#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 -0.14 -0.27 1.61 0.01 -1.26 -5.15 113.70 108.51 2yug s SER 2 Ca 0.00 -0.69 -0.11 0.00 1.31 0.00 0.00 55.95 56.46 2yug s SER 2 Cb 0.00 0.66 -0.05 0.00 0.21 0.00 0.00 66.02 66.84 2yug s SER 2 CO 0.00 -1.26 0.18 -0.44 0.41 0.00 0.00 173.24 172.13 2yug s SER 3 N -3.03 6.00 0.46 2.44 0.01 -1.26 -4.83 113.70 113.49 2yug s SER 3 Ca 0.14 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.41 2yug s SER 3 Cb -0.04 -2.11 0.00 0.00 0.21 0.00 0.00 66.02 64.08 2yug s SER 3 CO 0.06 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.31 2yug n GLY 4 N 4.84 -1.60 3.06 3.44 0.00 -1.26 -5.11 105.19 108.56 2yug n GLY 4 Ca -0.14 0.31 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 2yug n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yug s SER 5 N -2.40 -0.86 0.00 1.61 0.01 -1.26 -5.02 113.70 105.78 2yug s SER 5 Ca 0.00 0.19 0.00 0.00 1.31 0.00 0.00 55.95 57.45 2yug s SER 5 Cb 0.00 1.73 0.00 0.00 0.21 0.00 0.00 66.02 67.96 2yug s SER 5 CO 0.00 -0.31 0.00 -0.24 0.41 0.00 0.00 173.24 173.10 2yug n SER 6 N 5.40 0.29 0.00 2.44 2.88 -1.26 -5.14 113.62 118.22 2yug n SER 6 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 2yug n SER 6 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2yug n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yug n GLY 7 N 2.02 -0.47 3.63 0.46 0.00 -1.26 -5.10 105.19 104.46 2yug n GLY 7 Ca 0.00 0.17 -0.06 0.00 0.00 0.00 0.00 46.02 46.13 2yug n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2yug s LEU 8 N 0.00 -0.95 0.37 0.99 0.20 -1.26 -5.15 118.68 112.88 2yug s LEU 8 Ca 0.00 1.50 -0.28 0.00 0.69 0.00 0.00 54.13 56.04 2yug s LEU 8 Cb 0.00 2.33 -0.10 0.00 -0.43 0.00 0.00 46.19 47.98 2yug s LEU 8 CO 0.00 -0.23 1.42 -1.81 -0.29 0.00 0.00 176.35 175.43 2yug s ASP 9 N 1.86 6.44 -0.00 3.68 1.11 -1.26 -4.95 116.67 123.56 2yug s ASP 9 Ca -0.09 2.91 -0.02 0.00 0.18 0.00 0.00 52.55 55.53 2yug s ASP 9 Cb -0.06 -2.66 -0.01 0.00 1.07 0.00 0.00 42.92 41.26 2yug s ASP 9 CO -0.20 -0.79 0.03 -0.51 1.18 0.00 0.00 175.17 174.89 2yug s ILE 10 N -1.14 0.06 -0.37 0.77 1.10 -1.26 -2.67 121.20 117.69 2yug s ILE 10 Ca 0.52 -0.46 0.01 0.00 -0.51 0.00 0.00 60.65 60.21 2yug s ILE 10 Cb -0.44 -0.20 0.14 0.00 0.15 0.00 0.00 42.46 42.11 2yug s ILE 10 CO 0.59 -0.25 0.22 -0.69 -2.11 0.00 0.00 174.94 172.70 2yug s VAL 11 N -0.76 0.36 0.00 4.00 1.01 -1.16 -4.98 120.40 118.87 2yug s VAL 