#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 0.00 -3.06 1.61 0.87 -2.12 -3.47 113.55 107.38 2yqi h SER 2 Ca 0.00 -0.06 -0.48 0.00 -1.23 0.00 0.00 61.79 60.02 2yqi h SER 2 Cb 0.00 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 61.98 2yqi h SER 2 CO 0.00 0.58 -0.06 -0.55 -0.53 0.00 0.00 176.83 176.26 2yqi s SER 3 N -5.63 6.14 0.00 6.23 0.15 -1.26 -5.01 113.70 114.33 2yqi s SER 3 Ca -0.03 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.18 2yqi s SER 3 Cb 0.00 -1.96 0.00 0.00 -1.71 0.00 0.00 66.02 62.35 2yqi s SER 3 CO 0.08 -0.51 0.00 0.61 1.20 0.00 0.00 173.24 174.61 2yqi n GLY 4 N -2.03 1.54 3.02 9.45 0.00 -1.26 -5.08 105.19 110.83 2yqi n GLY 4 Ca -0.01 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 43.84 2yqi n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yqi s SER 5 N 0.00 -0.15 0.10 1.61 1.04 -1.26 -5.14 113.70 109.90 2yqi s SER 5 Ca 0.00 0.31 0.02 0.00 0.48 0.00 0.00 55.95 56.75 2yqi s SER 5 Cb 0.00 0.30 -0.04 0.00 0.10 0.00 0.00 66.02 66.38 2yqi s SER 5 CO 0.00 -0.07 0.22 -0.44 0.98 0.00 0.00 173.24 173.94 2yqi s SER 6 N 0.23 6.23 -0.49 7.02 0.01 -1.26 -5.07 113.70 120.37 2yqi s SER 6 Ca -0.01 0.18 0.05 0.00 1.31 0.00 0.00 55.95 57.48 2yqi s SER 6 Cb -0.02 -1.87 0.21 0.00 0.21 0.00 0.00 66.02 64.54 2yqi s SER 6 CO -0.01 0.12 0.82 0.61 0.41 0.00 0.00 173.24 175.19 2yqi n GLY 7 N -0.07 -0.63 0.07 3.44 0.00 -1.26 -5.04 105.19 101.70 2yqi n GLY 7 Ca -0.06 0.52 -0.07 0.00 0.00 0.00 0.00 46.02 46.40 2yqi n GLY 7 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2yqi n ASN 8 N 2.61 1.57 -4.76 1.61 4.13 -1.26 -4.99 115.26 114.17 2yqi n ASN 8 Ca 0.15 0.27 -0.37 0.00 1.68 0.00 0.00 54.58 56.31 2yqi n ASN 8 Cb 0.59 -0.70 0.02 0.00 -1.54 0.00 0.00 39.78 38.15 2yqi n ASN 8 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2yqi s ALA 9 N -2.92 2.84 0.09 5.41 0.00 -1.26 -4.96 121.76 120.96 2yqi s ALA 9 Ca -0.23 1.08 -0.31 0.00 0.00 0.00 0.00 51.96 52.50 2yqi s ALA 9 Cb 0.03 -3.46 -0.07 0.00 0.00 0.00 0.00 23.12 19.62 2yqi s ALA 9 CO 0.34 -0.99 1.38 -1.25 0.00 0.00 0.00 175.76 175.25 2yqi s PRO 10 N -2.89 4.32 -0.03 0.00 0.04 -1.26 -4.99 135.00 130.20 2yqi s PRO 10 Ca 0.69 2.03 -0.30 0.00 0.04 0.00 0.00 61.00 63.46 2yqi s PRO 10 Cb -0.33 -3.32 -0.03 0.00 0.04 0.00 0.00 34.50 30.86 2yqi s PRO 10 CO 0.39 -0.45 1.07 0.15 0.04 0.00 0.00 177.00 178.20 2yqi s LYS 11 N 1.35 4.46 0.26 4.56 1.02 -1.26 -4.98 119.74 125.15 2yqi s LYS 11 Ca 0.64 1.52 -0.29 0.00 0.02 0.00 0.00 55.97 57.87 2yqi s LYS 11 Cb -0.35 -3.48 -0.15 0.00 -0.52 0.00 0.00 37.83 33.33 2yqi s LYS 11 CO 0.30 -0.24 0.95 -2.13 -0.92 0.00 0.00 175.35 173.31 2yqi n ARG 12 N 4.46 1.13 -2.26 1.68 