#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqm n SER 2 N 0.00 -1.67 -4.90 1.61 2.88 -1.26 -5.14 113.62 105.14 2yqm n SER 2 Ca 0.00 -3.19 -0.20 0.00 -1.33 0.00 0.00 58.87 54.15 2yqm n SER 2 Cb 0.00 0.99 -0.02 0.00 -0.75 0.00 0.00 64.21 64.43 2yqm n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yqm s SER 3 N -1.56 5.16 0.37 -3.46 0.01 -1.26 -5.14 113.70 107.83 2yqm s SER 3 Ca 0.32 -0.68 0.08 0.00 1.31 0.00 0.00 55.95 56.97 2yqm s SER 3 Cb 0.24 -0.59 -0.03 0.00 0.21 0.00 0.00 66.02 65.84 2yqm s SER 3 CO -0.16 -0.67 0.27 -0.83 0.41 0.00 0.00 173.24 172.26 2yqm s GLY 4 N -4.17 2.01 0.30 3.44 0.00 -1.26 -5.14 107.32 102.50 2yqm s GLY 4 Ca 0.49 -1.83 0.01 0.00 0.00 0.00 0.00 44.72 43.39 2yqm s GLY 4 CO 0.29 -1.70 0.32 -1.35 0.00 0.00 0.00 173.10 170.65 2yqm s SER 5 N -4.00 0.97 0.05 1.64 1.04 -1.26 -5.18 113.70 106.96 2yqm s SER 5 Ca 0.43 -1.53 -0.27 0.00 0.48 0.00 0.00 55.95 55.05 2yqm s SER 5 Cb -0.03 0.55 0.10 0.00 0.10 0.00 0.00 66.02 66.74 2yqm s SER 5 CO 0.26 -1.09 1.19 -0.94 0.98 0.00 0.00 173.24 173.63 2yqm s SER 6 N -3.26 -0.04 0.01 7.02 1.04 -1.26 -5.19 113.70 112.01 2yqm s SER 6 Ca 0.36 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2yqm s SER 6 Cb 0.02 0.28 -0.00 0.00 0.10 0.00 0.00 66.02 66.42 2yqm s SER 6 CO 0.21 -0.53 0.01 0.61 0.98 0.00 0.00 173.24 174.51 2yqm n GLY 7 N -0.64 4.04 3.48 7.32 0.00 -1.26 -5.09 105.19 113.03 2yqm n GLY 7 Ca -0.04 -1.77 -0.43 0.00 0.00 0.00 0.00 46.02 43.79 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 -1.85 4.25 0.39 -0.61 1.01 -1.26 -5.01 121.20 118.13 2yqm s ILE 8 Ca 0.01 -0.46 0.08 0.00 0.00 0.00 0.00 60.65 60.28 2yqm s ILE 8 Cb 0.00 -4.77 -0.00 0.00 0.01 0.00 0.00 42.46 37.70 2yqm s ILE 8 CO 0.01 -1.57 0.50 -0.75 0.00 0.00 0.00 174.94 173.12 2yqm s LYS 9 N 4.20 2.85 0.17 2.79 2.47 -1.26 -5.13 119.74 125.84 2yqm s LYS 9 Ca 0.28 -1.23 -0.02 0.00 -1.56 0.00 0.00 55.97 53.44 2yqm s LYS 9 Cb -0.12 -2.70 0.04 0.00 -1.46 0.00 0.00 37.83 33.59 2yqm s LYS 9 CO 0.06 -0.16 0.24 -0.85 0.16 0.00 0.00 175.35 174.80 2yqm n GLU 10 N -1.73 0.07 -4.94 4.03 0.28 -1.26 -5.10 120.64 112.00 2yqm n GLU 10 Ca 0.05 -0.47 -0.28 0.00 -0.16 0.00 0.00 57.16 56.30 2yqm n GLU 10 Cb 0.59 -0.21 -0.16 0.00 1.43 0.00 0.00 31.44 33.09 2yqm n GLU 10 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2yqm s VAL 11 N -1.06 1.60 0.26 3.84 0.11 -1.26 -5.14 120.40 118.75 2yqm s VAL 11 Ca 0.14 -0.79 0.01 0.00 -2.93 0.00 0.00 61.98 58.41 2yqm s VAL 11 Cb -0.01 -1.38 -0.00 0.00 -1.53 0.00 0.00 36.38 33.46 2yqm s VAL 11 CO 0.10 0.46 0.04 -0.46 -3.33 0.00 0.00 175.10 171.91 2yqm