11 Ca -0.08 -1.89 0.00 0.00 0.00 0.00 0.00 61.98 60.00 2yug s VAL 11 Cb -0.05 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 35.06 2yug s VAL 11 CO -0.00 -0.98 0.00 0.61 0.00 0.00 0.00 175.10 174.73 2yug n GLY 12 N 3.91 0.86 1.36 4.51 0.00 -1.26 -2.18 105.19 112.39 2yug n GLY 12 Ca 0.12 0.09 -0.02 0.00 0.00 0.00 0.00 46.02 46.22 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 -3.64 -0.61 -5.35 -1.26 -5.03 119.36 103.51 2yug n ILE 13 Ca 0.00 -0.58 -0.29 0.00 -0.27 0.00 0.00 62.75 61.60 2yug n ILE 13 Cb 0.00 0.77 -0.13 0.00 -1.74 0.00 0.00 39.64 38.54 2yug n ILE 13 CO 0.00 0.00 0.00 0.26 -1.76 0.00 0.00 176.55 175.05 2yug s TRP 14 N -0.14 1.62 0.06 4.28 0.52 -0.93 -4.38 118.94 119.97 2yug s TRP 14 Ca 0.16 -2.16 -0.24 0.00 0.02 0.00 0.00 56.10 53.87 2yug s TRP 14 Cb 0.20 -1.61 -0.06 0.00 -1.15 0.00 0.00 33.47 30.85 2yug s TRP 14 CO -0.08 -0.80 0.74 1.67 0.02 0.00 0.00 176.95 178.50 2yug s TRP 15 N 0.62 3.76 0.28 -1.98 1.48 0.20 -2.96 118.94 120.34 2yug s TRP 15 Ca 0.17 1.46 -0.29 0.00 -1.06 0.00 0.00 56.10 56.38 2yug s TRP 15 Cb -0.24 -2.77 -0.10 0.00 -1.16 0.00 0.00 33.47 29.21 2yug s TRP 15 CO -0.01 0.34 1.17 0.99 -4.06 0.00 0.00 176.95 175.38 2yug s THR 16 N -0.32 3.30 0.98 0.66 2.01 -1.09 -0.11 115.64 121.07 2yug s THR 16 Ca 0.37 1.27 -0.15 0.00 0.31 0.00 0.00 61.69 63.49 2yug s THR 16 Cb -0.21 -3.81 0.18 0.00 0.01 0.00 0.00 72.50 68.68 2yug s THR 16 CO 0.23 0.29 1.19 0.68 -0.69 0.00 0.00 174.62 176.32 2yug s VAL 17 N -0.98 1.92 0.00 3.82 -7.23 -1.15 -4.85 120.40 111.93 2yug s VAL 17 Ca 0.47 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.64 2yug s VAL 17 Cb -0.34 -2.80 0.00 0.00 0.56 0.00 0.00 36.38 33.80 2yug s VAL 17 CO 0.43 0.00 0.00 -1.20 -0.31 0.00 0.00 175.10 174.02 2yug n SER 18 N -3.92 0.92 -3.86 4.85 7.64 -1.26 -5.03 113.62 112.96 2yug n SER 18 Ca 0.11 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.74 2yug n SER 18 Cb 0.60 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.73 2yug n SER 18 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2yug n ASN 19 N -2.49 1.99 -0.11 6.43 6.94 -1.26 -4.99 115.26 121.76 2yug n ASN 19 Ca 0.00 -2.90 -0.13 0.00 -0.02 0.00 0.00 54.58 51.53 2yug n ASN 19 Cb 0.28 0.67 -0.03 0.00 -2.36 0.00 0.00 39.78 38.34 2yug n ASN 19 CO 0.00 0.00 0.00 0.15 -1.03 0.00 0.00 177.26 176.38 2yug h PHE 20 N 1.45 0.94 -0.06 -2.53 3.57 -1.98 -2.95 116.94 115.37 2yug h PHE 20 Ca -0.31 -0.26 