#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 -1.42 0.03 1.61 1.04 -1.26 -5.15 113.70 108.55 2yqm s SER 2 Ca 0.00 0.04 0.08 0.00 0.48 0.00 0.00 55.95 56.55 2yqm s SER 2 Cb 0.00 1.93 -0.02 0.00 0.10 0.00 0.00 66.02 68.03 2yqm s SER 2 CO 0.00 -0.29 -0.23 -0.94 0.98 0.00 0.00 173.24 172.76 2yqm s SER 3 N 2.71 2.72 -0.00 7.02 1.04 -1.26 -5.14 113.70 120.79 2yqm s SER 3 Ca 0.11 -0.52 0.04 0.00 0.48 0.00 0.00 55.95 56.05 2yqm s SER 3 Cb -0.10 -0.25 -0.03 0.00 0.10 0.00 0.00 66.02 65.74 2yqm s SER 3 CO -0.25 0.21 -0.09 -0.83 0.98 0.00 0.00 173.24 173.27 2yqm s GLY 4 N -1.08 1.71 -0.30 7.32 0.00 -1.26 -5.10 107.32 108.60 2yqm s GLY 4 Ca 0.09 -1.03 -0.13 0.00 0.00 0.00 0.00 44.72 43.65 2yqm s GLY 4 CO 0.01 -0.89 0.93 -0.45 0.00 0.00 0.00 173.10 172.71 2yqm s SER 5 N -1.33 -0.68 0.03 1.64 0.15 -1.26 -5.17 113.70 107.07 2yqm s SER 5 Ca 0.16 0.84 0.00 0.00 0.70 0.00 0.00 55.95 57.65 2yqm s SER 5 Cb -0.11 1.74 -0.02 0.00 -1.71 0.00 0.00 66.02 65.91 2yqm s SER 5 CO 0.06 -0.13 -0.04 -0.94 1.20 0.00 0.00 173.24 173.40 2yqm s SER 6 N 2.58 0.36 -0.33 5.45 1.04 -1.26 -5.07 113.70 116.46 2yqm s SER 6 Ca -0.01 -0.57 0.14 0.00 0.48 0.00 0.00 55.95 55.99 2yqm s SER 6 Cb -0.08 0.10 0.43 0.00 0.10 0.00 0.00 66.02 66.57 2yqm s SER 6 CO -0.17 -0.33 1.42 0.61 0.98 0.00 0.00 173.24 175.76 2yqm n GLY 7 N 1.39 1.88 3.46 7.32 0.00 -1.26 -5.05 105.19 112.93 2yqm n GLY 7 Ca -0.23 -0.36 -0.44 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.65 4.92 0.09 -0.61 1.01 -1.26 -5.00 121.20 119.70 2yqm s ILE 8 Ca 0.15 -2.23 -0.12 0.00 0.00 0.00 0.00 60.65 58.44 2yqm s ILE 8 Cb 0.42 -4.86 -0.06 0.00 0.01 0.00 0.00 42.46 37.97 2yqm s ILE 8 CO -0.10 -1.57 0.46 -1.59 0.00 0.00 0.00 174.94 172.13 2yqm s LYS 9 N 1.99 3.88 -0.22 2.79 -2.85 -1.26 -5.09 119.74 118.98 2yqm s LYS 9 Ca 0.39 0.34 -0.27 0.00 -1.00 0.00 0.00 55.97 55.43 2yqm s LYS 9 Cb -0.04 -3.02 0.08 0.00 -2.06 0.00 0.00 37.83 32.79 2yqm s LYS 9 CO -0.04 0.56 0.74 -2.00 0.10 0.00 0.00 175.35 174.71 2yqm s GLU 10 N -1.76 0.86 -0.01 1.78 2.12 -1.26 -5.17 118.70 115.26 2yqm s GLU 10 Ca 0.33 0.77 0.05 0.00 0.36 0.00 0.00 54.97 56.48 2yqm s GLU 10 Cb -0.15 0.42 -0.01 0.00 0.26 0.00 0.00 34.13 34.64 2yqm s GLU 10 CO 0.18 -0.15 -0.17 0.54 -0.54 0.00 0.00 175.26 175.12 2yqm s VAL 11 N -0.04 1.31 -0.09 3.70 0.11 -1.26 -5.13 120.40 119.00 2yqm s VAL 11 Ca -0.02 -0.74 -0.03 0.00 -2.93 0.00 0.00 61.98 58.25 2yqm s VAL 11 Cb -0.04 -1.10 0.04 0.00 -1.53 0.00 0.00 36.38 33.76 2yqm s VAL 11 CO 0.03 0.35 0.08 0.21 -3.33 0.00 0.00 175.10 172.43 2yqm s ASN 12 N -0.46 1.59 0.32 3.54 2.47 -1.26 -5.15 114.94 