n ASN 12 N 3.29 1.96 -3.32 3.54 6.94 -1.26 -5.15 115.26 121.26 2yqm n ASN 12 Ca -0.19 -2.24 -0.08 0.00 -0.02 0.00 0.00 54.58 52.05 2yqm n ASN 12 Cb 0.53 0.39 -0.07 0.00 -2.36 0.00 0.00 39.78 38.27 2yqm n ASN 12 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 2yqm s GLN 13 N -2.96 0.38 -0.51 -3.83 -0.21 -1.26 -5.05 119.66 106.22 2yqm s GLN 13 Ca 0.06 0.52 0.05 0.00 0.02 0.00 0.00 55.36 56.01 2yqm s GLN 13 Cb 0.00 -0.35 0.39 0.00 1.00 0.00 0.00 33.01 34.05 2yqm s GLN 13 CO 0.04 -0.70 1.10 0.00 -2.12 0.00 0.00 175.29 173.62 2yqm n ALA 14 N 5.37 5.01 -3.80 6.09 0.00 -1.26 -4.93 120.51 126.99 2yqm n ALA 14 Ca -0.03 -4.45 -0.29 0.00 0.00 0.00 0.00 53.44 48.67 2yqm n ALA 14 Cb 0.50 -0.69 -0.13 0.00 0.00 0.00 0.00 19.45 19.14 2yqm n ALA 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2yqm s LEU 15 N -3.55 3.64 0.16 0.00 1.43 -1.26 -5.09 118.68 114.00 2yqm s LEU 15 Ca 0.48 -3.12 0.11 0.00 -1.03 0.00 0.00 54.13 50.57 2yqm s LEU 15 Cb 0.36 -1.32 -0.04 0.00 0.03 0.00 0.00 46.19 45.21 2yqm s LEU 15 CO -0.18 -0.20 -0.24 -0.54 0.23 0.00 0.00 176.35 175.42 2yqm s LYS 16 N -0.37 1.42 0.00 1.70 1.02 -1.26 -5.14 119.74 117.12 2yqm s LYS 16 Ca 0.21 -1.42 0.00 0.00 0.02 0.00 0.00 55.97 54.78 2yqm s LYS 16 Cb -0.17 -1.78 0.00 0.00 -0.52 0.00 0.00 37.83 35.36 2yqm s LYS 16 CO -0.06 0.40 0.00 0.41 -0.92 0.00 0.00 175.35 175.18 2yqm n GLY 17 N 0.57 5.00 2.96 -3.33 0.00 -1.26 -5.15 105.19 103.98 2yqm n GLY 17 Ca -0.15 -1.12 -0.30 0.00 0.00 0.00 0.00 46.02 44.45 2yqm n GLY 17 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2yqm s HIS 18 N -0.00 2.27 0.07 1.61 3.76 -1.26 -5.12 115.29 116.62 2yqm s HIS 18 Ca 0.00 -1.54 0.02 0.00 -0.15 0.00 0.00 55.06 53.39 2yqm s HIS 18 Cb 0.00 -1.56 -0.03 0.00 1.11 0.00 0.00 32.58 32.10 2yqm s HIS 18 CO 0.00 -0.73 -0.08 0.00 -0.85 0.00 0.00 174.74 173.08 2yqm s ALA 19 N 1.44 0.85 -0.13 -1.40 0.00 -1.26 -5.14 121.76 116.12 2yqm s ALA 19 Ca -0.02 -1.06 -0.14 0.00 0.00 0.00 0.00 51.96 50.74 2yqm s ALA 19 Cb -0.17 0.07 -0.05 0.00 0.00 0.00 0.00 23.12 22.98 2yqm s ALA 19 CO -0.07 -0.09 0.32 1.67 0.00 0.00 0.00 175.76 177.59 2yqm s TRP 20 N -2.36 3.51 -0.03 0.00 1.48 -1.26 -5.08 118.94 115.21 2yqm s TRP 20 Ca 0.01 0.68 0.00 0.00 -1.06 0.00 0.00 56.10 55.73 2yqm s TRP 20 Cb -0.03 -2.33 0.03 0.00 -1.16 0.00 0.00 33.47 29.97 2yqm s TRP 20 CO -0.01 0.32 0.00 -0.51 -4.06 0.00 0.00 176.95 172.69 2yqm s LEU 21 N 0.16 1.12 -0.01 -4.66 1.43 -1.26 -5.01 118.68 110.46 2yqm s LEU 21 Ca 0.18 -0.02 0.07 0.00 -1.03 0.00 0.00 54.13 53.33 2yqm s LEU 21 Cb -0.14 -0.21 0.11 0.00 0.03 0.00 0.00 46.19 45.99 2yqm