#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqi n SER 2 N 0.00 1.56 -4.63 1.61 7.64 -1.26 -4.96 113.62 113.58 2yqi n SER 2 Ca 0.00 1.17 -0.34 0.00 1.01 0.00 0.00 58.87 60.71 2yqi n SER 2 Cb 0.00 -1.31 -0.10 0.00 -1.01 0.00 0.00 64.21 61.79 2yqi n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yqi s SER 3 N -0.38 5.47 0.00 6.43 0.01 -1.26 -5.07 113.70 118.89 2yqi s SER 3 Ca 0.61 0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.94 2yqi s SER 3 Cb -0.71 -1.88 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2yqi s SER 3 CO 0.58 0.21 0.00 0.61 0.41 0.00 0.00 173.24 175.05 2yqi n GLY 4 N 3.29 2.97 3.38 3.44 0.00 -1.26 -5.12 105.19 111.90 2yqi n GLY 4 Ca -0.17 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.05 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 1.00 4.52 0.02 1.61 0.01 -1.26 -5.10 113.70 114.51 2yqi s SER 5 Ca 0.00 -0.30 -0.03 0.00 1.31 0.00 0.00 55.95 56.94 2yqi s SER 5 Cb 0.00 -1.77 -0.01 0.00 0.21 0.00 0.00 66.02 64.45 2yqi s SER 5 CO 0.00 0.04 0.03 -0.55 0.41 0.00 0.00 173.24 173.17 2yqi s SER 6 N 1.15 0.20 0.33 2.44 0.15 -1.26 -5.17 113.70 111.54 2yqi s SER 6 Ca 0.02 -0.47 -0.18 0.00 0.70 0.00 0.00 55.95 56.02 2yqi s SER 6 Cb -0.15 0.16 0.03 0.00 -1.71 0.00 0.00 66.02 64.36 2yqi s SER 6 CO 0.00 -0.38 0.74 -0.83 1.20 0.00 0.00 173.24 173.97 2yqi s GLY 7 N -1.68 0.16 -0.30 9.45 0.00 -1.26 -5.14 107.32 108.56 2yqi s GLY 7 Ca -0.12 -0.54 0.00 0.00 0.00 0.00 0.00 44.72 44.06 2yqi s GLY 7 CO -0.02 -0.22 -0.02 0.21 0.00 0.00 0.00 173.10 173.06 2yqi s ASN 8 N -3.00 4.76 0.04 1.64 3.84 -1.26 -5.09 114.94 115.87 2yqi s ASN 8 Ca 0.14 -1.43 0.02 0.00 0.21 0.00 0.00 52.86 51.79 2yqi s ASN 8 Cb -0.05 -1.66 -0.02 0.00 -0.55 0.00 0.00 41.25 38.96 2yqi s ASN 8 CO 0.09 -0.27 -0.07 0.00 -2.79 0.00 0.00 177.10 174.06 2yqi s ALA 9 N 1.17 0.55 1.25 1.71 0.00 -1.26 -5.16 121.76 120.01 2yqi s ALA 9 Ca -0.04 -0.69 -0.21 0.00 0.00 0.00 0.00 51.96 51.02 2yqi s ALA 9 Cb -0.20 0.02 0.31 0.00 0.00 0.00 0.00 23.12 23.25 2yqi s ALA 9 CO -0.03 -0.00 1.11 -1.25 0.00 0.00 0.00 175.76 175.59 2yqi s PRO 10 N -1.37 -1.60 0.06 0.00 0.04 -1.26 -5.09 135.00 125.78 2yqi s PRO 10 Ca -0.08 -0.20 0.02 0.00 0.04 0.00 0.00 61.00 60.77 2yqi s PRO 10 Cb -0.09 -1.56 -0.03 0.00 0.04 0.00 0.00 34.50 32.86 2yqi s PRO 10 CO 0.00 -3.94 -0.07 -1.59 0.04 0.00 0.00 177.00 171.45 2yqi s LYS 11 N -5.52 0.62 0.43 4.56 -2.85 -1.26 -5.11 119.74 110.63 2yqi s LYS 11 Ca 0.72 -0.98 -0.24 0.00 -1.00 0.00 0.00 55.97 54.47 2yqi s LYS 11 Cb -0.07 -0.19 -0.10 0.00 -2.06 0.00 0.00 37.83 35.40 2yqi s LYS 11 CO 0.56 0.01 1.05 0.54 0.10 0.00 0.00 175.35 177.60 2yqi n ARG 12 N 0.86 