115.99 2yqm s ASN 12 Ca 0.06 -0.18 0.06 0.00 0.42 0.00 0.00 52.86 53.22 2yqm s ASN 12 Cb -0.07 -0.16 -0.06 0.00 -1.45 0.00 0.00 41.25 39.51 2yqm s ASN 12 CO -0.00 -0.29 -0.00 0.00 -3.72 0.00 0.00 177.10 173.08 2yqm s GLN 13 N 2.16 1.65 -0.23 0.43 -2.07 -1.26 -4.97 119.66 115.36 2yqm s GLN 13 Ca 0.04 -1.88 -0.02 0.00 -1.82 0.00 0.00 55.36 51.67 2yqm s GLN 13 Cb -0.14 -1.11 0.01 0.00 -1.09 0.00 0.00 33.01 30.68 2yqm s GLN 13 CO -0.05 -0.06 0.05 0.00 -1.32 0.00 0.00 175.29 173.90 2yqm n ALA 14 N -0.68 -3.25 -3.62 2.60 0.00 -1.26 -4.99 120.51 109.32 2yqm n ALA 14 Ca -0.04 0.77 -0.27 0.00 0.00 0.00 0.00 53.44 53.90 2yqm n ALA 14 Cb 0.65 -1.61 -0.11 0.00 0.00 0.00 0.00 19.45 18.39 2yqm n ALA 14 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2yqm n LEU 15 N 1.04 1.62 -4.45 0.00 -0.00 -1.26 -5.09 117.00 108.86 2yqm n LEU 15 Ca -0.08 -4.90 -0.23 0.00 -0.00 0.00 0.00 56.01 50.81 2yqm n LEU 15 Cb 0.19 -0.17 -0.10 0.00 -0.00 0.00 0.00 43.42 43.33 2yqm n LEU 15 CO 0.36 1.85 -0.44 -0.54 -0.00 0.00 0.00 177.39 178.62 2yqm s LYS 16 N -1.00 1.61 -0.38 1.47 1.02 -1.26 -5.08 119.74 116.11 2yqm s LYS 16 Ca 0.30 -1.76 0.13 0.00 0.02 0.00 0.00 55.97 54.67 2yqm s LYS 16 Cb 0.02 -1.54 0.39 0.00 -0.52 0.00 0.00 37.83 36.18 2yqm s LYS 16 CO -0.16 0.24 0.85 0.41 -0.92 0.00 0.00 175.35 175.77 2yqm n GLY 17 N -0.59 3.21 3.15 -3.33 0.00 -1.26 -5.08 105.19 101.29 2yqm n GLY 17 Ca -0.06 -1.72 -0.12 0.00 0.00 0.00 0.00 46.02 44.12 2yqm n GLY 17 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2yqm s HIS 18 N -2.85 -0.09 -0.44 1.61 5.04 -1.26 -5.13 115.29 112.18 2yqm s HIS 18 Ca 0.37 0.15 -0.10 0.00 -1.54 0.00 0.00 55.06 53.94 2yqm s HIS 18 Cb 0.39 0.02 0.09 0.00 0.04 0.00 0.00 32.58 33.12 2yqm s HIS 18 CO -0.05 -0.28 0.29 0.00 -2.34 0.00 0.00 174.74 172.36 2yqm s ALA 19 N -1.05 3.34 -0.07 1.58 0.00 -1.26 -5.04 121.76 119.26 2yqm s ALA 19 Ca -0.11 -2.24 -0.03 0.00 0.00 0.00 0.00 51.96 49.58 2yqm s ALA 19 Cb -0.06 -2.73 0.04 0.00 0.00 0.00 0.00 23.12 20.38 2yqm s ALA 19 CO 0.02 -1.72 0.14 1.67 0.00 0.00 0.00 175.76 175.87 2yqm s TRP 20 N 1.43 -0.13 -0.30 0.00 1.48 -1.26 -5.00 118.94 115.16 2yqm s TRP 20 Ca 0.04 0.53 -0.00 0.00 -1.06 0.00 0.00 56.10 55.61 2yqm s TRP 20 Cb -0.24 -0.30 0.00 0.00 -1.16 0.00 0.00 33.47 31.78 2yqm s TRP 20 CO 0.02 -0.25 0.00 1.28 -4.06 0.00 0.00 176.95 173.94 2yqm n LEU 21 N 5.26 -7.98 0.08 -4.66 4.32 -1.26 -4.94 117.00 107.81 2yqm n LEU 21 Ca -0.06 1.45 0.12 0.00 -0.02 0.00 0.00 56.01 57.50 2yqm n LEU 21 Cb 0.50 -3.35 0.04 0.00 -1.62 0.00 0.00 43.42 38.99 2yqm n LEU 21 CO 0.05 -3.24 0.06 1.17 -1.22 0.00 0.00 