#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ytq s ASN 15 N 0.00 4.05 0.62 1.96 0.02 -1.26 -5.13 114.94 115.19 1ytq s ASN 15 Ca 0.00 -0.90 -0.14 0.00 -1.02 0.00 0.00 52.86 50.81 1ytq s ASN 15 Cb 0.00 -0.54 -0.03 0.00 0.02 0.00 0.00 41.25 40.70 1ytq s ASN 15 CO 0.00 -0.04 1.04 -2.16 0.02 0.00 0.00 177.10 175.96 1ytq s PRO 16 N -3.61 3.36 -0.21 -0.60 0.04 -1.26 -4.86 135.00 127.85 1ytq s PRO 16 Ca 0.32 1.00 -0.06 0.00 0.04 0.00 0.00 61.00 62.30 1ytq s PRO 16 Cb -0.04 -2.05 0.10 0.00 0.04 0.00 0.00 34.50 32.55 1ytq s PRO 16 CO 0.18 -0.76 0.43 -1.59 0.04 0.00 0.00 177.00 175.29 1ytq s LYS 17 N -4.56 0.34 -0.03 4.56 -2.85 0.89 -4.20 119.74 113.89 1ytq s LYS 17 Ca 0.60 1.00 0.03 0.00 -1.00 0.00 0.00 55.97 56.59 1ytq s LYS 17 Cb -0.13 0.28 0.00 0.00 -2.06 0.00 0.00 37.83 35.92 1ytq s LYS 17 CO 0.44 -0.30 -0.09 -1.50 0.10 0.00 0.00 175.35 174.00 1ytq s ILE 18 N 2.62 0.80 -0.18 3.79 2.07 -0.91 -0.95 121.20 128.44 1ytq s ILE 18 Ca 0.00 -0.37 -0.01 0.00 -1.41 0.00 0.00 60.65 58.86 1ytq s ILE 18 Cb -0.12 -0.71 0.00 0.00 0.13 0.00 0.00 42.46 41.76 1ytq s ILE 18 CO -0.13 0.25 -0.14 -0.63 -1.91 0.00 0.00 174.94 172.38 1ytq s ILE 19 N 0.18 2.68 -0.10 2.00 1.01 0.86 -0.79 121.20 127.04 1ytq s ILE 19 Ca -0.03 -0.75 -0.03 0.00 0.00 0.00 0.00 60.65 59.84 1ytq s ILE 19 Cb -0.09 -2.15 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 1ytq s ILE 19 CO 0.00 0.50 0.03 0.27 0.00 0.00 0.00 174.94 175.75 1ytq s ILE 20 N 1.07 4.56 0.12 2.92 -4.36 -0.74 -0.50 121.20 124.28 1ytq s ILE 20 Ca -0.00 -0.15 0.10 0.00 -0.26 0.00 0.00 60.65 60.34 1ytq s ILE 20 Cb -0.14 -2.95 -0.04 0.00 1.25 0.00 0.00 42.46 40.58 1ytq s ILE 20 CO -0.04 0.59 -0.22 -0.36 0.24 0.00 0.00 174.94 175.15 1ytq s PHE 21 N -0.77 2.43 0.08 1.37 0.40 -0.15 -1.28 117.98 120.06 1ytq s PHE 21 Ca 0.12 -0.31 -0.28 0.00 -0.60 0.00 0.00 56.93 55.85 1ytq s PHE 21 Cb -0.12 -1.30 -0.17 0.00 0.51 0.00 0.00 43.02 41.94 1ytq s PHE 21 CO 0.02 0.37 1.68 0.93 0.70 0.00 0.00 175.22 178.92 1ytq h GLU 22 N 3.78 -0.48 -6.34 0.44 5.08 -1.01 0.13 114.58 116.17 1ytq h GLU 22 Ca -0.50 0.03 -0.48 0.00 -1.00 0.00 0.00 59.36 57.41 1ytq h GLU 22 Cb 1.17 0.11 -0.00 0.00 0.50 0.00 0.00 28.75 30.53 1ytq h GLU 22 CO 0.43 -0.32 -0.27 -0.65 -1.00 0.00 0.00 179.01 177.20 1ytq s GLN 23 N -6.12 2.56 0.77 2.33 -0.21 -0.91 -1.61 119.66 116.48 1ytq s GLN 23 Ca -0.16 -1.51 -0.11 0.00 0.02 0.00 0.00 55.36 53.61 1ytq s GLN 23 Cb 0.05 -2.54 0.06 0.00 1.00 0.00 0.00 33.01 31.58 1ytq s GLN 23 CO 0.64 -0.40 1.09 -1.83 -2.12 0.00 0.00 175.29 172.66 1ytq s GLU 24 N -4.33 2.26 -1.46 2.91 -1.05 -1.26 -2.63 118.70 113.14 1ytq s GLU 24 Ca 0.52 1.11 -0.05 0.00 -0.15 0.00 0.00 54.97 56.39 1ytq s GLU 24 Cb -0.06 -1.90 0.02 0.00 -0.44 0.00 0.00 34.13 31.75 1ytq s GLU 24 CO 0.31 -1.62 0.47 0.09 0.95 0.00 0.00 175.26 175.46 1ytq n ASN 25 N -3.50 -5.23 -3.46 0.83 5.03 0.33 -3.31 115.26 105.95 1ytq n ASN 25 Ca 0.09 -0.25 -0.19 0.00 0.87 0.00 0.00 54.58 55.09 1ytq n ASN 25 Cb 0.53 -4.27 0.09 0.00 -1.02 0.00 0.00 39.78 35.11 1ytq n ASN 25 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1ytq n PHE 26 N -4.21 -2.42 -4.28 3.10 3.01 -1.25 -5.01 117.46 106.39 1ytq n PHE 26 Ca -0.10 0.96 -0.25 0.00 1.01 0.00 0.00 57.45 59.07 1ytq n PHE 26 Cb 0.60 -5.04 -0.08 0.00 -0.01 0.00 0.00 39.48 34.95 1ytq n PHE 26 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 1ytq s GLN 27 N -5.69 2.14 1.90 -1.08 -1.52 -1.21 -5.04 119.66 109.17 1ytq s GLN 27 Ca 0.21 -1.86 0.00 0.00 -1.95 0.00 0.00 55.36 51.76 1ytq s GLN 27 Cb -0.09 -1.91 0.00 0.00 -0.22 0.00 0.00 33.01 30.79 1ytq s GLN 27 CO 0.72 -0.03 0.00 0.41 -0.25 0.00 0.00 175.29 176.15 1ytq n GLY 28 N -1.11 -1.34 3.77 3.09 0.00 -1.26 -2.13 105.19 106.21 1ytq n GLY 28 Ca -0.03 -1.27 -0.40 0.00 0.00 0.00 0.00 46.02 44.32 1ytq n GLY 28 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ytq s HIS 29 N 0.00 3.22 0.13 1.61 5.65 -1.26 -4.72 115.29 119.92 1ytq s HIS 29 Ca 0.00 1.52 0.08 0.00 0.25 0.00 0.00 55.06 56.90 1ytq s HIS 29 Cb 0.00 -3.54 -0.04 0.00 -1.18 0.00 0.00 32.58 27.82 1ytq s HIS 29 CO 0.00 -1.41 -0.18 -1.54 -0.65 0.00 0.00 174.74 170.96 1ytq s SER 30 N -0.65 2.49 -0.05 9.88 1.04 -1.26 -0.82 113.70 124.34 1ytq s SER 30 Ca 0.48 -0.78 -0.02 0.00 0.48 0.00 0.00 55.95 56.11 1ytq s SER 30 Cb -0.37 -0.13 0.03 0.00 0.10 0.00 0.00 66.02 65.65 1ytq s SER 30 CO 0.48 -0.02 0.09 -2.28 0.98 0.00 0.00 173.24 172.49 1ytq s HIS 31 N -1.72 -0.04 -0.15 5.02 2.46 -0.40 -4.98 115.29 115.47 1ytq s HIS 31 Ca 0.11 0.32 -0.18 0.00 0.47 0.00 0.00 55.06 55.78 1ytq s HIS 31 Cb -0.07 -0.25 -0.04 0.00 -0.13 0.00 0.00 32.58 32.09 1ytq s HIS 31 CO 0.05 -0.16 0.48 -2.00 -2.47 0.00 0.00 174.74 170.64 1ytq s GLU 32 N 1.51 4.28 -0.15 2.88 2.12 -1.26 -1.78 118.70 126.29 1ytq s GLU 32 Ca -0.04 0.40 -0.04 0.00 0.36 0.00 0.00 54.97 55.65 1ytq s GLU 32 Cb -0.12 -3.48 -0.03 0.00 0.26 0.00 0.00 34.13 30.76 1ytq s GLU 32 CO -0.04 0.05 -0.03 -0.51 -0.54 0.00 0.00 175.26 174.19 1ytq s LEU 33 N 0.99 3.32 -0.09 2.70 1.43 0.03 -4.98 118.68 122.08 1ytq s LEU 33 Ca 0.24 -0.10 0.13 0.00 -1.03 0.00 0.00 54.13 53.38 1ytq s LEU 33 Cb -0.15 -1.80 0.34 0.00 0.03 0.00 0.00 46.19 44.60 1ytq s LEU 33 CO 0.10 0.18 1.25 0.59 0.23 0.00 0.00 176.35 178.70 1ytq n ASN 34 N 3.45 3.02 -2.58 2.29 3.02 -1.26 -2.15 115.26 121.05 1ytq n ASN 34 Ca -0.17 -2.58 -0.05 0.00 -0.03 0.00 0.00 54.58 51.75 1ytq n ASN 34 Cb 0.52 -0.35 0.02 0.00 -0.61 0.00 0.00 39.78 39.37 1ytq n ASN 34 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ytq n GLY 35 N -0.40 0.99 3.77 7.41 0.00 -1.26 -4.38 105.19 111.32 1ytq n GLY 35 Ca 0.14 -1.15 -0.39 0.00 0.00 0.00 0.00 46.02 44.62 1ytq n GLY 35 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ytq s PRO 36 N -2.05 4.13 -0.18 1.61 0.04 -1.26 -4.74 135.00 132.54 1ytq s PRO 36 Ca 0.15 1.95 -0.03 0.00 0.04 0.00 0.00 61.00 63.11 1ytq s PRO 36 Cb -0.03 -2.79 0.06 0.00 0.04 0.00 0.00 34.50 31.78 1ytq s PRO 36 CO 0.07 -0.29 0.03 0.00 0.04 0.00 0.00 177.00 176.85 1ytq n PRO 38 N 5.07 0.04 -3.45 0.00 -0.04 -1.26 -1.63 135.00 133.73 1ytq