#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqi h SER 2 N 0.00 0.07 -3.88 1.61 0.02 -2.07 -3.35 113.55 105.95 2yqi h SER 2 Ca 0.00 -0.03 -0.75 0.00 -0.84 0.00 0.00 61.79 60.16 2yqi h SER 2 Cb 0.00 -0.02 -0.30 0.00 0.14 0.00 0.00 62.40 62.22 2yqi h SER 2 CO 0.00 0.08 -0.04 -0.44 -1.14 0.00 0.00 176.83 175.29 2yqi s SER 3 N -5.28 6.23 0.00 3.07 0.01 -1.26 -4.98 113.70 111.50 2yqi s SER 3 Ca -0.13 -2.94 0.00 0.00 1.31 0.00 0.00 55.95 54.19 2yqi s SER 3 Cb 0.06 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.23 2yqi s SER 3 CO 0.67 -0.44 0.00 0.61 0.41 0.00 0.00 173.24 174.49 2yqi n GLY 4 N 3.53 0.98 3.60 3.44 0.00 -1.26 -5.12 105.19 110.36 2yqi n GLY 4 Ca 0.14 -2.25 -0.15 0.00 0.00 0.00 0.00 46.02 43.76 2yqi n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yqi s SER 5 N 0.00 -0.70 0.04 1.61 0.01 -1.26 -3.86 113.70 109.54 2yqi s SER 5 Ca 0.00 1.20 -0.04 0.00 1.31 0.00 0.00 55.95 58.42 2yqi s SER 5 Cb 0.00 1.17 -0.02 0.00 0.21 0.00 0.00 66.02 67.39 2yqi s SER 5 CO 0.00 -0.33 0.07 -0.94 0.41 0.00 0.00 173.24 172.45 2yqi s SER 6 N -0.05 0.22 0.00 2.44 1.04 -1.26 -5.03 113.70 111.06 2yqi s SER 6 Ca -0.02 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.81 2yqi s SER 6 Cb -0.04 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.30 2yqi s SER 6 CO 0.03 -0.50 0.00 0.61 0.98 0.00 0.00 173.24 174.35 2yqi n GLY 7 N 0.75 2.10 0.33 7.32 0.00 -1.26 -4.99 105.19 109.44 2yqi n GLY 7 Ca -0.19 -0.22 0.12 0.00 0.00 0.00 0.00 46.02 45.74 2yqi n GLY 7 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2yqi n ASN 8 N 0.00 -0.16 -4.77 1.61 2.85 -1.26 -4.36 115.26 109.17 2yqi n ASN 8 Ca 0.00 1.62 -0.38 0.00 -0.11 0.00 0.00 54.58 55.71 2yqi n ASN 8 Cb 0.00 -0.57 -0.02 0.00 1.24 0.00 0.00 39.78 40.44 2yqi n ASN 8 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2yqi s ALA 9 N -6.00 3.15 1.23 5.20 0.00 -1.26 -5.03 121.76 119.06 2yqi s ALA 9 Ca -0.13 1.01 -0.20 0.00 0.00 0.00 0.00 51.96 52.64 2yqi s ALA 9 Cb 0.27 -3.40 0.30 0.00 0.00 0.00 0.00 23.12 20.30 2yqi s ALA 9 CO 0.74 -0.59 1.11 -1.25 0.00 0.00 0.00 175.76 175.77 2yqi s PRO 10 N -2.32 -1.47 -0.10 0.00 0.04 -1.26 -5.09 135.00 124.80 2yqi s PRO 10 Ca 0.58 -0.15 -0.04 0.00 0.04 0.00 0.00 61.00 61.43 2yqi s PRO 10 Cb -0.32 -1.57 0.05 0.00 0.04 0.00 0.00 34.50 32.70 2yqi s PRO 10 CO 0.40 -3.86 0.22 0.15 0.04 0.00 0.00 177.00 173.95 2yqi s LYS 11 N -5.47 0.13 0.08 4.56 3.01 -1.26 -5.12 119.74 115.67 2yqi s LYS 11 Ca 0.72 0.57 -0.24 0.00 -1.01 0.00 0.00 55.97 56.01 2yqi s LYS 11 Cb -0.08 -0.14 -0.13 0.00 -1.01 0.00 0.00 37.83 36.47 2yqi s LYS 11 CO 0.56 -0.23 0.55 0.54 0.51 0.00 0.00 175.35 177.28 2yqi n ARG 12 N 4.77 0.00 -2.26 1.68 1.74 -1.26 -4.85 116.66 116.48 