#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 -2.97 -2.86 7.83 5.15 -1.26 -3.79 115.26 117.36 2k5j n ASN 2 Ca 0.00 -0.73 -0.02 0.00 -0.60 0.00 0.00 54.58 53.23 2k5j n ASN 2 Cb 0.00 -4.36 0.00 0.00 -0.53 0.00 0.00 39.78 34.89 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 -3.01 -7.66 -4.71 1.20 7.64 -1.26 -4.92 113.62 100.91 2k5j n SER 3 Ca -0.17 1.08 -0.41 0.00 1.01 0.00 0.00 58.87 60.38 2k5j n SER 3 Cb 0.62 -4.46 -0.04 0.00 -1.01 0.00 0.00 64.21 59.33 2k5j n SER 3 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2k5j s LEU 4 N -1.64 4.32 -0.28 -3.43 2.96 -1.25 -5.03 118.68 114.34 2k5j s LEU 4 Ca 0.04 1.37 -0.10 0.00 -0.22 0.00 0.00 54.13 55.22 2k5j s LEU 4 Cb -0.01 -3.29 0.11 0.00 0.50 0.00 0.00 46.19 43.51 2k5j s LEU 4 CO 0.63 -0.21 0.61 0.00 -1.32 0.00 0.00 176.35 176.06 2k5j s ALA 5 N 1.06 -1.84 0.49 5.97 0.00 -1.26 -5.06 121.76 121.11 2k5j s ALA 5 Ca 0.43 2.19 0.01 0.00 0.00 0.00 0.00 51.96 54.59 2k5j s ALA 5 Cb -0.19 -1.63 0.06 0.00 0.00 0.00 0.00 23.12 21.36 2k5j s ALA 5 CO 0.21 -0.81 0.42 0.41 0.00 0.00 0.00 175.76 175.99 2k5j n GLY 6 N 5.26 0.92 3.47 0.00 0.00 -1.26 -5.07 105.19 108.51 2k5j n GLY 6 Ca -0.13 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.48 2k5j n GLY 6 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2k5j s ILE 7 N -1.10 4.82 -1.25 -0.61 2.07 -1.26 -4.46 121.20 119.42 2k5j s ILE 7 Ca 0.28 -0.35 -0.02 0.00 -1.41 0.00 0.00 60.65 59.15 2k5j s ILE 7 Cb -0.02 -3.46 0.00 0.00 0.13 0.00 0.00 42.46 39.11 2k5j s ILE 7 CO 0.19 0.05 1.04 -0.67 -1.91 0.00 0.00 174.94 173.64 2k5j n ASP 8 N 5.02 -3.17 -4.45 4.50 4.64 -1.26 -4.96 116.55 116.86 2k5j n ASP 8 Ca -0.13 -0.60 -0.28 0.00 -1.38 0.00 0.00 54.79 52.39 2k5j n ASP 8 Cb 0.49 -5.08 0.26 0.00 -1.04 0.00 0.00 41.12 35.76 2k5j n ASP 8 CO 0.00 0.00 0.00 -0.04 -0.82 0.00 0.00 177.20 176.34 2k5j s MET 9 N -5.63 -1.20 0.47 -0.67 -1.94 -1.26 -5.05 119.30 104.02 2k5j s MET 9 Ca 0.16 0.80 0.07 0.00 -1.71 0.00 0.00 55.69 55.00 2k5j s MET 9 Cb -0.07 -1.52 -0.00 0.00 2.01 0.00 0.00 34.83 35.24 2k5j s MET 9 CO 0.73 -3.90 0.33 0.20 -0.01 0.00 0.00 175.02 172.37 2k5j s GLY 10 N -2.46 2.29 -0.11 -0.03 0.00 -1.26 -5.14 107.32 100.61 2k5j s GLY 10 Ca 0.69 -1.68 -0.09 0.00 0.00 0.00 0.00 44.72 43.64 2k5j s GLY 10 CO 0.65 -1.86 0.28 -1.60 0.00 0.00 0.00 173.10 170.58 2k5j s ARG 11 N -4.13 0.31 0.03 2.90 3.52 -1.26 -5.16 118.95 115.15 2k5j s ARG 11 Ca 0.40 0.44 0.01 0.00 -0.13 0.00 0.00 55.73 56.45 2k5j s ARG 11 Cb -0.01 0.10 -0.02 0.00 -1.56 0.00 0.00 34.95 33.46 2k5j s ARG 11 CO 0.24 -0.07 -0.05 0.42 -0.81 0.00 0.00 175.30 175.03 2k5j s ILE 12 N 0.42 0.26 -0.26 4.11 