#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 0.00 -2.73 7.83 5.15 -1.26 -4.80 115.26 119.45 2k5j n ASN 2 Ca 0.00 0.00 -0.04 0.00 -0.60 0.00 0.00 54.58 53.94 2k5j n ASN 2 Cb 0.00 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.21 2k5j n ASN 2 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2k5j n SER 3 N 0.78 -2.30 0.00 1.20 7.64 -1.26 -3.94 113.62 115.75 2k5j n SER 3 Ca 0.00 1.25 0.00 0.00 1.01 0.00 0.00 58.87 61.13 2k5j n SER 3 Cb 0.00 -4.32 0.00 0.00 -1.01 0.00 0.00 64.21 58.88 2k5j n SER 3 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2k5j n LEU 4 N 1.92 0.00 -0.84 -3.43 4.77 -1.26 -4.88 117.00 113.28 2k5j n LEU 4 Ca -0.32 0.00 0.10 0.00 -0.03 0.00 0.00 56.01 55.76 2k5j n LEU 4 Cb 0.49 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.55 2k5j n LEU 4 CO 0.30 0.00 -0.18 0.00 -1.33 0.00 0.00 177.39 176.19 2k5j n ALA 5 N 2.29 -2.91 0.00 -1.18 0.00 -1.25 -5.02 120.51 112.44 2k5j n ALA 5 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.72 2k5j n ALA 5 Cb 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 -2.71 -0.22 0.23 0.00 0.00 -1.26 -5.02 105.19 96.20 2k5j n GLY 6 Ca -0.01 -0.22 0.12 0.00 0.00 0.00 0.00 46.02 45.92 2k5j n GLY 6 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2k5j n ILE 7 N 0.00 0.05 -0.45 -0.61 -0.00 -1.26 -3.19 119.36 113.90 2k5j n ILE 7 Ca 0.00 -0.13 0.08 0.00 -0.00 0.00 0.00 62.75 62.70 2k5j n ILE 7 Cb 0.00 -0.03 0.24 0.00 -0.00 0.00 0.00 39.64 39.85 2k5j n ILE 7 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 2k5j n ASP 8 N -0.39 3.65 -4.63 4.38 10.43 -1.26 -4.95 116.55 123.78 2k5j n ASP 8 Ca 0.18 -2.28 -0.43 0.00 2.57 0.00 0.00 54.79 54.83 2k5j n ASP 8 Cb 0.20 -0.40 -0.02 0.00 1.84 0.00 0.00 41.12 42.73 2k5j n ASP 8 CO 0.00 0.00 0.00 -0.04 -1.07 0.00 0.00 177.20 176.09 2k5j s MET 9 N -1.51 3.89 0.07 -1.24 -1.94 -1.19 -4.98 119.30 112.39 2k5j s MET 9 Ca 0.36 1.22 -0.31 0.00 -1.71 0.00 0.00 55.69 55.26 2k5j s MET 9 Cb 0.23 -3.89 -0.06 0.00 2.01 0.00 0.00 34.83 33.11 2k5j s MET 9 CO 0.19 -1.16 1.28 0.20 -0.01 0.00 0.00 175.02 175.52 2k5j s GLY 10 N 2.90 2.22 0.26 -0.03 0.00 -1.26 -5.01 107.32 106.39 2k5j s GLY 10 Ca 0.57 0.94 -0.21 0.00 0.00 0.00 0.00 44.72 46.02 2k5j s GLY 10 CO 0.24 2.18 0.78 0.50 0.00 0.00 0.00 173.10 176.80 2k5j s ARG 11 N 1.19 4.31 0.02 2.90 1.81 -1.26 -5.08 118.95 122.85 2k5j s ARG 11 Ca 0.61 0.97 0.00 0.00 -1.72 0.00 0.00 55.73 55.59 2k5j s ARG 11 Cb -0.32 -2.81 -0.02 0.00 -0.45 0.00 0.00 34.95 31.35 2k5j s ARG 11 CO 0.29 0.34 -0.03 0.42 -0.68 0.00 0.00 175.30 175.64 2k5j s ILE 12 N -1.59 0.16 -0.22 1.52 1.01 -1.26 -5.14 121.20 115.68 2k5j s ILE 12 