177.39 174.22 2yqm n LYS 22 N 0.73 0.48 -3.33 3.23 3.00 -1.26 -5.01 118.16 116.00 2yqm n LYS 22 Ca -0.01 0.08 -0.13 0.00 -0.00 0.00 0.00 58.31 58.25 2yqm n LYS 22 Cb 0.02 -1.74 0.02 0.00 0.00 0.00 0.00 35.03 33.33 2yqm n LYS 22 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2yqm n ASP 23 N -2.40 -6.64 0.12 3.14 8.00 -1.26 -4.96 116.55 112.56 2yqm n ASP 23 Ca 0.01 -0.53 -0.05 0.00 0.71 0.00 0.00 54.79 54.93 2yqm n ASP 23 Cb 0.50 -4.38 -0.02 0.00 -0.02 0.00 0.00 41.12 37.21 2yqm n ASP 23 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2yqm h ASP 24 N -0.45 -0.27 0.00 -2.24 5.19 -2.04 -3.46 116.42 113.15 2yqm h ASP 24 Ca -0.36 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.06 2yqm h ASP 24 Cb 1.20 0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.78 2yqm h ASP 24 CO 0.38 -0.16 0.00 -0.62 -3.12 0.00 0.00 179.24 175.72 2yqm n GLU 25 N -3.03 0.00 -3.22 3.56 1.02 -1.26 -5.11 120.64 112.60 2yqm n GLU 25 Ca -0.04 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.14 2yqm n GLU 25 Cb 0.12 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.52 2yqm n GLU 25 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2yqm s ALA 26 N -2.00 -2.94 -0.04 0.62 0.00 -1.26 -5.04 121.76 111.11 2yqm s ALA 26 Ca 0.00 1.70 0.06 0.00 0.00 0.00 0.00 51.96 53.73 2yqm s ALA 26 Cb 0.00 -2.30 -0.09 0.00 0.00 0.00 0.00 23.12 20.73 2yqm s ALA 26 CO 0.00 -1.30 0.08 2.41 0.00 0.00 0.00 175.76 176.95 2yqm n THR 27 N 5.36 0.25 -4.59 0.00 -1.04 -1.26 -5.05 114.28 107.94 2yqm n THR 27 Ca -0.06 -0.23 -0.32 0.00 -2.04 0.00 0.00 64.05 61.40 2yqm n THR 27 Cb 0.53 -0.32 -0.06 0.00 -1.82 0.00 0.00 70.33 68.66 2yqm n THR 27 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 2yqm s HIS 28 N -2.30 1.73 0.34 -1.42 3.76 -1.26 -2.78 115.29 113.36 2yqm s HIS 28 Ca -0.03 -0.97 -0.14 0.00 -0.15 0.00 0.00 55.06 53.78 2yqm s HIS 28 Cb 0.03 -1.66 -0.08 0.00 1.11 0.00 0.00 32.58 31.98 2yqm s HIS 28 CO 0.28 0.05 0.75 0.00 -0.85 0.00 0.00 174.74 174.96 2yqm n ARG 30 N -0.59 2.23 0.00 0.00 0.00 -1.23 -3.06 116.66 114.01 2yqm n ARG 30 Ca 0.03 -2.59 0.00 0.00 -0.00 0.00 0.00 57.85 55.29 2yqm n ARG 30 Cb 0.53 -2.02 0.00 0.00 0.00 0.00 0.00 32.46 30.98 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 -0.62 0.00 -0.02 -0.14 7.27 -1.26 -4.94 117.38 117.66 2yqm n GLN 31 Ca 0.50 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 57.56 2yqm n GLN 31 Cb 0.96 0.00 -0.13 0.00 2.41 0.00 0.00 30.24 33.49 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 -2.72 -6.42 -4.76 0.00 2.13 -1.17 -4.98 120.64 102.72 2yqm n GLU 33 Ca -0.17 0.70 -0.28 0.00 0.66 