1.01 -1.26 -5.13 121.20 120.35 2k5j s ILE 12 Ca -0.02 -0.94 -0.17 0.00 0.00 0.00 0.00 60.65 59.52 2k5j s ILE 12 Cb -0.04 -0.38 -0.03 0.00 0.01 0.00 0.00 42.46 42.02 2k5j s ILE 12 CO -0.02 -0.44 0.47 -0.22 0.00 0.00 0.00 174.94 174.73 2k5j s LEU 13 N -1.45 4.05 -0.13 2.97 0.20 -1.26 -5.06 118.68 118.01 2k5j s LEU 13 Ca -0.13 0.45 0.00 0.00 0.69 0.00 0.00 54.13 55.14 2k5j s LEU 13 Cb -0.10 -2.58 -0.02 0.00 -0.43 0.00 0.00 46.19 43.06 2k5j s LEU 13 CO -0.00 -0.25 -0.13 -0.22 -0.29 0.00 0.00 176.35 175.45 2k5j s LEU 14 N 2.21 2.71 -0.14 -0.68 2.96 -1.26 -5.11 118.68 119.38 2k5j s LEU 14 Ca 0.19 -0.32 0.00 0.00 -0.22 0.00 0.00 54.13 53.78 2k5j s LEU 14 Cb -0.16 -1.61 -0.01 0.00 0.50 0.00 0.00 46.19 44.92 2k5j s LEU 14 CO 0.09 0.17 -0.14 1.51 -1.32 0.00 0.00 176.35 176.66 2k5j s ASP 15 N 0.30 3.83 0.03 3.68 -4.77 -1.26 -5.12 116.67 113.35 2k5j s ASP 15 Ca -0.10 -0.40 0.03 0.00 -3.30 0.00 0.00 52.55 48.79 2k5j s ASP 15 Cb -0.16 -1.58 -0.02 0.00 -1.09 0.00 0.00 42.92 40.07 2k5j s ASP 15 CO 0.06 0.13 -0.11 -0.76 0.70 0.00 0.00 175.17 175.19 2k5j s LEU 16 N 0.54 2.14 0.84 2.11 1.43 -1.26 -5.14 118.68 119.34 2k5j s LEU 16 Ca -0.09 -0.38 -0.10 0.00 -1.03 0.00 0.00 54.13 52.53 2k5j s LEU 16 Cb -0.16 -0.44 0.10 0.00 0.03 0.00 0.00 46.19 45.72 2k5j s LEU 16 CO 0.04 -0.00 1.11 -0.44 0.23 0.00 0.00 176.35 177.29 2k5j s SER 17 N -0.93 3.80 0.31 2.29 0.01 -1.26 -4.85 113.70 113.06 2k5j s SER 17 Ca -0.01 1.95 -0.01 0.00 1.31 0.00 0.00 55.95 59.20 2k5j s SER 17 Cb -0.07 -2.52 0.48 0.00 0.21 0.00 0.00 66.02 64.12 2k5j s SER 17 CO 0.01 -2.50 1.95 0.78 0.41 0.00 0.00 173.24 173.88 2k5j h ASN 18 N -1.46 0.86 -0.62 2.44 -0.26 -2.01 -1.77 115.58 112.76 2k5j h ASN 18 Ca -0.44 -0.05 0.00 0.00 -0.56 0.00 0.00 56.30 55.25 2k5j h ASN 18 Cb 1.25 -0.22 -0.03 0.00 -1.06 0.00 0.00 38.32 38.26 2k5j h ASN 18 CO 0.48 0.67 0.40 -0.08 -1.06 0.00 0.00 177.43 177.83 2k5j h GLU 19 N 0.98 0.84 -0.35 0.81 4.57 -2.01 -2.30 114.58 117.12 2k5j h GLU 19 Ca 0.26 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 58.30 2k5j h GLU 19 Cb -0.02 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.37 2k5j h GLU 19 CO -0.05 0.57 -0.10 0.28 -1.18 0.00 0.00 179.01 178.53 2k5j h VAL 20 N 0.86 1.28 -0.93 0.32 2.07 -1.68 -2.84 116.25 115.33 2k5j h VAL 20 Ca 0.23 -1.18 0.14 0.00 0.82 0.00 0.00 66.70 66.71 2k5j h VAL 20 Cb -0.07 1.32 -0.08 0.00 -1.52 0.00 0.00 31.29 30.94 2k5j h VAL 20 CO -0.05 0.39 0.59 0.40 0.02 0.00 0.00 177.57 178.92 2k5j h ILE 21 N 0.48 0.85 -0.63 4.57 2.04 -1.06 0.23 117.51 123.99 2k5j h ILE 21 Ca 0.09 -0.27 -0.07 0.00 1.00 0.00 0.00 64.86 65.61 2k5j h ILE 21 Cb 0.62 -0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 2k5j h ILE 21 CO 0.04 0.14 0.12 0.11 0.00 0.00 0.00 178.15 178.56 2k5j h LYS 22 N 0.78 1.00 -0.07 2.37 1.57 -1.26 0.71 116.57 121.68 2k5j h LYS 22 Ca 0.47 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 2k5j h LYS 22 Cb 0.66 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 2k5j h LYS 22 CO -0.23 0.91 0.00 1.96 -0.57 0.00 0.00 179.45 181.52 2k5j h GLN 23 N 0.95 0.11 -0.82 3.15 4.20 -0.43 -2.52 115.11 119.75 2k5j h GLN 23 Ca 0.20 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.85 2k5j h GLN 23 Cb 0.38 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 2k5j h GLN 23 CO 0.01 0.38 0.44 -0.07 -0.67 0.00 0.00 178.83 178.91 2k5j h LEU 24 N -0.16 1.04 -0.74 1.46 3.38 -0.83 -2.43 115.31 117.03 2k5j h LEU 24 Ca 0.02 -0.11 0.08 0.00 0.09 0.00 0.00 57.88 57.96 2k5j h LEU 24 Cb 0.32 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 2k5j h LEU 24 CO 0.00 0.85 0.41 -0.78 0.09 0.00 0.00 178.44 179.00 2k5j h ASP 25 N 1.15 0.58 -0.78 -0.43 1.82 -0.76 0.48 116.42 118.49 2k5j h ASP 25 Ca 0.29 0.04 -0.00 0.00 -0.39 0.00 0.00 57.03 56.97 2k5j h ASP 25 Cb 0.05 -0.07 -0.04 0.00 0.68 0.00 0.00 39.33 39.95 2k5j h ASP 25 CO -0.04 0.35 0.49 -0.78 -1.61 0.00 0.00 179.24 177.64 2k5j h ASP 26 N 0.71 0.93 0.36 2.28 -0.00 -1.00 0.11 116.42 119.81 2k5j h ASP 26 Ca 0.34 -0.05 -0.14 0.00 -0.00 0.00 0.00 57.03 57.18 2k5j h ASP 26 Cb 0.28 -0.23 -0.01 0.00 -0.00 0.00 0.00 39.33 39.36 2k5j h ASP 26 CO -0.22 0.71 -0.60 -0.07 -0.00 0.00 0.00 179.24 179.06 2k5j h LEU 27 N 1.07 0.27 -0.38 2.28 4.07 -0.93 -2.36 115.31 119.33 2k5j h LEU 27 Ca 0.28 -0.15 -0.16 0.00 0.08 0.00 0.00 57.88 57.93 2k5j h LEU 27 Cb -0.06 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 41.59 2k5j h LEU 27 CO -0.06 0.80 -0.40 -0.33 -1.08 0.00 0.00 178.44 177.38 2k5j h GLU 28 N 0.18 0.94 0.01 1.13 5.08 0.62 -2.59 114.58 119.94 2k5j h GLU 28 Ca -0.01 -0.50 -0.00 0.00 -1.00 0.00 0.00 59.36 57.85 2k5j h GLU 28 Cb 1.10 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2k5j h GLU 28 CO 0.09 1.16 -0.01 0.28 -1.00 0.00 0.00 179.01 179.54 2k5j h VAL 29 N 0.76 1.28 -0.44 3.13 2.07 -0.76 2.75 116.25 125.03 2k5j h VAL 29 Ca 0.06 -0.87 0.08 0.00 0.82 0.00 0.00 66.70 66.79 2k5j h VAL 29 Cb 1.00 1.86 -0.07 0.00 -1.52 0.00 0.00 31.29 32.56 2k5j h VAL 29 CO 0.10 0.22 -0.01 1.56 0.02 0.00 0.00 177.57 179.46 2k5j h GLN 30 N -0.39 0.09 0.00 1.57 1.08 -1.46 -0.84 115.11 115.16 2k5j h GLN 30 Ca -0.00 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2k5j h GLN 30 Cb 0.38 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2k5j h GLN 30 CO 0.00 0.06 -0.57 0.54 -0.95 0.00 0.00 178.83 177.91 2k5j n ARG 31 N -5.23 0.16 -2.51 1.46 1.74 -0.98 -4.94 116.66 106.36 2k5j n ARG 31 Ca 0.04 0.04 -0.20 0.00 -0.77 0.00 0.00 57.85 56.95 2k5j n ARG 31 Cb 0.24 -1.59 -0.00 0.00 -1.02 0.00 0.00 32.46 30.08 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 -1.82 -5.75 -4.62 0.55 3.02 0.91 -4.98 115.26 102.57 2k5j n ASN 32 Ca 0.04 -0.04 -0.25 0.00 -0.03 0.00 0.00 54.58 54.30 2k5j n ASN 32 Cb 0.39 -4.77 -0.08 0.00 -0.61 0.00 0.00 39.78 34.71 2k5j n ASN 32 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2k5j s LEU 33 N -6.11 3.13 0.68 3.41 1.02 -0.13 -4.97 118.68 115.71 2k5j s LEU 33 Ca 0.05 -0.60 -0.14 0.00 0.02 0.00 0.00 54.13 53.47 2k5j s LEU 33 Cb -0.02 -1.72 0.01 0.00 0.02 0.00 0.00 46.19 44.48 2k5j s LEU 33 CO 0.06 0.05 1.10 -2.16 0.02 0.00 0.00 176.35 175.42 2k5j s PRO 34 N -3.29 2.74 0.12 1.29 0.04 -1.26 -4.50 135.00 130.15 2k5j s PRO 34 Ca 0.29 1.30 -0.16 0.00 0.04 0.00 0.00 61.00 62.47 2k5j s PRO 34 Cb -0.08 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 2k5j s PRO 34 CO 0.18 -1.28 1.62 0.07 0.04 0.00 0.00 177.00 177.63 2k5j h ARG 35 N -0.21 0.61 -0.97 4.56 0.11 -1.97 -2.78 114.38 113.74 2k5j h ARG 35 Ca -0.46 -0.15 0.24 0.00 0.10 0.00 0.00 59.98 59.71 2k5j h ARG 35 Cb 1.24 -0.08 -0.13 0.00 1.11 0.00 0.00 29.97 32.11 2k5j h ARG 35 CO 0.54 0.65 0.52 0.00 0.10 0.00 0.00 179.97 181.78 2k5j h ALA 36 N 0.94 1.68 -0.57 0.08 0.00 -1.99 0.61 119.26 120.00 2k5j h ALA 36 Ca 0.12 0.14 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 2k5j h ALA 36 Cb 0.31 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2k5j h ALA 36 CO 0.00 -0.32 0.01 -0.44 0.00 0.00 0.00 179.25 178.50 2k5j h ASP 37 N 0.50 0.95 -0.61 0.00 3.45 -1.88 -1.98 116.42 116.85 2k5j h ASP 37 Ca 0.62 -0.25 -0.08 0.00 0.43 0.00 0.00 57.03 57.75 2k5j h ASP 37 Cb 1.20 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 39.69 2k5j h ASP 37 CO -0.51 1.00 0.09 -0.07 -1.57 0.00 0.00 179.24 178.18 2k5j h LEU 38 N 0.90 0.97 -0.29 1.55 3.38 0.24 -1.76 115.31 120.31 2k5j h LEU 38 Ca 0.17 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2k5j h LEU 38 Cb 0.51 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2k5j h LEU 38 CO 0.03 1.00 0.13 -0.07 0.09 0.00 0.00 178.44 179.61 2k5j h LEU 39 N 0.92 0.38 -0.62 1.67 3.38 -0.63 0.39 115.31 120.80 2k5j h LEU 39 Ca 0.18 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2k5j h LEU 39 Cb 0.44 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 2k5j h LEU 39 CO 0.01 0.41 0.40 -0.09 0.09 0.00 0.00 178.44 179.27 2k5j h ARG 40 N 0.33 0.83 -0.35 1.13 2.43 -1.24 0.17 114.38 117.66 2k5j h ARG 40 