#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 5.03 0.11 1.61 0.01 -1.26 -5.09 113.70 114.11 2yqm s SER 2 Ca 0.00 0.63 -0.25 0.00 1.31 0.00 0.00 55.95 57.64 2yqm s SER 2 Cb 0.00 -1.36 0.08 0.00 0.21 0.00 0.00 66.02 64.96 2yqm s SER 2 CO 0.00 -1.48 1.12 -0.55 0.41 0.00 0.00 173.24 172.74 2yqm s SER 3 N -4.46 -0.01 0.00 2.44 0.15 -1.26 -5.16 113.70 105.41 2yqm s SER 3 Ca 0.59 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.75 2yqm s SER 3 Cb -0.11 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.58 2yqm s SER 3 CO 0.46 -0.74 0.00 0.61 1.20 0.00 0.00 173.24 174.77 2yqm n GLY 4 N -0.73 -0.34 2.75 9.45 0.00 -1.26 -5.10 105.19 109.97 2yqm n GLY 4 Ca -0.02 0.57 -0.09 0.00 0.00 0.00 0.00 46.02 46.48 2yqm n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yqm s SER 5 N 2.00 -0.65 -0.13 1.61 1.04 -1.26 -5.14 113.70 111.18 2yqm s SER 5 Ca 0.00 -1.85 -0.18 0.00 0.48 0.00 0.00 55.95 54.40 2yqm s SER 5 Cb 0.00 1.32 0.05 0.00 0.10 0.00 0.00 66.02 67.49 2yqm s SER 5 CO 0.00 -0.11 0.47 -0.94 0.98 0.00 0.00 173.24 173.64 2yqm s SER 6 N 0.90 -0.46 -0.24 7.02 1.04 -1.26 -5.14 113.70 115.56 2yqm s SER 6 Ca 0.27 0.76 -0.03 0.00 0.48 0.00 0.00 55.95 57.43 2yqm s SER 6 Cb -0.01 0.79 0.12 0.00 0.10 0.00 0.00 66.02 67.01 2yqm s SER 6 CO -0.08 -0.29 0.28 -0.83 0.98 0.00 0.00 173.24 173.30 2yqm s GLY 7 N -0.27 -0.14 -0.29 7.32 0.00 -1.26 -5.12 107.32 107.56 2yqm s GLY 7 Ca -0.04 0.22 -0.01 0.00 0.00 0.00 0.00 44.72 44.88 2yqm s GLY 7 CO 0.03 2.43 -0.02 -0.42 0.00 0.00 0.00 173.10 175.11 2yqm s ILE 8 N 2.39 2.89 -1.22 0.90 1.01 -1.26 -5.01 121.20 120.89 2yqm s ILE 8 Ca 0.09 -1.39 -0.05 0.00 0.00 0.00 0.00 60.65 59.30 2yqm s ILE 8 Cb -0.15 -2.65 0.13 0.00 0.01 0.00 0.00 42.46 39.80 2yqm s ILE 8 CO -0.20 -0.08 2.37 1.17 0.00 0.00 0.00 174.94 178.20 2yqm n LYS 9 N 4.60 4.49 -1.25 2.79 3.00 -1.26 -4.98 118.16 125.55 2yqm n LYS 9 Ca -0.13 -3.48 0.17 0.00 -0.00 0.00 0.00 58.31 54.87 2yqm n LYS 9 Cb 0.43 -2.58 -0.04 0.00 0.00 0.00 0.00 35.03 32.85 2yqm n LYS 9 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2yqm n GLU 10 N 1.48 -2.51 -3.78 1.64 2.13 -1.26 -4.96 120.64 113.38 2yqm n GLU 10 Ca 0.60 1.66 -0.13 0.00 0.66 0.00 0.00 57.16 59.95 2yqm n GLU 10 Cb 0.27 -3.06 -0.10 0.00 0.27 0.00 0.00 31.44 28.81 2yqm n GLU 10 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2yqm s VAL 11 N -2.02 0.03 -0.08 6.31 0.11 -1.26 -5.16 120.40 118.32 2yqm s VAL 11 Ca 0.00 -0.21 -0.09 0.00 -2.93 0.00 0.00 61.98 58.75 2yqm s VAL 11 Cb 0.00 -0.48 -0.05 0.00 -1.53 0.00 0.00 36.38 34.33 2yqm s VAL 11 CO 0.00 -0.11 0.22 0.21 -3.33 0.00 0.00 175.10 172.09 2yqm s