#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yug s SER 2 N 0.00 0.56 -0.36 1.61 0.15 -1.26 -5.13 113.70 109.27 2yug s SER 2 Ca 0.00 -1.01 0.00 0.00 0.70 0.00 0.00 55.95 55.64 2yug s SER 2 Cb 0.00 0.19 0.12 0.00 -1.71 0.00 0.00 66.02 64.63 2yug s SER 2 CO 0.00 -0.59 0.18 -0.44 1.20 0.00 0.00 173.24 173.59 2yug s SER 3 N -2.94 3.53 0.00 5.45 0.01 -1.26 -4.89 113.70 113.60 2yug s SER 3 Ca 0.08 -2.08 0.00 0.00 1.31 0.00 0.00 55.95 55.26 2yug s SER 3 Cb 0.08 -0.72 0.00 0.00 0.21 0.00 0.00 66.02 65.59 2yug s SER 3 CO -0.09 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 173.83 2yug n GLY 4 N 4.23 0.00 0.03 3.44 0.00 -1.26 -5.03 105.19 106.61 2yug n GLY 4 Ca 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.04 2yug n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yug n SER 5 N 0.00 3.43 -2.47 1.61 2.88 -1.26 -5.10 113.62 112.71 2yug n SER 5 Ca 0.00 -0.01 -0.03 0.00 -1.33 0.00 0.00 58.87 57.50 2yug n SER 5 Cb 0.00 0.52 -0.03 0.00 -0.75 0.00 0.00 64.21 63.95 2yug n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2yug n SER 6 N -2.32 -2.97 -4.75 -3.46 2.88 -1.26 -4.92 113.62 96.83 2yug n SER 6 Ca -0.11 1.18 -0.41 0.00 -1.33 0.00 0.00 58.87 58.19 2yug n SER 6 Cb 0.70 -4.66 -0.03 0.00 -0.75 0.00 0.00 64.21 59.47 2yug n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2yug s GLY 7 N -0.87 2.62 -0.99 0.46 0.00 -1.26 -4.97 107.32 102.31 2yug s GLY 7 Ca -0.16 1.12 -0.07 0.00 0.00 0.00 0.00 44.72 45.62 2yug s GLY 7 CO 0.68 1.99 0.93 -2.27 0.00 0.00 0.00 173.10 174.43 2yug s LEU 8 N -0.57 6.07 -0.22 0.66 2.96 -1.26 -5.00 118.68 121.31 2yug s LEU 8 Ca 0.54 -3.52 -0.28 0.00 -0.22 0.00 0.00 54.13 50.65 2yug s LEU 8 Cb -0.37 -2.09 -0.05 0.00 0.50 0.00 0.00 46.19 44.18 2yug s LEU 8 CO 0.41 -0.28 2.23 -0.67 -1.32 0.00 0.00 176.35 176.72 2yug n ASP 9 N 2.73 3.26 -4.39 3.68 2.03 -1.26 -4.85 116.55 117.76 2yug n ASP 9 Ca 0.21 0.19 -0.33 0.00 0.52 0.00 0.00 54.79 55.38 2yug n ASP 9 Cb 0.39 -1.56 -0.14 0.00 -0.72 0.00 0.00 41.12 39.09 2yug n ASP 9 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2yug s ILE 10 N 8.38 3.20 -0.31 5.18 2.07 -1.26 -0.24 121.20 138.23 2yug s ILE 10 Ca 1.01 -0.60 0.01 0.00 -1.41 0.00 0.00 60.65 59.65 2yug s ILE 10 Cb -0.33 -2.36 0.10 0.00 0.13 0.00 0.00 42.46 39.99 2yug s ILE 10 CO 0.35 0.51 0.07 -0.69 -1.91 0.00 0.00 174.94 173.27 2yug s VAL 11 N 0.42 1.31 0.00 4.00 1.01 0.45 -4.96 120.40 122.64 2yug s VAL 11 Ca -0.09 -1.62 0.00 0.00 0.00 0.00 0.00 61.98 60.27 2yug s VAL 11 Cb -0.15 -1.94 0.00 0.00 0.00 0.00 0.00 36.38 34.28 2yug s VAL 11 CO 0.05 -0.60 0.00 0.61 0.00 0.00 0.00 175.10 175.16 2yug n GLY 12 N 4.67 1.25 1.49 4.51 0.00 -1.26 -2.08 105.19 113.76 2yug n GLY 12 Ca -0.01 0.45 0.02 0.00 0.00 0.00 0.00 46.02 46.48 2yug n GLY 12 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2yug n ILE 13 N 0.00 0.05 -4.19 -0.61 -6.64 -1.26 -5.08 119.36 101.62 2yug n ILE 13 Ca 0.00 -0.92 -0.17 0.00 -1.77 0.00 0.00 62.75 59.88 2yug n ILE 13 Cb 0.00 0.94 -0.15 0.00 -1.44 0.00 0.00 39.64 38.99 2yug n ILE 13 CO 0.00 0.00 0.00 0.26 -1.77 0.00 0.00 176.55 175.04 2yug s TRP 14 N -0.15 0.60 -0.21 4.28 0.52 -0.89 -4.57 118.94 118.51 2yug s TRP 14 Ca 0.28 -0.12 -0.00 0.00 0.02 0.00 0.00 56.10 56.28 2yug s TRP 14 Cb 0.33 -0.44 0.02 0.00 -1.15 0.00 0.00 33.47 32.23 2yug s TRP 14 CO -0.14 -0.06 -0.13 1.67 0.02 0.00 0.00 176.95 178.31 2yug s TRP 15 N 0.17 2.94 0.29 -1.98 1.48 0.50 -0.41 118.94 121.93 2yug s TRP 15 Ca -0.02 -1.61 -0.30 0.00 -1.06 0.00 0.00 56.10 53.11 2yug s TRP 15 Cb -0.06 -1.98 -0.12 0.00 -1.16 0.00 0.00 33.47 30.15 2yug s TRP 15 CO -0.00 -0.76 1.63 0.99 -4.06 0.00 0.00 176.95 174.74 2yug s THR 16 N 1.30 2.00 0.72 0.66 2.01 0.67 -2.60 115.64 120.41 2yug s THR 16 Ca 0.02 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 61.94 2yug s THR 16 Cb -0.15 -3.00 0.06 0.00 0.01 0.00 0.00 72.50 69.42 2yug s THR 16 CO -0.09 0.00 1.06 0.68 -0.69 0.00 0.00 174.62 175.58 2yug s VAL 17 N 0.15 2.43 0.00 3.82 -7.23 -1.22 -4.52 120.40 113.83 2yug s VAL 17 Ca 0.65 -0.10 0.00 0.00 -1.81 0.00 0.00 61.98 60.72 2yug s VAL 17 Cb -0.49 -3.08 0.00 0.00 0.56 0.00 0.00 36.38 33.37 2yug s VAL 17 CO 0.46 -0.10 0.00 -0.24 -0.31 0.00 0.00 175.10 174.91 2yug n SER 18 N -3.01 1.25 -4.84 4.85 2.88 -1.26 -5.00 113.62 108.49 2yug n SER 18 Ca 0.08 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.35 2yug n SER 18 Cb 0.60 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.03 2yug n SER 18 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2yug s ASN 19 N -4.36 4.54 0.26 -3.46 4.22 -1.26 -4.96 114.94 109.92 2yug s ASN 19 Ca 0.00 -1.24 0.07 0.00 -2.14 0.00 0.00 52.86 49.55 2yug s ASN 19 Cb 0.00 0.18 0.31 0.00 1.28 0.00 0.00 41.25 43.01 2yug s ASN 19 CO 0.00 -0.92 1.59 0.15 -2.04 0.00 0.00 177.10 175.89 2yug h PHE 20 N 1.01 0.19 -0.11 1.54 3.57 -1.97 -3.03 116.94 118.14 2yug h PHE 20 Ca -0.40 -0.07 0.03 0.00 3.53 0.00 0.00 57.97 61.06 2yug h PHE 20 Cb 1.29 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 2yug h PHE 20 CO 0.96 0.71 0.09 0.78 -2.23 0.00 0.00 178.31 178.62 2yug h GLY 21 