Ca 0.46 -0.89 -0.15 0.00 0.00 0.00 0.00 60.65 60.07 2k5j s ILE 12 Cb -0.16 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 41.97 2k5j s ILE 12 CO 0.21 -0.46 0.36 -0.76 0.00 0.00 0.00 174.94 174.29 2k5j s LEU 13 N -1.40 4.12 -0.13 2.97 2.01 -1.26 -5.06 118.68 119.92 2k5j s LEU 13 Ca -0.14 0.41 -0.00 0.00 0.01 0.00 0.00 54.13 54.40 2k5j s LEU 13 Cb -0.10 -2.44 -0.02 0.00 0.01 0.00 0.00 46.19 43.65 2k5j s LEU 13 CO -0.01 -0.09 -0.13 -0.76 1.01 0.00 0.00 176.35 176.37 2k5j s LEU 14 N 1.48 2.71 -0.38 1.79 2.01 -1.26 -5.09 118.68 119.93 2k5j s LEU 14 Ca 0.17 -0.32 -0.13 0.00 0.01 0.00 0.00 54.13 53.85 2k5j s LEU 14 Cb -0.15 -1.61 0.02 0.00 0.01 0.00 0.00 46.19 44.46 2k5j s LEU 14 CO 0.08 0.17 0.26 -1.81 1.01 0.00 0.00 176.35 176.06 2k5j s ASP 15 N 0.31 5.96 -0.06 2.29 -0.00 -1.26 -5.06 116.67 118.85 2k5j s ASP 15 Ca -0.10 -0.85 0.04 0.00 -0.00 0.00 0.00 52.55 51.64 2k5j s ASP 15 Cb -0.16 -2.11 0.00 0.00 -0.00 0.00 0.00 42.92 40.66 2k5j s ASP 15 CO 0.06 -0.39 -0.19 -0.76 -0.00 0.00 0.00 175.17 173.89 2k5j s LEU 16 N 1.64 1.91 0.78 1.23 1.43 -1.26 -5.12 118.68 119.29 2k5j s LEU 16 Ca 0.04 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 52.59 2k5j s LEU 16 Cb -0.19 -1.08 0.05 0.00 0.03 0.00 0.00 46.19 45.00 2k5j s LEU 16 CO 0.09 0.14 1.06 -1.20 0.23 0.00 0.00 176.35 176.67 2k5j n SER 17 N 3.35 0.62 -0.17 2.29 7.64 -1.26 -4.82 113.62 121.27 2k5j n SER 17 Ca -0.19 0.60 0.01 0.00 1.01 0.00 0.00 58.87 60.31 2k5j n SER 17 Cb 0.53 -1.45 0.29 0.00 -1.01 0.00 0.00 64.21 62.56 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 -0.67 0.77 -0.75 6.43 -0.26 -2.00 -1.42 115.58 117.67 2k5j h ASN 18 Ca -0.47 -0.02 0.09 0.00 -0.56 0.00 0.00 56.30 55.34 2k5j h ASN 18 Cb 1.31 -0.19 -0.05 0.00 -1.06 0.00 0.00 38.32 38.33 2k5j h ASN 18 CO 0.46 0.56 0.49 -0.33 -1.06 0.00 0.00 177.43 177.55 2k5j h GLU 19 N 0.91 0.68 -0.28 0.81 3.07 -2.01 -1.59 114.58 116.18 2k5j h GLU 19 Ca 0.25 -0.04 -0.11 0.00 -0.50 0.00 0.00 59.36 58.96 2k5j h GLU 19 Cb -0.10 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 27.65 2k5j h GLU 19 CO -0.05 0.45 -0.25 0.28 -1.40 0.00 0.00 179.01 178.04 2k5j h VAL 20 N 0.70 1.31 -0.96 3.13 2.07 -1.60 -3.00 116.25 117.89 2k5j h VAL 20 Ca 0.34 -1.41 0.15 0.00 0.82 0.00 0.00 66.70 66.60 2k5j h VAL 20 Cb 0.41 1.60 -0.09 0.00 -1.52 0.00 0.00 31.29 31.68 2k5j h VAL 20 CO -0.12 0.45 0.58 0.40 0.02 0.00 0.00 177.57 178.89 2k5j h ILE 21 N 0.39 0.81 -0.76 4.57 1.08 -1.06 0.19 117.51 122.72 2k5j h ILE 21 Ca 0.05 -0.28 -0.05 0.00 -0.39 0.00 0.00 64.86 64.18 2k5j h ILE 21 Cb 0.81 -0.10 -0.03 0.00 -3.07 0.00 0.00 36.82 34.43 2k5j h ILE 21 CO 0.06 0.15 