#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuz n SER 2 N 0.00 -5.78 -4.99 1.61 2.88 -1.26 -4.98 113.62 101.11 2yuz n SER 2 Ca 0.00 -0.60 -0.20 0.00 -1.33 0.00 0.00 58.87 56.75 2yuz n SER 2 Cb 0.00 -4.58 0.01 0.00 -0.75 0.00 0.00 64.21 58.89 2yuz n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yuz s SER 3 N -3.25 5.74 -0.29 -3.46 0.15 -1.26 -5.12 113.70 106.21 2yuz s SER 3 Ca 0.59 -0.12 -0.15 0.00 0.70 0.00 0.00 55.95 56.97 2yuz s SER 3 Cb -0.28 -1.08 0.13 0.00 -1.71 0.00 0.00 66.02 63.09 2yuz s SER 3 CO 0.73 -0.70 0.85 -0.83 1.20 0.00 0.00 173.24 174.49 2yuz s GLY 4 N -4.27 -0.31 -0.27 9.45 0.00 -1.26 -5.06 107.32 105.60 2yuz s GLY 4 Ca 0.51 2.82 -0.11 0.00 0.00 0.00 0.00 44.72 47.93 2yuz s GLY 4 CO 0.34 2.73 -0.27 -1.26 0.00 0.00 0.00 173.10 174.63 2yuz n SER 5 N 4.35 1.96 -4.44 1.64 2.88 -1.26 -4.99 113.62 113.75 2yuz n SER 5 Ca -0.16 0.24 -0.30 0.00 -1.33 0.00 0.00 58.87 57.32 2yuz n SER 5 Cb 0.56 -0.74 -0.12 0.00 -0.75 0.00 0.00 64.21 63.15 2yuz n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2yuz s SER 6 N -7.24 3.65 0.00 -3.46 1.04 -1.26 -5.06 113.70 101.37 2yuz s SER 6 Ca -0.37 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 55.48 2yuz s SER 6 Cb 0.13 -0.45 0.00 0.00 0.10 0.00 0.00 66.02 65.79 2yuz s SER 6 CO 0.53 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.56 2yuz n GLY 7 N 1.11 0.39 3.74 7.32 0.00 -1.26 -5.13 105.19 111.37 2yuz n GLY 7 Ca -0.16 0.37 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2yuz n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2yuz s LEU 8 N 0.00 4.46 -0.40 0.99 2.96 -1.26 -5.01 118.68 120.42 2yuz s LEU 8 Ca 0.00 2.19 -0.04 0.00 -0.22 0.00 0.00 54.13 56.07 2yuz s LEU 8 Cb 0.00 -3.61 0.10 0.00 0.50 0.00 0.00 46.19 43.18 2yuz s LEU 8 CO 0.00 -0.32 0.19 -0.54 -1.32 0.00 0.00 176.35 174.37 2yuz s LYS 9 N -0.34 2.14 -0.25 1.98 -0.14 -1.26 -5.03 119.74 116.85 2yuz s LYS 9 Ca 0.51 -1.72 -0.28 0.00 -1.36 0.00 0.00 55.97 53.13 2yuz s LYS 9 Cb -0.32 -3.58 -0.05 0.00 -1.68 0.00 0.00 37.83 32.20 2yuz s LYS 9 CO 0.36 -1.02 2.25 0.42 -0.76 0.00 0.00 175.35 176.61 2yuz s ILE 10 N 1.20 3.00 -0.11 2.17 1.09 -1.26 -3.25 121.20 124.03 2yuz s ILE 10 Ca 0.06 0.00 -0.06 0.00 -1.10 0.00 0.00 60.65 59.55 2yuz s ILE 10 Cb -0.23 -3.00 -0.05 0.00 -1.06 0.00 0.00 42.46 38.12 2yuz s ILE 10 CO -0.03 -0.00 0.10 -0.07 -0.10 0.00 0.00 174.94 174.84 2yuz h LEU 11 N 15.62 0.00 -7.36 2.97 3.38 -1.75 -3.43 115.31 124.74 2yuz h LEU 11 Ca -0.39 -0.16 -0.65 0.00 0.09 0.00 0.00 57.88 56.77 2yuz h LEU 11 Cb 1.24 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.59 2yuz h LEU 11 CO 0.98 0.63 -0.57 -0.89 0.09 0.00 0.00 178.44 178.68 2yuz s THR 12 N -1.74 2.84 0.91 0.22 2.01 0.15 -4.93 115.64 115.09 2yuz s THR 12 Ca -0.05 -3.44 -0.12 0.00 0.31 0.00 0.00 61.69 58.39 2yuz s THR 12 Cb -0.00 -2.93 0.13 0.00 0.01 0.00 0.00 72.50 69.72 2yuz s THR 12 CO 0.14 -0.85 1.09 -2.16 -0.69 0.00 0.00 174.62 172.15 2yuz s PRO 13 N -0.48 1.17 0.12 4.92 0.04 -1.26 0.01 135.00 139.52 2yuz s PRO 13 Ca 0.18 0.79 -0.30 0.00 0.04 0.00 0.00 61.00 61.71 2yuz s PRO 13 Cb -0.21 -1.80 -0.07 0.00 0.04 0.00 0.00 34.50 32.45 2yuz s PRO 13 CO -0.03 -2.29 1.24 -0.51 0.04 0.00 0.00 177.00 175.45 2yuz s LEU 14 N -6.24 4.40 0.00 -3.56 1.43 -1.26 -4.81 118.68 108.63 2yuz s LEU 14 Ca 0.64 2.18 0.00 0.00 -1.03 0.00 0.00 54.13 55.92 2yuz s LEU 14 Cb -0.18 -3.59 0.10 0.00 0.03 0.00 0.00 46.19 42.55 2yuz s LEU 14 CO 0.57 -0.48 0.69 0.35 0.23 0.00 0.00 176.35 177.71 2yuz n THR 15 N 3.36 0.00 -3.40 5.49 -2.24 -1.26 -4.65 114.28 111.59 2yuz n THR 15 Ca 0.08 -1.10 -0.38 0.00 -2.27 0.00 0.00 64.05 60.38 2yuz n THR 15 Cb 0.45 -1.03 -0.08 0.00 -2.10 0.00 0.00 70.33 67.57 2yuz n THR 15 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2yuz s ASP 16 N -3.80 6.37 -0.05 3.42 1.47 -1.26 -4.38 116.67 118.45 2yuz s ASP 16 Ca 0.46 0.43 0.06 0.00 1.18 0.00 0.00 52.55 54.68 2yuz s ASP 16 Cb -0.03 -2.22 -0.01 0.00 -0.34 0.00 0.00 42.92 40.32 2yuz s ASP 16 CO 0.30 -0.11 -0.22 -1.10 0.68 0.00 0.00 175.17 174.72 2yuz s GLN 17 N 1.54 2.27 -0.10 2.11 1.11 -1.03 -5.02 119.66 120.54 2yuz s GLN 17 Ca 0.17 -0.81 -0.00 0.00 0.01 0.00 0.00 55.36 54.73 2yuz s GLN 17 Cb -0.15 -1.95 0.02 0.00 -1.01 0.00 0.00 33.01 29.93 2yuz s GLN 17 CO 0.08 0.34 -0.07 0.99 0.01 0.00 0.00 175.29 176.65 2yuz s THR 18 N -0.12 0.94 0.07 -0.19 2.01 -1.26 -3.29 115.64 113.79 2yuz s THR 18 Ca -0.03 -0.25 -0.00 0.00 0.31 0.00 0.00 61.69 61.72 2yuz s THR 18 Cb -0.13 -0.97 -0.04 0.00 0.01 0.00 0.00 72.50 71.37 2yuz s THR 18 CO 0.03 0.35 -0.03 0.68 -0.69 0.00 0.00 174.62 174.96 2yuz s VAL 19 N 1.63 0.33 1.17 3.82 -7.23 -1.09 -5.00 120.40 114.03 2yuz s VAL 19 Ca 0.03 -1.85 -0.20 0.00 -1.81 0.00 0.00 61.98 58.16 2yuz s VAL 19 Cb -0.13 -1.59 0.28 0.00 0.56 0.00 0.00 36.38 35.51 2yuz s VAL 19 CO -0.07 -0.94 1.18 0.59 -0.31 0.00 0.00 175.10 175.55 2yuz n ASN 20 N 0.06 -1.43 -4.70 4.85 3.02 -1.26 -2.65 115.26 113.15 2yuz n ASN 20 Ca -0.13 -1.27 -0.42 0.00 -0.03 0.00 0.00 54.58 52.72 2yuz n ASN 20 Cb 0.61 -1.02 -0.03 0.00 -0.61 0.00 0.00 39.78 38.73 2yuz n ASN 20 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2yuz s LEU 21 N 0.00 4.33 0.00 3.41 0.20 0.25 -3.10 118.68 123.76 2yuz s LEU 21 Ca 0.73 1.87 0.00 0.00 0.69 0.00 0.00 54.13 57.42 2yuz s LEU 21 Cb -0.06 -3.57 0.00 0.00 -0.43 0.00 0.00 46.19 42.14 2yuz s LEU 21 CO 0.55 -0.49 0.00 0.61 -0.29 0.00 0.00 176.35 176.73 2yuz n GLY 22 N 3.23 0.86 3.90 7.98 0.00 -0.02 -4.94 105.19 116.21 2yuz n GLY 22 Ca 0.09 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2yuz n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuz s LYS 23 N -0.71 3.61 -0.82 1.61 -0.14 -1.18 -4.52 119.74 117.59 2yuz s LYS 23 Ca 0.00 -0.10 -0.22 0.00 -1.36 0.00 0.00 55.97 54.29 2yuz s LYS 23 Cb 0.00 -2.80 0.08 0.00 -1.68 0.00 0.00 37.83 33.43 2yuz s LYS 23 CO 0.00 0.40 1.15 -2.00 -0.76 0.00 0.00 175.35 174.14 2yuz s GLU 24 N -2.96 3.37 0.27 1.68 2.12 -1.26 -1.49 118.70 120.43 2yuz s GLU 24 Ca 0.41 -1.10 -0.29 0.00 0.36 0.00 0.00 54.97 54.35 2yuz s GLU 24 Cb -0.12 -4.65 -0.10 0.00 0.26 0.00 0.00 34.13 29.52 2yuz s GLU 24 CO 0.26 -1.92 1.34 0.42 -0.54 0.00 0.00 175.26 174.81 2yuz s ILE 25 N 4.03 2.85 -0.02 -3.70 1.01 -1.19 -4.87 121.20 119.32 2yuz s ILE 25 Ca 0.32 0.78 0.04 0.00 0.00 0.00 0.00 60.65 61.78 2yuz s ILE 25 Cb -0.09 -3.49 -0.01 0.00 0.01 0.00 0.00 42.46 38.88 2yuz s ILE 25 CO 0.01 0.15 -0.15 0.00 0.00 0.00 0.00 174.94 174.95 2yuz s LEU 27 N -0.21 0.58 -0.01 0.00 1.43 0.03 -4.98 118.68 115.52 