#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqg s SER 2 N 0.00 6.76 -0.14 1.61 0.15 -1.26 -5.08 113.70 115.74 2yqg s SER 2 Ca 0.00 0.91 -0.30 0.00 0.70 0.00 0.00 55.95 57.26 2yqg s SER 2 Cb 0.00 -2.23 0.11 0.00 -1.71 0.00 0.00 66.02 62.19 2yqg s SER 2 CO 0.00 0.30 0.89 -0.55 1.20 0.00 0.00 173.24 175.08 2yqg s SER 3 N -1.21 -0.47 0.00 5.45 0.15 -1.26 -5.10 113.70 111.26 2yqg s SER 3 Ca 0.25 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.46 2yqg s SER 3 Cb -0.16 0.44 0.00 0.00 -1.71 0.00 0.00 66.02 64.59 2yqg s SER 3 CO 0.14 -0.41 0.24 0.61 1.20 0.00 0.00 173.24 175.02 2yqg n GLY 4 N 0.93 -1.77 2.89 9.45 0.00 -1.26 -4.69 105.19 110.74 2yqg n GLY 4 Ca -0.13 0.38 -0.14 0.00 0.00 0.00 0.00 46.02 46.13 2yqg n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yqg s SER 5 N -2.35 -0.04 -0.16 1.61 0.15 -1.26 -5.14 113.70 106.52 2yqg s SER 5 Ca 0.00 0.17 -0.04 0.00 0.70 0.00 0.00 55.95 56.78 2yqg s SER 5 Cb 0.00 0.10 0.08 0.00 -1.71 0.00 0.00 66.02 64.48 2yqg s SER 5 CO 0.00 -0.10 0.22 -0.44 1.20 0.00 0.00 173.24 174.12 2yqg s SER 6 N 0.76 0.99 0.00 5.45 0.01 -1.26 -5.11 113.70 114.54 2yqg s SER 6 Ca -0.06 0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.30 2yqg s SER 6 Cb -0.08 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2yqg s SER 6 CO -0.03 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 173.94 2yqg n GLY 7 N 5.33 0.37 3.33 3.44 0.00 -1.26 -5.12 105.19 111.28 2yqg n GLY 7 Ca -0.05 -1.30 -0.20 0.00 0.00 0.00 0.00 46.02 44.47 2yqg n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yqg s GLN 8 N -2.00 1.26 -0.06 1.61 -0.21 -1.26 -5.09 119.66 113.92 2yqg s GLN 8 Ca 0.00 -1.46 -0.31 0.00 0.02 0.00 0.00 55.36 53.60 2yqg s GLN 8 Cb 0.00 -1.18 -0.09 0.00 1.00 0.00 0.00 33.01 32.73 2yqg s GLN 8 CO 0.00 0.22 2.00 1.63 -2.12 0.00 0.00 175.29 177.02 2yqg n LYS 9 N 0.03 2.46 -2.58 2.91 5.02 -1.26 -4.88 118.16 119.86 2yqg n LYS 9 Ca -0.11 0.87 -0.41 0.00 -2.02 0.00 0.00 58.31 56.63 2yqg n LYS 9 Cb 0.58 -2.92 -0.03 0.00 -0.02 0.00 0.00 35.03 32.65 2yqg n LYS 9 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2yqg s ARG 10 N 4.74 3.64 -0.09 1.97 6.06 -1.26 -4.81 118.95 129.20 2yqg s ARG 10 Ca 0.93 -1.27 -0.17 0.00 -2.50 0.00 0.00 55.73 52.72 2yqg s ARG 10 Cb -0.51 -5.36 -0.14 0.00 0.06 0.00 0.00 34.95 29.00 2yqg s ARG 10 CO 0.44 -2.19 0.57 0.00 -2.50 0.00 0.00 175.30 171.62 2yqg h ALA 11 N 9.45 -0.10 -3.42 6.12 0.00 -2.00 -3.45 119.26 125.87 2yqg h ALA 11 Ca 0.23 -0.23 -0.66 0.00 0.00 0.00 0.00 54.91 54.24 2yqg h ALA 11 Cb 0.99 0.04 -0.27 0.00 0.00 0.00 0.00 17.79 18.55 2yqg h ALA 11 CO 1.42 -0.13 -0.77 1.67 0.00 0.00 0.00 179.25 181.43 2yqg s TRP 12 N -2.51 2.78 0.49 0.00 1.48 -1.26 -5.12 118.94 114.81 2yqg s TRP 12 Ca -0.10 -0.60 0.02 0.00 -1.06 0.00 0.00 56.10 54.35 2yqg s TRP 12 Cb -0.01 -1.81 -0.02 0.00 -1.16 0.00 0.00 33.47 30.48 2yqg s TRP 12 CO 0.39 -0.17 0.02 0.96 -4.06 0.00 0.00 176.95 174.08 2yqg s ILE 13 N 0.21 1.12 0.37 0.66 -4.36 -1.26 -4.90 121.20 113.04 2yqg s ILE 13 Ca -0.09 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.34 2yqg s ILE 13 Cb -0.15 -2.22 -0.01 0.00 1.25 0.00 0.00 42.46 41.32 2yqg s ILE 13 CO 0.05 0.00 0.11 1.07 0.24 0.00 0.00 174.94 176.41 2yqg n THR 14 N -1.20 0.00 -4.03 8.37 5.66 -1.26 -5.14 114.28 116.67 2yqg n THR 14 Ca -0.17 -2.11 -0.33 0.00 -3.05 0.00 0.00 64.05 58.39 2yqg n THR 14 Cb 0.67 0.71 -0.06 0.00 -1.55 0.00 0.00 70.33 70.10 2yqg n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2yqg s ALA 15 N -2.95 3.71 -0.18 1.79 0.00 -1.26 -5.06 121.76 117.80 2yqg s ALA 15 Ca 0.16 -0.83 -0.29 0.00 0.00 0.00 0.00 51.96 51.00 2yqg s ALA 15 Cb 0.01 -1.69 -0.03 0.00 0.00 0.00 0.00 23.12 21.41 2yqg s ALA 15 CO 0.11 0.70 1.58 -1.25 0.00 0.00 0.00 175.76 176.91 2yqg s PRO 16 N -1.76 3.92 -0.73 0.00 0.04 -1.26 -4.96 135.00 130.26 2yqg s PRO 16 Ca 0.24 1.76 -0.25 0.00 0.04 0.00 0.00 61.00 62.79 2yqg s PRO 16 Cb -0.12 -3.99 0.05 0.00 0.04 0.00 0.00 34.50 30.47 2yqg s PRO 16 CO 0.15 -1.14 1.15 0.08 0.04 0.00 0.00 177.00 177.28 2yqg s VAL 17 N 4.78 4.00 -0.51 -0.36 1.01 -1.26 -4.98 120.40 123.09 2yqg s VAL 17 Ca 