0.26 0.11 -0.69 0.00 0.00 178.15 178.05 2k5j h LYS 22 N 0.83 1.16 -0.19 2.37 1.57 -1.41 -1.24 116.57 119.66 2k5j h LYS 22 Ca 0.51 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 2k5j h LYS 22 Cb 0.66 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 2k5j h LYS 22 CO -0.33 0.97 0.04 1.96 -0.57 0.00 0.00 179.45 181.52 2k5j h GLN 23 N 1.11 0.32 -0.61 3.15 4.20 -0.62 -1.82 115.11 120.84 2k5j h GLN 23 Ca 0.25 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.91 2k5j h GLN 23 Cb 0.27 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 2k5j h GLN 23 CO -0.01 0.47 0.37 -0.07 -0.67 0.00 0.00 178.83 178.91 2k5j h LEU 24 N 0.12 0.58 -1.35 1.46 3.38 -0.59 -1.02 115.31 117.88 2k5j h LEU 24 Ca 0.06 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2k5j h LEU 24 Cb 0.30 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2k5j h LEU 24 CO 0.00 0.40 0.15 -0.78 0.09 0.00 0.00 178.44 178.31 2k5j h ASP 25 N 0.71 0.54 0.02 -0.43 3.58 -1.10 1.19 116.42 120.93 2k5j h ASP 25 Ca 0.25 -0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.64 2k5j h ASP 25 Cb 0.06 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 40.97 2k5j h ASP 25 CO -0.12 0.50 -0.01 -0.78 -2.88 0.00 0.00 179.24 175.95 2k5j h ASP 26 N 0.59 -0.02 1.09 2.28 3.58 -0.34 0.98 116.42 124.58 2k5j h ASP 26 Ca 0.14 -0.31 -0.18 0.00 0.42 0.00 0.00 57.03 57.10 2k5j h ASP 26 Cb 0.14 0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.17 2k5j h ASP 26 CO -0.01 0.30 -0.87 0.17 -2.88 0.00 0.00 179.24 175.95 2k5j h LEU 27 N -0.35 0.00 -0.09 2.28 8.10 -1.09 -3.16 115.31 121.01 2k5j h LEU 27 Ca -0.00 0.00 -0.25 0.00 0.11 0.00 0.00 57.88 57.74 2k5j h LEU 27 Cb 0.33 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.57 2k5j h LEU 27 CO 0.00 0.87 -0.98 -0.08 -4.11 0.00 0.00 178.44 174.14 2k5j h GLU 28 N 0.00 0.59 -0.27 0.17 4.81 0.14 -2.29 114.58 117.74 2k5j h GLU 28 Ca -0.01 -0.62 -0.03 0.00 -0.13 0.00 0.00 59.36 58.57 2k5j h GLU 28 Cb 1.65 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 31.19 2k5j h GLU 28 CO 0.11 1.23 0.03 0.28 -0.73 0.00 0.00 179.01 179.94 2k5j h VAL 29 N 0.34 1.24 -0.36 0.32 2.07 -0.88 -1.30 116.25 117.68 2k5j h VAL 29 Ca -0.10 -0.81 -0.11 0.00 0.82 0.00 0.00 66.70 66.50 2k5j h VAL 29 Cb 1.62 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.63 2k5j h VAL 29 CO 0.18 0.26 -0.21 0.06 0.02 0.00 0.00 177.57 177.88 2k5j h GLN 30 N 0.25 0.70 0.00 1.57 3.07 -1.63 -2.30 115.11 116.77 2k5j h GLN 30 Ca 0.08 -0.27 0.00 0.00 0.09 0.00 0.00 58.65 58.55 2k5j h GLN 30 Cb 0.35 -0.04 0.00 0.00 0.08 0.00 0.00 27.48 27.87 2k5j h GLN 30 CO 0.01 0.85 0.00 0.00 0.09 0.00 0.00 178.83 