#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ytx n SER 2 N 0.00 4.64 -3.98 1.61 2.88 -1.26 -5.03 113.62 112.48 2ytx n SER 2 Ca 0.00 -3.58 -0.08 0.00 -1.33 0.00 0.00 58.87 53.88 2ytx n SER 2 Cb 0.00 -0.71 -0.09 0.00 -0.75 0.00 0.00 64.21 62.66 2ytx n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2ytx s SER 3 N -2.80 0.30 0.00 -3.46 0.01 -1.26 -5.05 113.70 101.44 2ytx s SER 3 Ca 0.43 -0.77 0.00 0.00 1.31 0.00 0.00 55.95 56.93 2ytx s SER 3 Cb 0.21 0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.68 2ytx s SER 3 CO -0.07 -0.60 0.00 0.61 0.41 0.00 0.00 173.24 173.59 2ytx n GLY 4 N 0.28 0.57 3.64 3.44 0.00 -1.26 -5.09 105.19 106.78 2ytx n GLY 4 Ca -0.16 -0.17 -0.07 0.00 0.00 0.00 0.00 46.02 45.63 2ytx n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ytx s SER 5 N -4.00 -0.50 0.60 1.61 1.04 -1.26 -5.17 113.70 106.02 2ytx s SER 5 Ca 0.00 0.89 -0.10 0.00 0.48 0.00 0.00 55.95 57.22 2ytx s SER 5 Cb 0.00 1.02 -0.04 0.00 0.10 0.00 0.00 66.02 67.10 2ytx s SER 5 CO 0.00 -0.15 0.99 -0.55 0.98 0.00 0.00 173.24 174.51 2ytx s SER 6 N 0.68 6.19 0.00 7.02 0.15 -1.26 -4.45 113.70 122.04 2ytx s SER 6 Ca -0.02 1.31 0.00 0.00 0.70 0.00 0.00 55.95 57.95 2ytx s SER 6 Cb -0.05 -2.40 0.00 0.00 -1.71 0.00 0.00 66.02 61.87 2ytx s SER 6 CO -0.10 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.11 2ytx n GLY 7 N -2.67 2.07 0.34 9.45 0.00 -1.26 -5.00 105.19 108.12 2ytx n GLY 7 Ca 0.05 -0.70 -0.03 0.00 0.00 0.00 0.00 46.02 45.34 2ytx n GLY 7 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ytx n ASN 8 N 2.17 1.83 -3.64 1.61 4.05 -1.26 -5.17 115.26 114.84 2ytx n ASN 8 Ca 0.00 -1.21 -0.08 0.00 0.45 0.00 0.00 54.58 53.74 2ytx n ASN 8 Cb 0.00 0.05 -0.07 0.00 1.23 0.00 0.00 39.78 40.99 2ytx n ASN 8 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 177.26 173.70 2ytx s ILE 9 N -1.31 0.00 0.52 -1.44 -1.16 -1.26 -4.89 121.20 111.66 2ytx s ILE 9 Ca 0.01 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.15 2ytx s ILE 9 Cb 0.00 -1.00 0.00 0.00 0.61 0.00 0.00 42.46 42.07 2ytx s ILE 9 CO 0.00 0.00 0.00 0.80 -2.81 0.00 0.00 174.94 172.93 2ytx n MET 10 N 2.07 -3.09 0.00 3.50 0.00 -1.26 -5.07 117.12 113.27 2ytx n MET 10 Ca -0.12 2.48 0.00 0.00 0.00 0.00 0.00 57.70 60.06 2ytx n MET 10 Cb 0.56 -3.34 0.00 0.00 0.00 0.00 0.00 33.22 30.44 2ytx n MET 10 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 2ytx n LEU 11 N -3.38 0.00 -1.36 -0.89 0.00 -1.26 -5.17 117.00 104.94 2ytx n LEU 11 Ca -0.05 0.00 0.18 0.00 0.00 0.00 0.00 56.01 56.14 2ytx n LEU 11 Cb 0.51 0.21 -0.05 0.00 0.00 0.00 0.00 43.42 44.09 2ytx n LEU 11 CO 0.02 -0.21 -0.27 0.18 0.00 0.00 0.00 177.39 177.11 2ytx n LEU 12 N -1.89 -0.69 -4.50 -1.96 7.99 -1.26 -4.80 117.00 109.89 2ytx n LEU 12 Ca 0.00 1.52 -0.34 0.00 -0.01 0.00 0.00 56.01 57.18 2ytx n LEU 12 Cb 0.00 -4.19 -0.12 0.00 -0.11 0.00 0.00 43.42 39.00 2ytx n LEU 12 CO 0.00 -3.57 -0.35 -0.54 -1.51 0.00 0.00 177.39 171.41 2ytx s LYS 13 N -2.29 3.62 0.00 3.23 3.01 -1.26 -4.88 119.74 121.17 2ytx s LYS 13 Ca 0.00 -0.52 0.00 0.00 -1.01 0.00 0.00 55.97 54.44 2ytx s LYS 13 Cb 0.00 -2.89 0.00 0.00 -1.01 0.00 0.00 37.83 33.93 