s LEU 21 CO 0.06 -0.11 1.05 2.29 0.23 0.00 0.00 176.35 179.87 2yqm n LYS 22 N 4.19 0.02 -2.88 1.70 2.85 -1.26 -5.03 118.16 117.75 2yqm n LYS 22 Ca -0.26 -1.26 -0.44 0.00 -1.05 0.00 0.00 58.31 55.30 2yqm n LYS 22 Cb 0.50 0.36 0.00 0.00 -0.65 0.00 0.00 35.03 35.25 2yqm n LYS 22 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2yqm n ASP 23 N 0.10 5.23 -2.72 -5.58 8.00 -1.26 -4.65 116.55 115.67 2yqm n ASP 23 Ca -0.19 -3.00 -0.05 0.00 0.71 0.00 0.00 54.79 52.25 2yqm n ASP 23 Cb 0.82 -1.55 0.05 0.00 -0.02 0.00 0.00 41.12 40.42 2yqm n ASP 23 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2yqm n ASP 24 N 5.28 0.92 -0.07 -2.24 2.03 -1.26 -4.88 116.55 116.33 2yqm n ASP 24 Ca 0.37 -2.42 -0.09 0.00 0.52 0.00 0.00 54.79 53.16 2yqm n ASP 24 Cb 0.42 -0.26 -0.08 0.00 -0.72 0.00 0.00 41.12 40.48 2yqm n ASP 24 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2yqm n GLU 25 N -0.40 0.79 -2.55 -0.67 -0.58 -1.26 -5.10 120.64 110.86 2yqm n GLU 25 Ca 0.05 0.06 -0.03 0.00 -0.42 0.00 0.00 57.16 56.82 2yqm n GLU 25 Cb 0.82 -1.30 -0.03 0.00 -0.57 0.00 0.00 31.44 30.36 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 -2.82 -3.59 -0.07 0.62 0.00 -1.26 -4.99 120.51 108.39 2yqm n ALA 26 Ca -0.25 1.55 -0.18 0.00 0.00 0.00 0.00 53.44 54.56 2yqm n ALA 26 Cb 0.81 -3.03 -0.13 0.00 0.00 0.00 0.00 19.45 17.10 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 1.20 1.61 -4.27 0.00 -2.24 -1.26 -5.00 114.28 104.31 2yqm n THR 27 Ca -0.24 -0.64 -0.15 0.00 -2.27 0.00 0.00 64.05 60.76 2yqm n THR 27 Cb 0.37 -1.46 -0.10 0.00 -2.10 0.00 0.00 70.33 67.04 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 -2.54 1.37 0.94 4.78 3.76 -1.26 -4.19 115.29 118.16 2yqm s HIS 28 Ca -0.27 -0.71 -0.12 0.00 -0.15 0.00 0.00 55.06 53.81 2yqm s HIS 28 Cb 0.08 -0.68 0.06 0.00 1.11 0.00 0.00 32.58 33.14 2yqm s HIS 28 CO 0.69 0.15 0.54 0.00 -0.85 0.00 0.00 174.74 175.27 2yqm n ARG 30 N -2.15 2.37 0.14 0.00 0.00 -1.24 -3.94 116.66 111.84 2yqm n ARG 30 Ca 0.08 -3.07 0.00 0.00 -0.00 0.00 0.00 57.85 54.85 2yqm n ARG 30 Cb 0.53 -1.93 0.00 0.00 0.00 0.00 0.00 32.46 31.06 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 -0.88 0.00 0.09 -0.14 7.27 -1.26 -4.92 117.38 117.55 2yqm n GLN 31 Ca 0.36 0.00 0.05 0.00 0.07 0.00 0.00 57.00 57.48 2yqm n GLN 31 Cb 1.15 0.00 -0.01 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 -2.90 -1.97 -4.34 0.00 4.71 -1.25 -5.02 120.64 109.87 2yqm n GLU 33 Ca -0.03 0.99 -0.21 0.00 -0.01 0.00 0.00 57.16 57.89 2yqm n GLU 33 Cb 0.70 -5.68 -0.16 0.00 -1.01 0.00 0.00 31.44 25.29 2yqm n GLU 33 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 