#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 -3.80 -4.48 1.61 2.88 -1.26 -4.99 113.62 103.58 2yqi n SER 2 Ca 0.00 -0.73 -0.26 0.00 -1.33 0.00 0.00 58.87 56.55 2yqi n SER 2 Cb 0.00 -4.26 -0.10 0.00 -0.75 0.00 0.00 64.21 59.09 2yqi n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yqi s SER 3 N -3.71 3.72 0.00 -3.46 0.01 -1.26 -4.92 113.70 104.08 2yqi s SER 3 Ca 0.40 -0.84 0.00 0.00 1.31 0.00 0.00 55.95 56.82 2yqi s SER 3 Cb -0.19 -0.40 0.00 0.00 0.21 0.00 0.00 66.02 65.64 2yqi s SER 3 CO 0.80 0.09 0.00 0.61 0.41 0.00 0.00 173.24 175.14 2yqi n GLY 4 N -0.10 4.97 0.10 3.44 0.00 -0.76 -5.04 105.19 107.81 2yqi n GLY 4 Ca -0.10 -1.99 -0.11 0.00 0.00 0.00 0.00 46.02 43.82 2yqi n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2yqi h SER 5 N 0.00 0.20 0.00 1.61 4.64 -2.05 -3.38 113.55 114.56 2yqi h SER 5 Ca 0.00 -0.12 -0.18 0.00 -0.47 0.00 0.00 61.79 61.02 2yqi h SER 5 Cb 0.00 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.01 2yqi h SER 5 CO 0.00 0.26 -1.65 -0.24 -0.87 0.00 0.00 176.83 174.34 2yqi n SER 6 N -4.90 2.28 -4.56 4.97 2.88 -1.26 -4.94 113.62 108.08 2yqi n SER 6 Ca -0.05 0.02 -0.40 0.00 -1.33 0.00 0.00 58.87 57.11 2yqi n SER 6 Cb 0.09 -0.24 -0.04 0.00 -0.75 0.00 0.00 64.21 63.28 2yqi n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yqi n GLY 7 N 2.70 0.50 2.81 0.46 0.00 -1.26 -4.92 105.19 105.48 2yqi n GLY 7 Ca -0.21 0.73 -0.24 0.00 0.00 0.00 0.00 46.02 46.30 2yqi n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yqi s ASN 8 N 10.39 1.70 0.04 1.61 4.22 -1.26 -1.82 114.94 129.82 2yqi s ASN 8 Ca 1.01 -0.14 -0.01 0.00 -2.14 0.00 0.00 52.86 51.58 2yqi s ASN 8 Cb -0.31 -0.54 -0.03 0.00 1.28 0.00 0.00 41.25 41.66 2yqi s ASN 8 CO 0.32 -0.17 -0.01 0.00 -2.04 0.00 0.00 177.10 175.19 2yqi s ALA 9 N 1.86 0.27 1.01 3.54 0.00 -1.26 -5.12 121.76 122.06 2yqi s ALA 9 Ca 0.04 -0.85 -0.12 0.00 0.00 0.00 0.00 51.96 51.02 2yqi s ALA 9 Cb -0.12 0.21 0.20 0.00 0.00 0.00 0.00 23.12 23.41 2yqi s ALA 9 CO -0.06 -0.27 1.09 -1.25 0.00 0.00 0.00 175.76 175.27 2yqi s PRO 10 N -2.67 0.30 -0.13 0.00 0.04 -1.26 -5.05 135.00 126.23 2yqi s PRO 10 Ca -0.05 0.49 0.01 0.00 0.04 0.00 0.00 61.00 61.49 2yqi s PRO 10 Cb -0.01 -1.72 0.02 0.00 0.04 0.00 0.00 34.50 32.82 2yqi s PRO 10 CO -0.05 -2.81 -0.13 0.15 0.04 0.00 0.00 177.00 174.19 2yqi s LYS 11 N -4.96 2.09 0.29 4.56 -0.14 -1.26 -5.08 119.74 115.24 2yqi s LYS 11 Ca 0.66 -0.49 -0.16 0.00 -1.36 0.00 0.00 55.97 54.62 2yqi s LYS 11 Cb -0.19 -1.91 -0.12 0.00 -1.68 0.00 0.00 37.83 33.94 2yqi s LYS 11 CO 0.58 -0.18 0.08 2.89 -0.76 0.00 0.00 175.35 177.95 2yqi n ARG 12 N 4.60 0.00 -2.26 1.68 1.85 -1.26 -4.85 116.66 116.42 2yqi n ARG 12 Ca -0.17 