179.78 2k5j h ARG 31 N 0.61 0.00 -6.20 0.06 2.47 -1.28 -3.46 114.38 106.58 2k5j h ARG 31 Ca 0.09 0.00 -0.46 0.00 -1.26 0.00 0.00 59.98 58.35 2k5j h ARG 31 Cb 0.70 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.02 2k5j h ARG 31 CO 0.05 0.00 -0.75 -1.71 0.56 0.00 0.00 179.97 178.12 2k5j n ASN 32 N -2.76 -4.78 -4.05 7.04 5.15 -0.50 -4.97 115.26 110.39 2k5j n ASN 32 Ca 0.02 -0.74 -0.11 0.00 -0.60 0.00 0.00 54.58 53.15 2k5j n ASN 32 Cb 0.31 -4.12 -0.11 0.00 -0.53 0.00 0.00 39.78 35.33 2k5j n ASN 32 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2k5j s LEU 33 N -7.23 2.31 0.47 1.20 1.43 -1.18 -5.08 118.68 110.60 2k5j s LEU 33 Ca 0.59 -0.63 -0.24 0.00 -1.03 0.00 0.00 54.13 52.82 2k5j s LEU 33 Cb -0.29 -0.03 -0.07 0.00 0.03 0.00 0.00 46.19 45.83 2k5j s LEU 33 CO 0.81 -0.31 1.34 -2.16 0.23 0.00 0.00 176.35 176.27 2k5j s PRO 34 N -2.05 3.57 0.25 1.29 0.04 -1.26 -4.79 135.00 132.04 2k5j s PRO 34 Ca -0.08 2.22 -0.06 0.00 0.04 0.00 0.00 61.00 63.12 2k5j s PRO 34 Cb -0.06 -2.51 0.25 0.00 0.04 0.00 0.00 34.50 32.22 2k5j s PRO 34 CO -0.02 -0.84 1.91 0.07 0.04 0.00 0.00 177.00 178.16 2k5j h ARG 35 N 2.08 1.30 -0.95 4.56 0.11 -1.97 -2.09 114.38 117.41 2k5j h ARG 35 Ca -0.50 -0.10 0.22 0.00 0.10 0.00 0.00 59.98 59.69 2k5j h ARG 35 Cb 1.27 -0.28 -0.12 0.00 1.11 0.00 0.00 29.97 31.95 2k5j h ARG 35 CO 0.60 0.89 0.51 0.00 0.10 0.00 0.00 179.97 182.06 2k5j h ALA 36 N 1.35 1.59 -0.36 0.08 0.00 -1.98 0.82 119.26 120.75 2k5j h ALA 36 Ca 0.35 0.13 -0.09 0.00 0.00 0.00 0.00 54.91 55.29 2k5j h ALA 36 Cb -0.10 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2k5j h ALA 36 CO -0.07 -0.24 -0.14 -0.44 0.00 0.00 0.00 179.25 178.36 2k5j h ASP 37 N 0.55 0.75 -0.43 0.00 3.32 -1.76 -1.26 116.42 117.59 2k5j h ASP 37 Ca 0.58 -0.39 -0.08 0.00 0.02 0.00 0.00 57.03 57.16 2k5j h ASP 37 Cb 1.05 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.38 2k5j h ASP 37 CO -0.47 0.97 -0.05 -0.07 -1.72 0.00 0.00 179.24 177.90 2k5j h LEU 38 N 0.52 0.79 -0.36 1.55 3.38 -0.48 -2.31 115.31 118.40 2k5j h LEU 38 Ca 0.08 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 2k5j h LEU 38 Cb 0.67 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2k5j h LEU 38 CO 0.05 0.94 0.15 -0.07 0.09 0.00 0.00 178.44 179.59 2k5j h LEU 39 N 0.62 0.50 -0.70 1.67 3.38 0.53 -0.62 115.31 120.70 2k5j h LEU 39 Ca 0.11 -0.16 0.05 0.00 0.09 0.00 0.00 57.88 57.97 2k5j h LEU 39 Cb 0.57 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 2k5j h LEU 39 CO 0.03 0.53 0.42 -0.09 0.09 0.00 0.00 178.44 179.42 2k5j h ARG 40 N 0.44 0.77 -0.61 1.13 2.43 -1.16 -1.23 114.38 116.15 2k5j h ARG 40 Ca 0.12 