#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuz s SER 2 N 0.00 5.58 0.15 1.61 0.01 -1.26 -4.94 113.70 114.85 2yuz s SER 2 Ca 0.00 -3.04 -0.19 0.00 1.31 0.00 0.00 55.95 54.03 2yuz s SER 2 Cb 0.00 -1.91 0.05 0.00 0.21 0.00 0.00 66.02 64.37 2yuz s SER 2 CO 0.00 -0.35 1.66 -1.28 0.41 0.00 0.00 173.24 173.68 2yuz h SER 3 N 6.88 -0.44 0.00 2.44 0.87 -2.08 -3.48 113.55 117.74 2yuz h SER 3 Ca 0.04 0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2yuz h SER 3 Cb 0.93 0.25 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 2yuz h SER 3 CO 0.75 -0.16 0.00 0.61 -0.53 0.00 0.00 176.83 177.49 2yuz n GLY 4 N -1.31 1.03 2.90 5.77 0.00 -1.26 -5.04 105.19 107.28 2yuz n GLY 4 Ca 0.00 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 2yuz n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuz s SER 5 N -4.00 3.35 0.79 1.61 0.01 -1.26 -5.13 113.70 109.07 2yuz s SER 5 Ca 0.00 -0.94 -0.07 0.00 1.31 0.00 0.00 55.95 56.25 2yuz s SER 5 Cb 0.00 -1.01 0.13 0.00 0.21 0.00 0.00 66.02 65.35 2yuz s SER 5 CO 0.00 -0.22 1.09 -0.94 0.41 0.00 0.00 173.24 173.58 2yuz s SER 6 N 1.54 4.11 0.00 2.44 1.04 -1.26 -4.98 113.70 116.59 2yuz s SER 6 Ca -0.03 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.45 2yuz s SER 6 Cb -0.17 -0.40 0.00 0.00 0.10 0.00 0.00 66.02 65.55 2yuz s SER 6 CO -0.07 -2.04 0.00 0.61 0.98 0.00 0.00 173.24 172.72 2yuz n GLY 7 N -3.13 -2.81 2.91 7.32 0.00 -1.26 -5.04 105.19 103.19 2yuz n GLY 7 Ca 0.13 -1.17 -0.24 0.00 0.00 0.00 0.00 46.02 44.74 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 -1.87 1.25 -0.22 0.99 2.96 -1.26 -5.03 118.68 115.50 2yuz s LEU 8 Ca 0.00 -0.23 -0.08 0.00 -0.22 0.00 0.00 54.13 53.61 2yuz s LEU 8 Cb 0.00 -0.68 -0.04 0.00 0.50 0.00 0.00 46.19 45.97 2yuz s LEU 8 CO 0.00 -0.07 0.08 -0.75 -1.32 0.00 0.00 176.35 174.28 2yuz s LYS 9 N 1.28 3.81 -0.37 1.98 2.20 -1.26 -5.03 119.74 122.35 2yuz s LYS 9 Ca -0.04 -0.41 -0.29 0.00 -0.36 0.00 0.00 55.97 54.87 2yuz s LYS 9 Cb -0.14 -3.31 0.01 0.00 -1.51 0.00 0.00 37.83 32.89 2yuz s LYS 9 CO -0.03 0.01 1.25 0.42 -0.36 0.00 0.00 175.35 176.64 2yuz s ILE 10 N 1.11 4.16 -0.12 5.43 1.09 -1.26 -2.80 121.20 128.81 2yuz s ILE 10 Ca 0.05 1.25 -0.05 0.00 -1.10 0.00 0.00 60.65 60.80 2yuz s ILE 10 Cb -0.14 -4.32 -0.03 0.00 -1.06 0.00 0.00 42.46 36.91 2yuz s ILE 10 CO 0.03 -0.68 0.02 -0.07 -0.10 0.00 0.00 174.94 174.15 2yuz h LEU 11 N 11.16 0.00 -7.08 2.97 3.38 -1.91 -3.44 115.31 120.39 2yuz h LEU 11 Ca -0.25 -0.09 -0.62 0.00 0.09 0.00 0.00 57.88 57.02 2yuz h LEU 11 Cb 1.08 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.43 2yuz h LEU 11 CO 1.07 0.63 -0.72 -0.89 0.09 0.00 0.00 178.44 178.61 2yuz s THR 12 N -1.79 1.57 0.42 0.22 2.01 -1.17 -4.96 115.64 111.94 2yuz s THR 12 Ca -0.06 -2.59 -0.25 0.00 0.31 0.00 0.00 61.69 59.10 2yuz s THR 12 Cb 0.00 -2.11 -0.08 0.00 0.01 0.00 0.00 72.50 70.33 2yuz s THR 12 CO 0.12 -0.86 1.18 -2.16 -0.69 0.00 0.00 174.62 172.21 2yuz s PRO 13 N 0.35 3.97 0.12 4.92 0.04 -1.26 -2.04 135.00 141.09 2yuz s PRO 13 Ca 0.17 1.86 -0.35 0.00 0.04 0.00 0.00 61.00 62.72 2yuz s PRO 13 Cb -0.24 -2.61 -0.16 0.00 0.04 0.00 0.00 34.50 31.52 2yuz s PRO 13 CO -0.01 -0.40 1.21 1.28 0.04 0.00 0.00 177.00 179.12 2yuz n LEU 14 N -0.06 1.39 -4.77 -3.56 4.77 -1.26 -4.96 117.00 108.54 2yuz n LEU 14 Ca 0.05 1.13 -0.34 0.00 -0.03 0.00 0.00 56.01 56.82 2yuz n LEU 14 Cb 0.47 -1.17 -0.07 0.00 -2.33 0.00 0.00 43.42 40.31 2yuz n LEU 14 CO 0.50 -1.28 -0.25 0.42 -1.33 0.00 0.00 177.39 175.45 2yuz s THR 15 N 0.09 4.78 -0.25 -5.08 -4.23 -1.26 -4.68 115.64 105.01 2yuz s THR 15 Ca 0.79 -0.22 -0.39 0.00 -1.18 0.00 0.00 61.69 60.69 2yuz s THR 15 Cb -0.93 -3.11 -0.15 0.00 1.34 0.00 0.00 72.50 69.65 2yuz s THR 15 CO 0.50 0.48 1.81 -0.90 -0.54 0.00 0.00 174.62 175.98 2yuz n ASP 16 N 1.64 2.58 -4.19 3.99 5.75 -1.26 -4.79 116.55 120.27 2yuz n ASP 16 Ca -0.16 1.01 -0.30 0.00 -0.01 0.00 0.00 54.79 55.33 2yuz n ASP 16 Cb 0.53 -1.19 -0.17 0.00 -1.03 0.00 0.00 41.12 39.27 2yuz n ASP 16 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2yuz s GLN 17 N 3.87 2.59 -0.04 0.11 -0.21 -0.91 -4.99 119.66 120.08 2yuz s GLN 17 Ca 0.98 -0.79 0.04 0.00 0.02 0.00 0.00 55.36 55.61 2yuz s GLN 17 Cb -0.99 -2.05 -0.00 0.00 1.00 0.00 0.00 33.01 30.97 2yuz s GLN 17 CO 0.62 0.21 -0.15 0.99 -2.12 0.00 0.00 175.29 174.85 2yuz s THR 18 N 0.23 1.24 0.20 -0.19 2.01 -1.26 -3.39 115.64 114.49 2yuz s THR 18 Ca -0.13 -0.61 -0.07 0.00 0.31 0.00 0.00 61.69 61.19 2yuz s THR 18 Cb -0.16 -1.08 -0.02 0.00 0.01 0.00 0.00 72.50 71.26 2yuz s THR 18 CO 0.06 0.36 0.29 0.68 -0.69 0.00 0.00 174.62 175.32 2yuz s VAL 19 N 0.09 0.03 0.64 3.82 -7.23 -1.12 -5.01 120.40 111.61 2yuz s VAL 19 Ca -0.04 -1.62 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 2yuz s VAL 19 Cb -0.11 -2.18 -0.02 0.00 0.56 0.00 0.00 36.38 34.63 2yuz s VAL 19 CO 0.02 -0.12 1.03 0.20 -0.31 0.00 0.00 175.10 175.93 2yuz s ASN 20 N -3.05 5.96 0.38 4.85 0.01 -1.26 -2.28 114.94 119.55 2yuz s ASN 20 Ca 0.26 1.27 -0.27 0.00 -0.71 0.00 0.00 52.86 53.42 2yuz s ASN 20 Cb 0.03 -2.26 -0.11 0.00 0.41 0.00 0.00 41.25 39.33 2yuz s ASN 20 CO 0.07 -1.01 1.29 -0.11 -1.51 0.00 0.00 177.10 175.82 2yuz n LEU 21 N -2.80 3.82 0.00 0.60 7.94 -0.42 -2.12 117.00 124.02 2yuz n LEU 21 Ca 0.06 1.16 0.00 0.00 -1.11 0.00 0.00 56.01 56.12 2yuz n LEU 21 Cb 0.55 -1.50 0.00 0.00 0.53 0.00 0.00 43.42 43.01 2yuz n LEU 21 CO 0.57 -0.54 0.00 0.61 -1.11 0.00 0.00 177.39 176.92 2yuz n GLY 22 N 0.78 2.01 3.21 -3.96 0.00 -0.41 -4.86 105.19 101.95 2yuz n GLY 22 Ca 0.05 -0.41 -0.37 0.00 0.00 0.00 0.00 46.02 45.30 2yuz n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yuz n LYS 23 N 0.00 0.04 -2.84 1.61 4.76 -0.90 -2.93 118.16 117.89 2yuz n LYS 23 Ca 0.00 0.03 -0.43 0.00 -2.87 0.00 0.00 58.31 55.04 2yuz n LYS 23 Cb 0.00 -1.22 -0.04 0.00 -1.84 0.00 0.00 35.03 31.93 2yuz n LYS 23 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2yuz s GLU 24 N -1.91 3.14 0.67 1.97 2.12 -1.26 0.19 118.70 123.62 2yuz s GLU 24 Ca 0.52 -0.85 -0.17 0.00 0.36 0.00 0.00 54.97 54.84 2yuz s GLU 24 Cb -0.33 -4.26 -0.05 0.00 0.26 0.00 0.00 34.13 29.75 2yuz s GLU 24 CO 0.71 -1.84 0.61 -0.89 -0.54 0.00 0.00 175.26 173.31 2yuz n ILE 25 N 5.94 2.20 -3.72 -3.70 2.08 -1.04 -4.75 119.36 116.37 2yuz n ILE 25 Ca -0.02 -0.43 -0.12 0.00 0.56 0.00 0.00 62.75 62.73 2yuz n ILE 25 Cb 0.46 -0.79 -0.10 0.00 -0.75 0.00 0.00 39.64 38.45 2yuz n ILE 25 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2yuz s LEU 27 N 0.59 -0.51 -0.00 0.00 