n PRO 38 Ca -0.09 0.07 -0.22 0.00 -0.04 0.00 0.00 63.50 63.22 1ytq n PRO 38 Cb 0.48 -1.55 -0.12 0.00 -0.04 0.00 0.00 33.50 32.26 1ytq n PRO 38 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1ytq s ASN 39 N -3.26 2.38 0.00 3.54 3.04 -1.24 -0.35 114.94 119.06 1ytq s ASN 39 Ca 0.13 -0.96 0.21 0.00 0.04 0.00 0.00 52.86 52.28 1ytq s ASN 39 Cb 0.17 0.18 1.04 0.00 -1.54 0.00 0.00 41.25 41.11 1ytq s ASN 39 CO 0.51 -0.41 1.69 0.18 -3.04 0.00 0.00 177.10 176.03 1ytq n LEU 40 N 5.29 0.00 0.21 3.21 4.77 0.80 -2.47 117.00 128.81 1ytq n LEU 40 Ca -0.04 0.33 0.05 0.00 -0.03 0.00 0.00 56.01 56.33 1ytq n LEU 40 Cb 0.45 -0.33 0.52 0.00 -2.33 0.00 0.00 43.42 41.72 1ytq n LEU 40 CO 0.02 -0.10 0.96 0.50 -1.33 0.00 0.00 177.39 177.44 1ytq h LYS 41 N 0.00 0.06 0.00 3.23 3.64 -1.80 -2.65 116.57 119.05 1ytq h LYS 41 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1ytq h LYS 41 Cb 0.24 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1ytq h LYS 41 CO 0.00 0.17 0.00 0.39 -2.27 0.00 0.00 179.45 177.74 1ytq n GLU 42 N -4.38 0.11 0.03 1.90 1.02 -1.03 -2.83 120.64 115.46 1ytq n GLU 42 Ca -0.02 0.28 0.13 0.00 -0.02 0.00 0.00 57.16 57.52 1ytq n GLU 42 Cb 0.20 -1.68 0.38 0.00 -0.02 0.00 0.00 31.44 30.32 1ytq n GLU 42 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1ytq n THR 43 N -1.87 0.17 -0.14 2.62 -2.24 -1.00 -4.92 114.28 106.90 1ytq n THR 43 Ca 0.04 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 1ytq n THR 43 Cb 0.25 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1ytq n THR 43 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ytq n GLY 44 N 1.43 1.48 2.95 3.38 0.00 -1.13 -4.84 105.19 108.47 1ytq n GLY 44 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 1ytq n GLY 44 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ytq s VAL 45 N -2.71 3.20 0.21 1.61 1.01 -1.25 -4.94 120.40 117.53 1ytq s VAL 45 Ca 0.00 -4.15 -0.07 0.00 0.00 0.00 0.00 61.98 57.76 1ytq s VAL 45 Cb 0.00 -3.08 0.08 0.00 0.00 0.00 0.00 36.38 33.38 1ytq s VAL 45 CO 0.00 -1.01 1.67 -0.08 0.00 0.00 0.00 175.10 175.68 1ytq h GLU 46 N 5.58 0.98 -3.06 2.72 4.81 -1.82 -3.39 114.58 120.39 1ytq h GLU 46 Ca 0.14 -0.31 -0.56 0.00 -0.13 0.00 0.00 59.36 58.50 1ytq h GLU 46 Cb 0.77 -0.09 -0.40 0.00 0.63 0.00 0.00 28.75 29.66 1ytq h GLU 46 CO 0.75 0.97 -0.78 0.21 -0.73 0.00 0.00 179.01 179.43 1ytq s LYS 47 N -4.98 0.51 0.35 1.92 2.20 -1.26 -4.56 119.74 113.92 1ytq s LYS 47 Ca -0.11 -0.95 -0.28 0.00 -0.36 0.00 0.00 55.97 54.27 1ytq s LYS 47 Cb 0.14 -1.57 -0.11 0.00 -1.51 0.00 0.00 37.83 34.78 1ytq s LYS 47 CO 0.84 -1.04 1.37 0.00 -0.36 0.00 0.00 175.35 176.16 1ytq s ALA 48 N 1.65 3.53 -0.10 3.13 0.00 -1.26 -4.84 121.76 123.86 1ytq s ALA 48 Ca 0.11 1.37 0.15 0.00 0.00 0.00 0.00 51.96 53.60 1ytq s ALA 48 Cb -0.18 -3.53 -0.21 0.00 0.00 0.00 0.00 23.12 19.21 1ytq s ALA 48 CO -0.25 -0.79 0.61 0.41 0.00 0.00 0.00 175.76 175.74 1ytq n GLY 49 N 0.69 -1.07 3.26 0.00 0.00 0.45 -4.77 105.19 103.75 1ytq n GLY 49 Ca 0.00 -0.13 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 1ytq n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ytq s SER 50 N -5.82 -0.10 -0.03 1.61 1.04 -1.08 -2.62 113.70 106.71 1ytq s SER 50 Ca -0.05 -0.35 0.01 0.00 0.48 0.00 0.00 55.95 56.04 1ytq s SER 50 Cb 0.08 0.39 0.02 0.00 0.10 0.00 0.00 66.02 66.62 1ytq s SER 50 CO 0.82 -0.72 -0.00 -0.69 0.98 0.00 0.00 173.24 173.63 1ytq s VAL 51 N -3.28 0.20 -0.22 5.02 1.01 0.43 -0.98 120.40 122.59 1ytq s VAL 51 Ca 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 1ytq s VAL 51 Cb 0.02 -0.28 0.02 0.00 0.00 0.00 0.00 36.38 36.13 1ytq s VAL 51 CO -0.08 0.14 -0.11 -0.22 0.00 0.00 0.00 175.10 174.83 1ytq s LEU 52 N 0.92 2.77 -0.27 3.92 2.96 0.34 -0.77 118.68 128.56 1ytq s LEU 52 Ca -0.09 -0.73 -0.13 0.00 -0.22 0.00 0.00 54.13 52.95 1ytq s LEU 52 Cb -0.13 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 1ytq s LEU 52 CO -0.01 -0.06 0.27 -0.69 -1.32 0.00 0.00 176.35 174.54 1ytq s VAL 53 N 1.33 5.25 -0.14 1.68 1.01 -0.57 -0.10 120.40 128.86 1ytq s VAL 53 Ca 0.02 0.36 0.13 0.00 0.00 0.00 0.00 61.98 62.50 1ytq s VAL 53 Cb -0.15 -3.61 -0.18 0.00 0.00 0.00 0.00 36.38 32.44 1ytq s VAL 53 CO -0.07 0.22 0.06 0.00 0.00 0.00 0.00 175.10 175.30 1ytq n GLN 54 N 5.09 1.61 -3.46 2.72 6.02 -0.13 -1.68 117.38 127.56 1ytq n GLN 54 Ca -0.11 -0.01 -0.08 0.00 -0.01 0.00 0.00 57.00 56.78 1ytq n GLN 54 Cb 0.51 -1.37 -0.08 0.00 1.02 0.00 0.00 30.24 30.32 1ytq n GLN 54 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ytq s ALA 55 N -2.37 -1.18 0.00 -1.58 0.00 -0.60 -4.90 121.76 111.14 1ytq s ALA 55 Ca -0.07 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.07 1ytq s ALA 55 Cb 0.04 -1.57 0.00 0.00 0.00 0.00 0.00 23.12 21.60 1ytq s ALA 55 CO 0.59 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.69 1ytq n GLY 56 N 5.38 5.53 3.87 0.00 0.00 -1.26 -0.08 105.19 118.63 1ytq n GLY 56 Ca -0.05 -1.09 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 1ytq n GLY 56 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ytq s PRO 57 N 3.34 3.47 0.30 1.61 0.04 -1.26 -4.96 135.00 137.53 1ytq s PRO 57 Ca 0.00 0.71 0.10 0.00 0.04 0.00 0.00 61.00 61.85 1ytq s PRO 57 Cb 0.00 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 1ytq s PRO 57 CO 0.00 -0.66 -0.09 -1.58 0.04 0.00 0.00 177.00 174.72 1ytq s TRP 58 N -3.20 2.46 -0.16 0.56 0.52 0.54 -1.16 118.94 118.49 1ytq s TRP 58 Ca 0.56 -0.36 0.00 0.00 0.02 0.00 0.00 56.10 56.32 1ytq s TRP 58 Cb -0.11 -1.22 0.03 0.00 -1.15 0.00 0.00 33.47 31.02 1ytq s TRP 58 CO 0.54 0.62 -0.10 0.54 0.02 0.00 0.00 176.95 178.56 1ytq s VAL 59 N -2.48 1.41 0.25 4.03 0.11 -0.25 -0.43 120.40 123.03 1ytq s VAL 59 Ca 0.32 -0.68 0.02 0.00 -2.93 0.00 0.00 61.98 58.70 1ytq s VAL 59 Cb -0.03 -1.43 -0.04 0.00 -1.53 0.00 0.00 36.38 33.35 1ytq s VAL 59 CO 0.17 0.29 0.42 -0.83 -3.33 0.00 0.00 175.10 171.82 1ytq s GLY 60 N 1.53 1.48 0.11 6.54 0.00 0.12 -2.33 107.32 114.76 1ytq s GLY 60 Ca 0.02 -0.99 0.05 0.00 0.00 0.00 0.00 44.72 43.81 1ytq s GLY 60 CO -0.09 -0.96 -0.14 -0.19 0.00 0.00 0.00 173.10 171.72 1ytq