#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k19 n GLY 2 N 0.00 0.80 3.70 3.03 0.00 -1.26 -5.00 105.19 106.47 2k19 n GLY 2 Ca 0.00 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2k19 n GLY 2 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k19 s LYS 3 N 2.01 4.50 -0.14 1.61 2.47 -1.26 -5.02 119.74 123.91 2k19 s LYS 3 Ca 0.00 1.31 -0.24 0.00 -1.56 0.00 0.00 55.97 55.48 2k19 s LYS 3 Cb 0.00 -3.48 -0.02 0.00 -1.46 0.00 0.00 37.83 32.87 2k19 s LYS 3 CO 0.00 -0.10 0.75 -0.51 0.16 0.00 0.00 175.35 175.66 2k19 s LEU 4 N 1.22 4.21 0.00 5.43 2.01 -1.26 -4.92 118.68 125.37 2k19 s LEU 4 Ca 0.48 1.11 0.22 0.00 0.01 0.00 0.00 54.13 55.96 2k19 s LEU 4 Cb -0.20 -3.12 0.19 0.00 0.01 0.00 0.00 46.19 43.07 2k19 s LEU 4 CO 0.24 -0.29 1.22 0.29 1.01 0.00 0.00 176.35 178.82 2k19 n LYS 5 N 4.75 2.13 -3.61 1.70 5.02 -1.26 -4.99 118.16 121.90 2k19 n LYS 5 Ca 0.02 -1.86 -0.28 0.00 -2.02 0.00 0.00 58.31 54.17 2k19 n LYS 5 Cb 0.50 -1.43 0.05 0.00 -0.02 0.00 0.00 35.03 34.12 2k19 n LYS 5 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2k19 n TRP 6 N 1.27 -2.01 -3.44 2.13 7.02 -1.26 -5.00 117.44 116.15 2k19 n TRP 6 Ca 0.13 0.54 -0.06 0.00 -1.02 0.00 0.00 57.50 57.10 2k19 n TRP 6 Cb 0.56 -3.61 -0.07 0.00 -2.42 0.00 0.00 31.31 25.78 2k19 n TRP 6 CO 0.00 0.00 0.00 0.12 -2.02 0.00 0.00 177.69 175.79 2k19 s PHE 7 N -3.47 -0.99 -0.29 -5.99 5.36 -1.26 -5.14 117.98 106.20 2k19 s PHE 7 Ca 0.45 1.32 -0.22 0.00 -0.96 0.00 0.00 56.93 57.53 2k19 s PHE 7 Cb -0.14 0.27 0.17 0.00 -0.34 0.00 0.00 43.02 42.98 2k19 s PHE 7 CO 0.84 -0.66 1.23 -1.54 -1.46 0.00 0.00 175.22 173.63 2k19 s SER 8 N 2.65 -0.22 0.00 6.13 1.04 -1.26 -5.17 113.70 116.87 2k19 s SER 8 Ca 0.08 0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.90 2k19 s SER 8 Cb -0.14 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.64 2k19 s SER 8 CO -0.16 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.61 2k19 n GLY 9 N 2.41 4.28 0.09 7.32 0.00 -1.26 -5.13 105.19 112.90 2k19 n GLY 9 Ca -0.14 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.24 2k19 n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k19 n GLY 10 N -0.42 0.69 2.20 -0.02 0.00 -1.26 -4.96 105.19 101.42 2k19 n GLY 10 Ca 0.00 -0.66 -0.27 0.00 0.00 0.00 0.00 46.02 45.09 2k19 n GLY 10 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2k19 n LYS 11 N -0.05 2.98 -3.59 1.61 2.85 -1.26 -4.79 118.16 115.92 2k19 n LYS 11 Ca 0.00 -1.80 -0.14 0.00 -1.05 0.00 0.00 58.31 55.33 2k19 n LYS 11 Cb 0.02 -2.41 -0.06 0.00 -0.65 0.00 0.00 35.03 31.92 2k19 n LYS 11 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2k19 s GLU 12 N 1.21 0.81 0.13 -1.58 2.02 -1.26 -5.05 118.70 114.98 2k19 s GLU 12 Ca 0.67 0.54 -0.03 0.00 0.02 0.00 0.00 54.97 56.17 2k19 s GLU 12 Cb 0.25 0.39 -0.11 0.00 0.10 0.00 0.00 34.13 34.76 2k19 s GLU 12 CO -0.05 -0.18 1.29 0.00 0.02 0.00 0.00 175.26 176.34 2k19 h ARG 13 N 3.77 0.33 0.03 1.61 3.08 -1.99 -2.50 114.38 118.71 2k19 h ARG 13 Ca -0.26 -0.39 -0.00 0.00 0.07 0.00 0.00 59.98 59.39 2k19 h ARG 13 Cb 1.16 0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2k19 h ARG 13 CO 0.22 1.09 -0.02 0.66 -1.07 0.00 0.00 179.97 180.86 2k19 h SER 14 N 0.17 -0.04 0.86 7.04 4.64 -1.97 -2.68 113.55 121.56 2k19 h SER 14 Ca -0.08 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 2k19 h SER 14 Cb 1.64 