#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ytx s SER 2 N 0.00 4.83 -0.26 1.61 0.01 -1.26 -5.12 113.70 113.51 2ytx s SER 2 Ca 0.00 -1.07 -0.01 0.00 1.31 0.00 0.00 55.95 56.18 2ytx s SER 2 Cb 0.00 0.29 0.08 0.00 0.21 0.00 0.00 66.02 66.60 2ytx s SER 2 CO 0.00 -1.14 0.05 -0.44 0.41 0.00 0.00 173.24 172.12 2ytx s SER 3 N -4.39 3.63 0.00 2.44 0.01 -1.26 -5.08 113.70 109.05 2ytx s SER 3 Ca 0.44 -1.30 0.00 0.00 1.31 0.00 0.00 55.95 56.41 2ytx s SER 3 Cb -0.03 -0.83 0.00 0.00 0.21 0.00 0.00 66.02 65.37 2ytx s SER 3 CO 0.28 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 174.18 2ytx n GLY 4 N 4.89 -0.28 3.63 3.44 0.00 -1.26 -5.05 105.19 110.55 2ytx n GLY 4 Ca -0.06 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.85 2ytx n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ytx s SER 5 N -1.56 -0.71 0.08 1.61 0.15 -1.26 -5.07 113.70 106.94 2ytx s SER 5 Ca 0.00 1.33 -0.35 0.00 0.70 0.00 0.00 55.95 57.63 2ytx s SER 5 Cb 0.00 1.34 -0.18 0.00 -1.71 0.00 0.00 66.02 65.47 2ytx s SER 5 CO 0.00 -0.22 1.59 0.28 1.20 0.00 0.00 173.24 176.09 2ytx h SER 6 N 5.19 -1.06 0.00 5.45 0.02 -2.06 -3.48 113.55 117.61 2ytx h SER 6 Ca -0.29 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 2ytx h SER 6 Cb 1.17 0.31 0.00 0.00 0.14 0.00 0.00 62.40 64.03 2ytx h SER 6 CO 0.08 -0.64 0.00 0.61 -1.14 0.00 0.00 176.83 175.74 2ytx n GLY 7 N -1.55 0.75 3.48 -3.77 0.00 -1.26 -5.16 105.19 97.68 2ytx n GLY 7 Ca -0.13 -0.69 -0.11 0.00 0.00 0.00 0.00 46.02 45.09 2ytx n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ytx s ASN 8 N -0.92 -0.46 -0.18 1.61 4.22 -1.26 -5.18 114.94 112.77 2ytx s ASN 8 Ca 0.00 0.10 -0.25 0.00 -2.14 0.00 0.00 52.86 50.58 2ytx s ASN 8 Cb 0.00 0.46 0.06 0.00 1.28 0.00 0.00 41.25 43.05 2ytx s ASN 8 CO 0.00 -0.71 0.65 -0.51 -2.04 0.00 0.00 177.10 174.49 2ytx s ILE 9 N -2.96 0.00 0.41 0.54 -1.16 -1.26 -5.15 121.20 111.63 2ytx s ILE 9 Ca 0.02 -0.02 -0.24 0.00 -0.51 0.00 0.00 60.65 59.89 2ytx s ILE 9 Cb -0.01 -0.92 -0.11 0.00 0.61 0.00 0.00 42.46 42.03 2ytx s ILE 9 CO -0.08 -0.01 0.89 0.23 -2.81 0.00 0.00 174.94 173.16 2ytx n MET 10 N 2.17 1.13 0.12 3.50 2.81 -1.26 -4.94 117.12 120.65 2ytx n MET 10 Ca -0.16 0.41 -0.08 0.00 -1.81 0.00 0.00 57.70 56.06 2ytx n MET 10 Cb 0.56 -1.89 -0.05 0.00 -0.71 0.00 0.00 33.22 31.14 2ytx n MET 10 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 2ytx h LEU 11 N 1.36 -0.32 -7.65 4.03 5.85 -2.01 -3.49 115.31 113.08 2ytx h LEU 11 Ca -0.43 -0.11 0.21 0.00 0.84 0.00 0.00 57.88 58.40 2ytx h LEU 11 Cb 1.35 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 42.39 2ytx h LEU 11 CO 0.56 0.16 0.60 -0.22 -0.34 0.00 0.00 178.44 179.20 2ytx s LEU 12 N -9.02 -0.10 -0.99 2.25 0.20 -1.26 -5.08 118.68 104.69 2ytx s LEU 12 Ca -0.09 -0.40 -0.24 0.00 0.69 0.00 0.00 54.13 54.09 2ytx s LEU 12 Cb 0.01 1.94 -0.02 0.00 -0.43 0.00 0.00 46.19 47.68 2ytx s LEU 12 CO 0.29 -0.77 1.80 -0.54 -0.29 0.00 0.00 176.35 176.85 2ytx s LYS 13 N -2.78 2.90 0.04 1.98 3.01 -1.26 -4.88 119.74 118.74 2ytx s LYS 13 Ca 0.16 -0.70 -0.17 0.00 -1.01 0.00 0.00 55.97 54.24 2ytx s