N 1.58 0.00 2.00 2.40 0.00 -2.03 -0.55 103.07 106.46 2yug h GLY 21 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.22 2yug h GLY 21 CO 0.09 0.00 -0.49 0.83 0.00 0.00 0.00 176.54 176.97 2yug h GLU 22 N 0.00 0.00 -5.74 4.80 4.39 -1.94 -3.42 114.58 112.66 2yug h GLU 22 Ca 0.05 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.25 2yug h GLU 22 Cb 0.23 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2yug h GLU 22 CO -0.00 0.49 1.58 0.42 -1.16 0.00 0.00 179.01 180.34 2yug s ILE 23 N -3.76 3.01 -0.28 3.13 -1.09 -0.22 -4.87 121.20 117.13 2yug s ILE 23 Ca -0.01 0.01 -0.25 0.00 -2.23 0.00 0.00 60.65 58.16 2yug s ILE 23 Cb 0.13 -3.03 0.15 0.00 -1.58 0.00 0.00 42.46 38.13 2yug s ILE 23 CO 0.73 -0.02 1.17 -0.94 -1.23 0.00 0.00 174.94 174.65 2yug s SER 24 N 10.89 -0.31 0.02 3.58 1.04 -1.26 -4.63 113.70 123.03 2yug s SER 24 Ca 0.98 0.59 0.00 0.00 0.48 0.00 0.00 55.95 58.00 2yug s SER 24 Cb -0.22 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.49 2yug s SER 24 CO 0.29 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.01 2yug n GLY 25 N 1.94 -1.67 3.72 7.32 0.00 -1.19 -4.72 105.19 110.59 2yug n GLY 25 Ca -0.11 -1.34 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 2yug n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yug s THR 26 N 0.00 3.40 0.03 2.61 2.01 -1.26 -0.73 115.64 121.70 2yug s THR 26 Ca 0.00 1.01 -0.07 0.00 0.31 0.00 0.00 61.69 62.94 2yug s THR 26 Cb 0.00 -3.65 -0.00 0.00 0.01 0.00 0.00 72.50 68.86 2yug s THR 26 CO 0.00 0.08 0.13 0.27 -0.69 0.00 0.00 174.62 174.41 2yug s ILE 27 N 1.06 0.11 0.06 1.82 -5.25 0.18 -2.40 121.20 116.78 2yug s ILE 27 Ca 0.63 -0.92 0.07 0.00 -0.99 0.00 0.00 60.65 59.45 2yug s ILE 27 Cb -0.36 -0.74 -0.04 0.00 2.95 0.00 0.00 42.46 44.28 2yug s ILE 27 CO 0.30 -0.50 -0.15 0.00 -1.79 0.00 0.00 174.94 172.80 2yug s ALA 28 N -2.19 2.74 -0.24 2.27 0.00 0.14 -1.12 121.76 123.36 2yug s ALA 28 Ca -0.08 -1.22 0.02 0.00 0.00 0.00 0.00 51.96 50.69 2yug s ALA 28 Cb -0.03 -0.80 0.05 0.00 0.00 0.00 0.00 23.12 22.34 2yug s ALA 28 CO -0.02 0.60 -0.13 0.42 0.00 0.00 0.00 175.76 176.63 2yug s ILE 29 N -1.04 2.16 -0.28 0.00 1.09 -1.26 -0.66 121.20 121.20 2yug s ILE 29 Ca 0.17 -1.48 -0.17 0.00 -1.10 0.00 0.00 60.65 58.07 2yug s ILE 29 Cb -0.11 -2.20 -0.03 0.00 -1.06 0.00 0.00 42.46 39.07 2yug s ILE 29 CO 0.08 0.09 0.46 -0.70 -0.10 0.00 0.00 174.94 174.78 2yug s GLU 30 N 1.14 3.95 -0.08 2.79 2.12 -0.82 -3.87 118.70 123.93 2yug s GLU 30 Ca -0.06 0.11 -0.03 0.00 0.36 0.00 0.00 54.97 55.35 2yug s GLU 30 Cb -0.18 -3.69 -0.01 0.00 0.26 0.00 0.00 34.13 30.51 2yug s GLU 30 CO -0.07 -0.39 -0.05 0.52 -0.54 0.00 0.00 175.26 174.73 2yug h MET 31 N 8.17 0.00 -6.69 4.30 2.86 -1.87 -2.86 114.93 118.84 2yug h MET 31 Ca -0.30 0.00 -0.46 0.00 -2.06 0.00 0.00 59.70 56.88 2yug h MET 31 Cb 1.14 0.00 0.04 0.00 0.06 0.00 0.00 31.60 32.84 2yug h MET 31 CO 0.70 0.00 -0.10 0.34 1.06 0.00 0.00 176.91 178.91 2yug s ASP 32 N -4.81 5.13 -1.19 1.22 -1.08 -1.14 -4.77 116.67 110.03 2yug s ASP 32 Ca -0.04 -0.58 -0.21 0.00 -0.52 0.00 0.00 52.55 51.20 2yug s ASP 32 Cb 0.01 -0.11 -0.02 0.00 -1.46 0.00 0.00 42.92 41.34 2yug s ASP 32 CO 0.06 -1.27 1.83 -0.54 0.52 0.00 0.00 175.17 175.78 2yug s LYS 33 N -4.68 3.10 0.00 4.34 1.02 -1.26 -3.16 119.74 119.10 2yug s LYS 33 Ca 0.60 -1.38 0.00 0.00 0.02 0.00 0.00 55.97 55.21 2yug s LYS 33 Cb -0.07 -5.34 0.00 0.00 -0.52 0.00 0.00 37.83 31.90 2yug s LYS 33 CO 0.38 -3.21 0.00 0.41 -0.92 0.00 0.00 175.35 172.01 2yug n GLY 34 N 5.83 1.14 3.82 -3.33 0.00 -1.26 -5.03 105.19 106.36 2yug n GLY 34 Ca 0.45 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.09 2yug n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yug s ALA 35 N -1.48 3.60 0.20 4.61 0.00 -1.19 -3.78 121.76 123.73 2yug s ALA 35 Ca 0.00 -0.03 0.08 0.00 0.00 0.00 0.00 51.96 52.00 2yug s ALA 35 Cb 0.00 -2.58 -0.05 0.00 0.00 0.00 0.00 23.12 20.50 2yug s ALA 35 CO 0.00 0.42 -0.14 0.71 0.00 0.00 0.00 175.76 176.75 2yug s TYR 36 N -1.18 1.69 -0.42 0.00 1.51 -1.25 -2.90 117.35 114.79 2yug s TYR 36 Ca 0.30 -0.58 -0.28 0.00 -1.01 0.00 0.00 57.07 55.50 2yug s TYR 36 Cb -0.18 -0.79 -0.01 0.00 -0.11 0.00 0.00 41.96 40.87 2yug s TYR 36 CO 0.18 0.34 1.70 0.42 -1.11 0.00 0.00 175.55 177.08 2yug s ILE 37 N -2.92 3.57 0.11 2.71 1.01 -1.25 0.10 121.20 124.53 2yug s ILE 37 Ca 0.21 0.54 -0.14 0.00 0.00 0.00 0.00 60.65 61.25 2yug s ILE 37 Cb -0.01 -3.88 -0.07 0.00 0.01 0.00 0.00 42.46 38.51 2yug s ILE 37 CO 0.06 -0.64 0.52 -2.28 0.00 0.00 0.00 174.94 172.60 2yug s HIS 38 N 6.95 3.64 0.00 3.97 2.46 0.25 -4.48 115.29 128.09 2yug s HIS 38 Ca 0.71 1.05 -0.05 0.00 0.47 0.00 0.00 55.06 57.25 2yug s HIS 38 Cb -0.18 -2.35 -0.04 0.00 -0.13 0.00 0.00 32.58 29.87 2yug s HIS 38 CO 0.30 0.48 0.23 0.00 -2.47 0.00 0.00 174.74 173.29 2yug s ALA 39 N -1.37 3.89 -0.05 1.58 0.00 -1.25 -1.70 121.76 122.87 2yug s ALA 39 Ca 0.35 -0.65 0.06 0.00 0.00 0.00 0.00 51.96 51.72 2yug s ALA 39 Cb -0.16 -1.99 -0.01 0.00 0.00 0.00 0.00 23.12 20.96 2yug s ALA 39 CO 0.18 0.69 -0.24 -0.51 0.00 0.00 0.00 175.76 175.88 2yug s LEU 40 N -1.83 2.05 0.40 0.00 