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.74 2k19 h SER 14 CO 0.16 0.23 0.00 0.59 -0.87 0.00 0.00 176.83 176.94 2k19 n ASN 15 N -4.99 0.58 0.34 4.97 3.02 -1.25 -3.64 115.26 114.31 2k19 n ASN 15 Ca -0.08 0.62 -0.14 0.00 -0.03 0.00 0.00 54.58 54.95 2k19 n ASN 15 Cb 0.16 -0.75 -0.07 0.00 -0.61 0.00 0.00 39.78 38.51 2k19 n ASN 15 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 2k19 h GLN 16 N 0.00 -0.85 -0.69 3.52 4.15 -1.08 -2.02 115.11 118.14 2k19 h GLN 16 Ca 0.00 0.06 0.14 0.00 0.77 0.00 0.00 58.65 59.61 2k19 h GLN 16 Cb 0.43 0.19 -0.10 0.00 0.21 0.00 0.00 27.48 28.22 2k19 h GLN 16 CO 0.00 -0.57 0.19 0.00 -1.93 0.00 0.00 178.83 176.52 2k19 h ALA 17 N -1.54 0.88 -0.87 3.38 0.00 -1.62 0.06 119.26 119.55 2k19 h ALA 17 Ca -0.09 0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.10 2k19 h ALA 17 Cb 0.69 0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.56 2k19 h ALA 17 CO 0.13 -0.29 0.48 1.49 0.00 0.00 0.00 179.25 181.06 2k19 h GLU 18 N 0.31 0.68 -0.57 0.00 4.81 -1.64 0.81 114.58 118.98 2k19 h GLU 18 Ca 0.37 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.48 2k19 h GLU 18 Cb 0.59 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 2k19 h GLU 18 CO -0.44 0.45 0.02 -0.91 -0.73 0.00 0.00 179.01 177.40 2k19 h ASN 19 N 0.70 0.93 0.28 1.04 2.35 -0.24 -2.42 115.58 118.22 2k19 h ASN 19 Ca 0.47 -0.24 -0.01 0.00 -0.55 0.00 0.00 56.30 55.96 2k19 h ASN 19 Cb 0.61 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.74 2k19 h ASN 19 CO -0.33 0.97 -0.13 0.40 -1.65 0.00 0.00 177.43 176.69 2k19 h ILE 20 N 0.89 0.74 -0.93 2.81 2.04 -0.41 -3.15 117.51 119.50 2k19 h ILE 20 Ca 0.17 -0.63 0.18 0.00 1.00 0.00 0.00 64.86 65.58 2k19 h ILE 20 Cb 0.49 1.07 -0.10 0.00 -0.74 0.00 0.00 36.82 37.54 2k19 h ILE 20 CO 0.02 0.12 0.51 0.40 0.00 0.00 0.00 178.15 179.21 2k19 h ILE 21 N -0.73 0.68 -0.32 -0.67 2.04 -0.92 0.31 117.51 117.90 2k19 h ILE 21 Ca -0.04 -0.23 0.09 0.00 1.00 0.00 0.00 64.86 65.69 2k19 h ILE 21 Cb 0.49 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 2k19 h ILE 21 CO 0.06 0.12 0.27 0.74 0.00 0.00 0.00 178.15 179.34 2k19 h THR 22 N 0.66 0.66 0.49 -0.27 2.02 -1.39 -2.76 112.91 112.32 2k19 h THR 22 Ca 0.53 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.69 2k19 h THR 22 Cb 0.84 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 2k19 h THR 22 CO -0.40 0.00 -0.24 -0.78 0.37 0.00 0.00 175.52 174.48 2k19 h ASP 23 N 0.00 -0.56 -0.77 4.18 1.82 -0.37 -1.86 116.42 118.86 2k19 h ASP 23 Ca 0.15 0.02 0.17 0.00 -0.39 0.00 0.00 57.03 56.98 2k19 h ASP 23 Cb 0.68 0.14 -0.11 0.00 0.68 0.00 0.00 39.33 40.73 2k19 h ASP 23 CO -0.00 -0.40 0.21 -0.07 -1.61 0.00 0.00 179.24 177.37 2k19 h LEU 24 N -0.67 0.06 -1.27 2.28 3.38 -1.56 0.25 115.31 117.79 2k19 h LEU 24 Ca -0.07 0.15 0.11 0.00 0.09 0.00 0.00 57.88 58.16 2k19 h LEU 24 Cb 0.51 0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.38 2k19 h LEU 24 CO 0.11 -0.03 0.56 -0.07 0.09 0.00 0.00 178.44 179.09 2k19 h LEU 25 N 0.29 0.71 0.78 1.67 -0.00 -1.42 0.13 115.31 117.46 2k19 h LEU 25 Ca 0.44 0.03 -0.04 0.00 -0.00 0.00 0.00 57.88 58.31 2k19 h LEU 25 Cb 0.77 -0.12 0.01 0.00 -0.00 0.00 0.00 40.66 41.32 2k19 h LEU 25 CO -0.52 0.41 -0.37 -0.78 -0.00 0.00 0.00 178.44 177.18 2k19 h ASP 26 N 0.78 -0.88 -0.15 -0.43 3.58 0.37 -1.74 116.42 117.95 2k19 h ASP 26 Ca 0.41 0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.86 