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 2k5j h ARG 40 Cb 0.18 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2k5j h ARG 40 CO -0.01 0.51 0.09 0.93 -1.51 0.00 0.00 179.97 179.98 2k5j h GLU 41 N 0.79 1.01 -0.28 0.20 4.39 -1.14 0.50 114.58 120.06 2k5j h GLU 41 Ca 0.30 -0.27 0.03 0.00 0.34 0.00 0.00 59.36 59.75 2k5j h GLU 41 Cb 0.11 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.61 2k5j h GLU 41 CO -0.15 0.95 0.09 0.00 -1.16 0.00 0.00 179.01 178.75 2k5j h ALA 42 N 1.02 0.31 0.22 3.43 0.00 -0.33 0.38 119.26 124.29 2k5j h ALA 42 Ca 0.18 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2k5j h ALA 42 Cb 0.43 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2k5j h ALA 42 CO 0.01 -0.31 -0.10 0.28 0.00 0.00 0.00 179.25 179.13 2k5j h VAL 43 N 0.22 0.86 -0.81 0.00 2.07 -1.10 -2.72 116.25 114.77 2k5j h VAL 43 Ca 0.12 -0.71 0.14 0.00 0.82 0.00 0.00 66.70 67.08 2k5j h VAL 43 Cb 0.09 1.25 -0.09 0.00 -1.52 0.00 0.00 31.29 31.03 2k5j h VAL 43 CO -0.13 0.15 0.38 -0.78 0.02 0.00 0.00 177.57 177.22 2k5j h ASP 44 N -0.67 0.43 -0.93 0.57 1.82 -0.76 0.22 116.42 117.11 2k5j h ASP 44 Ca -0.03 0.10 0.08 0.00 -0.39 0.00 0.00 57.03 56.79 2k5j h ASP 44 Cb 0.47 0.04 -0.07 0.00 0.68 0.00 0.00 39.33 40.45 2k5j h ASP 44 CO 0.05 0.18 0.60 1.56 -1.61 0.00 0.00 179.24 180.02 2k5j h GLN 45 N 0.55 0.98 -0.82 0.28 1.08 -0.19 -1.12 115.11 115.88 2k5j h GLN 45 Ca 0.44 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.55 2k5j h GLN 45 Cb 0.64 -0.22 -0.04 0.00 -0.05 0.00 0.00 27.48 27.81 2k5j h GLN 45 CO -0.38 0.65 0.39 -0.92 -0.95 0.00 0.00 178.83 177.62 2k5j h TYR 46 N 1.01 1.18 -0.95 2.96 3.20 -0.25 -2.50 116.97 121.61 2k5j h TYR 46 Ca 0.42 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 62.25 2k5j h TYR 46 Cb 0.30 -0.36 -0.05 0.00 1.54 0.00 0.00 36.73 38.15 2k5j h TYR 46 CO -0.00 0.86 0.63 -0.07 -1.64 0.00 0.00 178.16 177.93 2k5j h LEU 47 N 1.16 1.08 -0.37 2.82 3.38 -0.70 -1.34 115.31 121.34 2k5j h LEU 47 Ca 0.28 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.25 2k5j h LEU 47 Cb 0.12 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 2k5j h LEU 47 CO -0.03 0.77 0.20 0.40 0.09 0.00 0.00 178.44 179.86 2k5j h ILE 48 N 1.26 1.02 -0.74 1.22 1.08 -1.08 -1.56 117.51 118.71 2k5j h ILE 48 Ca 0.36 -0.14 -0.04 0.00 -0.39 0.00 0.00 64.86 64.65 2k5j h ILE 48 Cb -0.10 0.57 -0.03 0.00 -3.07 0.00 0.00 36.82 34.18 2k5j h ILE 48 CO -0.09 0.08 0.32 -1.13 -0.69 0.00 0.00 178.15 176.64 2k5j h ASN 49 N 0.41 0.99 -0.68 1.72 -0.73 -1.23 -2.64 115.58 113.43 2k5j h ASN 49 Ca 0.15 -0.16 0.05 0.00 1.87 0.00 0.00 56.30 58.21 2k5j h ASN 49 Cb 0.03 -0.26 -0.05 0.00 0.27 