#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k5j h ASN 2 N 0.00 1.08 -0.36 7.83 -1.24 -2.04 -3.48 115.58 117.38 2k5j h ASN 2 Ca 0.00 -0.17 0.00 0.00 0.71 0.00 0.00 56.30 56.84 2k5j h ASN 2 Cb 0.00 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 38.77 2k5j h ASN 2 CO 0.00 0.96 0.00 -1.20 -1.29 0.00 0.00 177.43 175.90 2k5j n SER 3 N -4.29 -2.19 -4.91 1.15 7.64 -1.26 -4.08 113.62 105.68 2k5j n SER 3 Ca 0.07 0.00 -0.27 0.00 1.01 0.00 0.00 58.87 59.68 2k5j n SER 3 Cb 0.19 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.40 2k5j n SER 3 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 2k5j s LEU 4 N 0.00 3.49 0.00 -3.43 2.34 -1.26 -4.38 118.68 115.44 2k5j s LEU 4 Ca 0.00 0.86 0.00 0.00 0.06 0.00 0.00 54.13 55.05 2k5j s LEU 4 Cb 0.00 -3.78 0.00 0.00 -0.56 0.00 0.00 46.19 41.85 2k5j s LEU 4 CO 0.00 -0.74 0.00 0.00 -1.06 0.00 0.00 176.35 174.55 2k5j n ALA 5 N -2.37 0.00 -0.02 1.48 0.00 -1.26 -4.89 120.51 113.44 2k5j n ALA 5 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 2k5j n ALA 5 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 0.00 -1.54 3.34 0.00 0.00 -1.26 -3.17 105.19 102.57 2k5j n GLY 6 Ca 0.00 -1.32 -0.40 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.01 0.98 -2.84 -0.61 5.41 -1.26 -4.03 119.36 117.00 2k5j n ILE 7 Ca 0.00 -0.89 -0.12 0.00 1.00 0.00 0.00 62.75 62.74 2k5j n ILE 7 Cb 0.00 -2.16 -0.01 0.00 -0.71 0.00 0.00 39.64 36.77 2k5j n ILE 7 CO 0.00 0.00 0.00 -0.90 0.00 0.00 0.00 176.55 175.65 2k5j n ASP 8 N 9.83 -2.47 -4.69 4.38 5.68 -1.26 -4.87 116.55 123.15 2k5j n ASP 8 Ca 0.47 0.07 -0.40 0.00 -0.50 0.00 0.00 54.79 54.43 2k5j n ASP 8 Cb 0.42 -2.15 -0.05 0.00 -1.14 0.00 0.00 41.12 38.21 2k5j n ASP 8 CO 0.00 0.00 0.00 -0.04 -1.33 0.00 0.00 177.20 175.83 2k5j s MET 9 N -5.42 4.35 0.05 0.11 -1.94 -1.19 -5.00 119.30 110.26 2k5j s MET 9 Ca 0.16 0.90 -0.30 0.00 -1.71 0.00 0.00 55.69 54.74 2k5j s MET 9 Cb -0.09 -3.52 -0.09 0.00 2.01 0.00 0.00 34.83 33.15 2k5j s MET 9 CO 0.19 -0.14 1.88 0.20 -0.01 0.00 0.00 175.02 177.14 2k5j s GLY 10 N 1.01 1.45 0.08 -0.03 0.00 -1.26 -4.72 107.32 103.84 2k5j s GLY 10 Ca 0.37 1.30 -0.31 0.00 0.00 0.00 0.00 44.72 46.08 2k5j s GLY 10 CO 0.15 3.31 1.19 -1.60 0.00 0.00 0.00 173.10 176.15 2k5j s ARG 11 N 3.91 4.45 0.01 2.90 3.52 -1.26 -5.03 118.95 127.44 2k5j s ARG 11 Ca 0.84 1.78 0.02 0.00 -0.13 0.00 0.00 55.73 58.24 2k5j s ARG 11 Cb -0.42 -3.33 -0.01 0.00 -1.56 0.00 0.00 34.95 29.63 2k5j s ARG 11 CO 0.38 -0.22 -0.08 0.42 -0.81 0.00 0.00 175.30 174.99 2k5j s ILE 12 N 0.89 0.59 -0.22 4.11 1.01 -1.26 -5.13 121.20 121.18 2k5j s ILE 12 Ca 0.58 -0.49 -0.11 0.00 0.00 0.00 0.00 60.65 