2yqi n ARG 12 Ca -0.16 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.56 2yqi n ARG 12 Cb 0.51 -0.87 -0.00 0.00 -1.02 0.00 0.00 32.46 31.07 2yqi n ARG 12 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2yqi s PRO 13 N -0.39 3.53 1.17 5.56 0.04 -1.26 -5.04 135.00 138.61 2yqi s PRO 13 Ca 0.54 1.68 -0.18 0.00 0.04 0.00 0.00 61.00 63.08 2yqi s PRO 13 Cb -0.77 -2.17 0.27 0.00 0.04 0.00 0.00 34.50 31.87 2yqi s PRO 13 CO 0.40 -0.72 1.11 -1.25 0.04 0.00 0.00 177.00 176.58 2yqi s PRO 14 N -3.04 -0.94 0.35 0.56 0.04 -1.26 -5.03 135.00 125.68 2yqi s PRO 14 Ca 0.69 0.03 0.08 0.00 0.04 0.00 0.00 61.00 61.84 2yqi s PRO 14 Cb -0.26 -1.62 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 2yqi s PRO 14 CO 0.30 -3.54 0.14 -1.12 0.04 0.00 0.00 177.00 172.81 2yqi s SER 15 N -3.81 4.58 0.35 6.66 0.01 -1.26 -4.78 113.70 115.46 2yqi s SER 15 Ca 0.70 -0.85 0.11 0.00 1.31 0.00 0.00 55.95 57.22 2yqi s SER 15 Cb -0.11 -0.66 0.89 0.00 0.21 0.00 0.00 66.02 66.35 2yqi s SER 15 CO 0.56 -0.34 1.81 1.23 0.41 0.00 0.00 173.24 176.92 2yqi h GLY 16 N 1.55 1.37 1.80 3.44 0.00 -1.87 0.18 103.07 109.53 2yqi h GLY 16 Ca -0.43 -0.28 -0.16 0.00 0.00 0.00 0.00 47.33 46.45 2yqi h GLY 16 CO 0.65 -0.03 -0.70 -2.75 0.00 0.00 0.00 176.54 173.70 2yqi h PHE 17 N 0.61 0.27 0.11 5.60 3.57 -1.95 -3.14 116.94 122.00 2yqi h PHE 17 Ca 0.53 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.91 2yqi h PHE 17 Cb 1.03 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.73 2yqi h PHE 17 CO -0.00 0.83 -0.05 0.35 -2.23 0.00 0.00 178.31 177.21 2yqi h PHE 18 N 0.14 -0.13 -0.41 0.41 3.04 -1.16 -2.21 116.94 116.62 2yqi h PHE 18 Ca -0.02 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 61.99 2yqi h PHE 18 Cb 1.25 0.04 -0.09 0.00 2.56 0.00 0.00 35.95 39.71 2yqi h PHE 18 CO 0.02 0.36 -0.45 -0.07 -2.02 0.00 0.00 178.31 176.15 2yqi h LEU 19 N -0.73 -1.51 -1.33 0.59 3.38 -0.95 0.18 115.31 114.93 2yqi h LEU 19 Ca -0.01 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2yqi h LEU 19 Cb 0.55 0.65 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 2yqi h LEU 19 CO 0.02 -0.38 0.41 0.15 0.09 0.00 0.00 178.44 178.74 2yqi h PHE 20 N -0.34 0.83 0.25 1.13 3.04 -1.65 -1.24 116.94 118.96 2yqi h PHE 20 Ca 0.13 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.08 2yqi h PHE 20 Cb 0.59 -0.28 0.00 0.00 2.56 0.00 0.00 35.95 38.82 2yqi h PHE 20 CO -0.65 0.54 -0.12 0.00 -2.02 0.00 0.00 178.31 176.06 2yqi h SER 22 N -0.35 0.00 0.60 0.00 0.87 -0.50 0.60 113.55 114.77 2yqi h SER 22 Ca -0.03 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.25 2yqi h SER 22 Cb 0.