LYS 13 Cb -0.00 -5.19 0.03 0.00 -1.01 0.00 0.00 37.83 31.66 2ytx s LYS 13 CO 0.02 -3.08 0.39 0.21 0.51 0.00 0.00 175.35 173.39 2ytx s LYS 14 N 6.27 0.88 0.05 1.68 2.20 -1.26 -5.18 119.74 124.38 2ytx s LYS 14 Ca 0.63 -0.36 0.02 0.00 -0.36 0.00 0.00 55.97 55.90 2ytx s LYS 14 Cb -0.04 0.39 -0.03 0.00 -1.51 0.00 0.00 37.83 36.65 2ytx s LYS 14 CO -0.01 -0.29 -0.07 0.15 -0.36 0.00 0.00 175.35 174.77 2ytx s LYS 15 N -2.35 0.58 0.99 4.03 -0.14 -1.26 -5.13 119.74 116.46 2ytx s LYS 15 Ca -0.06 -0.89 -0.11 0.00 -1.36 0.00 0.00 55.97 53.54 2ytx s LYS 15 Cb -0.01 -0.21 0.18 0.00 -1.68 0.00 0.00 37.83 36.11 2ytx s LYS 15 CO -0.02 0.02 1.09 1.14 -0.76 0.00 0.00 175.35 176.82 2ytx s GLN 16 N -2.18 0.49 -0.13 1.68 -2.07 -1.26 -5.07 119.66 111.13 2ytx s GLN 16 Ca -0.05 1.05 -0.19 0.00 -1.82 0.00 0.00 55.36 54.35 2ytx s GLN 16 Cb -0.06 -1.70 0.05 0.00 -1.09 0.00 0.00 33.01 30.21 2ytx s GLN 16 CO -0.01 -2.84 0.49 0.00 -1.32 0.00 0.00 175.29 171.61 2ytx s ALA 17 N -2.69 -1.24 0.58 2.60 0.00 -1.26 -5.18 121.76 114.57 2ytx s ALA 17 Ca 0.66 1.16 0.03 0.00 0.00 0.00 0.00 51.96 53.82 2ytx s ALA 17 Cb -0.22 -0.48 0.06 0.00 0.00 0.00 0.00 23.12 22.49 2ytx s ALA 17 CO 0.60 -0.27 0.80 -0.98 0.00 0.00 0.00 175.76 175.91 2ytx s ARG 18 N -0.35 2.31 -0.22 0.00 1.04 -1.26 -4.45 118.95 116.02 2ytx s ARG 18 Ca -0.05 -1.10 -0.15 0.00 -1.04 0.00 0.00 55.73 53.38 2ytx s ARG 18 Cb -0.03 -2.52 0.06 0.00 -2.04 0.00 0.00 34.95 30.42 2ytx s ARG 18 CO 0.03 -0.86 0.55 0.00 -0.04 0.00 0.00 175.30 174.98 2ytx s GLN 20 N 1.06 1.08 0.00 0.00 -2.07 -1.26 -1.21 119.66 117.26 2ytx s GLN 20 Ca -0.06 -1.44 0.00 0.00 -1.82 0.00 0.00 55.36 52.04 2ytx s GLN 20 Cb -0.06 0.29 0.00 0.00 -1.09 0.00 0.00 33.01 32.15 2ytx s GLN 20 CO -0.10 -0.35 0.00 0.41 -1.32 0.00 0.00 175.29 173.93 2ytx n GLY 21 N -0.18 1.80 2.98 2.60 0.00 -0.84 -4.31 105.19 107.24 2ytx n GLY 21 Ca -0.03 0.20 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 1.53 -0.04 -0.51 1.61 1.01 -1.23 -3.00 120.40 119.77 2ytx s VAL 22 Ca 0.00 0.16 -0.32 0.00 0.00 0.00 0.00 61.98 61.83 2ytx s VAL 22 Cb 0.00 -0.30 -0.12 0.00 0.00 0.00 0.00 36.38 35.97 2ytx s VAL 22 CO 0.00 0.07 2.35 0.52 0.00 0.00 0.00 175.10 178.04 2ytx n VAL 23 N 4.17 0.08 -0.09 2.92 0.31 -0.55 -1.31 118.33 123.86 2ytx n VAL 23 Ca -0.26 -0.37 -0.17 0.00 -0.01 0.00 0.00 64.34 63.53 2ytx n VAL 23 Cb 0.52 -1.79 -0.11 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 -2.36 3.58 -0.24 0.00 0.00 -1.23 -4.92 121.76 116.58 2ytx s ALA 25 Ca -0.24 -0.02 -0.01 0.00 0.00 0.00 0.00 51.96 51.70 2ytx s ALA 25 Cb 0.03 -2.60 0.07 0.00 0.00 0.00 0.00 23.12 20.62 2ytx s ALA 25 CO 0.56 0.42 0.02 -1.64 0.00 0.00 0.00 175.76 175.12 2ytx s MET 26 N -1.41 1.05 0.39 0.00 -1.94 -1.26 -3.40 119.30 112.73 2ytx s MET 26 Ca 0.32 -0.84 0.03 0.00 -1.71 0.00 0.00 55.69 53.50 2ytx s MET 26 Cb -0.18 -2.30 -0.04 0.00 2.01 0.00 0.00 34.83 34.32 2ytx s MET 26 CO 0.19 -0.72 0.09 0.21 -0.01 0.00 0.00 175.02 174.79 2ytx s LYS 27 N 1.60 1.85 -0.73 2.03 2.47 -1.10 -5.05 119.74 120.82 2ytx s LYS 27 Ca 0.00 -2.10 -0.02 0.00 -1.56 0.00 0.00 55.97 