1.43 -0.52 -4.93 118.68 115.27 2yug s LEU 40 Ca 0.27 -0.48 0.14 0.00 -1.03 0.00 0.00 54.13 53.03 2yug s LEU 40 Cb -0.13 -1.31 0.85 0.00 0.03 0.00 0.00 46.19 45.63 2yug s LEU 40 CO 0.17 0.24 1.89 -0.78 0.23 0.00 0.00 176.35 178.10 2yug h ASP 41 N 6.00 0.00 -0.19 2.29 1.82 -1.99 -2.48 116.42 121.86 2yug h ASP 41 Ca -0.33 0.00 0.05 0.00 -0.39 0.00 0.00 57.03 56.36 2yug h ASP 41 Cb 1.17 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.17 2yug h ASP 41 CO 0.47 0.30 0.17 -1.13 -1.61 0.00 0.00 179.24 177.44 2yug h ASN 42 N 0.00 0.00 0.00 2.28 -1.24 -2.00 -3.45 115.58 111.17 2yug h ASN 42 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2yug h ASN 42 Cb 0.55 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.60 2yug h ASN 42 CO 0.04 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.79 2yug n GLY 43 N -1.47 1.92 3.32 1.57 0.00 -0.94 -5.14 105.19 104.45 2yug n GLY 43 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 2yug n GLY 43 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yug n LEU 44 N 0.00 0.00 -3.76 0.99 4.77 -1.23 -4.61 117.00 113.16 2yug n LEU 44 Ca 0.00 -3.24 -0.14 0.00 -0.03 0.00 0.00 56.01 52.60 2yug n LEU 44 Cb 0.00 1.57 -0.15 0.00 -2.33 0.00 0.00 43.42 42.51 2yug n LEU 44 CO 0.00 -0.53 -0.29 -0.36 -1.33 0.00 0.00 177.39 174.88 2yug s PHE 45 N -3.33 -0.07 0.13 -1.77 0.40 -1.26 -1.45 117.98 110.63 2yug s PHE 45 Ca 0.36 0.31 0.02 0.00 -0.60 0.00 0.00 56.93 57.02 2yug s PHE 45 Cb 0.02 -0.17 -0.04 0.00 0.51 0.00 0.00 43.02 43.34 2yug s PHE 45 CO 0.26 -0.13 -0.04 -0.08 0.70 0.00 0.00 175.22 175.93 2yug s THR 46 N 1.16 0.69 -0.36 0.64 -1.32 -0.69 -2.77 115.64 113.00 2yug s THR 46 Ca -0.09 -1.95 -0.29 0.00 -1.21 0.00 0.00 61.69 58.15 2yug s THR 46 Cb -0.12 -1.84 -0.00 0.00 -1.51 0.00 0.00 72.50 69.02 2yug s THR 46 CO -0.04 -0.72 1.56 -0.22 -2.21 0.00 0.00 174.62 172.98 2yug s LEU 47 N -3.09 3.61 0.99 9.08 2.96 -1.26 0.84 118.68 131.81 2yug s LEU 47 Ca 0.16 1.10 -0.11 0.00 -0.22 0.00 0.00 54.13 55.06 2yug s LEU 47 Cb 0.05 -3.53 0.18 0.00 0.50 0.00 0.00 46.19 43.39 2yug s LEU 47 CO -0.01 -1.48 1.10 0.61 -1.32 0.00 0.00 176.35 175.24 2yug n GLY 48 N 5.10 -0.82 3.77 7.98 0.00 0.28 -4.81 105.19 116.69 2yug n GLY 48 Ca 0.19 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 2yug n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yug s ALA 49 N -2.58 3.21 0.44 4.61 0.00 -1.26 -3.96 121.76 122.22 2yug s ALA 49 Ca 0.67 1.19 -0.23 0.00 0.00 0.00 0.00 51.96 53.59 2yug s ALA 49 Cb -0.24 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.33 2yug s ALA 49 CO 0.60 -0.81 1.11 -1.25 0.00 0.00 0.00 175.76 175.41 2yug s PRO 50 N -2.30 3.93 0.60 0.00 0.04 -1.26 -4.73 135.00 131.27 2yug s PRO 50 Ca 0.58 1.63 -0.12 0.00 0.04 0.00 0.00 61.00 63.13 2yug s PRO 50 Cb -0.37 -2.44 -0.05 0.00 0.04 0.00 0.00 34.50 31.69 2yug s PRO 50 CO 0.47 -0.37 1.02 -1.01 0.04 0.00 0.00 177.00 177.15 2yug s HIS 51 N -1.63 3.60 -0.05 0.56 3.76 -1.25 -5.01 115.29 115.27 2yug s HIS 51 Ca 0.61 1.32 -0.25 0.00 -0.15 0.00 0.00 55.06 56.59 2yug s HIS 51 Cb -0.25 -2.73 -0.22 0.00 1.11 0.00 0.00 32.58 30.49 2yug s HIS 51 CO 0.31 -0.63 1.07 0.00 -0.85 0.00 0.00 174.74 174.64 2yug h ARG 52 N -0.08 0.12 -5.49 1.40 3.08 -1.97 -3.44 114.38 108.00 2yug h ARG 52 Ca -0.45 -0.11 -0.62 0.00 0.07 0.00 0.00 59.98 58.88 2yug h ARG 52 Cb 1.19 0.03 -0.10 0.00 0.08 0.00 0.00 29.97 31.17 2yug h ARG 52 CO 0.62 0.81 -0.43 -1.21 -1.07 0.00 0.00 179.97 178.69 2yug s GLU 53 N -3.35 3.95 0.10 0.04 0.41 -1.26 -5.01 118.70 113.58 2yug s GLU 53 Ca -0.16 -0.08 -0.22 0.00 -0.41 0.00 0.00 54.97 54.10 2yug s GLU 53 Cb 0.01 -3.33 -0.13 0.00 -1.78 0.00 0.00 34.13 28.89 2yug s GLU 53 CO 0.72 0.47 1.74 0.28 -0.49 0.00 0.00 175.26 177.98 2yug h VAL 54 N 4.39 1.00 0.00 2.63 2.07 -2.03 -3.26 116.25 121.04 2yug h VAL 54 Ca -0.46 -0.01 -0.65 0.00 0.82 0.00 0.00 66.70 66.40 2yug h VAL 54 Cb 1.18 0.95 0.02 0.00 -1.52 0.00 0.00 31.29 31.92 2yug h VAL 54 CO 0.69 0.01 2.67 -0.67 0.02 0.00 0.00 177.57 180.29 2yug n ASP 55 N -5.08 3.43 -3.87 0.57 -0.08 -1.26 -4.83 116.55 105.44 2yug n ASP 55 Ca -0.06 -2.70 -0.11 0.00 -1.51 0.00 0.00 54.79 50.41 2yug n ASP 55 Cb 0.03 -1.31 -0.11 0.00 2.34 0.00 0.00 41.12 42.07 2yug n ASP 55 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2yug s GLU 56 N 4.15 0.33 0.45 -0.67 0.41 -1.23 -4.80 118.70 117.34 2yug s GLU 56 Ca 0.53 -0.21 -0.16 0.00 -0.41 0.00 0.00 54.97 54.72 2yug s GLU 56 Cb 0.14 0.14 -0.08 0.00 -1.78 0.00 0.00 34.13 32.55 2yug s GLU 56 CO 0.03 -0.07 0.90 0.20 -0.49 0.00 0.00 175.26 175.83 2yug s GLY 57 N -0.83 2.14 0.67 -1.39 0.00 -1.26 -5.00 107.32 101.65 2yug s GLY 57 Ca -0.09 0.14 -0.15 0.00 0.00 0.00 0.00 44.72 44.61 2yug s GLY 57 CO 0.01 0.39 1.12 2.56 0.00 0.00 0.00 173.10 177.18 2yug s PRO 58 N -3.70 2.69 0.83 2.90 0.04 -1.26 -5.01 135.00 131.49 2yug s PRO 58 Ca 0.57 1.44 -0.11 0.00 0.04 0.00 0.00 61.00 62.95 2yug s PRO 58 Cb -0.10 -1.93 0.09 0.00 0.04 0.00 0.00 34.50 32.60 2yug s PRO 58 CO 0.26 -1.34 1.12 0.45 0.04 0.00 0.00 177.00 177.52 2yug s SER 59 N -2.52 3.83 0.20 6.66 0.15 -1.26 -4.68 113.70 