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 2yqi h SER 22 CO 0.06 0.15 -1.29 -0.08 -0.53 0.00 0.00 176.83 175.13 2yqi h GLU 23 N 0.00 0.28 0.00 2.24 4.57 -0.68 -3.30 114.58 117.69 2yqi h GLU 23 Ca -0.00 -0.47 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 2yqi h GLU 23 Cb 0.43 0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.19 2yqi h GLU 23 CO 0.02 1.21 -0.82 1.19 -1.18 0.00 0.00 179.01 179.43 2yqi n PHE 24 N -3.52 0.32 -0.21 0.92 3.01 0.12 -4.18 117.46 113.92 2yqi n PHE 24 Ca -0.10 0.09 0.00 0.00 1.01 0.00 0.00 57.45 58.45 2yqi n PHE 24 Cb 1.03 -0.47 0.11 0.00 -0.01 0.00 0.00 39.48 40.14 2yqi n PHE 24 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2yqi h ARG 25 N 0.00 0.46 -0.74 -1.08 2.43 0.13 -2.20 114.38 113.38 2yqi h ARG 25 Ca 0.00 -0.03 0.17 0.00 -0.81 0.00 0.00 59.98 59.31 2yqi h ARG 25 Cb 0.70 -0.10 -0.12 0.00 -0.42 0.00 0.00 29.97 30.03 2yqi h ARG 25 CO 0.00 0.30 0.10 -1.35 -1.51 0.00 0.00 179.97 177.51 2yqi h PRO 26 N 0.47 0.18 0.49 0.20 0.11 -1.74 -0.27 132.00 131.44 2yqi h PRO 26 Ca 0.31 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.39 2yqi h PRO 26 Cb 0.36 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.43 2yqi h PRO 26 CO -0.28 0.12 -0.23 0.87 -0.21 0.00 0.00 178.00 178.26 2yqi h LYS 27 N 0.18 -0.63 -0.86 1.05 1.57 -1.67 -1.12 116.57 115.09 2yqi h LYS 27 Ca 0.41 0.04 0.21 0.00 -1.87 0.00 0.00 60.65 59.44 2yqi h LYS 27 Cb 0.73 0.14 -0.12 0.00 0.08 0.00 0.00 32.23 33.06 2yqi h LYS 27 CO -0.58 -0.33 0.33 0.82 -0.57 0.00 0.00 179.45 179.12 2yqi h ILE 28 N -0.89 0.48 0.00 1.86 2.04 -1.10 1.14 117.51 121.04 2yqi h ILE 28 Ca -0.07 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.67 2yqi h ILE 28 Cb 0.59 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.75 2yqi h ILE 28 CO 0.11 0.07 0.00 0.11 0.00 0.00 0.00 178.15 178.44 2yqi h LYS 29 N 0.36 0.00 0.00 2.37 1.57 -0.99 0.16 116.57 120.04 2yqi h LYS 29 Ca 0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.30 2yqi h LYS 29 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.28 2yqi h LYS 29 CO -0.53 0.00 -0.96 0.43 -0.57 0.00 0.00 179.45 177.81 2yqi n SER 30 N -2.79 0.77 -0.09 0.86 7.64 0.33 -4.40 113.62 115.94 2yqi n SER 30 Ca 0.03 -0.65 -0.12 0.00 1.01 0.00 0.00 58.87 59.13 2yqi n SER 30 Cb 0.37 0.87 -0.09 0.00 -1.01 0.00 0.00 64.21 64.35 2yqi n SER 30 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2yqi n THR 31 N -1.62 1.05 -3.33 0.44 -2.24 0.25 -4.97 114.28 103.86 2yqi n THR 31 Ca 0.03 -0.41 -0.38 0.00 -2.27 0.00 0.00 64.05 61.02 2yqi n THR 31 Cb 0.36 -1.12 -0.06 0.00 -2.10 0.00 0.00 70.33 67.41 2yqi n THR 31 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2yqi s ASN 32 N -5.73 6.78 -0.09 3.42 0.01 0.54 -5.03 114.94 114.84 2yqi s ASN 32 Ca -0.24 0.93 -0.30 0.00 -0.71 0.00 0.00 52.86 52.55 2yqi s ASN 