0.02 0.00 3.53 0.00 0.00 57.97 60.94 2yug h PHE 20 Cb 1.08 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.61 2yug h PHE 20 CO 0.00 1.03 0.05 0.78 -2.23 0.00 0.00 178.31 177.94 2yug h GLY 21 N 0.57 0.00 1.90 2.40 0.00 -2.03 -1.13 103.07 104.79 2yug h GLY 21 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.21 2yug h GLY 21 CO 0.07 0.00 -0.83 0.83 0.00 0.00 0.00 176.54 176.61 2yug h GLU 22 N 0.00 0.09 -6.34 4.80 4.39 -1.93 -3.42 114.58 112.17 2yug h GLU 22 Ca 0.03 -0.10 -0.55 0.00 0.34 0.00 0.00 59.36 59.07 2yug h GLU 22 Cb 0.12 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.76 2yug h GLU 22 CO -0.00 0.87 1.18 0.42 -1.16 0.00 0.00 179.01 180.32 2yug s ILE 23 N -3.20 3.66 -0.28 3.13 1.01 -0.43 -4.94 121.20 120.16 2yug s ILE 23 Ca -0.01 0.62 -0.23 0.00 0.00 0.00 0.00 60.65 61.02 2yug s ILE 23 Cb 0.11 -4.06 0.10 0.00 0.01 0.00 0.00 42.46 38.62 2yug s ILE 23 CO 0.81 -0.79 0.88 -0.44 0.00 0.00 0.00 174.94 175.40 2yug s SER 24 N 5.34 -0.61 0.00 3.58 0.01 -1.26 -4.94 113.70 115.82 2yug s SER 24 Ca 0.65 1.14 0.00 0.00 1.31 0.00 0.00 55.95 59.05 2yug s SER 24 Cb -0.15 1.17 0.00 0.00 0.21 0.00 0.00 66.02 67.25 2yug s SER 24 CO 0.29 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.36 2yug n GLY 25 N 2.70 -1.50 3.66 3.44 0.00 -1.26 -4.76 105.19 107.48 2yug n GLY 25 Ca -0.14 -1.58 -0.43 0.00 0.00 0.00 0.00 46.02 43.87 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 3.93 0.02 2.61 2.01 -1.26 -1.01 115.64 121.94 2yug s THR 26 Ca 0.00 1.13 0.01 0.00 0.31 0.00 0.00 61.69 63.14 2yug s THR 26 Cb 0.00 -3.73 -0.01 0.00 0.01 0.00 0.00 72.50 68.77 2yug s THR 26 CO 0.00 -0.10 -0.04 0.27 -0.69 0.00 0.00 174.62 174.06 2yug s ILE 27 N 3.71 0.28 0.29 1.82 -4.36 0.95 -3.26 121.20 120.63 2yug s ILE 27 Ca 0.64 -0.64 0.08 0.00 -0.26 0.00 0.00 60.65 60.47 2yug s ILE 27 Cb -0.28 -0.33 -0.03 0.00 1.25 0.00 0.00 42.46 43.07 2yug s ILE 27 CO 0.22 -0.24 0.19 0.00 0.24 0.00 0.00 174.94 175.36 2yug s ALA 28 N -0.87 3.60 -0.02 2.27 0.00 -0.53 -2.59 121.76 123.63 2yug s ALA 28 Ca -0.07 -1.57 0.02 0.00 0.00 0.00 0.00 51.96 50.33 2yug s ALA 28 Cb -0.06 -1.13 0.01 0.00 0.00 0.00 0.00 23.12 21.94 2yug s ALA 28 CO -0.00 0.15 -0.06 0.42 0.00 0.00 0.00 175.76 176.27 2yug s ILE 29 N -2.25 0.52 -0.24 0.00 1.01 -1.26 -1.19 121.20 117.78 2yug s ILE 29 Ca 0.36 -0.21 -0.00 0.00 0.00 0.00 0.00 60.65 60.79 2yug s ILE 29 Cb -0.06 -0.48 0.03 0.00 0.01 0.00 0.00 42.46 