0.70 -0.01 -0.14 0.00 0.00 0.00 0.00 61.98 62.53 2yqg s VAL 17 Cb -0.26 -4.83 0.12 0.00 0.00 0.00 0.00 36.38 31.41 2yqg s VAL 17 CO 0.28 -1.69 0.43 0.00 0.00 0.00 0.00 175.10 174.11 2yqg s ALA 18 N 4.94 3.54 -0.07 5.51 0.00 -1.26 -3.27 121.76 131.15 2yqg s ALA 18 Ca 0.30 -2.47 -0.01 0.00 0.00 0.00 0.00 51.96 49.78 2yqg s ALA 18 Cb -0.11 -3.08 -0.03 0.00 0.00 0.00 0.00 23.12 19.89 2yqg s ALA 18 CO 0.11 -1.93 -0.00 -0.51 0.00 0.00 0.00 175.76 173.43 2yqg s LEU 19 N 1.52 3.55 0.48 0.00 1.43 -1.25 -4.99 118.68 119.43 2yqg s LEU 19 Ca 0.04 0.11 -0.20 0.00 -1.03 0.00 0.00 54.13 53.04 2yqg s LEU 19 Cb -0.28 -1.86 -0.09 0.00 0.03 0.00 0.00 46.19 43.99 2yqg s LEU 19 CO 0.02 0.36 1.02 -0.60 0.23 0.00 0.00 176.35 177.38 2yqg s ARG 20 N -1.02 3.89 0.22 1.70 3.52 -1.26 -2.74 118.95 123.25 2yqg s ARG 20 Ca 0.15 1.30 -0.02 0.00 -0.13 0.00 0.00 55.73 57.02 2yqg s ARG 20 Cb -0.11 -2.11 -0.05 0.00 -1.56 0.00 0.00 34.95 31.12 2yqg s ARG 20 CO 0.04 -0.35 0.43 -1.83 -0.81 0.00 0.00 175.30 172.78 2yqg s GLU 21 N -3.25 3.55 0.00 5.12 -1.05 -1.26 -4.38 118.70 117.43 2yqg s GLU 21 Ca 0.66 -0.24 0.00 0.00 -0.15 0.00 0.00 54.97 55.24 2yqg s GLU 21 Cb -0.15 -2.79 0.00 0.00 -0.44 0.00 0.00 34.13 30.75 2yqg s GLU 21 CO 0.19 0.35 0.00 0.41 0.95 0.00 0.00 175.26 177.16 2yqg n GLY 22 N -0.71 0.54 3.03 -3.83 0.00 -1.23 -4.44 105.19 98.55 2yqg n GLY 22 Ca -0.04 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 2yqg n GLY 22 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yqg s GLU 23 N -2.03 0.18 -0.26 1.61 0.41 -1.26 -5.11 118.70 112.24 2yqg s GLU 23 Ca 0.00 0.36 -0.27 0.00 -0.41 0.00 0.00 54.97 54.65 2yqg s GLU 23 Cb 0.00 -0.03 0.01 0.00 -1.78 0.00 0.00 34.13 32.33 2yqg s GLU 23 CO 0.00 -0.10 0.96 -0.51 -0.49 0.00 0.00 175.26 175.13 2yqg s ASP 24 N 0.69 6.94 -0.99 -0.19 1.11 -1.26 -4.62 116.67 118.35 2yqg s ASP 24 Ca -0.05 1.14 -0.05 0.00 0.18 0.00 0.00 52.55 53.77 2yqg s ASP 24 Cb -0.06 -2.50 0.24 0.00 1.07 0.00 0.00 42.92 41.67 2yqg s ASP 24 CO -0.04 -0.67 0.92 -0.76 1.18 0.00 0.00 175.17 175.81 2yqg s LEU 25 N 3.18 5.87 -0.19 1.23 1.43 -1.26 -4.78 118.68 124.15 2yqg s LEU 25 Ca 0.41 -3.70 -0.12 0.00 -1.03 0.00 0.00 54.13 49.69 2yqg s LEU 25 Cb -0.14 -2.03 -0.08 0.00 0.03 0.00 0.00 46.19 43.97 2yqg s LEU 25 CO 0.09 -0.22 -0.28 -0.24 0.23 0.00 0.00 176.35 175.94 2yqg n SER 26 N 2.44 1.57 0.12 2.29 2.88 -1.26 -4.28 113.62 117.37 2yqg n SER 26 Ca 0.23 0.27 -0.13 0.00 -1.33 0.00 0.00 58.87 57.91 2yqg n SER 26 Cb 0.38 -0.64 -0.08 0.00 -0.75 0.00 0.00 64.21 63.12 2yqg n SER 26 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2yqg h LYS 27 N -0.77 -0.31 -0.96 -1.46 1.63 -1.93 -3.19 116.57 109.59 2yqg h LYS 27 Ca -0.42 0.02 0.26 0.00 -0.85 0.00 0.00 60.65 59.66 2yqg h LYS 27 Cb 1.31 0.07 -0.18 0.00 -0.60 0.00 0.00 32.23 32.83 2yqg h LYS 27 CO -0.25 0.03 -0.01 1.63 -3.45 0.00 0.00 179.45 177.40 2yqg n LYS 28 N -5.07 -0.08 -0.92 1.90 5.02 -1.26 -4.59 118.16 113.16 2yqg n LYS 28 Ca -0.09 1.44 -0.29 0.00 -2.02 0.00 0.00 58.31 57.35 2yqg n LYS 28 Cb 0.25 -2.28 0.01 0.00 -0.02 0.00 0.00 35.03 33.00 2yqg n LYS 28 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2yqg n ASN 29 N -5.44 -3.04 -4.77 4.39 3.02 -1.21 -4.65 115.26 103.56 2yqg n ASN 29 Ca 0.22 0.45 -0.34 0.00 -0.03 0.00 0.00 54.58 54.88 2yqg n ASN 29 Cb 0.71 -0.64 0.02 0.00 -0.61 0.00 0.00 39.78 39.26 2yqg n ASN 29 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2yqg s PRO 30 N -0.87 3.13 -0.01 3.52 0.04 -1.26 -5.07 135.00 134.48 2yqg s PRO 30 Ca 0.42 1.52 0.22 0.00 0.04 0.00 0.00 61.00 63.20 2yqg s PRO 30 Cb -0.35 -1.98 -0.30 0.00 0.04 0.00 0.00 34.50 31.91 2yqg s PRO 30 CO 0.52 -1.01 0.52 0.44 0.04 0.00 0.00 177.00 177.51 2yqg n ILE 31 N -1.75 0.13 -3.72 0.56 -5.35 -1.14 -4.96 119.36 103.13 2yqg n ILE 31 Ca 0.11 -0.52 -0.13 0.00 -0.27 0.00 0.00 62.75 61.94 2yqg n ILE 31 Cb 0.51 -0.06 -0.10 0.00 -1.74 0.00 0.00 39.64 38.26 2yqg n ILE 31 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2yqg s ALA 32 N -3.46 -1.10 -0.07 -1.28 0.00 -1.25 -5.01 121.76 109.59 2yqg s ALA 32 Ca -0.07 1.22 -0.03 0.00 0.00 0.00 0.00 51.96 53.08 2yqg s