2k19 h ASP 26 Cb 0.50 0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.77 2k19 h ASP 26 CO -0.17 -0.57 0.08 0.44 -2.88 0.00 0.00 179.24 176.14 2k19 h ASP 27 N -1.14 0.22 0.86 2.28 3.32 -1.14 -0.57 116.42 120.25 2k19 h ASP 27 Ca -0.11 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 2k19 h ASP 27 Cb 0.81 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.31 2k19 h ASP 27 CO 0.17 0.19 -0.08 -0.07 -1.72 0.00 0.00 179.24 177.74 2k19 h LEU 28 N 0.25 0.00 -0.22 1.55 3.38 -0.56 -2.77 115.31 116.93 2k19 h LEU 28 Ca 0.06 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.08 2k19 h LEU 28 Cb 0.04 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 2k19 h LEU 28 CO -0.01 0.08 -0.48 0.50 0.09 0.00 0.00 178.44 178.62 2k19 h LYS 29 N 0.00 -0.46 0.00 1.13 3.64 -0.16 -1.86 116.57 118.86 2k19 h LYS 29 Ca -0.00 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 2k19 h LYS 29 Cb 0.53 0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 2k19 h LYS 29 CO 0.01 -0.31 -0.39 1.79 -2.27 0.00 0.00 179.45 178.28 2k19 h THR 30 N -0.48 0.00 -3.89 1.00 1.35 -1.72 -3.46 112.91 105.72 2k19 h THR 30 Ca 0.07 -0.98 -0.51 0.00 -0.55 0.00 0.00 66.41 64.45 2k19 h THR 30 Cb 0.64 1.78 0.04 0.00 -1.73 0.00 0.00 68.15 68.88 2k19 h THR 30 CO -0.47 0.00 0.52 -0.62 -0.25 0.00 0.00 175.52 174.70 2k19 s ASP 31 N -5.80 6.82 -0.29 5.36 -1.08 -0.70 -4.95 116.67 116.03 2k19 s ASP 31 Ca 0.04 2.39 0.09 0.00 -0.52 0.00 0.00 52.55 54.56 2k19 s ASP 31 Cb 0.07 -2.63 0.52 0.00 -1.46 0.00 0.00 42.92 39.43 2k19 s ASP 31 CO 0.72 -0.47 1.49 0.18 0.52 0.00 0.00 175.17 177.60 2k19 n LEU 32 N 0.58 4.27 0.00 -1.34 4.32 -1.26 -4.76 117.00 118.80 2k19 n LEU 32 Ca 0.02 -3.68 0.00 0.00 -0.02 0.00 0.00 56.01 52.33 2k19 n LEU 32 Cb 0.45 -0.64 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 2k19 n LEU 32 CO 0.53 1.18 0.00 0.47 -1.22 0.00 0.00 177.39 178.35 2k19 n ASP 33 N -1.06 0.00 -4.59 -1.43 9.92 -1.26 -4.81 116.55 113.33 2k19 n ASP 33 Ca 0.34 0.29 -0.41 0.00 -0.53 0.00 0.00 54.79 54.47 2k19 n ASP 33 Cb 1.06 -0.30 -0.07 0.00 -0.64 0.00 0.00 41.12 41.17 2k19 n ASP 33 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 2k19 s ASN 34 N -2.22 6.46 -0.25 -2.24 0.01 -1.26 -4.92 114.94 110.52 2k19 s ASN 34 Ca 0.00 0.32 -0.09 0.00 -0.71 0.00 0.00 52.86 52.39 2k19 s ASN 34 Cb 0.00 -2.32 -0.12 0.00 0.41 0.00 0.00 41.25 39.22 2k19 s ASN 34 CO 0.00 -0.50 -0.29 1.21 -1.51 0.00 0.00 177.10 176.01 2k19 n GLU 35 N 5.89 0.54 -0.06 -0.60 2.13 -1.26 -4.53 120.64 122.75 2k19 n GLU 35 Ca -0.02 0.21 -0.01 0.00 0.66 0.00 0.00 57.16 58.00 2k19 n GLU 35 Cb 0.49 -1.41 -0.16 0.00 0.27 0.00 0.00 31.44 30.63 2k19 n GLU 35 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2k19 n SER 36 N -3.87 0.03 -0.22 4.31 3.41 -1.26 -4.35 113.62 111.66 2k19 n SER 36 Ca -0.47 0.00 0.04 0.00 -0.26 0.00 0.00 58.87 58.18 2k19 n SER 36 Cb 0.87 1.43 0.30 0.00 -0.26 0.00 0.00 64.21 66.55 2k19 n SER 36 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2k19 h LEU 37 N 0.00 0.78 -1.97 1.04 7.12 -1.96 -1.04 115.31 119.28 2k19 h LEU 37 Ca -0.31 -0.00 0.25 0.00 0.13 0.00 0.00 57.88 57.95 2k19 h LEU 37 Cb 1.70 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 41.62 2k19 h LEU 37 CO 0.02 0.52 0.65 0.11 -0.13 0.00 0.00 178.44 179.60 2k19 h LYS 38 N 0.89 0.00 -0.84 1.25 1.57 -1.80 0.17 116.57 117.81 