0.63 -1.26 -4.91 116.66 116.13 2yqi n ARG 12 Ca 0.08 0.40 -0.36 0.00 -0.92 0.00 0.00 57.85 57.05 2yqi n ARG 12 Cb 0.49 -1.73 -0.00 0.00 0.45 0.00 0.00 32.46 31.67 2yqi n ARG 12 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2yqi s PRO 13 N -1.34 3.48 0.64 -0.14 0.04 -1.26 -5.02 135.00 131.40 2yqi s PRO 13 Ca 0.61 1.66 -0.16 0.00 0.04 0.00 0.00 61.00 63.16 2yqi s PRO 13 Cb -0.75 -2.13 -0.01 0.00 0.04 0.00 0.00 34.50 31.65 2yqi s PRO 13 CO 0.58 -0.76 1.11 -1.25 0.04 0.00 0.00 177.00 176.73 2yqi s PRO 14 N -3.10 2.91 0.18 0.56 0.04 -1.26 -5.02 135.00 129.32 2yqi s PRO 14 Ca 0.70 1.43 0.04 0.00 0.04 0.00 0.00 61.00 63.21 2yqi s PRO 14 Cb -0.25 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 2yqi s PRO 14 CO 0.29 -1.17 0.30 -1.12 0.04 0.00 0.00 177.00 175.34 2yqi s SER 15 N -2.43 6.26 0.57 6.66 0.01 -1.26 -4.70 113.70 118.81 2yqi s SER 15 Ca 0.68 0.11 0.44 0.00 1.31 0.00 0.00 55.95 58.49 2yqi s SER 15 Cb -0.21 -1.85 1.58 0.00 0.21 0.00 0.00 66.02 65.75 2yqi s SER 15 CO 0.39 0.01 1.58 1.23 0.41 0.00 0.00 173.24 176.85 2yqi h GLY 16 N 1.81 0.00 1.46 3.44 0.00 -1.87 1.54 103.07 109.45 2yqi h GLY 16 Ca -0.50 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 46.60 2yqi h GLY 16 CO 0.66 0.00 -0.98 -2.75 0.00 0.00 0.00 176.54 173.46 2yqi h PHE 17 N 0.00 0.72 0.11 5.60 3.57 -1.93 -3.27 116.94 121.75 2yqi h PHE 17 Ca 0.80 -0.40 -0.01 0.00 3.53 0.00 0.00 57.97 61.89 2yqi h PHE 17 Cb 3.36 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 42.02 2yqi h PHE 17 CO 0.00 1.23 -0.05 0.35 -2.23 0.00 0.00 178.31 177.60 2yqi h PHE 18 N 0.27 -0.14 -1.24 0.41 3.04 0.18 -2.80 116.94 116.65 2yqi h PHE 18 Ca -0.10 -0.00 0.45 0.00 3.98 0.00 0.00 57.97 62.30 2yqi h PHE 18 Cb 1.63 0.05 -0.15 0.00 2.56 0.00 0.00 35.95 40.04 2yqi h PHE 18 CO 0.07 0.25 0.77 1.28 -2.02 0.00 0.00 178.31 178.65 2yqi n LEU 19 N -4.85 0.24 0.11 0.59 4.77 -0.16 0.21 117.00 117.92 2yqi n LEU 19 Ca -0.06 1.42 -0.20 0.00 -0.03 0.00 0.00 56.01 57.15 2yqi n LEU 19 Cb 0.22 -0.70 -0.13 0.00 -2.33 0.00 0.00 43.42 40.48 2yqi n LEU 19 CO 0.18 -1.56 -0.09 0.15 -1.33 0.00 0.00 177.39 174.75 2yqi h PHE 20 N 0.00 0.75 -0.12 -1.77 3.04 -1.62 -2.84 116.94 114.38 2yqi h PHE 20 Ca 0.85 -0.52 -0.08 0.00 3.98 0.00 0.00 57.97 62.20 2yqi h PHE 20 Cb 2.60 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 41.05 2yqi h PHE 20 CO -0.01 1.39 -0.27 0.00 -2.02 0.00 0.00 178.31 177.40 2yqi h SER 22 N 0.20 0.00 0.53 0.00 0.87 -0.60 -2.08 113.55 112.47 2yqi h SER 22 Ca 0.03 -0.02 -0.21 0.00 -1.23 0.00 0.00 61.79 60.36 2yqi h SER 22 Cb 0.58 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.51 2yqi h SER 22 CO 0.04 0.01 -1.63 1.21 -0.53 