ALA 32 Cb 0.13 -0.69 0.04 0.00 0.00 0.00 0.00 23.12 22.60 2yqg s ALA 32 CO 0.89 -0.21 0.14 0.15 0.00 0.00 0.00 175.76 176.73 2yqg s LYS 33 N 0.16 0.07 -0.62 0.00 -0.14 -1.26 -3.27 119.74 114.67 2yqg s LYS 33 Ca -0.01 0.41 -0.02 0.00 -1.36 0.00 0.00 55.97 55.00 2yqg s LYS 33 Cb -0.03 -0.21 0.16 0.00 -1.68 0.00 0.00 37.83 36.06 2yqg s LYS 33 CO 0.01 -0.21 0.43 0.96 -0.76 0.00 0.00 175.35 175.78 2yqg s ILE 34 N 1.48 3.62 -0.33 2.17 -4.36 -1.26 -5.06 121.20 117.47 2yqg s ILE 34 Ca -0.06 -3.03 -0.20 0.00 -0.26 0.00 0.00 60.65 57.10 2yqg s ILE 34 Cb -0.12 -3.37 -0.01 0.00 1.25 0.00 0.00 42.46 40.22 2yqg s ILE 34 CO -0.06 -0.88 0.60 -1.00 0.24 0.00 0.00 174.94 173.85 2yqg s HIS 35 N -0.14 3.19 1.04 1.37 3.76 -1.26 -5.05 115.29 118.20 2yqg s HIS 35 Ca 0.17 0.44 -0.17 0.00 -0.15 0.00 0.00 55.06 55.35 2yqg s HIS 35 Cb -0.21 -3.01 0.27 0.00 1.11 0.00 0.00 32.58 30.74 2yqg s HIS 35 CO -0.03 -0.52 0.60 -1.13 -0.85 0.00 0.00 174.74 172.81 2yqg n SER 36 N 5.89 -3.53 -0.61 1.40 3.41 -1.26 -4.95 113.62 113.96 2yqg n SER 36 Ca -0.02 -0.61 0.09 0.00 -0.26 0.00 0.00 58.87 58.07 2yqg n SER 36 Cb 0.49 -0.70 0.22 0.00 -0.26 0.00 0.00 64.21 63.96 2yqg n SER 36 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2yqg n ASP 37 N -4.89 3.36 0.00 4.04 9.92 -1.26 -4.62 116.55 123.11 2yqg n ASP 37 Ca 0.10 -3.03 0.00 0.00 -0.53 0.00 0.00 54.79 51.32 2yqg n ASP 37 Cb 0.42 -0.50 0.00 0.00 -0.64 0.00 0.00 41.12 40.40 2yqg n ASP 37 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2yqg n LEU 38 N -0.81 1.49 -0.38 0.64 4.77 -1.26 -4.45 117.00 117.00 2yqg n LEU 38 Ca 0.19 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.08 2yqg n LEU 38 Cb 0.80 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.80 2yqg n LEU 38 CO 0.10 0.21 0.47 0.00 -1.33 0.00 0.00 177.39 176.84 2yqg n ALA 39 N -2.26 -0.57 -0.06 -1.18 0.00 -1.26 -0.05 120.51 115.12 2yqg n ALA 39 Ca 0.00 0.76 -0.14 0.00 0.00 0.00 0.00 53.44 54.06 2yqg n ALA 39 Cb 0.31 -0.09 -0.12 0.00 0.00 0.00 0.00 19.45 19.55 2yqg n ALA 39 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2yqg h GLU 40 N 0.00 -0.00 -0.90 0.00 4.81 -1.86 -0.67 114.58 115.96 2yqg h GLU 40 Ca 0.14 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.45 2yqg h GLU 40 Cb 0.37 0.00 -0.11 0.00 0.63 0.00 0.00 28.75 29.64 2yqg h GLU 40 CO -0.84 0.92 -0.56 0.93 -0.73 0.00 0.00 179.01 178.73 2yqg h GLU 41 N -0.94 -0.03 0.00 1.92 3.07 -1.68 -3.29 114.58 113.62 2yqg h GLU 41 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2yqg h GLU 41 Cb 0.92 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.84 2yqg h GLU 41 CO 0.00 -0.02 -0.07 0.00 -1.40 0.00 0.00 179.01 177.52 2yqg h ARG 42 N -0.04 0.00 0.00 2.33 2.47 -0.62 -3.50 114.38 115.02 2yqg h ARG 42 Ca 0.14 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.86 2yqg h ARG 42 Cb 0.41 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 2yqg h ARG 42 CO -0.86 0.00 0.00 0.41 0.56 0.00 0.00 179.97 180.08 2yqg n GLY 43 N 1.79 0.16 3.77 0.04 0.00 -0.31 -5.05 105.19 105.58 2yqg n GLY 43 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 2yqg n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yqg s LEU 44 N 0.00 3.66 -1.18 0.99 1.02 -0.86 -5.03 118.68 117.28 2yqg s LEU 44 Ca 0.00 -0.28 -0.08 0.00 0.02 0.00 0.00 54.13 53.79 2yqg s LEU 44 Cb 0.00 -2.23 0.23 0.00 0.02 0.00 0.00 46.19 44.21 2yqg s LEU 44 CO 0.00 0.02 1.63 1.17 0.02 0.00 0.00 176.35 179.19 2yqg n LYS 45 N -0.72 3.94 -2.24 1.70 4.81 -1.26 -4.57 118.16 119.82 2yqg n LYS 45 Ca -0.08 -4.03 -0.41 0.00 -0.87 0.00 0.00 58.31 52.92 2yqg n LYS 45 Cb 0.57 -2.75 -0.03 0.00 0.02 0.00 0.00 35.03 32.84 2yqg n LYS 45 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 2yqg s ILE 46 N -0.89 3.27 -0.07 3.15 1.01 -1.26 -4.52 121.20 121.88 2yqg s ILE 46 Ca 0.36 1.05 -0.07 0.00 0.00 0.00 0.00 60.65 61.99 2yqg s ILE 46 Cb 0.05 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 2yqg s ILE 46 CO 0.04 0.16 0.19 -0.89 0.00 0.00 0.00 174.94 174.43 2yqg s THR 47 N 0.07 5.43 0.02 2.92 2.01 -0.60 -4.99 115.64 120.50 2yqg s THR 47 Ca 0.56 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.76 