32 Cb 0.06 -2.30 -0.04 0.00 0.41 0.00 0.00 41.25 39.38 2yqi s ASN 32 CO 0.43 0.10 1.52 -2.16 -1.51 0.00 0.00 177.10 175.48 2yqi s PRO 33 N 0.06 4.20 -1.11 -0.60 0.04 -1.26 -3.73 135.00 132.59 2yqi s PRO 33 Ca 0.27 2.01 -0.02 0.00 0.04 0.00 0.00 61.00 63.29 2yqi s PRO 33 Cb -0.16 -3.90 0.00 0.00 0.04 0.00 0.00 34.50 30.49 2yqi s PRO 33 CO 0.13 -0.79 0.04 0.41 0.04 0.00 0.00 177.00 176.83 2yqi n GLY 34 N 3.94 -0.13 3.74 0.56 0.00 -1.26 -4.81 105.19 107.23 2yqi n GLY 34 Ca 0.16 0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 2yqi n GLY 34 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2yqi s ILE 35 N -4.01 2.15 -0.03 -0.61 2.07 -1.24 -5.00 121.20 114.53 2yqi s ILE 35 Ca 0.03 0.10 -0.14 0.00 -1.41 0.00 0.00 60.65 59.24 2yqi s ILE 35 Cb -0.02 -3.05 -0.05 0.00 0.13 0.00 0.00 42.46 39.47 2yqi s ILE 35 CO 0.73 -0.01 0.37 -0.44 -1.91 0.00 0.00 174.94 173.68 2yqi s SER 36 N -1.28 6.73 0.21 4.50 0.01 -1.26 -4.96 113.70 117.65 2yqi s SER 36 Ca 0.78 0.87 -0.02 0.00 1.31 0.00 0.00 55.95 58.88 2yqi s SER 36 Cb -0.37 -2.23 0.44 0.00 0.21 0.00 0.00 66.02 64.07 2yqi s SER 36 CO 0.41 0.30 1.14 -0.38 0.41 0.00 0.00 173.24 175.12 2yqi n ILE 37 N 2.05 -0.31 0.03 1.44 2.08 -1.26 0.91 119.36 124.30 2yqi n ILE 37 Ca -0.14 1.63 -0.10 0.00 0.56 0.00 0.00 62.75 64.70 2yqi n ILE 37 Cb 0.53 -2.32 -0.04 0.00 -0.75 0.00 0.00 39.64 37.06 2yqi n ILE 37 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2yqi h GLY 38 N 0.00 -0.12 0.04 7.39 0.00 -2.00 -2.35 103.07 106.02 2yqi h GLY 38 Ca 0.39 0.17 0.05 0.00 0.00 0.00 0.00 47.33 47.94 2yqi h GLY 38 CO -0.72 -0.14 -0.37 -0.55 0.00 0.00 0.00 176.54 174.76 2yqi h ASP 39 N -0.20 -1.18 -1.01 0.19 5.19 0.14 -0.47 116.42 119.09 2yqi h ASP 39 Ca 0.07 0.17 0.23 0.00 -0.62 0.00 0.00 57.03 56.87 2yqi h ASP 39 Cb 0.30 0.49 -0.12 0.00 0.18 0.00 0.00 39.33 40.18 2yqi h ASP 39 CO -0.18 -0.39 0.60 0.58 -3.12 0.00 0.00 179.24 176.73 2yqi h VAL 40 N -0.43 0.59 -0.05 -1.35 2.07 -1.24 -0.38 116.25 115.46 2yqi h VAL 40 Ca 0.10 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.40 2yqi h VAL 40 Cb 0.59 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 2yqi h VAL 40 CO -0.40 0.12 0.00 0.00 0.02 0.00 0.00 177.57 177.31 2yqi h ALA 41 N 1.70 0.04 -0.22 1.67 0.00 -0.56 0.10 119.26 122.00 2yqi h ALA 41 Ca 0.62 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.58 2yqi h ALA 41 Cb 1.13 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 2yqi h ALA 41 CO -0.44 -0.48 -0.04 -0.22 0.00 0.00 0.00 179.25 178.08 2yqi h LYS 42 N 0.02 0.02 0.42 0.00 3.64 -0.52 -2.06 116.57 118.11 2yqi h LYS 42 Ca 0.02 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 2yqi h LYS 42 Cb 0.02 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2yqi