116.08 2yug s SER 59 Ca 0.68 2.00 -0.14 0.00 0.70 0.00 0.00 55.95 59.19 2yug s SER 59 Cb -0.22 -2.54 0.21 0.00 -1.71 0.00 0.00 66.02 61.76 2yug s SER 59 CO 0.42 -2.49 1.65 -0.65 1.20 0.00 0.00 173.24 173.37 2yug h PRO 60 N -1.39 0.03 0.00 5.44 0.11 -1.95 0.10 132.00 134.35 2yug h PRO 60 Ca -0.44 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 2yug h PRO 60 Cb 1.25 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2yug h PRO 60 CO 0.47 0.02 -0.08 -1.00 -0.21 0.00 0.00 178.00 177.20 2yug h PRO 61 N 0.03 0.00 0.02 1.05 0.13 -1.94 -2.48 132.00 128.81 2yug h PRO 61 Ca 0.28 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 65.16 2yug h PRO 61 Cb 0.43 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.53 2yug h PRO 61 CO -0.55 0.08 -1.30 0.93 -0.23 0.00 0.00 178.00 176.93 2yug h GLU 62 N 0.00 0.05 -6.23 0.86 5.08 -1.11 -3.32 114.58 109.91 2yug h GLU 62 Ca -0.00 -0.08 -0.56 0.00 -1.00 0.00 0.00 59.36 57.71 2yug h GLU 62 Cb 0.34 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2yug h GLU 62 CO 0.01 0.88 1.25 -0.65 -1.00 0.00 0.00 179.01 179.49 2yug s GLN 63 N -2.66 3.68 0.47 2.33 -0.21 -0.08 -4.65 119.66 118.54 2yug s GLN 63 Ca -0.02 1.94 0.08 0.00 0.02 0.00 0.00 55.36 57.38 2yug s GLN 63 Cb 0.09 -4.15 0.03 0.00 1.00 0.00 0.00 33.01 29.98 2yug s GLN 63 CO 0.83 -1.45 0.61 -0.06 -2.12 0.00 0.00 175.29 173.10 2yug s PHE 64 N 5.89 2.30 -0.03 0.91 0.08 -0.27 -2.81 117.98 124.05 2yug s PHE 64 Ca 0.83 -0.53 0.04 0.00 0.12 0.00 0.00 56.93 57.38 2yug s PHE 64 Cb -0.31 -2.28 -0.01 0.00 -0.57 0.00 0.00 43.02 39.86 2yug s PHE 64 CO 0.33 -0.61 -0.15 0.99 -0.10 0.00 0.00 175.22 175.68 2yug s THR 65 N -2.48 1.25 -0.01 0.64 2.01 0.17 0.48 115.64 117.69 2yug s THR 65 Ca 0.55 -0.64 -0.00 0.00 0.31 0.00 0.00 61.69 61.91 2yug s THR 65 Cb -0.07 -1.07 -0.04 0.00 0.01 0.00 0.00 72.50 71.33 2yug s THR 65 CO 0.34 0.36 0.06 0.00 -0.69 0.00 0.00 174.62 174.69 2yug s ALA 66 N -0.07 3.52 -0.18 7.40 0.00 0.09 -0.55 121.76 131.96 2yug s ALA 66 Ca -0.00 -0.88 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 2yug s ALA 66 Cb -0.09 -1.53 0.07 0.00 0.00 0.00 0.00 23.12 21.56 2yug s ALA 66 CO 0.01 0.68 0.14 0.08 0.00 0.00 0.00 175.76 176.66 2yug s VAL 67 N -1.16 -0.17 -0.36 0.00 1.01 -1.03 -3.18 120.40 115.51 2yug s VAL 67 Ca 0.22 -0.13 -0.28 0.00 0.00 0.00 0.00 61.98 61.78 2yug s VAL 67 Cb -0.12 -0.60 -0.01 0.00 0.00 0.00 0.00 36.38 35.65 2yug s VAL 67 CO 0.12 -0.24 1.72 -0.54 0.00 0.00 0.00 175.10 176.17 2yug s LYS 68 N 2.21 3.35 -0.00 2.72 1.02 -1.26 -0.35 119.74 127.42 2yug s LYS 68 Ca 0.04 1.29 -0.00 0.00 0.02 0.00 0.00 55.97 57.31 2yug s LYS 68 Cb -0.16 -4.17 -0.00 0.00 -0.52 0.00 0.00 37.83 32.98 2yug s LYS 68 CO -0.10 -1.84 -0.00 1.28 -0.92 0.00 0.00 175.35 173.77 2yug n LEU 69 N 10.10 0.03 0.00 3.17 4.77 -0.08 -5.00 117.00 130.00 2yug n LEU 69 Ca 0.21 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 2yug n LEU 69 Cb 0.47 -0.51 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2yug n LEU 69 CO 0.69 -0.50 0.00 -1.20 -1.33 0.00 0.00 177.39 175.05 2yug n SER 70 N -2.32 0.00 -3.29 -1.43 7.64 -1.18 -4.98 113.62 108.06 2yug n SER 70 Ca -0.00 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.64 2yug n SER 70 Cb 0.01 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.25 2yug n SER 70 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2yug n ASP 71 N 0.00 -5.84 -2.63 6.43 8.00 -1.26 -1.26 116.55 119.99 2yug n ASP 71 Ca 0.00 -0.41 -0.21 0.00 0.71 0.00 0.00 54.79 54.88 2yug n ASP 71 Cb 0.00 -4.69 0.01 0.00 -0.02 0.00 0.00 41.12 36.43 2yug n ASP 71 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 2yug n SER 72 N -2.66 -5.90 -4.35 -2.24 2.88 -1.26 -4.98 113.62 95.10 2yug n SER 72 Ca -0.06 -0.16 -0.33 0.00 -1.33 0.00 0.00 58.87 57.00 2yug n SER 72 Cb 0.59 -4.81 -0.15 0.00 -0.75 0.00 0.00 64.21 59.09 2yug n SER 72 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2yug s ARG 73 N -5.36 3.34 0.35 -1.46 1.81 -0.39 -4.58 118.95 112.67 2yug s ARG 73 Ca 0.16 -0.71 0.08 0.00 -1.72 0.00 0.00 55.73 53.54 2yug s ARG 73 Cb -0.07 -2.59 -0.04 0.00 -0.45 0.00 0.00 34.95 31.81 2yug s ARG 73 CO 0.19 0.21 0.21 0.96 -0.68 0.00 0.00 175.30 176.19 2yug s ILE 74 N 0.34 3.07 -0.28 1.52 -4.36 -1.22 -0.90 121.20 119.36 2yug s ILE 74 Ca -0.12 -1.57 0.03 0.00 -0.26 0.00 0.00 60.65 58.73 2yug s ILE 74 Cb -0.16 -3.04 0.07 0.00 1.25 0.00 0.00 42.46 40.59 2yug s ILE 74 CO 0.06 -0.15 -0.05 0.00 0.24 0.00 0.00 174.94 175.04 2yug s ALA 75 N -2.41 2.57 0.32 2.27 0.00 0.53 -2.33 121.76 122.70 2yug s ALA 75 Ca 0.40 -1.94 -0.28 0.00 0.00 0.00 0.00 51.96 50.13 2yug s ALA 75 Cb -0.03 -1.68 -0.09 0.00 0.00 0.00 0.00 23.12 21.31 2yug s ALA 75 CO 0.24 -1.36 1.10 -0.51 0.00 0.00 0.00 175.76 175.23 2yug s LEU 76 N 1.09 4.43 -0.02 0.00 1.43 -1.25 -2.47 118.68 121.89 2yug s LEU 76 Ca -0.02 2.23 -0.00 0.00 -1.03 0.00 0.00 54.13 55.31 2yug s LEU 76 Cb -0.19 -3.78 0.03 0.00 0.03 0.00 0.00 46.19 42.27 2yug s LEU 76 CO -0.07 -0.27 0.03 -0.75 0.23 0.00 0.00 176.35 175.53 2yug s LYS 77 N -1.75 -0.01 0.72 1.70 2.20 0.29 -1.02 119.74 121.88 2yug