2k19 h LYS 38 Ca 0.33 0.00 0.20 0.00 -1.87 0.00 0.00 60.65 59.31 2k19 h LYS 38 Cb 0.16 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 2k19 h LYS 38 CO -0.11 0.00 0.57 1.57 -0.57 0.00 0.00 179.45 180.91 2k19 h LYS 39 N 0.00 0.29 0.02 3.15 2.10 -1.46 0.31 116.57 120.99 2k19 h LYS 39 Ca 0.40 -0.02 -0.00 0.00 -2.00 0.00 0.00 60.65 59.03 2k19 h LYS 39 Cb 1.70 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.97 2k19 h LYS 39 CO -0.00 0.19 -0.01 0.28 -2.00 0.00 0.00 179.45 177.91 2k19 h VAL 40 N 0.30 0.00 -0.73 0.07 2.07 -0.85 -0.57 116.25 116.54 2k19 h VAL 40 Ca 0.42 -0.02 0.12 0.00 0.82 0.00 0.00 66.70 68.05 2k19 h VAL 40 Cb 1.19 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.88 2k19 h VAL 40 CO -0.12 0.00 0.32 -0.07 0.02 0.00 0.00 177.57 177.72 2k19 h LEU 41 N -0.05 0.35 0.62 2.57 3.38 -1.63 0.51 115.31 121.07 2k19 h LEU 41 Ca -0.00 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2k19 h LEU 41 Cb 0.03 0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2k19 h LEU 41 CO 0.01 0.17 -0.33 -0.33 0.09 0.00 0.00 178.44 178.05 2k19 h GLU 42 N 0.51 -0.84 -0.06 1.13 5.08 -0.48 0.33 114.58 120.24 2k19 h GLU 42 Ca 0.39 0.06 0.03 0.00 -1.00 0.00 0.00 59.36 58.84 2k19 h GLU 42 Cb 0.52 0.19 -0.06 0.00 0.50 0.00 0.00 28.75 29.90 2k19 h GLU 42 CO -0.35 -0.56 -0.46 -0.97 -1.00 0.00 0.00 179.01 175.67 2k19 h ASN 43 N -0.87 -1.43 -0.75 1.42 -0.73 -0.84 -0.55 115.58 111.83 2k19 h ASN 43 Ca -0.08 0.17 0.11 0.00 1.87 0.00 0.00 56.30 58.37 2k19 h ASN 43 Cb 0.68 0.56 -0.08 0.00 0.27 0.00 0.00 38.32 39.75 2k19 h ASN 43 CO 0.12 -0.47 0.36 1.88 -0.37 0.00 0.00 177.43 178.96 2k19 h TYR 44 N -0.57 0.65 -0.90 0.67 0.05 -0.92 -0.72 116.97 115.21 2k19 h TYR 44 Ca 0.05 0.03 0.07 0.00 0.05 0.00 0.00 58.73 58.93 2k19 h TYR 44 Cb 0.67 -0.18 -0.07 0.00 1.01 0.00 0.00 36.73 38.17 2k19 h TYR 44 CO -0.49 0.20 0.56 1.25 -1.05 0.00 0.00 178.16 178.63 2k19 h LEU 45 N 0.59 0.87 -1.08 3.88 5.85 0.68 -0.93 115.31 125.16 2k19 h LEU 45 Ca 0.38 0.02 -0.09 0.00 0.84 0.00 0.00 57.88 59.04 2k19 h LEU 45 Cb 0.46 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2k19 h LEU 45 CO -0.31 0.54 -0.32 -0.33 -0.34 0.00 0.00 178.44 177.68 2k19 h GLU 46 N 0.99 0.24 -0.14 1.25 5.08 0.31 -2.68 114.58 119.64 2k19 h GLU 46 Ca 0.40 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2k19 h GLU 46 Cb 0.23 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2k19 h GLU 46 CO -0.19 0.54 0.09 0.93 -1.00 0.00 0.00 179.01 179.38 2k19 h GLU 47 N 0.21 0.17 -1.00 2.33 5.08 -0.31 -1.81 114.58 119.25 2k19 h GLU 47 Ca 0.03 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.42 2k19 h GLU 47 Cb 0.68 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.83 2k19 h GLU 47 CO 0.05 0.11 0.65 -0.07 -1.00 0.00 0.00 179.01 178.76 2k19 h LEU 48 N 0.17 1.09 -0.48 1.33 3.38 -1.31 -1.67 115.31 117.81 2k19 h LEU 48 Ca 0.05 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.86 2k19 h LEU 48 Cb 0.00 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2k19 h LEU 48 CO -0.01 0.74 -0.74 0.11 0.09 0.00 0.00 178.44 178.62 2k19 h LYS 49 N 1.25 0.00 -7.15 1.13 6.56 -1.47 -3.45 116.57 113.44 2k19 h LYS 49 Ca 0.40 0.00 -0.50 0.00 -1.06 0.00 0.00 60.65 59.50 2k19 h LYS 49 Cb 0.03 0.00 0.08 0.00 -0.57 0.00 0.00 32.23 31.76 2k19 h LYS 49 CO -0.13 0.74 0.39 -0.65 -2.06 0.00 0.00 179.45 177.74 2k19 s GLN 50 