h LYS 42 CO -0.03 0.01 -0.20 0.87 -2.27 0.00 0.00 179.45 177.83 2yqi h LYS 43 N 0.02 -0.55 -0.80 1.90 1.57 -1.21 -3.00 116.57 114.51 2yqi h LYS 43 Ca 0.10 0.04 0.15 0.00 -1.87 0.00 0.00 60.65 59.07 2yqi h LYS 43 Cb 0.15 0.12 -0.15 0.00 0.08 0.00 0.00 32.23 32.44 2yqi h LYS 43 CO -0.21 -0.34 -0.27 -0.07 -0.57 0.00 0.00 179.45 177.99 2yqi h LEU 44 N -0.62 -0.98 -0.63 2.94 3.38 -0.60 0.21 115.31 119.01 2yqi h LEU 44 Ca -0.06 0.25 0.12 0.00 0.09 0.00 0.00 57.88 58.29 2yqi h LEU 44 Cb 0.47 0.57 -0.09 0.00 0.09 0.00 0.00 40.66 41.70 2yqi h LEU 44 CO 0.10 -0.28 0.15 1.23 0.09 0.00 0.00 178.44 179.72 2yqi h GLY 45 N -0.04 0.83 0.80 0.83 0.00 -1.25 -0.87 103.07 103.37 2yqi h GLY 45 Ca 0.35 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 2yqi h GLY 45 CO -0.83 -0.12 -0.22 0.83 0.00 0.00 0.00 176.54 176.20 2yqi h GLU 46 N 0.28 -0.59 -0.92 4.80 4.39 -0.54 -1.86 114.58 120.13 2yqi h GLU 46 Ca 0.34 0.04 0.24 0.00 0.34 0.00 0.00 59.36 60.31 2yqi h GLU 46 Cb 0.51 0.13 -0.13 0.00 -0.10 0.00 0.00 28.75 29.16 2yqi h GLU 46 CO -0.42 -0.30 0.42 0.52 -1.16 0.00 0.00 179.01 178.07 2yqi h MET 47 N -0.82 0.37 0.76 2.33 2.86 -0.71 -0.21 114.93 119.51 2yqi h MET 47 Ca -0.06 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.52 2yqi h MET 47 Cb 0.56 -0.08 0.01 0.00 0.06 0.00 0.00 31.60 32.15 2yqi h MET 47 CO 0.10 0.25 -0.36 2.35 1.06 0.00 0.00 176.91 180.30 2yqi h TRP 48 N 0.38 -0.95 -0.45 -0.22 2.91 -1.04 -2.49 115.95 114.09 2yqi h TRP 48 Ca 0.59 -0.02 0.13 0.00 1.13 0.00 0.00 58.89 60.72 2yqi h TRP 48 Cb 1.17 0.31 -0.02 0.00 -0.51 0.00 0.00 29.16 30.11 2yqi h TRP 48 CO -0.12 -0.58 0.58 -0.97 -1.03 0.00 0.00 178.44 176.31 2yqi h ASN 49 N -1.26 0.00 0.01 2.65 -0.73 -0.50 0.35 115.58 116.10 2yqi h ASN 49 Ca -0.10 0.00 -0.25 0.00 1.87 0.00 0.00 56.30 57.81 2yqi h ASN 49 Cb 0.79 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.39 2yqi h ASN 49 CO 0.17 0.00 -0.97 0.78 -0.37 0.00 0.00 177.43 177.04 2yqi h ASN 50 N 0.00 0.87 -2.95 1.15 2.35 -0.80 -3.46 115.58 112.75 2yqi h ASN 50 Ca 0.21 -0.67 -0.56 0.00 -0.55 0.00 0.00 56.30 54.73 2yqi h ASN 50 Cb 1.37 -0.27 0.19 0.00 0.05 0.00 0.00 38.32 39.66 2yqi h ASN 50 CO -0.00 1.47 -0.65 0.18 -1.65 0.00 0.00 177.43 176.77 2yqi n LEU 51 N -3.86 -0.51 -4.98 1.61 4.77 0.12 -4.99 117.00 109.17 2yqi n LEU 51 Ca -0.10 0.54 -0.20 0.00 -0.03 0.00 0.00 56.01 56.22 2yqi n LEU 51 Cb 0.85 -1.