41.96 2yug s ILE 29 CO 0.24 0.18 -0.09 -0.70 0.00 0.00 0.00 174.94 174.57 2yug s GLU 30 N 0.28 2.70 -0.16 2.79 2.12 -0.82 -3.98 118.70 121.64 2yug s GLU 30 Ca -0.03 -1.05 -0.26 0.00 0.36 0.00 0.00 54.97 53.98 2yug s GLU 30 Cb -0.08 -2.92 -0.24 0.00 0.26 0.00 0.00 34.13 31.16 2yug s GLU 30 CO -0.00 -0.42 0.61 0.52 -0.54 0.00 0.00 175.26 175.43 2yug h MET 31 N 7.95 0.00 0.00 4.30 2.86 -1.88 -2.86 114.93 125.30 2yug h MET 31 Ca -0.31 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 56.79 2yug h MET 31 Cb 1.10 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 2yug h MET 31 CO 0.56 0.97 -0.17 -3.47 1.06 0.00 0.00 176.91 175.86 2yug n ASP 32 N -4.57 2.48 -4.58 1.22 -0.08 -1.21 -4.90 116.55 104.91 2yug n ASP 32 Ca -0.15 -2.76 -0.32 0.00 -1.51 0.00 0.00 54.79 50.05 2yug n ASP 32 Cb 0.52 -0.25 -0.04 0.00 2.34 0.00 0.00 41.12 43.69 2yug n ASP 32 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 2yug s LYS 33 N -4.52 2.91 0.00 -0.67 3.01 -1.26 -3.30 119.74 115.90 2yug s LYS 33 Ca 0.48 -1.30 0.00 0.00 -1.01 0.00 0.00 55.97 54.14 2yug s LYS 33 Cb -0.04 -5.31 0.00 0.00 -1.01 0.00 0.00 37.83 31.47 2yug s LYS 33 CO 0.30 -3.45 0.00 0.41 0.51 0.00 0.00 175.35 173.12 2yug n GLY 34 N 5.83 2.34 3.73 -3.33 0.00 -1.26 -4.94 105.19 107.55 2yug n GLY 34 Ca 0.45 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.38 3.38 0.10 4.61 0.00 -1.21 -3.74 121.76 122.52 2yug s ALA 35 Ca 0.00 0.84 0.09 0.00 0.00 0.00 0.00 51.96 52.89 2yug s ALA 35 Cb 0.00 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 2yug s ALA 35 CO 0.00 -0.31 -0.22 0.71 0.00 0.00 0.00 175.76 175.94 2yug s TYR 36 N 0.28 2.45 -0.56 0.00 1.51 -1.24 -3.12 117.35 116.68 2yug s TYR 36 Ca 0.53 -0.31 -0.26 0.00 -1.01 0.00 0.00 57.07 56.02 2yug s TYR 36 Cb -0.30 -1.34 -0.08 0.00 -0.11 0.00 0.00 41.96 40.14 2yug s TYR 36 CO 0.33 0.33 2.37 0.42 -1.11 0.00 0.00 175.55 177.89 2yug s ILE 37 N -1.06 3.03 0.31 2.71 1.01 -1.26 -0.29 121.20 125.66 2yug s ILE 37 Ca 0.16 0.01 -0.27 0.00 0.00 0.00 0.00 60.65 60.55 2yug s ILE 37 Cb -0.10 -3.09 -0.10 0.00 0.01 0.00 0.00 42.46 39.18 2yug s ILE 37 CO 0.07 -0.09 0.97 -2.28 0.00 0.00 0.00 174.94 173.62 2yug s HIS 38 N 12.51 3.70 -0.13 3.97 2.46 -0.16 -4.69 115.29 132.94 2yug s HIS 38 Ca 0.94 1.79 -0.04 0.00 0.47 0.00 0.00 55.06 58.22 2yug s HIS 38 Cb -0.16 -2.99 -0.03 0.00 -0.13 0.00 0.00 32.58 29.27 2yug s HIS 38 CO 0.22 0.10 0.00 0.00 -2.47 0.00 0.00 174.74 