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.32 2yqi n ARG 12 Cb 0.50 -0.74 -0.00 0.00 -1.05 0.00 0.00 32.46 31.17 2yqi n ARG 12 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2yqi s PRO 13 N -0.74 3.51 1.03 2.89 0.04 -1.26 -5.03 135.00 135.43 2yqi s PRO 13 Ca 0.44 1.67 -0.13 0.00 0.04 0.00 0.00 61.00 63.02 2yqi s PRO 13 Cb -0.48 -2.16 0.20 0.00 0.04 0.00 0.00 34.50 32.11 2yqi s PRO 13 CO 0.46 -0.74 1.09 -1.25 0.04 0.00 0.00 177.00 176.61 2yqi s PRO 14 N -3.06 0.18 0.10 0.56 0.04 -1.26 -5.01 135.00 126.54 2yqi s PRO 14 Ca 0.69 0.43 0.06 0.00 0.04 0.00 0.00 61.00 62.23 2yqi s PRO 14 Cb -0.26 -1.72 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2yqi s PRO 14 CO 0.30 -2.88 -0.05 0.45 0.04 0.00 0.00 177.00 174.85 2yqi s SER 15 N -3.49 4.70 0.61 6.66 0.15 -1.26 -4.75 113.70 116.31 2yqi s SER 15 Ca 0.66 -0.29 0.28 0.00 0.70 0.00 0.00 55.95 57.30 2yqi s SER 15 Cb -0.18 -1.01 0.96 0.00 -1.71 0.00 0.00 66.02 64.09 2yqi s SER 15 CO 0.58 0.17 1.31 1.23 1.20 0.00 0.00 173.24 177.73 2yqi h GLY 16 N 3.49 0.00 1.03 9.45 0.00 -1.86 1.66 103.07 116.85 2yqi h GLY 16 Ca -0.48 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 46.51 2yqi h GLY 16 CO 0.56 0.00 -1.68 -2.75 0.00 0.00 0.00 176.54 172.67 2yqi h PHE 17 N 0.00 0.61 0.04 5.60 3.57 -1.93 -3.22 116.94 121.59 2yqi h PHE 17 Ca 0.52 -0.44 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2yqi h PHE 17 Cb 2.99 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 41.71 2yqi h PHE 17 CO 0.00 1.56 -0.02 0.35 -2.23 0.00 0.00 178.31 177.97 2yqi h PHE 18 N 0.09 -0.05 0.36 0.41 3.04 0.20 -1.90 116.94 119.10 2yqi h PHE 18 Ca -0.31 -0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.63 2yqi h PHE 18 Cb 2.07 0.02 -0.01 0.00 2.56 0.00 0.00 35.95 40.58 2yqi h PHE 18 CO 0.09 0.24 -0.35 -0.07 -2.02 0.00 0.00 178.31 176.20 2yqi h LEU 19 N -0.33 -0.96 -1.15 0.59 3.38 -1.43 -0.57 115.31 114.84 2yqi h LEU 19 Ca -0.01 0.08 0.25 0.00 0.09 0.00 0.00 57.88 58.29 2yqi h LEU 19 Cb 0.31 0.32 -0.11 0.00 0.09 0.00 0.00 40.66 41.26 2yqi h LEU 19 CO 0.01 -0.47 0.63 0.15 0.09 0.00 0.00 178.44 178.85 2yqi h PHE 20 N -0.70 0.88 0.67 1.13 3.04 -1.64 -1.37 116.94 118.96 2yqi h PHE 20 Ca -0.05 0.03 -0.03 0.00 3.98 0.00 0.00 57.97 61.90 2yqi h PHE 20 Cb 0.61 -0.26 0.01 0.00 2.56 0.00 0.00 35.95 38.87 2yqi h PHE 20 CO -0.19 0.09 -0.32 0.00 -2.02 0.00 0.00 178.31 175.86 2yqi h SER 22 N -0.95 0.00 0.74 0.00 0.87 -0.45 0.68 113.55 114.44 2yqi h SER 22 Ca -0.09 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.32 2yqi h SER 22 Cb 0.69 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.63 2yqi h SER 22 CO 0.15 0.00 -1.35 -0.08 -0.53 0.00 0.00 176.83 175.02 