s TYR 61 N -2.02 1.32 0.11 1.90 1.51 0.18 -0.64 117.35 119.70 1ytq s TYR 61 Ca 0.37 -0.55 -0.21 0.00 -1.01 0.00 0.00 57.07 55.67 1ytq s TYR 61 Cb -0.10 -0.70 -0.10 0.00 -0.11 0.00 0.00 41.96 40.95 1ytq s TYR 61 CO 0.31 0.10 1.75 1.49 -1.11 0.00 0.00 175.55 178.10 1ytq h GLU 62 N 3.70 0.12 -6.04 -0.62 4.81 -1.10 -1.29 114.58 114.16 1ytq h GLU 62 Ca -0.40 -0.01 -0.54 0.00 -0.13 0.00 0.00 59.36 58.28 1ytq h GLU 62 Cb 1.19 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.48 1ytq h GLU 62 CO 0.48 0.08 -0.49 -0.65 -0.73 0.00 0.00 179.01 177.70 1ytq s GLN 63 N -6.18 2.36 0.77 1.92 -0.21 -0.22 -3.29 119.66 114.81 1ytq s GLN 63 Ca -0.13 -1.64 -0.12 0.00 0.02 0.00 0.00 55.36 53.49 1ytq s GLN 63 Cb 0.08 -2.15 0.06 0.00 1.00 0.00 0.00 33.01 32.00 1ytq s GLN 63 CO 0.68 -0.02 1.12 0.00 -2.12 0.00 0.00 175.29 174.94 1ytq s ALA 64 N -2.49 2.15 -1.45 6.09 0.00 -1.26 -3.42 121.76 121.37 1ytq s ALA 64 Ca 0.41 0.44 -0.04 0.00 0.00 0.00 0.00 51.96 52.77 1ytq s ALA 64 Cb -0.00 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1ytq s ALA 64 CO 0.24 -1.86 0.47 0.09 0.00 0.00 0.00 175.76 174.70 1ytq n ASN 65 N -3.36 -5.70 -3.46 0.00 3.02 0.53 -3.50 115.26 102.80 1ytq n ASN 65 Ca 0.10 -0.22 -0.18 0.00 -0.03 0.00 0.00 54.58 54.25 1ytq n ASN 65 Cb 0.52 -4.56 0.07 0.00 -0.61 0.00 0.00 39.78 35.21 1ytq n ASN 65 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ytq s LYS 67 N -5.28 1.35 1.54 0.00 -0.14 -1.22 -5.04 119.74 110.95 1ytq s LYS 67 Ca 0.15 -1.61 0.00 0.00 -1.36 0.00 0.00 55.97 53.15 1ytq s LYS 67 Cb -0.03 -1.11 0.00 0.00 -1.68 0.00 0.00 37.83 35.01 1ytq s LYS 67 CO 0.76 0.16 0.00 0.41 -0.76 0.00 0.00 175.35 175.92 1ytq n GLY 68 N -0.40 -0.58 3.77 -3.33 0.00 -1.26 -1.06 105.19 102.33 1ytq n GLY 68 Ca -0.08 -1.48 -0.37 0.00 0.00 0.00 0.00 46.02 44.10 1ytq n GLY 68 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ytq s GLU 69 N 0.00 3.85 -0.08 1.61 2.12 -1.26 -4.73 118.70 120.21 1ytq s GLU 69 Ca 0.00 1.78 0.01 0.00 0.36 0.00 0.00 54.97 57.12 1ytq s GLU 69 Cb 0.00 -2.48 -0.03 0.00 0.26 0.00 0.00 34.13 31.88 1ytq s GLU 69 CO 0.00 -0.47 -0.08 -0.65 -0.54 0.00 0.00 175.26 173.52 1ytq s GLN 70 N -2.59 2.82 -0.10 4.30 -0.21 -1.26 -1.09 119.66 121.52 1ytq s GLN 70 Ca 0.62 -0.57 -0.00 0.00 0.02 0.00 0.00 55.36 55.42 1ytq s GLN 70 Cb -0.29 -2.59 0.02 0.00 1.00 0.00 0.00 33.01 31.16 1ytq s GLN 70 CO 0.35 0.60 -0.07 -0.06 -2.12 0.00 0.00 175.29 174.00 1ytq s PHE 71 N -0.65 1.36 -0.25 0.91 0.08 0.18 -4.99 117.98 114.63 1ytq s PHE 71 Ca 0.10 -0.63 -0.20 0.00 0.12 0.00 0.00 56.93 56.32 1ytq s PHE 71 Cb -0.11 -1.15 -0.02 0.00 -0.57 0.00 0.00 43.02 41.17 1ytq s PHE 71 CO 0.02 -0.46 0.60 0.08 -0.10 0.00 0.00 175.22 175.36 1ytq s VAL 72 N 1.61 5.01 -0.20 -0.44 1.01 -1.26 0.12 120.40 126.26 1ytq s VAL 72 Ca 0.03 1.08 -0.07 0.00 0.00 0.00 0.00 61.98 63.02 1ytq s VAL 72 Cb -0.13 -3.91 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1ytq s VAL 72 CO -0.06 0.06 0.05 -0.36 0.00 0.00 0.00 175.10 174.78 1ytq s PHE 73 N 2.34 3.16 0.36 5.22 0.40 0.42 -4.98 117.98 124.92 1ytq s PHE 73 Ca 0.25 -0.12 0.08 0.00 -0.60 0.00 0.00 56.93 56.55 1ytq s PHE 73 Cb -0.16 -2.10 -0.06 0.00 0.51 0.00 0.00 43.02 41.22 1ytq s PHE 73 CO 0.09 -0.01 0.04 -1.21 0.70 0.00 0.00 175.22 174.82 1ytq s GLU 74 N 0.70 2.07 -0.13 0.44 2.02 -1.26 -0.34 118.70 122.20 1ytq s GLU 74 Ca 0.02 -1.83 -0.35 0.00 0.02 0.00 0.00 54.97 52.83 1ytq s GLU 74 Cb -0.13 -1.88 -0.12 0.00 0.10 0.00 0.00 34.13 32.09 1ytq s GLU 74 CO 0.02 0.06 1.88 1.17 0.02 0.00 0.00 175.26 178.40 1ytq n LYS 75 N -1.00 1.99 -1.96 1.61 4.81 -1.26 -4.57 118.16 117.78 1ytq n LYS 75 Ca -0.04 0.73 0.00 0.00 -0.87 0.00 0.00 58.31 58.13 1ytq n LYS 75 Cb 0.64 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 33.12 1ytq n LYS 75 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ytq n GLY 76 N 4.45 0.23 3.28 3.14 0.00 -0.67 -4.97 105.19 110.65 1ytq n GLY 76 Ca 0.24 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.41 1ytq n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ytq s GLU 77 N -2.00 3.26 -0.50 1.61 2.02 -1.26 -1.51 118.70 120.32 1ytq s GLU 77 Ca 0.00 -0.72 0.02 0.00 0.02 0.00 0.00 54.97 54.29 1ytq s GLU 77 Cb 0.00 -2.69 0.13 0.00 0.10 0.00 0.00 34.13 31.67 1ytq s GLU 77 CO 0.00 0.01 0.26 0.71 0.02 0.00 0.00 175.26 176.25 1ytq s TYR 78 N 0.86 3.36 -1.07 1.61 1.51 0.05 -5.00 117.35 118.68 1ytq s TYR 78 Ca -0.04 -3.01 0.29 0.00 -1.01 0.00 0.00 57.07 53.30 1ytq s TYR 78 Cb -0.15 -2.94 1.19 0.00 -0.11 0.00 0.00 41.96 39.94 1ytq s TYR 78 CO -0.00 -0.81 1.88 -0.35 -1.11 0.00 0.00 175.55 175.16 1ytq n PRO 79 N 3.48 0.07 -4.21 -1.71 -0.04 -1.26 -0.43 135.00 130.90 1ytq n PRO 79 Ca 0.05 -0.01 -0.12 0.00 -0.04 0.00 0.00 63.50 63.38 1ytq n PRO 79 Cb 0.36 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.22 1ytq n PRO 79 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1ytq s ARG 80 N -2.93 1.17 0.22 0.54 0.52 -1.24 -0.51 118.95 116.72 1ytq s ARG 80 Ca 0.16 -1.60 -0.06 0.00 -0.52 0.00 0.00 55.73 53.71 1ytq s ARG 80 Cb 0.19 0.11 0.20 0.00 0.52 0.00 0.00 34.95 35.97 1ytq s ARG 80 CO 0.54 -0.32 1.71 0.11 0.02 0.00 0.00 175.30 177.36 1ytq h TRP 81 N 2.64 1.02 -0.00 -0.53 5.08 -1.80 -2.99 115.95 119.36 1ytq h TRP 81 Ca -0.36 -0.15 0.00 0.00 1.08 0.00 0.00 58.89 59.45 1ytq h TRP 81 Cb 1.23 -0.27 0.00 0.00 -3.00 0.00 0.00 29.16 27.12 1ytq h TRP 81 CO 0.41 0.91 -0.01 -0.40 -1.28 0.00 0.00 178.44 178.06 1ytq n ASP 82 N -4.20 0.05 0.21 0.11 5.75 -1.26 -3.50 116.55 113.71 1ytq n ASP 82 Ca 0.03 -0.21 0.10 0.00 -0.01 0.00 0.00 54.79 54.70 1ytq n ASP 82 Cb 0.32 -0.25 0.36 0.00 -1.03 0.00 0.00 41.12 40.52 1ytq n ASP 82 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 1ytq h SER 83 N 0.05 0.00 -0.01 -1.12 4.64 -1.91 -3.31 113.55 111.89 1ytq h SER 83 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ytq h SER 83 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1ytq h SER 83 CO 0.00 0.23 -0.13 -2.67 -0.87 0.00 0.00 176.83 173.39 1ytq n TRP 84 N -3.29 0.00 -3.95 4.77 2.14 -1.23 -5.00 117.44 110.88 1ytq n TRP 84 Ca 