172.59 2yug s ALA 39 N -1.50 3.22 0.07 1.58 0.00 -1.26 -1.88 121.76 121.98 2yug s ALA 39 Ca 0.49 -0.79 -0.10 0.00 0.00 0.00 0.00 51.96 51.56 2yug s ALA 39 Cb -0.22 -1.61 -0.06 0.00 0.00 0.00 0.00 23.12 21.24 2yug s ALA 39 CO 0.27 0.37 0.39 -0.51 0.00 0.00 0.00 175.76 176.28 2yug s LEU 40 N -0.18 4.36 0.52 0.00 1.43 -0.03 -4.97 118.68 119.81 2yug s LEU 40 Ca 0.05 0.77 0.18 0.00 -1.03 0.00 0.00 54.13 54.10 2yug s LEU 40 Cb -0.13 -2.93 1.28 0.00 0.03 0.00 0.00 46.19 44.45 2yug s LEU 40 CO 0.02 0.19 2.11 -0.78 0.23 0.00 0.00 176.35 178.12 2yug h ASP 41 N 3.79 0.02 -0.35 2.29 1.82 -2.00 -1.38 116.42 120.62 2yug h ASP 41 Ca -0.49 -0.00 -0.12 0.00 -0.39 0.00 0.00 57.03 56.03 2yug h ASP 41 Cb 1.19 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 41.18 2yug h ASP 41 CO 0.66 0.02 -0.21 -1.13 -1.61 0.00 0.00 179.24 176.97 2yug h ASN 42 N 0.03 0.85 0.00 2.28 -1.24 -1.98 -3.47 115.58 112.05 2yug h ASN 42 Ca 0.07 -0.31 0.00 0.00 0.71 0.00 0.00 56.30 56.77 2yug h ASN 42 Cb 0.23 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2yug h ASN 42 CO -0.00 1.04 0.00 0.61 -1.29 0.00 0.00 177.43 177.78 2yug n GLY 43 N -0.22 1.20 3.75 1.57 0.00 -0.52 -5.04 105.19 105.93 2yug n GLY 43 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2yug n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yug s LEU 44 N 0.00 1.99 -0.07 0.99 1.43 -1.26 -2.86 118.68 118.90 2yug s LEU 44 Ca 0.00 1.12 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 2yug s LEU 44 Cb 0.00 -3.45 0.02 0.00 0.03 0.00 0.00 46.19 42.79 2yug s LEU 44 CO 0.00 -2.65 -0.08 -0.36 0.23 0.00 0.00 176.35 173.49 2yug s PHE 45 N -3.14 1.18 0.35 0.29 0.40 -1.26 -0.85 117.98 114.95 2yug s PHE 45 Ca 0.64 -0.44 0.06 0.00 -0.60 0.00 0.00 56.93 56.59 2yug s PHE 45 Cb -0.16 -0.94 -0.07 0.00 0.51 0.00 0.00 43.02 42.36 2yug s PHE 45 CO 0.55 -0.29 0.01 -0.08 0.70 0.00 0.00 175.22 176.11 2yug s THR 46 N 0.97 1.63 -0.39 0.64 -1.32 -0.79 -3.53 115.64 112.85 2yug s THR 46 Ca -0.09 -2.03 -0.29 0.00 -1.21 0.00 0.00 61.69 58.06 2yug s THR 46 Cb -0.15 -2.80 0.00 0.00 -1.51 0.00 0.00 72.50 68.04 2yug s THR 46 CO 0.00 -0.06 1.49 -0.22 -2.21 0.00 0.00 174.62 173.61 2yug s LEU 47 N -3.57 3.58 0.62 9.08 2.96 -1.26 -0.99 118.68 129.09 2yug s LEU 47 Ca 0.35 0.93 -0.17 0.00 -0.22 0.00 0.00 54.13 55.01 2yug s LEU 47 Cb 0.08 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.21 2yug s LEU 47 CO 0.16 -1.48 1.16 -0.83 -1.32 