2yqi h GLU 23 N 0.00 0.00 0.00 2.24 4.81 -0.73 -3.35 114.58 117.55 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 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2yqi h GLU 23 CO 0.00 0.26 -1.39 1.19 -0.73 0.00 0.00 179.01 178.34 2yqi n PHE 24 N -2.87 0.21 -0.20 0.92 3.01 0.20 -4.32 117.46 114.42 2yqi n PHE 24 Ca -0.08 0.06 -0.01 0.00 1.01 0.00 0.00 57.45 58.43 2yqi n PHE 24 Cb 0.81 -0.46 0.09 0.00 -0.01 0.00 0.00 39.48 39.91 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 0.47 -0.71 -1.08 2.43 -0.67 -2.40 114.38 112.43 2yqi h ARG 25 Ca 0.00 -0.03 0.16 0.00 -0.81 0.00 0.00 59.98 59.30 2yqi h ARG 25 Cb 0.83 -0.11 -0.12 0.00 -0.42 0.00 0.00 29.97 30.16 2yqi h ARG 25 CO 0.00 0.31 0.04 -1.35 -1.51 0.00 0.00 179.97 177.47 2yqi h PRO 26 N 0.49 0.14 0.41 0.20 0.11 -1.77 0.18 132.00 131.76 2yqi h PRO 26 Ca 0.29 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.37 2yqi h PRO 26 Cb 0.29 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.37 2yqi h PRO 26 CO -0.25 0.09 -0.20 0.87 -0.21 0.00 0.00 178.00 178.31 2yqi h LYS 27 N 0.14 -0.53 -0.37 1.05 1.57 -1.70 -1.32 116.57 115.41 2yqi h LYS 27 Ca 0.39 0.04 0.07 0.00 -1.87 0.00 0.00 60.65 59.27 2yqi h LYS 27 Cb 0.66 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 33.03 2yqi h LYS 27 CO -0.59 -0.29 -0.01 0.82 -0.57 0.00 0.00 179.45 178.81 2yqi h ILE 28 N -0.68 0.72 0.00 1.86 2.04 -1.13 0.29 117.51 120.60 2yqi h ILE 28 Ca -0.06 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.77 2yqi h ILE 28 Cb 0.49 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2yqi h ILE 28 CO 0.09 0.02 0.00 0.29 0.00 0.00 0.00 178.15 178.55 2yqi n LYS 29 N -5.20 0.03 -0.10 2.37 5.02 0.58 -0.46 118.16 120.40 2yqi n LYS 29 Ca 0.02 0.35 -0.21 0.00 -2.02 0.00 0.00 58.31 56.45 2yqi n LYS 29 Cb 0.19 -1.57 -0.12 0.00 -0.02 0.00 0.00 35.03 33.51 2yqi n LYS 29 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2yqi h SER 30 N 0.00 0.00 0.00 4.39 0.87 0.70 -3.40 113.55 116.11 2yqi h SER 30 Ca 0.00 -0.56 -0.21 0.00 -1.23 0.00 0.00 61.79 59.79 2yqi h SER 30 Cb 0.20 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.17 2yqi h SER 30 CO 0.00 1.44 -0.81 0.00 -0.53 0.00 0.00 176.83 176.93 2yqi h THR 31 N -1.00 1.36 -3.40 2.23 1.03 -0.93 -3.44 112.91 108.75 2yqi h THR 31 Ca -0.31 -2.16 -0.55 0.00 -0.01 0.00 0.00 66.41 63.38 2yqi h THR 31 Cb 1.27 2.51 -0.04 0.00 -1.07 0.00 0.00 68.15 70.82 2yqi h THR 31 CO -0.19 0.65 0.21 0.20 -0.01 0.00 0.00 175.52 176.38 2yqi s ASN 32 N -7.00 7.19 -0.14 0.00 0.01 0.39 -5.01 114.94 110.38 2yqi s ASN 32 Ca -0.12 1.43 -0.29 0.00 -0.71 0.00 0.00 52.86 53.17 2yqi s ASN 32 Cb 0.05 -2.49 -0.04 0.00 0.41 0.00 0.00 41.25 39.19 2yqi