#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqm s SER 2 N 0.00 2.13 -0.52 1.61 0.15 -1.26 -5.11 113.70 110.71 2yqm s SER 2 Ca 0.00 -0.95 0.07 0.00 0.70 0.00 0.00 55.95 55.77 2yqm s SER 2 Cb 0.00 -0.07 0.20 0.00 -1.71 0.00 0.00 66.02 64.43 2yqm s SER 2 CO 0.00 -0.21 0.75 -1.20 1.20 0.00 0.00 173.24 173.77 2yqm n SER 3 N -0.01 -3.39 -3.91 5.45 7.64 -1.26 -5.16 113.62 112.99 2yqm n SER 3 Ca -0.11 -2.96 -0.30 0.00 1.01 0.00 0.00 58.87 56.51 2yqm n SER 3 Cb 0.59 1.75 0.22 0.00 -1.01 0.00 0.00 64.21 65.76 2yqm n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yqm s GLY 4 N 0.57 1.72 0.04 0.23 0.00 -1.26 -5.09 107.32 103.52 2yqm s GLY 4 Ca 0.30 -1.17 0.04 0.00 0.00 0.00 0.00 44.72 43.89 2yqm s GLY 4 CO -0.07 -0.33 -0.13 -1.35 0.00 0.00 0.00 173.10 171.22 2yqm s SER 5 N -4.56 1.49 0.03 1.64 1.04 -1.26 -5.16 113.70 106.92 2yqm s SER 5 Ca 0.74 -0.45 -0.06 0.00 0.48 0.00 0.00 55.95 56.66 2yqm s SER 5 Cb -0.05 -0.08 -0.01 0.00 0.10 0.00 0.00 66.02 65.98 2yqm s SER 5 CO 0.54 0.00 0.10 -0.94 0.98 0.00 0.00 173.24 173.93 2yqm s SER 6 N -1.14 0.14 0.00 7.02 1.04 -1.26 -5.12 113.70 114.37 2yqm s SER 6 Ca 0.00 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 55.99 2yqm s SER 6 Cb -0.08 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.26 2yqm s SER 6 CO 0.01 -0.47 0.00 0.61 0.98 0.00 0.00 173.24 174.37 2yqm n GLY 7 N 0.97 -0.60 2.80 7.32 0.00 -1.26 -5.16 105.19 109.26 2yqm n GLY 7 Ca -0.20 0.74 -0.18 0.00 0.00 0.00 0.00 46.02 46.38 2yqm n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yqm s ILE 8 N 0.00 -0.25 0.45 -0.61 1.01 -1.26 -5.16 121.20 115.38 2yqm s ILE 8 Ca 0.00 0.24 0.07 0.00 0.00 0.00 0.00 60.65 60.96 2yqm s ILE 8 Cb 0.00 -0.37 0.02 0.00 0.01 0.00 0.00 42.46 42.12 2yqm s ILE 8 CO 0.00 0.06 0.61 -0.54 0.00 0.00 0.00 174.94 175.07 2yqm s LYS 9 N 2.28 2.76 0.29 2.79 3.01 -1.26 -5.13 119.74 124.48 2yqm s LYS 9 Ca 0.04 -1.16 0.11 0.00 -1.01 0.00 0.00 55.97 53.95 2yqm s LYS 9 Cb -0.13 -2.71 -0.05 0.00 -1.01 0.00 0.00 37.83 33.93 2yqm s LYS 9 CO -0.07 -0.37 -0.18 -2.00 0.51 0.00 0.00 175.35 173.25 2yqm s GLU 10 N -4.44 1.70 -0.06 1.68 2.12 -1.26 -5.15 118.70 113.30 2yqm s GLU 10 Ca 0.56 -1.80 0.04 0.00 0.36 0.00 0.00 54.97 54.12 2yqm s GLU 10 Cb -0.10 -1.74 -0.02 0.00 0.26 0.00 0.00 34.13 32.53 2yqm s GLU 10 CO 0.34 0.29 -0.16 0.54 -0.54 0.00 0.00 175.26 175.73 2yqm s VAL 11 N -2.54 2.90 -0.29 3.70 0.11 -1.26 -5.11 120.40 117.91 2yqm s VAL 11 Ca 0.30 -0.77 -0.25 0.00 -2.93 0.00 0.00 61.98 58.33 2yqm s VAL 11 Cb -0.03 -2.13 0.15 0.00 -1.53 0.00 0.00 36.38 32.84 2yqm s VAL 11 CO 0.15 0.58 1.22 0.54 -3.33 0.00 0.00 175.10 174.27 2yqm s ASN 12 N -0.55 -0.26 