52.29 2ytx s LYS 27 Cb -0.18 -0.78 0.35 0.00 -1.46 0.00 0.00 37.83 35.76 2ytx s LYS 27 CO -0.11 -0.37 2.11 -1.91 0.16 0.00 0.00 175.35 175.23 2ytx n GLU 28 N -0.86 2.65 0.00 4.03 4.07 -1.26 -4.32 120.64 124.95 2ytx n GLU 28 Ca -0.06 -3.23 0.00 0.00 -0.06 0.00 0.00 57.16 53.81 2ytx n GLU 28 Cb 0.66 -2.23 0.00 0.00 -0.06 0.00 0.00 31.44 29.81 2ytx n GLU 28 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2ytx n ALA 29 N -0.47 0.00 -3.42 4.31 0.00 -1.26 -5.14 120.51 114.53 2ytx n ALA 29 Ca 0.55 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.91 2ytx n ALA 29 Cb 0.42 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.83 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 -0.82 0.19 0.06 0.00 -0.12 -1.26 -2.74 117.98 113.29 2ytx s PHE 30 Ca 0.00 -0.59 -0.01 0.00 -0.05 0.00 0.00 56.93 56.28 2ytx s PHE 30 Cb 0.00 0.37 0.00 0.00 -0.63 0.00 0.00 43.02 42.77 2ytx s PHE 30 CO 0.00 -1.10 0.09 0.41 -0.05 0.00 0.00 175.22 174.58 2ytx n GLY 31 N -0.42 2.44 3.39 1.99 0.00 -1.10 -2.70 105.19 108.80 2ytx n GLY 31 Ca -0.02 -1.24 -0.20 0.00 0.00 0.00 0.00 46.02 44.55 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 -6.26 1.70 -0.04 1.61 0.40 -1.22 -3.26 117.98 110.91 2ytx s PHE 32 Ca 0.03 -1.22 0.00 0.00 -0.60 0.00 0.00 56.93 55.15 2ytx s PHE 32 Cb -0.00 -1.02 0.03 0.00 0.51 0.00 0.00 43.02 42.53 2ytx s PHE 32 CO 0.02 -0.32 -0.00 0.42 0.70 0.00 0.00 175.22 176.05 2ytx s ILE 33 N -3.50 0.21 -0.21 0.64 1.01 -1.26 -1.56 121.20 116.54 2ytx s ILE 33 Ca 0.34 0.09 -0.29 0.00 0.00 0.00 0.00 60.65 60.79 2ytx s ILE 33 Cb 0.06 -0.32 -0.01 0.00 0.01 0.00 0.00 42.46 42.20 2ytx s ILE 33 CO 0.15 0.17 1.31 -0.70 0.00 0.00 0.00 174.94 175.87 2ytx s GLU 34 N 1.18 4.11 1.04 2.79 2.12 -0.43 -4.47 118.70 125.03 2ytx s GLU 34 Ca -0.08 1.55 -0.16 0.00 0.36 0.00 0.00 54.97 56.65 2ytx s GLU 34 Cb -0.13 -3.83 0.07 0.00 0.26 0.00 0.00 34.13 30.51 2ytx s GLU 34 CO -0.02 -0.88 0.23 2.89 -0.54 0.00 0.00 175.26 176.94 2ytx n ARG 35 N 6.91 -0.96 0.00 4.30 0.00 -1.26 -3.52 116.66 122.13 2ytx n ARG 35 Ca 0.15 -0.25 0.00 0.00 -0.00 0.00 0.00 57.85 57.75 2ytx n ARG 35 Cb 0.45 -1.79 0.00 0.00 -0.00 0.00 0.00 32.46 31.12 2ytx n ARG 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2ytx n GLY 36 N 1.73 0.00 0.11 2.89 0.00 -1.26 -4.90 105.19 103.76 2ytx n GLY 36 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2ytx n GLY 36 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ytx n ASP 37 N -1.75 0.92 -4.88 1.61 5.75 -1.26 -5.01 116.55 111.93 2ytx n ASP 37 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 54.79 54.51 2ytx n ASP 37 Cb 0.01 0.28 -0.02 0.00 -1.03 0.00 0.00 41.12 40.37 2ytx n ASP 37 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 2ytx s VAL 38 N -2.51 1.54 -0.49 2.12 -7.23 -1.26 -5.06 120.40 107.51 2ytx s VAL 38 Ca -0.19 -1.59 0.04 0.00 -1.81 0.00 0.00 61.98 58.43 2ytx s VAL 38 Cb 0.07 -2.13 0.42 0.00 0.56 0.00 0.00 36.38 35.31 2ytx s VAL 38 CO 0.74 0.00 1.41 1.33 -0.31 0.00 0.00 175.10 178.28 2ytx n VAL 39 N -1.68 2.79 -3.90 1.32 0.24 -1.26 -4.77 118.33 111.07 2ytx n VAL 39 Ca -0.05 -4.34 -0.12 0.00 -2.04 0.00 0.00 64.34 57.78 2ytx n VAL 39 Cb 0.65 -1.21 -0.14 0.00 -1.47 0.00 0.00 33.84 31.67 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 -3.69 0.05 0.37 7.34 3.01 -1.26 -5.12 119.74 120.44 2ytx s LYS 40 Ca 0.52 -0.02 0.07 0.00 -1.01 0.00 0.00 55.97 55.53 2ytx s LYS 40 Cb 0.42 -0.05 -0.01 0.00 -1.01 0.00 0.00 37.83 37.19 2ytx s LYS 40 CO -0.13 0.01 0.46 -1.83 0.51 0.00 0.00 175.35 174.37 2ytx s GLU 41 N -0.01 2.90 0.17 1.68 -1.05 -1.26 -4.54 118.70 116.59 2ytx s GLU 41 Ca 0.00 -1.18 -0.05 0.00 -0.15 0.00 0.00 54.97 53.59 2ytx s GLU 41 Cb -0.00 -2.70 -0.03 0.00 -0.44 0.00 0.00 34.13 30.97 2ytx s GLU 41 CO -0.00 -0.06 0.18 0.96 0.95 0.00 0.00 175.26 177.30 2ytx s ILE 42 N -2.28 0.06 -0.04 1.83 -0.00 -1.26 -4.80 121.20 114.70 2ytx s ILE 42 Ca 0.48 -1.71 0.06 0.00 -0.00 0.00 0.00 60.65 59.47 2ytx s ILE 42 Cb -0.08 -2.09 -0.02 0.00 -0.00 0.00 0.00 42.46 40.27 2ytx s ILE 42 CO 0.31 -0.27 -0.20 0.12 -0.00 0.00 0.00 174.94 174.89 2ytx s PHE 43 N -4.04 2.52 0.02 1.37 2.19 -1.21 -4.11 117.98 114.73 2ytx s PHE 43 Ca 0.25 -0.33 0.01 0.00 0.33 0.00 0.00 56.93 57.19 2ytx s PHE 43 Cb 0.05 -1.57 -0.02 0.00 -1.31 0.00 0.00 43.02 40.17 2ytx s PHE 43 CO 0.04 0.05 -0.06 -0.59 1.83 0.00 0.00 175.22 176.49 2ytx s PHE 44 N -0.62 0.49 -0.05 10.12 -0.71 -1.20 -1.51 117.98 124.50 2ytx s PHE 44 Ca 0.09 -0.36 -0.00 0.00 -1.04 0.00 0.00 56.93 55.62 2ytx s PHE 44 Cb -0.11 -0.31 -0.03 0.00 -1.21 0.00 0.00 43.02 41.36 2ytx s PHE 44 CO 0.00 -0.08 -0.02 -1.58 -1.34 0.00 0.00 175.22 172.21 2ytx s HIS 45 N -0.96 3.07 0.56 3.49 2.46 -1.26 -2.72 115.29 119.93 2ytx s HIS 45 Ca -0.07 0.11 0.26 0.00 0.47 0.00 0.00 55.06 55.83 2ytx s HIS 45 Cb -0.07 -1.73 1.49 0.00 -0.13 0.00 0.00 32.58 32.13 2ytx s HIS 45 CO -0.00 0.43 2.02 1.88 -2.47 0.00 0.00 174.74 176.60 2ytx h TYR 46 N 4.93 0.00 -0.79 3.88 0.05 -1.89 -0.43 116.97 122.72 2ytx h TYR 46 Ca -0.50 0.00 0.15 0.00 0.05 0.00 0.00 58.73 58.44 2ytx h TYR 46 Cb 1.18 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.87 2ytx h TYR 46 CO 0.61 0.00 0.53 0.66 -1.05 0.00 0.00 178.16 178.90 2ytx h SER 47 N 0.00 0.43 0.54 3.88 4.64 -1.94 -0.84 113.55 120.25 2ytx h SER 47 Ca 0.17 0.03 -0.19 0.00 -0.47 0.00 0.00 61.79 61.33 2ytx h SER 47 Cb 0.80 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.80 2ytx h SER 47 CO -0.00 0.22 -1.61 -0.62 -0.87 0.00 0.00 176.83 173.95 2ytx n GLU 48 N -4.49 0.63 -1.65 4.77 4.71 -0.20 -4.92 120.64 119.49 2ytx n GLU 48 Ca 0.15 0.16 -0.49 0.00 -0.01 0.00 0.00 57.16 56.97 2ytx n GLU 48 Cb 0.54 -1.75 -0.05 0.00 -1.01 0.00 0.00 31.44 29.17 2ytx n GLU 48 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2ytx n PHE 49 N -2.83 1.99 -3.72 -0.32 7.35 -0.32 -3.55 117.46 116.06 2ytx n PHE 49 Ca -0.13 0.39 -0.31 0.00 -0.76 0.00 0.00 57.45 56.64 2ytx n PHE 49 Cb 0.87 -2.48 -0.09 0.00 0.35 0.00 0.00 39.48 38.14 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 3.70 2.30 0.00 -4.13 4.76 0.64 -4.92 118.16 120.51 2ytx n LYS 50 Ca 0.19 -4.52 0.00 0.00 -2.87 0.00 0.00 58.31 51.11 2ytx n LYS 50 Cb 0.24 -2.34 0.00 0.00 -1.84 0.00 0.00 35.03 31.09 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 1.92 2.62 3.51 0.72 0.00 -1.26 -4.30 105.19 108.39 2ytx n GLY 51 Ca 0.22 0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 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 2.00 5.97 0.20 1.61 1.01 -1.26 -4.94 116.67 121.26 2ytx s ASP 52 Ca 0.00 -0.47 0.17 0.00 0.71 0.00 0.00 52.55 52.96 2ytx s ASP 52 Cb 0.00 -2.11 -0.00 0.00 1.01 0.00 0.00 42.92 41.81 2ytx s ASP 52 CO 0.00 -0.24 1.19 0.25 0.21 0.00 0.00 175.17 176.58 2ytx h LEU 53 N 8.47 0.00 0.13 1.23 7.12 -1.99 -3.36 115.31 126.91 2ytx h LEU 53 Ca -0.31 0.00 -0.36 0.00 0.13 0.00 0.00 57.88 57.34 2ytx h LEU 53 Cb 1.15 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 41.27 2ytx h LEU 53 CO 0.64 0.46 -1.97 1.05 -0.13 0.00 0.00 178.44 178.49 2ytx h GLU 54 N 0.00 0.26 -3.57 1.25 4.11 -2.06 -3.42 114.58 111.15 2ytx h GLU 54 Ca -0.06 -0.45 -0.71 0.00 0.07 0.00 0.00 59.36 58.20 2ytx h GLU 54 Cb 1.41 0.17 -0.34 0.00 0.50 0.00 0.00 28.75 30.49 2ytx h GLU 54 CO 0.05 1.20 -0.24 0.95 0.07 0.00 0.00 179.01 181.03 2ytx s THR 55 N -2.56 4.14 -0.47 -1.06 -4.23 -1.26 -4.91 115.64 105.29 2ytx s THR 55 Ca -0.21 -3.01 0.06 0.00 -1.18 0.00 0.00 61.69 57.35 2ytx s THR 55 Cb 0.07 -3.65 0.22 0.00 1.34 0.00 0.00 72.50 70.48 2ytx s THR 55 CO 0.78 -0.93 0.71 -0.11 -0.54 0.00 0.00 174.62 174.53 2ytx n LEU 56 N 3.40 -2.29 -3.70 4.79 7.94 -1.26 -4.60 117.00 121.28 2ytx n LEU 56 Ca 0.11 -3.54 -0.10 0.00 -1.11 0.00 0.00 56.01 51.36 2ytx n LEU 56 Cb 0.39 0.75 -0.05 0.00 0.53 0.00 0.00 43.42 45.04 2ytx n LEU 56 CO 0.34 1.98 0.14 -1.10 -1.11 0.00 0.00 177.39 177.64 2ytx s GLN 57 N 0.37 1.11 0.39 1.96 -0.21 -1.26 -4.32 119.66 117.70 2ytx s GLN 57 Ca 0.32 -0.80 0.28 0.00 0.02 0.00 0.00 55.36 55.18 2ytx s GLN 57 Cb 0.13 0.46 1.18 0.00 1.00 0.00 0.00 33.01 35.77 2ytx s GLN 57 CO -0.16 -0.43 1.84 -1.00 -2.12 0.00 0.00 175.29 173.42 2ytx h PRO 58 N 2.38 0.00 0.00 2.91 0.13 -2.00 -3.41 132.00 132.01 2ytx h PRO 58 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2ytx h PRO 58 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2ytx h PRO 58 CO 0.46 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.64 2ytx n GLY 59 N -0.03 -0.29 1.28 1.56 0.00 -1.26 -4.96 105.19 101.50 2ytx n GLY 59 Ca 0.01 -0.01 0.16 0.00 0.00 0.00 0.00 46.02 46.18 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 -2.01 -7.21 -4.85 1.61 9.92 -1.26 -4.10 116.55 108.64 2ytx n ASP 60 Ca 0.00 1.18 -0.34 0.00 -0.53 0.00 0.00 54.79 55.09 2ytx n ASP 60 Cb 0.00 -4.33 -0.06 0.00 -0.64 0.00 0.00 41.12 36.09 2ytx n ASP 60 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 2ytx s ASP 61 N -6.93 6.79 0.03 -2.24 1.11 -1.26 -1.48 116.67 112.69 2ytx s ASP 61 Ca 0.00 1.09 -0.00 0.00 0.18 0.00 0.00 52.55 53.82 2ytx s ASP 61 Cb 0.00 -2.29 -0.03 0.00 1.07 0.00 0.00 42.92 41.67 2ytx s ASP 61 CO 0.00 0.03 -0.03 0.68 1.18 0.00 0.00 175.17 177.02 2ytx s VAL 62 N -1.60 0.17 0.26 -1.27 -7.23 -1.16 -0.21 120.40 109.36 2ytx s VAL 62 Ca 0.42 -1.17 0.10 0.00 -1.81 0.00 0.00 61.98 59.52 2ytx s VAL 62 Cb -0.14 -0.63 -0.04 0.00 0.56 0.00 0.00 36.38 36.12 2ytx s VAL 62 CO 0.20 -0.63 -0.07 -0.70 -0.31 0.00 0.00 175.10 173.58 2ytx s GLU 63 N -2.15 2.09 0.18 4.82 -6.30 0.80 -1.98 118.70 116.16 2ytx s GLU 63 Ca -0.09 -1.50 -0.24 0.00 -2.50 0.00 0.00 54.97 50.64 2ytx s GLU 63 Cb -0.05 -2.05 0.06 0.00 0.00 0.00 0.00 34.13 32.09 2ytx s GLU 63 CO -0.03 0.36 0.95 -0.59 0.02 0.00 0.00 175.26 175.97 2ytx s PHE 64 N -2.31 -0.09 -0.09 5.30 -0.12 -0.35 -2.06 117.98 118.27 2ytx s PHE 64 Ca 0.30 -0.26 -0.01 0.00 -0.05 0.00 0.00 56.93 56.91 2ytx s PHE 64 Cb -0.06 0.67 0.03 0.00 -0.63 0.00 0.00 43.02 43.02 2ytx s PHE 64 CO 0.18 -0.91 -0.04 0.99 -0.05 0.00 0.00 175.22 175.39 2ytx s THR 65 N -3.11 0.70 0.04 -4.49 2.01 -1.26 -1.69 115.64 107.84 2ytx s THR 65 Ca 0.14 -0.09 -0.25 0.00 0.31 0.00 0.00 61.69 61.80 2ytx s THR 65 Cb -0.02 -0.78 -0.05 0.00 0.01 0.00 0.00 72.50 71.66 2ytx s THR 65 CO 0.04 0.31 0.77 -0.63 -0.69 0.00 0.00 174.62 174.41 2ytx s ILE 66 N 1.74 4.74 0.51 1.82 -1.09 -1.26 -4.05 121.20 123.60 2ytx s ILE 66 Ca 0.03 1.64 0.03 0.00 -2.23 0.00 0.00 60.65 60.12 2ytx s ILE 66 Cb -0.13 -4.12 -0.00 0.00 -1.58 0.00 0.00 42.46 36.63 2ytx s ILE 66 CO -0.06 0.36 0.14 -0.54 -1.23 0.00 0.00 174.94 173.61 2ytx s LYS 67 N -0.03 2.21 -0.54 2.79 -0.14 -1.26 -4.90 119.74 117.87 2ytx s LYS 67 Ca 0.39 -2.24 -0.27 0.00 -1.36 0.00 0.00 55.97 52.49 2ytx s LYS 67 Cb -0.20 -1.74 -0.01 0.00 -1.68 0.00 0.00 37.83 34.19 2ytx s LYS 67 CO 0.23 -0.42 1.72 0.34 -0.76 0.00 0.00 175.35 176.46 2ytx s ASP 68 N -4.00 5.66 0.10 2.83 2.15 -1.26 -4.92 116.67 117.22 2ytx s ASP 68 Ca 0.18 0.53 0.08 0.00 0.43 0.00 0.00 52.55 53.77 2ytx s ASP 68 Cb 0.01 -2.53 -0.03 0.00 -0.30 0.00 0.00 42.92 40.06 2ytx s ASP 68 CO 0.10 -2.04 -0.21 -0.60 -0.17 0.00 0.00 175.17 172.26 2ytx s ARG 69 N 6.29 1.14 -0.34 4.34 6.06 -1.26 -5.12 118.95 130.07 2ytx s ARG 69 Ca 0.66 -1.16 -0.16 0.00 -2.50 0.00 0.00 55.73 52.57 2ytx s ARG 69 Cb -0.14 -1.41 -0.01 0.00 0.06 0.00 0.00 34.95 33.45 2ytx s ARG 69 CO 0.25 0.33 0.41 1.21 -2.50 0.00 0.00 175.30 174.99 2ytx s ASN 70 N -1.88 6.23 0.00 -2.12 2.47 -1.26 -4.64 114.94 113.74 2ytx s ASN 70 Ca 0.07 -0.13 0.00 0.00 0.42 0.00 0.00 52.86 53.22 2ytx s ASN 70 Cb -0.10 -2.22 0.00 0.00 -1.45 0.00 0.00 41.25 37.48 2ytx s ASN 70 CO 0.04 -0.37 0.00 0.61 -3.72 0.00 0.00 177.10 173.67 2ytx n GLY 71 N 4.88 2.18 3.47 1.21 0.00 -1.26 -4.99 105.19 110.69 2ytx n GLY 71 Ca -0.08 -0.66 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 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 1.67 -0.18 1.61 -0.14 -1.26 -5.14 119.74 116.30 2ytx s LYS 72 Ca 0.00 -1.90 -0.02 0.00 -1.36 0.00 0.00 55.97 52.69 2ytx s LYS 72 Cb 0.00 -1.14 -0.01 0.00 -1.68 0.00 0.00 37.83 35.01 2ytx s LYS 72 CO 0.00 -0.07 -0.09 -1.83 -0.76 0.00 0.00 175.35 172.60 2ytx s GLU 73 N -3.79 3.34 0.01 1.68 1.03 -1.26 -4.67 118.70 115.04 2ytx s GLU 73 Ca 0.33 -0.67 0.05 0.00 0.03 0.00 0.00 54.97 54.72 2ytx s GLU 73 Cb 0.07 -2.83 -0.03 0.00 -0.80 0.00 0.00 34.13 30.54 2ytx s GLU 73 CO 0.15 -0.05 -0.14 0.14 -1.33 0.00 0.00 175.26 174.03 2ytx s VAL 74 N 1.04 3.10 -0.32 1.83 -7.23 -1.26 -3.32 120.40 114.23 2ytx s VAL 74 Ca -0.00 -0.96 -0.24 0.00 -1.81 0.00 0.00 61.98 58.97 2ytx s VAL 74 Cb -0.15 -2.30 0.00 0.00 0.56 0.00 0.00 36.38 34.50 2ytx s VAL 74 CO -0.01 0.41 0.82 0.00 -0.31 0.00 0.00 175.10 176.00 2ytx s ALA 75 N -0.90 3.50 -0.09 1.32 0.00 -0.57 -4.63 121.76 120.40 2ytx s ALA 75 Ca 0.15 -0.44 -0.11 0.00 0.00 0.00 0.00 51.96 51.56 2ytx s ALA 75 Cb -0.11 -3.35 -0.05 0.00 0.00 0.00 0.00 23.12 19.61 2ytx s ALA 75 CO 0.05 -1.30 0.26 0.99 0.00 0.00 0.00 175.76 175.76 2ytx s THR 76 N 3.07 5.30 -0.67 0.00 2.01 -1.26 -4.59 115.64 119.50 2ytx s THR 76 Ca 0.33 0.49 -0.06 0.00 0.31 0.00 0.00 61.69 62.76 2ytx s THR 76 Cb -0.14 -3.55 0.01 0.00 0.01 0.00 0.00 72.50 68.83 2ytx s THR 76 CO 0.14 0.56 0.66 -0.67 -0.69 0.00 0.00 174.62 174.62 2ytx n ASP 77 N 2.26 -7.08 -4.70 3.53 2.03 -1.26 -4.27 116.55 107.05 2ytx n ASP 77 Ca -0.16 -0.12 -0.42 0.00 0.52 0.00 0.00 54.79 54.61 2ytx n ASP 77 Cb 0.53 -4.34 -0.03 0.00 -0.72 0.00 0.00 41.12 36.56 2ytx n ASP 77 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2ytx s VAL 78 N -2.80 4.89 -0.11 5.18 1.01 -1.23 -4.75 120.40 122.59 2ytx s VAL 78 Ca 0.08 1.87 0.04 0.00 0.00 0.00 0.00 61.98 63.97 2ytx s VAL 78 Cb -0.02 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 32.13 2ytx s VAL 78 CO 0.79 0.13 -0.23 -0.13 0.00 0.00 0.00 175.10 175.65 2ytx s ARG 79 N 1.35 3.03 0.71 2.72 0.52 -0.87 -0.26 118.95 126.14 2ytx s ARG 79 Ca 0.46 -0.87 -0.16 0.00 -0.52 0.00 0.00 55.73 54.64 2ytx s ARG 79 Cb -0.19 -2.32 -0.01 0.00 0.52 0.00 0.00 34.95 32.95 2ytx s ARG 79 CO 0.22 0.14 0.83 1.28 0.02 0.00 0.00 175.30 177.78 2ytx n LEU 80 N 3.64 2.64 -4.89 2.53 4.77 -1.26 -0.14 117.00 124.30 2ytx n LEU 80 Ca -0.19 0.65 -0.22 0.00 -0.03 0.00 0.00 56.01 56.22 2ytx n LEU 80 Cb 0.53 -1.34 -0.03 0.00 -2.33 0.00 0.00 43.42 40.24 2ytx n LEU 80 CO 0.28 -2.38 -0.11 -0.76 -1.33 0.00 0.00 177.39 173.08 2ytx s LEU 81 N -2.12 4.06 0.00 2.23 1.43 0.70 -4.66 118.68 120.32 2ytx s LEU 81 Ca 0.71 -0.08 -0.16 0.00 -1.03 0.00 0.00 54.13 53.57 2ytx s LEU 81 Cb -0.35 -2.61 0.23 0.00 0.03 0.00 0.00 46.19 43.49 2ytx s LEU 81 CO 0.53 -0.04 0.83 -0.81 0.23 0.00 0.00 176.35 177.09 2ytx n PRO 82 N -1.16 -2.66 -2.51 1.29 -0.04 -1.26 -4.72 135.00 123.94 2ytx n PRO 82 Ca -0.08 -1.33 -0.03 0.00 -0.04 0.00 0.00 63.50 62.02 2ytx n PRO 82 Cb 0.57 -1.25 -0.02 0.00 -0.04 0.00 0.00 33.50 32.76 2ytx n PRO 82 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2ytx n GLN 83 N -4.06 -3.57 0.00 0.54 7.27 -1.26 -4.86 117.38 111.44 2ytx n GLN 83 Ca 0.12 2.82 0.00 0.00 0.07 0.00 0.00 57.00 60.00 2ytx n GLN 83 Cb 0.45 -4.74 0.00 0.00 2.41 0.00 0.00 30.24 28.36 2ytx n GLN 83 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2ytx n GLY 84 N 1.05 0.91 3.25 1.69 0.00 -1.26 -4.84 105.19 105.99 2ytx n GLY 84 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 2ytx n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ytx s THR 85 N -1.56 2.06 0.52 2.61 2.01 -1.26 -4.96 115.64 115.07 2ytx s THR 85 Ca 0.00 -1.05 -0.22 0.00 0.31 0.00 0.00 61.69 60.73 2ytx s THR 85 Cb 