0.01 0.00 -0.12 0.00 2.07 0.00 0.00 57.50 59.46 1ytq n TRP 84 Cb 0.49 0.00 -0.13 0.00 -0.81 0.00 0.00 31.31 30.85 1ytq n TRP 84 CO 0.00 0.00 0.00 -0.08 2.07 0.00 0.00 177.69 179.68 1ytq s THR 85 N -1.18 0.11 -0.02 -1.67 -1.32 -1.25 -4.70 115.64 105.61 1ytq s THR 85 Ca 0.10 -0.23 0.10 0.00 -1.21 0.00 0.00 61.69 60.45 1ytq s THR 85 Cb 0.08 -0.13 -0.16 0.00 -1.51 0.00 0.00 72.50 70.79 1ytq s THR 85 CO 0.21 -0.07 0.20 -1.20 -2.21 0.00 0.00 174.62 171.55 1ytq n SER 86 N 2.75 2.65 -3.99 8.08 7.64 -1.26 -4.73 113.62 124.75 1ytq n SER 86 Ca -0.14 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.43 1ytq n SER 86 Cb 0.59 1.39 -0.15 0.00 -1.01 0.00 0.00 64.21 65.02 1ytq n SER 86 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1ytq s SER 87 N -3.30 4.59 -1.00 6.43 0.15 -1.26 -5.06 113.70 114.24 1ytq s SER 87 Ca -0.04 -1.92 -0.18 0.00 0.70 0.00 0.00 55.95 54.51 1ytq s SER 87 Cb 0.06 -1.51 0.14 0.00 -1.71 0.00 0.00 66.02 63.00 1ytq s SER 87 CO 0.42 -0.34 1.22 -0.60 1.20 0.00 0.00 173.24 175.14 1ytq s ARG 88 N 1.04 3.72 0.16 5.44 3.52 -1.26 -4.55 118.95 127.02 1ytq s ARG 88 Ca 0.07 -1.95 -0.08 0.00 -0.13 0.00 0.00 55.73 53.63 1ytq s ARG 88 Cb -0.19 -4.97 0.02 0.00 -1.56 0.00 0.00 34.95 28.25 1ytq s ARG 88 CO -0.09 -1.79 1.49 0.00 -0.81 0.00 0.00 175.30 174.10 1ytq h ARG 89 N 8.43 0.81 -4.27 5.12 3.08 -2.02 -3.48 114.38 122.05 1ytq h ARG 89 Ca 0.20 -0.45 -0.16 0.00 0.07 0.00 0.00 59.98 59.64 1ytq h ARG 89 Cb 0.98 0.03 -0.14 0.00 0.08 0.00 0.00 29.97 30.92 1ytq h ARG 89 CO 1.15 1.08 -0.57 0.95 -1.07 0.00 0.00 179.97 181.52 1ytq s THR 90 N -4.27 0.10 -0.24 2.04 -4.23 -1.26 -5.03 115.64 102.75 1ytq s THR 90 Ca -0.10 -1.76 0.12 0.00 -1.18 0.00 0.00 61.69 58.77 1ytq s THR 90 Cb 0.11 -1.95 0.49 0.00 1.34 0.00 0.00 72.50 72.50 1ytq s THR 90 CO 0.87 -0.46 1.41 -0.90 -0.54 0.00 0.00 174.62 175.00 1ytq n ASP 91 N -0.11 2.88 -4.79 3.99 5.75 -1.26 -5.04 116.55 117.98 1ytq n ASP 91 Ca -0.07 -3.47 -0.39 0.00 -0.01 0.00 0.00 54.79 50.85 1ytq n ASP 91 Cb 0.63 -0.58 -0.06 0.00 -1.03 0.00 0.00 41.12 40.08 1ytq n ASP 91 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1ytq s SER 92 N -2.41 7.28 -0.27 -1.12 0.01 -1.26 -4.84 113.70 111.09 1ytq s SER 92 Ca 0.42 1.51 -0.03 0.00 1.31 0.00 0.00 55.95 59.17 1ytq s SER 92 Cb 0.37 -2.45 0.09 0.00 0.21 0.00 0.00 66.02 64.24 1ytq s SER 92 CO 0.03 0.23 0.10 -0.22 0.41 0.00 0.00 173.24 173.79 1ytq s LEU 93 N -1.12 1.03 -0.01 2.44 2.96 -1.26 -4.28 118.68 118.45 1ytq s LEU 93 Ca 0.33 -1.24 0.06 0.00 -0.22 0.00 0.00 54.13 53.07 1ytq s LEU 93 Cb -0.22 -0.50 -0.08 0.00 0.50 0.00 0.00 46.19 45.89 1ytq s LEU 93 CO 0.24 -0.41 0.17 -1.20 -1.32 0.00 0.00 176.35 173.83 1ytq n SER 94 N 5.12 2.46 -3.77 3.68 7.64 -0.49 -4.50 113.62 123.77 1ytq n SER 94 Ca -0.05 -0.22 -0.13 0.00 1.01 0.00 0.00 58.87 59.47 1ytq n SER 94 Cb 0.44 1.17 -0.08 0.00 -1.01 0.00 0.00 64.21 64.73 1ytq n SER 94 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ytq s SER 95 N -2.28 -0.16 0.01 6.43 1.04 -1.22 -0.14 113.70 117.39 1ytq s SER 95 Ca -0.01 0.01 -0.02 0.00 0.48 0.00 0.00 55.95 56.42 1ytq s SER 95 Cb 0.04 0.31 -0.01 0.00 0.10 0.00 0.00 66.02 66.46 1ytq s SER 95 CO 0.24 -0.48 0.01 -0.76 0.98 0.00 0.00 173.24 173.24 1ytq s LEU 96 N -1.47 2.06 -0.04 2.42 1.43 -0.64 -0.65 118.68 121.78 1ytq s LEU 96 Ca -0.12 -0.37 -0.20 0.00 -1.03 0.00 0.00 54.13 52.41 1ytq s LEU 96 Cb -0.04 0.22 0.04 0.00 0.03 0.00 0.00 46.19 46.44 1ytq s LEU 96 CO 0.03 -0.28 0.45 0.00 0.23 0.00 0.00 176.35 176.77 1ytq s ARG 97 N -1.27 0.78 0.26 1.70 1.70 -0.98 -0.59 118.95 120.55 1ytq s ARG 97 Ca -0.14 0.04 -0.29 0.00 -0.47 0.00 0.00 55.73 54.87 1ytq s ARG 97 Cb -0.08 0.36 -0.09 0.00 -0.57 0.00 0.00 34.95 34.56 1ytq s ARG 97 CO -0.00 -0.22 1.14 -2.14 -1.08 0.00 0.00 175.30 173.00 1ytq s PRO 98 N -1.11 4.58 -0.23 3.89 0.02 -1.26 -1.09 135.00 139.79 1ytq s PRO 98 Ca -0.11 1.87 -0.26 0.00 0.02 0.00 0.00 61.00 62.52 1ytq s PRO 98 Cb -0.03 -3.19 -0.00 0.00 0.02 0.00 0.00 34.50 31.30 1ytq s PRO 98 CO 0.06 0.10 0.88 0.42 -0.33 0.00 0.00 177.00 178.13 1ytq s ILE 99 N -0.92 4.80 -1.05 2.83 1.01 -0.31 -4.87 121.20 122.70 1ytq s ILE 99 Ca 0.47 1.68 -0.22 0.00 0.00 0.00 0.00 60.65 62.57 1ytq s ILE 99 Cb -0.33 -4.16 0.04 0.00 0.01 0.00 0.00 42.46 38.01 1ytq s ILE 99 CO 0.41 -0.09 1.57 -0.54 0.00 0.00 0.00 174.94 176.29 1ytq s LYS 100 N 2.87 3.50 0.06 2.79 1.02 -1.26 -4.65 119.74 124.05 1ytq s LYS 100 Ca 0.37 -1.15 -0.31 0.00 0.02 0.00 0.00 55.97 54.90 1ytq s LYS 100 Cb -0.15 -5.35 -0.06 0.00 -0.52 0.00 0.00 37.83 31.75 1ytq s LYS 100 CO 0.07 -2.41 1.34 0.08 -0.92 0.00 0.00 175.35 173.52 1ytq s VAL 101 N 5.65 3.66 -0.75 3.17 1.01 -1.26 -4.98 120.40 126.90 1ytq s VAL 101 Ca 0.51 1.14 -0.17 0.00 0.00 0.00 0.00 61.98 63.46 1ytq s VAL 101 Cb -0.00 -3.73 0.15 0.00 0.00 0.00 0.00 36.38 32.80 1ytq s VAL 101 CO -0.06 0.05 0.81 -0.62 0.00 0.00 0.00 175.10 175.29 1ytq s ASP 102 N 1.37 6.50 -0.48 3.32 3.68 -1.26 -4.97 116.67 124.83 1ytq s ASP 102 Ca 0.63 -2.06 0.03 0.00 2.13 0.00 0.00 52.55 53.28 1ytq s ASP 102 Cb -0.33 -2.28 0.14 0.00 -1.45 0.00 0.00 42.92 39.00 1ytq s ASP 102 CO 0.28 -0.89 0.28 -0.55 0.13 0.00 0.00 175.17 174.43 1ytq s SER 103 N 3.10 3.63 0.38 -0.34 0.15 -1.26 -5.11 113.70 114.25 1ytq s SER 103 Ca 0.18 -2.85 -0.26 0.00 0.70 0.00 0.00 55.95 53.72 1ytq s SER 103 Cb -0.15 -1.10 -0.09 0.00 -1.71 0.00 0.00 66.02 62.98 1ytq s SER 103 CO -0.03 -0.23 1.15 -1.10 1.20 0.00 0.00 173.24 174.23 1ytq s GLN 104 N 0.05 4.16 0.01 5.44 -1.52 -1.26 -5.07 119.66 121.48 1ytq s GLN 104 Ca 0.20 1.82 -0.02 0.00 -1.95 0.00 0.00 55.36 55.41 1ytq s GLN 104 Cb -0.19 -2.75 -0.01 0.00 -0.22 0.00 0.00 33.01 29.84 1ytq s GLN 104 CO -0.04 -0.22 0.03 -1.83 -0.25 0.00 0.00 175.29 172.98 1ytq s GLU 105 N -2.18 0.30 -0.39 2.91 -1.05 -1.26 -5.13 118.70 111.90 1ytq s GLU 105 Ca 0.55 -0.42 -0.18 0.00 -0.15 0.00 0.00 54.97 54.76 1ytq s GLU 105 Cb -0.30 0.12 0.01 0.00 -0.44 0.00 0.00 34.13 33.51 1ytq s GLU 105 CO 0.38 -0.06 0.51 -1.01 0.95 0.00 0.00 175.26 176.04 1ytq s HIS 106 N -1.14 3.15 -0.08 4.83 3.76 -1.26 -4.75 115.29 119.79 1ytq s HIS 106 Ca -0.12 -0.07 0.05 0.00 -0.15 0.00 0.00 55.06 54.76 1ytq s HIS 106 Cb -0.07 -3.00 -0.01 0.00 1.11 0.00 0.00 32.58 30.61 1ytq s HIS 106 CO -0.00 -0.66 -0.24 0.21 -0.85 0.00 0.00 174.74 173.20 1ytq s LYS 107 N 2.39 2.84 -0.04 1.40 2.20 -0.54 -0.07 119.74 127.92 1ytq s LYS 107 Ca 0.17 -0.88 0.02 0.00 -0.36 0.00 0.00 55.97 54.92 1ytq s LYS 107 Cb -0.16 -2.26 0.01 0.00 -1.51 0.00 0.00 37.83 33.91 1ytq s LYS 107 CO 0.15 0.28 -0.09 -1.50 -0.36 0.00 0.00 175.35 173.83 1ytq s ILE 108 N 0.09 0.80 -0.18 5.43 2.07 -0.65 -1.60 121.20 127.17 1ytq s ILE 108 Ca -0.11 -0.32 0.01 0.00 -1.41 0.00 0.00 60.65 58.81 1ytq s ILE 108 Cb -0.16 -0.75 0.02 0.00 0.13 0.00 0.00 42.46 41.70 1ytq s ILE 108 CO 0.06 0.27 -0.19 -0.63 -1.91 0.00 0.00 174.94 172.54 1ytq s ILE 109 N 0.52 2.14 -0.12 2.00 1.01 -0.18 -1.02 121.20 125.55 1ytq s ILE 109 Ca -0.09 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 59.60 1ytq s ILE 109 Cb -0.12 -1.91 -0.03 0.00 0.01 0.00 0.00 42.46 40.41 1ytq s ILE 109 CO 0.01 0.52 -0.02 -0.76 0.00 0.00 0.00 174.94 174.69 1ytq s LEU 110 N 1.30 3.37 0.18 2.97 1.02 -0.87 -0.70 118.68 125.95 1ytq s LEU 110 Ca 0.05 -0.01 0.10 0.00 0.02 0.00 0.00 54.13 54.28 1ytq s LEU 110 Cb -0.13 -1.79 -0.04 0.00 0.02 0.00 0.00 46.19 44.25 1ytq s LEU 110 CO -0.12 0.27 -0.15 -0.31 0.02 0.00 0.00 176.35 176.06 1ytq s TYR 111 N -0.23 2.53 0.01 0.29 1.51 0.57 -1.27 117.35 120.75 1ytq s TYR 111 Ca 0.05 -0.26 -0.25 0.00 -1.01 0.00 0.00 57.07 55.59 1ytq s TYR 111 Cb -0.13 -1.25 -0.18 0.00 -0.11 0.00 0.00 41.96 40.29 1ytq s TYR 111 CO 0.02 0.49 1.32 1.49 -1.11 0.00 0.00 175.55 177.76 1ytq h GLU 112 N 3.10 -0.17 -6.16 -0.62 4.81 -0.08 -1.33 114.58 114.13 1ytq h GLU 112 Ca -0.47 0.01 -0.53 0.00 -0.13 0.00 0.00 59.36 58.24 1ytq h GLU 112 Cb 1.20 0.04 -0.07 0.00 0.63 0.00 0.00 28.75 30.55 1ytq h GLU 112 CO 0.51 0.18 -0.56 -0.80 -0.73 0.00 0.00 179.01 177.61 1ytq s ASN 113 N -5.36 4.89 0.91 1.04 0.01 -0.60 -2.79 114.94 113.04 1ytq s ASN 113 Ca -0.15 -0.58 -0.10 0.00 -0.71 0.00 0.00 52.86 51.32 1ytq s ASN 113 Cb 0.02 -0.94 0.14 0.00 0.41 0.00 0.00 41.25 40.88 1ytq s ASN 113 CO 0.61 -0.15 1.13 -2.84 -1.51 0.00 0.00 177.10 174.34 1ytq s PRO 114 N -3.81 1.06 -1.36 -0.60 0.02 -1.26 -3.27 135.00 125.78 1ytq s PRO 114 Ca 0.35 1.41 -0.01 0.00 0.02 0.00 0.00 61.00 62.77 1ytq s PRO 114 Cb -0.05 -1.74 0.00 0.00 0.02 0.00 0.00 34.50 32.72 1ytq s PRO 114 CO 0.23 -2.55 0.09 -1.71 -0.33 0.00 0.00 177.00 172.72 1ytq n ASN 115 N -4.17 -4.91 -3.18 2.53 5.15 0.21 -3.53 115.26 107.37 1ytq n ASN 115 Ca 0.11 -0.05 -0.15 0.00 -0.60 0.00 0.00 54.58 53.88 1ytq n ASN 115 Cb 0.52 -3.97 0.08 0.00 -0.53 0.00 0.00 39.78 35.89 1ytq n ASN 115 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1ytq n PHE 116 N -4.06 -2.02 -4.40 1.20 3.72 -1.25 -5.03 117.46 105.63 1ytq n PHE 116 Ca -0.17 0.84 -0.19 0.00 -0.05 0.00 0.00 57.45 57.87 1ytq n PHE 116 Cb 0.64 -4.68 -0.10 0.00 -0.94 0.00 0.00 39.48 34.40 1ytq n PHE 116 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1ytq s THR 117 N -3.33 1.02 0.00 4.37 -4.23 -1.20 -5.06 115.64 107.21 1ytq s THR 117 Ca 0.06 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 1ytq s THR 117 Cb -0.01 -2.67 0.00 0.00 1.34 0.00 0.00 72.50 71.17 1ytq s THR 117 CO 0.66 -0.07 0.00 0.61 -0.54 0.00 0.00 174.62 175.28 1ytq n GLY 118 N -0.58 -1.47 3.77 3.99 0.00 -1.26 -1.56 105.19 108.07 1ytq n GLY 118 Ca -0.02 -1.32 -0.38 0.00 0.00 0.00 0.00 46.02 44.30 1ytq n GLY 118 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ytq s LYS 119 N 0.00 3.71 0.21 1.61 2.20 -1.26 -4.70 119.74 121.50 1ytq s LYS 119 Ca 0.00 1.93 0.03 0.00 -0.36 0.00 0.00 55.97 57.57 1ytq s LYS 119 Cb 0.00 -2.47 -0.05 0.00 -1.51 0.00 0.00 37.83 33.80 1ytq s LYS 119 CO 0.00 -0.64 -0.02 -1.59 -0.36 0.00 0.00 175.35 172.75 1ytq s LYS 120 N -2.62 1.25 -0.07 4.03 -2.85 -1.26 0.38 119.74 118.60 1ytq s LYS 120 Ca 0.63 -1.61 -0.03 0.00 -1.00 0.00 0.00 55.97 53.96 1ytq s LYS 120 Cb -0.33 -0.54 0.04 0.00 -2.06 0.00 0.00 37.83 34.95 1ytq s LYS 120 CO 0.40 -0.08 0.11 1.41 0.10 0.00 0.00 175.35 177.28 1ytq s MET 121 N -3.86 -0.02 -0.22 1.78 1.75 -0.40 -5.00 119.30 113.34 1ytq s MET 121 Ca 0.26 0.41 -0.18 0.00 -1.25 0.00 0.00 55.69 54.93 1ytq s MET 121 Cb 0.05 -0.53 -0.03 0.00 2.84 0.00 0.00 34.83 37.16 1ytq s MET 121 CO 0.07 -0.36 0.53 -1.21 -0.65 0.00 0.00 175.02 173.40 1ytq s GLU 122 N 2.22 4.15 -0.20 4.11 2.02 -1.26 -2.04 118.70 127.70 1ytq s GLU 122 Ca 0.04 0.41 -0.05 0.00 0.02 0.00 0.00 54.97 55.39 1ytq s GLU 122 Cb -0.12 -3.59 -0.02 0.00 0.10 0.00 0.00 34.13 30.49 1ytq s GLU 122 CO -0.05 -0.23 -0.01 0.42 0.02 0.00 0.00 175.26 175.42 1ytq s ILE 123 N 1.89 3.92 -0.23 -1.63 1.01 -0.19 -5.01 121.20 120.96 1ytq s ILE 123 Ca 0.24 -0.33 -0.01 0.00 0.00 0.00 0.00 60.65 60.55 1ytq s ILE 123 Cb -0.15 -2.76 0.02 0.00 0.01 0.00 0.00 42.46 39.58 1ytq s ILE 123 CO 0.09 0.44 -0.09 -0.63 0.00 0.00 0.00 174.94 174.75 1ytq s ILE 124 N 0.94 2.70 0.00 2.92 1.01 -1.26 -1.64 121.20 125.86 1ytq s ILE 124 Ca 0.01 -1.01 0.00 0.00 0.00 0.00 0.00 60.65 59.65 1ytq s ILE 124 Cb -0.14 -2.33 0.00 0.00 0.01 0.00 0.00 42.46 39.99 1ytq s ILE 124 CO 0.02 0.27 0.00 0.47 0.00 0.00 0.00 174.94 175.69 1ytq n ASP 125 N 4.65 0.00 -4.84 3.58 8.00 0.91 -4.91 116.55 123.93 1ytq n ASP 125 Ca -0.17 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.01 1ytq n ASP 125 Cb 0.47 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.59 1ytq n ASP 125 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1ytq s ASP 126 N 0.00 6.04 0.48 -2.24 1.01 -1.26 -4.76 116.67 115.94 1ytq s ASP 126 Ca 0.00 1.55 -0.20 0.00 0.71 0.00 0.00 52.55 54.61 1ytq s ASP 126 Cb 0.00 -2.49 -0.09 0.00 1.01 0.00 0.00 42.92 41.35 1ytq s ASP 126 CO 0.00 -0.99 1.02 -1.81 0.21 0.00 0.00 175.17 173.60 1ytq s ASP 127 N -3.67 6.44 -0.35 0.27 1.01 -1.26 -4.71 116.67 114.40 1ytq s ASP 127 Ca 0.58 1.85 0.00 0.00 0.71 0.00 0.00 52.55 55.69 1ytq s ASP 127 Cb -0.12 -2.55 0.11 0.00 1.01 0.00 0.00 42.92 41.37 1ytq s ASP 127 CO 0.47 -0.71 0.14 -0.69 0.21 0.00 0.00 