60.63 2k5j s ILE 12 Cb -0.30 -0.53 -0.05 0.00 0.01 0.00 0.00 42.46 41.60 2k5j s ILE 12 CO 0.30 0.05 0.19 -0.76 0.00 0.00 0.00 174.94 174.72 2k5j s LEU 13 N -0.49 4.15 -0.14 2.97 1.02 -1.26 -5.08 118.68 119.85 2k5j s LEU 13 Ca 0.00 0.22 -0.00 0.00 0.02 0.00 0.00 54.13 54.37 2k5j s LEU 13 Cb -0.04 -2.18 -0.01 0.00 0.02 0.00 0.00 46.19 43.98 2k5j s LEU 13 CO -0.00 0.07 -0.12 -0.22 0.02 0.00 0.00 176.35 176.10 2k5j s LEU 14 N 0.90 2.70 -0.33 1.79 2.96 -1.26 -5.10 118.68 120.35 2k5j s LEU 14 Ca 0.10 -0.35 -0.07 0.00 -0.22 0.00 0.00 54.13 53.59 2k5j s LEU 14 Cb -0.13 -1.62 0.03 0.00 0.50 0.00 0.00 46.19 44.97 2k5j s LEU 14 CO 0.03 0.14 0.10 -1.81 -1.32 0.00 0.00 176.35 173.49 2k5j s ASP 15 N 0.52 5.28 0.00 3.68 -0.00 -1.26 -5.08 116.67 119.81 2k5j s ASP 15 Ca -0.08 -1.04 0.00 0.00 -0.00 0.00 0.00 52.55 51.43 2k5j s ASP 15 Cb -0.16 -1.88 0.00 0.00 -0.00 0.00 0.00 42.92 40.89 2k5j s ASP 15 CO 0.04 -0.30 0.00 0.18 -0.00 0.00 0.00 175.17 175.09 2k5j n LEU 16 N 4.83 0.00 -4.20 1.23 4.77 -1.26 -5.15 117.00 117.22 2k5j n LEU 16 Ca -0.13 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.67 2k5j n LEU 16 Cb 0.45 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.43 2k5j n LEU 16 CO 0.32 -0.09 -0.45 -0.55 -1.33 0.00 0.00 177.39 175.29 2k5j s SER 17 N -0.64 1.81 0.32 -1.43 0.15 -1.26 -5.01 113.70 107.64 2k5j s SER 17 Ca 0.00 -0.71 0.08 0.00 0.70 0.00 0.00 55.95 56.02 2k5j s SER 17 Cb 0.00 -0.05 0.79 0.00 -1.71 0.00 0.00 66.02 65.05 2k5j s SER 17 CO 0.00 -0.11 1.79 0.78 1.20 0.00 0.00 173.24 176.89 2k5j h ASN 18 N 3.93 0.73 -0.40 5.45 2.35 -2.01 0.43 115.58 126.07 2k5j h ASN 18 Ca -0.40 0.09 -0.12 0.00 -0.55 0.00 0.00 56.30 55.31 2k5j h ASN 18 Cb 1.19 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 39.51 2k5j h ASN 18 CO 0.45 0.26 -0.20 -0.08 -1.65 0.00 0.00 177.43 176.21 2k5j h GLU 19 N 0.72 0.90 -0.20 0.81 4.81 -2.00 -2.79 114.58 116.82 2k5j h GLU 19 Ca 0.57 -0.36 -0.08 0.00 -0.13 0.00 0.00 59.36 59.36 2k5j h GLU 19 Cb 0.95 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.28 2k5j h GLU 19 CO -0.35 1.01 -0.18 0.28 -0.73 0.00 0.00 179.01 179.04 2k5j h VAL 20 N 0.78 1.32 -0.83 0.32 2.07 -1.02 -2.85 116.25 116.05 2k5j h VAL 20 Ca 0.11 -1.32 0.17 0.00 0.82 0.00 0.00 66.70 66.48 2k5j h VAL 20 Cb 0.74 1.74 -0.06 0.00 -1.52 0.00 0.00 31.29 32.19 2k5j h VAL 20 CO 0.06 0.40 0.55 0.40 0.02 0.00 0.00 177.57 179.00 2k5j h ILE 21 N 0.16 0.74 -0.50 4.57 2.04 -0.26 0.27 117.51 124.54 2k5j h ILE 21 Ca 0.04 -0.15 -0.12 0.00 1.00 0.00 0.00 64.86 65.63 2k5j h ILE 21 Cb 0.71 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 2k5j h ILE 21 CO 0.05 0.08 -0.17 