0.00 0.00 176.35 174.04 2yug s GLY 48 N 4.33 2.51 0.57 7.98 0.00 0.60 -4.83 107.32 118.47 2yug s GLY 48 Ca 0.65 0.83 -0.20 0.00 0.00 0.00 0.00 44.72 46.00 2yug s GLY 48 CO 0.33 1.20 1.22 0.00 0.00 0.00 0.00 173.10 175.85 2yug s ALA 49 N -1.88 2.65 0.48 3.20 0.00 -1.26 -3.63 121.76 121.32 2yug s ALA 49 Ca 0.73 1.04 -0.22 0.00 0.00 0.00 0.00 51.96 53.52 2yug s ALA 49 Cb -0.26 -3.46 -0.07 0.00 0.00 0.00 0.00 23.12 19.33 2yug s ALA 49 CO 0.35 -1.11 1.13 -1.25 0.00 0.00 0.00 175.76 174.88 2yug s PRO 50 N -3.17 3.68 0.43 0.00 0.04 -1.26 -4.48 135.00 130.23 2yug s PRO 50 Ca 0.74 1.65 -0.23 0.00 0.04 0.00 0.00 61.00 63.21 2yug s PRO 50 Cb -0.31 -2.26 -0.09 0.00 0.04 0.00 0.00 34.50 31.88 2yug s PRO 50 CO 0.35 -0.59 1.07 -1.01 0.04 0.00 0.00 177.00 176.86 2yug s HIS 51 N -1.67 3.14 0.03 0.56 3.76 -1.25 -4.98 115.29 114.88 2yug s HIS 51 Ca 0.66 1.61 -0.26 0.00 -0.15 0.00 0.00 55.06 56.92 2yug s HIS 51 Cb -0.25 -3.16 -0.17 0.00 1.11 0.00 0.00 32.58 30.11 2yug s HIS 51 CO 0.30 -0.83 1.41 -0.09 -0.85 0.00 0.00 174.74 174.68 2yug h ARG 52 N 2.22 -0.36 -7.13 1.40 2.43 -1.97 -3.45 114.38 107.51 2yug h ARG 52 Ca -0.49 0.02 -0.47 0.00 -0.81 0.00 0.00 59.98 58.24 2yug h ARG 52 Cb 1.22 0.08 0.08 0.00 -0.42 0.00 0.00 29.97 30.94 2yug h ARG 52 CO 0.61 -0.09 0.12 -1.21 -1.51 0.00 0.00 179.97 177.89 2yug s GLU 53 N -5.17 1.64 -0.15 0.20 2.02 -1.26 -5.04 118.70 110.94 2yug s GLU 53 Ca -0.15 -1.09 0.14 0.00 0.02 0.00 0.00 54.97 53.89 2yug s GLU 53 Cb 0.03 -2.31 -0.24 0.00 0.10 0.00 0.00 34.13 31.71 2yug s GLU 53 CO 0.59 -1.48 0.24 0.28 0.02 0.00 0.00 175.26 174.91 2yug n VAL 54 N -2.87 1.48 -3.38 2.63 0.31 -1.26 -4.73 118.33 110.51 2yug n VAL 54 Ca 0.15 -0.81 -0.45 0.00 -0.01 0.00 0.00 64.34 63.21 2yug n VAL 54 Cb 0.61 -0.76 -0.03 0.00 -0.91 0.00 0.00 33.84 32.74 2yug n VAL 54 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2yug s ASP 55 N -5.81 6.48 -0.12 4.52 1.01 -1.26 -4.99 116.67 116.50 2yug s ASP 55 Ca -0.11 -2.58 -0.28 0.00 0.71 0.00 0.00 52.55 50.30 2yug s ASP 55 Cb 0.07 -2.16 0.07 0.00 1.01 0.00 0.00 42.92 41.90 2yug s ASP 55 CO 0.81 -0.59 0.67 -0.70 0.21 0.00 0.00 175.17 175.58 2yug s GLU 56 N 0.35 0.96 0.19 8.23 2.56 -1.26 -4.95 118.70 124.77 2yug s GLU 56 Ca 0.16 0.50 -0.18 0.00 0.00 0.00 0.00 54.97 55.45 2yug s GLU 56 Cb -0.14 0.46 -0.08 0.00 2.00 0.00 0.00 34.13 36.37 2yug s GLU 56 CO -0.07 -0.24 0.65 0.20 -0.56 0.00 0.00 175.26 175.25 2yug s