0.00 0.00 38.32 38.31 2k5j h ASN 49 CO -0.08 0.88 0.40 1.56 -0.37 0.00 0.00 177.43 179.81 2k5j h GLN 50 N 1.05 0.73 -0.74 6.67 1.08 -0.71 1.52 115.11 124.71 2k5j h GLN 50 Ca 0.25 -0.04 0.02 0.00 -1.45 0.00 0.00 58.65 57.43 2k5j h GLN 50 Cb 0.17 -0.16 -0.04 0.00 -0.05 0.00 0.00 27.48 27.39 2k5j h GLN 50 CO -0.03 0.48 0.47 0.77 -0.95 0.00 0.00 178.83 179.58 2k5j h SER 51 N 0.75 0.79 0.59 1.46 0.02 -0.96 -1.18 113.55 115.02 2k5j h SER 51 Ca 0.29 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2k5j h SER 51 Cb 0.13 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2k5j h SER 51 CO -0.15 0.55 -0.33 0.00 -1.14 0.00 0.00 176.83 175.76 2k5j n GLN 52 N -4.62 0.12 -0.38 3.45 6.02 -0.74 -5.04 117.38 116.19 2k5j n GLN 52 Ca 0.08 -0.05 0.05 0.00 -0.01 0.00 0.00 57.00 57.07 2k5j n GLN 52 Cb 0.07 -1.50 -0.01 0.00 1.02 0.00 0.00 30.24 29.82 2k5j n GLN 52 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2k5j n THR 53 N -1.39 0.00 -1.74 5.09 -2.24 0.51 -4.57 114.28 109.93 2k5j n THR 53 Ca 0.07 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.43 2k5j n THR 53 Cb 0.33 -0.13 -0.01 0.00 -2.10 0.00 0.00 70.33 68.42 2k5j n THR 53 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k5j n ALA 54 N -0.74 2.14 -2.77 6.98 0.00 -1.26 -4.86 120.51 120.00 2k5j n ALA 54 Ca 0.00 0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.65 2k5j n ALA 54 Cb 0.17 -2.40 -0.14 0.00 0.00 0.00 0.00 19.45 17.08 2k5j n ALA 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2k5j s ARG 55 N -1.19 0.37 -0.09 0.00 3.52 -1.26 -5.01 118.95 115.30 2k5j s ARG 55 Ca 0.60 -0.17 -0.06 0.00 -0.13 0.00 0.00 55.73 55.97 2k5j s ARG 55 Cb -0.52 -0.36 0.02 0.00 -1.56 0.00 0.00 34.95 32.53 2k5j s ARG 55 CO 0.55 0.10 0.13 2.41 -0.81 0.00 0.00 175.30 177.68 2k5j n THR 56 N 2.96-11.40 -1.31 4.11 -1.04 -1.26 -4.95 114.28 101.39 2k5j n THR 56 Ca -0.13 2.55 -0.30 0.00 -2.04 0.00 0.00 64.05 64.13 2k5j n THR 56 Cb 0.58 -5.76 0.12 0.00 -1.82 0.00 0.00 70.33 63.45 2k5j n THR 56 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2k5j s SER 57 N -0.55 3.96 -0.40 8.00 0.15 -1.26 -5.03 113.70 118.57 2k5j s SER 57 Ca -0.15 1.50 0.07 0.00 0.70 0.00 0.00 55.95 58.07 2k5j s SER 57 Cb 0.01 -2.20 0.22 0.00 -1.71 0.00 0.00 66.02 62.34 2k5j s SER 57 CO 0.39 -2.33 0.47 1.33 1.20 0.00 0.00 173.24 174.31 2k5j n VAL 58 N -3.69 -0.84 -1.74 4.45 0.24 -1.26 -5.13 118.33 110.36 2k5j n VAL 58 Ca 0.07 -3.75 -0.38 0.00 -2.04 0.00 0.00 64.34 58.24 2k5j n VAL 58 Cb 0.55 -1.76 0.05 0.00 -1.47 0.00 0.00 33.84 31.20 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 1.87 1.60 0.00 7.34 -0.02 -1.26 -4.97 135.00 139.56 