2yqm s LYS 34 N -4.17 1.13 -0.18 3.49 1.02 -1.26 -4.89 119.74 114.87 2yqm s LYS 34 Ca 0.35 -0.24 -0.37 0.00 0.02 0.00 0.00 55.97 55.74 2yqm s LYS 34 Cb -0.05 -1.02 -0.13 0.00 -0.52 0.00 0.00 37.83 36.10 2yqm s LYS 34 CO 0.75 -0.01 1.83 -1.91 -0.92 0.00 0.00 175.35 175.09 2yqm n GLU 35 N 3.83 1.73 -1.70 1.68 2.13 -1.26 -3.72 120.64 123.33 2yqm n GLU 35 Ca -0.24 0.63 -0.38 0.00 0.66 0.00 0.00 57.16 57.84 2yqm n GLU 35 Cb 0.52 -2.42 0.05 0.00 0.27 0.00 0.00 31.44 29.86 2yqm n GLU 35 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2yqm n PHE 36 N 6.20 1.80 -4.26 4.31 3.72 -1.26 -5.03 117.46 122.95 2yqm n PHE 36 Ca 0.25 0.44 -0.15 0.00 -0.05 0.00 0.00 57.45 57.94 2yqm n PHE 36 Cb 0.22 -2.28 -0.10 0.00 -0.94 0.00 0.00 39.48 36.38 2yqm n PHE 36 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2yqm s SER 37 N -1.10 1.85 0.34 4.37 1.04 -1.23 -5.00 113.70 113.98 2yqm s SER 37 Ca 0.75 -1.02 0.09 0.00 0.48 0.00 0.00 55.95 56.25 2yqm s SER 37 Cb -0.42 -0.02 0.83 0.00 0.10 0.00 0.00 66.02 66.52 2yqm s SER 37 CO 0.47 -0.33 1.81 0.40 0.98 0.00 0.00 173.24 176.58 2yqm h ILE 38 N 2.75 0.73 0.00 -1.02 1.08 -1.99 0.81 117.51 119.88 2yqm h ILE 38 Ca -0.37 -0.23 -0.21 0.00 -0.39 0.00 0.00 64.86 63.66 2yqm h ILE 38 Cb 1.19 -0.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.91 2yqm h ILE 38 CO 0.63 0.12 -0.98 -1.28 -0.69 0.00 0.00 178.15 175.96 2yqm h SER 39 N 0.68 0.01 -2.24 1.72 0.87 -2.02 -3.34 113.55 109.23 2yqm h SER 39 Ca 0.53 -0.01 -0.75 0.00 -1.23 0.00 0.00 61.79 60.32 2yqm h SER 39 Cb 0.93 -0.00 -0.31 0.00 -0.44 0.00 0.00 62.40 62.58 2yqm h SER 39 CO -0.29 0.99 0.62 -1.14 -0.53 0.00 0.00 176.83 176.48 2yqm n ARG 40 N -3.38 4.81 -0.66 2.24 3.00 0.25 -5.04 116.66 117.87 2yqm n ARG 40 Ca -0.00 -4.67 -0.32 0.00 -0.00 0.00 0.00 57.85 52.86 2yqm n ARG 40 Cb 0.92 -2.41 0.18 0.00 0.00 0.00 0.00 32.46 31.16 2yqm n ARG 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2yqm n ARG 41 N -0.13 -1.48 -3.75 -0.14 5.12 -1.03 -3.54 116.66 111.71 2yqm n ARG 41 Ca 0.43 -0.41 -0.23 0.00 -1.93 0.00 0.00 57.85 55.72 2yqm n ARG 41 Cb 0.29 -1.84 -0.02 0.00 -1.16 0.00 0.00 32.46 29.74 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 -3.70 3.46 0.07 5.56 -2.85 -1.26 -3.89 119.74 117.13 2yqm s LYS 42 Ca 0.59 -0.58 0.03 0.00 -1.00 0.00 0.00 55.97 55.00 2yqm s LYS 42 Cb -0.16 -2.81 -0.03 0.00 -2.06 0.00 0.00 37.83 32.76 2yqm s LYS 42 CO 0.66 0.33 -0.09 -1.01 0.10 0.00 0.00 175.35 175.34 2yqm s HIS 43 N -2.08 0.89 -0.27 1.78 3.76 0.44 -5.00 115.29 114.81 2yqm s HIS 43 Ca 0.36 -0.62 -0.06 0.00 -0.15 0.00 0.00 