0.26 3.54 4.22 -1.26 -5.19 114.94 115.69 2yqm s ASN 12 Ca 0.08 0.51 -0.02 0.00 -2.14 0.00 0.00 52.86 51.28 2yqm s ASN 12 Cb -0.11 0.53 -0.02 0.00 1.28 0.00 0.00 41.25 42.92 2yqm s ASN 12 CO 0.01 -0.09 0.28 0.00 -2.04 0.00 0.00 177.10 175.27 2yqm s GLN 13 N 0.15 1.48 -0.29 3.55 1.03 -1.26 -5.17 119.66 119.15 2yqm s GLN 13 Ca 0.05 -1.64 -0.18 0.00 0.04 0.00 0.00 55.36 53.63 2yqm s GLN 13 Cb -0.05 0.35 0.17 0.00 0.03 0.00 0.00 33.01 33.50 2yqm s GLN 13 CO -0.11 -0.55 1.11 0.00 -2.54 0.00 0.00 175.29 173.20 2yqm s ALA 14 N -3.83 -2.34 -0.48 2.60 0.00 -1.26 -5.09 121.76 111.36 2yqm s ALA 14 Ca 0.35 2.04 0.08 0.00 0.00 0.00 0.00 51.96 54.43 2yqm s ALA 14 Cb 0.03 -1.76 0.29 0.00 0.00 0.00 0.00 23.12 21.68 2yqm s ALA 14 CO 0.15 -0.30 0.70 1.28 0.00 0.00 0.00 175.76 177.60 2yqm n LEU 15 N 3.11 1.98 -3.76 0.00 4.77 -1.26 -5.07 117.00 116.78 2yqm n LEU 15 Ca -0.17 -5.13 -0.13 0.00 -0.03 0.00 0.00 56.01 50.55 2yqm n LEU 15 Cb 0.57 0.12 -0.09 0.00 -2.33 0.00 0.00 43.42 41.69 2yqm n LEU 15 CO 0.03 2.17 0.03 -1.59 -1.33 0.00 0.00 177.39 176.70 2yqm s LYS 16 N -2.21 0.61 -0.07 3.23 0.00 -1.26 -5.16 119.74 114.88 2yqm s LYS 16 Ca 0.40 -0.02 -0.03 0.00 0.00 0.00 0.00 55.97 56.32 2yqm s LYS 16 Cb 0.23 0.27 0.04 0.00 0.00 0.00 0.00 37.83 38.37 2yqm s LYS 16 CO -0.08 -0.15 0.15 0.20 0.00 0.00 0.00 175.35 175.46 2yqm s GLY 17 N -0.95 0.00 0.52 0.59 0.00 -1.26 -5.16 107.32 101.06 2yqm s GLY 17 Ca -0.10 0.63 -0.09 0.00 0.00 0.00 0.00 44.72 45.16 2yqm s GLY 17 CO 0.03 1.23 0.35 -2.39 0.00 0.00 0.00 173.10 172.32 2yqm n HIS 18 N 4.60 -2.90 -3.99 1.90 1.44 -1.26 -5.01 115.22 110.00 2yqm n HIS 18 Ca -0.19 -0.33 -0.35 0.00 -2.01 0.00 0.00 57.72 54.85 2yqm n HIS 18 Cb 0.51 -0.45 -0.14 0.00 0.12 0.00 0.00 29.99 30.02 2yqm n HIS 18 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2yqm s ALA 19 N -2.37 2.71 -0.19 1.59 0.00 -1.26 -4.97 121.76 117.27 2yqm s ALA 19 Ca 0.25 -1.16 0.16 0.00 0.00 0.00 0.00 51.96 51.21 2yqm s ALA 19 Cb -0.04 -1.58 0.50 0.00 0.00 0.00 0.00 23.12 22.00 2yqm s ALA 19 CO 0.21 -0.38 1.40 -2.67 0.00 0.00 0.00 175.76 174.31 2yqm n TRP 20 N 4.70 0.86 -1.26 0.00 4.27 -1.26 -4.59 117.44 120.15 2yqm n TRP 20 Ca -0.19 -0.98 -0.24 0.00 -3.89 0.00 0.00 57.50 52.20 2yqm n TRP 20 Cb 0.51 -0.32 0.17 0.00 -1.36 0.00 0.00 31.31 30.31 2yqm n TRP 20 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 2yqm n LEU 21 N -0.70 6.69 -3.47 5.67 4.77 -1.26 -4.81 117.00 123.89 2yqm n LEU 21 Ca 0.22 -3.72 -0.19 0.00 -0.03 0.00 0.00 56.01 52.29 2yqm n LEU 21 Cb 0.88 -0.84 -0.12 0.00 -2.33 0.00 0.00 43.42 41.01 2yqm n LEU 21 CO 0.14 1.13 -0.21 -0.54 -1.33 0.00 0.00 177.39 176.58 2yqm s LYS 22 N -3.37 0.23 -0.10 3.23 1.02 -1.26 -4.99 119.74 114.50 2yqm s LYS 22 Ca 0.57 0.02 0.15 0.00 0.02 0.00 0.00 55.97 56.73 2yqm s LYS 22 Cb 0.48 -1.04 0.34 0.00 -0.52 0.00 0.00 37.83 37.08 2yqm s LYS 22 CO 0.09 -0.81 1.16 -3.47 -0.92 0.00 0.00 175.35 171.40 2yqm n ASP 23 N 5.31 1.36 -0.03 2.83 2.03 -1.26 -4.52 116.55 122.26 2yqm n ASP 23 Ca -0.05 -2.91 -0.04 0.00 0.52 0.00 0.00 54.79 52.32 2yqm n ASP 23 Cb 0.48 -0.39 -0.03 0.00 -0.72 0.00 0.00 41.12 40.46 2yqm n ASP 23 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2yqm n ASP 24 N -0.52 2.98 0.01 1.67 8.00 -1.26 -4.73 116.55 122.70 2yqm n ASP 24 Ca 0.12 -0.01 -0.02 0.00 0.71 0.00 0.00 54.79 55.58 2yqm n ASP 24 Cb 0.82 -0.11 -0.10 0.00 -0.02 0.00 0.00 41.12 41.71 2yqm n ASP 24 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2yqm n GLU 25 N -2.78 0.63 -2.82 -1.24 -0.58 -1.26 -5.04 120.64 107.55 2yqm n GLU 25 Ca -0.11 0.22 -0.07 0.00 -0.42 0.00 0.00 57.16 56.78 2yqm n GLU 25 Cb 0.60 -1.78 0.01 0.00 -0.57 0.00 0.00 31.44 29.70 2yqm n GLU 25 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2yqm n ALA 26 N -2.44 -3.00 0.08 0.62 0.00 -1.26 -4.95 120.51 109.55 2yqm n ALA 26 Ca -0.12 1.11 0.02 0.00 0.00 0.00 0.00 53.44 54.44 2yqm n ALA 26 Cb 0.89 -3.62 -0.04 0.00 0.00 0.00 0.00 19.45 16.69 2yqm n ALA 26 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2yqm h THR 27 N 1.88 0.62 -3.95 0.00 2.02 -1.96 -3.47 112.91 108.05 2yqm h THR 27 Ca 0.00 -2.03 -0.24 0.00 0.77 0.00 0.00 66.41 64.91 2yqm h THR 27 Cb 0.97 2.16 -0.19 0.00 -1.74 0.00 0.00 68.15 69.35 2yqm h THR 27 CO 0.20 0.35 -0.72 -1.00 0.37 0.00 0.00 175.52 174.72 2yqm s HIS 28 N -2.96 0.67 0.92 3.16 3.76 -1.26 -3.56 115.29 116.01 2yqm s HIS 28 Ca -0.00 -0.64 -0.12 0.00 -0.15 0.00 0.00 55.06 54.14 2yqm s HIS 28 Cb 0.08 -0.40 0.06 0.00 1.11 0.00 0.00 32.58 33.43 2yqm s HIS 28 CO 0.79 -0.13 0.62 0.00 -0.85 0.00 0.00 174.74 175.16 2yqm n ARG 30 N -2.29 2.57 0.10 0.00 3.00 -1.24 -3.83 116.66 114.97 2yqm n ARG 30 Ca 0.08 -3.06 0.00 0.00 -0.00 0.00 0.00 57.85 54.87 2yqm n ARG 30 Cb 0.53 -1.97 0.00 0.00 0.00 0.00 0.00 32.46 31.02 2yqm n ARG 30 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2yqm n GLN 31 N -0.78 0.00 0.07 -0.14 7.27 -1.26 -4.92 117.38 117.62 2yqm n GLN 31 Ca 0.37 0.00 0.06 0.00 0.07 0.00 0.00 57.00 57.49 2yqm n GLN 31 Cb 1.19 0.00 -0.04 0.00 2.41 0.00 0.00 30.24 33.79 2yqm n GLN 31 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2yqm n GLU 33 N -2.77 -1.81 -4.49 0.00 -0.58 -1.25 -5.01 120.64 104.73 2yqm n GLU 33 Ca -0.05 1.11 -0.23 0.00 -0.42 0.00 0.00 57.16 57.58 2yqm n GLU 33 Cb 0.69 -5.68 -0.16 0.00 -0.57 0.00 0.00 31.44 25.72 2yqm n GLU 33 