00 0.25 -0.19 0.81 4.81 -2.01 -0.80 114.58 118.45 2k5j h GLU 19 Ca 0.26 -0.01 -0.17 0.00 -0.13 0.00 0.00 59.36 59.31 2k5j h GLU 19 Cb -0.06 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.27 2k5j h GLU 19 CO -0.05 0.16 -0.54 0.28 -0.73 0.00 0.00 179.01 178.13 2k5j h VAL 20 N 0.25 1.31 -0.97 0.32 2.07 -1.63 -3.08 116.25 114.52 2k5j h VAL 20 Ca 0.26 -1.77 0.16 0.00 0.82 0.00 0.00 66.70 66.17 2k5j h VAL 20 Cb 0.67 1.91 -0.09 0.00 -1.52 0.00 0.00 31.29 32.26 2k5j h VAL 20 CO -0.05 0.55 0.61 0.40 0.02 0.00 0.00 177.57 179.10 2k5j h ILE 21 N 0.39 0.80 -0.67 4.57 2.04 -1.00 0.23 117.51 123.87 2k5j h ILE 21 Ca -0.01 -0.27 -0.08 0.00 1.00 0.00 0.00 64.86 65.50 2k5j h ILE 21 Cb 1.16 -0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.16 2k5j h ILE 21 CO 0.12 0.14 0.12 0.50 0.00 0.00 0.00 178.15 179.03 2k5j h LYS 22 N 0.78 1.10 -0.23 2.37 3.64 -1.44 0.14 116.57 122.92 2k5j h LYS 22 Ca 0.51 -0.29 -0.03 0.00 -1.27 0.00 0.00 60.65 59.58 2k5j h LYS 22 Cb 0.77 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 2k5j h LYS 22 CO -0.28 1.00 0.05 1.96 -2.27 0.00 0.00 179.45 179.90 2k5j h GLN 23 N 1.02 0.38 -0.67 1.90 4.20 -0.60 -1.78 115.11 119.57 2k5j h GLN 23 Ca 0.20 -0.10 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 2k5j h GLN 23 Cb 0.43 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 2k5j h GLN 23 CO 0.01 0.51 0.20 -0.07 -0.67 0.00 0.00 178.83 178.81 2k5j h LEU 24 N 0.20 0.98 -0.07 1.46 3.38 -0.67 -1.91 115.31 118.67 2k5j h LEU 24 Ca 0.07 -0.21 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2k5j h LEU 24 Cb 0.30 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2k5j h LEU 24 CO 0.00 0.93 -0.03 -0.78 0.09 0.00 0.00 178.44 178.65 2k5j h ASP 25 N 0.97 -0.11 -0.54 -0.43 3.58 -0.57 0.82 116.42 120.14 2k5j h ASP 25 Ca 0.21 0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.72 2k5j h ASP 25 Cb 0.30 0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.39 2k5j h ASP 25 CO -0.01 -0.05 0.33 -0.78 -2.88 0.00 0.00 179.24 175.86 2k5j h ASP 26 N -0.03 0.54 0.02 2.28 -0.00 -1.18 0.01 116.42 118.05 2k5j h ASP 26 Ca 0.04 0.00 -0.10 0.00 -0.00 0.00 0.00 57.03 56.97 2k5j h ASP 26 Cb 0.09 -0.12 -0.01 0.00 -0.00 0.00 0.00 39.33 39.29 2k5j h ASP 26 CO -0.09 0.38 -0.31 -0.07 -0.00 0.00 0.00 179.24 179.15 2k5j h LEU 27 N 0.66 0.44 -0.55 2.28 3.38 -0.92 -2.70 115.31 117.91 2k5j h LEU 27 Ca 0.21 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 2k5j h LEU 27 Cb 0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2k5j h LEU 27 CO -0.09 0.74 -0.18 -0.08 0.09 0.00 0.00 178.44 178.92 2k5j h GLU 28 N 0.38 0.97 -0.37 1.13 4.81 0.15 -2.39 114.58 119.25 2k5j h GLU 28 Ca 0.05 -0.39 -0.05 0.00 -0.13 0.00 0.00 59.36 58.83 2k5j h GLU 28 Cb 0.74 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 