1.41 -2.26 1.78 1.74 -1.26 -4.94 116.66 113.99 2yqi n ARG 12 Ca -0.19 0.51 -0.36 0.00 -0.77 0.00 0.00 57.85 57.04 2yqi n ARG 12 Cb 0.57 -2.11 -0.01 0.00 -1.02 0.00 0.00 32.46 29.90 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 -2.10 3.60 0.10 5.56 0.04 -1.26 -5.05 135.00 135.89 2yqi s PRO 13 Ca 0.64 1.71 -0.02 0.00 0.04 0.00 0.00 61.00 63.37 2yqi s PRO 13 Cb -0.54 -2.25 0.02 0.00 0.04 0.00 0.00 34.50 31.78 2yqi s PRO 13 CO 0.56 -0.66 0.09 -0.35 0.04 0.00 0.00 177.00 176.68 2yqi n PRO 14 N -0.80 -1.20 -4.28 0.56 -0.04 -1.26 -5.04 135.00 122.94 2yqi n PRO 14 Ca 0.09 -0.14 -0.19 0.00 -0.04 0.00 0.00 63.50 63.21 2yqi n PRO 14 Cb 0.49 -0.13 -0.13 0.00 -0.04 0.00 0.00 33.50 33.69 2yqi n PRO 14 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2yqi s SER 15 N -1.75 1.66 0.39 3.54 0.15 -1.26 -4.83 113.70 111.60 2yqi s SER 15 Ca 0.06 -0.51 0.28 0.00 0.70 0.00 0.00 55.95 56.47 2yqi s SER 15 Cb -0.01 -0.08 1.35 0.00 -1.71 0.00 0.00 66.02 65.57 2yqi s SER 15 CO 0.04 -0.01 1.45 0.61 1.20 0.00 0.00 173.24 176.53 2yqi n GLY 16 N 1.67 -0.76 0.22 9.45 0.00 -1.25 0.18 105.19 114.70 2yqi n GLY 16 Ca -0.19 0.71 -0.14 0.00 0.00 0.00 0.00 46.02 46.41 2yqi n GLY 16 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2yqi h PHE 17 N 0.00 0.89 -0.69 1.61 3.57 -1.95 -2.72 116.94 117.65 2yqi h PHE 17 Ca 0.81 -0.28 -0.08 0.00 3.53 0.00 0.00 57.97 61.95 2yqi h PHE 17 Cb 2.50 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 41.03 2yqi h PHE 17 CO -0.01 1.05 0.13 0.35 -2.23 0.00 0.00 178.31 177.60 2yqi h PHE 18 N 0.49 1.20 0.30 0.41 3.04 0.15 -1.67 116.94 120.84 2yqi h PHE 18 Ca 0.04 -0.16 -0.01 0.00 3.98 0.00 0.00 57.97 61.82 2yqi h PHE 18 Cb 0.92 -0.33 0.00 0.00 2.56 0.00 0.00 35.95 39.10 2yqi h PHE 18 CO 0.07 0.99 -0.14 -0.07 -2.02 0.00 0.00 178.31 177.14 2yqi h LEU 19 N 1.06 -0.34 -1.33 0.59 4.07 -1.10 0.09 115.31 118.35 2yqi h LEU 19 Ca 0.21 0.01 0.23 0.00 0.08 0.00 0.00 57.88 58.41 2yqi h LEU 19 Cb 0.43 0.09 -0.09 0.00 1.08 0.00 0.00 40.66 42.17 2yqi h LEU 19 CO 0.01 -0.24 0.64 0.15 -1.08 0.00 0.00 178.44 177.92 2yqi h PHE 20 N -0.41 0.71 0.11 1.13 3.04 -1.55 0.25 116.94 120.23 2yqi h PHE 20 Ca -0.04 0.02 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 2yqi h PHE 20 Cb 0.31 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.61 2yqi h PHE 20 CO 0.15 0.12 -0.05 0.00 -2.02 0.00 0.00 178.31 176.51 2yqi h SER 22 N -0.33 0.00 1.09 0.00 0.87 0.51 0.27 113.55 115.94 2yqi h SER 22 Ca -0.01 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.36 2yqi h SER 22 Cb 0.27 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.21 2yqi h SER 22 CO 0.02 0.20 -0.94 -0.08 -0.53 0.00 0.00 176.83 175.50 2yqi h GLU 23 N 0.00 0.00 0.00 2.24 4.81 -0.29 -3.28 114.58 118.06 2yqi h GLU 23 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2yqi h GLU 23 Cb 0.59 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.97 2yqi h GLU 23 CO 0.03 0.76 -1.08 1.19 -0.73 0.00 0.00 179.01 179.18 2yqi n PHE 24 N -3.26 0.10 -0.21 0.92 3.01 0.56 -4.32 117.46 114.25 2yqi n PHE 24 Ca -0.01 0.03 0.01 0.00 1.01 0.00 0.00 57.45 58.48 2yqi n PHE 24 Cb 0.88 -0.26 0.12 0.00 -0.01 0.00 0.00 39.48 40.21 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 0.42 -0.41 -1.08 2.43 -0.54 -2.60 114.38 112.60 2yqi h ARG 25 Ca 0.00 -0.03 0.08 0.00 -0.81 0.00 0.00 59.98 59.23 2yqi h ARG 25 Cb 0.65 -0.10 -0.09 0.00 -0.42 0.00 0.00 29.97 30.01 2yqi h ARG 25 CO 0.00 0.28 -0.34 -1.35 -1.51 0.00 0.00 179.97 177.05 2yqi h PRO 26 N 0.44 -0.24 0.44 0.20 0.11 -1.75 -0.22 132.00 130.96 2yqi h PRO 26 Ca 0.32 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.44 2yqi h PRO 26 Cb 0.40 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 2yqi h PRO 26 CO -0.31 -0.16 -0.49 0.87 -0.21 0.00 0.00 178.00 177.69 2yqi h LYS 27 N -0.25 -0.91 -0.64 1.05 1.57 -1.75 0.36 116.57 116.00 2yqi h LYS 27 Ca 0.17 0.06 0.12 0.00 -1.87 0.00 0.00 60.65 59.14 2yqi h LYS 27 Cb 0.54 0.21 -0.12 0.00 0.08 0.00 0.00 32.23 32.94 2yqi h LYS 27 CO -0.55 -0.60 -0.22 0.82 -0.57 0.00 0.00 179.45 178.32 2yqi h ILE 28 N -0.94 0.28 0.00 1.86 2.04 -1.28 1.65 117.51 121.12 2yqi h ILE 28 Ca -0.05 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.81 2yqi h ILE 28 Cb 0.83 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2yqi h ILE 28 CO -0.09 0.00 0.00 0.11 0.00 0.00 0.00 178.15 178.17 2yqi h LYS 29 N -0.06 0.00 0.00 2.37 1.57 -0.74 0.22 116.57 119.94 2yqi h LYS 29 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 2yqi h LYS 29 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2yqi h LYS 29 CO -0.68 0.00 -1.00 0.43 -0.57 0.00 0.00 179.45 177.63 2yqi n SER 30 N -2.99 0.74 -0.12 0.86 7.64 0.30 -4.38 113.62 115.66 2yqi n SER 30 Ca 0.00 -0.61 -0.17 0.00 1.01 0.00 0.00 58.87 59.10 2yqi n SER 30 Cb 0.25 0.91 -0.11 0.00 -1.01 0.00 0.00 64.21 64.25 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 -1.66 1.36 -3.63 0.44 -2.24 0.48 -4.95 114.28 104.08 2yqi n THR 31 Ca 0.03 -0.51 -0.37 0.00 -2.27 0.00 0.00 64.05 60.94 2yqi n THR 31 Cb 0.37 -1.38 -0.07 0.00 -2.10 0.00 0.00 70.33 67.16 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 -6.38 6.46 0.14 3.42 0.01 0.72 -5.06 114.94 114.25 2yqi s ASN 32 Ca -0.32 0.54 -0.31 0.00 -0.71 0.00 0.00 52.86 52.06 2yqi s ASN 32 Cb 0.09 -2.16 -0.08 0.00 0.41 0.00 0.00 