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2yqm s LYS 34 N -3.89 1.39 -0.16 3.49 1.02 -1.26 -4.88 119.74 115.45 2yqm s LYS 34 Ca 0.26 -0.35 -0.37 0.00 0.02 0.00 0.00 55.97 55.54 2yqm s LYS 34 Cb -0.04 -1.20 -0.13 0.00 -0.52 0.00 0.00 37.83 35.94 2yqm s LYS 34 CO 0.75 0.05 1.82 -1.91 -0.92 0.00 0.00 175.35 175.14 2yqm n GLU 35 N 3.68 1.76 -1.87 1.68 2.13 -1.26 -3.58 120.64 123.17 2yqm n GLU 35 Ca -0.22 0.64 -0.42 0.00 0.66 0.00 0.00 57.16 57.82 2yqm n GLU 35 Cb 0.52 -2.42 -0.03 0.00 0.27 0.00 0.00 31.44 29.78 2yqm n GLU 35 CO 0.00 0.00 0.00 -0.06 -0.41 0.00 0.00 177.13 176.66 2yqm s PHE 36 N 3.79 3.00 0.32 4.31 0.08 -1.23 -5.01 117.98 123.25 2yqm s PHE 36 Ca 0.95 0.57 0.07 0.00 0.12 0.00 0.00 56.93 58.64 2yqm s PHE 36 Cb -0.85 -3.99 -0.06 0.00 -0.57 0.00 0.00 43.02 37.55 2yqm s PHE 36 CO 0.57 -3.64 -0.04 0.45 -0.10 0.00 0.00 175.22 172.46 2yqm s SER 37 N 1.09 3.13 0.21 1.36 0.15 -1.23 -4.99 113.70 113.42 2yqm s SER 37 Ca 0.71 -1.25 -0.09 0.00 0.70 0.00 0.00 55.95 56.01 2yqm s SER 37 Cb -0.45 -0.24 0.30 0.00 -1.71 0.00 0.00 66.02 63.92 2yqm s SER 37 CO 0.33 -0.36 1.71 0.40 1.20 0.00 0.00 173.24 176.52 2yqm h ILE 38 N 2.11 0.66 0.00 6.45 5.03 -1.98 0.55 117.51 130.32 2yqm h ILE 38 Ca -0.41 -0.10 -0.09 0.00 -0.12 0.00 0.00 64.86 64.14 2yqm h ILE 38 Cb 1.24 0.34 -0.01 0.00 -3.03 0.00 0.00 36.82 35.36 2yqm h ILE 38 CO 0.71 0.05 -0.42 0.77 -0.68 0.00 0.00 178.15 178.57 2yqm h SER 39 N 0.29 0.00 -2.07 1.72 4.64 -2.01 -3.26 113.55 112.87 2yqm h SER 39 Ca 0.32 0.00 -0.72 0.00 -0.47 0.00 0.00 61.79 60.92 2yqm h SER 39 Cb 0.47 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 62.23 2yqm h SER 39 CO -0.39 0.42 0.45 -1.14 -0.87 0.00 0.00 176.83 175.31 2yqm n ARG 40 N -3.53 3.93 -0.66 4.77 0.63 0.14 -5.04 116.66 116.89 2yqm n ARG 40 Ca -0.00 -4.35 -0.32 0.00 -0.92 0.00 0.00 57.85 52.26 2yqm n ARG 40 Cb 0.55 -2.33 0.18 0.00 0.45 0.00 0.00 32.46 31.30 2yqm n ARG 40 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2yqm n ARG 41 N -0.30 -1.60 -3.98 -0.14 5.12 -0.92 -3.50 116.66 111.34 2yqm n ARG 41 Ca 0.45 -0.45 -0.29 0.00 -1.93 0.00 0.00 57.85 55.63 2yqm n ARG 41 Cb 0.34 -1.76 -0.05 0.00 -1.16 0.00 0.00 32.46 29.84 2yqm n ARG 41 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 2yqm s LYS 42 N -3.55 3.22 -0.07 5.56 -2.85 -1.26 -4.11 119.74 116.68 2yqm s LYS 42 Ca 0.57 -0.61 0.01 0.00 -1.00 0.00 0.00 55.97 54.95 2yqm s LYS 42 Cb -0.14 -2.88 0.02 0.00 -2.06 0.00 0.00 37.83 32.77 2yqm s LYS 42 CO 0.66 0.56 -0.08 -1.01 0.10 0.00 0.00 175.35 175.57 2yqm s HIS 43 N -1.58 1.22 -0.28 1.78 3.76 0.74 -5.00 115.29 115.93 2yqm s HIS 43 Ca 0.33 -0.47 -0.23 0.00 -0.15 0.00 0.00 