2yqg s THR 47 Cb -0.36 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 2yqg s THR 47 CO 0.38 0.53 0.03 -0.31 -0.69 0.00 0.00 174.62 174.57 2yqg s TYR 48 N -1.12 3.15 0.14 4.92 2.02 -1.26 -2.07 117.35 123.12 2yqg s TYR 48 Ca 0.20 0.11 0.01 0.00 -0.37 0.00 0.00 57.07 57.01 2yqg s TYR 48 Cb -0.13 -1.67 -0.04 0.00 -0.40 0.00 0.00 41.96 39.72 2yqg s TYR 48 CO 0.09 0.50 -0.00 0.21 -1.57 0.00 0.00 175.55 174.77 2yqg s LYS 49 N -1.78 0.97 -0.08 -0.62 2.20 -1.24 -4.73 119.74 114.46 2yqg s LYS 49 Ca 0.22 -1.45 -0.04 0.00 -0.36 0.00 0.00 55.97 54.35 2yqg s LYS 49 Cb -0.12 -0.10 0.04 0.00 -1.51 0.00 0.00 37.83 36.14 2yqg s LYS 49 CO 0.13 -0.13 0.18 0.71 -0.36 0.00 0.00 175.35 175.88 2yqg s TYR 50 N -3.76 -0.23 -0.08 4.03 2.02 -1.26 -3.25 117.35 114.83 2yqg s TYR 50 Ca 0.20 0.61 0.01 0.00 -0.37 0.00 0.00 57.07 57.52 2yqg s TYR 50 Cb 0.06 -0.06 0.02 0.00 -0.40 0.00 0.00 41.96 41.58 2yqg s TYR 50 CO 0.00 -0.21 -0.10 0.95 -1.57 0.00 0.00 175.55 174.63 2yqg s THR 51 N 1.38 1.06 -5.00 -0.71 -4.23 -1.04 -4.90 115.64 102.20 2yqg s THR 51 Ca -0.07 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.04 2yqg s THR 51 Cb -0.11 -1.01 0.00 0.00 1.34 0.00 0.00 72.50 72.72 2yqg s THR 51 CO -0.07 0.35 0.00 0.61 -0.54 0.00 0.00 174.62 174.97 2yqg n GLY 52 N 4.22 -1.98 3.57 3.99 0.00 -1.26 -1.87 105.19 111.85 2yqg n GLY 52 Ca -0.19 -1.38 -0.45 0.00 0.00 0.00 0.00 46.02 43.99 2yqg n GLY 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2yqg n LYS 53 N -0.76 1.19 0.00 1.61 3.00 -1.22 -1.38 118.16 120.60 2yqg n LYS 53 Ca 0.00 0.42 0.00 0.00 -0.00 0.00 0.00 58.31 58.73 2yqg n LYS 53 Cb 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 35.03 33.27 2yqg n LYS 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2yqg n GLY 54 N 1.38 2.97 0.21 3.14 0.00 0.68 -4.71 105.19 108.86 2yqg n GLY 54 Ca 0.11 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.43 2yqg n GLY 54 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2yqg n ILE 55 N 0.00 1.05 -0.11 -0.61 5.41 -0.72 -3.43 119.36 120.95 2yqg n ILE 55 Ca 0.00 -0.35 -0.18 0.00 1.00 0.00 0.00 62.75 63.22 2yqg n ILE 55 Cb 0.00 -1.38 -0.12 0.00 -0.71 0.00 0.00 39.64 37.42 2yqg n ILE 55 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2yqg n THR 56 N -3.36 1.53 -4.50 1.39 -2.24 -0.48 -4.97 114.28 101.65 2yqg n THR 56 Ca -0.34 -0.59 -0.31 0.00 -2.27 0.00 0.00 64.05 60.54 2yqg n THR 56 Cb 0.81 -1.44 -0.11 0.00 -2.10 0.00 0.00 70.33 67.49 2yqg n THR 56 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2yqg s GLU 57 N -2.53 2.21 0.70 -0.78 2.02 -1.25 -5.03 118.70 114.05 2yqg s GLU 57 Ca -0.32 -0.92 -0.13 0.00 0.02 0.00 0.00 54.97 53.61 2yqg s GLU 57 Cb 0.09 -2.30 0.02 0.00 0.10 0.00 0.00 34.13 32.04 2yqg s GLU 57 CO 0.63 0.55 1.10 -1.25 0.02 0.00 0.00 175.26 176.31 2yqg s PRO 58 N -1.61 2.59 0.61 0.39 0.04 -1.26 -0.23 135.00 135.53 2yqg s PRO 58 Ca 0.17 1.30 -0.17 0.00 0.04 0.00 0.00 61.00 62.34 2yqg s PRO 58 Cb -0.11 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 2yqg s PRO 58 CO 0.08 -1.40 1.12 -1.25 0.04 0.00 0.00 177.00 175.58 2yqg s PRO 59 N -4.42 3.06 0.47 0.56 0.04 -1.26 -4.68 135.00 128.77 2yqg s PRO 59 Ca 0.65 1.49 0.08 0.00 0.04 0.00 0.00 61.00 63.25 2yqg s PRO 59 Cb -0.19 -1.98 0.02 0.00 0.04 0.00 0.00 34.50 32.39 2yqg s PRO 59 CO 0.47 -1.06 0.50 -0.06 0.04 0.00 0.00 177.00 176.89 2yqg s PHE 60 N -2.09 2.24 -0.45 0.56 0.40 -1.26 -3.63 117.98 113.76 2yqg s PHE 60 Ca 0.69 -0.59 -0.01 0.00 -0.60 0.00 0.00 56.93 56.42 2yqg s PHE 60 Cb -0.22 -2.17 0.00 0.00 0.51 0.00 0.00 43.02 41.14 2yqg s PHE 60 CO 0.35 -0.46 0.38 0.41 0.70 0.00 0.00 175.22 176.60 2yqg n GLY 61 N -1.79 0.22 0.55 4.36 0.00 -1.22 -4.98 105.19 102.33 2yqg n GLY 61 Ca 0.06 -0.29 -0.00 0.00 0.00 0.00 0.00 46.02 45.79 2yqg n GLY 61 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2yqg n ILE 62 N -2.47 0.03 -4.47 -0.61 5.41 -1.26 -4.68 119.36 111.31 2yqg n ILE 62 Ca -0.08 -0.01 -0.33 0.00 1.00 0.00 0.00 62.75 63.33 2yqg n ILE 62 Cb 0.55 -1.07 -0.16 0.00 -0.71 0.00 0.00 39.64 38.25 2yqg n ILE 62 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2yqg s PHE 