s LYS 77 Ca 0.48 0.19 -0.11 0.00 -0.36 0.00 0.00 55.97 56.18 2yug s LYS 77 Cb -0.30 -0.30 0.03 0.00 -1.51 0.00 0.00 37.83 35.75 2yug s LYS 77 CO 0.38 -0.18 1.07 -1.54 -0.36 0.00 0.00 175.35 174.72 2yug s SER 78 N 1.17 5.09 0.50 1.43 1.04 0.19 0.42 113.70 123.54 2yug s SER 78 Ca -0.08 1.60 0.17 0.00 0.48 0.00 0.00 55.95 58.12 2yug s SER 78 Cb -0.13 -2.43 1.23 0.00 0.10 0.00 0.00 66.02 64.79 2yug s SER 78 CO -0.03 -1.63 2.10 1.23 0.98 0.00 0.00 173.24 175.89 2yug h GLY 79 N -0.85 0.00 1.96 7.32 0.00 -1.70 -1.76 103.07 108.04 2yug h GLY 79 Ca -0.44 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.86 2yug h GLY 79 CO 0.56 0.00 -0.09 -0.97 0.00 0.00 0.00 176.54 176.05 2yug h TYR 80 N 0.00 0.05 0.00 5.60 0.05 -1.88 -3.46 116.97 117.34 2yug h TYR 80 Ca -0.00 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2yug h TYR 80 Cb 0.14 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 37.86 2yug h TYR 80 CO 0.00 0.14 0.00 0.41 -1.05 0.00 0.00 178.16 177.66 2yug n GLY 81 N -1.21 1.88 3.26 3.88 0.00 -0.66 -5.14 105.19 107.20 2yug n GLY 81 Ca -0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 2yug n GLY 81 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yug s LYS 82 N -0.22 1.12 -0.03 1.61 1.02 -1.24 -4.88 119.74 117.12 2yug s LYS 82 Ca 0.00 -1.09 -0.20 0.00 0.02 0.00 0.00 55.97 54.70 2yug s LYS 82 Cb 0.00 -1.33 -0.05 0.00 -0.52 0.00 0.00 37.83 35.93 2yug s LYS 82 CO 0.00 0.31 0.59 0.71 -0.92 0.00 0.00 175.35 176.04 2yug s TYR 83 N -1.11 3.65 0.49 3.18 1.51 -1.26 0.53 117.35 124.34 2yug s TYR 83 Ca 0.05 1.17 -0.22 0.00 -1.01 0.00 0.00 57.07 57.07 2yug s TYR 83 Cb -0.10 -2.62 -0.07 0.00 -0.11 0.00 0.00 41.96 39.06 2yug s TYR 83 CO 0.04 0.30 1.15 -0.51 -1.11 0.00 0.00 175.55 175.42 2yug s LEU 84 N 0.01 3.91 0.06 -1.29 1.43 -0.19 -3.94 118.68 118.67 2yug s LEU 84 Ca 0.31 2.25 -0.27 0.00 -1.03 0.00 0.00 54.13 55.39 2yug s LEU 84 Cb -0.18 -4.38 0.09 0.00 0.03 0.00 0.00 46.19 41.75 2yug s LEU 84 CO 0.16 -1.03 0.77 -0.83 0.23 0.00 0.00 176.35 175.65 2yug s GLY 85 N -1.53 -0.53 -0.01 -3.19 0.00 0.16 -4.40 107.32 97.81 2yug s GLY 85 Ca 0.67 0.83 0.00 0.00 0.00 0.00 0.00 44.72 46.22 2yug s GLY 85 CO 0.31 0.29 0.04 -0.26 0.00 0.00 0.00 173.10 173.49 2yug s ILE 86 N -3.29 4.47 0.96 0.90 -4.36 -1.25 0.10 121.20 118.73 2yug s ILE 86 Ca 0.03 -0.46 -0.15 0.00 -0.26 0.00 0.00 60.65 59.81 2yug s ILE 86 Cb -0.01 -3.00 0.20 0.00 1.25 0.00 0.00 42.46 40.90 2yug s ILE 86 CO -0.10 0.39 1.31 0.20 0.24 0.00 0.00 174.94 176.99 2yug s ASN 87 N -1.55 3.10 0.38 4.36 0.01 0.20 -4.82 114.94 116.62 2yug s ASN 87 Ca 0.20 0.18 0.11 0.00 -0.71 0.00 0.00 52.86 52.64 2yug s ASN 87 Cb -0.12 -0.21 0.75 0.00 0.41 0.00 0.00 41.25 42.09 2yug s ASN 87 CO 0.11 -2.74 1.87 0.28 -1.51 0.00 0.00 177.10 175.11 2yug h SER 88 N -1.61 0.10 0.16 -1.22 0.02 -2.00 -2.90 113.55 106.10 2yug h SER 88 Ca -0.44 -0.03 -0.29 0.00 -0.84 0.00 0.00 61.79 60.20 2yug h SER 88 Cb 1.23 -0.03 0.02 0.00 0.14 0.00 0.00 62.40 63.77 2yug h SER 88 CO 0.36 0.38 -1.19 -0.78 -1.14 0.00 0.00 176.83 174.46 2yug h ASP 89 N 0.10 0.82 0.00 3.07 3.58 -2.05 -3.48 116.42 118.46 2yug h ASP 89 Ca 0.01 -0.74 0.00 0.00 0.42 0.00 0.00 57.03 56.72 2yug h ASP 89 Cb 0.53 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2yug h ASP 89 CO 0.04 1.55 0.00 0.61 -2.88 0.00 0.00 179.24 178.56 2yug n GLY 90 N 1.30 0.99 3.70 -0.78 0.00 -1.10 -5.04 105.19 104.26 2yug n GLY 90 Ca -0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.49 2yug n GLY 90 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2yug n LEU 91 N 0.00 4.26 -4.49 0.99 0.00 -1.26 -3.24 117.00 113.25 2yug n LEU 91 Ca 0.00 1.06 -0.42 0.00 0.00 0.00 0.00 56.01 56.65 2yug n LEU 91 Cb 0.00 -1.50 -0.10 0.00 0.00 0.00 0.00 43.42 41.82 2yug n LEU 91 CO 0.00 -0.74 0.00 -0.69 0.00 0.00 0.00 177.39 175.96 2yug s VAL 92 N -1.24 5.19 0.49 1.96 1.01 0.37 0.62 120.40 128.79 2yug s VAL 92 Ca 0.64 -0.40 0.02 0.00 0.00 0.00 0.00 61.98 62.25 2yug s VAL 92 Cb -0.48 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 31.94 2yug s VAL 92 CO 0.56 -0.28 0.01 0.68 0.00 0.00 0.00 175.10 176.06 2yug s VAL 93 N 1.89 1.29 -0.39 2.92 -7.23 0.29 -4.43 120.40 114.74 2yug s VAL 93 Ca 0.09 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.29 2yug s VAL 93 Cb -0.18 -2.32 0.16 0.00 0.56 0.00 0.00 36.38 34.60 2yug s VAL 93 CO 0.12 0.00 0.36 -0.83 -0.31 0.00 0.00 175.10 174.44 2yug s GLY 94 N -3.84 0.34 -0.42 2.32 0.00 -1.26 0.35 107.32 104.81 2yug s GLY 94 Ca 0.12 -1.47 0.08 0.00 0.00 0.00 0.00 44.72 43.45 2yug s GLY 94 CO 0.06 2.54 1.23 -0.96 0.00 0.00 0.00 173.10 175.97 2yug n ARG 95 N 3.76 1.12 -0.02 2.90 -4.01 -1.25 -4.79 116.66 114.36 2yug n ARG 95 Ca 0.16 -1.94 -0.03 0.00 -1.04 0.00 0.00 57.85 55.01 2yug n ARG 95 Cb 0.45 -0.53 -0.02 0.00 -3.04 0.00 0.00 32.46 29.32 2yug n ARG 95 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 2yug n SER 96 N -0.15 3.70 -2.42 2.89 2.88 -1.26 -5.02 113.62 114.23 2yug n SER 96 Ca 0.02 -0.02 -0.20 0.00 -1.33 0.00 0.00 58.87 57.34 2yug n SER 96 Cb 0.78 -0.06 0.01 0.00 -0.75 0.00 0.00 64.21 64.19 2yug n SER 