55.06 54.54 2yqm s HIS 43 Cb -0.12 -0.97 -0.00 0.00 1.11 0.00 0.00 32.58 32.59 2yqm s HIS 43 CO 0.26 -0.30 0.78 -1.58 -0.85 0.00 0.00 174.74 173.05 2yqm s HIS 44 N 1.02 3.25 0.52 1.40 2.46 -1.26 -2.58 115.29 120.10 2yqm s HIS 44 Ca -0.09 0.92 -0.22 0.00 0.47 0.00 0.00 55.06 56.14 2yqm s HIS 44 Cb -0.15 -3.11 -0.06 0.00 -0.13 0.00 0.00 32.58 29.13 2yqm s HIS 44 CO -0.00 -0.48 1.26 0.00 -2.47 0.00 0.00 174.74 173.05 2yqm n ARG 46 N -0.75 4.77 0.00 0.00 3.00 -1.26 -3.69 116.66 118.73 2yqm n ARG 46 Ca 0.10 -3.14 0.00 0.00 -0.01 0.00 0.00 57.85 54.80 2yqm n ARG 46 Cb 0.44 -2.22 0.00 0.00 0.00 0.00 0.00 32.46 30.67 2yqm n ARG 46 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2yqm n ASN 47 N 0.71 0.00 0.14 0.55 5.15 -1.26 -4.89 115.26 115.66 2yqm n ASN 47 Ca 0.28 0.00 0.01 0.00 -0.60 0.00 0.00 54.58 54.27 2yqm n ASN 47 Cb 1.16 0.00 0.13 0.00 -0.53 0.00 0.00 39.78 40.55 2yqm n ASN 47 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2yqm n GLY 49 N 0.71 0.30 3.41 0.00 0.00 -1.24 -5.05 105.19 103.31 2yqm n GLY 49 Ca 0.00 -0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 2yqm n GLY 49 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2yqm s HIS 50 N -3.11 1.84 -0.33 1.61 3.76 -1.26 -4.90 115.29 112.90 2yqm s HIS 50 Ca 0.11 -0.87 -0.16 0.00 -0.15 0.00 0.00 55.06 53.99 2yqm s HIS 50 Cb -0.01 -1.12 -0.01 0.00 1.11 0.00 0.00 32.58 32.54 2yqm s HIS 50 CO 0.21 0.07 0.40 0.42 -0.85 0.00 0.00 174.74 174.99 2yqm s ILE 51 N -3.25 5.13 0.08 0.60 -1.09 -1.26 -2.24 121.20 119.17 2yqm s ILE 51 Ca 0.32 0.19 0.01 0.00 -2.23 0.00 0.00 60.65 58.94 2yqm s ILE 51 Cb 0.06 -3.84 -0.04 0.00 -1.58 0.00 0.00 42.46 37.07 2yqm s ILE 51 CO 0.12 -0.09 -0.05 -0.36 -1.23 0.00 0.00 174.94 173.33 2yqm s PHE 52 N 2.11 0.75 0.64 3.97 0.08 -1.07 -3.71 117.98 120.76 2yqm s PHE 52 Ca 0.14 -0.95 0.05 0.00 0.12 0.00 0.00 56.93 56.29 2yqm s PHE 52 Cb -0.16 -0.47 0.11 0.00 -0.57 0.00 0.00 43.02 41.93 2yqm s PHE 52 CO 0.12 -0.23 0.88 0.00 -0.10 0.00 0.00 175.22 175.90 2yqm h ASN 54 N -0.14 -0.04 0.01 0.00 -0.73 -1.88 0.48 115.58 113.28 2yqm h ASN 54 Ca -0.32 0.08 -0.00 0.00 1.87 0.00 0.00 56.30 57.93 2yqm h ASN 54 Cb 1.28 0.12 -0.00 0.00 0.27 0.00 0.00 38.32 39.99 2yqm h ASN 54 CO 0.40 0.01 -0.00 0.74 -0.37 0.00 0.00 177.43 178.21 2yqm h THR 55 N 0.19 0.81 -0.67 -3.57 2.02 -1.95 -0.50 112.91 109.24 2yqm h THR 55 Ca 0.21 -0.01 -0.35 0.00 0.77 0.00 0.00 66.41 67.03 2yqm h THR 55 Cb 0.28 1.01 -0.21 0.00 -1.74 0.00 0.00 68.15 67.49 2yqm h THR 55 CO -0.30 0.00 0.28 0.00 0.37 0.00 0.00 175.52 175.88 2yqm n SER 57 N -1.14 -0.44 -2.38 0.00 3.41 -0.41 -3.57 113.62 109.08 2yqm n SER 57 Ca 0.47 -1.33 -0.30 