Ca 0.10 -0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.12 2k5j h ARG 40 Cb 0.13 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 2k5j h ARG 40 CO -0.01 0.56 -0.14 0.93 -1.51 0.00 0.00 179.97 179.79 2k5j h GLU 41 N 0.84 0.72 -0.53 0.20 5.08 -1.08 0.11 114.58 119.93 2k5j h GLU 41 Ca 0.23 -0.31 0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2k5j h GLU 41 Cb -0.08 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 2k5j h GLU 41 CO -0.05 0.91 0.31 0.00 -1.00 0.00 0.00 179.01 179.18 2k5j h ALA 42 N 0.80 0.69 0.11 3.43 0.00 0.15 0.53 119.26 124.96 2k5j h ALA 42 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2k5j h ALA 42 Cb 0.68 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2k5j h ALA 42 CO 0.05 0.01 -0.06 0.28 0.00 0.00 0.00 179.25 179.53 2k5j h VAL 43 N 0.62 1.08 -0.44 0.00 2.07 -0.88 -0.39 116.25 118.30 2k5j h VAL 43 Ca 0.22 -0.87 0.08 0.00 0.82 0.00 0.00 66.70 66.95 2k5j h VAL 43 Cb 0.05 1.61 -0.07 0.00 -1.52 0.00 0.00 31.29 31.36 2k5j h VAL 43 CO -0.11 0.21 0.05 0.44 0.02 0.00 0.00 177.57 178.18 2k5j h ASP 44 N -0.57 -0.07 -0.92 0.57 3.45 -0.55 0.13 116.42 118.45 2k5j h ASP 44 Ca -0.02 0.09 -0.01 0.00 0.43 0.00 0.00 57.03 57.52 2k5j h ASP 44 Cb 0.45 0.14 -0.04 0.00 -0.56 0.00 0.00 39.33 39.32 2k5j h ASP 44 CO 0.03 -0.00 0.54 1.56 -1.57 0.00 0.00 179.24 179.79 2k5j h GLN 45 N 0.17 1.26 -0.80 3.56 4.20 0.06 -2.07 115.11 121.50 2k5j h GLN 45 Ca 0.22 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 2k5j h GLN 45 Cb 0.30 -0.26 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 2k5j h GLN 45 CO -0.32 0.90 0.48 -0.92 -0.67 0.00 0.00 178.83 178.29 2k5j h TYR 46 N 1.28 1.06 -0.77 2.96 3.20 0.63 -2.11 116.97 123.21 2k5j h TYR 46 Ca 0.33 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.17 2k5j h TYR 46 Cb -0.03 -0.35 -0.04 0.00 1.54 0.00 0.00 36.73 37.86 2k5j h TYR 46 CO 0.01 0.71 0.38 -0.07 -1.64 0.00 0.00 178.16 177.56 2k5j h LEU 47 N 1.10 1.00 -0.42 2.82 3.38 -0.22 0.00 115.31 122.97 2k5j h LEU 47 Ca 0.29 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2k5j h LEU 47 Cb -0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 2k5j h LEU 47 CO -0.05 0.85 0.24 0.40 0.09 0.00 0.00 178.44 179.97 2k5j h ILE 48 N 1.09 1.15 -0.59 1.22 2.04 -0.89 0.30 117.51 121.82 2k5j h ILE 48 Ca 0.27 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.69 2k5j h ILE 48 Cb 0.10 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 2k5j h ILE 48 CO -0.04 0.15 0.07 -1.13 0.00 0.00 0.00 178.15 177.20 2k5j h ASN 49 N 0.56 0.96 -0.37 1.72 -0.00 -1.09 1.47 115.58 118.83 2k5j h ASN 49 Ca 0.15 -0.28 -0.05 0.00 -0.00 0.00 0.00 56.30 