0.00 0.00 176.83 175.93 2yqi n GLU 23 N -2.76 0.63 0.00 2.24 2.13 -0.89 -4.03 120.64 117.96 2yqi n GLU 23 Ca 0.04 0.19 0.11 0.00 0.66 0.00 0.00 57.16 58.16 2yqi n GLU 23 Cb 0.50 -1.76 0.06 0.00 0.27 0.00 0.00 31.44 30.52 2yqi n GLU 23 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2yqi n PHE 24 N -2.87 0.00 -0.16 4.31 3.01 0.07 -4.30 117.46 117.50 2yqi n PHE 24 Ca -0.14 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.26 2yqi n PHE 24 Cb 0.91 -0.07 0.03 0.00 -0.01 0.00 0.00 39.48 40.34 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 0.84 0.60 -0.62 -1.08 2.43 -1.51 -2.88 114.38 112.17 2yqi h ARG 25 Ca 0.00 -0.04 0.13 0.00 -0.81 0.00 0.00 59.98 59.26 2yqi h ARG 25 Cb 0.57 -0.14 -0.11 0.00 -0.42 0.00 0.00 29.97 29.87 2yqi h ARG 25 CO 0.00 0.40 -0.12 -1.35 -1.51 0.00 0.00 179.97 177.39 2yqi h PRO 26 N 0.62 0.02 0.59 0.20 0.11 -1.80 0.15 132.00 131.89 2yqi h PRO 26 Ca 0.19 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.28 2yqi h PRO 26 Cb -0.02 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 2yqi h PRO 26 CO -0.07 0.01 -0.36 0.87 -0.21 0.00 0.00 178.00 178.24 2yqi h LYS 27 N 0.02 -0.87 -0.85 1.05 1.57 -1.79 -0.68 116.57 115.02 2yqi h LYS 27 Ca 0.30 0.06 0.14 0.00 -1.87 0.00 0.00 60.65 59.28 2yqi h LYS 27 Cb 0.47 0.20 -0.06 0.00 0.08 0.00 0.00 32.23 32.92 2yqi h LYS 27 CO -0.61 -0.58 0.55 0.82 -0.57 0.00 0.00 179.45 179.06 2yqi h ILE 28 N -0.90 0.85 0.00 1.86 2.04 -1.27 0.47 117.51 120.55 2yqi h ILE 28 Ca -0.07 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2yqi h ILE 28 Cb 0.73 0.13 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2yqi h ILE 28 CO 0.07 0.12 0.00 0.11 0.00 0.00 0.00 178.15 178.45 2yqi h LYS 29 N 0.65 0.00 0.00 2.37 1.57 -0.28 0.13 116.57 121.01 2yqi h LYS 29 Ca 0.42 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 59.03 2yqi h LYS 29 Cb 0.70 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 2yqi h LYS 29 CO -0.18 0.00 -1.94 0.45 -0.57 0.00 0.00 179.45 177.21 2yqi n SER 30 N -2.82 0.26 0.01 0.86 2.88 0.12 -4.42 113.62 110.52 2yqi n SER 30 Ca 0.02 0.11 -0.20 0.00 -1.33 0.00 0.00 58.87 57.47 2yqi n SER 30 Cb 0.34 1.10 -0.14 0.00 -0.75 0.00 0.00 64.21 64.76 2yqi n SER 30 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 2yqi h THR 31 N 0.00 0.67 -3.41 2.46 1.35 -0.23 -3.43 112.91 110.32 2yqi h THR 31 Ca -0.24 -2.39 -0.75 0.00 -0.55 0.00 0.00 66.41 62.48 2yqi h THR 31 Cb 1.59 2.53 -0.27 0.00 -1.73 0.00 0.00 68.15 70.27 2yqi h THR 31 CO 0.02 0.87 -0.18 0.20 -0.25 0.00 0.00 175.52 176.18 2yqi s ASN 32 N -6.99 6.15 -0.08 5.36 0.01 0.43 -5.05 114.94 114.78 2yqi s ASN 32 Ca -0.20 -2.21 -0.30 0.00 -0.71 0.00 0.00 52.86 49.45 