0.00 -0.26 0.00 0.00 58.87 57.45 2yqm n SER 57 Cb 1.35 0.20 0.03 0.00 -0.26 0.00 0.00 64.21 65.54 2yqm n SER 57 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2yqm n SER 58 N -0.45 7.13 -4.01 4.04 2.88 -0.33 -4.59 113.62 118.28 2yqm n SER 58 Ca -0.06 -3.51 -0.10 0.00 -1.33 0.00 0.00 58.87 53.88 2yqm n SER 58 Cb 0.60 -1.07 -0.07 0.00 -0.75 0.00 0.00 64.21 62.93 2yqm n SER 58 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 2yqm s ASN 59 N -0.74 -0.00 0.11 -3.46 0.01 -1.26 -5.09 114.94 104.51 2yqm s ASN 59 Ca 0.53 -0.97 0.00 0.00 -0.71 0.00 0.00 52.86 51.71 2yqm s ASN 59 Cb 0.40 0.49 -0.04 0.00 0.41 0.00 0.00 41.25 42.51 2yqm s ASN 59 CO -0.14 -0.99 -0.01 -1.61 -1.51 0.00 0.00 177.10 172.85 2yqm s GLU 60 N -4.02 0.87 -0.28 -0.60 2.02 -1.26 -1.98 118.70 113.45 2yqm s GLU 60 Ca 0.23 -1.39 -0.19 0.00 0.02 0.00 0.00 54.97 53.64 2yqm s GLU 60 Cb 0.02 0.00 0.09 0.00 0.10 0.00 0.00 34.13 34.34 2yqm s GLU 60 CO 0.05 -0.13 0.77 -1.17 0.02 0.00 0.00 175.26 174.80 2yqm s LEU 61 N -3.05 -0.79 -0.62 1.80 2.96 -1.06 -4.92 118.68 113.00 2yqm s LEU 61 Ca 0.17 1.34 -0.28 0.00 -0.22 0.00 0.00 54.13 55.14 2yqm s LEU 61 Cb 0.07 2.27 0.02 0.00 0.50 0.00 0.00 46.19 49.05 2yqm s LEU 61 CO -0.02 -0.22 1.32 0.00 -1.32 0.00 0.00 176.35 176.12 2yqm s ALA 62 N 1.13 2.82 0.37 5.97 0.00 -1.26 -3.26 121.76 127.54 2yqm s ALA 62 Ca -0.06 -0.92 -0.02 0.00 0.00 0.00 0.00 51.96 50.96 2yqm s ALA 62 Cb -0.05 -4.14 -0.04 0.00 0.00 0.00 0.00 23.12 18.90 2yqm s ALA 62 CO -0.12 -2.99 0.61 -0.51 0.00 0.00 0.00 175.76 172.75 2yqm s LEU 63 N 5.74 3.92 0.35 0.00 1.43 -1.26 -4.95 118.68 123.90 2yqm s LEU 63 Ca 0.45 0.62 0.27 0.00 -1.03 0.00 0.00 54.13 54.44 2yqm s LEU 63 Cb -0.09 -3.50 1.12 0.00 0.03 0.00 0.00 46.19 43.75 2yqm s LEU 63 CO 0.22 -0.36 1.80 1.55 0.23 0.00 0.00 176.35 179.80 2yqm h PRO 64 N 0.76 0.00 0.02 1.29 0.13 -1.98 -3.17 132.00 129.05 2yqm h PRO 64 Ca -0.49 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2yqm h PRO 64 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2yqm h PRO 64 CO 0.62 0.00 -0.01 0.77 -0.23 0.00 0.00 178.00 179.15 2yqm h SER 65 N 0.00 -0.03 -2.74 1.44 0.02 -1.98 -3.46 113.55 106.81 2yqm h SER 65 Ca 0.00 -0.72 -0.55 0.00 -0.84 0.00 0.00 61.79 59.68 2yqm h SER 65 Cb 0.40 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 2yqm h SER 65 CO 0.00 0.76 -0.41 -0.31 -1.14 0.00 0.00 176.83 175.74 2yqm s TYR 66 N -2.74 3.49 0.12 3.45 2.02 -1.20 -5.03 117.35 117.47 2yqm s TYR 66 Ca -0.16 0.24 -0.13 0.00 -0.37 0.00 0.00 57.07 56.66 2yqm s TYR 66 Cb -0.01 -1.77 -0.06 0.00 -0.40 0.00 0.00 41.96 39.71 2yqm s TYR 66 CO 0.60 0.46 1.45 -1.00 -1.57 0.00 0.00 175.55 175.49 2yqm