0.00 0.00 57.16 58.07 2yqm n GLU 33 Cb 0.90 -5.33 -0.14 0.00 0.27 0.00 0.00 31.44 27.14 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 -5.87 1.59 0.27 5.31 1.02 -1.26 -4.85 119.74 115.96 2yqm s LYS 34 Ca 0.37 -1.05 -0.30 0.00 0.02 0.00 0.00 55.97 55.02 2yqm s LYS 34 Cb -0.16 -1.76 -0.11 0.00 -0.52 0.00 0.00 37.83 35.28 2yqm s LYS 34 CO 0.61 0.45 1.54 -2.00 -0.92 0.00 0.00 175.35 175.03 2yqm s GLU 35 N -1.25 4.18 0.13 1.68 2.12 -1.26 -2.69 118.70 121.61 2yqm s GLU 35 Ca 0.10 2.47 -0.31 0.00 0.36 0.00 0.00 54.97 57.59 2yqm s GLU 35 Cb -0.09 -3.06 -0.08 0.00 0.26 0.00 0.00 34.13 31.15 2yqm s GLU 35 CO 0.02 -0.56 1.36 -0.06 -0.54 0.00 0.00 175.26 175.48 2yqm s PHE 36 N 0.09 3.26 0.39 5.30 0.08 -1.12 -4.98 117.98 121.01 2yqm s PHE 36 Ca 0.62 1.05 0.01 0.00 0.12 0.00 0.00 56.93 58.73 2yqm s PHE 36 Cb -0.45 -3.64 -0.00 0.00 -0.57 0.00 0.00 43.02 38.35 2yqm s PHE 36 CO 0.45 -2.18 0.02 0.43 -0.10 0.00 0.00 175.22 173.84 2yqm n SER 37 N 3.62 2.76 0.01 1.36 7.64 -1.23 -4.98 113.62 122.80 2yqm n SER 37 Ca 0.10 -2.74 0.02 0.00 1.01 0.00 0.00 58.87 57.25 2yqm n SER 37 Cb 0.43 0.37 0.36 0.00 -1.01 0.00 0.00 64.21 64.36 2yqm n SER 37 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2yqm h ILE 38 N 1.26 1.16 0.00 0.44 5.03 -2.01 -2.09 117.51 121.30 2yqm h ILE 38 Ca -0.32 -0.55 -0.14 0.00 -0.12 0.00 0.00 64.86 63.74 2yqm h ILE 38 Cb 0.99 0.79 -0.02 0.00 -3.03 0.00 0.00 36.82 35.56 2yqm h ILE 38 CO 0.52 0.20 -0.65 -1.28 -0.68 0.00 0.00 178.15 176.26 2yqm h SER 39 N 0.50 0.00 -3.28 1.72 0.87 -2.00 -3.37 113.55 107.99 2yqm h SER 39 Ca 0.12 0.00 -0.74 0.00 -1.23 0.00 0.00 61.79 59.94 2yqm h SER 39 Cb 0.18 0.00 -0.33 0.00 -0.44 0.00 0.00 62.40 61.81 2yqm h SER 39 CO -0.01 0.65 0.16 0.54 -0.53 0.00 0.00 176.83 177.64 2yqm n ARG 40 N -3.33 3.14 -1.35 2.24 3.00 -0.78 -4.91 116.66 114.67 2yqm n ARG 40 Ca 0.01 -4.49 -0.32 0.00 -0.01 0.00 0.00 57.85 53.03 2yqm n ARG 40 Cb 0.77 -2.46 0.09 0.00 0.00 0.00 0.00 32.46 30.86 2yqm n ARG 40 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2yqm s ARG 41 N -1.59 2.23 0.22 5.56 0.52 -1.25 -3.57 118.95 121.07 2yqm s ARG 41 Ca 0.30 1.36 -0.30 0.00 -0.52 0.00 0.00 55.73 56.56 2yqm s ARG 41 Cb -0.05 -1.88 -0.08 0.00 0.52 0.00 0.00 34.95 33.45 2yqm s ARG 41 CO -0.08 -1.68 0.98 0.15 0.02 0.00 0.00 175.30 174.69 2yqm s LYS 42 N -4.51 4.77 -0.09 3.54 1.02 -1.26 -3.78 119.74 119.43 2yqm s LYS 42 Ca 0.65 1.55 -0.01 0.00 0.02 0.00 0.00 55.97 58.18 2yqm s LYS 42 Cb -0.20 -3.28 0.03 0.00 -0.52 0.00 0.00 37.83 33.85 2yqm s LYS 42 CO 0.51 0.38 -0.04 -1.01 -0.92 0.00 0.00 175.35 174.26 2yqm s HIS 43 N -0.87 1.11 -0.09 3.18 3.76 -0.96 -5.01 115.29 116.41 2yqm s HIS 43 Ca 0.43 -0.48 -0.18 0.00 -0.15 0.00 0.00 55.06 54.69 2yqm s HIS 43 Cb -0.27 -1.04 -0.05 0.00 1.11 0.00 0.00 32.58 32.34 2yqm s HIS 43 CO 0.33 -0.43 0.48 -1.01 -0.85 0.00 0.00 174.74 173.26 2yqm s HIS 44 N 1.82 3.56 0.33 1.40 3.76 -1.26 -2.82 115.29 122.07 2yqm s HIS 44 Ca 0.05 0.93 -0.27 0.00 -0.15 0.00 0.00 55.06 55.62 2yqm s HIS 44 Cb -0.12 -2.52 -0.09 0.00 1.11 0.00 0.00 32.58 30.95 2yqm s HIS 44 CO -0.07 0.25 1.06 0.00 -0.85 0.00 0.00 174.74 175.13 2yqm n ARG 46 N 0.67 4.63 0.03 0.00 3.00 -1.26 -3.42 116.66 120.30 2yqm n ARG 46 Ca 0.01 -3.02 0.00 0.00 -0.01 0.00 0.00 57.85 54.83 2yqm n ARG 46 Cb 0.47 -2.19 0.00 0.00 0.00 0.00 0.00 32.46 30.74 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 0.69 0.19 0.06 0.55 5.15 -1.26 -4.89 115.26 115.75 2yqm n ASN 47 Ca 0.27 0.09 -0.01 0.00 -0.60 0.00 0.00 54.58 54.33 2yqm n ASN 47 Cb 1.13 -0.01 -0.06 0.00 -0.53 0.00 0.00 39.78 40.31 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 1.35 -0.68 3.27 0.00 0.00 -1.22 -5.05 105.19 102.86 2yqm n GLY 49 Ca -0.06 0.09 -0.17 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.89 1.60 -0.18 1.61 3.76 -1.26 -4.91 115.29 113.01 2yqm s HIS 50 Ca 0.01 -1.59 -0.07 0.00 -0.15 0.00 0.00 55.06 53.26 2yqm s HIS 50 Cb -0.00 -0.66 -0.04 0.00 1.11 0.00 0.00 32.58 32.99 2yqm s HIS 50 CO 0.29 -0.82 0.06 0.42 -0.85 0.00 0.00 174.74 173.84 2yqm s ILE 51 N -3.61 4.78 0.23 0.60 -1.09 -1.26 -2.75 121.20 118.09 2yqm s ILE 51 Ca 0.40 -0.04 -0.07 0.00 -2.23 0.00 0.00 60.65 58.71 2yqm s ILE 51 Cb 0.03 -3.15 -0.02 0.00 -1.58 0.00 0.00 42.46 37.74 2yqm s ILE 51 CO 0.24 0.46 0.34 -0.36 -1.23 0.00 0.00 174.94 174.38 2yqm s PHE 52 N 0.39 0.73 0.52 3.97 0.08 -1.13 -3.52 117.98 119.02 2yqm s PHE 52 Ca 0.03 -1.02 0.04 0.00 0.12 0.00 0.00 56.93 56.10 2yqm s PHE 52 Cb -0.12 -0.13 0.03 0.00 -0.57 0.00 0.00 43.02 42.23 2yqm s PHE 52 CO 0.00 -0.86 0.72 0.00 -0.10 0.00 0.00 175.22 174.98 2yqm h ASN 54 N 0.23 -0.28 -0.15 0.00 -1.24 -1.88 0.29 115.58 112.55 2yqm h ASN 54 Ca -0.40 0.08 0.04 0.00 0.71 0.00 0.00 56.30 56.74 2yqm h ASN 54 Cb 1.29 0.18 -0.01 0.00 0.73 0.00 0.00 38.32 40.51 2yqm h ASN 54 CO 0.48 -0.10 0.18 0.74 -1.29 0.00 0.00 177.43 177.43 2yqm h THR 55 N -0.02 0.46 0.07 -3.57 2.02 -1.95 -0.96 112.91 108.97 2yqm h THR 55 Ca 0.13 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 67.00 2yqm h THR 55 Cb 0.22 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 2yqm h THR 55 CO -0.28 0.00 -1.68 0.00 0.37 0.00 0.00 175.52 173.93 2yqm n SER 57 N -3.31 7.24 -1.81 0.00 3.41 0.81 -2.45 