2ytx s LYS 13 CO 0.00 0.27 0.00 1.17 0.51 0.00 0.00 175.35 177.30 2ytx n LYS 14 N 3.44 0.00 -3.64 1.68 4.81 -1.26 -5.10 118.16 118.09 2ytx n LYS 14 Ca -0.17 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 56.89 2ytx n LYS 14 Cb 0.52 -0.01 -0.10 0.00 0.02 0.00 0.00 35.03 35.46 2ytx n LYS 14 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2ytx s LYS 15 N -1.24 3.99 -0.99 1.64 2.47 -1.26 -5.03 119.74 119.33 2ytx s LYS 15 Ca 0.00 -0.31 -0.04 0.00 -1.56 0.00 0.00 55.97 54.07 2ytx s LYS 15 Cb 0.00 -3.58 0.26 0.00 -1.46 0.00 0.00 37.83 33.05 2ytx s LYS 15 CO 0.00 -0.07 1.07 1.04 0.16 0.00 0.00 175.35 177.55 2ytx n GLN 16 N 4.69 3.39 -3.30 4.03 6.02 -1.26 -4.93 117.38 126.02 2ytx n GLN 16 Ca -0.15 -4.52 0.03 0.00 -0.01 0.00 0.00 57.00 52.36 2ytx n GLN 16 Cb 0.52 -2.46 -0.04 0.00 1.02 0.00 0.00 30.24 29.27 2ytx n GLN 16 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ytx s ALA 17 N -1.85 -3.06 0.21 -1.58 0.00 -1.26 -5.19 121.76 109.04 2ytx s ALA 17 Ca 0.31 1.88 0.00 0.00 0.00 0.00 0.00 51.96 54.16 2ytx s ALA 17 Cb -0.02 -2.19 -0.05 0.00 0.00 0.00 0.00 23.12 20.86 2ytx s ALA 17 CO -0.04 -0.88 0.08 -0.98 0.00 0.00 0.00 175.76 173.95 2ytx s ARG 18 N 2.01 1.24 -0.22 0.00 1.04 -1.26 -4.34 118.95 117.42 2ytx s ARG 18 Ca -0.01 -1.65 -0.18 0.00 -1.04 0.00 0.00 55.73 52.85 2ytx s ARG 18 Cb -0.02 -0.05 0.06 0.00 -2.04 0.00 0.00 34.95 32.89 2ytx s ARG 18 CO -0.16 -0.29 0.56 0.00 -0.04 0.00 0.00 175.30 175.37 2ytx s GLN 20 N 0.62 1.09 0.02 0.00 0.00 -1.26 -0.86 119.66 119.27 2ytx s GLN 20 Ca -0.03 -1.49 -0.14 0.00 -0.00 0.00 0.00 55.36 53.71 2ytx s GLN 20 Cb -0.05 -0.53 0.05 0.00 0.00 0.00 0.00 33.01 32.48 2ytx s GLN 20 CO -0.04 0.01 0.64 0.41 0.00 0.00 0.00 175.29 176.31 2ytx n GLY 21 N -0.22 0.58 3.57 2.60 0.00 -0.56 -4.67 105.19 106.49 2ytx n GLY 21 Ca -0.09 -0.98 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 2ytx n GLY 21 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ytx s VAL 22 N -2.15 4.54 -0.59 1.61 1.01 -1.16 -0.20 120.40 123.46 2ytx s VAL 22 Ca 0.15 -0.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.71 2ytx s VAL 22 Cb -0.01 -3.05 -0.12 0.00 0.00 0.00 0.00 36.38 33.20 2ytx s VAL 22 CO 0.01 0.44 2.43 0.52 0.00 0.00 0.00 175.10 178.51 2ytx n VAL 23 N 3.79 0.02 -0.05 2.92 0.31 -0.43 -1.77 118.33 123.11 2ytx n VAL 23 Ca -0.17 -0.44 -0.01 0.00 -0.01 0.00 0.00 64.34 63.71 2ytx n VAL 23 Cb 0.52 -1.90 -0.01 0.00 -0.91 0.00 0.00 33.84 31.55 2ytx n VAL 23 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ytx s ALA 25 N -2.55 3.62 -0.06 0.00 0.00 -0.44 -4.95 121.76 117.39 2ytx s ALA 25 Ca -0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 51.96 51.77 2ytx s ALA 25 Cb 0.00 -2.48 0.03 0.00 0.00 0.00 0.00 23.12 20.67 2ytx s ALA 25 CO 0.04 0.47 0.03 -1.64 0.00 0.00 0.00 175.76 174.66 2ytx s MET 26 N -1.66 0.25 0.32 0.00 -1.94 -1.26 -3.10 119.30 111.90 2ytx s MET 26 Ca 0.33 0.25 0.04 0.00 -1.71 0.00 0.00 55.69 54.60 2ytx s MET 26 Cb -0.16 -0.74 -0.04 0.00 2.01 0.00 0.00 34.83 35.91 2ytx s MET 26 CO 0.18 -0.32 0.16 0.21 -0.01 0.00 0.00 175.02 175.24 2ytx s LYS 27 N 2.08 1.65 -0.52 2.03 2.20 -1.07 -5.03 