41.25 39.51 2yqi s ASN 32 CO 0.54 0.21 1.35 -2.16 -1.51 0.00 0.00 177.10 175.53 2yqi s PRO 33 N -0.10 4.35 -1.12 -0.60 0.04 -1.26 -3.62 135.00 132.69 2yqi s PRO 33 Ca 0.16 2.04 -0.01 0.00 0.04 0.00 0.00 61.00 63.23 2yqi s PRO 33 Cb -0.13 -3.24 0.01 0.00 0.04 0.00 0.00 34.50 31.18 2yqi s PRO 33 CO 0.05 -0.36 0.03 0.41 0.04 0.00 0.00 177.00 177.16 2yqi n GLY 34 N 3.09 -0.10 3.66 0.56 0.00 -1.26 -4.80 105.19 106.33 2yqi n GLY 34 Ca 0.09 0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 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 -3.90 4.46 0.45 -0.61 2.07 -1.24 -5.01 121.20 117.42 2yqi s ILE 35 Ca 0.04 1.75 -0.22 0.00 -1.41 0.00 0.00 60.65 60.81 2yqi s ILE 35 Cb -0.02 -4.17 -0.09 0.00 0.13 0.00 0.00 42.46 38.31 2yqi s ILE 35 CO 0.71 -0.19 1.03 -0.94 -1.91 0.00 0.00 174.94 173.64 2yqi s SER 36 N 1.67 6.56 0.50 4.50 1.04 -1.26 -4.89 113.70 121.81 2yqi s SER 36 Ca 0.50 1.94 0.36 0.00 0.48 0.00 0.00 55.95 59.23 2yqi s SER 36 Cb -0.18 -2.57 1.50 0.00 0.10 0.00 0.00 66.02 64.88 2yqi s SER 36 CO 0.11 -0.63 1.69 0.40 0.98 0.00 0.00 173.24 175.79 2yqi h ILE 37 N 1.83 0.23 -0.55 -1.02 2.04 -2.00 0.21 117.51 118.25 2yqi h ILE 37 Ca -0.49 -0.03 0.09 0.00 1.00 0.00 0.00 64.86 65.43 2yqi h ILE 37 Cb 1.21 0.15 -0.07 0.00 -0.74 0.00 0.00 36.82 37.37 2yqi h ILE 37 CO 0.60 0.01 0.15 1.23 0.00 0.00 0.00 178.15 180.15 2yqi h GLY 38 N 0.08 0.71 0.72 5.37 0.00 -2.01 -1.34 103.07 106.61 2yqi h GLY 38 Ca 0.74 -0.06 -0.02 0.00 0.00 0.00 0.00 47.33 48.00 2yqi h GLY 38 CO -0.17 -0.06 -0.16 -1.80 0.00 0.00 0.00 176.54 174.35 2yqi h ASP 39 N 0.30 -0.38 -0.58 0.19 3.58 -0.94 -3.20 116.42 115.39 2yqi h ASP 39 Ca 0.28 -0.14 0.09 0.00 0.42 0.00 0.00 57.03 57.68 2yqi h ASP 39 Cb 0.37 0.10 -0.11 0.00 1.72 0.00 0.00 39.33 41.41 2yqi h ASP 39 CO -0.33 -0.05 -0.40 0.58 -2.88 0.00 0.00 179.24 176.16 2yqi h VAL 40 N -0.73 0.11 -0.93 2.25 2.07 -1.42 0.12 116.25 117.73 2yqi h VAL 40 Ca -0.05 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.75 2yqi h VAL 40 Cb 0.50 0.11 -0.16 0.00 -1.52 0.00 0.00 31.29 30.22 2yqi h VAL 40 CO 0.08 0.00 0.21 0.00 0.02 0.00 0.00 177.57 177.88 2yqi h ALA 41 N 0.74 1.37 0.24 1.67 0.00 -1.28 0.38 119.26 122.38 2yqi h ALA 41 Ca 0.20 0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.36 2yqi h ALA 41 Cb 0.56 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2yqi h ALA 41 CO -0.68 -0.57 -0.12 -0.22 0.00 0.00 0.00 179.25 177.66 2yqi h LYS 42 N 0.12 -0.31 0.92 0.00 3.64 -0.77 -2.76 116.57 117.41 2yqi h LYS 42 Ca 0.61 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.97 2yqi h LYS 42 Cb 1.31 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 33.20 