2k5j h GLU 28 CO 0.06 1.07 0.04 0.28 -0.73 0.00 0.00 179.01 179.72 2k5j h VAL 29 N 0.85 1.25 -0.55 0.32 2.07 -0.90 0.39 116.25 119.68 2k5j h VAL 29 Ca 0.12 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 2k5j h VAL 29 Cb 0.75 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 2k5j h VAL 29 CO 0.06 0.30 0.33 1.56 0.02 0.00 0.00 177.57 179.85 2k5j h GLN 30 N 0.47 0.75 0.00 1.57 4.20 -1.42 -1.54 115.11 119.13 2k5j h GLN 30 Ca 0.11 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2k5j h GLN 30 Cb 0.40 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.02 2k5j h GLN 30 CO 0.01 0.54 0.00 0.00 -0.67 0.00 0.00 178.83 178.71 2k5j h ARG 31 N 0.74 0.00 -4.38 1.46 3.08 -1.34 -3.46 114.38 110.48 2k5j h ARG 31 Ca 0.20 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.88 2k5j h ARG 31 Cb -0.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 2k5j h ARG 31 CO -0.04 0.00 -0.53 0.09 -1.07 0.00 0.00 179.97 178.42 2k5j n ASN 32 N -2.58 -5.07 -4.31 7.04 5.03 0.11 -4.96 115.26 110.52 2k5j n ASN 32 Ca 0.03 -0.18 -0.18 0.00 0.87 0.00 0.00 54.58 55.12 2k5j n ASN 32 Cb 0.38 -4.17 -0.10 0.00 -1.02 0.00 0.00 39.78 34.86 2k5j n ASN 32 CO 0.00 0.00 0.00 -1.48 -1.83 0.00 0.00 177.26 173.95 2k5j s LEU 33 N -6.34 2.50 0.43 3.41 2.34 -1.13 -5.05 118.68 114.84 2k5j s LEU 33 Ca 0.22 -0.95 -0.26 0.00 0.06 0.00 0.00 54.13 53.20 2k5j s LEU 33 Cb -0.11 -0.63 -0.09 0.00 -0.56 0.00 0.00 46.19 44.80 2k5j s LEU 33 CO 0.28 -0.16 1.44 -2.16 -1.06 0.00 0.00 176.35 174.68 2k5j s PRO 34 N -3.32 3.81 0.20 1.48 0.04 -1.26 -4.77 135.00 131.18 2k5j s PRO 34 Ca 0.18 2.45 -0.11 0.00 0.04 0.00 0.00 61.00 63.56 2k5j s PRO 34 Cb -0.02 -2.75 0.13 0.00 0.04 0.00 0.00 34.50 31.91 2k5j s PRO 34 CO 0.05 -0.73 1.84 -0.09 0.04 0.00 0.00 177.00 178.12 2k5j h ARG 35 N 2.52 0.95 -1.04 4.56 2.43 -1.96 -2.15 114.38 119.70 2k5j h ARG 35 Ca -0.51 -0.08 0.27 0.00 -0.81 0.00 0.00 59.98 58.84 2k5j h ARG 35 Cb 1.26 -0.20 -0.11 0.00 -0.42 0.00 0.00 29.97 30.50 2k5j h ARG 35 CO 0.62 0.67 0.64 0.00 -1.51 0.00 0.00 179.97 180.40 2k5j h ALA 36 N 1.22 2.07 -0.51 2.80 0.00 -2.00 0.62 119.26 123.46 2k5j h ALA 36 Ca 0.25 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.17 2k5j h ALA 36 Cb -0.04 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2k5j h ALA 36 CO -0.05 -0.52 -0.03 0.22 0.00 0.00 0.00 179.25 178.88 2k5j h ASP 37 N 0.46 0.87 -0.43 0.00 1.82 -1.76 -1.49 116.42 115.88 2k5j h ASP 37 Ca 0.63 -0.24 -0.07 0.00 -0.39 0.00 0.00 57.03 56.96 2k5j h ASP 37 Cb 1.44 -0.23 -0.02 0.00 0.68 0.00 0.00 39.33 41.20 2k5j h ASP 37 CO -0.38 0.95 0.01 -0.07 -1.61 0.00 0.00 179.24 178.13 2k5j h LEU 38 N 0.82 0.74 -0.33 2.28 3.38 0.23 -1.84 115.31 120.59 2k5j h LEU 38 Ca 0.15 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 