ASN 12 N -0.43 6.52 0.28 3.54 3.84 -1.26 -5.08 114.94 122.35 2yqm s ASN 12 Ca -0.05 0.63 -0.28 0.00 0.21 0.00 0.00 52.86 53.36 2yqm s ASN 12 Cb -0.04 -2.13 -0.09 0.00 -0.55 0.00 0.00 41.25 38.44 2yqm s ASN 12 CO 0.02 0.38 0.96 -1.10 -2.79 0.00 0.00 177.10 174.57 2yqm s GLN 13 N -1.04 4.71 -0.32 0.43 1.11 -1.26 -5.04 119.66 118.25 2yqm s GLN 13 Ca 0.18 1.46 -0.10 0.00 0.01 0.00 0.00 55.36 56.90 2yqm s GLN 13 Cb -0.13 -3.06 -0.00 0.00 -1.01 0.00 0.00 33.01 28.81 2yqm s GLN 13 CO 0.07 0.37 0.17 0.00 0.01 0.00 0.00 175.29 175.91 2yqm s ALA 14 N -1.37 3.29 -0.29 6.09 0.00 -1.26 -5.04 121.76 123.18 2yqm s ALA 14 Ca 0.46 -1.45 -0.16 0.00 0.00 0.00 0.00 51.96 50.80 2yqm s ALA 14 Cb -0.23 -2.43 0.16 0.00 0.00 0.00 0.00 23.12 20.61 2yqm s ALA 14 CO 0.29 -0.99 1.04 -0.51 0.00 0.00 0.00 175.76 175.59 2yqm s LEU 15 N 1.61 -0.41 -0.22 0.00 1.43 -1.26 -5.14 118.68 114.68 2yqm s LEU 15 Ca 0.04 0.66 -0.18 0.00 -1.03 0.00 0.00 54.13 53.63 2yqm s LEU 15 Cb -0.17 1.61 -0.03 0.00 0.03 0.00 0.00 46.19 47.62 2yqm s LEU 15 CO 0.07 -0.10 0.49 -0.54 0.23 0.00 0.00 176.35 176.49 2yqm s LYS 16 N 1.25 4.15 -1.07 1.70 1.02 -1.26 -5.01 119.74 120.53 2yqm s LYS 16 Ca -0.09 0.34 -0.22 0.00 0.02 0.00 0.00 55.97 56.03 2yqm s LYS 16 Cb -0.03 -3.58 0.05 0.00 -0.52 0.00 0.00 37.83 33.75 2yqm s LYS 16 CO -0.14 -0.18 1.50 0.20 -0.92 0.00 0.00 175.35 175.81 2yqm s GLY 17 N 1.24 1.34 -0.20 -3.33 0.00 -1.26 -4.91 107.32 100.21 2yqm s GLY 17 Ca 0.22 -2.39 -0.04 0.00 0.00 0.00 0.00 44.72 42.51 2yqm s GLY 17 CO 0.09 2.69 0.07 0.30 0.00 0.00 0.00 173.10 176.26 2yqm s HIS 18 N 4.81 0.60 -0.14 1.90 4.02 -1.26 -5.12 115.29 120.10 2yqm s HIS 18 Ca 0.47 -0.64 -0.29 0.00 1.02 0.00 0.00 55.06 55.62 2yqm s HIS 18 Cb 0.01 -0.89 -0.01 0.00 -1.02 0.00 0.00 32.58 30.67 2yqm s HIS 18 CO -0.07 -0.60 1.09 0.00 1.02 0.00 0.00 174.74 176.19 2yqm s ALA 19 N 2.00 3.54 1.09 -1.40 0.00 -1.26 -5.03 121.76 120.70 2yqm s ALA 19 Ca 0.02 0.38 -0.05 0.00 0.00 0.00 0.00 51.96 52.31 2yqm s ALA 19 Cb -0.16 -3.51 0.08 0.00 0.00 0.00 0.00 23.12 19.52 2yqm s ALA 19 CO -0.12 -0.84 0.19 0.91 0.00 0.00 0.00 175.76 175.90 2yqm n TRP 20 N 5.64 -2.53 -3.77 0.00 7.02 -1.26 -4.99 117.44 117.55 2yqm n TRP 20 Ca 0.11 -0.18 -0.37 0.00 -1.02 0.00 0.00 57.50 56.04 2yqm n TRP 20 Cb 0.47 -0.26 -0.13 0.00 -2.42 0.00 0.00 31.31 28.98 2yqm n TRP 20 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 2yqm s LEU 21 N 0.00 3.89 0.35 -0.99 1.43 -1.26 -5.07 118.68 117.02 2yqm s LEU 21 Ca 0.14 -0.77 -0.07 0.00 -1.03 0.00 0.00 54.13 52.39 2yqm s LEU 21 Cb -0.02 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.34 2yqm s LEU 21 CO 0.12 -0.21 0.56 -1.59 0.23 0.00 0.00 176.35 175.46 2yqm s LYS 22 N 1.48 1.97 -1.53 1.70 -2.85 -1.26 -4.93 119.74 114.31 2yqm s LYS 22 Ca 0.02 -1.61 -0.02 0.00 -1.00 0.00 0.00 55.97 53.36 2yqm s LYS 22 Cb -0.17 0.50 0.00 0.00 -2.06 0.00 0.00 37.83 36.10 2yqm s LYS 22 CO 0.02 -0.85 0.21 -3.47 0.10 0.00 0.00 175.35 171.36 2yqm n ASP 23 N -1.30 -5.54 -0.01 0.03 2.03 -1.26 -4.86 116.55 105.64 2yqm n ASP 23 Ca -0.02 -0.11 -0.02 0.00 0.52 0.00 0.00 54.79 55.16 2yqm n ASP 23 Cb 0.61 -4.50 -0.01 0.00 -0.72 0.00 0.00 41.12 36.50 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 -1.78 0.77 -3.53 1.67 8.00 -1.26 -4.94 116.55 115.48 2yqm n ASP 24 Ca -0.18 0.02 -0.27 0.00 0.71 0.00 0.00 54.79 55.07 2yqm n ASP 24 Cb 0.65 -0.05 -0.11 0.00 -0.02 0.00 0.00 41.12 41.59 2yqm n ASP 24 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2yqm s GLU 25 N -2.03 1.33 1.37 -1.24 0.41 -1.26 -5.13 118.70 112.15 2yqm s GLU 25 Ca -0.03 -2.45 -0.23 0.00 -0.41 0.00 0.00 54.97 51.86 2yqm s GLU 25 Cb 0.01 -1.96 0.36 0.00 -1.78 0.00 0.00 34.13 30.76 2yqm s GLU 25 CO 0.03 -1.36 0.80 0.00 -0.49 0.00 0.00 175.26 174.25 2yqm n ALA 26 N 2.60 -4.89 0.00 5.21 0.00 -1.26 -4.98 120.51 117.19 2yqm n ALA 26 Ca 0.27 -1.42 0.00 0.00 0.00 0.00 0.00 53.44 52.29 2yqm n ALA 26 Cb 0.44 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.77 2yqm n ALA 26 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2yqm n THR 27 N -5.65 0.00 -3.88 0.00 -2.24 -1.26 -5.15 114.28 96.10 2yqm n THR 27 Ca 0.13 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.64 2yqm n THR 27 Cb 0.56 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2yqm n THR 27 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2yqm s HIS 28 N -0.96 1.50 0.40 4.78 3.76 -1.26 -3.74 115.29 119.77 2yqm s HIS 28 Ca 0.00 -0.87 -0.20 0.00 -0.15 0.00 0.00 55.06 53.84 2yqm s HIS 28 Cb 0.00 -1.90 -0.10 0.00 1.11 0.00 0.00 32.58 31.69 2yqm s HIS 28 CO 0.00 -0.54 0.89 0.00 -0.85 0.00 0.00 174.74 174.24 2yqm n ARG 30 N -0.54 2.22 0.00 0.00 3.00 -1.13 -3.12 116.66 117.08 2yqm n ARG 30 Ca 0.06 -2.35 0.00 0.00 -0.00 0.00 0.00 57.85 55.56 2yqm n ARG 30 Cb 0.54 -1.93 0.00 0.00 0.00 0.00 0.00 32.46 31.07 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 -0.13 0.00 0.02 -0.14 7.27 -1.26 -4.95 117.38 118.20 2yqm n GLN 31 Ca 0.45 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.50 2yqm n GLN 31 Cb 0.59 0.00 -0.09 0.00 2.41 0.00 0.00 30.24 33.15 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 -2.92 -6.36 -4.35 0.00 2.13 -1.18 -4.98 120.64 102.99 2yqm n GLU 33 Ca -0.11 0.71 -0.20 0.00 0.66 0.00 0.00 57.16 58.22 2yqm n GLU 33 Cb 