113.62 117.52 2yqm n SER 57 Ca -0.19 -3.65 -0.18 0.00 -0.26 0.00 0.00 58.87 54.59 2yqm n SER 57 Cb 1.04 -1.11 0.16 0.00 -0.26 0.00 0.00 64.21 64.04 2yqm n SER 57 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2yqm n SER 58 N -0.15 3.91 -4.04 4.04 7.64 -1.11 -4.74 113.62 119.17 2yqm n SER 58 Ca 0.53 -3.73 -0.11 0.00 1.01 0.00 0.00 58.87 56.57 2yqm n SER 58 Cb 0.34 -0.74 -0.11 0.00 -1.01 0.00 0.00 64.21 62.69 2yqm n SER 58 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2yqm s ASN 59 N -2.06 0.66 0.00 6.43 2.20 -1.25 -5.06 114.94 115.85 2yqm s ASN 59 Ca 0.53 -0.56 0.01 0.00 -0.94 0.00 0.00 52.86 51.90 2yqm s ASN 59 Cb 0.45 0.06 -0.01 0.00 -2.00 0.00 0.00 41.25 39.76 2yqm s ASN 59 CO 0.04 -0.25 -0.05 -1.61 -2.94 0.00 0.00 177.10 172.29 2yqm s GLU 60 N -1.66 0.37 -0.04 3.55 2.02 -1.26 -0.33 118.70 121.35 2yqm s GLU 60 Ca -0.11 -0.22 -0.09 0.00 0.02 0.00 0.00 54.97 54.57 2yqm s GLU 60 Cb -0.09 -0.33 0.01 0.00 0.10 0.00 0.00 34.13 33.82 2yqm s GLU 60 CO -0.00 0.09 0.21 -1.17 0.02 0.00 0.00 175.26 174.41 2yqm s LEU 61 N -0.26 1.23 -0.61 1.80 2.96 -1.12 -4.95 118.68 117.73 2yqm s LEU 61 Ca 0.00 0.14 -0.26 0.00 -0.22 0.00 0.00 54.13 53.79 2yqm s LEU 61 Cb -0.03 0.85 0.04 0.00 0.50 0.00 0.00 46.19 47.55 2yqm s LEU 61 CO -0.00 -0.26 1.10 0.00 -1.32 0.00 0.00 176.35 175.87 2yqm s ALA 62 N -0.74 3.02 0.40 5.97 0.00 -1.26 -3.11 121.76 126.04 2yqm s ALA 62 Ca -0.08 -1.16 -0.03 0.00 0.00 0.00 0.00 51.96 50.69 2yqm s ALA 62 Cb -0.05 -3.96 -0.04 0.00 0.00 0.00 0.00 23.12 19.08 2yqm s ALA 62 CO 0.02 -2.69 0.66 -0.51 0.00 0.00 0.00 175.76 173.23 2yqm s LEU 63 N 4.67 3.85 0.34 0.00 1.43 -1.26 -4.95 118.68 122.76 2yqm s LEU 63 Ca 0.35 0.71 0.27 0.00 -1.03 0.00 0.00 54.13 54.43 2yqm s LEU 63 Cb -0.10 -3.60 1.11 0.00 0.03 0.00 0.00 46.19 43.62 2yqm s LEU 63 CO 0.20 -0.40 1.79 1.55 0.23 0.00 0.00 176.35 179.72 2yqm h PRO 64 N 0.68 0.00 0.02 1.29 0.13 -1.98 -3.16 132.00 128.97 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 -0.01 1.03 -0.23 0.00 0.00 178.00 179.41 2yqm h SER 65 N 0.00 -0.02 -2.68 1.44 0.87 -1.97 -3.46 113.55 107.74 2yqm h SER 65 Ca 0.00 -0.76 -0.55 0.00 -1.23 0.00 0.00 61.79 59.25 2yqm h SER 65 Cb 0.39 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 2yqm h SER 65 CO 0.00 0.80 -0.44 -0.31 -0.53 0.00 0.00 176.83 176.35 2yqm s TYR 66 N -2.71 3.49 0.12 2.24 2.02 -1.20 -5.03 117.35 116.29 2yqm s TYR 66 Ca -0.16 0.19 -0.13 0.00 -0.37 0.00 0.00 57.07 56.60 2yqm s TYR 66 Cb -0.02 -1.73 -0.06 0.00 -0.40 0.00 0.00 41.96 39.76 2yqm s TYR 66 CO 0.62 0.49 1.46 -1.00 -1.57 0.00 0.00 175.55 175.55 2yqm h PRO 67 N 