63 N -2.01 2.75 -0.13 1.39 0.08 -1.26 -0.26 117.98 118.53 2yqg s PHE 63 Ca -0.01 -1.26 -0.03 0.00 0.12 0.00 0.00 56.93 55.76 2yqg s PHE 63 Cb 0.00 -1.88 -0.03 0.00 -0.57 0.00 0.00 43.02 40.54 2yqg s PHE 63 CO 0.01 -0.59 -0.04 0.14 -0.10 0.00 0.00 175.22 174.64 2yqg s VAL 64 N 0.94 3.92 -0.08 -0.44 -7.23 -0.44 -4.88 120.40 112.19 2yqg s VAL 64 Ca -0.03 -0.36 -0.10 0.00 -1.81 0.00 0.00 61.98 59.67 2yqg s VAL 64 Cb -0.15 -2.69 0.02 0.00 0.56 0.00 0.00 36.38 34.13 2yqg s VAL 64 CO -0.03 0.53 0.26 0.72 -0.31 0.00 0.00 175.10 176.27 2yqg s PHE 65 N -0.02 -0.25 0.51 2.82 -0.12 -1.26 -1.77 117.98 117.90 2yqg s PHE 65 Ca 0.01 0.57 0.01 0.00 -0.05 0.00 0.00 56.93 57.47 2yqg s PHE 65 Cb -0.13 0.09 0.01 0.00 -0.63 0.00 0.00 43.02 42.35 2yqg s PHE 65 CO 0.03 -0.19 0.08 -1.71 -0.05 0.00 0.00 175.22 173.37 2yqg n ASN 66 N 2.55 3.26 -0.03 1.98 5.15 -1.26 -4.98 115.26 121.92 2yqg n ASN 66 Ca -0.15 -3.12 0.00 0.00 -0.60 0.00 0.00 54.58 50.71 2yqg n ASN 66 Cb 0.58 0.27 -0.10 0.00 -0.53 0.00 0.00 39.78 40.00 2yqg n ASN 66 CO 0.00 0.00 0.00 2.29 1.40 0.00 0.00 177.26 180.95 2yqg n LYS 67 N -1.34 1.24 -0.06 1.20 2.85 -1.26 -3.48 118.16 117.30 2yqg n LYS 67 Ca -0.17 -0.06 -0.13 0.00 -1.05 0.00 0.00 58.31 56.90 2yqg n LYS 67 Cb 0.63 -1.31 -0.12 0.00 -0.65 0.00 0.00 35.03 33.58 2yqg n LYS 67 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 2yqg h ASP 68 N 0.00 -0.00 0.23 -5.58 3.58 -1.97 -3.39 116.42 109.29 2yqg h ASP 68 Ca -0.17 -0.90 -0.35 0.00 0.42 0.00 0.00 57.03 56.03 2yqg h ASP 68 Cb 1.20 0.00 0.01 0.00 1.72 0.00 0.00 39.33 42.26 2yqg h ASP 68 CO 0.01 0.93 -1.74 0.71 -2.88 0.00 0.00 179.24 176.27 2yqg h THR 69 N -0.97 0.94 -4.75 2.25 1.35 -2.01 -3.50 112.91 106.22 2yqg h THR 69 Ca -0.00 -2.54 0.00 0.00 -0.55 0.00 0.00 66.41 63.32 2yqg h THR 69 Cb 0.90 2.74 0.00 0.00 -1.73 0.00 0.00 68.15 70.06 2yqg h THR 69 CO 0.00 0.85 -0.75 0.61 -0.25 0.00 0.00 175.52 175.99 2yqg n GLY 70 N 1.84 -3.61 3.56 5.82 0.00 -1.23 -5.03 105.19 106.56 2yqg n GLY 70 Ca -0.24 0.44 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 2yqg n GLY 70 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yqg s GLU 71 N -1.48 0.79 -0.59 1.61 -1.05 -1.26 -4.96 118.70 111.76 2yqg s GLU 71 Ca 0.03 0.28 -0.08 0.00 -0.15 0.00 0.00 54.97 55.06 2yqg s GLU 71 Cb -0.01 0.37 0.15 0.00 -0.44 0.00 0.00 34.13 34.21 2yqg s GLU 71 CO 0.64 -0.23 0.45 -1.17 0.95 0.00 0.00 175.26 175.90 2yqg s LEU 72 N -0.94 5.73 -0.24 1.83 2.96 -1.20 -3.99 118.68 122.82 2yqg s LEU 72 Ca -0.05 -2.39 -0.08 0.00 -0.22 0.00 0.00 54.13 51.40 2yqg s LEU 72 Cb -0.01 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 2yqg s LEU 72 CO 0.04 -0.55 0.09 0.20 -1.32 0.00 0.00 176.35 174.81 2yqg s ASN 73 N 1.87 5.37 0.14 3.68 -0.87 -0.73 -2.87 114.94 121.53 2yqg s ASN 73 Ca 0.12 -0.13 -0.25 0.00 -1.57 0.00 0.00 52.86 51.03 2yqg s ASN 73 Cb -0.21 -1.97 -0.07 0.00 -0.02 0.00 0.00 41.25 38.98 2yqg s ASN 73 CO -0.03 -0.01 0.76 0.54 -2.57 0.00 0.00 177.10 175.79 2yqg s VAL 74 N 1.46 4.45 -0.18 1.60 0.11 -1.26 -1.33 120.40 125.24 2yqg s VAL 74 Ca 0.06 1.67 0.17 0.00 -2.93 0.00 0.00 61.98 60.95 2yqg s VAL 74 Cb -0.15 -4.12 0.45 0.00 -1.53 0.00 0.00 36.38 31.03 2yqg s VAL 74 CO 0.05 0.50 1.17 0.35 -3.33 0.00 0.00 175.10 173.84 2yqg n THR 75 N 1.81 1.44 -3.82 5.04 -2.24 0.64 -4.24 114.28 112.90 2yqg n THR 75 Ca -0.05 -2.76 -0.10 0.00 -2.27 0.00 0.00 64.05 58.87 2yqg n THR 75 Cb 0.49 0.27 -0.08 0.00 -2.10 0.00 0.00 70.33 68.92 2yqg n THR 75 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2yqg s SER 76 N -3.11 0.02 -0.80 3.42 0.15 -1.25 -4.84 113.70 107.29 2yqg s SER 76 Ca 0.37 -0.43 -0.19 0.00 0.70 0.00 0.00 55.95 56.41 2yqg s SER 76 Cb 0.37 0.33 0.13 0.00 -1.71 0.00 0.00 66.02 65.14 2yqg s SER 76 CO -0.07 -0.64 0.96 -0.63 1.20 0.00 0.00 173.24 174.06 2yqg s ILE 77 N -3.05 4.83 0.61 6.45 1.09 -1.26 -4.59 121.20 125.27 2yqg s ILE 77 Ca -0.01 -1.41 -0.17 0.00 -1.10 0.00 0.00 60.65 57.96 2yqg s ILE 77 Cb 0.01 -4.66 -0.14 0.00 -1.06 0.00 0.00 42.46 36.61 2yqg s ILE 77 CO -0.07 -1.35 -0.30 0.18 -0.10 0.00 0.00 174.94 173.31 2yqg n LEU 78 N 6.27 -4.08 -3.69 2.97 4.77 -1.26 -4.65 117.00 117.34 2yqg n LEU 78 Ca 0.11 0.48 -0.11 0.00 -0.03 0.00 0.00 56.01 56.47 2yqg n LEU 78 Cb 0.47 -0.77 -0.11 0.00 -2.33 0.00 0.00 43.42 40.68 2yqg n LEU 78 CO 0.51 -4.82 -0.02 -0.62 -1.33 0.00 0.00 177.39 171.12 2yqg s ASP 79 N -0.93 -0.27 0.02 -1.43 -1.08 -1.26 -3.48 116.67 108.24 2yqg s ASP 79 Ca 0.49 0.80 -0.20 0.00 -0.52 0.00 0.00 52.55 53.12 2yqg s ASP 79 Cb -0.38 0.83 -0.11 0.00 -1.46 0.00 0.00 42.92 41.81 2yqg s ASP 79 CO 0.66 -0.21 1.10 -0.09 0.52 0.00 0.00 175.17 177.16 2yqg h ARG 80 N 7.58 -0.68 -0.86 4.34 2.43 -1.85 0.10 114.38 125.44 2yqg h ARG 80 Ca -0.29 0.05 0.16 0.00 -0.81 0.00 0.00 59.98 59.09 2yqg h ARG 80 Cb 1.15 0.16 -0.16 0.00 -0.42 0.00 0.00 29.97 30.70 2yqg h ARG 80 CO 0.24 -0.46 -0.28 1.05 -1.51 0.00 0.00 179.97 179.01 2yqg h GLU 81 N -0.84 -0.03 0.31 0.20 4.11 -1.97 -2.38 114.58 113.98 2yqg h GLU 81 Ca -0.07 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.34 2yqg h GLU 81 Cb 0.54 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2yqg h GLU 81 CO 0.12 -0.02 -0.15 1.49 0.07 0.00 0.00 179.01 180.52 2yqg h GLU 82 N -0.03 -0.40 -4.60 1.06 4.57 -1.99 -3.43 114.58 109.76 2yqg h GLU 82 Ca 0.37 0.03 -0.58 0.00 -1.18 0.00 0.00 59.36 58.00 2yqg h GLU 82 Cb 0.62 0.09 -0.36 0.00 -0.16 0.00 0.00 28.75 28.94 2yqg h GLU 82 CO -0.89 -0.27 -0.83 0.95 -1.18 0.00 0.00 179.01 176.79 2yqg s THR 83 N -3.60 1.44 0.17 0.32 -4.23 0.35 -5.02 115.64 105.07 2yqg s THR 83 Ca -0.06 -0.57 -0.08 0.00 -1.18 0.00 0.00 61.69 59.81 2yqg s THR 83 Cb 0.01 -1.36 -0.03 0.00 1.34 0.00 0.00 72.50 72.45 2yqg s THR 83 CO 0.18 0.44 1.51 1.55 -0.54 0.00 0.00 174.62 177.76 2yqg h PRO 84 N 7.92 0.81 -2.13 3.99 0.13 -1.73 -3.33 132.00 137.66 2yqg h PRO 84 Ca -0.35 -0.42 -0.06 0.00 -0.87 0.00 0.00 66.00 64.30 2yqg h PRO 84 Cb 1.14 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.08 2yqg h PRO 84 CO 0.50 1.06 0.08 -0.59 -0.23 0.00 0.00 178.00 178.81 2yqg s PHE 85 N -4.33 -0.71 -0.98 1.56 -0.71 -1.26 -3.36 117.98 108.20 2yqg s PHE 85 Ca -0.10 1.66 -0.00 0.00 -1.04 0.00 0.00 56.93 57.44 2yqg s PHE 85 Cb 0.12 0.27 0.32 0.00 -1.21 0.00 0.00 43.02 42.52 2yqg s PHE 85 CO 0.86 -0.39 1.74 1.19 -1.34 0.00 0.00 175.22 177.28 2yqg n PHE 86 N 2.43 2.91 -1.64 3.49 3.72 -1.03 -4.95 117.46 122.39 2yqg n PHE 86 Ca -0.15 -2.71 -0.58 0.00 -0.05 0.00 0.00 57.45 53.97 2yqg n PHE 86 Cb 0.56 -1.12 -0.07 0.00 -0.94 0.00 0.00 39.48 37.90 2yqg n PHE 86 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 2yqg n LEU 87 N -0.09 1.46 0.00 4.37 7.94 -1.26 -4.16 117.00 125.26 2yqg n LEU 87 Ca 0.45 1.13 -0.17 0.00 -1.11 0.00 0.00 56.01 56.31 2yqg n LEU 87 Cb 0.27 -1.06 -0.04 0.00 0.53 0.00 0.00 43.42 43.13 2yqg n LEU 87 CO 0.50 -0.99 -0.12 0.18 -1.11 0.00 0.00 177.39 175.85 2yqg n LEU 88 N 3.47 0.00 -3.16 -1.96 4.77 0.12 -3.41 117.00 116.84 2yqg n LEU 88 Ca 0.24 -1.66 0.04 0.00 -0.03 0.00 0.00 56.01 54.59 2yqg n LEU 88 Cb 0.10 0.21 -0.01 0.00 -2.33 0.00 0.00 43.42 41.39 2yqg n LEU 88 CO 0.73 -0.24 0.17 -0.89 -1.33 0.00 0.00 177.39 175.84 2yqg s THR 89 N -1.98 -0.98 -0.13 -5.08 2.01 -0.78 -3.05 115.64 105.64 2yqg s THR 89 Ca 0.01 0.00 -0.21 0.00 0.31 0.00 0.00 61.69 61.80 2yqg s THR 89 Cb 0.00 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.48 2yqg s THR 89 CO 0.01 0.00 0.62 -0.83 -0.69 0.00 0.00 174.62 173.73 2yqg s GLY 90 N 2.86 2.36 -0.29 4.40 0.00 -1.26 -2.49 107.32 112.90 2yqg s GLY 90 Ca 0.20 -0.08 0.02 0.00 0.00 0.00 0.00 44.72 44.86 2yqg s GLY 90 CO -0.21 1.13 -0.04 -0.19 0.00 0.00 0.00 173.10 173.80 2yqg s TYR 91 N 1.16 3.42 -0.78 1.90 2.02 -1.20 -3.57 117.35 120.29 2yqg s TYR 91 Ca 0.32 -2.46 -0.25 0.00 -0.37 0.00 0.00 57.07 54.31 2yqg s TYR 91 Cb -0.16 -2.29 -0.01 0.00 -0.40 0.00 0.00 41.96 39.10 2yqg s TYR 91 CO 0.13 -0.89 1.70 0.00 -1.57 0.00 0.00 175.55 174.92 2yqg s ALA 92 N 1.07 2.24 0.11 3.71 0.00 -1.26 -3.61 121.76 124.01 2yqg s ALA 92 Ca -0.02 -1.30 -0.11 0.00 0.00 0.00 0.00 51.96 50.53 2yqg s ALA 92 Cb -0.20 -4.40 -0.06 0.00 0.00 0.00 0.00 23.12 18.46 2yqg s ALA 92 CO -0.05 -3.98 0.46 -0.51 0.00 0.00 0.00 175.76 171.68 2yqg s LEU 93 N 7.99 4.34 0.65 0.00 1.43 -0.88 -3.93 