2yuz s LEU 27 Ca 0.03 0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.49 2yuz s LEU 27 Cb -0.07 0.41 -0.00 0.00 0.03 0.00 0.00 46.19 46.56 2yuz s LEU 27 CO 0.00 -0.16 -0.08 -0.75 0.23 0.00 0.00 176.35 175.59 2yuz s LYS 28 N 1.32 0.71 0.10 1.70 2.20 -1.26 -0.56 119.74 123.94 2yuz s LYS 28 Ca -0.08 -0.29 -0.02 0.00 -0.36 0.00 0.00 55.97 55.22 2yuz s LYS 28 Cb -0.11 -0.69 -0.04 0.00 -1.51 0.00 0.00 37.83 35.48 2yuz s LYS 28 CO -0.06 0.16 0.05 0.00 -0.36 0.00 0.00 175.35 175.14 2yuz s GLU 30 N -3.99 0.87 0.39 0.00 -6.30 0.10 -3.05 118.70 106.72 2yuz s GLU 30 Ca 0.17 -0.29 0.07 0.00 -2.50 0.00 0.00 54.97 52.42 2yuz s GLU 30 Cb 0.07 -0.83 -0.07 0.00 0.00 0.00 0.00 34.13 33.30 2yuz s GLU 30 CO -0.03 0.12 -0.01 0.96 0.02 0.00 0.00 175.26 176.32 2yuz s ILE 31 N 0.14 1.98 -0.22 -3.70 -4.36 -0.85 -0.67 121.20 113.52 2yuz s ILE 31 Ca -0.02 -2.05 0.21 0.00 -0.26 0.00 0.00 60.65 58.53 2yuz s ILE 31 Cb -0.07 -2.89 -0.02 0.00 1.25 0.00 0.00 42.46 40.72 2yuz s ILE 31 CO 0.00 -0.05 1.02 -1.28 0.24 0.00 0.00 174.94 174.87 2yuz h SER 32 N 1.87 0.00 -3.02 4.36 0.87 -1.87 -3.45 113.55 112.31 2yuz h SER 32 Ca -0.43 0.00 -0.61 0.00 -1.23 0.00 0.00 61.79 59.51 2yuz h SER 32 Cb 1.24 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.11 2yuz h SER 32 CO 0.77 0.13 -0.62 -1.61 -0.53 0.00 0.00 176.83 174.98 2yuz s GLU 33 N -3.26 2.72 -1.00 2.24 0.41 -1.26 -4.99 118.70 113.56 2yuz s GLU 33 Ca -0.01 -0.86 -0.04 0.00 -0.41 0.00 0.00 54.97 53.65 2yuz s GLU 33 Cb 0.09 -2.59 0.27 0.00 -1.78 0.00 0.00 34.13 30.12 2yuz s GLU 33 CO 0.79 0.51 1.08 -1.71 -0.49 0.00 0.00 175.26 175.45 2yuz n ASN 34 N 0.12 5.21 -4.05 -0.19 5.15 -1.26 -4.63 115.26 115.61 2yuz n ASN 34 Ca -0.09 -3.20 -0.12 0.00 -0.60 0.00 0.00 54.58 50.56 2yuz n ASN 34 Cb 0.53 -1.19 -0.11 0.00 -0.53 0.00 0.00 39.78 38.48 2yuz n ASN 34 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2yuz s ILE 35 N -1.83 0.45 0.71 -1.44 -5.25 -1.26 -4.99 121.20 107.59 2yuz s ILE 35 Ca 0.31 -1.06 -0.13 0.00 -0.99 0.00 0.00 60.65 58.77 2yuz s ILE 35 Cb -0.03 -0.56 0.02 0.00 2.95 0.00 0.00 42.46 44.84 2yuz s ILE 35 CO -0.04 -0.42 1.10 -2.16 -1.79 0.00 0.00 174.94 171.63 2yuz s PRO 36 N -1.61 2.57 0.21 0.37 0.04 -1.26 -4.88 135.00 130.43 2yuz s PRO 36 Ca -0.11 1.29 -0.03 0.00 0.04 0.00 0.00 61.00 62.20 2yuz s PRO 36 Cb -0.10 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.53 2yuz s PRO 36 CO -0.00 -1.42 0.32 0.41 0.04 0.00 0.00 177.00 176.35 2yuz n GLY 37 N -0.83 2.26 2.97 0.56 0.00 -1.26 -1.52 105.19 107.38 2yuz n GLY 37 Ca 0.10 -1.42 -0.10 0.00 0.00 0.00 0.00 46.02 44.59 2yuz n GLY 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuz s LYS 38 N -2.36 0.25 0.09 1.61 -0.14 -0.55 -4.86 119.74 113.79 2yuz s LYS 38 Ca 0.15 -0.41 -0.05 0.00 -1.36 0.00 0.00 55.97 54.30 2yuz s LYS 38 Cb -0.01 0.09 -0.05 0.00 -1.68 0.00 0.00 37.83 36.18 2yuz s LYS 38 CO 0.11 -0.04 0.32 -1.58 -0.76 0.00 0.00 175.35 173.40 2yuz s TRP 39 N -1.04 3.52 -0.02 3.18 0.52 -1.26 -1.36 118.94 122.47 2yuz s TRP 39 Ca -0.11 0.53 0.00 0.00 0.02 0.00 0.00 56.10 56.54 2yuz s TRP 39 Cb -0.07 -1.97 0.02 0.00 -1.15 0.00 0.00 33.47 30.30 2yuz s TRP 39 CO -0.00 0.51 -0.00 0.95 0.02 0.00 0.00 176.95 178.43 2yuz s THR 40 N -1.52 0.15 0.01 2.01 -4.23 0.36 -2.75 115.64 109.66 2yuz s THR 40 Ca 0.36 0.06 0.01 0.00 -1.18 0.00 0.00 61.69 60.94 2yuz s THR 40 Cb -0.13 -0.22 -0.04 0.00 1.34 0.00 0.00 72.50 73.46 2yuz s THR 40 CO 0.23 0.11 0.03 -0.75 -0.54 0.00 0.00 174.62 173.70 2yuz s LYS 41 N 0.77 2.86 -1.49 3.99 2.20 0.11 -1.22 119.74 126.96 2yuz s LYS 41 Ca -0.07 -0.59 -0.18 0.00 -0.36 0.00 0.00 55.97 54.76 2yuz s LYS 41 Cb -0.11 -2.72 0.18 0.00 -1.51 0.00 0.00 37.83 33.68 2yuz s LYS 41 CO -0.01 0.63 0.46 0.09 -0.36 0.00 0.00 175.35 176.15 2yuz n ASN 42 N 1.25 -1.38 -2.57 1.43 5.03 -1.07 0.12 115.26 118.06 2yuz n ASN 42 Ca -0.14 -0.99 -0.11 0.00 0.87 0.00 0.00 54.58 54.21 2yuz n ASN 42 Cb 0.53 -1.27 0.06 0.00 -1.02 0.00 0.00 39.78 38.08 2yuz n ASN 42 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2yuz n GLY 43 N -0.98 -0.08 3.42 7.41 0.00 -1.26 -5.04 105.19 108.66 2yuz n GLY 43 Ca 0.08 -0.10 -0.15 0.00 0.00 0.00 0.00 46.02 45.85 2yuz n GLY 43 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2yuz s LEU 44 N -4.84 -0.19 -0.28 0.99 0.05 0.32 -5.13 118.68 109.59 2yuz s LEU 44 Ca 0.02 0.37 -0.29 0.00 0.05 0.00 0.00 54.13 54.29 2yuz s LEU 44 Cb -0.01 2.19 -0.02 0.00 -2.05 0.00 0.00 46.19 46.30 2yuz s LEU 44 CO 0.47 -0.65 1.66 -2.16 -0.55 0.00 0.00 176.35 175.12 2yuz s PRO 45 N -1.83 3.60 0.06 1.48 0.04 -1.26 0.07 135.00 137.15 2yuz s PRO 45 Ca -0.09 1.48 -0.31 0.00 0.04 0.00 0.00 61.00 62.13 2yuz s PRO 45 Cb -0.01 -4.09 -0.07 0.00 0.04 0.00 0.00 34.50 30.36 2yuz s PRO 45 CO 0.03 -1.53 1.54 0.08 0.04 0.00 0.00 177.00 177.16 2yuz s VAL 46 N 5.84 3.27 -0.36 -0.36 1.01 -1.11 -4.89 120.40 123.80 2yuz s VAL 46 Ca 0.73 0.74 -0.29 0.00 0.00 0.00 0.00 61.98 63.16 2yuz s VAL 46 Cb -0.23 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.69 2yuz s VAL 46 CO 0.31 0.01 1.42 0.00 0.00 0.00 0.00 175.10 176.84 2yuz s GLN 47 N 2.32 3.67 0.00 2.72 0.00 -1.26 -4.93 119.66 122.17 2yuz s GLN 47 Ca 0.69 1.10 -0.20 0.00 -0.00 0.00 0.00 55.36 56.95 2yuz s GLN 47 Cb -0.37 -4.00 -0.06 0.00 0.00 0.00 0.00 33.01 28.59 2yuz s GLN 47 CO 0.30 -1.45 0.59 -1.21 0.00 0.00 0.00 175.29 173.52 2yuz s GLU 48 N 4.76 4.30 0.39 9.60 2.02 -1.26 -4.82 118.70 133.68 2yuz s GLU 48 Ca 0.62 0.73 -0.14 0.00 0.02 0.00 0.00 54.97 56.19 2yuz s GLU 48 Cb -0.16 -3.33 0.05 0.00 0.10 0.00 0.00 34.13 30.80 2yuz s GLU 48 CO 0.30 0.41 0.76 0.45 0.02 0.00 0.00 175.26 177.20 2yuz s SER 49 N -0.31 0.14 0.27 -0.19 0.15 -0.85 -4.96 113.70 107.94 2yuz s SER 49 Ca 0.31 -1.23 0.12 0.00 0.70 0.00 0.00 55.95 55.84 2yuz s SER 49 Cb -0.18 0.84 0.89 0.00 -1.71 0.00 0.00 66.02 65.86 2yuz s SER 49 CO 0.17 -1.68 1.21 -0.90 1.20 0.00 0.00 173.24 173.24 2yuz n ASP 50 N -1.49 0.16 0.14 5.45 5.75 -1.26 -0.59 116.55 124.70 2yuz n ASP 50 Ca -0.08 1.28 -0.06 0.00 -0.01 0.00 0.00 54.79 55.93 2yuz n ASP 50 Cb 0.60 -0.58 -0.03 0.00 -1.03 0.00 0.00 41.12 40.09 2yuz n ASP 50 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2yuz h ARG 51 N 0.00 -0.35 -5.85 0.11 2.47 -1.97 -3.42 114.38 105.38 2yuz h ARG 51 Ca 0.59 0.02 -0.60 0.00 -1.26 0.00 0.00 59.98 58.74 2yuz h ARG 51 Cb 1.48 0.08 -0.10 0.00 -1.65 0.00 0.00 29.97 29.79 2yuz h ARG 51 CO -0.63 -0.23 0.46 -1.17 0.56 0.00 0.00 179.97 178.96 2yuz s LEU 52 N -6.19 4.07 -0.08 3.04 0.20 0.24 -4.02 118.68 115.94 2yuz