h PRO 67 N 2.19 0.84 -6.29 -1.71 0.13 -1.89 -3.39 132.00 121.87 2yqm h PRO 67 Ca -0.48 -0.44 -0.58 0.00 -0.87 0.00 0.00 66.00 63.63 2yqm h PRO 67 Cb 1.19 0.02 -0.11 0.00 0.13 0.00 0.00 31.00 32.22 2yqm h PRO 67 CO 0.69 1.08 -0.67 -1.59 -0.23 0.00 0.00 178.00 177.28 2yqm s LYS 68 N -4.38 2.21 -0.06 0.86 -2.85 -1.26 -4.94 119.74 109.32 2yqm s LYS 68 Ca -0.12 -1.35 -0.30 0.00 -1.00 0.00 0.00 55.97 53.20 2yqm s LYS 68 Cb 0.10 -2.17 -0.05 0.00 -2.06 0.00 0.00 37.83 33.66 2yqm s LYS 68 CO 0.86 0.39 1.50 -1.25 0.10 0.00 0.00 175.35 176.95 2yqm s PRO 69 N -3.34 4.22 0.59 1.78 0.04 -1.26 -4.62 135.00 132.41 2yqm s PRO 69 Ca 0.29 2.01 0.10 0.00 0.04 0.00 0.00 61.00 63.44 2yqm s PRO 69 Cb -0.07 -3.82 0.10 0.00 0.04 0.00 0.00 34.50 30.75 2yqm s PRO 69 CO 0.18 -0.74 0.82 1.33 0.04 0.00 0.00 177.00 178.62 2yqm n VAL 70 N 5.22 0.00 -2.83 -0.36 0.24 -1.20 -4.67 118.33 114.73 2yqm n VAL 70 Ca 0.15 -1.95 -0.42 0.00 -2.04 0.00 0.00 64.34 60.08 2yqm n VAL 70 Cb 0.43 -0.52 -0.04 0.00 -1.47 0.00 0.00 33.84 32.25 2yqm n VAL 70 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2yqm s ARG 71 N -4.67 4.16 0.51 7.34 3.52 -1.26 -2.56 118.95 125.98 2yqm s ARG 71 Ca 0.62 0.99 0.02 0.00 -0.13 0.00 0.00 55.73 57.22 2yqm s ARG 71 Cb -0.05 -3.66 0.02 0.00 -1.56 0.00 0.00 34.95 29.69 2yqm s ARG 71 CO 0.39 -0.60 0.13 1.33 -0.81 0.00 0.00 175.30 175.75 2yqm n VAL 72 N 5.36 0.00 -3.85 7.11 0.24 -0.84 -4.27 118.33 122.08 2yqm n VAL 72 Ca 0.07 -2.27 -0.24 0.00 -2.04 0.00 0.00 64.34 59.86 2yqm n VAL 72 Cb 0.47 0.30 -0.02 0.00 -1.47 0.00 0.00 33.84 33.12 2yqm n VAL 72 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2yqm h ASP 74 N 1.62 0.00 0.44 0.00 3.58 -1.93 0.25 116.42 120.37 2yqm h ASP 74 Ca -0.50 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 56.91 2yqm h ASP 74 Cb 1.21 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.25 2yqm h ASP 74 CO 0.65 0.00 -0.22 -1.28 -2.88 0.00 0.00 179.24 175.51 2yqm h SER 75 N 0.00 0.00 0.00 2.28 0.87 -1.94 -2.08 113.55 112.68 2yqm h SER 75 Ca 0.12 0.00 -0.44 0.00 -1.23 0.00 0.00 61.79 60.24 2yqm h SER 75 Cb 0.55 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.44 2yqm h SER 75 CO -0.00 0.22 -2.44 0.00 -0.53 0.00 0.00 176.83 174.08 2yqm h HIS 77 N -0.82 -0.81 -0.16 0.00 6.17 -0.69 0.21 115.15 119.04 2yqm h HIS 77 Ca -0.66 0.03 -0.02 0.00 0.71 0.00 0.00 60.37 60.44 2yqm h HIS 77 Cb 1.65 0.37 -0.01 0.00 2.52 0.00 0.00 27.41 31.94 2yqm h HIS 77 CO -0.05 -0.38 0.03 1.15 0.71 0.00 0.00 177.93 179.38 2yqm h THR 78 N -0.40 1.21 0.29 6.26 2.02 -1.60 -1.08 112.91 119.62 2yqm h THR 78 Ca 0.08 -0.69 0.00 0.00 0.77 0.00 0.00 66.41 66.58 2yqm h THR 78 Cb 0.53 