s ASN 32 CO 0.87 -0.14 1.56 -2.16 -1.51 0.00 0.00 177.10 175.72 2yqi s PRO 33 N 0.66 4.03 -1.25 -0.60 0.04 -1.26 -3.70 135.00 132.93 2yqi s PRO 33 Ca 0.43 1.87 -0.14 0.00 0.04 0.00 0.00 61.00 63.20 2yqi s PRO 33 Cb -0.20 -3.96 0.14 0.00 0.04 0.00 0.00 34.50 30.52 2yqi s PRO 33 CO 0.23 -1.00 0.35 0.41 0.04 0.00 0.00 177.00 177.03 2yqi n GLY 34 N 4.24 -0.24 3.44 0.56 0.00 -1.26 -4.76 105.19 107.17 2yqi n GLY 34 Ca 0.17 0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.86 2yqi n GLY 34 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2yqi n ILE 35 N -3.00 1.85 -3.22 -0.61 3.06 -1.24 -4.95 119.36 111.26 2yqi n ILE 35 Ca 0.04 -0.50 -0.31 0.00 -2.50 0.00 0.00 62.75 59.48 2yqi n ILE 35 Cb 0.33 -0.57 -0.05 0.00 0.54 0.00 0.00 39.64 39.90 2yqi n ILE 35 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 2yqi s SER 36 N -1.10 6.60 0.37 9.51 0.15 -1.26 -4.94 113.70 123.02 2yqi s SER 36 Ca 0.66 1.01 0.13 0.00 0.70 0.00 0.00 55.95 58.45 2yqi s SER 36 Cb -0.48 -2.26 0.95 0.00 -1.71 0.00 0.00 66.02 62.51 2yqi s SER 36 CO 0.57 -0.20 1.80 0.40 1.20 0.00 0.00 173.24 177.01 2yqi h ILE 37 N 1.67 0.65 -0.78 6.45 2.04 -1.99 0.20 117.51 125.75 2yqi h ILE 37 Ca -0.47 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.19 2yqi h ILE 37 Cb 1.18 0.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 2yqi h ILE 37 CO 0.67 0.10 0.47 1.23 0.00 0.00 0.00 178.15 180.62 2yqi h GLY 38 N 0.55 1.13 0.90 5.37 0.00 -1.99 0.18 103.07 109.21 2yqi h GLY 38 Ca 0.54 -0.46 -0.09 0.00 0.00 0.00 0.00 47.33 47.32 2yqi h GLY 38 CO -0.29 0.45 -0.16 -0.55 0.00 0.00 0.00 176.54 175.99 2yqi h ASP 39 N 1.06 0.62 -0.28 0.19 5.19 -1.37 -2.01 116.42 119.81 2yqi h ASP 39 Ca 0.28 -0.42 -0.03 0.00 -0.62 0.00 0.00 57.03 56.23 2yqi h ASP 39 Cb -0.05 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.28 2yqi h ASP 39 CO -0.05 0.91 0.05 0.58 -3.12 0.00 0.00 179.24 177.61 2yqi h VAL 40 N 0.33 1.23 -0.22 -1.35 2.07 -1.13 -2.01 116.25 115.18 2yqi h VAL 40 Ca 0.06 -0.78 0.01 0.00 0.82 0.00 0.00 66.70 66.81 2yqi h VAL 40 Cb 0.69 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 2yqi h VAL 40 CO 0.05 0.25 0.11 0.00 0.02 0.00 0.00 177.57 178.00 2yqi h ALA 41 N 0.87 0.26 -0.48 1.67 0.00 -0.65 0.26 119.26 121.20 2yqi h ALA 41 Ca 0.09 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.03 2yqi h ALA 41 Cb 0.33 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2yqi h ALA 41 CO 0.00 -0.30 0.26 -0.22 0.00 0.00 0.00 179.25 179.00 2yqi h LYS 42 N 0.23 0.50 0.69 0.00 3.64 -1.31 -2.51 116.57 117.81 2yqi h LYS 42 Ca 0.09 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 2yqi h LYS 42 Cb 0.02 -0.11 0.01 0.00 -0.41 0.00 0.00 32.23 31.73 2yqi