2k5j n PRO 59 Ca 0.23 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2k5j n PRO 59 Cb 0.52 -2.58 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2k5j n PRO 59 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2k5j n GLY 60 N 0.78 -1.30 3.17 -1.23 0.00 -1.26 -4.86 105.19 100.49 2k5j n GLY 60 Ca 0.11 0.11 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 2k5j n GLY 60 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2k5j s ILE 61 N -0.20 0.90 0.00 -0.61 -4.36 -1.26 -5.10 121.20 110.57 2k5j s ILE 61 Ca 0.00 -1.68 0.00 0.00 -0.26 0.00 0.00 60.65 58.71 2k5j s ILE 61 Cb 0.00 -1.39 0.00 0.00 1.25 0.00 0.00 42.46 42.32 2k5j s ILE 61 CO 0.00 -0.60 0.19 0.79 0.24 0.00 0.00 174.94 175.56 2k5j n TRP 62 N 0.48 0.00 0.00 1.37 7.02 -1.26 -5.06 117.44 119.98 2k5j n TRP 62 Ca -0.15 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.33 2k5j n TRP 62 Cb 0.58 -0.15 0.00 0.00 -2.42 0.00 0.00 31.31 29.32 2k5j n TRP 62 CO 0.00 0.00 0.00 0.94 -2.02 0.00 0.00 177.69 176.61 2k5j n GLN 63 N -0.96 0.00 -0.15 -0.99 7.27 -1.26 -4.97 117.38 116.33 2k5j n GLN 63 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 57.05 2k5j n GLN 63 Cb 0.00 0.00 0.20 0.00 2.41 0.00 0.00 30.24 32.85 2k5j n GLN 63 CO 0.00 0.00 0.00 0.78 0.07 0.00 0.00 177.06 177.91 2k5j h GLY 64 N 0.00 0.93 -6.00 1.69 0.00 -2.02 -3.48 103.07 94.19 2k5j h GLY 64 Ca 0.00 -0.49 -0.16 0.00 0.00 0.00 0.00 47.33 46.68 2k5j h GLY 64 CO 0.00 0.47 -0.96 0.00 0.00 0.00 0.00 176.54 176.05 2k5j n GLU 66 N 0.21 0.00 -3.03 0.00 -0.58 -1.26 -4.80 120.64 111.18 2k5j n GLU 66 Ca -0.00 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.62 2k5j n GLU 66 Cb 0.50 0.00 0.01 0.00 -0.57 0.00 0.00 31.44 31.38 2k5j n GLU 66 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2k5j n GLU 67 N 0.00 -2.08 -2.76 3.49 2.13 -1.26 -4.86 120.64 115.31 2k5j n GLU 67 Ca 0.00 1.85 -0.43 0.00 0.66 0.00 0.00 57.16 59.24 2k5j n GLU 67 Cb 0.00 -5.05 -0.02 0.00 0.27 0.00 0.00 31.44 26.65 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 -2.55 6.73 0.26 4.31 2.15 -1.26 -4.78 116.67 121.54 2k5j s ASP 68 Ca 0.21 -2.17 0.09 0.00 0.43 0.00 0.00 52.55 51.11 2k5j s ASP 68 Cb -0.05 -2.48 0.32 0.00 -0.30 0.00 0.00 42.92 40.41 2k5j s ASP 68 CO 0.79 -1.14 1.59 1.23 -0.17 0.00 0.00 175.17 177.47 2k5j h GLY 69 N 11.35 0.04 2.00 2.66 0.00 -2.01 -2.95 103.07 114.15 2k5j h GLY 69 Ca 0.26 -0.05 -0.00 0.00 0.00 0.00 0.00 47.33 47.54 2k5j h GLY 69 CO 1.30 0.04 -0.01 -0.24 0.00 0.00 0.00 176.54 177.63 2k5j h VAL 70 N 0.02 0.65 0.00 4.60 3.04 -2.01 -3.42 116.25 119.14 2k5j h VAL 70 Ca -0.01 -0.04 -0.38 0.00 -1.01 0.00 0.00 66.70 65.26 2k5j