0.11 0.00 0.00 0.00 178.15 178.21 2k5j h LYS 22 N 0.43 0.99 -0.19 2.37 1.57 -1.32 -1.15 116.57 119.26 2k5j h LYS 22 Ca 0.42 -0.40 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2k5j h LYS 22 Cb 0.99 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.25 2k5j h LYS 22 CO -0.15 1.08 0.06 1.96 -0.57 0.00 0.00 179.45 181.83 2k5j h GLN 23 N 0.85 0.29 -0.74 3.15 4.20 -0.32 -2.06 115.11 120.48 2k5j h GLN 23 Ca 0.12 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2k5j h GLN 23 Cb 0.74 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.45 2k5j h GLN 23 CO 0.06 0.40 0.41 -0.07 -0.67 0.00 0.00 178.83 178.96 2k5j h LEU 24 N 0.13 0.92 -0.89 1.46 3.38 -1.00 -2.35 115.31 116.96 2k5j h LEU 24 Ca 0.06 -0.09 0.04 0.00 0.09 0.00 0.00 57.88 57.98 2k5j h LEU 24 Cb 0.23 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 2k5j h LEU 24 CO -0.00 0.75 0.57 -0.78 0.09 0.00 0.00 178.44 179.06 2k5j h ASP 25 N 1.02 0.93 -0.94 -0.43 3.58 -1.03 0.24 116.42 119.80 2k5j h ASP 25 Ca 0.26 0.00 0.04 0.00 0.42 0.00 0.00 57.03 57.75 2k5j h ASP 25 Cb 0.03 -0.20 -0.06 0.00 1.72 0.00 0.00 39.33 40.82 2k5j h ASP 25 CO -0.04 0.63 0.61 -0.78 -2.88 0.00 0.00 179.24 176.77 2k5j h ASP 26 N 1.08 1.00 0.56 2.28 1.82 -0.84 0.61 116.42 122.94 2k5j h ASP 26 Ca 0.36 -0.00 -0.13 0.00 -0.39 0.00 0.00 57.03 56.87 2k5j h ASP 26 Cb 0.06 -0.22 -0.02 0.00 0.68 0.00 0.00 39.33 39.83 2k5j h ASP 26 CO -0.14 0.68 -0.61 -0.07 -1.61 0.00 0.00 179.24 177.49 2k5j h LEU 27 N 1.16 0.06 -0.31 2.28 3.38 -1.01 -2.54 115.31 118.33 2k5j h LEU 27 Ca 0.38 -0.03 -0.16 0.00 0.09 0.00 0.00 57.88 58.16 2k5j h LEU 27 Cb 0.04 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2k5j h LEU 27 CO -0.13 0.65 -0.44 -0.33 0.09 0.00 0.00 178.44 178.28 2k5j h GLU 28 N 0.04 0.84 -0.02 1.13 5.08 0.32 -1.12 114.58 120.84 2k5j h GLU 28 Ca -0.01 -0.49 -0.00 0.00 -1.00 0.00 0.00 59.36 57.86 2k5j h GLU 28 Cb 1.09 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 2k5j h GLU 28 CO 0.08 1.13 -0.00 0.28 -1.00 0.00 0.00 179.01 179.50 2k5j h VAL 29 N 0.62 1.27 -0.42 3.13 2.07 -0.89 2.42 116.25 124.46 2k5j h VAL 29 Ca 0.03 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 2k5j h VAL 29 Cb 1.04 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.58 2k5j h VAL 29 CO 0.10 0.22 0.22 1.56 0.02 0.00 0.00 177.57 179.69 2k5j h GLN 30 N -0.30 0.58 0.00 1.57 1.08 -1.51 -2.42 115.11 114.12 2k5j h GLN 30 Ca 0.01 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 2k5j h GLN 30 Cb 0.35 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.67 2k5j h GLN 30 CO 0.00 0.48 -0.33 0.54 -0.95 0.00 0.00 178.83 178.57 2k5j n ARG 31 N -4.71 0.28 -3.80 1.46 1.74 -0.43 -4.94 116.66 106.26 2k5j n ARG 31 Ca 0.00 0.15 -0.28 0.00 -0.77 0.00 0.00 57.85 56.96 2k5j n ARG 31 Cb 0.09 -1.74 0.04 0.00 -1.02 0.00 0.00 32.46 29.83 2k5j n ARG 31 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2k5j n ASN 32 N -2.18 -5.01 -4.13 0.55 4.13 0.81 -4.98 115.26 104.45 2k5j n ASN 32 Ca 0.04 -0.71 -0.15 0.00 1.68 0.00 0.00 54.58 55.45 2k5j n ASN 32 Cb 0.44 -4.27 -0.11 0.00 -1.54 0.00 0.00 39.78 34.29 2k5j n ASN 32 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2k5j s LEU 33 N -7.24 2.31 0.66 3.41 1.43 -0.58 -5.00 118.68 113.67 2k5j s LEU 33 Ca 0.59 -0.66 -0.17 0.00 -1.03 0.00 0.00 54.13 52.86 2k5j s LEU 33 Cb -0.28 -0.30 -0.00 0.00 0.03 0.00 0.00 46.19 45.63 2k5j s LEU 33 CO 0.80 -0.19 1.23 -2.16 0.23 0.00 0.00 176.35 176.25 2k5j s PRO 34 N -2.05 2.56 0.11 1.29 0.04 -1.26 -4.49 135.00 131.20 2k5j s PRO 34 Ca -0.03 1.86 -0.18 0.00 0.04 0.00 0.00 61.00 62.70 2k5j s PRO 34 Cb -0.07 -1.87 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 2k5j s PRO 34 CO 0.01 -1.53 1.61 0.07 0.04 0.00 0.00 177.00 177.20 2k5j h ARG 35 N 0.36 0.49 -0.97 4.56 0.11 -1.97 -2.78 114.38 114.18 2k5j h ARG 35 Ca -0.50 -0.11 0.29 0.00 0.10 0.00 0.00 59.98 59.76 2k5j h ARG 35 Cb 1.31 -0.07 -0.14 0.00 1.11 0.00 0.00 29.97 32.18 2k5j h ARG 35 CO 0.53 0.54 0.48 0.00 0.10 0.00 0.00 179.97 181.62 2k5j h ALA 36 N 0.92 1.74 -0.45 0.08 0.00 -1.99 1.02 119.26 120.57 2k5j h ALA 36 Ca 0.10 0.19 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 2k5j h ALA 36 Cb 0.27 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2k5j h ALA 36 CO -0.00 -0.49 -0.19 -0.44 0.00 0.00 0.00 179.25 178.13 2k5j h ASP 37 N 0.34 0.91 -0.46 0.00 3.32 -1.88 -2.37 116.42 116.27 2k5j h ASP 37 Ca 0.67 -0.32 -0.13 0.00 0.02 0.00 0.00 57.03 57.27 2k5j h ASP 37 Cb 1.45 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2k5j h ASP 37 CO -0.60 1.07 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.73 2k5j h LEU 38 N 0.78 0.99 -0.41 1.55 3.38 1.00 -2.84 115.31 119.75 2k5j h LEU 38 Ca 0.11 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 2k5j h LEU 38 Cb 0.73 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2k5j h LEU 38 CO 0.06 1.14 0.20 -0.07 0.09 0.00 0.00 178.44 179.86 2k5j h LEU 39 N 0.84 0.53 -0.79 1.67 3.38 -0.09 0.13 115.31 120.99 2k5j h LEU 39 Ca 0.12 -0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2k5j h LEU 39 Cb 0.76 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.31 2k5j h LEU 39 CO 0.06 0.50 0.46 -0.09 0.09 0.00 0.00 178.44 179.47 2k5j h ARG 40 N 0.52 0.80 -0.32 1.13 2.43 -1.35 -0.93 114.38 116.67 2k5j h ARG 40 Ca 0.14 