1.43 -0.44 -4.97 118.68 114.78 2yuz s LEU 27 Ca -0.03 0.25 0.08 0.00 -1.03 0.00 0.00 54.13 53.40 2yuz s LEU 27 Cb -0.05 0.97 -0.02 0.00 0.03 0.00 0.00 46.19 47.12 2yuz s LEU 27 CO -0.04 -0.29 -0.25 -0.75 0.23 0.00 0.00 176.35 175.26 2yuz s LYS 28 N 2.50 2.07 0.07 1.70 2.20 -1.26 -1.54 119.74 125.48 2yuz s LYS 28 Ca 0.09 -0.95 -0.10 0.00 -0.36 0.00 0.00 55.97 54.65 2yuz s LYS 28 Cb -0.15 -2.07 0.00 0.00 -1.51 0.00 0.00 37.83 34.11 2yuz s LYS 28 CO -0.14 0.55 0.22 0.00 -0.36 0.00 0.00 175.35 175.62 2yuz s GLU 30 N -3.26 1.85 0.01 0.00 2.56 -0.87 -2.35 118.70 116.65 2yuz s GLU 30 Ca 0.00 -1.35 -0.08 0.00 0.00 0.00 0.00 54.97 53.55 2yuz s GLU 30 Cb 0.02 -2.05 0.00 0.00 2.00 0.00 0.00 34.13 34.10 2yuz s GLU 30 CO -0.08 0.43 0.15 0.96 -0.56 0.00 0.00 175.26 176.16 2yuz s ILE 31 N -1.64 0.09 -0.18 -3.70 -4.36 -1.16 -3.05 121.20 107.19 2yuz s ILE 31 Ca 0.23 -0.74 -0.02 0.00 -0.26 0.00 0.00 60.65 59.86 2yuz s ILE 31 Cb -0.09 -0.53 0.03 0.00 1.25 0.00 0.00 42.46 43.12 2yuz s ILE 31 CO 0.13 -0.41 2.46 -1.54 0.24 0.00 0.00 174.94 175.83 2yuz n SER 32 N 1.30 5.89 -3.56 4.36 3.41 -1.12 -4.80 113.62 119.11 2yuz n SER 32 Ca -0.22 -2.78 -0.15 0.00 -0.26 0.00 0.00 58.87 55.46 2yuz n SER 32 Cb 0.56 -1.18 -0.06 0.00 -0.26 0.00 0.00 64.21 63.27 2yuz n SER 32 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2yuz s GLU 33 N -0.70 0.86 -0.92 4.33 0.41 -1.26 -4.77 118.70 116.65 2yuz s GLU 33 Ca 0.34 0.36 -0.00 0.00 -0.41 0.00 0.00 54.97 55.25 2yuz s GLU 33 Cb 0.21 0.41 0.31 0.00 -1.78 0.00 0.00 34.13 33.28 2yuz s GLU 33 CO -0.04 -0.24 1.41 -1.71 -0.49 0.00 0.00 175.26 174.19 2yuz n ASN 34 N 1.20 6.06 -4.15 -0.19 5.15 -1.26 -4.56 115.26 117.51 2yuz n ASN 34 Ca -0.15 -3.55 -0.17 0.00 -0.60 0.00 0.00 54.58 50.10 2yuz n ASN 34 Cb 0.57 -1.04 -0.12 0.00 -0.53 0.00 0.00 39.78 38.66 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 -3.52 0.98 0.46 -1.44 -5.25 -1.26 -5.02 121.20 106.16 2yuz s ILE 35 Ca 0.38 -1.31 -0.23 0.00 -0.99 0.00 0.00 60.65 58.50 2yuz s ILE 35 Cb 0.15 -1.02 -0.07 0.00 2.95 0.00 0.00 42.46 44.46 2yuz s ILE 35 CO -0.03 -0.30 1.16 -2.16 -1.79 0.00 0.00 174.94 171.83 2yuz s PRO 36 N -1.85 3.75 0.10 0.37 0.04 -1.26 -4.93 135.00 131.22 2yuz s PRO 36 Ca -0.02 1.77 -0.05 0.00 0.04 0.00 0.00 61.00 62.73 2yuz s PRO 36 Cb -0.09 -2.40 -0.02 0.00 0.04 0.00 0.00 34.50 32.03 2yuz s PRO 36 CO 0.02 -0.56 0.12 0.20 0.04 0.00 0.00 177.00 176.82 2yuz s GLY 37 N -1.37 0.46 0.23 0.56 0.00 -1.26 -2.46 107.32 103.47 2yuz s GLY 37 Ca 0.64 -1.02 0.11 0.00 0.00 0.00 0.00 44.72 44.46 2yuz s GLY 37 CO 0.34 -1.07 -0.21 1.25 0.00 0.00 0.00 173.10 173.42 2yuz s LYS 38 N -3.94 1.64 0.34 2.90 2.20 -0.47 -4.93 119.74 117.49 2yuz s LYS 38 Ca 0.12 -1.61 0.07 0.00 -0.36 0.00 0.00 55.97 54.20 2yuz s LYS 38 Cb 0.06 -1.84 -0.02 0.00 -1.51 0.00 0.00 37.83 34.52 2yuz s LYS 38 CO -0.06 0.37 0.36 -1.58 -0.36 0.00 0.00 175.35 174.09 2yuz s TRP 39 N -2.03 2.95 -0.18 4.03 0.52 -1.26 -0.63 118.94 122.35 2yuz s TRP 39 Ca 0.25 -0.29 -0.12 0.00 0.02 0.00 0.00 56.10 55.96 2yuz s TRP 39 Cb -0.07 -1.90 0.05 0.00 -1.15 0.00 0.00 33.47 30.41 2yuz s TRP 39 CO 0.13 0.09 0.44 0.95 0.02 0.00 0.00 176.95 178.57 2yuz s THR 40 N -2.28 -0.02 -0.00 2.01 -4.23 0.29 -3.18 115.64 108.23 