N -3.27 3.20 0.00 3.15 -1.52 -0.63 -4.94 119.66 115.65 2k19 s GLN 50 Ca -0.00 1.41 0.15 0.00 -1.95 0.00 0.00 55.36 54.97 2k19 s GLN 50 Cb 0.12 -2.00 0.46 0.00 -0.22 0.00 0.00 33.01 31.36 2k19 s GLN 50 CO 0.78 -0.94 1.37 0.36 -0.25 0.00 0.00 175.29 176.61 2k19 n LYS 51 N -1.82 1.95 0.00 2.91 2.85 -1.26 -4.44 118.16 118.35 2k19 n LYS 51 Ca 0.10 -1.47 0.00 0.00 -1.05 0.00 0.00 58.31 55.89 2k19 n LYS 51 Cb 0.52 -1.35 0.00 0.00 -0.65 0.00 0.00 35.03 33.55 2k19 n LYS 51 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2k19 n SER 52 N 0.69 0.00 -4.74 -5.58 7.64 -1.26 -4.89 113.62 105.48 2k19 n SER 52 Ca 0.15 0.20 -0.41 0.00 1.01 0.00 0.00 58.87 59.81 2k19 n SER 52 Cb 0.36 -0.26 -0.04 0.00 -1.01 0.00 0.00 64.21 63.27 2k19 n SER 52 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k19 s ALA 53 N -3.60 3.41 0.57 -0.43 0.00 -1.26 -5.02 121.76 115.42 2k19 s ALA 53 Ca 0.00 0.89 -0.16 0.00 0.00 0.00 0.00 51.96 52.69 2k19 s ALA 53 Cb 0.00 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.67 2k19 s ALA 53 CO 0.00 -0.32 1.04 0.45 0.00 0.00 0.00 175.76 176.93 2k19 s SER 54 N 0.14 6.06 0.12 0.00 0.15 -1.26 -4.73 113.70 114.18 2k19 s SER 54 Ca 0.52 1.75 -0.30 0.00 0.70 0.00 0.00 55.95 58.62 2k19 s SER 54 Cb -0.31 -2.53 -0.09 0.00 -1.71 0.00 0.00 66.02 61.39 2k19 s SER 54 CO 0.35 -0.98 1.58 0.58 1.20 0.00 0.00 173.24 175.98 2k19 h VAL 55 N 0.63 0.14 0.00 4.45 2.07 -1.92 0.14 116.25 121.76 2k19 h VAL 55 Ca -0.47 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2k19 h VAL 55 Cb 1.21 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 2k19 h VAL 55 CO 0.59 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.73 2k19 h PRO 56 N -0.59 0.00 0.04 1.57 0.13 -1.93 -2.54 132.00 128.67 2k19 h PRO 56 Ca 0.04 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.92 2k19 h PRO 56 Cb 0.66 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.77 2k19 h PRO 56 CO -0.31 0.00 -1.23 1.25 -0.23 0.00 0.00 178.00 177.48 2k19 h LEU 57 N 0.00 0.12 0.01 1.56 6.46 -1.54 -2.95 115.31 118.97 2k19 h LEU 57 Ca 0.00 -0.15 -0.00 0.00 -0.12 0.00 0.00 57.88 57.61 2k19 h LEU 57 Cb 0.41 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.30 2k19 h LEU 57 CO 0.00 1.12 -0.00 0.40 -0.62 0.00 0.00 178.44 179.34 2k19 h ILE 58 N 0.02 0.82 -0.19 4.05 2.04 -0.51 -3.14 117.51 120.60 2k19 h ILE 58 Ca -0.11 -1.60 0.06 0.00 1.00 0.00 0.00 64.86 64.21 2k19 h ILE 58 Cb 1.88 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 39.49 2k19 h ILE 58 CO 0.14 0.28 0.14 -0.07 0.00 0.00 0.00 178.15 178.64 2k19 h LEU 59 N -1.00 0.00 0.63 1.44 3.38 -1.63 0.27 115.31 118.40 2k19 h LEU 59 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2k19 h LEU 59 Cb 0.46 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.22 2k19 h LEU 59 CO 0.00 0.00 -0.30 -1.28 0.09 0.00 0.00 178.44 176.95 2k19 h SER 60 N 0.00 -0.72 -0.67 -0.43 0.87 -1.62 -2.30 113.55 108.69 2k19 h SER 60 Ca 0.09 0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.59 2k19 h SER 60 Cb 0.37 0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.49 2k19 h SER 60 CO -0.00 -0.39 0.10 0.03 -0.53 0.00 0.00 176.83 176.04 2k19 h ARG 61 N -1.08 1.11 -0.13 2.24 -0.00 -1.45 -3.04 114.38 112.02 2k19 h ARG 61 Ca -0.09 -0.30 0.05 0.00 -0.50 0.00 0.00 59.98 59.14 2k19 h ARG 61 Cb 0.65 -0.13 -0.06 0.00 0.00 0.00 0.00 29.97 30.43 2k19 h ARG 61 