1.36 -0.04 0.00 -1.74 0.00 0.00 68.15 68.26 2yqm h THR 78 CO -0.31 0.21 -0.51 0.25 0.37 0.00 0.00 175.52 175.53 2yqm h LEU 79 N 0.06 -1.47 -0.39 2.58 5.85 -1.54 0.07 115.31 120.46 2yqm h LEU 79 Ca 0.05 0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.96 2yqm h LEU 79 Cb 0.29 0.52 -0.05 0.00 0.37 0.00 0.00 40.66 41.79 2yqm h LEU 79 CO 0.00 -0.59 0.10 -0.07 -0.34 0.00 0.00 178.44 177.54 2yqm h LEU 80 N -0.85 0.06 -2.02 2.25 3.38 -0.63 -0.05 115.31 117.45 2yqm h LEU 80 Ca -0.03 0.06 0.13 0.00 0.09 0.00 0.00 57.88 58.12 2yqm h LEU 80 Cb 0.79 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.59 2yqm h LEU 80 CO -0.18 0.07 0.33 -0.07 0.09 0.00 0.00 178.44 178.68 2yqm h LEU 81 N 0.24 0.00 0.00 1.67 3.38 -0.82 0.70 115.31 120.47 2yqm h LEU 81 Ca 0.19 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.93 2yqm h LEU 81 Cb 0.20 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2yqm h LEU 81 CO -0.22 0.00 -1.18 1.56 0.09 0.00 0.00 178.44 178.69 2yqm h GLN 82 N 0.00 0.00 -5.97 1.13 4.20 0.77 -3.44 115.11 111.79 2yqm h GLN 82 Ca 0.21 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.35 2yqm h GLN 82 Cb 0.87 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.65 2yqm h GLN 82 CO -0.00 0.86 1.49 0.50 -0.67 0.00 0.00 178.83 181.00 2yqm s ARG 83 N -2.69 3.00 0.40 1.46 3.52 0.24 -4.96 118.95 119.93 2yqm s ARG 83 Ca -0.00 1.85 -0.06 0.00 -0.13 0.00 0.00 55.73 57.38 2yqm s ARG 83 Cb 0.09 -4.38 -0.05 0.00 -1.56 0.00 0.00 34.95 29.05 2yqm s ARG 83 CO 0.82 -2.25 0.71 0.00 -0.81 0.00 0.00 175.30 173.77 2yqm s SER 85 N -3.57 5.03 0.06 0.00 1.04 -1.26 -5.04 113.70 109.96 2yqm s SER 85 Ca 0.47 -0.91 -0.22 0.00 0.48 0.00 0.00 55.95 55.77 2yqm s SER 85 Cb -0.10 0.30 -0.14 0.00 0.10 0.00 0.00 66.02 66.18 2yqm s SER 85 CO 0.36 -1.29 1.56 0.28 0.98 0.00 0.00 173.24 175.13 2yqm h SER 86 N 0.29 0.13 -2.90 7.02 0.02 -2.06 -3.49 113.55 112.56 2yqm h SER 86 Ca -0.31 -0.21 0.35 0.00 -0.84 0.00 0.00 61.79 60.78 2yqm h SER 86 Cb 1.29 -0.03 -0.09 0.00 0.14 0.00 0.00 62.40 63.71 2yqm h SER 86 CO 0.44 0.31 -0.46 0.41 -1.14 0.00 0.00 176.83 176.39 2yqm n THR 87 N -4.90 0.00 -4.35 -2.27 -1.04 -1.26 -4.85 114.28 95.61 2yqm n THR 87 Ca -0.06 0.00 -0.32 0.00 -2.04 0.00 0.00 64.05 61.63 2yqm n THR 87 Cb 0.14 -0.43 -0.09 0.00 -1.82 0.00 0.00 70.33 68.12 2yqm n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yqm s ALA 88 N -2.14 3.17 0.00 2.41 0.00 -1.26 -5.33 121.76 118.61 2yqm s ALA 88 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 50.98 2yqm s ALA 88 Cb 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 23.12 21.87 2yqm s ALA 88 CO 0.00 0.63 0.18 0.45 0.00 0.00 0.00 175.76 177.02