2yuz s THR 40 Ca 0.43 0.06 0.02 0.00 -1.18 0.00 0.00 61.69 61.02 2yuz s THR 40 Cb -0.07 -0.64 -0.03 0.00 1.34 0.00 0.00 72.50 73.10 2yuz s THR 40 CO 0.28 0.02 -0.04 -0.75 -0.54 0.00 0.00 174.62 173.59 2yuz s LYS 41 N 1.03 2.64 -1.60 3.99 2.20 0.72 0.16 119.74 128.89 2yuz s LYS 41 Ca -0.06 -0.67 -0.18 0.00 -0.36 0.00 0.00 55.97 54.69 2yuz s LYS 41 Cb -0.06 -2.57 0.18 0.00 -1.51 0.00 0.00 37.83 33.87 2yuz s LYS 41 CO -0.09 0.61 0.46 0.09 -0.36 0.00 0.00 175.35 176.06 2yuz n ASN 42 N 1.55 -1.29 -2.72 1.43 3.02 -0.53 0.11 115.26 116.84 2yuz n ASN 42 Ca -0.15 -1.08 -0.13 0.00 -0.03 0.00 0.00 54.58 53.18 2yuz n ASN 42 Cb 0.53 -1.38 0.06 0.00 -0.61 0.00 0.00 39.78 38.38 2yuz n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2yuz n GLY 43 N -1.15 -0.12 3.31 7.41 0.00 -1.26 -5.04 105.19 108.34 2yuz n GLY 43 Ca 0.06 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 2yuz n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yuz s LEU 44 N -5.19 0.45 -0.16 0.99 1.43 0.30 -5.13 118.68 111.37 2yuz s LEU 44 Ca 0.11 0.10 -0.29 0.00 -1.03 0.00 0.00 54.13 53.02 2yuz s LEU 44 Cb -0.05 1.65 -0.03 0.00 0.03 0.00 0.00 46.19 47.79 2yuz s LEU 44 CO 0.52 -0.58 1.57 -2.16 0.23 0.00 0.00 176.35 175.92 2yuz s PRO 45 N -1.94 3.99 0.22 1.29 0.04 -1.26 -0.20 135.00 137.14 2yuz s PRO 45 Ca -0.09 1.83 -0.30 0.00 0.04 0.00 0.00 61.00 62.48 2yuz s PRO 45 Cb -0.02 -3.97 -0.09 0.00 0.04 0.00 0.00 34.50 30.46 2yuz s PRO 45 CO 0.01 -1.05 1.20 0.08 0.04 0.00 0.00 177.00 177.28 2yuz s VAL 46 N 4.53 3.44 -0.06 -0.36 1.01 -1.19 -4.87 120.40 122.90 2yuz s VAL 46 Ca 0.69 1.27 -0.30 0.00 0.00 0.00 0.00 61.98 63.65 2yuz s VAL 46 Cb -0.27 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.28 2yuz s VAL 46 CO 0.27 0.23 1.00 0.00 0.00 0.00 0.00 175.10 176.60 2yuz s GLN 47 N -0.60 4.48 -0.31 2.72 -2.07 -1.26 -4.92 119.66 117.70 2yuz s GLN 47 Ca 0.51 1.41 -0.11 0.00 -1.82 0.00 0.00 55.36 55.35 2yuz s GLN 47 Cb -0.33 -3.50 -0.03 0.00 -1.09 0.00 0.00 33.01 28.05 2yuz s GLN 47 CO 0.39 -0.20 0.20 -1.21 -1.32 0.00 0.00 175.29 173.15 2yuz s GLU 48 N 1.56 3.64 0.32 9.60 2.02 -1.26 -4.78 118.70 129.78 2yuz s GLU 48 Ca 0.50 -0.53 -0.04 0.00 0.02 0.00 0.00 54.97 54.92 2yuz s GLU 48 Cb -0.20 -3.69 -0.00 0.00 0.10 0.00 0.00 34.13 30.34 2yuz s GLU 48 CO 0.23 -0.33 0.44 -1.12 0.02 0.00 0.00 175.26 174.49 2yuz s SER 49 N 1.71 0.73 0.24 -0.19 0.01 -0.00 -4.97 113.70 111.23 2yuz s SER 49 Ca 0.06 -1.40 -0.09 0.00 1.31 0.00 0.00 55.95 55.83 2yuz s SER 49 Cb -0.17 0.62 0.37 0.00 0.21 0.00 0.00 66.02 67.06 2yuz s SER 49 CO 0.10 -1.23 1.39 -0.67 0.41 0.00 0.00 173.24 173.24 2yuz n ASP 50 N -1.17 -0.37 0.14 2.44 -0.08 -1.26 0.27 116.55 116.52 2yuz n ASP 50 Ca 0.01 1.53 -0.14 0.00 -1.51 0.00 0.00 54.79 54.69 2yuz n ASP 50 Cb 0.62 -0.44 -0.07 0.00 2.34 0.00 0.00 41.12 43.56 2yuz n ASP 50 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 2yuz h ARG 51 N 0.00 -0.27 -4.39 -0.67 3.08 -1.96 -3.38 114.38 106.79 2yuz h ARG 51 Ca 0.41 0.02 -0.72 0.00 0.07 0.00 0.00 59.98 59.75 2yuz h ARG 51 Cb 0.63 0.06 -0.27 0.00 0.08 0.00 0.00 29.97 30.47 2yuz h ARG 51 CO -0.91 -0.18 -0.43 -1.17 -1.07 0.00 0.00 179.97 176.21 2yuz s LEU 52 N -10.17 5.35 -0.05 3.04 0.20 0.14 -2.71 118.68 114.49 2yuz s