56.13 2k5j h ASN 49 Cb 0.03 -0.26 -0.01 0.00 -0.00 0.00 0.00 38.32 38.08 2k5j h ASN 49 CO -0.03 1.00 0.05 1.56 -0.00 0.00 0.00 177.43 180.00 2k5j h GLN 50 N 0.89 0.62 0.03 6.67 1.08 -0.62 -3.30 115.11 120.48 2k5j h GLN 50 Ca 0.18 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2k5j h GLN 50 Cb 0.46 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.82 2k5j h GLN 50 CO 0.02 0.70 -0.01 0.77 -0.95 0.00 0.00 178.83 179.35 2k5j h SER 51 N 0.46 -0.03 0.00 1.46 0.02 -0.29 -3.46 113.55 111.70 2k5j h SER 51 Ca 0.11 -0.60 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 2k5j h SER 51 Cb 0.39 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.94 2k5j h SER 51 CO 0.01 0.73 0.00 1.67 -1.14 0.00 0.00 176.83 178.10 2k5j n GLN 52 N -4.72 0.00 -2.73 3.45 7.27 0.50 -0.51 117.38 120.64 2k5j n GLN 52 Ca -0.07 0.00 -0.04 0.00 0.07 0.00 0.00 57.00 56.96 2k5j n GLN 52 Cb 0.30 0.00 0.07 0.00 2.41 0.00 0.00 30.24 33.03 2k5j n GLN 52 CO 0.00 0.00 0.00 -2.37 0.07 0.00 0.00 177.06 174.76 2k5j n THR 53 N 0.00 0.71 -1.58 1.69 5.66 -1.26 -4.95 114.28 114.55 2k5j n THR 53 Ca 0.00 -2.30 -0.17 0.00 -3.05 0.00 0.00 64.05 58.53 2k5j n THR 53 Cb 0.00 1.02 -0.07 0.00 -1.55 0.00 0.00 70.33 69.74 2k5j n THR 53 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2k5j n ALA 54 N -0.67 -0.30 -3.56 1.79 0.00 0.33 -2.20 120.51 115.90 2k5j n ALA 54 Ca 0.00 0.26 -0.25 0.00 0.00 0.00 0.00 53.44 53.46 2k5j n ALA 54 Cb 0.83 -1.75 0.05 0.00 0.00 0.00 0.00 19.45 18.58 2k5j n ALA 54 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2k5j n ARG 55 N -2.21 -2.17 -0.01 0.00 0.63 -1.24 -4.91 116.66 106.75 2k5j n ARG 55 Ca -0.17 0.61 0.02 0.00 -0.92 0.00 0.00 57.85 57.38 2k5j n ARG 55 Cb 0.57 -4.82 0.03 0.00 0.45 0.00 0.00 32.46 28.69 2k5j n ARG 55 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2k5j n THR 56 N -3.91 1.15 -0.24 5.15 -2.24 -0.94 -4.71 114.28 108.54 2k5j n THR 56 Ca -0.12 -1.22 -0.05 0.00 -2.27 0.00 0.00 64.05 60.39 2k5j n THR 56 Cb 0.62 0.37 0.06 0.00 -2.10 0.00 0.00 70.33 69.28 2k5j n THR 56 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2k5j h SER 57 N 0.03 0.76 -4.01 3.42 0.02 -1.91 -3.42 113.55 108.44 2k5j h SER 57 Ca 0.00 -0.01 -0.45 0.00 -0.84 0.00 0.00 61.79 60.49 2k5j h SER 57 Cb 0.59 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.93 2k5j h SER 57 CO 0.00 0.54 0.32 0.68 -1.14 0.00 0.00 176.83 177.23 2k5j s VAL 58 N -6.13 4.40 0.50 2.27 -7.23 -1.26 -5.03 120.40 107.91 2k5j s VAL 58 Ca -0.13 1.48 -0.22 0.00 -1.81 0.00 0.00 61.98 61.30 2k5j s VAL 58 Cb 0.14 -3.64 -0.06 0.00 0.56 0.00 0.00 36.38 33.38 2k5j s VAL 58 CO 0.77 -0.26 1.18 -2.16 -0.31 0.00 0.00 175.10 174.32 2k5j s PRO 59 N -3.04 3.53 0.14 4.82 0.04 -1.26 -4.76 135.00 134.47 2k5j s PRO 59 Ca 0.60 1.79 0.00 0.00 0.04 0.00 0.00 61.00 63.43 2k5j s PRO 59 Cb -0.10 -2.26 0.00 0.00 0.04 0.00 0.00 34.50 32.18 2k5j s PRO 59 CO 0.14 -0.74 0.00 0.41 0.04 0.00 0.00 177.00 176.85 2k5j n GLY 60 N 0.41 -4.21 3.21 0.56 0.00 -1.26 -4.90 105.19 99.00 2k5j n GLY 60 Ca 0.09 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.00 4.72 0.05 -0.61 -4.36 -1.26 -5.02 121.20 113.70 2k5j s ILE 61 Ca 0.00 -2.81 -0.11 0.00 -0.26 0.00 0.00 60.65 57.48 2k5j s ILE 61 Cb 0.00 -3.97 0.01 0.00 1.25 0.00 0.00 42.46 39.75 2k5j s ILE 61 CO 0.00 -0.97 0.23 -1.66 0.24 0.00 0.00 174.94 172.78 2k5j s TRP 62 N -0.08 0.01 -0.41 1.37 1.48 -1.26 -5.12 118.94 114.92 2k5j s TRP 62 Ca 0.18 -0.22 0.04 0.00 -1.06 0.00 0.00 56.10 55.04 2k5j s TRP 62 Cb -0.14 0.01 0.17 0.00 -1.16 0.00 0.00 33.47 32.34 2k5j s TRP 62 CO -0.07 -0.46 0.39 -0.65 -4.06 0.00 0.00 176.95 172.10 2k5j s GLN 63 N -2.66 0.85 0.26 3.25 -0.21 -1.26 -4.98 119.66 114.91 2k5j s GLN 63 Ca -0.04 -1.69 -0.03 0.00 0.02 0.00 0.00 55.36 53.62 2k5j s GLN 63 Cb -0.01 -1.09 0.34 0.00 1.00 0.00 0.00 33.01 33.25 2k5j s GLN 63 CO -0.04 -1.33 1.81 0.78 -2.12 0.00 0.00 175.29 174.38 2k5j h GLY 64 N 5.89 0.96 0.99 3.09 0.00 -2.00 -2.50 103.07 109.51 2k5j h GLY 64 Ca 0.18 -0.56 0.05 0.00 0.00 0.00 0.00 47.33 47.00 2k5j h GLY 64 CO 0.28 0.53 0.55 0.00 0.00 0.00 0.00 176.54 177.89 2k5j n GLU 66 N -4.47 -3.24 0.00 0.00 2.13 -0.94 -4.69 120.64 109.43 2k5j n GLU 66 Ca 0.12 2.51 0.00 0.00 0.66 0.00 0.00 57.16 60.44 2k5j n GLU 66 Cb 0.16 -3.27 0.00 0.00 0.27 0.00 0.00 31.44 28.61 2k5j n GLU 66 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2k5j n GLU 67 N 2.04 0.00 -2.34 5.31 1.02 -1.26 -4.61 120.64 120.80 2k5j n GLU 67 Ca -0.21 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.52 2k5j n GLU 67 Cb 0.33 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.71 2k5j n GLU 67 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2k5j s ASP 68 N -4.00 7.07 -0.18 1.62 1.01 -1.26 -5.01 116.67 115.92 2k5j s ASP 68 Ca 0.00 2.36 -0.35 0.00 0.71 0.00 0.00 52.55 55.27 2k5j s ASP 68 Cb 0.00 -2.62 0.14 0.00 1.01 0.00 0.00 42.92 41.45 2k5j s ASP 68 CO 0.00 -0.33 1.26 -0.83 0.21 0.00 0.00 175.17 175.48 2k5j s GLY 69 N -0.39 -0.30 0.09 0.21 0.00 -1.26 -5.17 107.32 100.50 2k5j s GLY 69 Ca 0.49 1.53 0.01 0.00 0.00 0.00 0.00 44.72 46.74 2k5j s GLY 69 CO 0.42 0.49 -0.03 -1.34 0.00 0.00 0.00 173.10 172.64 2k5j s VAL 70 N -2.34 0.47 -0.77 1.40 -7.23 -1.26 -5.10 120.40 105.57 2k5j s VAL 70 Ca 0.11 -1.90 -0.26 0.00 -1.81 0.00 0.00 61.98 