2yqi h LYS 42 CO -0.75 -0.12 -0.46 0.87 -2.27 0.00 0.00 179.45 176.72 2yqi h LYS 43 N -0.46 -1.22 -0.87 1.90 1.57 -0.19 -3.11 116.57 114.20 2yqi h LYS 43 Ca -0.03 0.08 0.09 0.00 -1.87 0.00 0.00 60.65 58.92 2yqi h LYS 43 Cb 0.34 0.28 -0.11 0.00 0.08 0.00 0.00 32.23 32.82 2yqi h LYS 43 CO 0.05 -0.81 -0.47 1.28 -0.57 0.00 0.00 179.45 178.93 2yqi n LEU 44 N -5.64 -0.84 -0.30 2.94 4.77 0.11 0.74 117.00 118.78 2yqi n LEU 44 Ca -0.16 1.54 0.12 0.00 -0.03 0.00 0.00 56.01 57.47 2yqi n LEU 44 Cb 0.51 -0.23 0.27 0.00 -2.33 0.00 0.00 43.42 41.63 2yqi n LEU 44 CO 0.39 -1.28 0.90 1.23 -1.33 0.00 0.00 177.39 177.30 2yqi h GLY 45 N 0.00 1.25 0.67 -0.72 0.00 -1.44 0.13 103.07 102.96 2yqi h GLY 45 Ca 0.18 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 2yqi h GLY 45 CO -0.83 -0.38 -0.23 0.83 0.00 0.00 0.00 176.54 175.93 2yqi h GLU 46 N 0.15 -0.62 -1.02 4.80 4.39 0.38 -2.68 114.58 119.98 2yqi h GLU 46 Ca 0.53 0.04 0.25 0.00 0.34 0.00 0.00 59.36 60.53 2yqi h GLU 46 Cb 1.07 0.14 -0.12 0.00 -0.10 0.00 0.00 28.75 29.74 2yqi h GLU 46 CO -0.70 -0.32 0.62 0.52 -1.16 0.00 0.00 179.01 177.97 2yqi h MET 47 N -0.99 0.51 0.85 2.33 2.86 -0.16 -0.72 114.93 119.62 2yqi h MET 47 Ca -0.07 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 2yqi h MET 47 Cb 0.59 -0.12 0.01 0.00 0.06 0.00 0.00 31.60 32.15 2yqi h MET 47 CO 0.11 0.34 -0.41 2.35 1.06 0.00 0.00 176.91 180.36 2yqi h TRP 48 N 0.53 -1.06 -0.96 -0.22 2.91 -0.71 -2.66 115.95 113.77 2yqi h TRP 48 Ca 0.64 -0.02 0.19 0.00 1.13 0.00 0.00 58.89 60.82 2yqi h TRP 48 Cb 1.31 0.35 -0.11 0.00 -0.51 0.00 0.00 29.16 30.21 2yqi h TRP 48 CO -0.01 -0.66 0.56 -0.97 -1.03 0.00 0.00 178.44 176.33 2yqi h ASN 49 N -1.20 0.69 -0.70 2.65 -1.24 -0.99 0.03 115.58 114.82 2yqi h ASN 49 Ca -0.12 0.11 0.10 0.00 0.71 0.00 0.00 56.30 57.10 2yqi h ASN 49 Cb 0.87 -0.01 -0.07 0.00 0.73 0.00 0.00 38.32 39.84 2yqi h ASN 49 CO 0.19 0.22 0.33 0.78 -1.29 0.00 0.00 177.43 177.67 2yqi h ASN 50 N 0.69 0.41 -2.97 1.15 2.35 -1.01 -3.43 115.58 112.77 2yqi h ASN 50 Ca 0.56 0.07 -0.58 0.00 -0.55 0.00 0.00 56.30 55.80 2yqi h ASN 50 Cb 0.90 0.00 0.17 0.00 0.05 0.00 0.00 38.32 39.44 2yqi h ASN 50 CO -0.40 0.23 -0.35 0.18 -1.65 0.00 0.00 177.43 175.43 2yqi n LEU 51 N -4.90 0.94 -4.94 1.61 4.77 -0.00 -4.98 117.00 109.49 2yqi n LEU 51 Ca 0.11 0.75 -0.24 0.00 -0.03 0.00 0.00 56.01 56.60 2yqi n LEU 51 Cb 0.29 -1.19 -0.02 0.00 -2.33 0.00 0.00 43.42 40.17 2yqi n LEU 51 CO 0.24 -2.95 0.04 0.21 -1.33 0.00 0.00 177.39 173.60 2yqi s ASN 52 N -1.16 6.34 0.34 -1.43 2.47 -1.26 -4.91 114.94 115.33 2yqi s ASN 52 Ca 0.69 0.31 0.14 0.00 0.42 0.00 0.00 52.86 54.41 2yqi s ASN 52 Cb -0.45 -1.97 