LEU 52 Ca -0.14 -1.57 0.04 0.00 0.69 0.00 0.00 54.13 53.14 2yuz s LEU 52 Cb 0.05 -2.02 -0.03 0.00 -0.43 0.00 0.00 46.19 43.77 2yuz s LEU 52 CO 0.65 -0.59 -0.15 -0.75 -0.29 0.00 0.00 176.35 175.21 2yuz s LYS 53 N 1.44 2.46 -0.50 1.98 2.47 -1.20 -0.82 119.74 125.57 2yuz s LYS 53 Ca 0.04 -0.72 -0.12 0.00 -1.56 0.00 0.00 55.97 53.61 2yuz s LYS 53 Cb -0.24 -2.35 0.12 0.00 -1.46 0.00 0.00 37.83 33.91 2yuz s LYS 53 CO 0.02 0.62 0.40 0.08 0.16 0.00 0.00 175.35 176.63 2yuz s VAL 54 N -0.73 4.58 0.12 4.02 1.01 -1.26 -3.95 120.40 124.20 2yuz s VAL 54 Ca 0.11 -1.68 -0.11 0.00 0.00 0.00 0.00 61.98 60.30 2yuz s VAL 54 Cb -0.11 -3.98 -0.06 0.00 0.00 0.00 0.00 36.38 32.23 2yuz s VAL 54 CO 0.00 -0.81 0.47 -0.69 0.00 0.00 0.00 175.10 174.08 2yuz s VAL 55 N 1.45 4.99 -0.09 2.92 1.01 -0.90 -4.91 120.40 124.86 2yuz s VAL 55 Ca 0.05 0.59 0.03 0.00 0.00 0.00 0.00 61.98 62.64 2yuz s VAL 55 Cb -0.28 -3.68 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 2yuz s VAL 55 CO 0.01 0.23 -0.18 -1.58 0.00 0.00 0.00 175.10 173.57 2yuz s GLN 56 N -2.04 2.98 -0.37 2.72 0.74 -1.26 -0.58 119.66 121.84 2yuz s GLN 56 Ca 0.37 -0.77 0.01 0.00 0.05 0.00 0.00 55.36 55.01 2yuz s GLN 56 Cb -0.14 -2.42 0.12 0.00 1.10 0.00 0.00 33.01 31.67 2yuz s GLN 56 CO 0.19 0.32 0.17 0.15 -0.55 0.00 0.00 175.29 175.57 2yuz s LYS 57 N 0.04 1.00 -0.23 1.67 -0.14 -0.61 -4.94 119.74 116.53 2yuz s LYS 57 Ca -0.07 -1.56 -0.21 0.00 -1.36 0.00 0.00 55.97 52.78 2yuz s LYS 57 Cb -0.15 -2.15 0.03 0.00 -1.68 0.00 0.00 37.83 33.88 2yuz s LYS 57 CO 0.05 -1.08 0.34 0.41 -0.76 0.00 0.00 175.35 174.31 2yuz n GLY 58 N 4.16 0.10 3.43 -3.33 0.00 -1.26 -2.36 105.19 105.93 2yuz n GLY 58 Ca 0.04 0.60 -0.17 0.00 0.00 0.00 0.00 46.02 46.49 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 0.25 -6.65 -3.70 1.61 1.74 -1.26 -4.98 116.66 103.68 2yuz n ARG 59 Ca -0.05 0.85 -0.11 0.00 -0.77 0.00 0.00 57.85 57.78 2yuz n ARG 59 Cb 0.47 -5.87 -0.11 0.00 -1.02 0.00 0.00 32.46 25.94 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 -3.36 -0.02 -0.31 0.55 1.01 -1.00 -2.97 121.20 115.10 2yuz s ILE 60 Ca 0.01 0.09 -0.09 0.00 0.00 0.00 0.00 60.65 60.66 2yuz s ILE 60 Cb -0.01 -0.61 0.00 0.00 0.01 0.00 0.00 42.46 41.86 2yuz s ILE 60 CO 0.73 0.04 0.13 -1.00 0.00 0.00 0.00 174.94 174.83 2yuz s HIS 61 N 1.30 3.18 -0.09 3.97 3.76 -0.99 -1.57 115.29 124.85 2yuz s HIS 61 Ca -0.09 -0.80 -0.02 0.00 -0.15 0.00 0.00 55.06 54.00 2yuz s HIS 61 Cb -0.08 -2.32 -0.03 0.00 1.11 0.00 0.00 32.58 31.25 2yuz s HIS 61 CO -0.12 -0.53 0.01 0.21 -0.85 0.00 0.00 174.74 173.46 2yuz s LYS 62 N 1.55 3.03 -0.23 1.40 2.47 0.25 -2.86 119.74 125.35 2yuz s LYS 62 Ca 0.03 -0.39 -0.03 0.00 -1.56 0.00 0.00 55.97 54.02 2yuz s LYS 62 Cb -0.17 -2.83 0.11 0.00 -1.46 0.00 0.00 37.83 33.48 2yuz s LYS 62 CO 0.05 0.70 0.24 -1.17 0.16 0.00 0.00 175.35 175.33 2yuz s LEU 63 N -0.86 -0.13 -0.10 5.43 0.20 -0.59 -2.13 118.68 120.50 2yuz s LEU 63 Ca 0.13 -0.39 0.03 0.00 0.69 0.00 0.00 54.13 54.59 2yuz s LEU 63 Cb -0.11 0.41 0.01 0.00 -0.43 0.00 0.00 46.19 46.07 2yuz s LEU 63 CO 0.02 -0.35 -0.20 0.68 -0.29 0.00 0.00 176.35 176.22 2yuz s VAL 64 N 2.33 1.77 0.03 1.68 -7.23 -1.25 -1.33 120.40 116.40 2yuz s VAL 64 Ca 0.08 -0.84 -0.15 0.00 -1.81 0.00 0.00 61.98 