119.74 121.09 2ytx s LYS 27 Ca 0.05 -1.95 -0.03 0.00 -0.36 0.00 0.00 55.97 53.68 2ytx s LYS 27 Cb -0.12 -0.15 0.17 0.00 -1.51 0.00 0.00 37.83 36.22 2ytx s LYS 27 CO -0.04 -0.46 2.44 0.39 -0.36 0.00 0.00 175.35 177.32 2ytx n GLU 28 N -0.63 2.37 0.00 4.03 1.02 -1.26 -4.21 120.64 121.96 2ytx n GLU 28 Ca 0.01 -2.48 0.00 0.00 -0.02 0.00 0.00 57.16 54.66 2ytx n GLU 28 Cb 0.65 -2.08 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 2ytx n GLU 28 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ytx n ALA 29 N 0.38 0.00 -3.42 0.62 0.00 -1.26 -5.12 120.51 111.71 2ytx n ALA 29 Ca 0.47 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.83 2ytx n ALA 29 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 2ytx n ALA 29 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2ytx s PHE 30 N -1.43 0.17 0.31 0.00 -0.12 -1.26 -2.69 117.98 112.95 2ytx s PHE 30 Ca 0.00 -0.57 -0.11 0.00 -0.05 0.00 0.00 56.93 56.20 2ytx s PHE 30 Cb 0.00 0.38 0.04 0.00 -0.63 0.00 0.00 43.02 42.81 2ytx s PHE 30 CO 0.00 -1.08 0.61 0.41 -0.05 0.00 0.00 175.22 175.10 2ytx n GLY 31 N -0.41 1.24 3.11 1.99 0.00 -1.08 -2.60 105.19 107.44 2ytx n GLY 31 Ca -0.02 -1.21 -0.15 0.00 0.00 0.00 0.00 46.02 44.63 2ytx n GLY 31 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ytx s PHE 32 N -3.71 0.91 0.03 1.61 0.40 -1.18 -2.93 117.98 113.11 2ytx s PHE 32 Ca 0.13 -0.49 0.08 0.00 -0.60 0.00 0.00 56.93 56.05 2ytx s PHE 32 Cb -0.04 -0.52 -0.03 0.00 0.51 0.00 0.00 43.02 42.94 2ytx s PHE 32 CO 0.09 -0.02 -0.24 0.42 0.70 0.00 0.00 175.22 176.17 2ytx s ILE 33 N -1.36 2.29 -0.20 0.64 1.01 -1.25 -0.86 121.20 121.47 2ytx s ILE 33 Ca -0.06 -1.29 -0.24 0.00 0.00 0.00 0.00 60.65 59.06 2ytx s ILE 33 Cb -0.10 -1.89 -0.01 0.00 0.01 0.00 0.00 42.46 40.46 2ytx s ILE 33 CO 0.01 0.40 0.79 -1.61 0.00 0.00 0.00 174.94 174.53 2ytx s GLU 34 N -1.17 4.24 0.00 2.79 2.02 -0.73 -4.09 118.70 121.76 2ytx s GLU 34 Ca 0.12 0.91 0.00 0.00 0.02 0.00 0.00 54.97 56.02 2ytx s GLU 34 Cb -0.10 -3.60 0.00 0.00 0.10 0.00 0.00 34.13 30.53 2ytx s GLU 34 CO 0.02 -0.38 0.79 0.54 0.02 0.00 0.00 175.26 176.25 2ytx n ARG 35 N 5.49 0.00 0.00 1.61 1.74 -1.11 -2.98 116.66 121.42 2ytx n ARG 35 Ca 0.04 0.46 0.00 0.00 -0.77 0.00 0.00 57.85 57.58 2ytx n ARG 35 Cb 0.48 -1.29 0.00 0.00 -1.02 0.00 0.00 32.46 30.64 2ytx n ARG 35 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ytx n GLY 36 N -0.86 -1.86 2.40 -0.13 0.00 -1.26 -4.41 105.19 99.06 2ytx n GLY 36 Ca 0.00 0.99 -0.18 0.00 0.00 0.00 0.00 46.02 46.83 2ytx n GLY 36 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ytx n ASP 37 N 0.00 -5.02 -3.86 1.61 2.03 -1.26 -4.94 116.55 105.10 2ytx n ASP 37 Ca 0.00 0.19 -0.24 0.00 0.52 0.00 0.00 54.79 55.25 2ytx n ASP 37 Cb 0.00 -4.30 -0.06 0.00 -0.72 0.00 0.00 41.12 36.04 2ytx n ASP 37 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2ytx n VAL 38 N -3.25 0.00 -1.57 5.18 0.24 -1.26 -5.05 118.33 112.61 2ytx n VAL 38 Ca -0.20 -2.07 -0.34 0.00 -2.04 0.00 0.00 64.34 59.69 2ytx n VAL 38 Cb 0.64 0.61 0.06 0.00 -1.47 0.00 0.00 33.84 33.68 2ytx n VAL 38 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 2ytx n VAL 39 N -0.92 