2k5j h LEU 38 Cb 0.53 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2k5j h LEU 38 CO 0.03 0.86 0.11 -0.07 0.09 0.00 0.00 178.44 179.46 2k5j h LEU 39 N 0.60 0.48 -0.66 1.67 3.38 -0.98 -0.89 115.31 118.91 2k5j h LEU 39 Ca 0.12 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.92 2k5j h LEU 39 Cb 0.48 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 2k5j h LEU 39 CO 0.02 0.54 0.42 -0.09 0.09 0.00 0.00 178.44 179.42 2k5j h ARG 40 N 0.38 0.81 -0.59 1.13 2.43 -1.21 -1.75 114.38 115.58 2k5j h ARG 40 Ca 0.11 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.19 2k5j h ARG 40 Cb 0.23 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 2k5j h ARG 40 CO -0.00 0.54 0.21 0.93 -1.51 0.00 0.00 179.97 180.13 2k5j h GLU 41 N 0.84 0.91 -0.42 0.20 4.39 -1.13 0.26 114.58 119.63 2k5j h GLU 41 Ca 0.25 -0.18 0.04 0.00 0.34 0.00 0.00 59.36 59.81 2k5j h GLU 41 Cb -0.03 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 28.44 2k5j h GLU 41 CO -0.08 0.80 0.18 0.00 -1.16 0.00 0.00 179.01 178.75 2k5j h ALA 42 N 1.07 0.51 0.11 3.43 0.00 -0.61 0.52 119.26 124.29 2k5j h ALA 42 Ca 0.19 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2k5j h ALA 42 Cb 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2k5j h ALA 42 CO -0.01 -0.19 -0.05 0.28 0.00 0.00 0.00 179.25 179.27 2k5j h VAL 43 N 0.37 1.10 -0.59 0.00 2.07 -1.12 -2.84 116.25 115.23 2k5j h VAL 43 Ca 0.19 -1.14 0.10 0.00 0.82 0.00 0.00 66.70 66.66 2k5j h VAL 43 Cb 0.13 1.78 -0.07 0.00 -1.52 0.00 0.00 31.29 31.60 2k5j h VAL 43 CO -0.16 0.26 0.20 -0.78 0.02 0.00 0.00 177.57 177.11 2k5j h ASP 44 N -0.71 0.17 -0.85 0.57 3.58 -0.36 -0.11 116.42 118.71 2k5j h ASP 44 Ca -0.01 0.08 0.10 0.00 0.42 0.00 0.00 57.03 57.62 2k5j h ASP 44 Cb 0.54 0.08 -0.08 0.00 1.72 0.00 0.00 39.33 41.59 2k5j h ASP 44 CO 0.02 0.10 0.50 1.56 -2.88 0.00 0.00 179.24 178.54 2k5j h GLN 45 N 0.37 0.80 -0.64 0.28 1.08 0.01 -0.48 115.11 116.52 2k5j h GLN 45 Ca 0.30 -0.05 -0.05 0.00 -1.45 0.00 0.00 58.65 57.40 2k5j h GLN 45 Cb 0.39 -0.18 -0.03 0.00 -0.05 0.00 0.00 27.48 27.61 2k5j h GLN 45 CO -0.32 0.53 0.20 -0.92 -0.95 0.00 0.00 178.83 177.36 2k5j h TYR 46 N 0.82 1.04 -0.69 2.96 3.20 -0.81 -2.65 116.97 120.83 2k5j h TYR 46 Ca 0.41 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 62.14 2k5j h TYR 46 Cb 0.38 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.32 2k5j h TYR 46 CO -0.05 0.85 0.30 -0.07 -1.64 0.00 0.00 178.16 177.54 2k5j h LEU 47 N 0.93 0.91 -0.60 2.82 3.38 0.03 -2.26 115.31 120.51 2k5j h LEU 47 Ca 0.21 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2k5j h LEU 47 Cb 0.30 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 2k5j h LEU 47 CO -0.01 0.79 0.37 0.40 0.09 0.00 0.00 178.44 180.08 2k5j h ILE 48 N 0.99 1.17 0.28 1.22 2.04 -0.80 -1.99 117.51 120.42 2k5j h ILE 48 Ca 0.24 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 2k5j h ILE 48 Cb 0.15 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2k5j h ILE 48 CO -0.03 0.18 -0.13 -1.13 0.00 0.00 0.00 178.15 177.04 2k5j h ASN 49 N 0.81 -0.32 0.00 1.72 -1.24 -1.23 -2.32 115.58 113.00 2k5j h ASN 49 Ca 0.21 -0.14 0.00 0.00 0.71 0.00 0.00 56.30 57.09 2k5j h ASN 49 Cb -0.03 0.08 0.00 0.00 0.73 0.00 0.00 38.32 39.10 2k5j h ASN 49 CO -0.04 -0.04 0.00 0.00 -1.29 0.00 0.00 177.43 176.06 2k5j n GLN 50 N -5.16 0.68 0.00 6.67 -0.00 -0.88 -3.00 117.38 115.69 2k5j n GLN 50 Ca -0.10 0.00 0.13 0.00 -0.00 0.00 0.00 57.00 57.03 2k5j n GLN 50 Cb 0.23 -1.34 0.39 0.00 -0.00 0.00 0.00 30.24 29.53 2k5j n GLN 50 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 2k5j n SER 51 N 0.17 0.50 -4.74 2.61 3.41 -0.76 -4.85 113.62 109.96 2k5j n SER 51 Ca 0.00 -0.28 -0.41 0.00 -0.26 0.00 0.00 58.87 57.92 2k5j n SER 51 Cb 0.17 0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 2k5j n SER 51 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2k5j s GLN 52 N -2.83 4.47 -0.65 4.33 2.00 -1.16 -3.95 119.66 121.87 2k5j s GLN 52 Ca 0.17 1.93 -0.15 0.00 -2.00 0.00 0.00 55.36 55.31 2k5j s GLN 52 Cb 0.18 -3.21 0.02 0.00 0.80 0.00 0.00 33.01 30.80 2k5j s GLN 52 CO 0.60 -0.11 0.64 0.25 -0.50 0.00 0.00 175.29 176.17 2k5j n THR 53 N 2.34 -5.39 -3.08 -0.34 -2.24 -1.26 -4.88 114.28 99.43 2k5j n THR 53 Ca 0.04 0.09 -0.42 0.00 -2.27 0.00 0.00 64.05 61.49 2k5j n THR 53 Cb 0.44 -4.20 -0.06 0.00 -2.10 0.00 0.00 70.33 64.40 2k5j n THR 53 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k5j s ALA 54 N -2.45 3.43 0.26 6.98 0.00 -1.25 -4.93 121.76 123.79 2k5j s ALA 54 Ca 0.15 -0.86 -0.03 0.00 0.00 0.00 0.00 51.96 51.23 2k5j s ALA 54 Cb -0.02 -3.23 0.32 0.00 0.00 0.00 0.00 23.12 20.18 2k5j s ALA 54 CO 0.86 -1.44 1.79 0.00 0.00 0.00 0.00 175.76 176.97 2k5j h ARG 55 N 8.53 0.91 -5.88 0.00 3.08 -1.96 -3.48 114.38 115.57 2k5j h ARG 55 Ca -0.26 -0.20 -0.10 0.00 0.07 0.00 0.00 59.98 59.49 2k5j h ARG 55 Cb 1.10 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 31.03 2k5j h ARG 55 CO 0.86 0.82 -0.95 0.25 -1.07 0.00 0.00 179.97 179.89 2k5j n THR 56 N -4.25 -6.96 -2.19 2.04 -2.24 -1.26 -4.89 114.28 94.52 2k5j n THR 56 Ca 0.04 0.81 -0.37 0.00 -2.27 0.00 0.00 64.05 62.26 2k5j n THR 56 Cb 0.24 -5.05 -0.00 0.00 -2.10 0.00 0.00 70.33 63.42 2k5j n THR 56 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2k5j s SER 57 N -1.63 5.96 0.64 3.42 0.01 -1.26 -4.95 113.70 115.88 2k5j s SER 57 Ca 0.16 2.34 -0.17 0.00 1.31 0.00 0.00 55.95 59.59 2k5j s SER 57 Cb -0.03 -2.60 -0.07 0.00 0.21 0.00 0.00 66.02 63.53 2k5j s SER 57 CO 0.59 -1.06 0.47 1.33 0.41 0.00 0.00 173.24 174.98 2k5j n VAL 58 N -0.71 1.96 -1.08 3.43 0.24 -1.26 -4.86 118.33 116.04 2k5j n VAL 58 Ca 0.08 -0.46 -0.36 0.00 -2.04 0.00 0.00 64.34 61.56 2k5j n VAL 58 Cb 0.48 -0.67 0.06 0.00 -1.47 0.00 0.00 33.84 32.24 2k5j n VAL 58 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2k5j n PRO 59 N -0.20 0.03 -3.31 7.34 -0.02 -1.26 -5.01 135.00 132.57 2k5j n PRO 59 Ca 0.11 0.03 -0.08 0.00 -2.02 0.00 0.00 63.50 61.53 2k5j n PRO 59 Cb 0.49 -1.37 -0.06 0.00 -0.02 0.00 0.00 33.50 32.53 2k5j n PRO 59 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2k5j s GLY 60 N -1.30 -0.55 -0.18 -1.23 0.00 -1.26 -5.14 107.32 97.65 2k5j s GLY 60 Ca 0.53 0.48 -0.06 0.00 0.00 0.00 0.00 44.72 45.68 2k5j s GLY 60 CO 0.70 2.96 0.02 -0.42 0.00 0.00 0.00 173.10 176.36 2k5j s ILE 61 N 2.56 4.29 -0.23 0.90 -1.09 -1.26 -4.95 121.20 121.41 2k5j s ILE 61 Ca 0.11 -0.21 0.14 0.00 -2.23 0.00 0.00 60.65 58.47 2k5j s ILE 61 Cb -0.13 -2.93 0.37 0.00 -1.58 0.00 0.00 42.46 38.19 2k5j s ILE 61 CO -0.26 0.45 1.32 -2.67 -1.23 0.00 0.00 174.94 172.55 2k5j n TRP 62 N 3.80 -0.75 -2.28 3.97 2.14 -1.26 -5.12 117.44 117.94 2k5j n TRP 62 Ca -0.17 -1.51 -0.41 0.00 2.07 0.00 0.00 57.50 57.48 2k5j n TRP 62 Cb 0.52 0.81 -0.03 0.00 -0.81 0.00 0.00 31.31 31.80 2k5j n TRP 62 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 2k5j s GLN 63 N -0.85 4.41 -0.32 -2.67 -0.21 -1.26 -4.97 119.66 113.79 2k5j s GLN 63 Ca 0.14 1.97 -0.09 0.00 0.02 0.00 0.00 55.36 57.39 2k5j s GLN 63 Cb 0.34 -3.24 0.19 0.00 1.00 0.00 0.00 33.01 31.30 2k5j s GLN 63 CO -0.09 -0.23 1.02 0.20 -2.12 0.00 0.00 175.29 174.07 2k5j s GLY 64 N 0.50 -1.33 -0.26 3.09 0.00 -1.26 -5.13 107.32 102.92 2k5j s GLY 64 Ca 0.57 1.50 -0.01 0.00 0.00 0.00 0.00 44.72 46.78 2k5j s GLY 64 CO 0.35 4.21 0.37 0.00 0.00 0.00 0.00 173.10 178.03 2k5j n GLU 66 N 5.35 0.55 0.00 0.00 0.00 -1.26 -4.89 120.64 120.39 2k5j n GLU 66 Ca -0.02 0.22 0.00 0.00 0.00 0.00 0.00 57.16 57.35 2k5j n GLU 66 Cb 0.49 -1.80 0.00 0.00 0.00 0.00 0.00 31.44 30.13 2k5j n GLU 66 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 2k5j n GLU 67 N -0.33 2.21 -1.92 3.44 2.13 -1.26 -5.10 120.64 119.81 2k5j n GLU 67 Ca 0.12 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.52 2k5j n GLU 67 Cb 0.48 -0.20 -0.02 0.00 0.27 0.00 0.00 31.44 31.96 2k5j n GLU 67 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 2k5j s ASP 68 N -0.10 6.56 -0.30 4.31 2.15 -1.26 -4.98 116.67 123.06 2k5j s ASP 68 Ca 0.00 2.72 -0.19 0.00 0.43 0.00 0.00 52.55 55.51 2k5j s ASP 68 Cb 0.00 -2.62 0.20 0.00 -0.30 0.00 0.00 42.92 40.20 2k5j s ASP 68 CO 0.00 -0.80 1.29 -0.83 -0.17 0.00 0.00 175.17 174.66 2k5j s GLY 69 N 0.66 0.34 0.11 2.66 0.00 -1.26 -5.18 107.32 104.65 2k5j s GLY 69 Ca 0.64 3.69 0.01 0.00 0.00 0.00 0.00 44.72 49.06 2k5j s GLY 69 CO 0.40 3.30 -0.02 -1.34 0.00 0.00 0.00 173.10 175.44 