2yqi s ASN 32 Cb 0.07 -2.13 -0.04 0.00 0.41 0.00 0.00 41.25 39.56 2yqi s ASN 32 CO 0.78 -0.68 1.51 -2.16 -1.51 0.00 0.00 177.10 175.05 2yqi s PRO 33 N 0.93 4.21 -0.49 -0.60 0.04 -1.26 -3.10 135.00 134.73 2yqi s PRO 33 Ca 0.10 2.02 -0.03 0.00 0.04 0.00 0.00 61.00 63.12 2yqi s PRO 33 Cb -0.22 -3.87 0.00 0.00 0.04 0.00 0.00 34.50 30.45 2yqi s PRO 33 CO -0.02 -0.78 0.42 0.41 0.04 0.00 0.00 177.00 177.08 2yqi n GLY 34 N 3.93 0.37 3.85 0.56 0.00 -1.26 -5.03 105.19 107.61 2yqi n GLY 34 Ca 0.16 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.12 4.57 -0.06 -0.61 2.07 -1.18 -5.07 121.20 117.80 2yqi s ILE 35 Ca 0.18 1.13 -0.04 0.00 -1.41 0.00 0.00 60.65 60.51 2yqi s ILE 35 Cb -0.08 -3.69 -0.04 0.00 0.13 0.00 0.00 42.46 38.78 2yqi s ILE 35 CO 0.27 -0.55 0.12 -0.94 -1.91 0.00 0.00 174.94 171.92 2yqi s SER 36 N -2.87 6.05 0.12 4.50 1.04 -1.26 -4.98 113.70 116.29 2yqi s SER 36 Ca 0.58 0.31 -0.20 0.00 0.48 0.00 0.00 55.95 57.12 2yqi s SER 36 Cb -0.10 -1.86 -0.02 0.00 0.10 0.00 0.00 66.02 64.15 2yqi s SER 36 CO 0.27 0.33 1.07 -0.38 0.98 0.00 0.00 173.24 175.52 2yqi n ILE 37 N 1.54 -0.46 -0.28 -1.02 5.41 -1.26 0.56 119.36 123.85 2yqi n ILE 37 Ca -0.16 1.67 -0.01 0.00 1.00 0.00 0.00 62.75 65.26 2yqi n ILE 37 Cb 0.54 -2.09 0.06 0.00 -0.71 0.00 0.00 39.64 37.43 2yqi n ILE 37 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2yqi h GLY 38 N 0.00 0.23 0.05 7.39 0.00 -1.98 0.17 103.07 108.93 2yqi h GLY 38 Ca 0.13 0.39 0.01 0.00 0.00 0.00 0.00 47.33 47.86 2yqi h GLY 38 CO -0.66 -0.25 -0.24 -0.55 0.00 0.00 0.00 176.54 174.84 2yqi h ASP 39 N -0.06 -0.74 -0.99 0.19 5.19 -0.28 0.26 116.42 120.00 2yqi h ASP 39 Ca 0.33 0.08 0.20 0.00 -0.62 0.00 0.00 57.03 57.02 2yqi h ASP 39 Cb 0.59 0.27 -0.11 0.00 0.18 0.00 0.00 39.33 40.26 2yqi h ASP 39 CO -0.83 -0.25 0.58 0.58 -3.12 0.00 0.00 179.24 176.19 2yqi h VAL 40 N -0.34 0.64 -0.28 -1.35 2.07 -1.07 -0.23 116.25 115.69 2yqi h VAL 40 Ca -0.00 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 2yqi h VAL 40 Cb 0.35 -0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 2yqi h VAL 40 CO -0.14 0.12 0.14 0.00 0.02 0.00 0.00 177.57 177.72 2yqi h ALA 41 N 1.67 0.36 0.42 1.67 0.00 0.11 -1.14 119.26 122.35 2yqi h ALA 41 Ca 0.59 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.40 2yqi h ALA 41 Cb 0.98 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 2yqi h ALA 41 CO -0.42 -0.09 -0.24 -0.22 0.00 0.00 0.00 179.25 178.28 2yqi h LYS 42 N 0.33 -0.60 0.39 0.00 3.64 0.12 -2.73 116.57 117.71 2yqi h LYS 42 Ca 0.10 0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.51 2yqi h LYS 42 Cb 0.10 0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 2yqi h LYS 