h LYS 42 CO -0.06 0.33 -0.33 0.87 -2.27 0.00 0.00 179.45 178.00 2yqi h LYS 43 N 0.52 -0.89 -0.84 1.90 1.57 -1.06 -3.20 116.57 114.58 2yqi h LYS 43 Ca 0.20 0.06 0.15 0.00 -1.87 0.00 0.00 60.65 59.19 2yqi h LYS 43 Cb 0.07 0.20 -0.15 0.00 0.08 0.00 0.00 32.23 32.43 2yqi h LYS 43 CO -0.12 -0.59 -0.27 1.28 -0.57 0.00 0.00 179.45 179.18 2yqi n LEU 44 N -5.39 -0.42 -0.12 2.94 4.77 0.90 0.39 117.00 120.08 2yqi n LEU 44 Ca -0.11 1.45 -0.06 0.00 -0.03 0.00 0.00 56.01 57.26 2yqi n LEU 44 Cb 0.36 -0.38 0.01 0.00 -2.33 0.00 0.00 43.42 41.08 2yqi n LEU 44 CO 0.28 -1.35 0.71 1.23 -1.33 0.00 0.00 177.39 176.93 2yqi h GLY 45 N 0.00 0.04 0.99 -0.72 0.00 -1.47 -0.10 103.07 101.80 2yqi h GLY 45 Ca 0.35 0.28 0.05 0.00 0.00 0.00 0.00 47.33 48.01 2yqi h GLY 45 CO -0.85 -0.20 0.54 0.83 0.00 0.00 0.00 176.54 176.86 2yqi h GLU 46 N -0.15 0.92 0.17 4.80 4.39 -0.06 -2.66 114.58 121.99 2yqi h GLU 46 Ca 0.20 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.85 2yqi h GLU 46 Cb 0.45 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 2yqi h GLU 46 CO -0.50 0.61 -0.26 0.52 -1.16 0.00 0.00 179.01 178.22 2yqi h MET 47 N 0.94 -0.48 -0.66 2.33 2.86 -0.08 -0.88 114.93 118.96 2yqi h MET 47 Ca 0.34 0.03 0.13 0.00 -2.06 0.00 0.00 59.70 58.15 2yqi h MET 47 Cb 0.16 0.11 -0.13 0.00 0.06 0.00 0.00 31.60 31.80 2yqi h MET 47 CO -0.12 -0.32 -0.18 2.35 1.06 0.00 0.00 176.91 179.70 2yqi h TRP 48 N -0.50 -0.40 -0.65 -0.22 2.91 -1.06 0.29 115.95 116.33 2yqi h TRP 48 Ca 0.02 0.06 -0.02 0.00 1.13 0.00 0.00 58.89 60.07 2yqi h TRP 48 Cb 0.50 0.28 -0.03 0.00 -0.51 0.00 0.00 29.16 29.40 2yqi h TRP 48 CO -0.22 -0.30 0.31 -0.97 -1.03 0.00 0.00 178.44 176.23 2yqi h ASN 49 N -0.01 0.82 -0.29 2.65 -0.73 -1.40 -2.13 115.58 114.50 2yqi h ASN 49 Ca 0.31 -0.09 -0.03 0.00 1.87 0.00 0.00 56.30 58.37 2yqi h ASN 49 Cb 0.49 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 38.86 2yqi h ASN 49 CO -0.69 0.70 0.10 0.78 -0.37 0.00 0.00 177.43 177.95 2yqi h ASN 50 N 0.91 0.47 -3.38 1.15 2.35 0.93 -3.44 115.58 114.58 2yqi h ASN 50 Ca 0.22 -0.06 -0.45 0.00 -0.55 0.00 0.00 56.30 55.47 2yqi h ASN 50 Cb 0.10 -0.12 0.21 0.00 0.05 0.00 0.00 38.32 38.56 2yqi h ASN 50 CO -0.03 0.47 0.04 -0.76 -1.65 0.00 0.00 177.43 175.50 2yqi s LEU 51 N -9.22 1.05 0.27 1.61 1.43 -0.37 -5.04 118.68 108.41 2yqi s LEU 51 Ca -0.08 1.58 0.09 0.00 -1.03 0.00 0.00 54.13 54.69 2yqi s LEU 51 Cb 0.16 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.80 2yqi s LEU 51 CO 0.75 -4.09 0.06 0.21 0.23 0.00 0.00 176.35 173.51 2yqi s ASN 52 N -2.55 4.79 0.62 2.29 2.47 -1.26 -4.98 114.94 116.31 2yqi s ASN 52 Ca 0.68 -0.56 0.31 0.00 0.42 0.00 0.00 52.86 53.70 2yqi s ASN 52 Cb -0.25 -0.97 1.68 