1.03 0.00 -1.45 0.00 0.00 41.25 38.41 2yqi s ASN 52 CO 0.54 -0.12 1.70 0.44 -3.72 0.00 0.00 177.10 175.94 2yqi h ASP 53 N 1.41 0.56 0.61 -4.21 5.19 -1.96 1.03 116.42 119.06 2yqi h ASP 53 Ca -0.50 0.16 -0.10 0.00 -0.62 0.00 0.00 57.03 55.97 2yqi h ASP 53 Cb 1.21 0.08 -0.01 0.00 0.18 0.00 0.00 39.33 40.79 2yqi h ASP 53 CO 0.64 -0.03 -0.50 0.28 -3.12 0.00 0.00 179.24 176.52 2yqi h SER 54 N 0.42 0.00 0.37 6.45 0.02 -2.00 -1.50 113.55 117.31 2yqi h SER 54 Ca 0.69 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 61.43 2yqi h SER 54 Cb 1.53 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.07 2yqi h SER 54 CO -0.52 0.50 -0.89 -0.33 -1.14 0.00 0.00 176.83 174.45 2yqi h GLU 55 N 0.00 0.37 0.00 3.45 4.39 0.64 -3.17 114.58 120.26 2yqi h GLU 55 Ca -0.00 -0.38 -0.02 0.00 0.34 0.00 0.00 59.36 59.30 2yqi h GLU 55 Cb 0.94 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.69 2yqi h GLU 55 CO 0.06 1.05 -0.16 0.87 -1.16 0.00 0.00 179.01 179.67 2yqi h LYS 56 N 0.21 0.00 -0.68 2.33 1.57 -0.90 -3.36 116.57 115.75 2yqi h LYS 56 Ca -0.06 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.80 2yqi h LYS 56 Cb 1.51 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.72 2yqi h LYS 56 CO 0.15 0.08 -0.51 1.96 -0.57 0.00 0.00 179.45 180.56 2yqi h GLN 57 N 0.00 -0.19 0.00 3.15 1.08 -1.24 0.97 115.11 118.88 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 1.07 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 2yqi h GLN 57 CO 0.01 -0.13 0.00 -0.35 -0.95 0.00 0.00 178.83 177.41 2yqi n PRO 58 N -5.36 0.03 -0.05 1.46 -0.04 -1.26 -1.71 135.00 128.07 2yqi n PRO 58 Ca 0.01 0.24 -0.07 0.00 -0.04 0.00 0.00 63.50 63.64 2yqi n PRO 58 Cb 0.33 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.14 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 -1.47 0.47 0.07 0.54 4.01 0.27 -4.03 117.16 117.03 2yqi n TYR 59 Ca 0.04 0.17 -0.22 0.00 -0.16 0.00 0.00 57.90 57.72 2yqi n TYR 59 Cb 0.16 -1.05 -0.15 0.00 -0.31 0.00 0.00 39.34 37.99 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 0.95 -0.74 -0.72 2.04 0.64 -3.32 117.51 116.36 2yqi h ILE 60 Ca -0.38 -2.54 0.05 0.00 1.00 0.00 0.00 64.86 62.99 2yqi h ILE 60 Cb 2.02 2.76 -0.04 0.00 -0.74 0.00 0.00 36.82 40.81 2yqi h ILE 60 CO 0.05 0.85 0.49 0.74 0.00 0.00 0.00 178.15 180.28 2yqi h THR 61 N 0.10 1.06 -0.31 -0.27 2.02 -1.54 -0.28 112.91 113.70 2yqi h THR 61 Ca -0.34 -0.29 -0.07 0.00 0.77 0.00 0.00 66.41 66.49 2yqi h THR 61 Cb 2.09 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 2yqi h THR 61 CO 0.18 0.15 -0.11 0.50 0.37 0.00 0.00 175.52 176.61 2yqi h LYS 62 N 0.83 0.51 0.00 6.66 1.63 -1.70 0.41 116.57 124.92 2yqi h