0.87 -5.34 -0.13 0.00 0.27 0.00 0.00 31.44 27.11 2yqm n GLU 33 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2yqm s LYS 34 N -6.02 0.94 0.51 5.31 1.02 -1.26 -4.87 119.74 115.37 2yqm s LYS 34 Ca 0.46 -0.78 -0.22 0.00 0.02 0.00 0.00 55.97 55.45 2yqm s LYS 34 Cb -0.20 -0.95 -0.06 0.00 -0.52 0.00 0.00 37.83 36.10 2yqm s LYS 34 CO 0.57 0.23 1.28 -2.00 -0.92 0.00 0.00 175.35 174.52 2yqm s GLU 35 N -1.18 3.39 0.65 1.68 2.12 -1.26 -2.42 118.70 121.67 2yqm s GLU 35 Ca 0.01 2.06 -0.11 0.00 0.36 0.00 0.00 54.97 57.29 2yqm s GLU 35 Cb -0.08 -2.32 -0.02 0.00 0.26 0.00 0.00 34.13 31.97 2yqm s GLU 35 CO 0.01 -0.93 1.05 -0.06 -0.54 0.00 0.00 175.26 174.79 2yqm s PHE 36 N -1.40 3.46 0.36 5.30 0.08 -1.25 -4.94 117.98 119.60 2yqm s PHE 36 Ca 0.68 1.28 0.03 0.00 0.12 0.00 0.00 56.93 59.05 2yqm s PHE 36 Cb -0.36 -2.81 -0.04 0.00 -0.57 0.00 0.00 43.02 39.24 2yqm s PHE 36 CO 0.43 -0.89 0.09 -1.12 -0.10 0.00 0.00 175.22 173.63 2yqm s SER 37 N -4.12 2.50 0.15 1.36 0.01 -0.86 -4.99 113.70 107.75 2yqm s SER 37 Ca 0.56 -1.52 -0.17 0.00 1.31 0.00 0.00 55.95 56.13 2yqm s SER 37 Cb -0.12 0.23 0.06 0.00 0.21 0.00 0.00 66.02 66.40 2yqm s SER 37 CO 0.54 -0.78 1.73 0.40 0.41 0.00 0.00 173.24 175.54 2yqm h ILE 38 N 1.97 0.83 0.00 1.44 5.03 -1.99 -2.30 117.51 122.49 2yqm h ILE 38 Ca -0.38 -0.06 -0.17 0.00 -0.12 0.00 0.00 64.86 64.13 2yqm h ILE 38 Cb 1.26 0.64 -0.02 0.00 -3.03 0.00 0.00 36.82 35.66 2yqm h ILE 38 CO 0.63 0.03 -0.82 -1.28 -0.68 0.00 0.00 178.15 176.03 2yqm h SER 39 N 0.18 0.00 -2.80 1.72 0.87 -2.04 -3.36 113.55 108.12 2yqm h SER 39 Ca 0.16 0.00 -0.78 0.00 -1.23 0.00 0.00 61.79 59.94 2yqm h SER 39 Cb 0.18 0.00 -0.30 0.00 -0.44 0.00 0.00 62.40 61.84 2yqm h SER 39 CO -0.21 0.82 0.61 -1.14 -0.53 0.00 0.00 176.83 176.37 2yqm n ARG 40 N -3.37 4.25 -0.56 2.24 0.63 -0.88 -5.04 116.66 113.94 2yqm n ARG 40 Ca 0.00 -4.58 -0.19 0.00 -0.92 0.00 0.00 57.85 52.17 2yqm n ARG 40 Cb 0.84 -2.48 0.16 0.00 0.45 0.00 0.00 32.46 31.44 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 1.21 -2.60 -4.14 -0.14 5.12 -1.14 -2.04 116.66 112.93 2yqm n ARG 41 Ca 0.27 -1.05 -0.31 0.00 -1.93 0.00 0.00 57.85 54.82 2yqm n ARG 41 Cb 0.34 -1.04 -0.08 0.00 -1.16 0.00 0.00 32.46 30.52 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 -4.50 2.83 -0.13 5.56 -2.85 -1.26 -4.41 119.74 114.98 2yqm s LYS 42 Ca 0.44 -0.66 0.03 0.00 -1.00 0.00 0.00 55.97 54.78 2yqm s LYS 42 Cb -0.05 -2.70 0.01 0.00 -2.06 0.00 0.00 37.83 33.03 2yqm s LYS 42 CO 0.34 0.59 -0.22 -1.01 0.10 0.00 0.00 175.35 175.16 2yqm s HIS 43 N -1.25 2.58 -0.25 1.78 3.76 0.32 -4.96 115.29 117.28 2yqm s HIS 43 Ca 0.25 -1.24 -0.22 