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.14 2k5j h ARG 40 Cb 0.11 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2k5j h ARG 40 CO -0.02 0.53 -0.32 0.93 -1.51 0.00 0.00 179.97 179.58 2k5j h GLU 41 N 0.82 0.69 -0.32 0.20 4.39 -1.22 -2.58 114.58 116.57 2k5j h GLU 41 Ca 0.36 -0.32 0.03 0.00 0.34 0.00 0.00 59.36 59.77 2k5j h GLU 41 Cb 0.24 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 2k5j h GLU 41 CO -0.20 0.92 0.13 0.00 -1.16 0.00 0.00 179.01 178.69 2k5j h ALA 42 N 1.06 0.37 0.38 3.43 0.00 0.33 0.18 119.26 125.01 2k5j h ALA 42 Ca 0.07 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2k5j h ALA 42 Cb 0.83 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2k5j h ALA 42 CO 0.07 -0.27 -0.18 0.28 0.00 0.00 0.00 179.25 179.15 2k5j h VAL 43 N 0.27 0.63 -0.26 0.00 2.07 -1.22 0.82 116.25 118.56 2k5j h VAL 43 Ca 0.14 -0.19 0.06 0.00 0.82 0.00 0.00 66.70 67.53 2k5j h VAL 43 Cb 0.09 0.72 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 2k5j h VAL 43 CO -0.13 0.04 -0.12 -0.78 0.02 0.00 0.00 177.57 176.59 2k5j h ASP 44 N -0.62 -0.42 -0.46 0.57 1.82 -1.27 0.29 116.42 116.33 2k5j h ASP 44 Ca -0.05 0.10 -0.07 0.00 -0.39 0.00 0.00 57.03 56.62 2k5j h ASP 44 Cb 0.46 0.23 -0.02 0.00 0.68 0.00 0.00 39.33 40.68 2k5j h ASP 44 CO 0.09 -0.16 0.03 1.56 -1.61 0.00 0.00 179.24 179.15 2k5j h GLN 45 N -0.09 0.86 -0.51 0.28 7.50 -0.56 -2.83 115.11 119.76 2k5j h GLN 45 Ca 0.14 -0.23 -0.00 0.00 0.50 0.00 0.00 58.65 59.06 2k5j h GLN 45 Cb 0.30 -0.10 -0.02 0.00 0.05 0.00 0.00 27.48 27.70 2k5j h GLN 45 CO -0.32 0.84 0.30 -0.92 -1.50 0.00 0.00 178.83 177.23 2k5j h TYR 46 N 0.81 0.67 -0.31 2.96 3.20 0.20 0.77 116.97 125.28 2k5j h TYR 46 Ca 0.16 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.06 2k5j h TYR 46 Cb 0.44 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 2k5j h TYR 46 CO 0.02 0.47 0.11 -0.07 -1.64 0.00 0.00 178.16 177.06 2k5j h LEU 47 N 0.68 0.12 -0.02 2.82 3.38 -0.26 1.63 115.31 123.66 2k5j h LEU 47 Ca 0.18 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.16 2k5j h LEU 47 Cb 0.00 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2k5j h LEU 47 CO -0.03 0.10 -0.08 0.40 0.09 0.00 0.00 178.44 178.92 2k5j h ILE 48 N 0.25 1.49 0.00 1.22 2.04 -1.32 -3.09 117.51 118.10 2k5j h ILE 48 Ca 0.14 -1.58 0.00 0.00 1.00 0.00 0.00 64.86 64.42 2k5j h ILE 48 Cb 0.11 2.49 0.00 0.00 -0.74 0.00 0.00 36.82 38.68 2k5j h ILE 48 CO -0.14 0.42 0.00 -3.20 0.00 0.00 0.00 178.15 175.23 2k5j n ASN 49 N -4.69 0.65 0.13 1.72 2.85 0.27 -3.08 115.26 113.11 2k5j n ASN 49 Ca -0.09 0.69 0.02 0.00 -0.11 0.00 0.00 54.58 55.09 2k5j n ASN 49 Cb 0.37 -0.82 