42 CO -0.01 -0.40 -0.52 0.87 -2.27 0.00 0.00 179.45 177.11 2yqi h LYS 43 N -0.63 -0.91 -0.69 1.90 1.57 -1.22 -2.96 116.57 113.64 2yqi h LYS 43 Ca -0.05 0.06 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 2yqi h LYS 43 Cb 0.50 0.21 -0.08 0.00 0.08 0.00 0.00 32.23 32.94 2yqi h LYS 43 CO 0.06 -0.60 -0.40 1.28 -0.57 0.00 0.00 179.45 179.21 2yqi n LEU 44 N -5.54 -0.73 -0.33 2.94 4.77 -0.44 0.79 117.00 118.47 2yqi n LEU 44 Ca -0.11 1.42 0.25 0.00 -0.03 0.00 0.00 56.01 57.54 2yqi n LEU 44 Cb 0.45 -0.26 0.47 0.00 -2.33 0.00 0.00 43.42 41.76 2yqi n LEU 44 CO 0.23 -1.09 0.98 1.23 -1.33 0.00 0.00 177.39 177.41 2yqi h GLY 45 N 0.00 1.90 0.53 -0.72 0.00 -1.32 0.14 103.07 103.60 2yqi h GLY 45 Ca 0.11 -0.06 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 2yqi h GLY 45 CO -0.64 -0.67 -0.15 0.83 0.00 0.00 0.00 176.54 175.90 2yqi h GLU 46 N 0.04 -0.41 -0.74 4.80 4.39 0.47 -2.64 114.58 120.50 2yqi h GLU 46 Ca 0.75 0.03 0.21 0.00 0.34 0.00 0.00 59.36 60.69 2yqi h GLU 46 Cb 1.83 0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 30.55 2yqi h GLU 46 CO -0.80 -0.07 0.58 0.52 -1.16 0.00 0.00 179.01 178.08 2yqi h MET 47 N -0.90 0.00 0.22 2.33 2.86 0.38 -0.73 114.93 119.10 2yqi h MET 47 Ca -0.04 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2yqi h MET 47 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 2yqi h MET 47 CO 0.07 0.00 -0.11 2.35 1.06 0.00 0.00 176.91 180.29 2yqi h TRP 48 N 0.00 -0.27 -0.78 -0.22 2.91 -0.75 -3.10 115.95 113.74 2yqi h TRP 48 Ca 0.35 -0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.43 2yqi h TRP 48 Cb 1.51 0.09 -0.06 0.00 -0.51 0.00 0.00 29.16 30.19 2yqi h TRP 48 CO 0.00 0.11 0.46 -0.97 -1.03 0.00 0.00 178.44 177.01 2yqi h ASN 49 N -0.88 0.68 -0.71 2.65 -1.24 -0.90 -1.97 115.58 113.21 2yqi h ASN 49 Ca -0.03 0.03 0.13 0.00 0.71 0.00 0.00 56.30 57.14 2yqi h ASN 49 Cb 0.51 -0.11 -0.09 0.00 0.73 0.00 0.00 38.32 39.36 2yqi h ASN 49 CO 0.05 0.43 0.27 0.78 -1.29 0.00 0.00 177.43 177.66 2yqi h ASN 50 N 0.81 0.23 -1.92 1.15 2.35 -1.25 -3.43 115.58 113.53 2yqi h ASN 50 Ca 0.35 0.10 -0.54 0.00 -0.55 0.00 0.00 56.30 55.67 2yqi h ASN 50 Cb 0.23 0.09 0.24 0.00 0.05 0.00 0.00 38.32 38.94 2yqi h ASN 50 CO -0.20 0.10 -1.93 0.18 -1.65 0.00 0.00 177.43 173.93 2yqi n LEU 51 N -5.02 -5.19 -4.82 1.61 4.77 -0.74 -4.97 117.00 102.65 2yqi n LEU 51 Ca 0.13 0.16 -0.26 0.00 -0.03 0.00 0.00 56.01 56.01 2yqi n LEU 51 Cb 0.38 -0.75 -0.05 0.00 -2.33 0.00 0.00 43.42 40.67 2yqi n LEU 51 CO 0.19 -5.31 -0.20 0.21 -1.33 0.00 0.00 177.39 170.95 2yqi s ASN 52 N -1.07 5.60 0.58 -1.43 2.47 -1.26 -4.96 114.94 114.88 2yqi s ASN 52 Ca 0.41 -0.11 0.29 0.00 0.42 0.00 0.00 52.86 53.86 