55.06 54.59 2yqm s HIS 43 Cb -0.09 -0.51 0.00 0.00 1.11 0.00 0.00 32.58 33.09 2yqm s HIS 43 CO 0.31 -0.06 0.04 -1.01 -0.85 0.00 0.00 174.74 173.18 2yqm s HIS 44 N -2.12 3.10 0.54 1.40 3.76 -1.26 -2.47 115.29 118.23 2yqm s HIS 44 Ca -0.00 -0.97 -0.21 0.00 -0.15 0.00 0.00 55.06 53.72 2yqm s HIS 44 Cb -0.05 -2.20 -0.06 0.00 1.11 0.00 0.00 32.58 31.39 2yqm s HIS 44 CO -0.01 -0.56 1.24 0.00 -0.85 0.00 0.00 174.74 174.56 2yqm n ARG 46 N -0.86 4.59 0.00 0.00 3.00 -1.26 -3.69 116.66 118.45 2yqm n ARG 46 Ca 0.11 -2.99 0.00 0.00 -0.01 0.00 0.00 57.85 54.96 2yqm n ARG 46 Cb 0.44 -2.19 0.00 0.00 0.00 0.00 0.00 32.46 30.72 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 0.68 0.00 0.14 0.55 5.15 -1.26 -4.89 115.26 115.63 2yqm n ASN 47 Ca 0.26 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.25 2yqm n ASN 47 Cb 1.12 0.00 0.15 0.00 -0.53 0.00 0.00 39.78 40.52 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 0.55 -0.24 3.48 0.00 0.00 -1.24 -5.05 105.19 102.69 2yqm n GLY 49 Ca -0.00 0.08 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.10 1.77 -0.24 1.61 3.76 -1.26 -4.91 115.29 112.92 2yqm s HIS 50 Ca 0.12 -1.36 -0.08 0.00 -0.15 0.00 0.00 55.06 53.58 2yqm s HIS 50 Cb -0.02 -1.07 -0.04 0.00 1.11 0.00 0.00 32.58 32.57 2yqm s HIS 50 CO 0.31 -0.41 0.10 0.42 -0.85 0.00 0.00 174.74 174.31 2yqm s ILE 51 N -3.25 4.62 0.06 0.60 -1.09 -1.26 -2.86 121.20 118.02 2yqm s ILE 51 Ca 0.26 -0.07 -0.05 0.00 -2.23 0.00 0.00 60.65 58.56 2yqm s ILE 51 Cb 0.02 -3.16 -0.02 0.00 -1.58 0.00 0.00 42.46 37.73 2yqm s ILE 51 CO 0.17 0.34 0.08 -0.36 -1.23 0.00 0.00 174.94 173.94 2yqm s PHE 52 N 1.43 0.30 0.69 3.97 0.08 -1.03 -3.67 117.98 119.75 2yqm s PHE 52 Ca 0.06 -0.74 0.00 0.00 0.12 0.00 0.00 56.93 56.37 2yqm s PHE 52 Cb -0.15 -0.21 0.12 0.00 -0.57 0.00 0.00 43.02 42.21 2yqm s PHE 52 CO 0.05 -0.43 0.96 0.00 -0.10 0.00 0.00 175.22 175.69 2yqm h ASN 54 N -0.41 0.15 0.38 0.00 4.21 -1.85 0.25 115.58 118.30 2yqm h ASN 54 Ca -0.36 0.09 -0.03 0.00 1.21 0.00 0.00 56.30 57.21 2yqm h ASN 54 Cb 1.27 0.09 -0.00 0.00 -1.12 0.00 0.00 38.32 38.56 2yqm h ASN 54 CO 0.41 0.09 -0.14 0.74 -1.29 0.00 0.00 177.43 177.24 2yqm h THR 55 N 0.35 0.65 -0.43 2.81 2.02 -1.94 -2.07 112.91 114.30 2yqm h THR 55 Ca 0.31 -0.60 -0.17 0.00 0.77 0.00 0.00 66.41 66.73 2yqm h THR 55 Cb 0.43 1.38 -0.10 0.00 -1.74 0.00 0.00 68.15 68.11 2yqm h THR 55 CO -0.34 0.14 0.06 0.00 0.37 0.00 0.00 175.52 175.74 2yqm n SER 57 N -0.85 -1.33 -0.07 0.00 3.41 0.57 -4.17 113.62 111.18 2yqm n SER 57 Ca 0.33 -2.06 -0.02 0.00 -0.26 0.00 0.00 58.87 56.86 2yqm n SER 57 Cb 1.10 0.68 -0.16 0.00 -0.26 0.00 0.00 64.21 65.57 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 -1.06 0.03 -4.76 4.04 3.41 -0.97 -4.48 113.62 109.83 2yqm n SER 58 Ca -0.13 0.01 -0.41 0.00 -0.26 0.00 0.00 58.87 58.09 2yqm n SER 58 Cb 0.80 1.32 -0.04 0.00 -0.26 0.00 0.00 64.21 66.04 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 -5.16 7.10 0.23 4.04 -0.87 -1.24 -4.86 114.94 114.17 2yqm s ASN 59 Ca -0.09 2.37 0.10 0.00 -1.57 0.00 0.00 52.86 53.67 2yqm s ASN 59 Cb 0.09 -2.63 -0.05 0.00 -0.02 0.00 0.00 41.25 38.64 2yqm s ASN 59 CO 0.86 -0.29 -0.18 -1.61 -2.57 0.00 0.00 177.10 173.31 2yqm s GLU 60 N -1.30 1.48 -0.00 -0.60 2.02 -1.26 -1.32 118.70 117.71 2yqm s GLU 60 Ca 0.47 -1.62 -0.23 0.00 0.02 0.00 0.00 54.97 53.61 2yqm s GLU 60 Cb -0.34 -1.48 0.05 0.00 0.10 0.00 0.00 34.13 32.45 2yqm s GLU 60 CO 0.43 0.28 0.50 -1.17 0.02 0.00 0.00 175.26 175.32 2yqm s LEU 61 N -3.22 0.04 -0.44 1.80 2.96 -1.18 -4.96 118.68 113.68 2yqm s LEU 61 Ca 0.24 0.31 -0.21 0.00 -0.22 0.00 0.00 54.13 54.25 2yqm s LEU 61 Cb -0.04 1.98 0.02 0.00 0.50 0.00 0.00 46.19 48.66 2yqm s LEU 61 CO 0.10 -0.60 0.69 0.00 -1.32 0.00 0.00 176.35 175.22 2yqm s ALA 62 N -1.71 3.33 0.31 5.97 0.00 -1.26 -2.90 121.76 125.49 2yqm s ALA 62 Ca -0.10 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.73 2yqm s ALA 62 Cb -0.02 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 2yqm s ALA 62 CO 0.04 -1.83 0.50 -0.51 0.00 0.00 0.00 175.76 173.96 2yqm s LEU 63 N 2.97 4.09 0.25 0.00 1.43 -1.26 -4.96 118.68 121.21 2yqm s LEU 63 Ca 0.25 0.40 0.02 0.00 -1.03 0.00 0.00 54.13 53.77 2yqm s LEU 63 Cb -0.13 -3.23 0.31 0.00 0.03 0.00 0.00 46.19 43.16 2yqm s LEU 63 CO 0.20 -0.22 1.62 1.55 0.23 0.00 0.00 176.35 179.73 2yqm h PRO 64 N 1.01 0.39 0.59 1.29 0.13 -1.97 -3.27 132.00 130.17 2yqm h PRO 64 Ca -0.50 -0.20 -0.03 0.00 -0.87 0.00 0.00 66.00 64.40 2yqm h PRO 64 Cb 1.22 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2yqm h PRO 64 CO 0.62 0.76 -0.31 1.03 -0.23 0.00 0.00 178.00 179.88 2yqm h SER 65 N 0.31 -0.75 -3.29 1.44 0.87 -1.99 -3.43 113.55 106.71 2yqm h SER 65 Ca 0.02 0.03 -0.52 0.00 -1.23 0.00 0.00 61.79 60.10 2yqm h SER 65 Cb 0.91 0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 63.07 2yqm h SER 65 CO 0.08 -0.51 -0.11 -0.31 -0.53 0.00 0.00 176.83 175.45 2yqm s TYR 66 N -6.06 3.47 0.09 2.24 2.02 -1.23 -5.02 117.35 112.85 2yqm s TYR 66 Ca -0.17 0.72 -0.16 0.00 -0.37 0.00 0.00 57.07 57.09 2yqm s TYR 66 Cb 0.04 -2.16 -0.10 0.00 -0.40 0.00 0.00 41.96 39.34 2yqm s TYR 66 CO 0.62 0.15 1.41 -1.00 -1.57 0.00 0.00 175.55 175.17 2yqm h PRO 67 N 1.76 0.63 -6.29 -1.71 0.13 -1.84 -3.40 132.00 121.27 2yqm h PRO 67 Ca -0.47 -0.33 -0.59 0.00 -0.87 0.00 0.00 66.00 63.74 2yqm h PRO 67 Cb 1.19 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.21 2yqm h PRO 67 CO 0.66 0.93 -0.68 -1.59 -0.23 0.00 0.00 178.00 177.09 2yqm s LYS 68 N -4.36 2.19 0.03 0.86 -2.85 -1.26 -4.93 119.74 109.41 2yqm s LYS 68 Ca -0.13 -1.37 -0.30 0.00 -1.00 0.00 0.00 55.97 53.17 2yqm s LYS 68 Cb 0.08 -2.15 -0.06 0.00 -2.06 0.00 0.00 37.83 33.64 2yqm s LYS 68 CO 0.81 0.39 1.43 -1.25 0.10 0.00 0.00 175.35 176.83 2yqm s PRO 69 N -3.35 4.28 0.48 1.78 0.04 -1.26 -4.62 135.00 132.35 2yqm s PRO 69 Ca 0.29 2.02 0.07 0.00 0.04 0.00 0.00 61.00 63.42 2yqm s PRO 69 Cb -0.07 -3.52 0.07 0.00 0.04 0.00 0.00 34.50 31.02 2yqm s PRO 69 CO 0.18 -0.57 0.58 1.33 0.04 0.00 0.00 177.00 178.57 2yqm n VAL 70 N 4.55 0.00 -2.69 -0.36 0.24 -1.14 -4.79 118.33 114.14 2yqm n VAL 70 Ca 0.13 -1.69 -0.42 0.00 -2.04 0.00 0.00 64.34 60.32 2yqm n VAL 70 Cb 0.43 -0.45 -0.03 0.00 -1.47 0.00 0.00 33.84 32.32 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 -4.13 4.58 0.33 7.34 3.52 -1.26 -3.12 118.95 126.20 2yqm s ARG 71 Ca 0.44 1.46 0.06 0.00 -0.13 0.00 0.00 55.73 57.57 2yqm s ARG 71 Cb -0.04 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.90 2yqm s ARG 71 CO 0.28 -0.00 0.23 1.33 -0.81 0.00 0.00 175.30 176.33 2yqm n VAL 72 N 3.61 0.00 -3.70 7.11 0.24 -0.43 -4.13 118.33 121.03 2yqm n VAL 72 Ca 0.05 -2.25 -0.32 0.00 -2.04 0.00 0.00 64.34 59.79 2yqm n VAL 72 Cb 0.50 1.04 -0.05 0.00 -1.47 0.00 0.00 33.84 33.86 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 2.91 0.35 -0.05 0.00 3.58 -1.87 0.28 116.42 121.62 2yqm h ASP 74 Ca -0.46 0.03 0.01 0.00 0.42 0.00 0.00 57.03 57.03 2yqm h ASP 74 Cb 1.17 -0.04 -0.00 0.00 1.72 0.00 0.00 39.33 42.18 2yqm h ASP 74 CO 0.73 0.16 0.04 -1.28 -2.88 0.00 0.00 179.24 176.00 2yqm h SER 75 N 0.36 0.00 0.07 2.28 0.87 -1.93 -0.53 113.55 114.67 2yqm h SER 75 Ca 0.42 0.00 -0.35 0.00 -1.23 0.00 0.00 61.79 60.63 2yqm h SER 75 Cb 1.08 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.01 2yqm h SER 75 CO -0.13 0.00 -1.98 0.00 -0.53 0.00 0.00 176.83 174.19 2yqm h HIS 77 N -0.23 -0.09 -0.41 0.00 6.17 -0.85 0.16 115.15 119.90 2yqm h HIS 77 Ca -0.46 0.02 -0.14 0.00 0.71 0.00 0.00 60.37 60.50 2yqm h HIS 77 Cb 1.84 0.07 -0.01 0.00 2.52 0.00 0.00 27.41 31.82 2yqm h HIS 77 CO 0.06 -0.07 -0.30 1.15 0.71 0.00 0.00 177.93 179.48 2yqm h THR 78 N 0.01 1.27 0.95 6.26 2.02 -1.30 -2.28 112.91 119.83 2yqm h THR 78 Ca 0.09 -1.47 -0.05 0.00 0.77 0.00 0.00 66.41 65.75 2yqm h THR 78 Cb 0.13 1.28 0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2yqm