0.00 -1.45 0.00 0.00 41.25 40.27 2yqi s ASN 52 CO 0.64 -0.04 2.03 0.44 -3.72 0.00 0.00 177.10 176.45 2yqi h ASP 53 N 1.76 0.00 0.86 -4.21 5.19 -1.97 0.26 116.42 118.31 2yqi h ASP 53 Ca -0.45 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 55.75 2yqi h ASP 53 Cb 1.25 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.72 2yqi h ASP 53 CO 0.61 0.00 -1.23 -1.28 -3.12 0.00 0.00 179.24 174.22 2yqi h SER 54 N 0.00 0.00 0.53 6.45 0.87 -2.00 -3.07 113.55 116.33 2yqi h SER 54 Ca 0.09 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.41 2yqi h SER 54 Cb 0.66 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2yqi h SER 54 CO -0.00 0.82 -1.02 -0.33 -0.53 0.00 0.00 176.83 175.77 2yqi h GLU 55 N 0.00 0.29 0.00 2.24 4.39 -0.92 -3.20 114.58 117.37 2yqi h GLU 55 Ca -0.13 -0.36 -0.04 0.00 0.34 0.00 0.00 59.36 59.17 2yqi h GLU 55 Cb 1.74 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 30.50 2yqi h GLU 55 CO 0.08 1.09 -0.20 0.87 -1.16 0.00 0.00 179.01 179.70 2yqi h LYS 56 N 0.14 0.00 -0.66 2.33 1.57 -1.32 -3.34 116.57 115.28 2yqi h LYS 56 Ca -0.08 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.78 2yqi h LYS 56 Cb 1.68 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.89 2yqi h LYS 56 CO 0.17 0.20 -0.51 1.96 -0.57 0.00 0.00 179.45 180.69 2yqi h GLN 57 N 0.00 -0.20 0.00 3.15 1.08 -1.53 0.96 115.11 118.57 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 1.05 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.53 2yqi h GLN 57 CO 0.03 -0.13 0.00 -0.35 -0.95 0.00 0.00 178.83 177.42 2yqi n PRO 58 N -5.36 0.03 -0.01 1.46 -0.04 -1.25 -1.86 135.00 127.96 2yqi n PRO 58 Ca 0.01 0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.76 2yqi n PRO 58 Cb 0.33 -1.56 -0.12 0.00 -0.04 0.00 0.00 33.50 32.10 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 -1.62 0.46 -0.09 0.54 4.01 0.24 -4.02 117.16 116.68 2yqi n TYR 59 Ca 0.03 0.15 -0.15 0.00 -0.16 0.00 0.00 57.90 57.77 2yqi n TYR 59 Cb 0.18 -0.91 -0.09 0.00 -0.31 0.00 0.00 39.34 38.20 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 0.91 -1.00 -0.72 2.04 0.95 -3.35 117.51 116.34 2yqi h ILE 60 Ca -0.22 -1.94 0.23 0.00 1.00 0.00 0.00 64.86 63.92 2yqi h ILE 60 Cb 1.60 1.98 -0.10 0.00 -0.74 0.00 0.00 36.82 39.56 2yqi h ILE 60 CO 0.03 0.31 0.62 0.74 0.00 0.00 0.00 178.15 179.85 2yqi h THR 61 N -1.00 0.61 -0.51 -0.27 2.02 -1.60 0.38 112.91 112.55 2yqi h THR 61 Ca -0.18 -0.20 0.05 0.00 0.77 0.00 0.00 66.41 66.85 2yqi h THR 61 Cb 1.00 -0.01 -0.05 0.00 -1.74 0.00 0.00 68.15 67.35 2yqi h THR 61 CO -0.11 0.11 0.25 0.50 0.37 0.00 0.00 175.52 176.64 2yqi h LYS 62 N 0.58 0.47 -0.42 6.66 3.64 -1.72 -2.40 116.57 123.37 2yqi h LYS 62 Ca 0.59 