58.12 2k5j s VAL 70 Cb -0.00 -1.72 0.03 0.00 0.56 0.00 0.00 36.38 35.26 2k5j s VAL 70 CO -0.04 -0.83 1.29 -1.61 -0.31 0.00 0.00 175.10 173.61 2k5j s GLU 71 N -3.90 3.24 0.17 4.82 0.41 -1.26 -4.86 118.70 117.32 2k5j s GLU 71 Ca 0.13 -0.37 -0.13 0.00 -0.41 0.00 0.00 54.97 54.19 2k5j s GLU 71 Cb 0.07 -4.33 0.06 0.00 -1.78 0.00 0.00 34.13 28.14 2k5j s GLU 71 CO -0.05 -2.15 1.77 1.88 -0.49 0.00 0.00 175.26 176.23 2k5j h TYR 72 N 9.99 0.77 -3.52 1.61 0.05 -2.07 -3.42 116.97 120.37 2k5j h TYR 72 Ca -0.22 -0.02 -0.52 0.00 0.05 0.00 0.00 58.73 58.02 2k5j h TYR 72 Cb 1.05 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 38.54 2k5j h TYR 72 CO 1.15 0.57 0.47 -1.14 -1.05 0.00 0.00 178.16 178.15 2k5j s GLN 73 N -5.82 4.59 -0.10 4.88 0.74 -1.26 -5.03 119.66 117.66 2k5j s GLN 73 Ca -0.13 1.69 -0.12 0.00 0.05 0.00 0.00 55.36 56.85 2k5j s GLN 73 Cb 0.12 -3.30 -0.05 0.00 1.10 0.00 0.00 33.01 30.89 2k5j s GLN 73 CO 0.77 0.05 0.29 -0.98 -0.55 0.00 0.00 175.29 174.87 2k5j s ARG 74 N -0.16 3.94 0.00 1.67 1.70 -1.26 -4.97 118.95 119.87 2k5j s ARG 74 Ca 0.50 0.15 0.25 0.00 -0.47 0.00 0.00 55.73 56.16 2k5j s ARG 74 Cb -0.29 -3.30 0.54 0.00 -0.57 0.00 0.00 34.95 31.34 2k5j s ARG 74 CO 0.34 0.53 1.44 0.36 -1.08 0.00 0.00 175.30 176.88 2k5j n LYS 75 N 2.58 1.18 -2.22 3.89 2.85 -1.26 -4.92 118.16 120.25 2k5j n LYS 75 Ca -0.15 -0.81 -0.41 0.00 -1.05 0.00 0.00 58.31 55.89 2k5j n LYS 75 Cb 0.53 -1.48 -0.03 0.00 -0.65 0.00 0.00 35.03 33.40 2k5j n LYS 75 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2k5j s LEU 76 N -2.38 4.42 -0.17 -5.58 1.43 -1.26 -5.02 118.68 110.12 2k5j s LEU 76 Ca 0.25 2.42 -0.12 0.00 -1.03 0.00 0.00 54.13 55.65 2k5j s LEU 76 Cb 0.19 -3.61 0.05 0.00 0.03 0.00 0.00 46.19 42.85 2k5j s LEU 76 CO 0.49 -0.51 0.44 -0.60 0.23 0.00 0.00 176.35 176.40 2k5j s ARG 77 N -0.35 0.46 0.07 1.70 3.52 -1.26 -5.04 118.95 118.05 2k5j s ARG 77 Ca 0.55 0.73 0.00 0.00 -0.13 0.00 0.00 55.73 56.88 2k5j s ARG 77 Cb -0.37 0.11 0.00 0.00 -1.56 0.00 0.00 34.95 33.14 2k5j s ARG 77 CO 0.40 -0.11 0.00 -1.91 -0.81 0.00 0.00 175.30 172.87 2k5j n GLU 78 N 3.59 0.00 -3.06 5.12 0.00 -1.26 -5.11 120.64 119.92 2k5j n GLU 78 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 57.16 56.83 2k5j n GLU 78 Cb 0.56 0.00 0.02 0.00 0.00 0.00 0.00 31.44 32.02 2k5j n GLU 78 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2k5j n GLU 79 N -2.66 -2.20 -0.39 5.31 1.02 -1.26 -5.38 120.64 115.08 2k5j n GLU 79 Ca 0.00 1.88 0.00 0.00 -0.02 0.00 0.00 57.16 59.02 2k5j n GLU 79 Cb 0.00 -4.01 0.00 0.00 -0.02 0.00 0.00 31.44 27.41 2k5j n GLU 79 CO 0.00 0.00 0.00 1.87 1.18 0.00 0.00 177.13 180.18