0.00 -1.75 -0.06 0.00 0.01 0.00 0.00 72.50 70.70 2ytx s THR 85 CO 0.00 0.57 1.25 -0.69 -0.69 0.00 0.00 174.62 175.06 2ytx s VAL 86 N 0.01 2.61 -0.03 3.82 1.01 -1.26 -5.02 120.40 121.53 2ytx s VAL 86 Ca -0.09 0.44 -0.02 0.00 0.00 0.00 0.00 61.98 62.30 2ytx s VAL 86 Cb -0.15 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 32.98 2ytx s VAL 86 CO 0.06 -0.02 0.12 -0.63 0.00 0.00 0.00 175.10 174.62 2ytx s ILE 87 N -1.46 5.06 0.53 2.22 -1.09 -1.26 -5.10 121.20 120.11 2ytx s ILE 87 Ca 0.70 -0.20 -0.19 0.00 -2.23 0.00 0.00 60.65 58.73 2ytx s ILE 87 Cb -0.33 -3.30 -0.06 0.00 -1.58 0.00 0.00 42.46 37.19 2ytx s ILE 87 CO 0.39 0.41 1.06 -0.36 -1.23 0.00 0.00 174.94 175.22 2ytx s PHE 88 N -1.18 2.93 1.38 3.97 0.40 -1.26 -5.03 117.98 119.19 2ytx s PHE 88 Ca 0.22 1.55 -0.21 0.00 -0.60 0.00 0.00 56.93 57.89 2ytx s PHE 88 Cb -0.12 -3.09 0.35 0.00 0.51 0.00 0.00 43.02 40.67 2ytx s PHE 88 CO 0.13 -1.07 0.95 -1.21 0.70 0.00 0.00 175.22 174.72 2ytx s GLU 89 N -3.53 -2.63 -0.25 0.44 0.41 -1.26 -5.01 118.70 106.87 2ytx s GLU 89 Ca 0.67 0.21 -0.04 0.00 -0.41 0.00 0.00 54.97 55.40 2ytx s GLU 89 Cb -0.18 -1.41 -0.14 0.00 -1.78 0.00 0.00 34.13 30.63 2ytx s GLU 89 CO 0.27 -4.70 -0.27 -0.25 -0.49 0.00 0.00 175.26 169.82 2ytx n ASP 90 N -5.52 2.00 0.21 -0.19 8.00 -1.26 -4.44 116.55 115.35 2ytx n ASP 90 Ca 0.11 0.04 0.06 0.00 0.71 0.00 0.00 54.79 55.72 2ytx n ASP 90 Cb 0.59 -0.54 0.45 0.00 -0.02 0.00 0.00 41.12 41.60 2ytx n ASP 90 CO 0.00 0.00 0.00 0.16 -0.39 0.00 0.00 177.20 176.97 2ytx h ILE 91 N -0.37 0.98 -3.57 0.53 3.07 -2.06 -3.39 117.51 112.70 2ytx h ILE 91 Ca -0.60 -1.15 -0.71 0.00 1.55 0.00 0.00 64.86 63.95 2ytx h ILE 91 Cb 1.75 1.66 -0.23 0.00 -0.27 0.00 0.00 36.82 39.73 2ytx h ILE 91 CO -0.21 0.30 -0.49 -0.44 -1.05 0.00 0.00 178.15 176.26 2ytx s SER 92 N -6.60 5.82 -0.49 2.16 0.01 -1.26 -4.99 113.70 108.35 2ytx s SER 92 Ca -0.02 -0.93 0.07 0.00 1.31 0.00 0.00 55.95 56.38 2ytx s SER 92 Cb 0.13 -2.06 0.26 0.00 0.21 0.00 0.00 66.02 64.57 2ytx s SER 92 CO 0.68 -0.39 0.65 0.61 0.41 0.00 0.00 173.24 175.20 2ytx n GLY 93 N 5.04 3.81 3.72 3.44 0.00 -1.26 -4.42 105.19 115.50 2ytx n GLY 93 Ca -0.12 -2.09 -0.30 0.00 0.00 0.00 0.00 46.02 43.51 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 -1.90 1.21 0.15 1.61 0.04 -1.26 -5.07 135.00 129.79 2ytx s PRO 94 Ca 0.38 0.80 -0.23 0.00 0.04 0.00 0.00 61.00 61.99 2ytx s PRO 94 Cb 0.18 -1.80 0.08 0.00 0.04 0.00 0.00 34.50 33.00 2ytx s PRO 94 CO -0.07 -2.27 1.08 -1.54 0.04 0.00 0.00 177.00 174.23 2ytx s SER 95 N -3.42 0.00 0.37 6.66 1.04 -1.26 -5.11 113.70 111.99 2ytx s SER 95 Ca 0.64 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 56.46 2ytx s SER 95 Cb -0.18 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.39 2ytx s SER 95 CO 0.57 -0.89 0.00 -0.24 0.98 0.00 0.00 173.24 173.66 2ytx n SER 96 N -1.20 -3.37 0.00 7.02 2.88 -1.26 -5.36 113.62 112.33 2ytx n SER 96 Ca -0.02 0.73 0.05 0.00 -1.33 0.00 0.00 58.87 58.30 2ytx n SER 96 Cb 0.59 3.23 0.31 0.00 -0.75 0.00 0.00 64.21 67.58 2ytx n SER 96 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42