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.95 2yqi h LYS 62 Cb 1.18 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.87 2yqi h LYS 62 CO -0.35 0.31 0.26 0.00 -2.27 0.00 0.00 179.45 177.40 2yqi h ALA 63 N 1.28 0.53 -0.59 5.00 0.00 -1.05 -1.63 119.26 122.81 2yqi h ALA 63 Ca 0.23 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.29 2yqi h ALA 63 Cb 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2yqi h ALA 63 CO -0.17 -0.04 0.49 0.00 0.00 0.00 0.00 179.25 179.53 2yqi h ALA 64 N 1.17 2.43 0.03 0.00 0.00 -1.10 0.18 119.26 121.97 2yqi h ALA 64 Ca 0.16 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.81 2yqi h ALA 64 Cb -0.03 0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.81 2yqi h ALA 64 CO -0.06 -0.79 -1.02 0.87 0.00 0.00 0.00 179.25 178.25 2yqi h LYS 65 N 0.00 0.42 -0.11 0.00 1.79 -1.08 -3.19 116.57 114.39 2yqi h LYS 65 Ca 0.28 -0.50 -0.05 0.00 -2.18 0.00 0.00 60.65 58.20 2yqi h LYS 65 Cb 1.26 0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 32.05 2yqi h LYS 65 CO -0.00 1.16 -0.18 -0.07 -1.08 0.00 0.00 179.45 179.28 2yqi h LEU 66 N 0.22 0.18 -0.95 2.94 -0.00 -0.44 -2.22 115.31 115.03 2yqi h LEU 66 Ca -0.10 -0.04 -0.11 0.00 -0.00 0.00 0.00 57.88 57.63 2yqi h LEU 66 Cb 1.67 -0.05 -0.02 0.00 -0.00 0.00 0.00 40.66 42.27 2yqi h LEU 66 CO 0.18 0.37 -0.51 0.50 -0.00 0.00 0.00 178.44 178.99 2yqi h LYS 67 N 0.17 0.00 -0.40 1.13 3.64 -1.45 -1.99 116.57 117.67 2yqi h LYS 67 Ca 0.03 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2yqi h LYS 67 Cb 0.42 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.22 2yqi h LYS 67 CO 0.03 0.51 0.07 0.93 -2.27 0.00 0.00 179.45 178.72 2yqi h GLU 68 N 0.00 0.60 0.00 1.90 5.08 -1.39 -1.63 114.58 119.14 2yqi h GLU 68 Ca -0.01 -0.11 -0.13 0.00 -1.00 0.00 0.00 59.36 58.11 2yqi h GLU 68 Cb 0.93 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 2yqi h GLU 68 CO 0.07 0.57 -1.08 -0.22 -1.00 0.00 0.00 179.01 177.35 2yqi h LYS 69 N 0.59 0.00 0.41 2.33 3.11 -1.52 -3.35 116.57 118.14 2yqi h LYS 69 Ca 0.13 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.95 2yqi h LYS 69 Cb 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.50 2yqi h LYS 69 CO 0.00 0.31 -0.19 -0.92 -2.81 0.00 0.00 179.45 175.84 2yqi h TYR 70 N 0.00 -0.50 -0.99 1.91 3.20 -0.92 -2.82 116.97 116.84 2yqi h TYR 70 Ca -0.10 -0.01 0.28 0.00 3.14 0.00 0.00 58.73 62.04 2yqi h TYR 70 Cb 1.45 0.17 -0.14 0.00 1.54 0.00 0.00 36.73 39.75 2yqi h TYR 70 CO 0.00 -0.19 0.55 0.93 -1.64 0.00 0.00 178.16 177.80 2yqi h GLU 71 N -1.01 0.41 0.25 1.82 5.08 -1.48 0.23 114.58 119.88 2yqi h GLU 71 Ca -0.06 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2yqi h GLU 71 Cb 0.54 