CO 0.14 1.02 -0.30 1.98 0.00 0.00 0.00 179.97 182.81 2k19 h MET 62 N 1.04 -0.36 -0.85 0.04 4.05 -0.52 0.19 114.93 118.52 2k19 h MET 62 Ca 0.20 0.02 0.13 0.00 -0.28 0.00 0.00 59.70 59.77 2k19 h MET 62 Cb 0.45 0.08 -0.09 0.00 -0.80 0.00 0.00 31.60 31.25 2k19 h MET 62 CO 0.01 -0.24 0.46 -0.97 0.23 0.00 0.00 176.91 176.40 2k19 h ASN 63 N -0.37 0.60 1.14 1.39 -0.73 -1.35 0.38 115.58 116.64 2k19 h ASN 63 Ca 0.10 0.07 0.00 0.00 1.87 0.00 0.00 56.30 58.34 2k19 h ASN 63 Cb 0.53 -0.03 0.00 0.00 0.27 0.00 0.00 38.32 39.08 2k19 h ASN 63 CO -0.34 0.29 0.00 -0.07 -0.37 0.00 0.00 177.43 176.94 2k19 h LEU 64 N 0.70 0.00 0.00 0.34 3.38 -1.15 -2.30 115.31 116.28 2k19 h LEU 64 Ca 0.44 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.34 2k19 h LEU 64 Cb 0.54 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2k19 h LEU 64 CO -0.32 0.00 -0.54 -0.78 0.09 0.00 0.00 178.44 176.90 2k19 h ASP 65 N 0.00 0.00 -0.14 -0.43 1.82 0.26 -3.24 116.42 114.69 2k19 h ASP 65 Ca 0.00 -0.40 0.03 0.00 -0.39 0.00 0.00 57.03 56.27 2k19 h ASP 65 Cb 0.57 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.55 2k19 h ASP 65 CO 0.00 1.00 -0.06 0.40 -1.61 0.00 0.00 179.24 178.98 2k19 h ILE 66 N -1.00 0.81 -0.80 2.25 2.04 -0.52 -0.27 117.51 120.02 2k19 h ILE 66 Ca -0.11 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.87 2k19 h ILE 66 Cb 0.79 0.81 -0.06 0.00 -0.74 0.00 0.00 36.82 37.62 2k19 h ILE 66 CO -0.07 0.00 0.53 -1.28 0.00 0.00 0.00 178.15 177.33 2k19 h SER 67 N -0.04 0.56 -0.21 1.72 0.87 -1.61 -1.21 113.55 113.64 2k19 h SER 67 Ca 0.07 0.03 -0.17 0.00 -1.23 0.00 0.00 61.79 60.49 2k19 h SER 67 Cb 0.15 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.02 2k19 h SER 67 CO -0.16 0.30 -0.53 0.11 -0.53 0.00 0.00 176.83 176.02 2k19 h LYS 68 N 0.60 0.73 -0.00 2.24 1.57 -1.35 -2.97 116.57 117.39 2k19 h LYS 68 Ca 0.39 -0.51 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2k19 h LYS 68 Cb 0.66 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.05 2k19 h LYS 68 CO -0.15 1.13 0.11 0.00 -0.57 0.00 0.00 179.45 179.96 2k19 h ALA 69 N 0.60 1.13 -0.17 3.86 0.00 0.16 -1.50 119.26 123.34 2k19 h ALA 69 Ca -0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2k19 h ALA 69 Cb 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2k19 h ALA 69 CO 0.12 -0.11 0.00 -0.89 0.00 0.00 0.00 179.25 178.37 2k19 n ILE 70 N -3.05 0.00 -0.05 0.00 5.41 -1.03 -1.52 119.36 119.12 2k19 n ILE 70 Ca -0.03 1.24 -0.10 0.00 1.00 0.00 0.00 62.75 64.86 2k19 n ILE 70 Cb 0.17 -2.22 -0.04 0.00 -0.71 0.00 0.00 39.64 36.84 2k19 n ILE 70 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 176.55 176.63 2k19 h ARG 71 N 0.00 0.28 0.00 0.38 0.11 -1.66 0.39 114.38 113.88 2k19 h ARG 71 Ca 0.00 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.04 2k19 h ARG 71 Cb 0.00 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.03 2k19 h ARG 71 CO 0.00 0.29 0.00 0.09 0.10 0.00 0.00 179.97 180.45 2k19 n ASN 72 N -4.88 0.00 -0.00 0.08 3.02 -0.57 -3.58 115.26 109.32 2k19 n ASN 72 Ca -0.04 0.61 -0.09 0.00 -0.03 0.00 0.00 54.58 55.03 2k19 n ASN 72 Cb 0.09 -0.11 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 2k19 n ASN 72 CO 0.00 0.00 0.00 -0.78 -2.62 0.00 0.00 177.26 173.86 2k19 h ASP 73 N 0.00 -0.57 0.00 6.41 3.58 -1.38 -3.47 116.42 120.99 2k19 h ASP 73 Ca 0.00 0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.55 