96 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2yug n ASP 97 N -2.61 -5.67 -3.72 -3.46 8.00 -1.26 -4.95 116.55 102.88 2yug n ASP 97 Ca -0.07 -0.10 -0.04 0.00 0.71 0.00 0.00 54.79 55.29 2yug n ASP 97 Cb 0.57 -4.63 -0.01 0.00 -0.02 0.00 0.00 41.12 37.03 2yug n ASP 97 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2yug s ALA 98 N -3.03 -1.71 -0.06 2.24 0.00 -1.26 -4.98 121.76 112.97 2yug s ALA 98 Ca 0.10 0.25 -0.20 0.00 0.00 0.00 0.00 51.96 52.10 2yug s ALA 98 Cb -0.04 0.60 -0.04 0.00 0.00 0.00 0.00 23.12 23.63 2yug s ALA 98 CO 0.12 -1.01 0.58 0.42 0.00 0.00 0.00 175.76 175.87 2yug s ILE 99 N -3.21 5.05 0.16 0.00 1.01 -1.26 -4.86 121.20 118.09 2yug s ILE 99 Ca 0.12 1.20 -0.08 0.00 0.00 0.00 0.00 60.65 61.88 2yug s ILE 99 Cb -0.01 -3.92 -0.01 0.00 0.01 0.00 0.00 42.46 38.53 2yug s ILE 99 CO 0.01 0.34 0.26 -0.83 0.00 0.00 0.00 174.94 174.71 2yug s GLY 100 N 0.35 0.51 0.22 6.18 0.00 -1.26 -5.02 107.32 108.30 2yug s GLY 100 Ca 0.31 -0.93 -0.08 0.00 0.00 0.00 0.00 44.72 44.02 2yug s GLY 100 CO 0.15 -0.89 1.73 -2.55 0.00 0.00 0.00 173.10 171.55 2yug h PRO 101 N 2.59 0.39 -0.14 2.90 0.11 -1.97 -0.02 132.00 135.85 2yug h PRO 101 Ca -0.32 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.57 2yug h PRO 101 Cb 1.22 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.26 2yug h PRO 101 CO 0.50 0.25 -0.67 0.00 -0.21 0.00 0.00 178.00 177.87 2yug h ARG 102 N 0.40 0.70 -0.02 1.05 3.08 -1.94 -3.13 114.38 114.53 2yug h ARG 102 Ca 0.34 -0.57 0.00 0.00 0.07 0.00 0.00 59.98 59.83 2yug h ARG 102 Cb 0.46 0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 2yug h ARG 102 CO -0.35 1.18 0.01 0.93 -1.07 0.00 0.00 179.97 180.67 2yug h GLU 103 N 0.39 0.00 -7.23 0.04 3.07 -1.61 -3.34 114.58 105.90 2yug h GLU 103 Ca -0.04 0.00 -0.47 0.00 -0.50 0.00 0.00 59.36 58.34 2yug h GLU 103 Cb 1.30 0.00 0.19 0.00 -0.84 0.00 0.00 28.75 29.40 2yug h GLU 103 CO 0.14 0.00 0.13 -0.65 -1.40 0.00 0.00 179.01 177.23 2yug s GLN 104 N -5.04 0.18 0.35 2.33 -0.21 -0.08 -4.54 119.66 112.66 2yug s GLN 104 Ca -0.05 1.05 0.03 0.00 0.02 0.00 0.00 55.36 56.41 2yug s GLN 104 Cb 0.17 -1.67 -0.01 0.00 1.00 0.00 0.00 33.01 32.50 2yug s GLN 104 CO 0.66 -3.04 0.38 -1.58 -2.12 0.00 0.00 175.29 169.59 2yug s TRP 105 N -2.64 1.48 -0.36 0.91 0.52 -0.98 -3.76 118.94 114.11 2yug s TRP 105 Ca 0.67 -1.52 0.06 0.00 0.02 0.00 0.00 56.10 55.33 2yug s TRP 105 Cb -0.23 -0.43 0.19 0.00 -1.15 0.00 0.00 33.47 31.86 2yug s TRP 105 CO 0.61 -1.02 0.64 -2.00 0.02 0.00 0.00 176.95 175.20 2yug s GLU 106 N -3.18 0.68 0.34 4.98 2.12 0.10 -3.40 118.70 120.33 2yug s GLU 106 Ca 0.36 0.06 -0.28 0.00 0.36 0.00 0.00 54.97 55.48 2yug s GLU 106 Cb 0.01 0.15 -0.09 0.00 0.26 0.00 0.00 34.13 34.46 2yug s GLU 106 CO 0.25 -1.08 1.21 -1.25 -0.54 0.00 0.00 175.26 173.85 2yug s PRO 107 N 2.25 4.32 -0.11 4.30 0.04 -1.26 -1.71 135.00 142.83 2yug s PRO 107 Ca 0.14 1.98 0.03 0.00 0.04 0.00 0.00 61.00 63.19 2yug s PRO 107 Cb -0.06 -2.97 0.01 0.00 0.04 0.00 0.00 34.50 31.52 2yug s PRO 107 CO -0.15 -0.13 -0.19 0.08 0.04 0.00 0.00 177.00 176.65 2yug s VAL 108 N -1.24 1.75 -0.15 -0.36 1.01 -0.70 -4.90 120.40 115.81 2yug s VAL 108 Ca 0.51 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.68 2yug s VAL 108 Cb -0.35 -1.55 -0.00 0.00 0.00 0.00 0.00 36.38 34.48 2yug s VAL 108 CO 0.45 0.49 -0.15 -0.36 0.00 0.00 0.00 175.10 175.53 2yug s PHE 109 N 0.70 2.78 -0.15 5.22 0.40 -1.26 -1.09 117.98 124.58 2yug s PHE 109 Ca -0.12 -0.99 -0.09 0.00 -0.60 0.00 0.00 56.93 55.13 2yug s PHE 109 Cb -0.16 -1.88 0.05 0.00 0.51 0.00 0.00 43.02 41.54 2yug s PHE 109 CO 0.02 -0.44 0.36 -1.14 0.70 0.00 0.00 175.22 174.72 2yug s GLN 110 N 0.76 0.35 -1.19 0.44 2.00 -1.06 -4.89 119.66 116.07 2yug s GLN 110 Ca -0.06 0.68 -0.04 0.00 -2.00 0.00 0.00 55.36 53.94 2yug s GLN 110 Cb -0.15 -0.02 0.00 0.00 0.80 0.00 0.00 33.01 33.64 2yug s GLN 110 CO 0.01 -0.14 1.02 -0.25 -0.50 0.00 0.00 175.29 175.42 2yug n ASP 111 N 4.06 -3.95 -1.92 6.67 9.92 -1.26 -2.09 116.55 127.97 2yug n ASP 111 Ca -0.22 -0.54 -0.18 0.00 -0.53 0.00 0.00 54.79 53.31 2yug n ASP 111 Cb 0.55 -4.78 -0.02 0.00 -0.64 0.00 0.00 41.12 36.23 2yug n ASP 111 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2yug n GLY 112 N -1.50 0.03 3.64 0.44 0.00 -1.26 -4.98 105.19 101.56 2yug n GLY 112 Ca -0.14 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 2yug n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yug n LYS 113 N -2.68 0.65 -3.65 1.61 4.76 -0.89 -5.17 118.16 112.79 2yug n LYS 113 Ca -0.21 -3.73 -0.12 0.00 -2.87 0.00 0.00 58.31 51.38 2yug n LYS 113 Cb 0.65 1.47 -0.06 0.00 -1.84 0.00 0.00 35.03 35.25 2yug n LYS 113 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2yug s MET 114 N -3.77 0.97 -0.30 1.97 0.23 -1.26 -2.56 119.30 114.59 2yug s MET 114 Ca 0.10 -0.45 -0.09 0.00 -1.03 0.00 0.00 55.69 54.22 2yug s MET 114 Cb 0.01 0.43 0.18 0.00 -1.53 0.00 0.00 34.83 33.91 2yug s MET 114 CO 0.07 -0.35 0.86 0.00 -2.03 0.00 0.00 175.02 173.58 2yug s ALA 115 N -2.86 -2.85 0.14 3.16 0.00 -0.25 -2.55 121.76 116.56 2yug s ALA 115 Ca -0.03 1.72 -0.31 0.00 0.00 