2yqi s ASN 52 Cb -0.13 -1.48 1.43 0.00 -1.45 0.00 0.00 41.25 39.61 2yqi s ASN 52 CO 0.79 0.05 1.83 -0.78 -3.72 0.00 0.00 177.10 175.28 2yqi h ASP 53 N 2.26 0.00 1.06 -4.21 1.82 -1.95 0.72 116.42 116.13 2yqi h ASP 53 Ca -0.48 0.00 -0.19 0.00 -0.39 0.00 0.00 57.03 55.97 2yqi h ASP 53 Cb 1.20 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.19 2yqi h ASP 53 CO 0.63 0.00 -0.97 0.28 -1.61 0.00 0.00 179.24 177.57 2yqi h SER 54 N 0.00 0.00 0.66 2.28 0.02 -2.00 -2.89 113.55 111.61 2yqi h SER 54 Ca 0.29 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.99 2yqi h SER 54 Cb 1.47 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.01 2yqi h SER 54 CO -0.00 0.83 -1.12 -0.33 -1.14 0.00 0.00 176.83 175.07 2yqi h GLU 55 N 0.00 0.23 0.00 3.45 4.39 0.01 -3.23 114.58 119.42 2yqi h GLU 55 Ca -0.05 -0.35 -0.03 0.00 0.34 0.00 0.00 59.36 59.27 2yqi h GLU 55 Cb 1.68 0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 30.44 2yqi h GLU 55 CO 0.10 1.13 -0.16 0.87 -1.16 0.00 0.00 179.01 179.80 2yqi h LYS 56 N 0.08 0.00 -0.61 2.33 1.57 -1.19 -3.34 116.57 115.41 2yqi h LYS 56 Ca -0.09 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.76 2yqi h LYS 56 Cb 1.83 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 34.04 2yqi h LYS 56 CO 0.18 0.16 -0.51 1.96 -0.57 0.00 0.00 179.45 180.66 2yqi h GLN 57 N 0.00 -0.23 0.00 3.15 1.08 -1.53 0.85 115.11 118.43 2yqi h GLN 57 Ca -0.00 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.21 2yqi h GLN 57 Cb 1.02 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.51 2yqi h GLN 57 CO 0.02 -0.16 0.00 -0.35 -0.95 0.00 0.00 178.83 177.39 2yqi n PRO 58 N -5.37 0.02 -0.05 1.46 -0.04 -1.25 -1.71 135.00 128.06 2yqi n PRO 58 Ca 0.00 0.24 -0.06 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 32.15 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 -1.48 0.47 0.03 0.54 4.01 0.23 -3.84 117.16 117.12 2yqi n TYR 59 Ca 0.04 0.17 -0.14 0.00 -0.16 0.00 0.00 57.90 57.81 2yqi n TYR 59 Cb 0.16 -1.03 -0.14 0.00 -0.31 0.00 0.00 39.34 38.02 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 1.06 -0.55 -0.72 2.04 0.70 -3.30 117.51 116.73 2yqi h ILE 60 Ca -0.36 -2.78 -0.10 0.00 1.00 0.00 0.00 64.86 62.62 2yqi h ILE 60 Cb 1.97 2.63 -0.02 0.00 -0.74 0.00 0.00 36.82 40.66 2yqi h ILE 60 CO 0.05 0.75 -0.04 0.74 0.00 0.00 0.00 178.15 179.64 2yqi h THR 61 N 0.04 1.26 -0.10 -0.27 2.02 -1.52 -2.76 112.91 111.58 2yqi h THR 61 Ca -0.25 -1.16 0.00 0.00 0.77 0.00 0.00 66.41 65.77 2yqi h THR 61 Cb 1.99 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 2yqi h THR 61 CO 0.12 0.42 0.06 0.50 0.37 0.00 0.00 175.52 176.99 2yqi h LYS 62 N 0.89 0.12 -0.56 6.66 3.64 -1.70 -2.79 