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2yqi h GLU 71 CO 0.09 0.27 -0.12 0.87 -1.00 0.00 0.00 179.01 179.12 2yqi h LYS 72 N 0.42 -0.33 -0.17 2.33 1.57 -1.68 0.63 116.57 119.35 2yqi h LYS 72 Ca 0.68 0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 59.48 2yqi h LYS 72 Cb 1.42 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.80 2yqi h LYS 72 CO -0.55 -0.16 0.10 0.22 -0.57 0.00 0.00 179.45 178.48 2yqi h ASP 73 N -0.42 0.21 0.33 0.86 1.82 -0.70 -2.78 116.42 115.73 2yqi h ASP 73 Ca -0.03 -0.07 -0.00 0.00 -0.39 0.00 0.00 57.03 56.54 2yqi h ASP 73 Cb 0.32 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 40.26 2yqi h ASP 73 CO 0.06 0.21 -0.30 0.58 -1.61 0.00 0.00 179.24 178.18 2yqi h VAL 74 N 0.18 0.37 -0.62 2.25 2.07 -0.60 -2.35 116.25 117.55 2yqi h VAL 74 Ca 0.06 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.64 2yqi h VAL 74 Cb 0.05 0.37 -0.10 0.00 -1.52 0.00 0.00 31.29 30.10 2yqi h VAL 74 CO -0.01 0.00 -0.57 0.00 0.02 0.00 0.00 177.57 177.01 2yqi h ALA 75 N -0.09 -0.70 -0.99 1.67 0.00 -0.82 0.29 119.26 118.62 2yqi h ALA 75 Ca -0.02 0.04 0.21 0.00 0.00 0.00 0.00 54.91 55.15 2yqi h ALA 75 Cb 0.58 1.22 -0.12 0.00 0.00 0.00 0.00 17.79 19.48 2yqi h ALA 75 CO -0.04 -1.03 0.58 -0.44 0.00 0.00 0.00 179.25 178.33 2yqi h ASP 76 N -0.25 0.70 0.02 0.00 5.19 -1.39 -0.84 116.42 119.85 2yqi h ASP 76 Ca 0.10 0.12 -0.00 0.00 -0.62 0.00 0.00 57.03 56.63 2yqi h ASP 76 Cb 0.53 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.04 2yqi h ASP 76 CO -0.72 0.18 -0.01 0.22 -3.12 0.00 0.00 179.24 175.79 2yqi h TYR 77 N 0.66 -0.02 -0.25 4.55 3.20 0.07 -2.96 116.97 122.21 2yqi h TYR 77 Ca 0.60 -0.00 -0.33 0.00 3.14 0.00 0.00 58.73 62.14 2yqi h TYR 77 Cb 1.04 0.01 -0.08 0.00 1.54 0.00 0.00 36.73 39.24 2yqi h TYR 77 CO -0.02 0.02 0.37 1.63 -1.64 0.00 0.00 178.16 178.53 2yqi n LYS 78 N -5.08 2.38 0.22 1.82 4.76 -0.32 -4.43 118.16 117.50 2yqi n LYS 78 Ca -0.07 -1.50 0.14 0.00 -2.87 0.00 0.00 58.31 54.01 2yqi n LYS 78 Cb 0.06 -2.15 0.45 0.00 -1.84 0.00 0.00 35.03 31.55 2yqi n LYS 78 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2yqi h SER 79 N 3.30 0.00 -0.84 4.39 4.64 -1.53 -3.04 113.55 120.47 2yqi h SER 79 Ca 0.33 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 61.16 2yqi h SER 79 Cb 1.17 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.99 2yqi h SER 79 CO 0.59 0.00 0.45 2.29 -0.87 0.00 0.00 176.83 179.28 2yqi n LYS 80 N -2.89 2.37 0.00 4.77 0.00 -1.26 -5.15 118.16 115.99 2yqi n LYS 80 Ca 0.02 -3.21 0.00 0.00 -0.00 0.00 0.00 58.31 55.13 2yqi n LYS 80 Cb 0.39 -2.14 0.00 0.00 -0.00 0.00 0.00 35.03 33.28 2yqi n LYS 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81