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 2yqi n LEU 51 CO 0.55 -3.66 0.16 0.21 -1.33 0.00 0.00 177.39 173.31 2yqi s ASN 52 N -1.40 5.88 0.35 -1.43 2.47 -1.26 -4.94 114.94 114.61 2yqi s ASN 52 Ca 0.61 -0.01 0.22 0.00 0.42 0.00 0.00 52.86 54.10 2yqi s ASN 52 Cb -0.34 -1.32 1.19 0.00 -1.45 0.00 0.00 41.25 39.33 2yqi s ASN 52 CO 0.62 -0.57 1.65 0.44 -3.72 0.00 0.00 177.10 175.53 2yqi h ASP 53 N 0.67 0.00 0.39 -4.21 5.19 -1.99 0.23 116.42 116.70 2yqi h ASP 53 Ca -0.46 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.95 2yqi h ASP 53 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 2yqi h ASP 53 CO 0.54 0.00 -1.56 -0.24 -3.12 0.00 0.00 179.24 174.86 2yqi n SER 54 N -2.29 0.36 0.08 6.45 2.88 -1.26 -3.58 113.62 116.27 2yqi n SER 54 Ca -0.01 0.09 -0.17 0.00 -1.33 0.00 0.00 58.87 57.45 2yqi n SER 54 Cb 0.09 1.35 -0.14 0.00 -0.75 0.00 0.00 64.21 64.75 2yqi n SER 54 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2yqi h GLU 55 N 0.00 0.26 0.00 -1.46 4.39 -0.94 -3.31 114.58 113.53 2yqi h GLU 55 Ca 0.00 -0.45 -0.05 0.00 0.34 0.00 0.00 59.36 59.20 2yqi h GLU 55 Cb 0.98 0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 2yqi h GLU 55 CO 0.00 1.15 -0.21 0.87 -1.16 0.00 0.00 179.01 179.66 2yqi h LYS 56 N 0.07 0.00 -0.78 2.33 1.57 -1.58 -3.35 116.57 114.83 2yqi h LYS 56 Ca -0.21 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.66 2yqi h LYS 56 Cb 2.01 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 34.20 2yqi h LYS 56 CO 0.18 0.21 -0.52 1.96 -0.57 0.00 0.00 179.45 180.71 2yqi h GLN 57 N 0.00 -0.13 0.00 3.15 1.08 -1.64 1.11 115.11 118.68 2yqi h GLN 57 Ca -0.00 0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2yqi h GLN 57 Cb 1.14 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.60 2yqi h GLN 57 CO 0.03 -0.09 0.00 -0.35 -0.95 0.00 0.00 178.83 177.47 2yqi n PRO 58 N -5.34 0.07 0.00 1.46 -0.04 -1.26 -1.89 135.00 128.01 2yqi n PRO 58 Ca 0.02 0.32 0.04 0.00 -0.04 0.00 0.00 63.50 63.83 2yqi n PRO 58 Cb 0.32 -1.63 -0.11 0.00 -0.04 0.00 0.00 33.50 32.03 2yqi n PRO 58 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2yqi n TYR 59 N -1.76 0.46 -0.05 0.54 4.01 0.30 -3.94 117.16 116.73 2yqi n TYR 59 Ca 0.03 0.15 -0.20 0.00 -0.16 0.00 0.00 57.90 57.71 2yqi n TYR 59 Cb 0.19 -0.86 -0.13 0.00 -0.31 0.00 0.00 39.34 38.23 2yqi n TYR 59 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 2yqi h ILE 60 N 0.00 1.09 -0.76 -0.72 2.04 0.12 -3.35 117.51 115.92 2yqi h ILE 60 Ca -0.16 -2.29 0.10 0.00 1.00 0.00 0.00 64.86 63.50 2yqi h ILE 60 Cb 1.43 2.61 -0.05 0.00 -0.74 0.00 0.00 36.82 40.07 2yqi h ILE 60 CO 0.02 0.53 0.50 0.74 0.00 0.00 0.00 178.15 179.94 2yqi h THR 61 N -0.70 0.93 -0.13 -0.27 2.02 -1.59 -2.09 112.91 111.09 2yqi h THR 61 Ca -0.28 -0.23 0.03 0.00 0.77 0.00 0.00 66.41 66.70 2yqi h THR 61 Cb 1.45 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 68.04 2yqi h THR 61 CO -0.06 0.12 -0.06 0.50 0.37 0.00 0.00 175.52 176.39 2yqi h LYS 62 N 0.67 -0.04 -0.61 6.66 1.63 -1.71 -1.67 116.57 