116.57 122.84 2yqi h LYS 62 Ca 0.15 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.59 2yqi h LYS 62 Cb 0.58 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.32 2yqi h LYS 62 CO 0.03 0.08 0.27 0.00 -2.27 0.00 0.00 179.45 177.57 2yqi h ALA 63 N 1.04 0.72 -1.04 5.00 0.00 -1.63 -1.60 119.26 121.75 2yqi h ALA 63 Ca 0.04 0.03 0.27 0.00 0.00 0.00 0.00 54.91 55.26 2yqi h ALA 63 Cb -0.01 -0.05 -0.12 0.00 0.00 0.00 0.00 17.79 17.61 2yqi h ALA 63 CO -0.01 -0.09 0.64 0.00 0.00 0.00 0.00 179.25 179.79 2yqi h ALA 64 N 1.32 2.04 0.12 0.00 0.00 -1.21 -0.82 119.26 120.71 2yqi h ALA 64 Ca 0.26 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 2yqi h ALA 64 Cb 0.20 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2yqi h ALA 64 CO -0.19 -0.51 -0.06 0.87 0.00 0.00 0.00 179.25 179.36 2yqi h LYS 65 N 0.45 -0.15 -1.14 0.00 1.57 -1.22 -3.15 116.57 112.93 2yqi h LYS 65 Ca 0.65 0.01 0.32 0.00 -1.87 0.00 0.00 60.65 59.76 2yqi h LYS 65 Cb 1.47 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 33.72 2yqi h LYS 65 CO -0.42 0.31 0.75 -0.07 -0.57 0.00 0.00 179.45 179.45 2yqi h LEU 66 N -0.70 0.31 -0.32 2.94 3.38 -0.84 0.26 115.31 120.33 2yqi h LEU 66 Ca -0.02 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 2yqi h LEU 66 Cb 0.53 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2yqi h LEU 66 CO 0.03 0.01 0.12 0.50 0.09 0.00 0.00 178.44 179.19 2yqi h LYS 67 N 0.25 0.49 -0.58 1.13 3.64 -1.31 -2.40 116.57 117.78 2yqi h LYS 67 Ca 0.64 -0.10 0.11 0.00 -1.27 0.00 0.00 60.65 60.03 2yqi h LYS 67 Cb 1.90 -0.08 -0.11 0.00 -0.41 0.00 0.00 32.23 33.53 2yqi h LYS 67 CO -0.26 0.51 -0.25 0.93 -2.27 0.00 0.00 179.45 178.11 2yqi h GLU 68 N 0.37 -0.10 -0.71 1.90 4.39 -0.47 0.80 114.58 120.75 2yqi h GLU 68 Ca 0.11 0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2yqi h GLU 68 Cb 0.21 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 2yqi h GLU 68 CO -0.01 -0.06 0.33 0.87 -1.16 0.00 0.00 179.01 178.98 2yqi h LYS 69 N -0.10 1.03 0.27 2.33 1.57 -1.48 -3.08 116.57 117.11 2yqi h LYS 69 Ca 0.26 -0.16 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2yqi h LYS 69 Cb 0.51 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 2yqi h LYS 69 CO -0.65 0.82 -0.32 -0.92 -0.57 0.00 0.00 179.45 177.81 2yqi h TYR 70 N 1.00 -0.87 -0.96 -1.35 3.20 -0.41 -2.28 116.97 115.29 2yqi h TYR 70 Ca 0.24 0.01 0.30 0.00 3.14 0.00 0.00 58.73 62.42 2yqi h TYR 70 Cb 0.13 0.35 -0.17 0.00 1.54 0.00 0.00 36.73 38.58 2yqi h TYR 70 CO 0.01 -0.45 0.23 0.93 -1.64 0.00 0.00 178.16 177.23 2yqi h GLU 71 N -0.64 0.07 0.41 1.82 5.08 -0.92 0.18 114.58 120.59 2yqi h GLU 71 Ca -0.01 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 