175.17 174.59 1ytq s VAL 128 N -2.09 1.04 -0.92 -1.27 1.01 0.91 -5.00 120.40 114.07 1ytq s VAL 128 Ca 0.65 -1.76 0.23 0.00 0.00 0.00 0.00 61.98 61.11 1ytq s VAL 128 Cb -0.14 -1.77 0.21 0.00 0.00 0.00 0.00 36.38 34.67 1ytq s VAL 128 CO 0.20 -0.75 1.73 -0.81 0.00 0.00 0.00 175.10 175.48 1ytq n PRO 129 N 4.44 0.05 -3.53 2.72 -0.04 -1.26 -1.14 135.00 136.24 1ytq n PRO 129 Ca 0.02 0.15 -0.13 0.00 -0.04 0.00 0.00 63.50 63.50 1ytq n PRO 129 Cb 0.40 -1.57 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 1ytq n PRO 129 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ytq s SER 130 N -3.29 0.50 0.19 3.54 0.15 -1.25 -0.57 113.70 112.97 1ytq s SER 130 Ca 0.10 0.33 -0.04 0.00 0.70 0.00 0.00 55.95 57.04 1ytq s SER 130 Cb 0.14 0.82 0.11 0.00 -1.71 0.00 0.00 66.02 65.38 1ytq s SER 130 CO 0.44 -0.28 1.52 -0.26 1.20 0.00 0.00 173.24 175.86 1ytq h PHE 131 N 8.25 0.79 -0.09 3.44 0.05 -1.14 -3.10 116.94 125.14 1ytq h PHE 131 Ca -0.17 -0.26 -0.03 0.00 3.82 0.00 0.00 57.97 61.34 1ytq h PHE 131 Cb 1.13 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 38.92 1ytq h PHE 131 CO 0.23 1.00 -0.07 0.45 -0.18 0.00 0.00 178.31 179.73 1ytq h HIS 132 N 0.51 0.13 0.00 -0.55 3.86 -1.80 -1.65 115.15 115.66 1ytq h HIS 132 Ca 0.03 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1ytq h HIS 132 Cb 1.02 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 29.45 1ytq h HIS 132 CO 0.05 0.21 -0.03 0.00 0.86 0.00 0.00 177.93 179.02 1ytq h ALA 133 N 1.80 1.12 -0.59 2.45 0.00 -1.86 -0.90 119.26 121.28 1ytq h ALA 133 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ytq h ALA 133 Cb 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ytq h ALA 133 CO 0.01 0.04 0.00 0.72 0.00 0.00 0.00 179.25 180.02 1ytq n HIS 134 N -3.30 1.45 -1.00 0.00 -0.00 -0.80 -4.95 115.22 106.62 1ytq n HIS 134 Ca -0.02 -0.64 -0.00 0.00 -0.00 0.00 0.00 57.72 57.06 1ytq n HIS 134 Cb 0.17 -0.27 -0.00 0.00 -0.00 0.00 0.00 29.99 29.89 1ytq n HIS 134 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1ytq n GLY 135 N 0.91 0.39 3.34 -1.41 0.00 -0.34 -4.99 105.19 103.08 1ytq n GLY 135 Ca 0.25 -0.01 -0.46 0.00 0.00 0.00 0.00 46.02 45.80 1ytq n GLY 135 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ytq s TYR 136 N -1.77 3.26 -1.05 1.61 6.14 -0.69 -4.84 117.35 120.01 1ytq s TYR 136 Ca 0.00 -1.32 0.13 0.00 0.64 0.00 0.00 57.07 56.52 1ytq s TYR 136 Cb 0.00 -3.89 0.36 0.00 0.42 0.00 0.00 41.96 38.86 1ytq s TYR 136 CO 0.00 -1.12 1.30 1.04 0.64 0.00 0.00 175.55 177.41 1ytq n GLN 137 N 5.41 2.87 -2.14 4.97 6.02 -1.26 -2.93 117.38 130.31 1ytq n GLN 137 Ca -0.06 -2.17 -0.28 0.00 -0.01 0.00 0.00 57.00 54.48 1ytq n GLN 137 Cb 0.42 -1.33 0.06 0.00 1.02 0.00 0.00 30.24 30.40 1ytq n GLN 137 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1ytq s GLU 138 N -1.06 2.54 0.78 -1.09 8.01 -1.26 -5.07 118.70 121.55 1ytq s GLU 138 Ca 0.28 0.04 -0.11 0.00 0.01 0.00 0.00 54.97 55.19 1ytq s GLU 138 Cb 0.15 -2.13 0.06 0.00 -4.31 0.00 0.00 34.13 27.90 1ytq s GLU 138 CO 0.18 -1.08 1.09 -1.59 0.01 0.00 0.00 175.26 173.87 1ytq s LYS 139 N -5.24 2.19 -0.31 1.61 -2.85 -1.26 -4.85 119.74 109.02 1ytq s LYS 139 Ca 0.58 1.10 0.03 0.00 -1.00 0.00 0.00 55.97 56.68 1ytq s LYS 139 Cb -0.11 -1.89 0.08 0.00 -2.06 0.00 0.00 37.83 33.85 1ytq s LYS 139 CO 0.47 -1.67 -0.00 0.08 0.10 0.00 0.00 175.35 174.33 1ytq s VAL 140 N -2.93 2.32 -0.26 1.79 1.01 -0.82 -4.02 120.40 117.49 1ytq s VAL 140 Ca 0.61 -2.05 0.19 0.00 0.00 0.00 0.00 61.98 60.74 1ytq s VAL 140 Cb -0.17 -2.57 -0.27 0.00 0.00 0.00 0.00 36.38 33.37 1ytq s VAL 140 CO 0.56 -0.38 0.52 -1.20 0.00 0.00 0.00 175.10 174.60 1ytq n SER 141 N 4.34 0.67 -3.69 3.32 7.64 -0.50 -3.97 113.62 121.43 1ytq n SER 141 Ca -0.03 -0.26 -0.14 0.00 1.01 0.00 0.00 58.87 59.45 1ytq n SER 141 Cb 0.42 1.64 -0.07 0.00 -1.01 0.00 0.00 64.21 65.19 1ytq n SER 141 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ytq s SER 142 N -3.82 -0.29 -0.02 6.43 1.04 -1.22 0.04 113.70 115.86 1ytq s SER 142 Ca -0.03 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.55 1ytq s SER 142 Cb 0.13 0.39 0.02 0.00 0.10 0.00 0.00 66.02 66.65 1ytq s SER 142 CO 0.79 -0.55 0.01 -0.69 0.98 0.00 0.00 173.24 173.78 1ytq s VAL 143 N -1.74 0.06 -0.28 5.02 1.01 -0.12 -0.31 120.40 124.05 1ytq s VAL 143 Ca -0.10 0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.95 1ytq s VAL 143 Cb -0.03 -0.14 0.04 0.00 0.00 0.00 0.00 36.38 36.26 1ytq s VAL 143 CO 0.03 0.08 -0.04 -0.60 0.00 0.00 0.00 175.10 174.58 1ytq s ARG 144 N 0.67 2.53 -0.55 2.72 3.52 0.13 -0.36 118.95 127.62 1ytq s ARG 144 Ca -0.06 -1.19 -0.18 0.00 -0.13 0.00 0.00 55.73 54.17 1ytq s ARG 144 Cb -0.09 -3.08 0.09 0.00 -1.56 0.00 0.00 34.95 30.31 1ytq s ARG 144 CO -0.02 -0.54 0.63 0.08 -0.81 0.00 0.00 175.30 174.64 1ytq s VAL 145 N 1.25 4.91 0.04 7.11 1.01 -0.58 -1.01 120.40 133.14 1ytq s VAL 145 Ca -0.04 -0.87 -0.00 0.00 0.00 0.00 0.00 61.98 61.06 1ytq s VAL 145 Cb -0.19 -4.37 -0.26 0.00 0.00 0.00 0.00 36.38 31.56 1ytq s VAL 145 CO -0.03 -0.94 0.99 -0.61 0.00 0.00 0.00 175.10 174.52 1ytq h GLN 146 N 9.05 0.19 -1.94 2.72 4.15 -1.57 -1.41 115.11 126.29 1ytq h GLN 146 Ca -0.29 -0.32 -0.01 0.00 0.77 0.00 0.00 58.65 58.80 1ytq h GLN 146 Cb 1.09 0.12 -0.20 0.00 0.21 0.00 0.00 27.48 28.71 1ytq h GLN 146 CO 1.03 1.06 0.30 -1.54 -1.93 0.00 0.00 178.83 177.75 1ytq s SER 147 N -6.89 -0.57 0.00 -0.69 1.04 -0.87 -4.87 113.70 100.85 1ytq s SER 147 Ca -0.05 0.57 0.00 0.00 0.48 0.00 0.00 55.95 56.95 1ytq s SER 147 Cb 0.08 0.47 0.00 0.00 0.10 0.00 0.00 66.02 66.67 1ytq s SER 147 CO 0.85 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 175.13 1ytq n GLY 148 N 0.75 1.79 3.09 7.32 0.00 -1.26 -1.47 105.19 115.41 1ytq n GLY 148 Ca -0.16 -2.01 -0.32 0.00 0.00 0.00 0.00 46.02 43.52 1ytq n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ytq s THR 149 N -2.18 2.03 0.20 2.61 2.01 -1.26 -4.05 115.64 114.99 1ytq s THR 149 Ca 0.00 -1.12 0.10 0.00 0.31 0.00 0.00 61.69 60.98 1ytq s THR 149 Cb 0.00 -1.94 -0.04 0.00 0.01 0.00 0.00 72.50 70.52 1ytq s THR 149 CO 0.00 0.35 -0.20 0.26 -0.69 0.00 0.00 174.62 174.35 1ytq s TRP 150 N 1.26 2.01 -0.17 4.92 0.52 -0.33 0.54 118.94 127.68 1ytq s TRP 150 Ca 0.01 -0.43 0.01 0.00 0.02 0.00 0.00 56.10 55.70 1ytq s TRP 150 Cb -0.15 -0.97 0.03 0.00 -1.15 0.00 0.00 33.47 31.23 1ytq s TRP 150 CO -0.10 0.44 -0.13 0.08 0.02 0.00 0.00 176.95 177.26 1ytq s VAL 151 N -2.13 1.62 0.14 4.03 1.01 -0.23 -0.04 120.40 124.80 1ytq s VAL 151 Ca 0.20 -0.79 -0.10 0.00 0.00 0.00 0.00 61.98 61.29 1ytq s VAL 151 Cb -0.06 -1.59 -0.06 0.00 0.00 0.00 0.00 36.38 34.68 1ytq s VAL 151 CO 0.09 0.35 0.47 -0.83 0.00 0.00 0.00 175.10 175.17 1ytq s GLY 152 N 1.44 2.34 0.08 4.51 0.00 0.38 -2.16 107.32 113.92 1ytq s GLY 152 Ca 0.03 -0.32 0.05 0.00 0.00 0.00 0.00 44.72 44.48 1ytq s GLY 152 CO -0.10 -0.12 -0.14 -0.19 0.00 0.00 0.00 173.10 172.55 1ytq s TYR 153 N -1.54 1.23 0.19 1.90 2.02 0.38 -0.55 117.35 120.98 1ytq s TYR 153 Ca 0.38 -0.49 -0.10 0.00 -0.37 0.00 0.00 57.07 56.49 1ytq s TYR 153 Cb -0.13 -0.68 0.10 0.00 -0.40 0.00 0.00 41.96 40.85 1ytq s TYR 153 CO 0.20 0.06 1.74 1.96 -1.57 0.00 0.00 175.55 177.94 1ytq h GLN 154 N 4.12 1.02 -5.93 -0.62 4.20 -1.46 0.02 115.11 116.47 1ytq h GLN 154 Ca -0.40 -0.19 -0.59 0.00 0.06 0.00 0.00 58.65 57.52 1ytq h GLN 154 Cb 1.19 -0.16 -0.14 0.00 0.30 0.00 0.00 27.48 28.67 1ytq h GLN 154 CO 0.43 0.86 -0.70 0.71 -0.67 0.00 0.00 178.83 179.45 1ytq s TYR 155 N -5.51 2.28 0.58 2.96 2.02 -0.77 -2.94 117.35 115.98 1ytq s TYR 155 Ca -0.13 -0.49 -0.19 0.00 -0.37 0.00 0.00 57.07 55.90 1ytq s TYR 155 Cb 0.14 -1.23 -0.04 0.00 -0.40 0.00 0.00 41.96 40.43 1ytq s TYR 155 CO 0.82 0.57 1.17 -2.14 -1.57 0.00 0.00 175.55 174.39 1ytq s PRO 156 N -3.60 3.08 -0.33 -1.71 0.02 -1.26 -3.14 135.00 128.05 1ytq s PRO 156 Ca 0.31 1.69 0.00 0.00 0.02 0.00 0.00 61.00 63.02 1ytq s PRO 156 Cb 0.01 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.57 1ytq s PRO 156 CO 0.15 -1.09 0.00 0.41 -0.33 0.00 0.00 177.00 176.14 1ytq n GLY 157 N 0.26 0.29 3.41 0.52 0.00 0.26 -4.08 105.19 105.85 1ytq n GLY 157 Ca 0.12 -0.76 -0.17 0.00 0.00 0.00 0.00 46.02 45.21 1ytq n GLY 157 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ytq n TYR 158 N -3.81 -2.19 -4.39 1.61 4.01 -1.23 -5.02 117.16 106.14 1ytq n TYR 158 Ca -0.04 0.93 -0.25 0.00 -0.16 0.00 0.00 57.90 58.38 1ytq n TYR 158 Cb 0.46 -5.06 -0.10 0.00 -0.31 0.00 0.00 39.34 34.34 1ytq n TYR 158 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1ytq s ARG 159 N -5.38 1.82 1.07 -0.72 0.52 -1.19 -5.03 118.95 110.05 1ytq s ARG 159 Ca 0.02 -1.53 0.00 0.00 -0.52 0.00 0.00 55.73 53.70 1ytq s ARG 159 Cb -0.01 -1.95 0.00 0.00 0.52 0.00 0.00 34.95 33.52 1ytq s ARG 159 CO 0.72 0.38 0.00 0.41 0.02 0.00 0.00 175.30 176.83 1ytq n GLY 160 N -0.27 -1.03 3.77 -3.53 0.00 -1.26 -1.85 105.19 101.02 1ytq n GLY 160 Ca -0.09 -1.62 -0.39 0.00 0.00 0.00 0.00 46.02 43.93 1ytq n GLY 160 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ytq s LEU 161 N 0.00 4.17 -0.08 0.99 1.43 -1.26 -4.80 118.68 119.13 1ytq s LEU 161 Ca 0.00 2.53 -0.03 0.00 -1.03 0.00 0.00 54.13 55.60 1ytq s LEU 161 Cb 0.00 -3.99 -0.04 0.00 0.03 0.00 0.00 46.19 42.19 1ytq s LEU 161 CO 0.00 -0.84 0.04 -1.10 0.23 0.00 0.00 176.35 174.68 1ytq s GLN 162 N -2.34 3.08 -0.23 1.70 -0.21 -1.26 -3.07 119.66 117.33 1ytq s GLN 162 Ca 0.58 -0.37 -0.01 0.00 0.02 0.00 0.00 55.36 55.59 1ytq s GLN 162 Cb -0.35 -2.88 0.07 0.00 1.00 0.00 0.00 33.01 30.85 1ytq s GLN 162 CO 0.44 0.71 0.00 0.71 -2.12 0.00 0.00 175.29 175.03 1ytq s TYR 163 N -0.97 1.86 -0.33 0.91 2.02 0.29 -4.97 117.35 116.16 1ytq s TYR 163 Ca 0.15 -1.48 -0.29 0.00 -0.37 0.00 0.00 57.07 55.09 1ytq s TYR 163 Cb -0.12 -1.45 -0.00 0.00 -0.40 0.00 0.00 41.96 39.99 1ytq s TYR 163 CO 0.05 -0.74 1.41 -1.17 -1.57 0.00 0.00 175.55 173.54 1ytq s LEU 164 N 1.57 3.76 -0.29 -1.29 2.96 -1.26 -0.47 118.68 123.66 1ytq s LEU 164 Ca -0.01 1.15 -0.05 0.00 -0.22 0.00 0.00 54.13 54.99 1ytq s LEU 164 Cb -0.18 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 42.99 1ytq s LEU 164 CO -0.09 -1.26 0.05 -0.76 -1.32 0.00 0.00 176.35 172.96 1ytq s LEU 165 N 4.99 3.79 0.40 -0.68 1.43 0.93 -4.99 118.68 124.55 1ytq s LEU 165 Ca 0.62 -0.84 0.07 0.00 -1.03 0.00 0.00 54.13 52.95 1ytq s LEU 165 Cb -0.17 -1.82 -0.08 0.00 0.03 0.00 0.00 46.19 44.15 1ytq s LEU 165 CO 0.28 -0.20 0.00 -1.61 0.23 0.00 0.00 176.35 175.05 1ytq s GLU 166 N 1.43 1.92 -0.13 1.70 2.02 -1.26 -1.18 118.70 123.20 1ytq s GLU 166 Ca 0.01 -2.07 -0.38 0.00 0.02 0.00 0.00 54.97 52.55 1ytq s GLU 166 Cb -0.18 -1.59 -0.15 0.00 0.10 0.00 0.00 34.13 32.32 1ytq s GLU 166 CO 0.01 -0.04 1.66 1.17 0.02 0.00 0.00 175.26 178.08 1ytq n LYS 167 N -0.93 1.39 -1.45 1.61 4.81 -1.26 -4.60 118.16 117.74 1ytq n LYS 167 Ca -0.05 0.51 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 1ytq n LYS 167 Cb 0.67 -2.21 0.00 0.00 0.02 0.00 0.00 35.03 33.50 1ytq n LYS 167 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ytq n GLY 168 N 3.78 0.15 3.37 3.14 0.00 -0.53 -4.99 105.19 110.10 1ytq n GLY 168 Ca 0.23 -1.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.26 1ytq n GLY 168 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ytq s ASP 169 N -4.00 4.15 -0.60 1.61 -0.00 -1.26 -1.52 116.67 115.05 1ytq s ASP 169 Ca 0.00 -0.33 -0.00 0.00 -0.00 0.00 0.00 52.55 52.22 1ytq s ASP 169 Cb 0.00 -1.66 0.15 0.00 -0.00 0.00 0.00 42.92 41.41 1ytq s ASP 169 CO 0.00 0.12 0.39 -0.31 -0.00 0.00 0.00 175.17 175.37 1ytq s TYR 170 N 0.63 3.33 -0.17 4.23 2.02 0.52 -4.96 117.35 122.95 1ytq s TYR 170 Ca -0.06 -2.90 0.29 0.00 -0.37 0.00 0.00 57.07 54.04 1ytq s TYR 170 Cb -0.15 -3.06 1.11 0.00 -0.40 0.00 0.00 41.96 39.46 1ytq s TYR 170 CO 0.03 -0.80 1.86 0.87 -1.57 0.00 0.00 175.55 175.93 1ytq h LYS 171 N 6.78 0.00 -4.66 -0.62 1.57 -1.89 -0.28 116.57 117.47 1ytq h LYS 171 Ca -0.03 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.49 1ytq h LYS 171 Cb 0.92 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.05 1ytq h LYS 171 CO 0.71 0.00 -0.72 0.34 -0.57 0.00 0.00 179.45 179.21 1ytq s ASP 172 N -5.28 1.06 0.52 0.86 2.15 -1.25 -0.62 116.67 114.11 1ytq s ASP 172 Ca 0.03 -0.77 0.29 0.00 0.43 0.00 0.00 52.55 52.53 1ytq s ASP 172 Cb 0.09 0.06 1.43 0.00 -0.30 0.00 0.00 42.92 44.19 1ytq s ASP 172 CO 0.52 -0.32 2.05 0.77 -0.17 0.00 0.00 175.17 178.02 1ytq h SER 173 N 3.75 0.00 0.58 -0.34 4.64 -0.68 -1.69 113.55 119.81 1ytq h SER 173 Ca -0.36 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.93 1ytq h SER 173 Cb 1.