LYS 62 Ca 0.31 -0.14 -0.13 0.00 -0.85 0.00 0.00 60.65 59.83 2yqi h LYS 62 Cb 0.17 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.72 2yqi h LYS 62 CO -0.10 0.62 -0.63 0.00 -3.45 0.00 0.00 179.45 175.90 2yqi h ALA 63 N 1.41 0.62 0.23 5.00 0.00 -1.32 -2.87 119.26 122.33 2yqi h ALA 63 Ca 0.09 -0.57 -0.32 0.00 0.00 0.00 0.00 54.91 54.11 2yqi h ALA 63 Cb 0.48 -0.10 0.04 0.00 0.00 0.00 0.00 17.79 18.21 2yqi h ALA 63 CO 0.03 0.78 -1.39 0.00 0.00 0.00 0.00 179.25 178.67 2yqi h ALA 64 N 1.37 -0.15 -0.12 0.00 0.00 -0.68 -3.15 119.26 116.53 2yqi h ALA 64 Ca -0.01 -0.83 -0.10 0.00 0.00 0.00 0.00 54.91 53.97 2yqi h ALA 64 Cb 1.44 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.39 2yqi h ALA 64 CO 0.08 0.65 -0.37 1.57 0.00 0.00 0.00 179.25 181.18 2yqi h LYS 65 N 0.10 0.25 -0.29 0.00 5.09 -1.01 -2.86 116.57 117.85 2yqi h LYS 65 Ca -0.24 -0.11 -0.10 0.00 0.09 0.00 0.00 60.65 60.28 2yqi h LYS 65 Cb 2.09 -0.01 -0.01 0.00 0.10 0.00 0.00 32.23 34.40 2yqi h LYS 65 CO 0.26 0.60 -0.26 -0.07 -2.09 0.00 0.00 179.45 177.89 2yqi h LEU 66 N 0.22 0.57 0.17 7.07 3.38 -1.59 -3.15 115.31 121.98 2yqi h LEU 66 Ca 0.02 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2yqi h LEU 66 Cb 0.76 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2yqi h LEU 66 CO 0.06 0.82 -0.08 0.50 0.09 0.00 0.00 178.44 179.82 2yqi h LYS 67 N 0.50 -0.22 -0.82 1.13 3.64 -1.46 -1.32 116.57 118.02 2yqi h LYS 67 Ca 0.07 0.02 0.20 0.00 -1.27 0.00 0.00 60.65 59.66 2yqi h LYS 67 Cb 0.71 0.05 -0.14 0.00 -0.41 0.00 0.00 32.23 32.44 2yqi h LYS 67 CO 0.05 -0.09 0.07 0.93 -2.27 0.00 0.00 179.45 178.14 2yqi h GLU 68 N -0.30 0.12 -0.48 1.90 4.39 -1.50 0.25 114.58 118.96 2yqi h GLU 68 Ca -0.02 -0.01 -0.13 0.00 0.34 0.00 0.00 59.36 59.53 2yqi h GLU 68 Cb 0.24 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2yqi h GLU 68 CO 0.04 0.08 -0.23 -0.22 -1.16 0.00 0.00 179.01 177.52 2yqi h LYS 69 N 0.13 1.00 0.15 2.33 3.64 -1.52 -2.97 116.57 119.32 2yqi h LYS 69 Ca 0.47 -0.43 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2yqi h LYS 69 Cb 0.88 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.64 2yqi h LYS 69 CO -0.69 1.11 -0.36 -0.92 -2.27 0.00 0.00 179.45 176.32 2yqi h TYR 70 N 0.85 -1.03 -0.60 1.91 3.20 0.65 -1.47 116.97 120.48 2yqi h TYR 70 Ca 0.11 0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.12 2yqi h TYR 70 Cb 0.81 0.43 -0.11 0.00 1.54 0.00 0.00 36.73 39.40 2yqi h TYR 70 CO 0.05 -0.42 -0.06 0.93 -1.64 0.00 0.00 178.16 177.02 2yqi h GLU 71 N -0.56 0.07 -0.29 1.82 5.08 -1.39 0.58 114.58 119.88 2yqi h GLU 71 Ca -0.01 -0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.42 2yqi h GLU 71 Cb 