59.26 2yuz s VAL 64 Cb -0.15 -1.56 -0.06 0.00 0.56 0.00 0.00 36.38 35.17 2yuz s VAL 64 CO -0.19 0.50 0.45 -0.63 -0.31 0.00 0.00 175.10 174.92 2yuz s ILE 65 N 0.57 4.96 0.12 -0.62 1.01 -0.91 -4.03 121.20 122.30 2yuz s ILE 65 Ca -0.15 0.89 -0.24 0.00 0.00 0.00 0.00 60.65 61.15 2yuz s ILE 65 Cb -0.17 -3.75 -0.06 0.00 0.01 0.00 0.00 42.46 38.50 2yuz s ILE 65 CO 0.05 0.53 1.66 0.00 0.00 0.00 0.00 174.94 177.18 2yuz h ALA 66 N 4.52 -0.23 -3.33 9.38 0.00 -1.85 -2.75 119.26 125.01 2yuz h ALA 66 Ca -0.51 0.01 -0.44 0.00 0.00 0.00 0.00 54.91 53.97 2yuz h ALA 66 Cb 1.22 0.34 -0.36 0.00 0.00 0.00 0.00 17.79 18.98 2yuz h ALA 66 CO 0.62 -0.68 -0.77 -0.80 0.00 0.00 0.00 179.25 177.62 2yuz s ASN 67 N -4.96 1.40 -0.65 0.00 0.01 -1.26 -4.32 114.94 105.16 2yuz s ASN 67 Ca -0.15 -0.13 -0.26 0.00 -0.71 0.00 0.00 52.86 51.61 2yuz s ASN 67 Cb 0.09 -0.49 -0.04 0.00 0.41 0.00 0.00 41.25 41.22 2yuz s ASN 67 CO 0.66 -0.13 1.98 0.00 -1.51 0.00 0.00 177.10 178.11 2yuz s ALA 68 N 1.51 1.93 0.11 0.60 0.00 0.13 -4.77 121.76 121.27 2yuz s ALA 68 Ca -0.02 -0.71 -0.03 0.00 0.00 0.00 0.00 51.96 51.20 2yuz s ALA 68 Cb -0.13 -4.37 -0.05 0.00 0.00 0.00 0.00 23.12 18.57 2yuz s ALA 68 CO -0.03 -4.24 0.31 -0.51 0.00 0.00 0.00 175.76 171.30 2yuz s LEU 69 N 9.97 4.30 0.57 0.00 1.43 -1.26 -1.29 118.68 132.40 2yuz s LEU 69 Ca 0.73 0.48 0.41 0.00 -1.03 0.00 0.00 54.13 54.72 2yuz s LEU 69 Cb -0.12 -3.17 1.48 0.00 0.03 0.00 0.00 46.19 44.41 2yuz s LEU 69 CO 0.17 0.10 1.54 0.74 0.23 0.00 0.00 176.35 179.13 2yuz h THR 70 N 2.08 0.07 -0.33 5.49 2.02 -1.97 0.54 112.91 120.82 2yuz h THR 70 Ca -0.46 0.00 0.04 0.00 0.77 0.00 0.00 66.41 66.76 2yuz h THR 70 Cb 1.16 0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.62 2yuz h THR 70 CO 0.74 0.00 0.11 -0.33 0.37 0.00 0.00 175.52 176.40 2yuz h GLU 71 N 0.00 0.24 -1.41 6.66 4.39 -1.98 -1.35 114.58 121.12 2yuz h GLU 71 Ca 0.74 -0.01 0.41 0.00 0.34 0.00 0.00 59.36 60.84 2yuz h GLU 71 Cb 3.24 -0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 31.77 2yuz h GLU 71 CO -0.01 0.16 1.00 0.22 -1.16 0.00 0.00 179.01 179.22 2yuz h ASP 72 N 0.24 0.08 -1.93 1.42 1.82 -0.29 -3.39 116.42 114.36 2yuz h ASP 72 Ca 0.15 0.03 -0.59 0.00 -0.39 0.00 0.00 57.03 56.22 2yuz h ASP 72 Cb 0.13 0.02 0.00 0.00 0.68 0.00 0.00 39.33 40.16 2yuz h ASP 72 CO -0.16 -0.01 1.37 1.21 -1.61 0.00 0.00 179.24 180.03 2yuz n GLU 73 N -4.22 2.06 0.00 0.28 2.13 -0.51 -4.70 120.64 115.68 2yuz n GLU 73 Ca 0.32 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.79 2yuz n GLU 73 Cb 1.45 -2.98 0.00 0.00 0.27 0.00 0.00 31.44 30.18 2yuz n GLU 73 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2yuz n GLY 74 N 5.42 -0.60 3.18 8.31 0.00 -1.22 -5.03 105.19 115.24 2yuz n GLY 74 Ca 0.28 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 2yuz n GLY 74 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2yuz s ASP 75 N -4.00 3.22 -0.19 1.61 2.15 -1.26 -2.93 116.67 115.27 2yuz s ASP 75 Ca 0.00 -0.59 -0.09 0.00 0.43 0.00 0.00 52.55 52.30 2yuz s ASP 75 Cb 0.00 -1.48 -0.05 0.00 -0.30 0.00 0.00 42.92 41.10 2yuz s ASP 75 CO 0.00 0.06 0.12 -0.31 -0.17 0.00 0.00 175.17 174.87 2yuz s TYR 76 N 0.92 3.40 -0.04 -5.34 1.51 -0.32 -1.45 117.35 116.03 2yuz s TYR 76 Ca -0.04 0.30 0.02 0.00 -1.01 0.00 0.00 57.07 56.34 2yuz s TYR 76 Cb -0.15 -2.12 0.01 0.00 -0.11 0.00 0.00 41.96 39.59 2yuz s TYR 76 CO -0.04 0.31 -0.08 0.08 -1.11 0.00 0.00 175.55 174.71 2yuz s VAL 77 N 0.20 0.78 -0.12 0.71 1.01 0.12 -0.81 120.40 122.29 2yuz s VAL 77 Ca 0.08 -0.