0.08 0.00 1.24 0.00 0.00 39.78 40.65 2k5j n ASN 49 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 2k5j n GLN 50 N -2.26 0.03 -1.65 1.20 0.00 0.56 -4.65 117.38 110.61 2k5j n GLN 50 Ca 0.01 0.41 0.00 0.00 -0.00 0.00 0.00 57.00 57.42 2k5j n GLN 50 Cb 0.18 -2.16 0.00 0.00 0.00 0.00 0.00 30.24 28.26 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 -1.67 -1.67 -4.48 1.69 3.41 -1.18 -4.89 113.62 104.83 2k5j n SER 51 Ca -0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.49 2k5j n SER 51 Cb 0.58 -0.42 -0.10 0.00 -0.26 0.00 0.00 64.21 64.01 2k5j n SER 51 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2k5j n GLN 52 N -0.85 0.09 -0.51 4.33 -0.06 -1.26 -3.20 117.38 115.92 2k5j n GLN 52 Ca 0.00 -1.40 0.00 0.00 -2.00 0.00 0.00 57.00 53.60 2k5j n GLN 52 Cb 0.42 -3.46 0.00 0.00 -4.06 0.00 0.00 30.24 23.14 2k5j n GLN 52 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 2k5j n THR 53 N 8.36 0.00 -2.41 1.69 -2.24 -1.26 -4.87 114.28 113.55 2k5j n THR 53 Ca 0.35 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.74 2k5j n THR 53 Cb 0.47 -0.51 -0.03 0.00 -2.10 0.00 0.00 70.33 68.16 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 -0.57 3.24 -0.04 6.98 0.00 -1.19 -4.43 121.76 125.75 2k5j s ALA 54 Ca 0.00 0.89 -0.02 0.00 0.00 0.00 0.00 51.96 52.83 2k5j s ALA 54 Cb 0.00 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.79 2k5j s ALA 54 CO 0.00 -0.33 0.04 -2.13 0.00 0.00 0.00 175.76 173.34 2k5j n ARG 55 N 0.46 -1.73 -0.20 0.00 3.00 -1.26 -4.82 116.66 112.12 2k5j n ARG 55 Ca 0.02 1.57 -0.05 0.00 -0.00 0.00 0.00 57.85 59.39 2k5j n ARG 55 Cb 0.46 -1.71 0.04 0.00 0.00 0.00 0.00 32.46 31.25 2k5j n ARG 55 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 2k5j h THR 56 N 4.57 1.10 -3.71 5.15 1.35 -2.00 -3.41 112.91 115.96 2k5j h THR 56 Ca -0.09 -0.25 -0.50 0.00 -0.55 0.00 0.00 66.41 65.02 2k5j h THR 56 Cb 0.39 0.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.12 2k5j h THR 56 CO 0.01 0.13 0.44 -0.94 -0.25 0.00 0.00 175.52 174.91 2k5j s SER 57 N -5.66 7.37 -0.43 5.36 1.04 -1.26 -4.97 113.70 115.15 2k5j s SER 57 Ca -0.13 2.12 0.08 0.00 0.48 0.00 0.00 55.95 58.50 2k5j s SER 57 Cb 0.13 -2.61 0.34 0.00 0.10 0.00 0.00 66.02 63.97 2k5j s SER 57 CO 0.75 -0.09 1.03 1.33 0.98 0.00 0.00 173.24 177.24 2k5j n VAL 58 N 1.68 -0.02 -1.24 5.02 0.24 -1.26 -5.15 118.33 117.60 2k5j n VAL 58 Ca -0.00 -2.33 -0.31 0.00 -2.04 0.00 0.00 64.34 59.66 2k5j n VAL 58 Cb 0.46 0.99 0.11 0.00 -1.47 0.00 0.00 33.84 33.93 2k5j n VAL 58 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2k5j s PRO 59 N -0.52 1.93 0.00 7.34 0.04 -1.26 -4.33 135.00 138.20 2k5j s