3.41 -4.53 3.34 0.24 -1.26 -4.81 118.33 113.80 2ytx n VAL 39 Ca -0.10 -3.42 -0.31 0.00 -2.04 0.00 0.00 64.34 58.47 2ytx n VAL 39 Cb 0.54 -1.17 -0.17 0.00 -1.47 0.00 0.00 33.84 31.57 2ytx n VAL 39 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2ytx s LYS 40 N -3.82 2.71 0.20 7.34 1.02 -1.26 -5.11 119.74 120.81 2ytx s LYS 40 Ca 0.60 -0.74 0.01 0.00 0.02 0.00 0.00 55.97 55.86 2ytx s LYS 40 Cb 0.48 -2.24 -0.05 0.00 -0.52 0.00 0.00 37.83 35.50 2ytx s LYS 40 CO -0.07 -0.06 0.05 -1.83 -0.92 0.00 0.00 175.35 172.52 2ytx s GLU 41 N 0.94 1.20 0.16 1.68 -1.05 -1.26 -2.74 118.70 117.62 2ytx s GLU 41 Ca -0.05 -1.61 -0.02 0.00 -0.15 0.00 0.00 54.97 53.14 2ytx s GLU 41 Cb -0.15 -0.17 -0.04 0.00 -0.44 0.00 0.00 34.13 33.33 2ytx s GLU 41 CO -0.03 -0.22 0.10 0.96 0.95 0.00 0.00 175.26 177.02 2ytx s ILE 42 N -3.77 0.06 -0.18 1.83 -0.00 -1.26 -5.01 121.20 112.88 2ytx s ILE 42 Ca 0.30 -1.90 -0.02 0.00 -0.00 0.00 0.00 60.65 59.02 2ytx s ILE 42 Cb 0.07 -2.19 -0.01 0.00 -0.00 0.00 0.00 42.46 40.33 2ytx s ILE 42 CO 0.08 -0.29 -0.09 0.12 -0.00 0.00 0.00 174.94 174.76 2ytx s PHE 43 N -4.08 2.90 -0.04 1.37 2.19 -1.24 -3.93 117.98 115.15 2ytx s PHE 43 Ca 0.29 -0.82 0.03 0.00 0.33 0.00 0.00 56.93 56.76 2ytx s PHE 43 Cb 0.07 -1.98 0.00 0.00 -1.31 0.00 0.00 43.02 39.80 2ytx s PHE 43 CO 0.05 -0.40 -0.14 -0.59 1.83 0.00 0.00 175.22 175.98 2ytx s PHE 44 N 0.95 1.41 0.04 10.12 -0.71 -1.15 -2.42 117.98 126.22 2ytx s PHE 44 Ca -0.01 -0.40 -0.13 0.00 -1.04 0.00 0.00 56.93 55.34 2ytx s PHE 44 Cb -0.15 -0.97 -0.06 0.00 -1.21 0.00 0.00 43.02 40.63 2ytx s PHE 44 CO -0.00 -0.15 0.42 -1.58 -1.34 0.00 0.00 175.22 172.57 2ytx s HIS 45 N 0.16 3.68 0.58 3.49 2.46 -1.26 -2.64 115.29 121.75 2ytx s HIS 45 Ca -0.05 0.94 0.27 0.00 0.47 0.00 0.00 55.06 56.70 2ytx s HIS 45 Cb -0.11 -2.26 1.63 0.00 -0.13 0.00 0.00 32.58 31.71 2ytx s HIS 45 CO 0.02 0.59 2.14 1.88 -2.47 0.00 0.00 174.74 176.89 2ytx h TYR 46 N 4.31 0.00 -0.55 3.88 -1.99 -1.89 -0.69 116.97 120.04 2ytx h TYR 46 Ca -0.51 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.21 2ytx h TYR 46 Cb 1.21 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.91 2ytx h TYR 46 CO 0.69 0.00 0.29 0.66 -0.00 0.00 0.00 178.16 179.80 2ytx h SER 47 N 0.00 0.68 0.93 3.88 4.64 -1.93 -2.37 113.55 119.38 2ytx h SER 47 Ca 0.07 -0.05 -0.17 0.00 -0.47 0.00 0.00 61.79 61.17 2ytx h SER 47 Cb 0.34 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.23 2ytx h SER 47 CO -0.00 0.56 -1.15 -0.33 -0.87 0.00 0.00 176.83 175.04 2ytx h GLU 48 N 0.77 0.00 -6.40 4.77 3.07 -1.54 -3.47 114.58 111.79 2ytx h GLU 48 Ca 0.20 0.00 -0.62 0.00 -0.50 0.00 0.00 59.36 58.43 2ytx h GLU 48 Cb 0.04 0.00 0.05 0.00 -0.84 0.00 0.00 28.75 28.01 2ytx h GLU 48 CO -0.03 0.43 0.70 0.34 -1.40 0.00 0.00 179.01 179.05 2ytx n PHE 49 N -3.04 2.00 -3.76 4.33 7.35 -0.88 -3.36 117.46 120.09 2ytx n PHE 49 Ca -0.06 0.39 -0.30 0.00 -0.76 0.00 0.00 57.45 56.72 2ytx n PHE 49 Cb 0.84 -2.47 -0.10 0.00 0.35 0.00 0.00 39.48 38.10 2ytx n PHE 49 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 2ytx n LYS 50 N 3.34 2.17 0.00 -4.13 4.76 0.82 -4.90 118.16 120.22 2ytx n LYS 50 Ca 0.18 -4.52 0.00 0.00 -2.87 0.00 0.00 58.31 51.10 2ytx n LYS 50 Cb 0.25 -2.32 0.00 0.00 -1.84 0.00 0.00 35.03 31.12 2ytx n LYS 50 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ytx n GLY 51 N 1.86 3.95 3.34 0.72 0.00 -1.26 -4.09 105.19 109.70 2ytx n GLY 51 Ca 0.22 -0.23 -0.47 0.00 0.00 0.00 0.00 46.02 45.54 2ytx n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ytx s ASP 52 N 1.88 6.70 0.56 1.61 1.01 -1.26 -4.88 116.67 122.29 2ytx s ASP 52 Ca 0.00 -2.55 0.27 0.00 0.71 0.00 0.00 52.55 50.98 2ytx s ASP 52 Cb 0.00 -2.23 1.62 0.00 1.01 0.00 0.00 42.92 43.33 2ytx s ASP 52 CO 0.00 -0.64 2.18 0.25 0.21 0.00 0.00 175.17 177.17 2ytx h LEU 53 N 8.10 0.00 0.21 1.23 7.12 -1.98 -2.41 115.31 127.57 2ytx h LEU 53 Ca 0.07 0.00 -0.34 0.00 0.13 0.00 0.00 57.88 57.74 2ytx h LEU 53 Cb 1.04 0.00 0.02 0.00 -0.53 0.00 0.00 40.66 41.20 2ytx h LEU 53 CO 0.81 0.05 -1.61 1.05 -0.13 0.00 0.00 178.44 178.60 2ytx h GLU 54 N 0.00 0.44 -3.39 1.25 4.11 -2.05 -3.41 114.58 111.52 2ytx h GLU 54 Ca -0.00 -0.75 -0.65 0.00 0.07 0.00 0.00 59.36 58.03 2ytx h GLU 54 Cb 0.11 0.28 -0.40 0.00 0.50 0.00 0.00 28.75 29.25 2ytx h GLU 54 CO 0.01 1.36 -0.56 0.95 0.07 0.00 0.00 179.01 180.84 2ytx s THR 55 N -2.57 2.89 -0.43 -1.06 -4.23 -0.91 -4.97 115.64 104.34 2ytx s THR 55 Ca -0.14 -3.35 0.05 0.00 -1.18 0.00 0.00 61.69 57.07 2ytx s THR 55 Cb 0.05 -2.96 0.17 0.00 1.34 0.00 0.00 72.50 71.10 2ytx s THR 55 CO 0.88 -0.84 0.42 -0.22 -0.54 0.00 0.00 174.62 174.32 2ytx s LEU 56 N -0.38 0.80 0.10 4.79 2.96 -1.18 -4.52 118.68 121.25 2ytx s LEU 56 Ca 0.18 -2.80 -0.25 0.00 -0.22 0.00 0.00 54.13 51.04 2ytx s LEU 56 Cb -0.23 0.05 0.08 0.00 0.50 0.00 0.00 46.19 46.60 2ytx s LEU 56 CO -0.02 -0.15 0.76 -1.10 -1.32 0.00 0.00 176.35 174.52 2ytx s GLN 57 N 0.23 1.11 0.38 1.98 -0.21 -1.26 -4.48 119.66 117.40 2ytx s GLN 57 Ca 0.32 -0.44 0.28 0.00 0.02 0.00 0.00 55.36 55.54 2ytx s GLN 57 Cb 0.03 0.49 1.16 0.00 1.00 0.00 0.00 33.01 35.69 2ytx s GLN 57 CO -0.17 -0.49 1.83 -1.00 -2.12 0.00 0.00 175.29 173.34 2ytx h PRO 58 N 2.00 0.00 0.00 2.91 0.13 -1.99 -3.42 132.00 131.63 2ytx h PRO 58 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 2ytx h PRO 58 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2ytx h PRO 58 CO 0.33 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.51 2ytx n GLY 59 N -0.02 -0.24 1.35 1.56 0.00 -1.26 -4.93 105.19 101.65 2ytx n GLY 59 Ca 0.01 -0.01 0.17 0.00 0.00 0.00 0.00 46.02 46.20 2ytx n GLY 59 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ytx n ASP 60 N -1.90 -7.91 -4.88 1.61 8.00 -1.26 -4.09 116.55 106.11 2ytx n ASP 60 Ca 0.00 1.08 -0.32 0.00 0.71 0.00 0.00 54.79 56.26 2ytx n ASP 60 Cb 0.00 -4.45 -0.05 0.00 -0.02 0.00 0.00 41.12 36.60 2ytx n ASP 60 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2ytx s ASP 61 N -7.09 6.58 0.16 -2.24 1.11 -1.26 -1.32 116.67 112.62 2ytx s ASP 61 Ca 0.00 0.83 -0.03 0.00 0.18 0.00 0.00 52.55 53.53 2ytx s ASP 61 Cb 0.00 -2.19 -0.03 0.00 1.07 0.00 0.00 42.92 41.77 2ytx s ASP 61 CO 0.00 -0.06 0.15 0.68 1.18 0.00 0.00 175.17 177.12 2ytx s VAL 62 N -1.81 0.06 0.06 -1.27 -7.23 0.71 -0.18 120.40 110.75 2ytx s VAL 62 Ca 0.46 -1.80 0.03 0.00 -1.81 0.00 0.00 61.98 58.86 2ytx s VAL 62 Cb -0.11 -2.14 -0.03 0.00 0.56 0.00 0.00 36.38 34.66 2ytx s VAL 62 CO 0.23 -0.28 -0.10 -0.70 -0.31 0.00 0.00 175.10 173.94 2ytx s GLU 63 N -4.06 0.66 0.34 4.82 -6.30 0.26 -1.49 118.70 112.93 2ytx s GLU 63 Ca 0.27 -0.86 -0.14 0.00 -2.50 0.00 0.00 54.97 51.74 2ytx s GLU 63 Cb 0.06 -0.50 0.03 0.00 0.00 0.00 0.00 34.13 33.72 2ytx s GLU 63 CO 0.05 0.10 0.68 -0.59 0.02 0.00 0.00 175.26 175.51 2ytx s PHE 64 N -1.44 0.28 -0.17 5.30 -0.12 -0.04 -1.80 117.98 119.99 2ytx s PHE 64 Ca -0.06 -0.79 -0.02 0.00 -0.05 0.00 0.00 56.93 56.02 2ytx s PHE 64 Cb -0.09 0.55 0.05 0.00 -0.63 0.00 0.00 43.02 42.90 2ytx s PHE 64 CO 0.01 -1.35 -0.00 0.99 -0.05 0.00 0.00 175.22 174.81 2ytx s THR 65 N -2.97 0.74 -0.17 -4.49 2.01 -1.26 -1.35 115.64 108.16 2ytx s THR 65 Ca 0.18 -0.51 -0.29 0.00 0.31 0.00 0.00 61.69 61.38 2ytx s THR 65 Cb -0.04 -1.08 -0.02 0.00 0.01 0.00 0.00 72.50 71.38 2ytx s THR 65 CO 0.12 -0.02 1.35 -0.63 -0.69 0.00 0.00 174.62 174.75 2ytx s ILE 66 N 1.78 4.12 0.45 1.82 -1.09 -1.26 -4.39 121.20 122.63 2ytx s ILE 66 Ca 0.00 1.33 0.08 0.00 -2.23 0.00 0.00 60.65 59.83 2ytx s ILE 66 Cb -0.16 -3.92 0.01 0.00 -1.58 0.00 0.00 42.46 36.81 2ytx s ILE 66 CO -0.07 -0.18 0.48 -0.54 -1.23 0.00 0.00 174.94 173.40 2ytx s LYS 67 N 3.75 2.55 -1.24 2.79 -0.14 -1.26 -4.94 119.74 121.24 2ytx s LYS 67 Ca 0.59 -1.53 -0.19 0.00 -1.36 0.00 0.00 55.97 53.48 2ytx s LYS 67 Cb -0.23 -2.47 0.06 0.00 -1.68 0.00 0.00 37.83 33.51 2ytx s LYS 67 CO 0.19 -0.34 1.70 0.34 -0.76 0.00 0.00 175.35 176.47 2ytx s ASP 68 N -4.27 6.70 -0.43 2.83 2.15 -1.26 -4.89 116.67 117.50 2ytx s ASP 68 Ca 0.50 -2.23 -0.13 0.00 0.43 0.00 0.00 52.55 51.12 2ytx s ASP 68 Cb -0.05 -2.58 0.06 0.00 -0.30 0.00 0.00 42.92 40.05 2ytx s ASP 68 CO 0.30 -1.31 0.31 -0.60 -0.17 0.00 0.00 175.17 173.69 2ytx s ARG 69 N 4.47 2.83 -0.36 4.34 6.06 -1.26 -5.03 118.95 129.99 2ytx s ARG 69 Ca 0.53 -1.30 -0.31 0.00 -2.50 0.00 0.00 55.73 52.14 2ytx s ARG 69 Cb 0.03 -3.93 -0.09 0.00 0.06 0.00 0.00 34.95 31.02 2ytx s ARG 69 CO 0.05 -0.92 2.27 0.09 -2.50 0.00 0.00 175.30 174.29 2ytx n ASN 70 N 5.07 2.42 0.00 -2.12 3.02 -1.26 -3.51 115.26 118.88 2ytx n ASN 70 Ca -0.11 0.19 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 2ytx n ASN 70 Cb 0.44 -1.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.22 2ytx n ASN 70 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ytx n GLY 71 N 6.22 1.60 3.32 7.41 0.00 -1.26 -5.07 105.19 117.41 2ytx n GLY 71 Ca 0.38 -0.51 -0.19 0.00 0.00 0.00 0.00 46.02 45.70 2ytx n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ytx s LYS 72 N 0.00 1.26 -0.40 1.61 -0.14 -1.23 -5.12 119.74 115.72 2ytx s LYS 72 Ca 0.00 -1.47 -0.18 0.00 -1.36 0.00 0.00 55.97 52.97 2ytx s LYS 72 Cb 0.00 -1.16 0.01 0.00 -1.68 0.00 0.00 37.83 35.01 2ytx s LYS 72 CO 0.00 0.21 0.47 -1.21 -0.76 0.00 0.00 175.35 174.07 2ytx s GLU 73 N -3.18 3.29 0.04 1.68 2.02 -1.26 -4.64 118.70 116.65 2ytx s GLU 73 Ca 0.18 -0.53 0.09 0.00 0.02 0.00 0.00 54.97 54.72 2ytx s GLU 73 Cb -0.03 -3.91 -0.03 0.00 0.10 0.00 0.00 34.13 30.26 2ytx s GLU 73 CO 0.06 -0.79 -0.25 0.14 0.02 