0.00 -0.15 0.00 0.00 55.06 53.69 2yqm s HIS 43 Cb -0.12 -1.75 -0.01 0.00 1.11 0.00 0.00 32.58 31.80 2yqm s HIS 43 CO 0.16 -0.56 0.70 -1.01 -0.85 0.00 0.00 174.74 173.18 2yqm s HIS 44 N 0.73 3.30 0.34 1.40 3.76 -1.26 -2.77 115.29 120.79 2yqm s HIS 44 Ca -0.10 0.94 -0.29 0.00 -0.15 0.00 0.00 55.06 55.47 2yqm s HIS 44 Cb -0.16 -2.91 -0.11 0.00 1.11 0.00 0.00 32.58 30.52 2yqm s HIS 44 CO 0.00 -0.34 1.38 0.00 -0.85 0.00 0.00 174.74 174.93 2yqm n ARG 46 N 0.74 3.75 0.00 0.00 3.00 -1.26 -3.29 116.66 119.60 2yqm n ARG 46 Ca 0.01 -2.29 0.00 0.00 -0.01 0.00 0.00 57.85 55.55 2yqm n ARG 46 Cb 0.41 -2.01 0.00 0.00 0.00 0.00 0.00 32.46 30.85 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 0.52 0.00 0.10 0.55 5.15 -1.26 -4.89 115.26 115.43 2yqm n ASN 47 Ca 0.20 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 54.16 2yqm n ASN 47 Cb 0.91 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 40.12 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 1.25 -0.04 3.45 0.00 0.00 -1.21 -5.04 105.19 103.61 2yqm n GLY 49 Ca 0.01 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.07 1.77 -0.14 1.61 3.76 -1.26 -4.89 115.29 113.07 2yqm s HIS 50 Ca 0.08 -1.41 -0.05 0.00 -0.15 0.00 0.00 55.06 53.53 2yqm s HIS 50 Cb -0.01 -1.02 -0.04 0.00 1.11 0.00 0.00 32.58 32.62 2yqm s HIS 50 CO 0.22 -0.48 0.04 0.42 -0.85 0.00 0.00 174.74 174.09 2yqm s ILE 51 N -3.27 4.61 0.22 0.60 -1.09 -1.26 -2.48 121.20 118.51 2yqm s ILE 51 Ca 0.28 -0.12 -0.14 0.00 -2.23 0.00 0.00 60.65 58.44 2yqm s ILE 51 Cb 0.02 -3.01 0.01 0.00 -1.58 0.00 0.00 42.46 37.90 2yqm s ILE 51 CO 0.18 0.54 0.47 -0.36 -1.23 0.00 0.00 174.94 174.53 2yqm s PHE 52 N -0.25 0.19 0.05 3.97 0.08 -1.11 -2.85 117.98 118.05 2yqm s PHE 52 Ca 0.07 -0.55 0.00 0.00 0.12 0.00 0.00 56.93 56.58 2yqm s PHE 52 Cb -0.12 0.23 0.01 0.00 -0.57 0.00 0.00 43.02 42.57 2yqm s PHE 52 CO 0.02 -0.93 0.07 0.00 -0.10 0.00 0.00 175.22 174.28 2yqm h ASN 54 N -0.01 -0.10 -0.25 0.00 -0.73 -1.89 0.23 115.58 112.83 2yqm h ASN 54 Ca -0.02 -0.30 0.07 0.00 1.87 0.00 0.00 56.30 57.92 2yqm h ASN 54 Cb 0.10 0.03 -0.01 0.00 0.27 0.00 0.00 38.32 38.70 2yqm h ASN 54 CO 0.03 0.26 0.25 0.74 -0.37 0.00 0.00 177.43 178.34 2yqm h THR 55 N -0.47 0.53 0.04 -3.57 2.02 -1.97 -0.67 112.91 108.82 2yqm h THR 55 Ca -0.01 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 66.85 2yqm h THR 55 Cb 0.39 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 2yqm h THR 55 CO 0.02 0.00 -1.78 0.00 0.37 0.00 0.00 175.52 174.12 2yqm n SER 57 N -3.19 6.80 -1.78 0.00 3.41 0.78 -1.82 113.62 117.82 2yqm n SER 57 Ca -0.21 -3.81 -0.16 0.00 -0.26 0.00 0.00 58.87 54.43 2yqm