s LEU 52 Ca -0.05 0.74 0.03 0.00 0.69 0.00 0.00 54.13 55.54 2yuz s LEU 52 Cb 0.01 -3.15 0.01 0.00 -0.43 0.00 0.00 46.19 42.62 2yuz s LEU 52 CO 0.16 -0.64 -0.18 -0.75 -0.29 0.00 0.00 176.35 174.65 2yuz s LYS 53 N 3.04 2.34 -0.49 1.98 2.47 -1.25 -2.02 119.74 125.82 2yuz s LYS 53 Ca 0.34 -0.63 -0.14 0.00 -1.56 0.00 0.00 55.97 53.99 2yuz s LYS 53 Cb -0.14 -1.84 0.10 0.00 -1.46 0.00 0.00 37.83 34.49 2yuz s LYS 53 CO 0.12 0.08 0.40 0.08 0.16 0.00 0.00 175.35 176.20 2yuz s VAL 54 N 0.55 4.90 0.09 4.02 1.01 -1.26 -3.89 120.40 125.82 2yuz s VAL 54 Ca -0.16 -1.38 -0.14 0.00 0.00 0.00 0.00 61.98 60.30 2yuz s VAL 54 Cb -0.17 -4.05 -0.06 0.00 0.00 0.00 0.00 36.38 32.10 2yuz s VAL 54 CO 0.05 -0.69 0.50 -0.69 0.00 0.00 0.00 175.10 174.27 2yuz s VAL 55 N 1.55 4.91 -0.10 2.92 1.01 -0.92 -4.94 120.40 124.82 2yuz s VAL 55 Ca 0.04 0.83 0.03 0.00 0.00 0.00 0.00 61.98 62.88 2yuz s VAL 55 Cb -0.26 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 2yuz s VAL 55 CO 0.04 0.37 -0.19 -1.58 0.00 0.00 0.00 175.10 173.73 2yuz s GLN 56 N -1.64 3.08 -0.38 2.72 0.74 -1.26 -1.63 119.66 121.29 2yuz s GLN 56 Ca 0.33 -0.79 0.01 0.00 0.05 0.00 0.00 55.36 54.95 2yuz s GLN 56 Cb -0.16 -2.42 0.12 0.00 1.10 0.00 0.00 33.01 31.65 2yuz s GLN 56 CO 0.18 0.25 0.18 0.15 -0.55 0.00 0.00 175.29 175.50 2yuz s LYS 57 N 0.20 1.02 -0.09 1.67 -0.14 -0.58 -4.95 119.74 116.88 2yuz s LYS 57 Ca -0.12 -1.60 -0.08 0.00 -1.36 0.00 0.00 55.97 52.82 2yuz s LYS 57 Cb -0.16 -2.16 0.01 0.00 -1.68 0.00 0.00 37.83 33.84 2yuz s LYS 57 CO 0.06 -1.09 0.13 0.41 -0.76 0.00 0.00 175.35 174.10 2yuz n GLY 58 N 4.10 0.04 3.48 -3.33 0.00 -1.26 -2.60 105.19 105.61 2yuz n GLY 58 Ca 0.05 0.22 -0.18 0.00 0.00 0.00 0.00 46.02 46.11 2yuz n GLY 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuz n ARG 59 N 0.74 -5.50 -3.53 1.61 1.74 -1.26 -4.92 116.66 105.52 2yuz n ARG 59 Ca -0.02 0.79 -0.06 0.00 -0.77 0.00 0.00 57.85 57.80 2yuz n ARG 59 Cb 0.39 -5.66 -0.07 0.00 -1.02 0.00 0.00 32.46 26.10 2yuz n ARG 59 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2yuz s ILE 60 N -3.44 -0.75 -0.50 0.55 1.01 -1.07 -2.01 121.20 114.99 2yuz s ILE 60 Ca 0.07 0.07 -0.13 0.00 0.00 0.00 0.00 60.65 60.66 2yuz s ILE 60 Cb -0.01 -0.80 0.12 0.00 0.01 0.00 0.00 42.46 41.78 2yuz s ILE 60 CO 0.75 0.01 0.42 -1.00 0.00 0.00 0.00 174.94 175.12 2yuz s HIS 61 N 2.69 3.33 0.01 3.97 3.76 -1.17 -1.52 115.29 126.36 2yuz s HIS 61 Ca 0.03 -1.55 -0.01 0.00 -0.15 0.00 0.00 55.06 53.38 2yuz s HIS 61 Cb -0.13 -3.61 -0.04 0.00 1.11 0.00 0.00 32.58 29.91 2yuz s HIS 61 CO -0.16 -1.00 0.13 0.21 -0.85 0.00 0.00 174.74 173.08 2yuz s LYS 62 N 1.49 3.23 -0.10 1.40 2.20 -0.64 -3.44 119.74 123.88 2yuz s LYS 62 Ca 0.04 -0.44 -0.06 0.00 -0.36 0.00 0.00 55.97 55.15 2yuz s LYS 62 Cb -0.28 -2.95 0.04 0.00 -1.51 0.00 0.00 37.83 33.12 2yuz s LYS 62 CO 0.01 0.64 0.23 -1.17 -0.36 0.00 0.00 175.35 174.71 2yuz s LEU 63 N -1.98 0.69 -0.08 5.43 0.20 0.27 -2.17 118.68 121.03 2yuz s LEU 63 Ca 0.27 0.49 -0.06 0.00 0.69 0.00 0.00 54.13 55.51 2yuz s LEU 63 Cb -0.12 0.73 0.03 0.00 -0.43 0.00 0.00 46.19 46.40 2yuz s LEU 63 CO 0.18 -0.13 0.21 0.54 -0.29 0.00 0.00 176.35 176.86 2yuz s VAL 64 N 0.85 -0.02 -0.09 1.68 0.11 -1.25 -0.79 120.40 120.89 2yuz s VAL 64 Ca -0.06 0.07 -0.06 