2yqi h GLU 71 Cb 0.60 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 2yqi h GLU 71 CO -0.09 0.05 -0.46 0.87 -1.00 0.00 0.00 179.01 178.38 2yqi h LYS 72 N 0.07 -0.86 -0.30 2.33 1.79 -1.40 0.16 116.57 118.37 2yqi h LYS 72 Ca 0.65 0.06 0.02 0.00 -2.18 0.00 0.00 60.65 59.20 2yqi h LYS 72 Cb 1.46 0.20 -0.02 0.00 -1.58 0.00 0.00 32.23 32.28 2yqi h LYS 72 CO -0.80 -0.57 0.15 -0.44 -1.08 0.00 0.00 179.45 176.71 2yqi h ASP 73 N -0.89 0.23 -0.83 0.86 5.19 -0.76 -0.16 116.42 120.06 2yqi h ASP 73 Ca -0.04 0.01 0.11 0.00 -0.62 0.00 0.00 57.03 56.49 2yqi h ASP 73 Cb 0.80 -0.03 -0.06 0.00 0.18 0.00 0.00 39.33 40.22 2yqi h ASP 73 CO -0.09 0.17 0.54 0.58 -3.12 0.00 0.00 179.24 177.32 2yqi h VAL 74 N 0.32 0.92 0.32 -1.35 2.07 -0.53 0.20 116.25 118.20 2yqi h VAL 74 Ca 0.12 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.37 2yqi h VAL 74 Cb 0.03 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.93 2yqi h VAL 74 CO -0.08 0.13 -0.15 0.00 0.02 0.00 0.00 177.57 177.50 2yqi h ALA 75 N 1.59 -0.45 -0.47 1.67 0.00 0.00 -3.29 119.26 118.31 2yqi h ALA 75 Ca 0.39 -0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.30 2yqi h ALA 75 Cb 0.51 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.38 2yqi h ALA 75 CO -0.16 -0.42 -0.05 -0.44 0.00 0.00 0.00 179.25 178.18 2yqi h ASP 76 N -1.04 -0.31 -1.34 0.00 5.19 -0.90 0.07 116.42 118.10 2yqi h ASP 76 Ca -0.04 0.13 0.42 0.00 -0.62 0.00 0.00 57.03 56.92 2yqi h ASP 76 Cb 0.32 0.24 -0.12 0.00 0.18 0.00 0.00 39.33 39.96 2yqi h ASP 76 CO 0.07 -0.11 0.88 0.22 -3.12 0.00 0.00 179.24 177.18 2yqi h TYR 77 N 0.06 0.47 -3.99 4.55 5.03 -0.73 -3.40 116.97 118.97 2yqi h TYR 77 Ca 0.23 0.02 -0.51 0.00 2.58 0.00 0.00 58.73 61.06 2yqi h TYR 77 Cb 0.36 -0.12 0.06 0.00 1.55 0.00 0.00 36.73 38.58 2yqi h TYR 77 CO -0.35 -0.15 0.49 0.15 -1.32 0.00 0.00 178.16 176.98 2yqi s LYS 78 N -5.27 3.83 -1.24 1.82 1.02 0.01 -3.44 119.74 116.47 2yqi s LYS 78 Ca -0.07 1.79 -0.04 0.00 0.02 0.00 0.00 55.97 57.67 2yqi s LYS 78 Cb 0.29 -2.47 0.00 0.00 -0.52 0.00 0.00 37.83 35.13 2yqi s LYS 78 CO 0.82 -0.50 1.06 0.45 -0.92 0.00 0.00 175.35 176.27 2yqi n SER 79 N -0.35 -4.03 -4.75 2.83 2.88 -1.26 -4.97 113.62 103.96 2yqi n SER 79 Ca 0.07 -0.57 -0.40 0.00 -1.33 0.00 0.00 58.87 56.64 2yqi n SER 79 Cb 0.48 -4.97 -0.05 0.00 -0.75 0.00 0.00 64.21 58.92 2yqi n SER 79 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2yqi s LYS 80 N -5.77 4.50 0.00 -1.46 -2.85 -1.22 -5.14 119.74 107.79 2yqi s LYS 80 Ca 0.27 1.07 0.00 0.00 -1.00 0.00 0.00 55.97 56.31 2yqi s LYS 80 Cb -0.12 -3.35 0.00 0.00 -2.06 0.00 0.00 37.83 32.30 2yqi s LYS 80 CO 0.71 0.33 0.00 0.41 0.10 0.00 0.00 175.35 176.90