121.50 2yqi h LYS 62 Ca 0.35 0.00 0.07 0.00 -0.85 0.00 0.00 60.65 60.22 2yqi h LYS 62 Cb 0.47 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.08 2yqi h LYS 62 CO -0.13 -0.03 0.40 0.00 -3.45 0.00 0.00 179.45 176.25 2yqi h ALA 63 N 1.08 1.84 -0.75 5.00 0.00 -1.51 -1.35 119.26 123.57 2yqi h ALA 63 Ca 0.07 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2yqi h ALA 63 Cb 0.15 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2yqi h ALA 63 CO -0.16 0.06 0.35 0.00 0.00 0.00 0.00 179.25 179.49 2yqi h ALA 64 N 1.68 1.20 0.00 0.00 0.00 -1.10 -1.44 119.26 119.59 2yqi h ALA 64 Ca 0.26 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2yqi h ALA 64 Cb 0.32 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2yqi h ALA 64 CO -0.08 0.60 -0.03 0.87 0.00 0.00 0.00 179.25 180.61 2yqi h LYS 65 N 1.07 0.00 0.10 0.00 1.57 -0.85 -2.89 116.57 115.58 2yqi h LYS 65 Ca 0.26 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.75 2yqi h LYS 65 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2yqi h LYS 65 CO -0.03 0.03 -1.44 -0.07 -0.57 0.00 0.00 179.45 177.37 2yqi h LEU 66 N 0.00 0.35 -0.59 2.94 3.38 -1.04 -3.33 115.31 117.02 2yqi h LEU 66 Ca -0.00 -0.45 -0.04 0.00 0.09 0.00 0.00 57.88 57.48 2yqi h LEU 66 Cb 0.54 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2yqi h LEU 66 CO 0.00 1.37 0.23 0.50 0.09 0.00 0.00 178.44 180.64 2yqi h LYS 67 N 0.06 0.88 -0.58 1.13 3.64 -1.13 -1.16 116.57 119.41 2yqi h LYS 67 Ca -0.21 -0.16 0.10 0.00 -1.27 0.00 0.00 60.65 59.12 2yqi h LYS 67 Cb 1.99 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 33.63 2yqi h LYS 67 CO 0.16 0.76 0.39 1.05 -2.27 0.00 0.00 179.45 179.54 2yqi h GLU 68 N 0.81 0.34 0.04 1.90 4.11 -1.65 0.28 114.58 120.41 2yqi h GLU 68 Ca 0.19 -0.02 -0.07 0.00 0.07 0.00 0.00 59.36 59.54 2yqi h GLU 68 Cb 0.21 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.39 2yqi h GLU 68 CO -0.01 0.22 -0.28 -0.22 0.07 0.00 0.00 179.01 178.78 2yqi h LYS 69 N 0.35 0.12 -0.12 1.06 3.64 -1.55 -3.13 116.57 116.93 2yqi h LYS 69 Ca 0.27 -0.18 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 2yqi h LYS 69 Cb 0.60 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.45 2yqi h LYS 69 CO -0.07 1.06 -0.08 -0.92 -2.27 0.00 0.00 179.45 177.17 2yqi h TYR 70 N -0.73 -0.20 -0.03 1.91 3.20 -0.71 -0.31 116.97 120.10 2yqi h TYR 70 Ca -0.05 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.85 2yqi h TYR 70 Cb 1.19 0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.57 2yqi h TYR 70 CO 0.24 -0.13 0.04 0.93 -1.64 0.00 0.00 178.16 177.60 2yqi h GLU 71 N -0.09 0.00 0.02 1.82 4.39 -1.10 0.38 114.58 120.00 2yqi h GLU 71 Ca 0.08 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.68 2yqi h