0.00 -2.93 0.00 0.00 61.98 59.00 2yuz s VAL 64 Cb -0.07 -0.31 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 2yuz s VAL 64 CO -0.05 0.03 0.14 -0.63 -3.33 0.00 0.00 175.10 171.26 2yuz s ILE 65 N 0.58 5.42 0.05 7.04 1.01 -0.85 -3.93 121.20 130.53 2yuz s ILE 65 Ca -0.04 0.08 -0.31 0.00 0.00 0.00 0.00 60.65 60.39 2yuz s ILE 65 Cb -0.05 -3.41 -0.18 0.00 0.01 0.00 0.00 42.46 38.83 2yuz s ILE 65 CO -0.03 0.54 1.47 0.00 0.00 0.00 0.00 174.94 176.92 2yuz h ALA 66 N 4.68 -0.83 -3.46 9.38 0.00 -1.89 -3.15 119.26 123.98 2yuz h ALA 66 Ca -0.53 -0.20 -0.61 0.00 0.00 0.00 0.00 54.91 53.57 2yuz h ALA 66 Cb 1.22 0.32 -0.37 0.00 0.00 0.00 0.00 17.79 18.95 2yuz h ALA 66 CO 0.61 -0.91 -0.80 -0.80 0.00 0.00 0.00 179.25 177.34 2yuz s ASN 67 N -4.53 3.43 0.13 0.00 0.01 -1.26 -4.08 114.94 108.64 2yuz s ASN 67 Ca -0.16 -0.92 -0.31 0.00 -0.71 0.00 0.00 52.86 50.75 2yuz s ASN 67 Cb 0.03 -1.19 -0.08 0.00 0.41 0.00 0.00 41.25 40.42 2yuz s ASN 67 CO 0.58 -0.17 1.37 0.00 -1.51 0.00 0.00 177.10 177.36 2yuz s ALA 68 N 1.42 3.57 0.49 0.60 0.00 -0.55 -4.82 121.76 122.47 2yuz s ALA 68 Ca -0.02 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.11 2yuz s ALA 68 Cb -0.17 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.45 2yuz s ALA 68 CO -0.08 -0.59 0.42 -0.51 0.00 0.00 0.00 175.76 175.00 2yuz s LEU 69 N 0.87 3.02 0.00 0.00 1.02 -1.26 -0.84 118.68 121.50 2yuz s LEU 69 Ca 0.63 -1.01 0.26 0.00 0.02 0.00 0.00 54.13 54.03 2yuz s LEU 69 Cb -0.36 -1.57 1.27 0.00 0.02 0.00 0.00 46.19 45.55 2yuz s LEU 69 CO 0.32 -0.93 1.87 0.41 0.02 0.00 0.00 176.35 178.03 2yuz n THR 70 N -1.71 0.18 -0.10 5.49 -1.04 -1.26 -3.20 114.28 112.65 2yuz n THR 70 Ca 0.02 0.05 -0.11 0.00 -2.04 0.00 0.00 64.05 61.97 2yuz n THR 70 Cb 0.63 -0.62 -0.13 0.00 -1.82 0.00 0.00 70.33 68.39 2yuz n THR 70 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2yuz n GLU 71 N -1.32 0.92 -0.27 -2.82 0.28 -1.26 -4.49 120.64 111.68 2yuz n GLU 71 Ca 0.11 0.03 0.06 0.00 -0.16 0.00 0.00 57.16 57.21 2yuz n GLU 71 Cb 0.22 -1.46 0.18 0.00 1.43 0.00 0.00 31.44 31.81 2yuz n GLU 71 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 177.13 177.19 2yuz h ASP 72 N 0.00 -0.30 -2.15 -1.84 1.82 -1.95 -3.41 116.42 108.59 2yuz h ASP 72 Ca -0.50 0.20 -0.47 0.00 -0.39 0.00 0.00 57.03 55.87 2yuz h ASP 72 Cb 2.03 0.34 0.24 0.00 0.68 0.00 0.00 39.33 42.61 2yuz h ASP 72 CO -0.00 -0.18 -1.35 -1.84 -1.61 0.00 0.00 179.24 174.26 2yuz n GLU 73 N -5.33 -1.24 0.00 0.28 0.28 -1.26 -4.79 120.64 108.59 2yuz n GLU 73 Ca 0.15 -0.35 0.00 0.00 -0.16 0.00 0.00 57.16 56.80 2yuz n GLU 73 Cb 0.51 -1.58 0.00 0.00 1.43 0.00 0.00 31.44 31.80 2yuz n GLU 73 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2yuz n GLY 74 N 2.27 0.46 2.73 -1.84 0.00 -1.10 -4.99 105.19 102.72 2yuz n GLY 74 Ca 0.00 -1.04 -0.29 0.00 0.00 0.00 0.00 46.02 44.70 2yuz n GLY 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yuz s ASP 75 N -4.00 3.40 -0.02 1.61 1.01 -1.26 -2.97 116.67 114.44 2yuz s ASP 75 Ca 0.00 -1.15 -0.21 0.00 0.71 0.00 0.00 52.55 51.90 2yuz s ASP 75 Cb 0.00 -0.71 -0.05 0.00 1.01 0.00 0.00 42.92 43.17 2yuz s ASP 75 CO 0.00 -0.35 0.61 -0.31 0.21 0.00 0.00 175.17 175.33 2yuz s TYR 76 N 1.76 3.66 -0.02 4.23 1.51 0.01 -2.61 117.35 125.89 2yuz s TYR 