118.68 128.28 2yqg s LEU 93 Ca 0.58 0.89 0.02 0.00 -1.03 0.00 0.00 54.13 54.59 2yqg s LEU 93 Cb -0.08 -3.12 0.10 0.00 0.03 0.00 0.00 46.19 43.12 2yqg s LEU 93 CO 0.09 0.14 0.90 -1.81 0.23 0.00 0.00 176.35 175.89 2yqg s ASP 94 N -1.78 4.71 0.37 2.29 1.01 -1.23 -1.56 116.67 120.48 2yqg s ASP 94 Ca 0.35 -0.40 0.17 0.00 0.71 0.00 0.00 52.55 53.39 2yqg s ASP 94 Cb -0.14 -0.13 1.14 0.00 1.01 0.00 0.00 42.92 44.79 2yqg s ASP 94 CO 0.19 -1.59 1.68 0.00 0.21 0.00 0.00 175.17 175.65 2yqg h ALA 95 N -0.24 2.12 -0.18 5.23 0.00 -1.95 0.51 119.26 124.76 2yqg h ALA 95 Ca -0.36 0.15 -0.20 0.00 0.00 0.00 0.00 54.91 54.50 2yqg h ALA 95 Cb 1.28 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2yqg h ALA 95 CO 0.43 -0.70 -0.69 0.00 0.00 0.00 0.00 179.25 178.29 2yqg h ARG 96 N 0.31 0.74 0.00 0.00 3.08 -1.97 -3.48 114.38 113.06 2yqg h ARG 96 Ca 0.72 -0.55 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2yqg h ARG 96 Cb 1.77 0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.92 2yqg h ARG 96 CO -0.52 1.17 0.00 0.41 -1.07 0.00 0.00 179.97 179.96 2yqg n GLY 97 N 0.55 1.76 3.45 0.04 0.00 0.18 -5.12 105.19 106.05 2yqg n GLY 97 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 2yqg n GLY 97 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2yqg s ASN 98 N -2.00 4.33 -1.03 1.61 0.01 -1.26 -4.81 114.94 111.79 2yqg s ASN 98 Ca 0.00 -0.21 -0.24 0.00 -0.71 0.00 0.00 52.86 51.70 2yqg s ASN 98 Cb 0.00 -1.52 -0.15 0.00 0.41 0.00 0.00 41.25 39.99 2yqg s ASN 98 CO 0.00 0.21 1.95 -0.46 -1.51 0.00 0.00 177.10 177.30 2yqg n ASN 99 N 3.21 2.46 0.23 -1.22 6.94 -1.26 -3.52 115.26 122.09 2yqg n ASN 99 Ca -0.18 -2.64 0.11 0.00 -0.02 0.00 0.00 54.58 51.86 2yqg n ASN 99 Cb 0.53 -1.57 0.41 0.00 -2.36 0.00 0.00 39.78 36.79 2yqg n ASN 99 CO 0.00 0.00 0.00 -0.37 -1.03 0.00 0.00 177.26 175.86 2yqg h VAL 100 N 5.96 0.33 -4.12 3.53 -1.51 -1.96 -3.44 116.25 115.04 2yqg h VAL 100 Ca 0.20 -1.07 -0.69 0.00 -1.23 0.00 0.00 66.70 63.91 2yqg h VAL 100 Cb 0.90 1.82 -0.24 0.00 -2.13 0.00 0.00 31.29 31.64 2yqg h VAL 100 CO 1.34 0.15 -0.85 -0.70 -1.23 0.00 0.00 177.57 176.28 2yqg s GLU 101 N -3.48 1.85 0.37 5.19 2.56 -1.26 -5.12 118.70 118.80 2yqg s GLU 101 Ca 0.02 -1.10 -0.26 0.00 0.00 0.00 0.00 54.97 53.64 2yqg s GLU 101 Cb 0.09 -2.05 -0.09 0.00 2.00 0.00 0.00 34.13 34.08 2yqg s GLU 101 CO 0.63 0.51 1.09 0.15 -0.56 0.00 0.00 175.26 177.08 2yqg s LYS 102 N -1.44 4.26 0.96 4.30 1.02 -1.26 -4.45 119.74 123.13 2yqg s LYS 102 Ca 0.13 1.66 -0.12 0.00 0.02 0.00 0.00 55.97 57.66 2yqg s LYS 102 Cb -0.10 -2.74 0.17 0.00 -0.52 0.00 0.00 37.83 34.64 2yqg s LYS 102 CO 0.04 -0.09 1.09 -1.25 -0.92 0.00 0.00 175.35 174.22 2yqg s PRO 103 N -2.18 0.71 -0.03 -1.68 0.04 -1.26 -4.85 135.00 125.76 2yqg s PRO 103 Ca 0.54 0.62 0.07 0.00 0.04 0.00 0.00 61.00 62.27 2yqg s PRO 103 Cb -0.27 -1.76 0.16 0.00 0.04 0.00 0.00 34.50 32.68 2yqg s PRO 103 CO 0.33 -2.57 1.13 1.47 0.04 0.00 0.00 177.00 177.40 2yqg n LEU 104 N -4.08 2.46 -3.73 -3.56 -0.00 -1.23 -4.98 117.00 101.89 2yqg n LEU 104 Ca 0.06 -2.18 -0.23 0.00 -0.00 0.00 0.00 56.01 53.66 2yqg n LEU 104 Cb 0.56 -0.16 -0.07 0.00 -0.00 0.00 0.00 43.42 43.76 2yqg n LEU 104 CO 0.57 0.61 -0.29 1.21 -0.00 0.00 0.00 177.39 179.49 2yqg n GLU 105 N -0.27 -0.93 -1.49 1.47 2.13 -1.26 -4.60 120.64 115.69 2yqg n GLU 105 Ca 0.07 0.07 -0.58 0.00 0.66 0.00 0.00 57.16 57.37 2yqg n GLU 105 Cb 0.39 -2.62 -0.09 0.00 0.27 0.00 0.00 31.44 29.38 2yqg n GLU 105 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2yqg n LEU 106 N -3.37 1.56 -4.67 4.31 7.94 -1.17 -4.55 117.00 117.03 2yqg n LEU 106 Ca -0.17 0.79 -0.35 0.00 -1.11 0.00 0.00 56.01 55.17 2yqg n LEU 106 Cb 0.45 -1.04 -0.10 0.00 0.53 0.00 0.00 43.42 43.26 2yqg n LEU 106 CO 0.60 -0.69 -0.32 0.00 -1.11 0.00 0.00 177.39 175.88 2yqg s ARG 107 N 5.01 2.95 -0.07 1.96 1.70 -1.26 0.16 118.95 129.40 2yqg s ARG 107 Ca 1.10 -0.42 0.06 0.00 -0.47 0.00 0.00 55.73 55.99 2yqg s ARG 107 Cb -1.24 -2.77 -0.01 0.00 -0.57 0.00 0.00 34.95 30.36 2yqg s ARG 107 CO 0.64 0.70 -0.25 0.42 -1.08 0.00 0.00 175.30 175.73 2yqg s ILE 108 N -0.88 2.04 0.02 4.99 1.01 -1.26 -4.15 121.20 