2.25 0.85 -6.29 -1.71 0.13 -1.90 -3.39 132.00 121.94 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 0.01 -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 0.00 178.00 177.28 2yqm s LYS 68 N -4.40 2.22 -0.08 0.86 -2.85 -1.26 -4.94 119.74 109.30 2yqm s LYS 68 Ca -0.12 -1.35 -0.30 0.00 -1.00 0.00 0.00 55.97 53.21 2yqm s LYS 68 Cb 0.10 -2.17 -0.04 0.00 -2.06 0.00 0.00 37.83 33.66 2yqm s LYS 68 CO 0.86 0.40 1.51 -1.25 0.10 0.00 0.00 175.35 176.96 2yqm s PRO 69 N -3.33 4.21 0.48 1.78 0.04 -1.26 -4.62 135.00 132.29 2yqm s PRO 69 Ca 0.29 2.01 0.08 0.00 0.04 0.00 0.00 61.00 63.42 2yqm s PRO 69 Cb -0.07 -3.86 0.08 0.00 0.04 0.00 0.00 34.50 30.68 2yqm s PRO 69 CO 0.18 -0.77 0.64 1.33 0.04 0.00 0.00 177.00 178.42 2yqm n VAL 70 N 5.34 0.00 -2.70 -0.36 0.24 -1.18 -4.71 118.33 114.96 2yqm n VAL 70 Ca 0.16 -1.62 -0.42 0.00 -2.04 0.00 0.00 64.34 60.42 2yqm n VAL 70 Cb 0.43 -0.56 -0.03 0.00 -1.47 0.00 0.00 33.84 32.21 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 -4.16 4.36 0.51 7.34 3.52 -1.26 -2.81 118.95 126.45 2yqm s ARG 71 Ca 0.49 1.34 0.01 0.00 -0.13 0.00 0.00 55.73 57.44 2yqm s ARG 71 Cb -0.04 -3.57 -0.01 0.00 -1.56 0.00 0.00 34.95 29.77 2yqm s ARG 71 CO 0.31 -0.41 0.02 0.14 -0.81 0.00 0.00 175.30 174.55 2yqm s VAL 72 N 2.37 0.99 0.19 7.11 -7.23 0.55 -4.07 120.40 120.32 2yqm s VAL 72 Ca 0.46 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.66 2yqm s VAL 72 Cb -0.17 -2.11 -0.03 0.00 0.56 0.00 0.00 36.38 34.62 2yqm s VAL 72 CO 0.14 0.00 0.33 0.00 -0.31 0.00 0.00 175.10 175.26 2yqm h ASP 74 N 1.78 0.63 0.01 0.00 3.32 -1.87 0.28 116.42 120.57 2yqm h ASP 74 Ca -0.49 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.59 2yqm h ASP 74 Cb 1.21 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 40.67 2yqm h ASP 74 CO 0.66 0.32 -0.00 -1.28 -1.72 0.00 0.00 179.24 177.21 2yqm h SER 75 N 0.66 0.00 0.01 6.45 0.87 -1.94 -1.08 113.55 118.52 2yqm h SER 75 Ca 0.44 0.00 -0.35 0.00 -1.23 0.00 0.00 61.79 60.65 2yqm h SER 75 Cb 0.74 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.65 2yqm h SER 75 CO -0.20 0.00 -1.94 0.00 -0.53 0.00 0.00 176.83 174.17 2yqm h HIS 77 N -0.84 -0.48 -0.15 0.00 6.17 -0.65 0.21 115.15 119.40 2yqm h HIS 77 Ca -0.52 0.03 -0.02 0.00 0.71 0.00 0.00 60.37 60.57 2yqm h HIS 77 Cb 1.54 0.25 -0.01 0.00 2.52 0.00 0.00 27.41 31.72 2yqm h HIS 77 CO 0.01 -0.26 0.00 1.15 0.71 0.00 0.00 177.93 179.54 2yqm h THR 78 N -0.18 1.25 0.21 6.26 2.02 -1.42 -1.63 112.91 119.42 2yqm h THR 78 Ca 0.14 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.52 2yqm h THR 78 Cb 0.39 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 