GLU 71 Cb 0.20 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2yqi h GLU 71 CO -0.18 0.00 -0.36 0.87 -1.16 0.00 0.00 179.01 178.18 2yqi h LYS 72 N 0.00 0.22 -0.00 2.33 1.79 -1.05 -2.92 116.57 116.93 2yqi h LYS 72 Ca 0.02 -0.26 -0.15 0.00 -2.18 0.00 0.00 60.65 58.08 2yqi h LYS 72 Cb 0.10 0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 2yqi h LYS 72 CO -0.00 1.00 -0.70 -0.44 -1.08 0.00 0.00 179.45 178.23 2yqi h ASP 73 N -0.45 0.00 -0.45 0.86 3.32 -0.54 -2.65 116.42 116.51 2yqi h ASP 73 Ca -0.05 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.94 2yqi h ASP 73 Cb 1.14 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 2yqi h ASP 73 CO 0.07 0.70 0.06 0.58 -1.72 0.00 0.00 179.24 178.94 2yqi h VAL 74 N 0.00 1.25 -0.19 -1.35 2.07 -0.36 -0.37 116.25 117.31 2yqi h VAL 74 Ca -0.01 -0.92 -0.08 0.00 0.82 0.00 0.00 66.70 66.51 2yqi h VAL 74 Cb 1.24 0.97 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2yqi h VAL 74 CO 0.09 0.32 -0.21 0.00 0.02 0.00 0.00 177.57 177.79 2yqi h ALA 75 N 0.94 0.28 -0.12 1.67 0.00 -1.52 -1.99 119.26 118.52 2yqi h ALA 75 Ca 0.14 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 2yqi h ALA 75 Cb 0.40 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2yqi h ALA 75 CO 0.01 0.22 -0.11 0.22 0.00 0.00 0.00 179.25 179.60 2yqi h ASP 76 N 0.13 0.17 0.32 0.00 3.58 -1.44 -0.87 116.42 118.32 2yqi h ASP 76 Ca 0.03 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 2yqi h ASP 76 Cb 0.77 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.78 2yqi h ASP 76 CO 0.05 0.31 -0.15 0.22 -2.88 0.00 0.00 179.24 176.79 2yqi h TYR 77 N 0.18 -0.40 -0.69 0.28 5.03 -0.98 -3.32 116.97 117.08 2yqi h TYR 77 Ca 0.04 -0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.45 2yqi h TYR 77 Cb 0.31 0.13 -0.08 0.00 1.55 0.00 0.00 36.73 38.64 2yqi h TYR 77 CO 0.00 -0.25 0.27 -0.22 -1.32 0.00 0.00 178.16 176.64 2yqi h LYS 78 N -0.95 0.43 -3.99 1.82 3.64 -1.36 -3.31 116.57 112.85 2yqi h LYS 78 Ca -0.04 -0.03 -0.75 0.00 -1.27 0.00 0.00 60.65 58.56 2yqi h LYS 78 Cb 0.33 -0.10 -0.28 0.00 -0.41 0.00 0.00 32.23 31.77 2yqi h LYS 78 CO 0.07 0.28 -0.19 -1.12 -2.27 0.00 0.00 179.45 176.23 2yqi s SER 79 N -5.38 6.10 -0.26 4.20 0.01 -0.34 -5.03 113.70 113.00 2yqi s SER 79 Ca -0.13 -2.28 -0.28 0.00 1.31 0.00 0.00 55.95 54.58 2yqi s SER 79 Cb 0.19 -2.10 -0.05 0.00 0.21 0.00 0.00 66.02 64.26 2yqi s SER 79 CO 0.75 -0.65 2.26 0.29 0.41 0.00 0.00 173.24 176.31 2yqi n LYS 80 N 4.47 1.82 0.00 12.44 4.01 -1.25 -4.53 118.16 135.13 2yqi n LYS 80 Ca 0.00 0.45 0.00 0.00 -0.51 0.00 0.00 58.31 58.25 2yqi n LYS 80 Cb 0.42 -3.28 0.00 0.00 -0.51 0.00 0.00 35.03 31.66 2yqi n LYS 80 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70