2k5j s VAL 70 N 1.90 0.51 -0.21 1.40 -7.23 -1.26 -5.15 120.40 110.36 2k5j s VAL 70 Ca -0.01 -1.92 -0.06 0.00 -1.81 0.00 0.00 61.98 58.18 2k5j s VAL 70 Cb -0.01 -1.82 0.10 0.00 0.56 0.00 0.00 36.38 35.21 2k5j s VAL 70 CO -0.15 -0.73 0.43 -0.70 -0.31 0.00 0.00 175.10 173.64 2k5j s GLU 71 N -3.90 0.35 -0.15 4.82 2.12 -1.26 -5.15 118.70 115.52 2k5j s GLU 71 Ca 0.16 0.99 -0.09 0.00 0.36 0.00 0.00 54.97 56.40 2k5j s GLU 71 Cb 0.06 0.26 -0.04 0.00 0.26 0.00 0.00 34.13 34.67 2k5j s GLU 71 CO -0.02 -0.31 0.14 0.71 -0.54 0.00 0.00 175.26 175.24 2k5j s TYR 72 N 2.63 3.51 -0.11 5.30 1.51 -1.26 -5.02 117.35 123.92 2k5j s TYR 72 Ca 0.01 0.45 -0.13 0.00 -1.01 0.00 0.00 57.07 56.39 2k5j s TYR 72 Cb -0.13 -2.05 -0.11 0.00 -0.11 0.00 0.00 41.96 39.57 2k5j s TYR 72 CO -0.14 0.53 0.37 1.96 -1.11 0.00 0.00 175.55 177.16 2k5j h GLN 73 N 5.77 -0.04 -6.04 -0.62 1.08 -2.09 -3.49 115.11 109.68 2k5j h GLN 73 Ca -0.48 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 56.44 2k5j h GLN 73 Cb 1.19 0.01 0.03 0.00 -0.05 0.00 0.00 27.48 28.66 2k5j h GLN 73 CO 0.66 0.35 -0.63 0.54 -0.95 0.00 0.00 178.83 178.80 2k5j n ARG 74 N -4.75 -1.39 -2.17 1.46 1.74 -1.26 -4.88 116.66 105.41 2k5j n ARG 74 Ca -0.04 0.96 -0.41 0.00 -0.77 0.00 0.00 57.85 57.58 2k5j n ARG 74 Cb 0.20 -4.23 -0.03 0.00 -1.02 0.00 0.00 32.46 27.38 2k5j n ARG 74 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2k5j s LYS 75 N -4.48 4.37 0.06 5.56 2.47 -1.26 -4.98 119.74 121.47 2k5j s LYS 75 Ca 0.15 2.12 -0.28 0.00 -1.56 0.00 0.00 55.97 56.39 2k5j s LYS 75 Cb -0.05 -3.16 -0.05 0.00 -1.46 0.00 0.00 37.83 33.11 2k5j s LYS 75 CO 0.83 -0.27 0.91 -0.51 0.16 0.00 0.00 175.35 176.46 2k5j s LEU 76 N -0.36 4.44 -0.18 5.43 2.01 -1.26 -5.04 118.68 123.72 2k5j s LEU 76 Ca 0.56 1.65 -0.11 0.00 0.01 0.00 0.00 54.13 56.23 2k5j s LEU 76 Cb -0.38 -3.47 -0.05 0.00 0.01 0.00 0.00 46.19 42.30 2k5j s LEU 76 CO 0.41 -0.10 0.19 -0.60 1.01 0.00 0.00 176.35 177.26 2k5j s ARG 77 N 0.30 4.20 0.39 1.70 6.06 -1.26 -5.07 118.95 125.26 2k5j s ARG 77 Ca 0.46 -0.10 -0.25 0.00 -2.50 0.00 0.00 55.73 53.34 2k5j s ARG 77 Cb -0.22 -3.42 -0.09 0.00 0.06 0.00 0.00 34.95 31.29 2k5j s ARG 77 CO 0.27 0.29 1.08 -1.21 -2.50 0.00 0.00 175.30 173.22 2k5j s GLU 78 N 0.37 4.19 0.15 5.12 8.01 -1.26 -5.06 118.70 130.23 2k5j s GLU 78 Ca 0.11 1.60 0.01 0.00 0.01 0.00 0.00 54.97 56.70 2k5j s GLU 78 Cb -0.12 -2.64 0.01 0.00 -4.31 0.00 0.00 34.13 27.07 2k5j s GLU 78 CO 0.00 -0.14 0.05 0.39 0.01 0.00 0.00 175.26 175.58 2k5j n GLU 79 N 0.09 1.48 0.00 1.61 1.02 -1.26 -5.35 120.64 118.24 2k5j n GLU 79 Ca 0.04 -1.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.18 2k5j n GLU 79 Cb 0.48 0.20 0.00 0.00 -0.02 0.00 0.00 31.44 32.11 2k5j n GLU 79 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22