0.54 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2yqi h GLU 71 CO -0.16 0.04 0.32 -0.22 -1.00 0.00 0.00 179.01 177.99 2yqi h LYS 72 N 0.07 0.00 0.00 2.33 3.64 -1.28 -0.84 116.57 120.49 2yqi h LYS 72 Ca 0.31 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 2yqi h LYS 72 Cb 0.49 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 2yqi h LYS 72 CO -0.56 0.00 -0.09 -0.44 -2.27 0.00 0.00 179.45 176.09 2yqi h ASP 73 N 0.00 0.00 -1.38 4.20 5.19 0.11 -2.94 116.42 121.60 2yqi h ASP 73 Ca 0.14 0.00 0.43 0.00 -0.62 0.00 0.00 57.03 56.97 2yqi h ASP 73 Cb 0.77 0.00 -0.10 0.00 0.18 0.00 0.00 39.33 40.18 2yqi h ASP 73 CO -0.00 0.22 0.93 -0.37 -3.12 0.00 0.00 179.24 176.90 2yqi h VAL 74 N -0.35 0.19 0.21 -1.35 -1.51 -0.97 0.45 116.25 112.93 2yqi h VAL 74 Ca 0.00 -0.03 -0.01 0.00 -1.23 0.00 0.00 66.70 65.43 2yqi h VAL 74 Cb 0.09 0.09 0.00 0.00 -2.13 0.00 0.00 31.29 29.34 2yqi h VAL 74 CO 0.00 0.02 -0.10 0.00 -1.23 0.00 0.00 177.57 176.26 2yqi h ALA 75 N 1.47 -0.28 -0.00 5.19 0.00 -1.31 -0.76 119.26 123.56 2yqi h ALA 75 Ca 0.78 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.52 2yqi h ALA 75 Cb 2.61 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 20.51 2yqi h ALA 75 CO -0.27 -0.31 0.01 0.22 0.00 0.00 0.00 179.25 178.90 2yqi h ASP 76 N -0.98 0.00 0.09 0.00 3.58 -0.78 -2.30 116.42 116.02 2yqi h ASP 76 Ca -0.03 0.00 -0.23 0.00 0.42 0.00 0.00 57.03 57.19 2yqi h ASP 76 Cb 0.43 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.48 2yqi h ASP 76 CO 0.05 0.00 -1.15 0.22 -2.88 0.00 0.00 179.24 175.48 2yqi h TYR 77 N 0.00 0.36 -0.97 0.28 5.03 -0.23 -3.36 116.97 118.08 2yqi h TYR 77 Ca 0.00 -0.26 -0.48 0.00 2.58 0.00 0.00 58.73 60.57 2yqi h TYR 77 Cb 0.01 -0.01 -0.17 0.00 1.55 0.00 0.00 36.73 38.11 2yqi h TYR 77 CO 0.00 1.45 0.42 1.63 -1.32 0.00 0.00 178.16 180.33 2yqi n LYS 78 N -4.09 2.31 -3.96 1.82 5.02 -0.29 -4.81 118.16 114.15 2yqi n LYS 78 Ca -0.22 -2.25 -0.31 0.00 -2.02 0.00 0.00 58.31 53.51 2yqi n LYS 78 Cb 0.82 -2.05 -0.15 0.00 -0.02 0.00 0.00 35.03 33.62 2yqi n LYS 78 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2yqi s SER 79 N 0.25 4.54 -0.06 4.39 0.01 -1.13 -4.92 113.70 116.77 2yqi s SER 79 Ca 0.54 -1.95 -0.18 0.00 1.31 0.00 0.00 55.95 55.67 2yqi s SER 79 Cb 0.36 -1.44 0.04 0.00 0.21 0.00 0.00 66.02 65.19 2yqi s SER 79 CO -0.18 -0.37 0.42 -1.59 0.41 0.00 0.00 173.24 171.94 2yqi s LYS 80 N 1.09 0.71 0.00 12.44 0.00 -1.26 -5.06 119.74 127.65 2yqi s LYS 80 Ca 0.08 0.13 0.00 0.00 0.00 0.00 0.00 55.97 56.18 2yqi s LYS 80 Cb -0.19 0.33 0.00 0.00 0.00 0.00 0.00 37.83 37.97 2yqi s LYS 80 CO -0.11 -0.18 0.00 0.41 0.00 0.00 0.00 175.35 175.47