n SER 57 Cb 1.05 -0.90 0.19 0.00 -0.26 0.00 0.00 64.21 64.28 2yqm n SER 57 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2yqm n SER 58 N -0.54 3.20 -3.90 4.04 3.41 -0.74 -4.77 113.62 114.32 2yqm n SER 58 Ca 0.50 -3.69 -0.11 0.00 -0.26 0.00 0.00 58.87 55.32 2yqm n SER 58 Cb 0.36 -0.76 -0.11 0.00 -0.26 0.00 0.00 64.21 63.45 2yqm n SER 58 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2yqm s ASN 59 N -1.83 0.07 0.10 4.04 0.01 -1.26 -5.10 114.94 110.97 2yqm s ASN 59 Ca 0.52 -0.24 0.06 0.00 -0.71 0.00 0.00 52.86 52.49 2yqm s ASN 59 Cb 0.45 0.18 -0.03 0.00 0.41 0.00 0.00 41.25 42.25 2yqm s ASN 59 CO 0.06 -0.31 -0.15 -1.61 -1.51 0.00 0.00 177.10 173.58 2yqm s GLU 60 N -1.23 0.97 -0.09 -0.60 8.01 -1.26 -1.61 118.70 122.89 2yqm s GLU 60 Ca -0.13 -1.13 -0.14 0.00 0.01 0.00 0.00 54.97 53.59 2yqm s GLU 60 Cb -0.07 -0.97 0.03 0.00 -4.31 0.00 0.00 34.13 28.81 2yqm s GLU 60 CO 0.01 0.20 0.35 -1.17 0.01 0.00 0.00 175.26 174.66 2yqm s LEU 61 N -2.10 0.69 -0.60 1.80 2.96 -1.11 -4.95 118.68 115.37 2yqm s LEU 61 Ca 0.05 0.49 -0.26 0.00 -0.22 0.00 0.00 54.13 54.19 2yqm s LEU 61 Cb -0.08 1.27 0.04 0.00 0.50 0.00 0.00 46.19 47.92 2yqm s LEU 61 CO 0.03 -0.25 1.08 0.00 -1.32 0.00 0.00 176.35 175.89 2yqm s ALA 62 N -0.39 3.04 0.40 5.97 0.00 -1.26 -3.01 121.76 126.51 2yqm s ALA 62 Ca -0.05 -1.16 -0.03 0.00 0.00 0.00 0.00 51.96 50.72 2yqm s ALA 62 Cb -0.03 -3.93 -0.04 0.00 0.00 0.00 0.00 23.12 19.12 2yqm s ALA 62 CO 0.02 -2.64 0.66 -0.51 0.00 0.00 0.00 175.76 173.29 2yqm s LEU 63 N 4.57 3.84 0.33 0.00 1.43 -1.26 -4.95 118.68 122.63 2yqm s LEU 63 Ca 0.35 0.72 0.26 0.00 -1.03 0.00 0.00 54.13 54.43 2yqm s LEU 63 Cb -0.10 -3.62 1.08 0.00 0.03 0.00 0.00 46.19 43.57 2yqm s LEU 63 CO 0.20 -0.41 1.77 1.55 0.23 0.00 0.00 176.35 179.69 2yqm h PRO 64 N 0.66 0.00 0.01 1.29 0.13 -1.98 -3.16 132.00 128.95 2yqm h PRO 64 Ca -0.48 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.65 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 -0.00 1.03 -0.23 0.00 0.00 178.00 179.42 2yqm h SER 65 N 0.00 -0.01 -2.64 1.44 0.87 -1.97 -3.46 113.55 107.78 2yqm h SER 65 Ca 0.00 -0.82 -0.55 0.00 -1.23 0.00 0.00 61.79 59.19 2yqm h SER 65 Cb 0.39 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 2yqm h SER 65 CO 0.00 0.84 -0.46 -0.31 -0.53 0.00 0.00 176.83 176.37 2yqm s TYR 66 N -2.66 3.49 0.12 2.24 2.02 -1.19 -5.03 117.35 116.34 2yqm s TYR 66 Ca -0.17 0.16 -0.13 0.00 -0.37 0.00 0.00 57.07 56.56 2yqm s TYR 66 Cb -0.02 -1.70 -0.06 0.00 -0.40 0.00 0.00 41.96 39.78 2yqm s TYR 66 CO 0.64 0.51 1.45 -1.00 -1.57 0.00 0.00 175.55 175.59 2yqm h PRO 67 N 2.28 0.85 -6.29 -1.71 0.13 -1.90 -3.39 132.00 121.97 2yqm h PRO 67 Ca -0.48 -0.44 -0.58 0.00 -0.87 0.00 0.00 66.00 63.62 2yqm h PRO 67 Cb 1.19 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.22 2yqm h PRO 67 CO 0.70 1.08 -0.67 -1.59 -0.23 0.00 0.00 178.00 177.29 2yqm s LYS 68 N -4.39 2.21 0.01 0.86 -2.85 -1.26 -4.94 119.74 109.38 2yqm s LYS 68 Ca -0.12 -1.36 -0.30 0.00 -1.00 0.00 0.00 55.97 53.20 2yqm s LYS 68 Cb 0.10 -2.16 -0.06 0.00 -2.06 0.00 0.00 37.83 33.65 2yqm s LYS 68 CO 0.86 0.39 1.44 -1.25 0.10 0.00 0.00 175.35 176.90 2yqm s PRO 69 N -3.34 4.27 0.48 1.78 0.04 -1.26 -4.62 135.00 132.35 2yqm s PRO 69 Ca 0.29 2.02 0.06 0.00 0.04 0.00 0.00 61.00 63.41 2yqm s PRO 69 Cb -0.07 -3.59 0.06 0.00 0.04 0.00 0.00 34.50 30.94 2yqm s PRO 69 CO 0.18 -0.61 0.53 1.33 0.04 0.00 0.00 177.00 178.48 2yqm n VAL 70 N 4.70 0.00 -2.77 -0.36 0.24 -1.16 -4.72 118.33 114.25 2yqm n VAL 70 Ca 0.14 -1.73 -0.42 0.00 -2.04 0.00 0.00 64.34 60.29 2yqm n VAL 70 Cb 0.43 -0.37 -0.03 0.00 -1.47 0.00 0.00 33.84 32.40 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 -4.08 4.28 0.50 7.34 3.52 -1.26 -2.74 118.95 126.50 2yqm s ARG 71 Ca 0.40 1.19 0.01 0.00 -0.13 0.00 0.00 55.73 57.20 2yqm s ARG 71 Cb -0.03 -3.61 -0.01 0.00 -1.56 0.00 0.00 34.95 29.74 2yqm s ARG 71 CO 0.26 -0.48 0.02 0.14 -0.81 0.00 0.00 175.30 174.43 2yqm s VAL 72 N 2.66 1.06 0.27 7.11 -7.23 -0.63 -4.11 120.40 119.52 2yqm s VAL 72 Ca 0.41 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.59 2yqm s VAL 72 Cb -0.16 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.57 2yqm s VAL 72 CO 0.10 0.00 0.46 0.00 -0.31 0.00 0.00 175.10 175.35 2yqm h ASP 74 N 1.32 0.00 0.29 0.00 1.82 -1.74 0.19 116.42 118.30 2yqm h ASP 74 Ca -0.49 0.00 -0.04 0.00 -0.39 0.00 0.00 57.03 56.11 2yqm h ASP 74 Cb 1.21 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.21 2yqm h ASP 74 CO 0.64 0.00 -0.18 -1.28 -1.61 0.00 0.00 179.24 176.80 2yqm h SER 75 N 0.00 0.00 0.01 2.28 0.87 -1.94 -1.61 113.55 113.16 2yqm h SER 75 Ca 0.15 0.00 -0.39 0.00 -1.23 0.00 0.00 61.79 60.32 2yqm h SER 75 Cb 0.59 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 62.49 2yqm h SER 75 CO -0.00 0.18 -2.18 0.00 -0.53 0.00 0.00 176.83 174.30 2yqm h HIS 77 N -0.75 -0.52 -0.55 0.00 6.17 -0.77 0.22 115.15 118.94 2yqm h HIS 77 Ca -0.58 0.03 -0.09 0.00 0.71 0.00 0.00 60.37 60.44 2yqm h HIS 77 Cb 1.62 0.26 -0.02 0.00 2.52 0.00 0.00 27.41 31.79 2yqm h HIS 77 CO -0.01 -0.28 -0.02 1.15 0.71 0.00 0.00 177.93 179.49 2yqm h THR 78 N -0.24 1.27 0.76 6.26 2.02 -1.52 -1.85 112.91 119.61 2yqm h THR 78 Ca 0.11 -1.14 -0.04 0.00 0.77 0.00 0.00 66.41 66.11 2yqm h THR 78 Cb 0.40 