76 Ca 0.03 1.20 0.02 0.00 -1.01 0.00 0.00 57.07 57.31 2yuz s TYR 76 Cb -0.17 -2.64 0.00 0.00 -0.11 0.00 0.00 41.96 39.04 2yuz s TYR 76 CO -0.16 0.30 -0.08 0.08 -1.11 0.00 0.00 175.55 174.58 2yuz s VAL 77 N -0.00 0.70 -0.16 0.71 1.01 -0.36 -0.18 120.40 122.12 2yuz s VAL 77 Ca 0.32 -0.32 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 2yuz s VAL 77 Cb -0.18 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 2yuz s VAL 77 CO 0.17 0.22 0.01 0.12 0.00 0.00 0.00 175.10 175.62 2yuz s PHE 78 N 0.16 3.13 -0.18 5.22 5.36 -1.19 -0.48 117.98 130.00 2yuz s PHE 78 Ca -0.02 -0.09 -0.01 0.00 -0.96 0.00 0.00 56.93 55.84 2yuz s PHE 78 Cb -0.07 -1.98 0.05 0.00 -0.34 0.00 0.00 43.02 40.67 2yuz s PHE 78 CO 0.00 0.10 -0.02 0.00 -1.46 0.00 0.00 175.22 173.85 2yuz s ALA 79 N 0.21 1.33 0.54 11.12 0.00 -0.46 -3.12 121.76 131.38 2yuz s ALA 79 Ca 0.01 -0.82 -0.20 0.00 0.00 0.00 0.00 51.96 50.95 2yuz s ALA 79 Cb -0.13 -1.17 -0.06 0.00 0.00 0.00 0.00 23.12 21.76 2yuz s ALA 79 CO 0.02 -0.96 1.13 -1.25 0.00 0.00 0.00 175.76 174.69 2yuz s PRO 80 N 1.70 3.38 -0.02 0.00 0.04 -1.26 -1.48 135.00 137.36 2yuz s PRO 80 Ca -0.01 1.62 0.03 0.00 0.04 0.00 0.00 61.00 62.68 2yuz s PRO 80 Cb -0.16 -2.02 0.12 0.00 0.04 0.00 0.00 34.50 32.48 2yuz s PRO 80 CO -0.07 -0.83 0.91 -3.47 0.04 0.00 0.00 177.00 173.58 2yuz n ASP 81 N -1.26 1.19 0.00 6.66 2.03 -0.58 -3.30 116.55 121.29 2yuz n ASP 81 Ca 0.11 -2.07 0.00 0.00 0.52 0.00 0.00 54.79 53.35 2yuz n ASP 81 Cb 0.51 -0.29 0.00 0.00 -0.72 0.00 0.00 41.12 40.62 2yuz n ASP 81 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2yuz n ALA 82 N -0.02 1.58 -4.29 -1.67 0.00 -1.26 -5.03 120.51 109.81 2yuz n ALA 82 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.24 2yuz n ALA 82 Cb 0.25 0.05 -0.08 0.00 0.00 0.00 0.00 19.45 19.67 2yuz n ALA 82 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2yuz n TYR 83 N -1.27 -0.65 -1.06 0.00 4.02 -1.21 -5.05 117.16 111.94 2yuz n TYR 83 Ca 0.00 -2.77 0.05 0.00 -0.01 0.00 0.00 57.90 55.17 2yuz n TYR 83 Cb 0.11 0.24 0.27 0.00 -0.02 0.00 0.00 39.34 39.94 2yuz n TYR 83 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 176.86 176.12 2yuz n ASN 84 N -1.66 3.97 -4.76 7.72 2.04 -1.26 -4.15 115.26 117.16 2yuz n ASN 84 Ca 0.06 -3.15 -0.39 0.00 -0.44 0.00 0.00 54.58 50.66 2yuz n ASN 84 Cb 0.60 -0.60 0.02 0.00 -2.53 0.00 0.00 39.78 37.28 2yuz n ASN 84 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 2yuz s VAL 85 N -2.91 2.24 -0.10 3.53 1.01 -1.26 -4.99 120.40 117.93 2yuz s VAL 85 Ca 0.45 0.20 -0.01 0.00 0.00 0.00 0.00 61.98 62.63 2yuz s VAL 85 Cb 0.37 -3.11 0.03 0.00 0.00 0.00 0.00 36.38 33.67 2yuz s VAL 85 CO 0.09 0.02 -0.03 0.42 0.00 0.00 0.00 175.10 175.60 2yuz s THR 86 N -1.26 0.65 -0.42 3.92 -4.23 -1.26 -4.19 115.64 108.85 2yuz s THR 86 Ca 0.63 -0.09 -0.08 0.00 -1.18 0.00 0.00 61.69 60.97 2yuz s THR 86 Cb -0.41 -0.78 0.09 0.00 1.34 0.00 0.00 72.50 72.75 2yuz s THR 86 CO 0.51 0.28 0.26 -0.76 -0.54 0.00 0.00 174.62 174.36 2yuz s LEU 87 N 1.86 5.21 0.24 4.79 1.02 -1.18 -4.92 118.68 125.68 2yuz s LEU 87 Ca 0.05 -1.64 -0.30 0.00 0.02 0.00 0.00 54.13 52.26 2yuz s LEU 87 Cb -0.13 -1.96 -0.09 0.00 0.02 0.00 0.00 46.19 44.03 2yuz s LEU 87 CO -0.07 -0.55 1.28 -2.16 0.02 0.00 0.00 176.35 174.87 