122.97 2yqg s ILE 108 Ca 0.13 -1.05 0.01 0.00 0.00 0.00 0.00 60.65 59.74 2yqg s ILE 108 Cb -0.11 -1.74 -0.04 0.00 0.01 0.00 0.00 42.46 40.58 2yqg s ILE 108 CO 0.02 0.57 0.06 -0.75 0.00 0.00 0.00 174.94 174.84 2yqg s LYS 109 N -0.06 2.94 -0.50 2.79 2.20 -1.20 -2.47 119.74 123.43 2yqg s LYS 109 Ca -0.07 -0.57 -0.14 0.00 -0.36 0.00 0.00 55.97 54.83 2yqg s LYS 109 Cb -0.15 -2.77 0.11 0.00 -1.51 0.00 0.00 37.83 33.51 2yqg s LYS 109 CO 0.05 0.62 0.42 0.08 -0.36 0.00 0.00 175.35 176.16 2yqg s VAL 110 N -1.21 4.92 1.00 4.02 1.01 -1.21 -3.75 120.40 125.18 2yqg s VAL 110 Ca 0.23 -1.46 -0.17 0.00 0.00 0.00 0.00 61.98 60.59 2yqg s VAL 110 Cb -0.12 -4.11 0.25 0.00 0.00 0.00 0.00 36.38 32.41 2yqg s VAL 110 CO 0.15 -0.76 0.71 0.18 0.00 0.00 0.00 175.10 175.38 2yqg n LEU 111 N 5.14 0.00 -4.75 3.92 4.77 -1.11 -4.77 117.00 120.20 2yqg n LEU 111 Ca -0.12 -0.73 -0.27 0.00 -0.03 0.00 0.00 56.01 54.86 2yqg n LEU 111 Cb 0.41 -0.73 -0.06 0.00 -2.33 0.00 0.00 43.42 40.71 2yqg n LEU 111 CO 0.49 -2.21 -0.26 -1.81 -1.33 0.00 0.00 177.39 172.27 2yqg s ASP 112 N -3.18 5.27 0.50 -1.43 1.01 -1.26 -4.11 116.67 113.47 2yqg s ASP 112 Ca 0.50 -0.21 0.18 0.00 0.71 0.00 0.00 52.55 53.73 2yqg s ASP 112 Cb -0.07 -1.30 1.24 0.00 1.01 0.00 0.00 42.92 43.79 2yqg s ASP 112 CO 0.40 0.08 2.07 -0.29 0.21 0.00 0.00 175.17 177.65 2yqg h ILE 113 N 2.22 0.92 0.16 0.77 6.09 -1.97 -2.86 117.51 122.84 2yqg h ILE 113 Ca -0.47 -0.04 -0.01 0.00 -1.37 0.00 0.00 64.86 62.97 2yqg h ILE 113 Cb 1.20 0.80 0.00 0.00 0.47 0.00 0.00 36.82 39.29 2yqg h ILE 113 CO 0.62 0.02 -0.08 0.78 -3.07 0.00 0.00 178.15 176.42 2yqg h ASN 114 N 0.11 -0.18 -1.08 2.19 -0.26 -1.94 -3.46 115.58 110.96 2yqg h ASN 114 Ca 0.13 -0.26 -0.75 0.00 -0.56 0.00 0.00 56.30 54.85 2yqg h ASN 114 Cb 0.37 0.05 0.06 0.00 -1.06 0.00 0.00 38.32 37.74 2yqg h ASN 114 CO -0.01 0.38 -0.04 0.47 -1.06 0.00 0.00 177.43 177.17 2yqg n ASP 115 N -4.90 -0.14 -3.69 5.81 9.92 -1.08 -4.96 116.55 117.51 2yqg n ASP 115 Ca -0.06 1.15 -0.18 0.00 -0.53 0.00 0.00 54.79 55.17 2yqg n ASP 115 Cb 0.22 -0.95 -0.17 0.00 -0.64 0.00 0.00 41.12 39.58 2yqg n ASP 115 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 2yqg s ASN 116 N -0.20 0.75 -0.04 -2.24 3.84 -1.26 -4.78 114.94 111.01 2yqg s ASN 116 Ca 0.84 0.18 0.04 0.00 0.21 0.00 0.00 52.86 54.13 2yqg s ASN 116 Cb -1.16 0.04 -0.03 0.00 -0.55 0.00 0.00 41.25 39.55 2yqg s ASN 116 CO 0.56 -0.22 -0.13 -1.61 -2.79 0.00 0.00 177.10 172.90 2yqg s GLU 117 N 1.98 2.50 1.03 0.43 2.02 -1.26 -5.13 118.70 120.27 2yqg s GLU 117 Ca 0.01 -0.70 -0.13 0.00 0.02 0.00 0.00 54.97 54.17 2yqg s GLU 117 Cb -0.12 -2.39 0.20 0.00 0.10 0.00 0.00 34.13 31.92 2yqg s GLU 117 CO -0.04 0.62 1.09 -1.25 0.02 0.00 0.00 175.26 175.70 2yqg s PRO 118 N -0.84 0.17 -0.30 0.39 0.04 -1.26 -4.99 135.00 128.22 2yqg s PRO 118 Ca 0.12 0.43 -0.23 0.00 0.04 0.00 0.00 61.00 61.36 2yqg s PRO 118 Cb -0.11 -1.71 -0.00 0.00 0.04 0.00 0.00 34.50 32.72 2yqg s PRO 118 CO 0.01 -2.89 0.76 0.14 0.04 0.00 0.00 177.00 175.07 2yqg s VAL 119 N -2.97 4.82 0.42 -0.36 -7.23 -1.26 -5.05 120.40 108.77 2yqg s VAL 119 Ca 0.66 1.15 0.08 0.00 -1.81 0.00 0.00 61.98 62.06 2yqg s VAL 119 Cb -0.18 -4.12 -0.01 0.00 0.56 0.00 0.00 36.38 32.63 2yqg s VAL 119 CO 0.58 -0.22 0.42 -0.36 -0.31 0.00 0.00 175.10 175.21 2yqg s PHE 120 N 2.89 2.71 -0.06 2.82 0.08 -1.26 -5.14 117.98 120.01 2yqg s PHE 120 Ca 0.31 -0.48 -0.06 0.00 0.12 0.00 0.00 56.93 56.82 2yqg s PHE 120 Cb -0.14 -2.22 0.02 0.00 -0.57 0.00 0.00 43.02 40.11 2yqg s PHE 120 CO 0.12 -0.20 0.17 -0.08 -0.10 0.00 0.00 175.22 175.13 2yqg s THR 121 N -2.45 0.00 0.30 0.64 -1.32 -1.26 -5.17 115.64 106.38 2yqg s THR 121 Ca 0.50 -0.01 0.08 0.00 -1.21 0.00 0.00 61.69 61.05 2yqg s THR 121 Cb -0.05 -0.25 -0.06 0.00 -1.51 0.00 0.00 72.50 70.64 2yqg s THR 121 CO 0.29 -0.00 -0.08 0.00 -2.21 0.00 0.00 174.62 172.62 2yqg s GLN 122 N 0.08 1.66 0.00 7.08 -2.07 -1.26 -5.35 119.66 119.80 2yqg s GLN 122 Ca -0.00 -1.84 0.00 0.00 -1.82 0.00 0.00 55.36 51.69 2yqg s GLN 122 Cb -0.01 -1.41 0.00 0.00 -1.09 0.00 0.00 33.01 30.50 2yqg s GLN 122 CO 0.00 0.09 0.38 -0.40 -1.32 0.00 0.00 175.29 174.05