PRO 59 Ca 0.27 1.06 0.00 0.00 0.04 0.00 0.00 61.00 62.37 2k5j s PRO 59 Cb 0.32 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.99 2k5j s PRO 59 CO -0.06 -1.84 0.00 0.41 0.04 0.00 0.00 177.00 175.55 2k5j n GLY 60 N -1.18 1.06 3.05 0.56 0.00 -1.26 -5.03 105.19 102.40 2k5j n GLY 60 Ca 0.08 -0.47 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 2k5j n GLY 60 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2k5j n ILE 61 N -2.37 0.00 -1.92 -0.61 -0.00 -1.26 -4.69 119.36 108.51 2k5j n ILE 61 Ca 0.00 -0.46 -0.41 0.00 -0.00 0.00 0.00 62.75 61.88 2k5j n ILE 61 Cb 0.28 -0.07 -0.03 0.00 -0.00 0.00 0.00 39.64 39.82 2k5j n ILE 61 CO 0.00 0.00 0.00 0.86 -0.00 0.00 0.00 176.55 177.41 2k5j s TRP 62 N -2.05 1.61 -0.13 1.39 -0.00 -1.26 -4.79 118.94 113.71 2k5j s TRP 62 Ca 0.42 0.78 0.19 0.00 -0.00 0.00 0.00 56.10 57.49 2k5j s TRP 62 Cb -0.18 -4.03 -0.17 0.00 -0.00 0.00 0.00 33.47 29.08 2k5j s TRP 62 CO 0.81 -2.83 0.67 1.04 -0.00 0.00 0.00 176.95 176.64 2k5j n GLN 63 N 8.74 0.64 -2.42 5.86 6.02 -1.26 -4.98 117.38 129.97 2k5j n GLN 63 Ca 0.25 0.07 -0.11 0.00 -0.01 0.00 0.00 57.00 57.20 2k5j n GLN 63 Cb 0.49 -1.70 0.01 0.00 1.02 0.00 0.00 30.24 30.05 2k5j n GLN 63 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2k5j n GLY 64 N 1.38 -0.01 3.67 1.08 0.00 -1.26 -4.95 105.19 105.10 2k5j n GLY 64 Ca -0.10 -0.38 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 2k5j n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k5j s GLU 66 N 3.58 0.42 -1.02 0.00 0.41 -1.26 -5.08 118.70 115.74 2k5j s GLU 66 Ca 0.67 -0.27 -0.23 0.00 -0.41 0.00 0.00 54.97 54.73 2k5j s GLU 66 Cb -0.30 -0.36 0.01 0.00 -1.78 0.00 0.00 34.13 31.70 2k5j s GLU 66 CO 0.25 0.09 1.67 -2.00 -0.49 0.00 0.00 175.26 174.79 2k5j s GLU 67 N -0.36 3.23 -0.39 1.61 2.12 -1.26 -4.94 118.70 118.72 2k5j s GLU 67 Ca -0.00 -0.96 -0.26 0.00 0.36 0.00 0.00 54.97 54.11 2k5j s GLU 67 Cb -0.03 -5.28 0.02 0.00 0.26 0.00 0.00 34.13 29.10 2k5j s GLU 67 CO -0.00 -2.70 0.92 -0.51 -0.54 0.00 0.00 175.26 172.42 2k5j s ASP 68 N 5.96 6.63 0.00 -1.70 1.01 -1.26 -4.92 116.67 122.39 2k5j s ASP 68 Ca 0.56 0.48 0.00 0.00 0.71 0.00 0.00 52.55 54.30 2k5j s ASP 68 Cb -0.02 -2.46 0.00 0.00 1.01 0.00 0.00 42.92 41.46 2k5j s ASP 68 CO -0.04 -0.89 0.00 0.61 0.21 0.00 0.00 175.17 175.07 2k5j n GLY 69 N 4.50 0.94 3.06 0.21 0.00 -1.26 -5.17 105.19 107.47 2k5j n GLY 69 Ca 0.07 -0.55 -0.18 0.00 0.00 0.00 0.00 46.02 45.36 2k5j n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k5j s VAL 70 N -1.91 0.77 0.00 1.61 0.11 -1.26 -5.15 120.40 114.57 2k5j s VAL 70 Ca 0.00 -0.63 0.00 0.00 -2.93 0.00 0.00 61.98 58.42 2k5j s VAL 70 Cb 