2k19 h ASP 73 Cb 0.00 0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.31 2k19 h ASP 73 CO 0.00 -0.23 0.00 0.61 -2.88 0.00 0.00 179.24 176.74 2k19 n GLY 74 N -1.33 1.43 3.74 -0.78 0.00 0.14 -5.05 105.19 103.34 2k19 n GLY 74 Ca -0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.60 2k19 n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k19 s VAL 75 N -2.00 4.94 -0.20 1.61 1.01 -1.07 -4.97 120.40 119.71 2k19 s VAL 75 Ca 0.00 1.34 -0.09 0.00 0.00 0.00 0.00 61.98 63.23 2k19 s VAL 75 Cb 0.00 -3.98 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2k19 s VAL 75 CO 0.00 0.36 0.10 -0.89 0.00 0.00 0.00 175.10 174.67 2k19 s THR 76 N 0.16 5.06 0.28 3.92 2.01 -1.26 -4.42 115.64 121.39 2k19 s THR 76 Ca 0.34 0.07 -0.29 0.00 0.31 0.00 0.00 61.69 62.11 2k19 s THR 76 Cb -0.18 -3.31 -0.10 0.00 0.01 0.00 0.00 72.50 68.93 2k19 s THR 76 CO 0.18 0.43 1.08 -0.76 -0.69 0.00 0.00 174.62 174.86 2k19 s LEU 77 N 0.54 4.56 0.98 4.42 1.43 -1.26 -5.04 118.68 124.31 2k19 s LEU 77 Ca 0.05 2.24 -0.14 0.00 -1.03 0.00 0.00 54.13 55.26 2k19 s LEU 77 Cb -0.12 -3.63 0.18 0.00 0.03 0.00 0.00 46.19 42.64 2k19 s LEU 77 CO 0.00 -0.12 1.16 -0.44 0.23 0.00 0.00 176.35 177.18 2k19 s SER 78 N -0.91 2.93 0.09 2.29 0.01 -1.26 -4.64 113.70 112.21 2k19 s SER 78 Ca 0.44 0.81 -0.32 0.00 1.31 0.00 0.00 55.95 58.19 2k19 s SER 78 Cb -0.31 -1.25 -0.14 0.00 0.21 0.00 0.00 66.02 64.53 2k19 s SER 78 CO 0.40 -2.90 1.51 0.44 0.41 0.00 0.00 173.24 173.11 2k19 h ASP 79 N -1.74 -1.44 -0.89 2.44 3.32 -1.99 -0.37 116.42 115.74 2k19 h ASP 79 Ca -0.49 0.15 0.09 0.00 0.02 0.00 0.00 57.03 56.80 2k19 h ASP 79 Cb 1.31 0.53 -0.06 0.00 0.22 0.00 0.00 39.33 41.32 2k19 h ASP 79 CO 0.53 -0.53 0.58 0.10 -1.72 0.00 0.00 179.24 178.20 2k19 h TYR 80 N -0.73 0.97 0.00 4.55 -0.00 -1.98 -0.34 116.97 119.45 2k19 h TYR 80 Ca -0.01 0.03 0.00 0.00 -0.00 0.00 0.00 58.73 58.74 2k19 h TYR 80 Cb 0.72 -0.31 0.00 0.00 -0.00 0.00 0.00 36.73 37.13 2k19 h TYR 80 CO -0.41 0.46 0.00 1.04 -0.00 0.00 0.00 178.16 179.24 2k19 n GLN 81 N -4.52 0.00 -0.29 0.10 6.02 -0.70 -0.03 117.38 117.96 2k19 n GLN 81 Ca 0.15 0.33 0.27 0.00 -0.01 0.00 0.00 57.00 57.74 2k19 n GLN 81 Cb 0.29 -1.30 0.62 0.00 1.02 0.00 0.00 30.24 30.88 2k19 n GLN 81 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2k19 h SER 82 N 0.00 0.22 -0.10 1.08 0.87 -1.07 0.74 113.55 115.30 2k19 h SER 82 Ca 0.00 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2k19 h SER 82 Cb 0.00 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2k19 h SER 82 CO 0.00 0.05 -0.01 0.11 -0.53 0.00 0.00 176.83 176.45 2k19 h LYS 83 N 0.20 0.18 0.00 2.24 1.57 -0.89 -2.72 116.57 117.14 2k19 h LYS 83 Ca 0.54 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 2k19 h LYS 83 Cb 1.74 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.04 2k19 h LYS 83 CO -0.14 0.46 0.00 1.57 -0.57 0.00 0.00 179.45 180.77 2k19 h LYS 84 N -0.12 0.00 -0.23 3.15 5.09 0.19 -1.99 116.57 122.66 2k19 h LYS 84 Ca 0.03 0.00 -0.11 0.00 0.09 0.00 0.00 60.65 60.66 2k19 h LYS 84 Cb 0.39 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.71 2k19 h LYS 84 CO 0.01 0.00 -0.32 1.25 -2.09 0.00 0.00 179.45 178.30 2k19 h LEU 85 N 0.00 0.48 0.00 7.07 5.85 -1.00 -2.26 115.31 125.45 2k19 h LEU 85 Ca 0.00 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.54 2k19 h LEU 85 Cb 0.18 