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1ytq h SER 173 CO 0.52 0.12 -0.13 0.77 -0.87 0.00 0.00 176.83 177.24 1ytq h SER 174 N 0.00 0.00 0.18 4.97 4.64 -1.87 -2.14 113.55 119.33 1ytq h SER 174 Ca -0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1ytq h SER 174 Cb 0.39 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.47 1ytq h SER 174 CO 0.02 0.13 -0.32 0.44 -0.87 0.00 0.00 176.83 176.23 1ytq h ASP 175 N 0.00 0.22 -0.76 4.97 3.45 -1.65 -2.32 116.42 120.33 1ytq h ASP 175 Ca -0.00 -0.07 -0.25 0.00 0.43 0.00 0.00 57.03 57.14 1ytq h ASP 175 Cb 0.46 -0.06 -0.15 0.00 -0.56 0.00 0.00 39.33 39.02 1ytq h ASP 175 CO 0.02 0.53 0.31 2.22 -1.57 0.00 0.00 179.24 180.74 1ytq n PHE 176 N -4.11 2.52 -1.34 4.55 -1.74 -1.14 -4.95 117.46 111.24 1ytq n PHE 176 Ca -0.01 -1.27 -0.06 0.00 -0.56 0.00 0.00 57.45 55.55 1ytq n PHE 176 Cb 0.40 -0.72 -0.02 0.00 1.52 0.00 0.00 39.48 40.67 1ytq n PHE 176 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1ytq n GLY 177 N -0.26 0.70 3.76 4.97 0.00 -0.87 -4.72 105.19 108.76 1ytq n GLY 177 Ca 0.43 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 45.29 1ytq n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ytq s ALA 178 N -2.23 3.48 0.26 4.61 0.00 -0.82 -4.98 121.76 122.10 1ytq s ALA 178 Ca 0.00 0.03 0.09 0.00 0.00 0.00 0.00 51.96 52.08 1ytq s ALA 178 Cb 0.00 -2.75 0.33 0.00 0.00 0.00 0.00 23.12 20.70 1ytq s ALA 178 CO 0.00 0.15 1.60 -1.00 0.00 0.00 0.00 175.76 176.51 1ytq h PRO 179 N 5.71 0.05 -3.78 0.00 0.13 -1.95 -3.35 132.00 128.80 1ytq h PRO 179 Ca -0.45 -0.04 -0.11 0.00 -0.87 0.00 0.00 66.00 64.53 1ytq h PRO 179 Cb 1.20 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 32.17 1ytq h PRO 179 CO 0.70 0.65 -0.47 -3.38 -0.23 0.00 0.00 178.00 175.28 1ytq s HIS 180 N -3.64 0.18 -1.26 1.56 -3.43 -1.26 -5.02 115.29 102.42 1ytq s HIS 180 Ca -0.02 -0.52 -0.19 0.00 -0.80 0.00 0.00 55.06 53.53 1ytq s HIS 180 Cb 0.12 -0.12 0.01 0.00 -1.43 0.00 0.00 32.58 31.17 1ytq s HIS 180 CO 0.77 -0.43 1.84 -0.35 -2.00 0.00 0.00 174.74 174.58 1ytq n PRO 181 N 0.47 2.61 -3.74 -0.38 -0.04 -1.26 -4.86 135.00 127.80 1ytq n PRO 181 Ca -0.17 -2.92 -0.24 0.00 -0.04 0.00 0.00 63.50 60.13 1ytq n PRO 181 Cb 0.60 -3.53 -0.17 0.00 -0.04 0.00 0.00 33.50 30.36 1ytq n PRO 181 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1ytq s GLN 182 N 4.87 0.50 -0.04 0.54 0.74 -1.25 -1.95 119.66 123.06 1ytq s GLN 182 Ca 0.58 -0.02 -0.01 0.00 0.05 0.00 0.00 55.36 55.97 1ytq s GLN 182 Cb 0.04 -1.30 0.03 0.00 1.10 0.00 0.00 33.01 32.88 1ytq s GLN 182 CO 0.09 -0.43 0.01 0.08 -0.55 0.00 0.00 175.29 174.49 1ytq s VAL 183 N 1.98 0.19 0.00 1.34 1.01 -1.26 -4.25 120.40 119.41 1ytq s VAL 183 Ca 0.03 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1ytq s VAL 183 Cb -0.14 -0.33 0.00 0.00 0.00 0.00 0.00 36.38 35.91 1ytq s VAL 183 CO -0.06 0.19 0.17 0.00 0.00 0.00 0.00 175.10 175.40 1ytq n GLN 184 N 4.66 3.59 -3.69 2.72 6.02 -0.01 -4.77 117.38 125.90 1ytq n GLN 184 Ca -0.16 -0.17 -0.14 0.00 -0.01 0.00 0.00 57.00 56.51 1ytq n GLN 184 Cb 0.50 -0.65 -0.08 0.00 1.02 0.00 0.00 30.24 31.03 1ytq n GLN 184 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1ytq s SER 185 N -0.56 -0.43 -0.01 1.08 1.04 -1.18 -0.64 113.70 113.01 1ytq s SER 185 Ca 0.00 0.61 0.00 0.00 0.48 0.00 0.00 55.95 57.04 1ytq s SER 185 Cb 0.00 0.66 0.01 0.00 0.10 0.00 0.00 66.02 66.79 1ytq s SER 185 CO 0.00 -0.36 0.00 -0.69 0.98 0.00 0.00 173.24 173.17 1ytq s VAL 186 N -0.59 0.04 0.05 5.02 1.01 -0.29 -0.47 120.40 125.17 1ytq s VAL 186 Ca -0.07 0.03 0.05 0.00 0.00 0.00 0.00 61.98 61.98 1ytq s VAL 186 Cb -0.03 -0.07 -0.02 0.00 0.00 0.00 0.00 36.38 36.25 1ytq s VAL 186 CO 0.04 0.04 -0.13 0.00 0.00 0.00 0.00 175.10 175.05 1ytq s ARG 187 N 0.27 0.83 -0.05 2.72 1.70 -0.92 -0.07 118.95 123.43 1ytq s ARG 187 Ca -0.02 -0.81 -0.16 0.00 -0.47 0.00 0.00 55.73 54.27 1ytq s ARG 187 Cb -0.04 -0.81 -0.05 0.00 -0.57 0.00 0.00 34.95 33.48 1ytq s ARG 187 CO -0.01 0.19 0.43 0.50 -1.08 0.00 0.00 175.30 175.33 1ytq s ARG 188 N -1.37 4.11 -0.43 3.89 3.52 -1.26 -1.06 118.95 126.34 1ytq s ARG 188 Ca -0.01 0.41 -0.24 0.00 -0.13 0.00 0.00 55.73 55.76 1ytq s ARG 188 Cb -0.09 -3.31 0.02 0.00 -1.56 0.00 0.00 34.95 30.01 1ytq s ARG 188 CO 0.01 0.47 0.86 0.42 -0.81 0.00 0.00 175.30 176.25 1ytq s ILE 189 N -0.37 4.58 -0.08 4.11 -1.09 0.19 -4.91 121.20 123.63 1ytq s ILE 189 Ca 0.24 0.71 0.20 0.00 -2.23 0.00 0.00 60.65 59.56 1ytq s ILE 189 Cb -0.16 -4.36 -0.29 0.00 -1.58 0.00 0.00 42.46 36.07 1ytq s ILE 189 CO 0.12 -0.71 0.33 0.54 -1.23 0.00 0.00 174.94 173.99 1ytq n ARG 190 N 6.88 0.70 -4.24 2.79 1.74 -1.26 -4.47 116.66 118.80 1ytq n ARG 190 Ca 0.05 -0.13 -0.27 0.00 -0.77 0.00 0.00 57.85 56.72 1ytq n ARG 190 Cb 0.48 -1.49 -0.09 0.00 -1.02 0.00 0.00 32.46 30.35 1ytq n ARG 190 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ytq s ASP 191 N -4.67 4.50 -0.25 0.55 -0.00 -1.26 -5.12 116.67 110.42 1ytq s ASP 191 Ca -0.08 -0.47 -0.11 0.00 -0.00 0.00 0.00 52.55 51.89 1ytq s ASP 191 Cb 0.11 -0.87 0.09 0.00 -0.00 0.00 0.00 42.92 42.25 1ytq s ASP 191 CO 0.83 0.11 0.57 -0.32 -0.00 0.00 0.00 175.17 176.36 1ytq s MET 192 N -2.76 0.54 -0.27 8.23 1.75 -1.26 -5.07 119.30 120.46 1ytq s MET 192 Ca 0.25 1.15 0.05 0.00 -1.25 0.00 0.00 55.69 55.89 1ytq s MET 192 Cb -0.09 0.31 0.49 0.00 2.84 0.00 0.00 34.83 38.38 1ytq s MET 192 CO 0.16 -0.18 1.56 1.04 -0.65 0.00 0.00 175.02 176.96 1ytq n GLN 193 N 4.76 2.35 0.00 4.11 3.00 -1.26 -5.34 117.38 125.00 1ytq n GLN 193 Ca -0.17 -2.10 0.00 0.00 -0.01 0.00 0.00 57.00 54.72 1ytq n GLN 193 Cb 0.54 -1.87 0.00 0.00 0.00 0.00 0.00 30.24 28.91 1ytq n GLN 193 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.06 174.39