0.00 -0.69 0.00 0.00 -1.53 0.00 0.00 36.38 34.16 2k5j s VAL 70 CO 0.00 0.07 0.00 -0.62 -3.33 0.00 0.00 175.10 171.22 2k5j n GLU 71 N 2.43 -0.00 -5.24 1.54 4.71 -1.26 -5.05 120.64 117.76 2k5j n GLU 71 Ca -0.16 0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.68 2k5j n GLU 71 Cb 0.56 0.00 -0.16 0.00 -1.01 0.00 0.00 31.44 30.83 2k5j n GLU 71 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 2k5j s TYR 72 N -0.49 2.41 -0.22 -0.32 2.02 -1.26 -4.87 117.35 114.62 2k5j s TYR 72 Ca 0.00 -0.49 -0.13 0.00 -0.37 0.00 0.00 57.07 56.08 2k5j s TYR 72 Cb 0.00 -1.55 0.02 0.00 -0.40 0.00 0.00 41.96 40.03 2k5j s TYR 72 CO 0.00 -0.06 0.25 0.94 -1.57 0.00 0.00 175.55 175.11 2k5j n GLN 73 N 2.58 -1.43 -3.15 -0.62 -0.06 -1.26 -4.92 117.38 108.51 2k5j n GLN 73 Ca -0.17 1.39 -0.36 0.00 -2.00 0.00 0.00 57.00 55.86 2k5j n GLN 73 Cb 0.51 -2.38 -0.06 0.00 -4.06 0.00 0.00 30.24 24.26 2k5j n GLN 73 CO 0.00 0.00 0.00 -0.98 -0.20 0.00 0.00 177.06 175.88 2k5j s ARG 74 N -1.67 4.20 0.08 3.69 1.70 -1.26 -5.08 118.95 120.60 2k5j s ARG 74 Ca 0.14 0.80 0.09 0.00 -0.47 0.00 0.00 55.73 56.29 2k5j s ARG 74 Cb -0.02 -2.89 -0.03 0.00 -0.57 0.00 0.00 34.95 31.44 2k5j s ARG 74 CO 0.45 0.41 -0.23 0.15 -1.08 0.00 0.00 175.30 175.00 2k5j s LYS 75 N -1.97 1.76 1.78 3.89 -0.14 -1.26 -5.06 119.74 118.73 2k5j s LYS 75 Ca 0.42 -1.16 0.00 0.00 -1.36 0.00 0.00 55.97 53.87 2k5j s LYS 75 Cb -0.16 -2.03 0.00 0.00 -1.68 0.00 0.00 37.83 33.96 2k5j s LYS 75 CO 0.21 0.50 0.00 1.28 -0.76 0.00 0.00 175.35 176.57 2k5j n LEU 76 N 1.33 0.00 -4.77 3.17 4.77 -1.26 -4.65 117.00 115.59 2k5j n LEU 76 Ca -0.17 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.42 2k5j n LEU 76 Cb 0.52 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.56 2k5j n LEU 76 CO 0.25 -1.00 0.51 -0.13 -1.33 0.00 0.00 177.39 175.68 2k5j s ARG 77 N 0.00 4.60 0.31 3.23 0.52 -1.26 -5.03 118.95 121.32 2k5j s ARG 77 Ca 0.00 1.20 -0.29 0.00 -0.52 0.00 0.00 55.73 56.12 2k5j s ARG 77 Cb 0.00 -3.28 -0.10 0.00 0.52 0.00 0.00 34.95 32.09 2k5j s ARG 77 CO 0.00 0.51 1.24 -1.83 0.02 0.00 0.00 175.30 175.24 2k5j s GLU 78 N -0.95 4.45 0.00 3.54 -1.05 -1.26 -4.91 118.70 118.51 2k5j s GLU 78 Ca 0.37 2.08 0.29 0.00 -0.15 0.00 0.00 54.97 57.56 2k5j s GLU 78 Cb -0.23 -3.11 1.21 0.00 -0.44 0.00 0.00 34.13 31.56 2k5j s GLU 78 CO 0.27 -0.06 1.84 0.39 0.95 0.00 0.00 175.26 178.64 2k5j n GLU 79 N 0.98 1.51 -0.55 -4.83 1.02 -1.26 -5.24 120.64 112.26 2k5j n GLU 79 Ca -0.00 -0.76 0.00 0.00 -0.02 0.00 0.00 57.16 56.38 2k5j n GLU 79 Cb 0.43 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 2k5j n GLU 79 CO 0.00 0.00 0.00 0.91 1.18 0.00 0.00 177.13 179.22