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 2yuz s VAL 77 Cb -0.11 -0.72 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2yuz s VAL 77 CO -0.01 0.26 -0.01 0.12 0.00 0.00 0.00 175.10 175.46 2yuz s PHE 78 N 0.48 3.12 -0.06 5.22 5.36 -1.17 0.10 117.98 131.04 2yuz s PHE 78 Ca -0.08 0.01 -0.02 0.00 -0.96 0.00 0.00 56.93 55.88 2yuz s PHE 78 Cb -0.12 -1.88 0.03 0.00 -0.34 0.00 0.00 43.02 40.71 2yuz s PHE 78 CO 0.01 0.25 0.03 0.00 -1.46 0.00 0.00 175.22 174.05 2yuz s ALA 79 N -0.29 0.48 0.78 11.12 0.00 0.20 -2.56 121.76 131.49 2yuz s ALA 79 Ca 0.06 0.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.94 2yuz s ALA 79 Cb -0.12 -0.68 0.06 0.00 0.00 0.00 0.00 23.12 22.38 2yuz s ALA 79 CO 0.02 -0.46 1.09 -1.25 0.00 0.00 0.00 175.76 175.16 2yuz s PRO 80 N 2.04 2.17 -0.04 0.00 0.04 -1.26 -1.36 135.00 136.58 2yuz s PRO 80 Ca 0.05 1.15 0.13 0.00 0.04 0.00 0.00 61.00 62.36 2yuz s PRO 80 Cb -0.12 -1.89 0.45 0.00 0.04 0.00 0.00 34.50 32.98 2yuz s PRO 80 CO -0.04 -1.70 1.34 -3.47 0.04 0.00 0.00 177.00 173.17 2yuz n ASP 81 N -3.56 2.98 0.00 6.66 2.03 -1.03 -4.06 116.55 119.57 2yuz n ASP 81 Ca 0.09 -2.17 0.00 0.00 0.52 0.00 0.00 54.79 53.23 2yuz n ASP 81 Cb 0.53 -0.40 0.00 0.00 -0.72 0.00 0.00 41.12 40.53 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 0.76 1.90 -2.58 -1.67 0.00 -1.26 -5.07 120.51 112.58 2yuz n ALA 82 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.34 2yuz n ALA 82 Cb 0.53 0.29 -0.10 0.00 0.00 0.00 0.00 19.45 20.18 2yuz n ALA 82 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2yuz s TYR 83 N -1.81 2.19 -0.57 0.00 1.51 -1.26 -5.05 117.35 112.36 2yuz s TYR 83 Ca 0.00 -0.85 0.00 0.00 -1.01 0.00 0.00 57.07 55.21 2yuz s TYR 83 Cb 0.00 -1.56 0.47 0.00 -0.11 0.00 0.00 41.96 40.76 2yuz s TYR 83 CO 0.00 0.22 1.86 0.27 -1.11 0.00 0.00 175.55 176.79 2yuz n ASN 84 N -0.96 6.80 -4.85 2.29 6.94 -1.26 -4.16 115.26 120.06 2yuz n ASN 84 Ca -0.07 -3.77 -0.32 0.00 -0.02 0.00 0.00 54.58 50.41 2yuz n ASN 84 Cb 0.67 -0.84 -0.02 0.00 -2.36 0.00 0.00 39.78 37.23 2yuz n ASN 84 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2yuz s VAL 85 N -4.65 4.61 -0.08 3.53 1.01 -1.26 -5.03 120.40 118.53 2yuz s VAL 85 Ca 0.61 1.06 -0.03 0.00 0.00 0.00 0.00 61.98 63.62 2yuz s VAL 85 Cb 0.49 -3.78 0.04 0.00 0.00 0.00 0.00 36.38 33.13 2yuz s VAL 85 CO 0.01 -0.88 0.16 0.42 0.00 0.00 0.00 175.10 174.81 2yuz s THR 86 N -2.85 -0.19 -0.40 3.92 -4.23 -1.25 -4.27 115.64 106.37 2yuz s THR 86 Ca 0.57 0.28 -0.06 0.00 -1.18 0.00 0.00 61.69 61.30 2yuz s THR 86 Cb -0.10 -0.28 0.09 0.00 1.34 0.00 0.00 72.50 73.54 2yuz s THR 86 CO 0.41 0.12 0.21 -0.76 -0.54 0.00 0.00 174.62 174.06 2yuz s LEU 87 N 1.87 5.05 0.34 4.79 1.02 -1.06 -4.92 118.68 125.77 2yuz s LEU 87 Ca -0.02 -1.68 -0.28 0.00 0.02 0.00 0.00 54.13 52.17 2yuz s LEU 87 Cb -0.12 -1.90 -0.10 0.00 0.02 0.00 0.00 46.19 44.10 2yuz s LEU 87 CO -0.06 -0.51 1.22 -2.16 0.02 0.00 0.00 176.35 174.85 2yuz s PRO 88 N 1.30 4.33 -0.11 1.29 