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.08 2k19 h LEU 85 CO 0.00 0.77 0.00 2.29 -0.34 0.00 0.00 178.44 181.16 2k19 n LYS 86 N -4.08 0.07 0.00 1.25 -0.00 -0.75 -2.85 118.16 111.80 2k19 n LYS 86 Ca -0.01 0.19 0.00 0.00 -0.00 0.00 0.00 58.31 58.49 2k19 n LYS 86 Cb 0.45 -1.50 0.00 0.00 -0.00 0.00 0.00 35.03 33.98 2k19 n LYS 86 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2k19 n GLU 87 N -1.44 0.00 0.00 -1.58 1.02 -0.85 -3.52 120.64 114.26 2k19 n GLU 87 Ca 0.05 0.19 0.05 0.00 -0.02 0.00 0.00 57.16 57.43 2k19 n GLU 87 Cb 0.18 -0.97 0.28 0.00 -0.02 0.00 0.00 31.44 30.91 2k19 n GLU 87 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2k19 n LEU 88 N -1.06 0.00 0.28 -4.62 -0.00 -1.25 -2.60 117.00 107.74 2k19 n LEU 88 Ca 0.00 0.17 0.13 0.00 -0.00 0.00 0.00 56.01 56.32 2k19 n LEU 88 Cb 0.00 -0.17 0.80 0.00 -0.00 0.00 0.00 43.42 44.05 2k19 n LEU 88 CO 0.00 -0.11 1.04 0.00 -0.00 0.00 0.00 177.39 178.31 2k19 h THR 89 N 0.00 0.57 0.02 1.47 1.03 -1.57 -1.45 112.91 112.98 2k19 h THR 89 Ca 0.00 -0.30 -0.09 0.00 -0.01 0.00 0.00 66.41 66.00 2k19 h THR 89 Cb 0.06 1.19 0.01 0.00 -1.07 0.00 0.00 68.15 68.34 2k19 h THR 89 CO 0.00 0.07 -0.37 0.77 -0.01 0.00 0.00 175.52 175.97 2k19 h SER 90 N 0.00 0.30 -0.61 0.00 4.64 -1.65 -2.47 113.55 113.76 2k19 h SER 90 Ca -0.00 -0.81 -0.05 0.00 -0.47 0.00 0.00 61.79 60.46 2k19 h SER 90 Cb 0.19 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 2k19 h SER 90 CO 0.01 1.08 0.18 0.40 -0.87 0.00 0.00 176.83 177.63 2k19 h ILE 91 N -0.44 1.25 0.00 0.95 2.04 -1.69 -2.22 117.51 117.39 2k19 h ILE 91 Ca -0.05 -0.85 0.00 0.00 1.00 0.00 0.00 64.86 64.96 2k19 h ILE 91 Cb 1.15 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 2k19 h ILE 91 CO 0.07 0.32 0.00 -1.28 0.00 0.00 0.00 178.15 177.27 2k19 h SER 92 N 0.87 0.00 -5.62 1.72 0.87 -1.37 -3.48 113.55 106.55 2k19 h SER 92 Ca 0.20 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.45 2k19 h SER 92 Cb 0.31 0.00 0.17 0.00 -0.44 0.00 0.00 62.40 62.44 2k19 h SER 92 CO -0.00 0.00 -0.82 0.59 -0.53 0.00 0.00 176.83 176.06 2k19 n ASN 93 N -2.82 -4.25 -3.00 6.23 3.02 -0.84 -4.80 115.26 108.79 2k19 n ASN 93 Ca 0.02 -0.70 -0.33 0.00 -0.03 0.00 0.00 54.58 53.54 2k19 n ASN 93 Cb 0.31 -5.00 -0.05 0.00 -0.61 0.00 0.00 39.78 34.42 2k19 n ASN 93 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2k19 n ILE 94 N -3.73 4.22 -0.16 2.41 2.08 -1.05 -4.66 119.36 118.47 2k19 n ILE 94 Ca -0.18 -2.96 0.23 0.00 0.56 0.00 0.00 62.75 60.40 2k19 n ILE 94 Cb 0.64 -2.20 0.63 0.00 -0.75 0.00 0.00 39.64 37.96 2k19 n ILE 94 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 2k19 h ARG 95 N 4.23 0.16 -6.59 0.38 3.08 -1.89 -3.41 114.38 110.35 2k19 h ARG 95 Ca 0.63 -0.01 -0.52 0.00 0.07 0.00 0.00 59.98 60.15 2k19 h ARG 95 Cb 0.58 -0.04 0.05 0.00 0.08 0.00 0.00 29.97 30.64 2k19 h ARG 95 CO 1.28 0.11 1.04 0.71 -1.07 0.00 0.00 179.97 182.04 2k19 s TYR 96 N -5.17 2.62 -0.06 3.04 2.02 -1.26 -4.93 117.35 113.61 2k19 s TYR 96 Ca -0.06 0.23 -0.20 0.00 -0.37 0.00 0.00 57.07 56.66 2k19 s TYR 96 Cb 0.22 -4.13 -0.15 0.00 -0.40 0.00 0.00 41.96 37.49 2k19 s TYR 96 CO 0.77 -4.45 0.82 0.78 -1.57 0.00 0.00 175.55 171.90 2k19 h GLY 97 N 7.53 -0.23 1.00 0.71 0.00 -2.03 -3.54 103.07 106.52 2k19 h GLY 97 Ca -0.44 0.09 0.00 0.00 0.00 0.00 0.00 47.33 46.97 2k19 h GLY 97 CO 0.95 -0.08 0.00 -1.72 0.00 0.00 0.00 176.54 175.69