68.26 2yqm h THR 78 CO -0.37 0.24 -0.42 0.25 0.37 0.00 0.00 175.52 175.59 2yqm h LEU 79 N 0.01 -1.22 -0.41 2.58 5.85 -1.46 0.23 115.31 120.90 2yqm h LEU 79 Ca 0.04 0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.95 2yqm h LEU 79 Cb 0.36 0.44 -0.05 0.00 0.37 0.00 0.00 40.66 41.78 2yqm h LEU 79 CO 0.01 -0.52 0.11 -0.07 -0.34 0.00 0.00 178.44 177.63 2yqm h LEU 80 N -0.72 0.07 -1.47 2.25 3.38 -0.64 0.26 115.31 118.45 2yqm h LEU 80 Ca 0.00 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.06 2yqm h LEU 80 Cb 0.71 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 2yqm h LEU 80 CO -0.19 0.08 0.39 -0.07 0.09 0.00 0.00 178.44 178.74 2yqm h LEU 81 N 0.25 0.60 -3.69 1.67 3.38 -0.88 -1.48 115.31 115.17 2yqm h LEU 81 Ca 0.19 -0.01 -0.36 0.00 0.09 0.00 0.00 57.88 57.80 2yqm h LEU 81 Cb 0.21 -0.14 -0.21 0.00 0.09 0.00 0.00 40.66 40.61 2yqm h LEU 81 CO -0.23 0.42 0.30 0.00 0.09 0.00 0.00 178.44 179.02 2yqm n GLN 82 N -4.46 2.07 -2.71 1.13 -0.00 0.79 -4.93 117.38 109.27 2yqm n GLN 82 Ca 0.07 -3.10 -0.42 0.00 -0.00 0.00 0.00 57.00 53.55 2yqm n GLN 82 Cb 0.13 -2.01 -0.03 0.00 -0.00 0.00 0.00 30.24 28.33 2yqm n GLN 82 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 2yqm s ARG 83 N -3.28 3.20 -0.69 2.61 3.52 0.80 -4.94 118.95 120.17 2yqm s ARG 83 Ca 0.51 -0.64 0.02 0.00 -0.13 0.00 0.00 55.73 55.49 2yqm s ARG 83 Cb 0.45 -4.32 0.17 0.00 -1.56 0.00 0.00 34.95 29.69 2yqm s ARG 83 CO 0.06 -1.99 0.50 0.00 -0.81 0.00 0.00 175.30 173.06 2yqm n SER 85 N 2.53 -0.59 -4.06 0.00 2.88 -1.26 -5.08 113.62 108.04 2yqm n SER 85 Ca 0.15 -1.25 -0.34 0.00 -1.33 0.00 0.00 58.87 56.10 2yqm n SER 85 Cb 0.35 0.18 -0.12 0.00 -0.75 0.00 0.00 64.21 63.87 2yqm n SER 85 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2yqm s SER 86 N -0.59 4.99 0.00 -3.46 1.04 -1.26 -4.79 113.70 109.63 2yqm s SER 86 Ca 0.00 -2.44 0.00 0.00 0.48 0.00 0.00 55.95 53.99 2yqm s SER 86 Cb 0.00 -1.76 0.00 0.00 0.10 0.00 0.00 66.02 64.36 2yqm s SER 86 CO 0.00 -0.41 0.00 0.41 0.98 0.00 0.00 173.24 174.22 2yqm n THR 87 N 3.98 0.00 0.33 2.02 -1.04 -1.26 -4.96 114.28 113.36 2yqm n THR 87 Ca 0.03 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.90 2yqm n THR 87 Cb 0.39 -0.27 -0.07 0.00 -1.82 0.00 0.00 70.33 68.56 2yqm n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yqm h ALA 88 N 0.00 -0.89 0.00 2.41 0.00 -2.06 -3.58 119.26 115.15 2yqm h ALA 88 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 2yqm h ALA 88 Cb 0.00 0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2yqm h ALA 88 CO 0.00 -0.83 0.00 0.43 0.00 0.00 0.00 179.25 178.85