h THR 78 CO -0.18 0.49 -0.46 0.25 0.37 0.00 0.00 175.52 176.00 2yqm h LEU 79 N 0.76 -1.08 -0.48 2.58 5.85 -1.43 -2.23 115.31 119.29 2yqm h LEU 79 Ca 0.08 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.93 2yqm h LEU 79 Cb 0.88 0.28 -0.08 0.00 0.37 0.00 0.00 40.66 42.11 2yqm h LEU 79 CO 0.08 -0.74 0.02 -0.07 -0.34 0.00 0.00 178.44 177.39 2yqm h LEU 80 N -1.34 -0.15 -1.90 2.25 3.38 -0.76 0.96 115.31 117.74 2yqm h LEU 80 Ca -0.13 0.11 0.17 0.00 0.09 0.00 0.00 57.88 58.12 2yqm h LEU 80 Cb 0.98 0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.88 2yqm h LEU 80 CO 0.21 -0.04 0.46 -0.07 0.09 0.00 0.00 178.44 179.09 2yqm h LEU 81 N 0.14 0.09 -4.69 1.67 3.38 -1.36 -1.08 115.31 113.46 2yqm h LEU 81 Ca 0.24 0.01 -0.70 0.00 0.09 0.00 0.00 57.88 57.51 2yqm h LEU 81 Cb 0.35 -0.01 -0.32 0.00 0.09 0.00 0.00 40.66 40.77 2yqm h LEU 81 CO -0.38 0.04 0.47 0.00 0.09 0.00 0.00 178.44 178.67 2yqm n GLN 82 N -4.38 2.97 -3.05 1.13 6.02 0.32 -4.97 117.38 115.42 2yqm n GLN 82 Ca 0.13 -3.79 -0.43 0.00 -0.01 0.00 0.00 57.00 52.89 2yqm n GLN 82 Cb 0.66 -2.27 -0.06 0.00 1.02 0.00 0.00 30.24 29.60 2yqm n GLN 82 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2yqm s ARG 83 N -3.88 3.21 -0.28 -1.09 1.81 -0.41 -4.95 118.95 113.35 2yqm s ARG 83 Ca 0.52 -0.62 -0.29 0.00 -1.72 0.00 0.00 55.73 53.63 2yqm s ARG 83 Cb 0.44 -4.06 -0.02 0.00 -0.45 0.00 0.00 34.95 30.85 2yqm s ARG 83 CO -0.29 -1.27 1.79 0.00 -0.68 0.00 0.00 175.30 174.85 2yqm n SER 85 N 9.82 -8.23 -3.68 0.00 2.88 -1.26 -4.95 113.62 108.20 2yqm n SER 85 Ca 0.22 0.84 -0.11 0.00 -1.33 0.00 0.00 58.87 58.49 2yqm n SER 85 Cb 0.46 -4.35 -0.12 0.00 -0.75 0.00 0.00 64.21 59.45 2yqm n SER 85 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yqm s SER 86 N -7.06 -0.08 -0.37 -3.46 0.01 -1.26 -5.00 113.70 96.48 2yqm s SER 86 Ca 0.00 0.74 -0.14 0.00 1.31 0.00 0.00 55.95 57.86 2yqm s SER 86 Cb 0.00 0.82 0.02 0.00 0.21 0.00 0.00 66.02 67.06 2yqm s SER 86 CO 0.00 -0.21 0.52 0.41 0.41 0.00 0.00 173.24 174.37 2yqm n THR 87 N 4.94 -9.96 -0.02 1.44 -1.04 -1.26 -4.98 114.28 103.39 2yqm n THR 87 Ca -0.14 0.78 -0.12 0.00 -2.04 0.00 0.00 64.05 62.54 2yqm n THR 87 Cb 0.51 -6.89 -0.14 0.00 -1.82 0.00 0.00 70.33 61.99 2yqm n THR 87 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yqm n ALA 88 N -0.33 1.36 -0.56 2.41 0.00 -1.26 -5.31 120.51 116.84 2yqm n ALA 88 Ca 0.10 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.77 2yqm n ALA 88 Cb 0.40 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.10 2yqm n ALA 88 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93