0.00 0.00 51.96 53.34 2yug s ALA 115 Cb -0.00 -2.28 -0.10 0.00 0.00 0.00 0.00 23.12 20.74 2yug s ALA 115 CO -0.05 -1.31 1.62 -1.17 0.00 0.00 0.00 175.76 174.85 2yug s LEU 116 N 2.84 4.37 -0.19 0.00 2.96 -1.26 -1.72 118.68 125.68 2yug s LEU 116 Ca 0.06 2.62 -0.04 0.00 -0.22 0.00 0.00 54.13 56.55 2yug s LEU 116 Cb -0.11 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.97 2yug s LEU 116 CO -0.16 -0.86 -0.04 -0.22 -1.32 0.00 0.00 176.35 173.74 2yug s LEU 117 N 1.61 3.04 1.00 -0.68 2.96 -0.70 -3.21 118.68 122.70 2yug s LEU 117 Ca 0.72 -0.27 -0.12 0.00 -0.22 0.00 0.00 54.13 54.24 2yug s LEU 117 Cb -0.43 -1.75 0.19 0.00 0.50 0.00 0.00 46.19 44.69 2yug s LEU 117 CO 0.32 0.07 1.09 0.00 -1.32 0.00 0.00 176.35 176.51 2yug s ALA 118 N 0.92 0.91 -0.73 5.97 0.00 -0.55 -0.73 121.76 127.55 2yug s ALA 118 Ca -0.00 -0.27 0.18 0.00 0.00 0.00 0.00 51.96 51.86 2yug s ALA 118 Cb -0.15 -3.15 0.76 0.00 0.00 0.00 0.00 23.12 20.59 2yug s ALA 118 CO 0.01 -2.86 1.54 0.45 0.00 0.00 0.00 175.76 174.90 2yug n SER 119 N -4.21 0.32 -1.70 0.00 2.88 -1.25 -2.26 113.62 107.40 2yug n SER 119 Ca 0.05 0.59 -0.04 0.00 -1.33 0.00 0.00 58.87 58.14 2yug n SER 119 Cb 0.56 -0.65 0.24 0.00 -0.75 0.00 0.00 64.21 63.61 2yug n SER 119 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2yug n ASN 120 N -1.86 4.17 -2.55 -3.46 5.15 -1.26 -4.88 115.26 110.57 2yug n ASN 120 Ca 0.02 -2.90 -0.17 0.00 -0.60 0.00 0.00 54.58 50.93 2yug n ASN 120 Cb 0.17 -0.69 -0.00 0.00 -0.53 0.00 0.00 39.78 38.73 2yug n ASN 120 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2yug n SER 121 N -0.01 -4.91 -3.89 1.20 7.64 -0.96 -4.96 113.62 107.73 2yug n SER 121 Ca 0.30 0.02 -0.22 0.00 1.01 0.00 0.00 58.87 59.99 2yug n SER 121 Cb 1.13 -4.10 -0.17 0.00 -1.01 0.00 0.00 64.21 60.07 2yug n SER 121 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2yug s PHE 123 N 1.18 -0.30 0.19 0.00 0.08 -1.07 -1.48 117.98 116.58 2yug s PHE 123 Ca -0.06 0.71 0.05 0.00 0.12 0.00 0.00 56.93 57.74 2yug s PHE 123 Cb -0.14 -2.89 -0.04 0.00 -0.57 0.00 0.00 43.02 39.38 2yug s PHE 123 CO -0.01 -4.87 0.24 0.96 -0.10 0.00 0.00 175.22 171.43 2yug s ILE 124 N -2.25 4.89 0.01 0.64 -4.36 -1.20 -0.68 121.20 118.26 2yug s ILE 124 Ca 0.68 -1.00 -0.28 0.00 -0.26 0.00 0.00 60.65 59.80 2yug s ILE 124 Cb -0.16 -3.56 0.09 0.00 1.25 0.00 0.00 42.46 40.08 2yug s ILE 124 CO 0.60 -0.19 0.75 -0.60 0.24 0.00 0.00 174.94 175.74 2yug s ARG 125 N -3.44 1.00 -0.18 0.37 3.52 -0.39 -4.69 118.95 115.16 2yug s ARG 125 Ca 0.33 -0.14 -0.04 0.00 -0.13 0.00 0.00 55.73 55.75 2yug s ARG 125 Cb -0.10 0.47 -0.02 0.00 -1.56 0.00 0.00 34.95 33.74 2yug s ARG 125 CO 0.26 -0.39 -0.04 0.00 -0.81 0.00 0.00 175.30 174.32 2yug s ASN 127 N 0.75 4.49 0.15 0.00 0.01 -0.73 -4.97 114.94 114.66 2yug s ASN 127 Ca -0.02 1.27 0.05 0.00 -0.71 0.00 0.00 52.86 53.45 2yug s ASN 127 Cb -0.15 -1.99 -0.06 0.00 0.41 0.00 0.00 41.25 39.46 2yug s ASN 127 CO 0.02 -1.96 1.35 -0.33 -1.51 0.00 0.00 177.10 174.67 2yug h GLU 128 N -1.08 0.09 -0.14 -0.60 4.39 -2.00 -3.28 114.58 111.96 2yug h GLU 128 Ca -0.47 -0.12 -0.22 0.00 0.34 0.00 0.00 59.36 58.89 2yug h GLU 128 Cb 1.27 0.04 0.01 0.00 -0.10 0.00 0.00 28.75 29.97 2yug h GLU 128 CO 0.60 0.95 -0.77 0.00 -1.16 0.00 0.00 179.01 178.62 2yug h ALA 129 N 1.01 0.36 0.00 3.43 0.00 -2.04 -3.48 119.26 118.54 2yug h ALA 129 Ca -0.03 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2yug h ALA 129 Cb 1.59 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.36 2yug h ALA 129 CO 0.13 0.70 0.00 0.41 0.00 0.00 0.00 179.25 180.49 2yug n GLY 130 N 0.67 0.26 3.05 0.00 0.00 -1.24 -5.05 105.19 102.89 2yug n GLY 130 Ca -0.07 -0.26 -0.12 0.00 0.00 0.00 0.00 46.02 45.57 2yug n GLY 130 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yug s ASP 131 N 0.00 0.24 -0.62 1.61 1.01 -1.26 -4.49 116.67 113.16 2yug s ASP 131 Ca 0.00 0.57 -0.27 0.00 0.71 0.00 0.00 52.55 53.56 2yug s ASP 131 Cb 0.00 0.95 0.03 0.00 1.01 0.00 0.00 42.92 44.91 2yug s ASP 131 CO 0.00 -0.26 1.17 -0.63 0.21 0.00 0.00 175.17 175.67 2yug s ILE 132 N 2.49 4.00 0.48 0.77 -1.09 -1.11 -1.77 121.20 124.97 2yug s ILE 132 Ca 0.03 0.64 0.05 0.00 -2.23 0.00 0.00 60.65 59.13 2yug s ILE 132 Cb -0.13 -4.76 -0.01 0.00 -1.58 0.00 0.00 42.46 35.98 2yug s ILE 132 CO -0.11 -1.46 0.19 -1.83 -1.23 0.00 0.00 174.94 170.49 2yug s GLU 133 N 5.00 2.21 -0.09 2.79 -1.05 -0.71 -0.48 118.70 126.37 2yug s GLU 133 Ca 0.38 -2.08 -0.11 0.00 -0.15 0.00 0.00 54.97 53.01 2yug s GLU 133 Cb -0.09 -1.87 -0.05 0.00 -0.44 0.00 0.00 34.13 31.69 2yug s GLU 133 CO 0.21 -0.34 0.27 0.00 0.95 0.00 0.00 175.26 176.35 2yug s ALA 134 N -2.74 3.74 0.38 -0.84 0.00 -1.20 -1.26 121.76 119.83 2yug s ALA 134 Ca 0.28 -0.46 0.04 0.00 0.00 0.00 0.00 51.96 51.82 2yug s ALA 134 Cb 0.02 -2.22 -0.01 0.00 0.00 0.00 0.00 23.12 20.90 2yug s ALA 134 CO 0.16 0.42 0.55 0.21 0.00 0.00 0.00 175.76 177.10 2yug s LYS 135 N -0.60 3.14 1.19 0.00 2.47 0.15 -4.91 119.74 121.18 2yug s LYS 135 Ca 0.18 -0.74 -0.17 0.00 -1.56 0.00 0.00 55.97 53.68 2yug s LYS 135 Cb -0.14 -2.71 0.22 0.00 -1.46 0.00 0.00 37.83 33.75 2yug s LYS 135 