2yuz s PRO 88 N 1.37 4.42 -0.07 1.29 0.04 -1.26 -3.18 135.00 137.60 2yuz s PRO 88 Ca 0.04 2.05 -0.02 0.00 0.04 0.00 0.00 61.00 63.10 2yuz s PRO 88 Cb -0.23 -3.17 0.04 0.00 0.04 0.00 0.00 34.50 31.17 2yuz s PRO 88 CO 0.01 -0.17 0.05 0.00 0.04 0.00 0.00 177.00 176.92 2yuz s ALA 89 N -0.31 0.43 0.03 8.56 0.00 0.75 -4.66 121.76 126.55 2yuz s ALA 89 Ca 0.53 -0.01 -0.20 0.00 0.00 0.00 0.00 51.96 52.29 2yuz s ALA 89 Cb -0.36 -0.74 -0.06 0.00 0.00 0.00 0.00 23.12 21.96 2yuz s ALA 89 CO 0.41 -0.61 0.57 0.15 0.00 0.00 0.00 175.76 176.29 2yuz s LYS 90 N 2.10 4.25 0.02 0.00 1.02 -1.26 -0.81 119.74 125.05 2yuz s LYS 90 Ca 0.04 0.72 -0.09 0.00 0.02 0.00 0.00 55.97 56.66 2yuz s LYS 90 Cb -0.13 -3.29 0.00 0.00 -0.52 0.00 0.00 37.83 33.90 2yuz s LYS 90 CO -0.05 0.51 0.18 0.14 -0.92 0.00 0.00 175.35 175.21 2yuz s VAL 91 N -0.66 0.09 -0.00 3.17 -7.23 -1.16 -2.48 120.40 112.13 2yuz s VAL 91 Ca 0.30 -0.77 -0.03 0.00 -1.81 0.00 0.00 61.98 59.67 2yuz s VAL 91 Cb -0.19 -0.66 -0.00 0.00 0.56 0.00 0.00 36.38 36.08 2yuz s VAL 91 CO 0.18 -0.42 0.06 -2.28 -0.31 0.00 0.00 175.10 172.32 2yuz s HIS 92 N -1.90 0.06 -0.09 2.82 2.46 -1.21 -2.70 115.29 114.74 2yuz s HIS 92 Ca -0.10 -0.13 0.05 0.00 0.47 0.00 0.00 55.06 55.34 2yuz s HIS 92 Cb -0.04 -0.06 -0.01 0.00 -0.13 0.00 0.00 32.58 32.34 2yuz s HIS 92 CO -0.00 -0.16 -0.24 0.54 -2.47 0.00 0.00 174.74 172.41 2yuz s VAL 93 N -0.84 2.14 -0.10 0.89 0.11 -1.26 -2.69 120.40 118.64 2yuz s VAL 93 Ca -0.09 -1.01 -0.02 0.00 -2.93 0.00 0.00 61.98 57.93 2yuz s VAL 93 Cb -0.06 -1.80 -0.03 0.00 -1.53 0.00 0.00 36.38 32.96 2yuz s VAL 93 CO 0.00 0.56 -0.03 -0.63 -3.33 0.00 0.00 175.10 171.67 2yuz s ILE 94 N 0.14 3.98 0.34 7.04 1.01 -1.08 -4.91 121.20 127.72 2yuz s ILE 94 Ca -0.12 -0.36 0.06 0.00 0.00 0.00 0.00 60.65 60.23 2yuz s ILE 94 Cb -0.16 -2.68 -0.07 0.00 0.01 0.00 0.00 42.46 39.56 2yuz s ILE 94 CO 0.07 0.56 0.01 -0.44 0.00 0.00 0.00 174.94 175.15 2yuz s SER 95 N -0.44 3.00 0.00 3.58 0.01 -1.26 0.84 113.70 119.43 2yuz s SER 95 Ca 0.07 -1.33 0.00 0.00 1.31 0.00 0.00 55.95 56.00 2yuz s SER 95 Cb -0.12 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 65.89 2yuz s SER 95 CO 0.02 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 173.79 2yuz n GLY 96 N -0.76 -1.72 0.02 3.44 0.00 -1.26 -4.98 105.19 99.94 2yuz n GLY 96 Ca -0.04 -1.11 0.08 0.00 0.00 0.00 0.00 46.02 44.95 2yuz n GLY 96 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2yuz n PRO 97 N -0.33 0.04 -1.64 1.61 -0.04 -1.26 -4.83 135.00 128.54 2yuz n PRO 97 Ca 0.00 0.29 -0.58 0.00 -0.04 0.00 0.00 63.50 63.17 2yuz n PRO 97 Cb 0.00 -1.57 -0.07 0.00 -0.04 0.00 0.00 33.50 31.82 2yuz n PRO 97 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2yuz n SER 98 N -1.64 1.59 -4.25 3.54 7.64 -1.26 -4.85 113.62 114.40 2yuz n SER 98 Ca 0.03 1.12 -0.35 0.00 1.01 0.00 0.00 58.87 60.69 2yuz n SER 98 Cb 0.18 -1.08 0.08 0.00 -1.01 0.00 0.00 64.21 62.38 2yuz n SER 98 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2yuz n SER 99 N 3.62 -3.67 -0.11 6.43 2.88 -1.26 -5.16 113.62 116.34 2yuz n SER 99 Ca 0.23 0.29 0.16 0.00 -1.33 0.00 0.00 58.87 58.22 2yuz n SER 99 Cb 0.11 -1.02 0.85 0.00 -0.75 0.00 0.00 64.21 63.41 2yuz n SER 99 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42