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 2yqm h THR 78 CO -0.30 0.41 -0.40 0.25 0.37 0.00 0.00 175.52 175.85 2yqm h LEU 79 N 0.86 -0.97 -0.36 2.58 5.85 -1.45 -1.90 115.31 119.93 2yqm h LEU 79 Ca 0.15 0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.99 2yqm h LEU 79 Cb 0.56 0.26 -0.07 0.00 0.37 0.00 0.00 40.66 41.78 2yqm h LEU 79 CO 0.03 -0.65 -0.11 -0.07 -0.34 0.00 0.00 178.44 177.30 2yqm h LEU 80 N -1.06 -0.40 -1.96 2.25 3.38 -0.64 0.86 115.31 117.73 2yqm h LEU 80 Ca -0.10 0.12 0.23 0.00 0.09 0.00 0.00 57.88 58.21 2yqm h LEU 80 Cb 0.83 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.79 2yqm h LEU 80 CO 0.15 -0.14 0.58 -0.07 0.09 0.00 0.00 178.44 179.05 2yqm h LEU 81 N -0.03 0.03 -5.76 1.67 3.38 -1.28 -2.00 115.31 111.33 2yqm h LEU 81 Ca 0.18 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.44 2yqm h LEU 81 Cb 0.30 -0.00 -0.34 0.00 0.09 0.00 0.00 40.66 40.71 2yqm h LEU 81 CO -0.39 0.01 0.25 0.00 0.09 0.00 0.00 178.44 178.41 2yqm n GLN 82 N -4.31 4.38 -0.09 1.13 1.13 0.29 -4.64 117.38 115.27 2yqm n GLN 82 Ca 0.17 -4.73 -0.10 0.00 -1.94 0.00 0.00 57.00 50.40 2yqm n GLN 82 Cb 0.86 -2.36 -0.14 0.00 0.11 0.00 0.00 30.24 28.72 2yqm n GLN 82 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 2yqm n ARG 83 N -0.16 1.03 -0.59 -1.09 1.85 -0.75 -4.91 116.66 112.04 2yqm n ARG 83 Ca 0.40 0.01 0.08 0.00 -1.00 0.00 0.00 57.85 57.33 2yqm n ARG 83 Cb 0.32 -1.46 -0.02 0.00 -1.05 0.00 0.00 32.46 30.26 2yqm n ARG 83 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2yqm h SER 85 N -0.54 0.81 -3.45 0.00 4.64 -2.01 -3.43 113.55 109.57 2yqm h SER 85 Ca 0.01 -0.34 -0.54 0.00 -0.47 0.00 0.00 61.79 60.45 2yqm h SER 85 Cb 0.54 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.37 2yqm h SER 85 CO 0.00 0.96 0.16 -0.44 -0.87 0.00 0.00 176.83 176.64 2yqm s SER 86 N -6.38 7.27 0.25 4.97 0.01 -1.26 -5.05 113.70 113.51 2yqm s SER 86 Ca -0.12 1.51 -0.22 0.00 1.31 0.00 0.00 55.95 58.42 2yqm s SER 86 Cb 0.11 -2.47 0.03 0.00 0.21 0.00 0.00 66.02 63.90 2yqm s SER 86 CO 0.82 0.09 0.72 0.28 0.41 0.00 0.00 173.24 175.56 2yqm s THR 87 N -0.47 0.00 0.04 1.44 -1.32 -1.26 -4.91 115.64 109.16 2yqm s THR 87 Ca 0.37 -0.80 -0.26 0.00 -1.21 0.00 0.00 61.69 59.80 2yqm s THR 87 Cb -0.21 -1.82 -0.05 0.00 -1.51 0.00 0.00 72.50 68.91 2yqm s THR 87 CO 0.24 0.00 0.79 0.00 -2.21 0.00 0.00 174.62 173.44 2yqm s ALA 88 N -3.84 3.34 -0.93 11.08 0.00 -1.26 -5.22 121.76 124.93 2yqm s ALA 88 Ca 0.09 0.32 0.07 0.00 0.00 0.00 0.00 51.96 52.45 2yqm s ALA 88 Cb -0.05 -3.04 0.06 0.00 0.00 0.00 0.00 23.12 20.09 2yqm s ALA 88 CO 0.03 0.03 0.74 0.45 0.00 0.00 0.00 175.76 177.01