0.00 0.00 175.26 174.44 2ytx s VAL 74 N 2.28 2.04 -0.30 2.63 -7.23 -1.26 -3.60 120.40 114.95 2ytx s VAL 74 Ca 0.15 -1.34 -0.24 0.00 -1.81 0.00 0.00 61.98 58.74 2ytx s VAL 74 Cb -0.16 -1.75 0.00 0.00 0.56 0.00 0.00 36.38 35.03 2ytx s VAL 74 CO 0.14 0.34 0.82 0.00 -0.31 0.00 0.00 175.10 176.10 2ytx s ALA 75 N -0.79 3.53 -0.10 1.32 0.00 -1.01 -4.61 121.76 120.10 2ytx s ALA 75 Ca 0.11 -0.37 -0.12 0.00 0.00 0.00 0.00 51.96 51.57 2ytx s ALA 75 Cb -0.10 -3.34 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 2ytx s ALA 75 CO 0.02 -1.22 0.29 0.99 0.00 0.00 0.00 175.76 175.84 2ytx s THR 76 N 3.03 5.27 -0.62 0.00 2.01 -1.26 -4.58 115.64 119.47 2ytx s THR 76 Ca 0.34 0.56 -0.10 0.00 0.31 0.00 0.00 61.69 62.79 2ytx s THR 76 Cb -0.14 -3.60 0.01 0.00 0.01 0.00 0.00 72.50 68.79 2ytx s THR 76 CO 0.13 0.51 0.65 0.47 -0.69 0.00 0.00 174.62 175.69 2ytx n ASP 77 N 2.58 -6.99 -4.71 3.53 8.00 -1.26 -4.48 116.55 113.22 2ytx n ASP 77 Ca -0.15 -0.07 -0.41 0.00 0.71 0.00 0.00 54.79 54.87 2ytx n ASP 77 Cb 0.53 -4.16 -0.03 0.00 -0.02 0.00 0.00 41.12 37.43 2ytx n ASP 77 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2ytx s VAL 78 N -2.67 4.92 -0.14 2.53 1.01 -1.22 -4.82 120.40 120.02 2ytx s VAL 78 Ca 0.13 1.88 0.00 0.00 0.00 0.00 0.00 61.98 63.99 2ytx s VAL 78 Cb -0.03 -4.24 -0.00 0.00 0.00 0.00 0.00 36.38 32.11 2ytx s VAL 78 CO 0.80 0.18 -0.16 -0.13 0.00 0.00 0.00 175.10 175.80 2ytx s ARG 79 N 0.97 3.24 0.31 2.72 3.00 -0.75 -0.12 118.95 128.32 2ytx s ARG 79 Ca 0.48 -0.75 -0.29 0.00 0.00 0.00 0.00 55.73 55.17 2ytx s ARG 79 Cb -0.20 -2.60 -0.12 0.00 0.00 0.00 0.00 34.95 32.03 2ytx s ARG 79 CO 0.25 0.07 1.47 1.28 0.00 0.00 0.00 175.30 178.37 2ytx n LEU 80 N 3.89 4.04 -4.87 2.53 4.77 -1.26 -0.57 117.00 125.54 2ytx n LEU 80 Ca -0.19 1.18 -0.31 0.00 -0.03 0.00 0.00 56.01 56.66 2ytx n LEU 80 Cb 0.52 -1.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.07 2ytx n LEU 80 CO 0.29 -0.11 0.70 -0.76 -1.33 0.00 0.00 177.39 176.18 2ytx s LEU 81 N -0.85 3.30 0.77 2.23 1.43 0.75 -4.80 118.68 121.51 2ytx s LEU 81 Ca 0.60 1.42 -0.11 0.00 -1.03 0.00 0.00 54.13 55.01 2ytx s LEU 81 Cb -0.54 -4.45 0.05 0.00 0.03 0.00 0.00 46.19 41.29 2ytx s LEU 81 CO 0.55 -0.82 1.09 -2.16 0.23 0.00 0.00 176.35 175.25 2ytx s PRO 82 N -5.01 2.27 0.45 1.29 0.04 -1.26 -4.74 135.00 128.04 2ytx s PRO 82 Ca 0.55 1.18 0.07 0.00 0.04 0.00 0.00 61.00 62.84 2ytx s PRO 82 Cb -0.11 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 2ytx s PRO 82 CO 0.50 -1.63 0.34 -0.65 0.04 0.00 0.00 177.00 175.61 2ytx s GLN 83 N -4.87 2.39 -0.19 4.56 -1.52 -1.26 -4.94 119.66 113.82 2ytx s GLN 83 Ca 0.61 -1.73 -0.15 0.00 -1.95 0.00 0.00 55.36 52.14 2ytx s GLN 83 Cb -0.17 -2.22 -0.08 0.00 -0.22 0.00 0.00 33.01 30.32 2ytx s GLN 83 CO 0.55 -0.29 -0.32 0.41 -0.25 0.00 0.00 175.29 175.39 2ytx n GLY 84 N -1.54 -0.47 3.36 3.09 0.00 -1.26 -4.92 105.19 103.45 2ytx n GLY 84 Ca 0.01 -0.24 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 2ytx n GLY 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ytx s THR 85 N -2.70 4.37 0.03 2.61 -4.23 -1.26 -5.07 115.64 109.39 2ytx s THR 85 Ca -0.30 -0.89 0.02 0.00 -1.18 0.00 0.00 61.69 59.35 2ytx s THR 85 Cb 0.07 -3.43 -0.02 0.00 1.34 0.00 0.00 72.50 70.47 2ytx s THR 85 CO 0.42 -0.19 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.54 2ytx s VAL 86 N 1.52 0.58 0.10 2.29 1.01 -1.26 -5.15 120.40 119.48 2ytx s VAL 86 Ca 0.01 -0.81 -0.16 0.00 0.00 0.00 0.00 61.98 61.02 2ytx s VAL 86 Cb -0.19 -0.58 -0.07 0.00 0.00 0.00 0.00 36.38 35.54 2ytx s VAL 86 CO 0.06 -0.18 0.54 -0.63 0.00 0.00 0.00 175.10 174.88 2ytx s ILE 87 N -0.92 4.83 0.35 2.22 1.01 -1.26 -5.04 121.20 122.39 2ytx s ILE 87 Ca -0.05 0.99 -0.28 0.00 0.00 0.00 0.00 60.65 61.31 2ytx s ILE 87 Cb -0.07 -3.80 -0.11 0.00 0.01 0.00 0.00 42.46 38.49 2ytx s ILE 87 CO 0.00 0.42 1.43 0.72 0.00 0.00 0.00 174.94 177.51 2ytx s PHE 88 N -1.27 2.77 0.34 3.97 -0.12 -1.26 -5.02 117.98 117.39 2ytx s PHE 88 Ca 0.32 1.22 0.05 0.00 -0.05 0.00 0.00 56.93 58.48 2ytx s PHE 88 Cb -0.17 -3.90 0.05 0.00 -0.63 0.00 0.00 43.02 38.37 2ytx s PHE 88 CO 0.18 -2.63 0.41 0.39 -0.05 0.00 0.00 175.22 173.53 2ytx n GLU 89 N 0.76 0.83 -3.34 1.99 1.02 -1.26 -4.78 120.64 115.86 2ytx n GLU 89 Ca 0.01 -1.88 -0.18 0.00 -0.02 0.00 0.00 57.16 55.09 2ytx n GLU 89 Cb 0.40 -0.05 0.06 0.00 -0.02 0.00 0.00 31.44 31.83 2ytx n GLU 89 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2ytx n ASP 90 N -2.43 -6.39 0.13 1.62 9.92 -1.26 -4.89 116.55 113.25 2ytx n ASP 90 Ca 0.07 -0.77 0.04 0.00 -0.53 0.00 0.00 54.79 53.60 2ytx n ASP 90 Cb 0.36 -4.81 0.44 0.00 -0.64 0.00 0.00 41.12 36.46 2ytx n ASP 90 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 2ytx h ILE 91 N -1.23 1.14 -2.50 0.53 5.03 -2.03 -3.43 117.51 115.02 2ytx h ILE 91 Ca -0.61 -0.59 -0.18 0.00 -0.12 0.00 0.00 64.86 63.35 2ytx h ILE 91 Cb 1.32 1.11 0.09 0.00 -3.03 0.00 0.00 36.82 36.30 2ytx h ILE 91 CO 0.45 0.19 0.10 -1.20 -0.68 0.00 0.00 178.15 177.00 2ytx n SER 92 N -4.34 -1.01 -3.03 1.72 7.64 -1.26 -5.10 113.62 108.24 2ytx n SER 92 Ca -0.01 -0.93 -0.16 0.00 1.01 0.00 0.00 58.87 58.78 2ytx n SER 92 Cb 0.22 -0.46 -0.05 0.00 -1.01 0.00 0.00 64.21 62.92 2ytx n SER 92 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ytx n GLY 93 N -0.21 3.55 3.71 0.23 0.00 -1.26 -5.12 105.19 106.09 2ytx n GLY 93 Ca 0.07 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 2ytx n GLY 93 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ytx s PRO 94 N -3.01 4.33 0.40 1.61 0.04 -1.26 -5.02 135.00 132.08 2ytx s PRO 94 Ca 0.13 2.03 0.02 0.00 0.04 0.00 0.00 61.00 63.22 2ytx s PRO 94 Cb 0.01 -3.30 -0.01 0.00 0.04 0.00 0.00 34.50 31.24 2ytx s PRO 94 CO 0.09 -0.43 0.09 0.43 0.04 0.00 0.00 177.00 177.22 2ytx n SER 95 N 4.10 1.89 -4.72 6.66 7.64 -1.26 -5.12 113.62 122.81 2ytx n SER 95 Ca 0.11 -2.97 -0.42 0.00 1.01 0.00 0.00 58.87 56.61 2ytx n SER 95 Cb 0.43 0.73 -0.03 0.00 -1.01 0.00 0.00 64.21 64.32 2ytx n SER 95 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ytx s SER 96 N -3.34 7.09 0.00 6.43 0.01 -1.26 -5.35 113.70 117.28 2ytx s SER 96 Ca 0.12 2.09 0.00 0.00 1.31 0.00 0.00 55.95 59.48 2ytx s SER 96 Cb 0.01 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.65 2ytx s SER 96 CO 0.09 -0.43 0.00 0.61 0.41 0.00 0.00 173.24 173.92