CO 0.07 -0.04 0.50 0.09 0.16 0.00 0.00 175.35 176.12 2yug n ASN 136 N -1.81 -2.59 -0.10 1.43 4.13 -1.26 -2.61 115.26 112.45 2yug n ASN 136 Ca -0.00 -0.31 -0.08 0.00 1.68 0.00 0.00 54.58 55.87 2yug n ASN 136 Cb 0.58 -1.03 -0.00 0.00 -1.54 0.00 0.00 39.78 37.78 2yug n ASN 136 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 2yug h LYS 137 N -2.63 0.39 -5.63 3.52 1.79 -1.98 -3.37 116.57 108.67 2yug h LYS 137 Ca -0.52 -0.02 -0.46 0.00 -2.18 0.00 0.00 60.65 57.47 2yug h LYS 137 Cb 1.28 -0.09 0.01 0.00 -1.58 0.00 0.00 32.23 31.85 2yug h LYS 137 CO 0.37 0.26 1.62 0.95 -1.08 0.00 0.00 179.45 181.57 2yug s THR 138 N -6.16 3.02 -0.26 -0.16 -4.23 -1.26 -4.84 115.64 101.74 2yug s THR 138 Ca -0.13 0.01 -0.23 0.00 -1.18 0.00 0.00 61.69 60.16 2yug s THR 138 Cb 0.10 -3.05 -0.01 0.00 1.34 0.00 0.00 72.50 70.89 2yug s THR 138 CO 0.71 -0.05 0.78 0.00 -0.54 0.00 0.00 174.62 175.52 2yug s ALA 139 N 12.14 3.61 1.13 3.99 0.00 -1.26 -5.05 121.76 136.31 2yug s ALA 139 Ca 0.96 -0.27 -0.18 0.00 0.00 0.00 0.00 51.96 52.47 2yug s ALA 139 Cb -0.17 -3.25 0.26 0.00 0.00 0.00 0.00 23.12 19.96 2yug s ALA 139 CO 0.26 -0.99 1.15 0.20 0.00 0.00 0.00 175.76 176.37 2yug s GLY 140 N 1.45 1.61 0.30 0.00 0.00 -1.26 -4.89 107.32 104.54 2yug s GLY 140 Ca 0.33 -0.92 0.01 0.00 0.00 0.00 0.00 44.72 44.13 2yug s GLY 140 CO 0.09 -0.10 1.83 0.83 0.00 0.00 0.00 173.10 175.76 2yug h GLU 141 N -2.31 0.68 0.00 2.90 5.08 -1.99 -2.67 114.58 116.27 2yug h GLU 141 Ca -0.46 -0.15 -0.17 0.00 -1.00 0.00 0.00 59.36 57.58 2yug h GLU 141 Cb 1.29 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 2yug h GLU 141 CO 0.38 0.67 -0.98 0.93 -1.00 0.00 0.00 179.01 179.01 2yug h GLU 142 N 0.64 0.00 -0.34 2.33 4.39 -2.01 -3.29 114.58 116.31 2yug h GLU 142 Ca 0.14 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.93 2yug h GLU 142 Cb 0.35 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 2yug h GLU 142 CO 0.01 0.58 0.28 1.49 -1.16 0.00 0.00 179.01 180.22 2yug h GLU 143 N 0.00 0.00 -7.06 2.33 4.57 -1.82 -3.43 114.58 109.18 2yug h GLU 143 Ca -0.07 0.00 -0.55 0.00 -1.18 0.00 0.00 59.36 57.56 2yug h GLU 143 Cb 1.60 0.00 0.18 0.00 -0.16 0.00 0.00 28.75 30.37 2yug h GLU 143 CO 0.08 0.00 0.21 -1.33 -1.18 0.00 0.00 179.01 176.79 2yug n MET 144 N -4.13 0.40 -4.38 1.92 2.81 -1.22 -4.91 117.12 107.61 2yug n MET 144 Ca 0.05 0.20 -0.21 0.00 -1.81 0.00 0.00 57.70 55.93 2yug n MET 144 Cb 0.45 -2.32 -0.08 0.00 -0.71 0.00 0.00 33.22 30.55 2yug n MET 144 CO 0.00 0.00 0.00 0.96 1.51 0.00 0.00 175.97 178.44 2yug s ILE 145 N -1.93 0.30 -0.16 2.02 -4.36 -1.06 -4.94 121.20 111.08 2yug s ILE 145 Ca 0.74 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 59.11 2yug s ILE 145 Cb -0.32 -2.44 0.04 0.00 1.25 0.00 0.00 42.46 40.99 2yug s ILE 145 CO 0.50 0.00 -0.02 -0.54 0.24 0.00 0.00 174.94 175.13 2yug s LYS 146 N -3.65 1.05 -0.36 0.37 1.02 -1.08 -4.28 119.74 112.81 2yug s LYS 146 Ca 0.33 -0.38 -0.16 0.00 0.02 0.00 0.00 55.97 55.78 2yug s LYS 146 Cb 0.03 -1.85 -0.00 0.00 -0.52 0.00 0.00 37.83 35.49 2yug s LYS 146 CO 0.20 -0.47 0.39 0.42 -0.92 0.00 0.00 175.35 174.96 2yug s ILE 147 N 1.76 5.14 -0.01 2.17 1.01 -1.26 -1.94 121.20 128.07 2yug s ILE 147 Ca 0.01 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.58 2yug s ILE 147 Cb -0.15 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.39 2yug s ILE 147 CO -0.07 -0.19 0.11 -0.13 0.00 0.00 0.00 174.94 174.65 2yug s ARG 148 N 2.05 3.17 0.18 2.79 0.52 0.16 -3.43 118.95 124.39 2yug s ARG 148 Ca 0.12 -0.43 0.11 0.00 -0.52 0.00 0.00 55.73 55.01 2yug s ARG 148 Cb -0.17 -2.93 -0.04 0.00 0.52 0.00 0.00 34.95 32.33 2yug s ARG 148 CO 0.12 0.66 -0.22 0.45 0.02 0.00 0.00 175.30 176.33 2yug s SER 149 N -1.75 3.56 -0.22 0.23 0.15 -1.07 0.24 113.70 114.83 2yug s SER 149 Ca 0.24 -0.79 0.14 0.00 0.70 0.00 0.00 55.95 56.23 2yug s SER 149 Cb -0.12 -0.33 0.45 0.00 -1.71 0.00 0.00 66.02 64.31 2yug s SER 149 CO 0.15 0.13 1.18 0.00 1.20 0.00 0.00 173.24 175.90 2yug s ALA 151 N -3.05 3.49 -0.08 0.00 0.00 -1.26 -4.91 121.76 115.96 2yug s ALA 151 Ca 0.40 -0.07 -0.29 0.00 0.00 0.00 0.00 51.96 52.00 2yug s ALA 151 Cb 0.38 -2.61 -0.07 0.00 0.00 0.00 0.00 23.12 20.82 2yug s ALA 151 CO -0.03 0.42 2.07 -1.83 0.00 0.00 0.00 175.76 176.39 2yug s GLU 152 N -2.36 3.70 0.13 0.00 -1.05 -1.26 -4.93 118.70 112.93 2yug s GLU 152 Ca 0.44 2.35 -0.30 0.00 -0.15 0.00 0.00 54.97 57.31 2yug s GLU 152 Cb -0.13 -4.25 -0.07 0.00 -0.44 0.00 0.00 34.13 29.23 2yug s GLU 152 CO 0.20 -1.45 1.19 1.03 0.95 0.00 0.00 175.26 177.17 2yug s ARG 153 N 5.28 4.47 -0.23 -4.83 0.52 -1.26 -4.92 118.95 117.98 2yug s ARG 153 Ca 0.93 1.82 0.17 0.00 -0.52 0.00 0.00 55.73 58.14 2yug s ARG 153 Cb -0.38 -3.29 0.41 0.00 0.52 0.00 0.00 34.95 32.21 2yug s ARG 153 CO 0.39 -0.15 1.26 0.39 0.02 0.00 0.00 175.30 177.21 2yug n GLU 154 N 3.13 1.19 0.00 3.54 1.02 -1.26 -5.31 120.64 122.95 2yug n GLU 154 Ca 0.06 -2.24 0.00 0.00 -0.02 0.00 0.00 57.16 54.97 2yug n GLU 154 Cb 0.45 -0.46 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2yug n GLU 154 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56