0.04 -1.26 -3.04 135.00 137.54 2yuz s PRO 88 Ca 0.04 2.00 -0.11 0.00 0.04 0.00 0.00 61.00 62.97 2yuz s PRO 88 Cb -0.23 -2.98 0.03 0.00 0.04 0.00 0.00 34.50 31.36 2yuz s PRO 88 CO -0.01 -0.13 0.32 0.00 0.04 0.00 0.00 177.00 177.22 2yuz s ALA 89 N -1.23 -0.78 -0.12 8.56 0.00 0.01 -4.60 121.76 123.60 2yuz s ALA 89 Ca 0.50 0.86 -0.02 0.00 0.00 0.00 0.00 51.96 53.31 2yuz s ALA 89 Cb -0.35 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.25 2yuz s ALA 89 CO 0.46 -0.16 -0.06 0.21 0.00 0.00 0.00 175.76 176.21 2yuz s LYS 90 N 0.09 3.28 0.08 0.00 2.47 -1.26 -1.17 119.74 123.22 2yuz s LYS 90 Ca -0.01 -0.54 0.03 0.00 -1.56 0.00 0.00 55.97 53.89 2yuz s LYS 90 Cb -0.02 -2.76 -0.03 0.00 -1.46 0.00 0.00 37.83 33.55 2yuz s LYS 90 CO 0.01 0.41 -0.10 0.14 0.16 0.00 0.00 175.35 175.97 2yuz s VAL 91 N -0.12 0.85 -0.04 4.02 -7.23 -1.15 -2.15 120.40 114.58 2yuz s VAL 91 Ca 0.02 -1.46 -0.13 0.00 -1.81 0.00 0.00 61.98 58.60 2yuz s VAL 91 Cb -0.13 -1.14 0.02 0.00 0.56 0.00 0.00 36.38 35.70 2yuz s VAL 91 CO 0.03 -0.47 0.29 -2.28 -0.31 0.00 0.00 175.10 172.36 2yuz s HIS 92 N -2.04 -0.21 0.02 2.82 2.46 -1.22 -3.41 115.29 113.71 2yuz s HIS 92 Ca 0.01 0.40 0.08 0.00 0.47 0.00 0.00 55.06 56.02 2yuz s HIS 92 Cb -0.05 0.09 -0.03 0.00 -0.13 0.00 0.00 32.58 32.46 2yuz s HIS 92 CO 0.00 -0.31 -0.23 0.54 -2.47 0.00 0.00 174.74 172.27 2yuz s VAL 93 N -0.87 2.36 -0.22 0.89 0.11 -1.26 -2.81 120.40 118.60 2yuz s VAL 93 Ca -0.09 -1.21 -0.08 0.00 -2.93 0.00 0.00 61.98 57.67 2yuz s VAL 93 Cb -0.05 -1.91 -0.04 0.00 -1.53 0.00 0.00 36.38 32.85 2yuz s VAL 93 CO 0.03 0.44 0.08 -0.63 -3.33 0.00 0.00 175.10 171.69 2yuz s ILE 94 N -0.78 4.70 0.10 7.04 1.01 -0.97 -4.93 121.20 127.37 2yuz s ILE 94 Ca 0.12 -0.05 -0.30 0.00 0.00 0.00 0.00 60.65 60.42 2yuz s ILE 94 Cb -0.10 -3.16 -0.06 0.00 0.01 0.00 0.00 42.46 39.15 2yuz s ILE 94 CO 0.02 0.39 1.05 -0.55 0.00 0.00 0.00 174.94 175.85 2yuz s SER 95 N 0.99 7.33 0.00 3.58 0.15 -1.26 -1.29 113.70 123.20 2yuz s SER 95 Ca 0.05 1.89 0.00 0.00 0.70 0.00 0.00 55.95 58.58 2yuz s SER 95 Cb -0.14 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 2yuz s SER 95 CO 0.03 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2yuz n GLY 96 N 2.52 -1.03 3.57 9.45 0.00 -1.26 -4.97 105.19 113.46 2yuz n GLY 96 Ca 0.04 0.79 -0.28 0.00 0.00 0.00 0.00 46.02 46.58 2yuz n GLY 96 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yuz s PRO 97 N 0.00 2.52 -0.87 1.61 0.04 -1.26 -4.83 135.00 132.21 2yuz s PRO 97 Ca 0.00 -0.89 -0.25 0.00 0.04 0.00 0.00 61.00 59.90 2yuz s PRO 97 Cb 0.00 -5.19 -0.06 0.00 0.04 0.00 0.00 34.50 29.30 2yuz s PRO 97 CO 0.00 -3.79 2.00 0.45 0.04 0.00 0.00 177.00 175.70 2yuz s SER 98 N 6.98 4.99 -0.10 6.66 0.15 -1.26 -4.89 113.70 126.23 2yuz s SER 98 Ca 0.69 -0.53 -0.02 0.00 0.70 0.00 0.00 55.95 56.79 2yuz s SER 98 Cb -0.03 -2.56 0.04 0.00 -1.71 0.00 0.00 66.02 61.76 2yuz s SER 98 CO 0.09 -2.87 0.02 -0.44 1.20 0.00 0.00 173.24 171.24 2yuz s SER 99 N 8.41 1.86 0.00 5.45 0.01 -1.26 -5.24 113.70 122.93 2yuz s SER 99 Ca 0.73 -0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.74 2yuz s SER 99 Cb -0.08 -0.43 0.00 0.00 0.21 0.00 0.00 66.02 65.72 2yuz s SER 99 CO 0.01 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.04