h VAL 70 Cb 1.12 1.02 -0.11 0.00 -2.01 0.00 0.00 31.29 31.32 2k5j h VAL 70 CO 0.08 0.01 1.94 1.21 -1.01 0.00 0.00 177.57 179.81 2k5j n GLU 71 N -4.01 0.00 -4.14 4.17 2.13 -1.12 -4.84 120.64 112.82 2k5j n GLU 71 Ca -0.03 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.54 2k5j n GLU 71 Cb 0.09 -1.09 -0.06 0.00 0.27 0.00 0.00 31.44 30.66 2k5j n GLU 71 CO 0.00 0.00 0.00 -0.47 -0.41 0.00 0.00 177.13 176.25 2k5j s TYR 72 N 1.89 3.01 0.11 4.31 6.14 -1.26 -5.03 117.35 126.52 2k5j s TYR 72 Ca 1.30 -0.09 -0.16 0.00 0.64 0.00 0.00 57.07 58.76 2k5j s TYR 72 Cb -0.92 -1.42 -0.04 0.00 0.42 0.00 0.00 41.96 40.00 2k5j s TYR 72 CO 0.54 0.53 1.57 0.37 0.64 0.00 0.00 175.55 179.20 2k5j h GLN 73 N 2.27 0.59 0.00 4.97 5.75 -2.00 -3.45 115.11 123.24 2k5j h GLN 73 Ca -0.47 -0.17 0.00 0.00 -0.15 0.00 0.00 58.65 57.85 2k5j h GLN 73 Cb 1.21 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.70 2k5j h GLN 73 CO 0.61 0.69 0.00 -2.13 -2.65 0.00 0.00 178.83 175.35 2k5j n ARG 74 N -4.55 -1.42 -1.75 1.69 3.00 -1.26 -2.57 116.66 109.80 2k5j n ARG 74 Ca -0.02 0.25 -0.02 0.00 -0.00 0.00 0.00 57.85 58.06 2k5j n ARG 74 Cb 0.24 -4.01 -0.01 0.00 0.00 0.00 0.00 32.46 28.69 2k5j n ARG 74 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2k5j n LYS 75 N 0.18 -1.91 -0.21 -0.14 5.02 -1.26 -4.73 118.16 115.11 2k5j n LYS 75 Ca 0.00 0.13 -0.07 0.00 -2.02 0.00 0.00 58.31 56.35 2k5j n LYS 75 Cb 0.25 -4.40 0.03 0.00 -0.02 0.00 0.00 35.03 30.89 2k5j n LYS 75 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2k5j h LEU 76 N 0.00 0.76 -9.41 -0.35 5.85 -1.88 -3.41 115.31 106.87 2k5j h LEU 76 Ca -0.05 -0.12 -0.63 0.00 0.84 0.00 0.00 57.88 57.91 2k5j h LEU 76 Cb 0.58 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 41.31 2k5j h LEU 76 CO 0.07 0.66 -0.50 -0.13 -0.34 0.00 0.00 178.44 178.20 2k5j s ARG 77 N -5.75 3.79 0.32 1.25 1.81 -1.26 -5.08 118.95 114.02 2k5j s ARG 77 Ca -0.13 -0.20 -0.28 0.00 -1.72 0.00 0.00 55.73 53.40 2k5j s ARG 77 Cb 0.13 -3.27 -0.09 0.00 -0.45 0.00 0.00 34.95 31.26 2k5j s ARG 77 CO 0.78 0.52 1.05 -2.00 -0.68 0.00 0.00 175.30 174.97 2k5j s GLU 78 N -0.29 4.52 -0.07 3.54 2.12 -1.26 -5.05 118.70 122.21 2k5j s GLU 78 Ca 0.11 1.63 -0.18 0.00 0.36 0.00 0.00 54.97 56.89 2k5j s GLU 78 Cb -0.12 -2.97 0.04 0.00 0.26 0.00 0.00 34.13 31.34 2k5j s GLU 78 CO 0.01 0.15 0.42 -1.83 -0.54 0.00 0.00 175.26 173.47 2k5j s GLU 79 N -1.79 0.69 0.00 4.30 -1.05 -1.26 -5.22 118.70 114.37 2k5j s GLU 79 Ca 0.49 0.16 0.00 0.00 -0.15 0.00 0.00 54.97 55.47 2k5j s GLU 79 Cb -0.27 0.32 0.00 0.00 -0.44 0.00 0.00 34.13 33.74 2k5j s GLU 79 CO 0.34 -0.17 0.00 1.87 0.95 0.00 0.00 175.26 178.25