GLY 57 N -0.64 2.56 1.02 -1.50 0.00 -1.26 -5.02 107.32 102.48 2yug s GLY 57 Ca -0.07 0.05 -0.14 0.00 0.00 0.00 0.00 44.72 44.56 2yug s GLY 57 CO 0.07 0.39 0.43 -1.05 0.00 0.00 0.00 173.10 172.93 2yug n PRO 58 N 0.81 -0.88 -1.11 2.90 -0.02 -1.26 -4.97 135.00 130.47 2yug n PRO 58 Ca -0.04 -0.22 -0.30 0.00 -2.02 0.00 0.00 63.50 60.92 2yug n PRO 58 Cb 0.51 -1.90 0.14 0.00 -0.02 0.00 0.00 33.50 32.23 2yug n PRO 58 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2yug s SER 59 N -2.07 3.52 0.20 2.55 1.04 -1.26 -4.74 113.70 112.94 2yug s SER 59 Ca 0.59 1.67 -0.12 0.00 0.48 0.00 0.00 55.95 58.57 2yug s SER 59 Cb -0.19 -2.33 0.23 0.00 0.10 0.00 0.00 66.02 63.84 2yug s SER 59 CO 0.66 -2.63 1.69 -0.65 0.98 0.00 0.00 173.24 173.28 2yug h PRO 60 N -1.54 0.16 0.00 4.02 0.11 -1.95 -0.92 132.00 131.88 2yug h PRO 60 Ca -0.48 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 65.57 2yug h PRO 60 Cb 1.27 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 2yug h PRO 60 CO 0.52 0.10 -0.27 -1.00 -0.21 0.00 0.00 178.00 177.14 2yug h PRO 61 N 0.16 0.00 -0.19 1.05 0.13 -1.92 -3.16 132.00 128.08 2yug h PRO 61 Ca 0.28 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.21 2yug h PRO 61 Cb 0.42 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.56 2yug h PRO 61 CO -0.42 0.27 -0.66 0.93 -0.23 0.00 0.00 178.00 177.88 2yug h GLU 62 N 0.00 0.71 -5.82 0.86 5.08 -1.49 -2.60 114.58 111.31 2yug h GLU 62 Ca -0.00 -0.51 -0.52 0.00 -1.00 0.00 0.00 59.36 57.32 2yug h GLU 62 Cb 0.88 0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.21 2yug h GLU 62 CO 0.03 1.13 1.54 -0.65 -1.00 0.00 0.00 179.01 180.07 2yug s GLN 63 N -3.88 2.59 0.25 2.33 -0.21 -0.54 -4.77 119.66 115.43 2yug s GLN 63 Ca -0.09 1.56 -0.11 0.00 0.02 0.00 0.00 55.36 56.74 2yug s GLN 63 Cb 0.10 -4.47 -0.08 0.00 1.00 0.00 0.00 33.01 29.56 2yug s GLN 63 CO 0.88 -2.73 0.60 -0.06 -2.12 0.00 0.00 175.29 171.87 2yug s PHE 64 N 10.22 3.41 -0.30 0.91 0.08 -1.07 -3.53 117.98 127.70 2yug s PHE 64 Ca 0.95 0.98 -0.07 0.00 0.12 0.00 0.00 56.93 58.91 2yug s PHE 64 Cb -0.23 -2.34 0.01 0.00 -0.57 0.00 0.00 43.02 39.89 2yug s PHE 64 CO 0.29 0.22 0.09 0.99 -0.10 0.00 0.00 175.22 176.71 2yug s THR 65 N -1.86 3.96 0.47 0.64 2.01 0.13 -0.03 115.64 120.97 2yug s THR 65 Ca 0.49 -0.76 -0.19 0.00 0.31 0.00 0.00 61.69 61.54 2yug s THR 65 Cb -0.11 -3.08 -0.09 0.00 0.01 0.00 0.00 72.50 69.23 2yug s THR 65 CO 0.20 0.03 0.98 0.00 -0.69 0.00 0.00 174.62 175.14 2yug s ALA 66 N 1.49 3.01 -0.19 7.40 0.00 -0.18 -0.98 121.76 132.31 2yug s ALA 66 Ca 0.02 0.37 -0.04 0.00 0.00 0.00 0.00 51.96 52.31 2yug s ALA 66 Cb -0.18 -3.16 0.09 0.00 0.00 0.00 0.00 23.12 19.88 2yug s ALA 66 CO 0.03 -0.08 0.27 0.08 0.00 0.00 0.00 175.76 176.06 2yug s VAL 67 N -2.28 -0.42 0.48 0.00 1.01 0.91 -3.99 120.40 116.11 2yug s VAL 67 Ca 0.62 0.03 -0.21 0.00 0.00 0.00 0.00 61.98 62.41 2yug s VAL 67 Cb -0.11 -0.63 -0.07 0.00 0.00 0.00 0.00 36.38 35.56 2yug s VAL 67 CO 0.20 -0.08 1.10 -0.54 0.00 0.00 0.00 175.10 175.78 2yug s LYS 68 N 2.41 3.71 0.06 2.72 1.02 -1.26 -0.28 119.74 128.12 2yug s LYS 68 Ca 0.06 1.57 0.00 0.00 0.02 0.00 0.00 55.97 57.62 2yug s LYS 68 Cb -0.14 -2.22 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 2yug s LYS 68 CO -0.12 -0.54 0.00 1.28 -0.92 0.00 0.00 175.35 175.05 2yug n LEU 69 N -0.80 0.06 -3.64 3.17 4.77 -1.04 -4.92 117.00 114.60 2yug n LEU 69 Ca 0.09 0.09 -0.02 0.00 -0.03 0.00 0.00 56.01 56.15 2yug n LEU 69 Cb 0.50 0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.62 2yug n LEU 69 CO 0.43 -0.57 1.20 -0.94 -1.33 0.00 0.00 177.39 176.19 2yug s SER 70 N -4.56 -0.00 -1.71 -1.43 1.04 -1.24 -4.99 113.70 100.81 2yug s SER 70 Ca 0.00 -0.00 -0.01 0.00 0.48 0.00 0.00 55.95 56.42 2yug s SER 70 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.12 2yug s SER 70 CO 0.00 -0.00 0.13 -0.67 0.98 0.00 0.00 173.24 173.68 2yug n ASP 71 N -0.03 -5.87 -3.12 7.02 -0.08 -1.26 -1.56 116.55 111.66 2yug n ASP 71 Ca 0.05 -0.06 -0.22 0.00 -1.51 0.00 0.00 54.79 53.04 2yug n ASP 71 Cb 0.56 -4.86 0.05 0.00 2.34 0.00 0.00 41.12 39.22 2yug n ASP 71 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2yug n SER 72 N -2.11 -6.12 -4.16 1.67 7.64 -1.26 -4.98 113.62 104.30 2yug n SER 72 Ca -0.22 -0.36 -0.34 0.00 1.01 0.00 0.00 58.87 58.97 2yug n SER 72 Cb 0.67 -4.88 -0.14 0.00 -1.01 0.00 0.00 64.21 58.85 2yug n SER 72 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2yug s ARG 73 N -5.87 2.59 0.32 1.43 1.81 -0.60 -4.48 118.95 114.15 2yug s ARG 73 Ca 0.39 -1.14 0.07 0.00 -1.72 0.00 0.00 55.73 53.33 2yug s ARG 73 Cb -0.17 -2.99 -0.02 0.00 -0.45 0.00 0.00 34.95 31.31 2yug s ARG 73 CO 0.48 -0.49 0.34 0.96 -0.68 0.00 0.00 175.30 175.91 2yug s ILE 74 N 1.25 3.88 -0.04 1.52 -4.36 -1.20 -2.48 121.20 119.77 2yug s ILE 74 Ca -0.03 -1.24 0.05 0.00 -0.26 0.00 0.00 60.65 59.16 2yug s ILE 74 Cb -0.18 -3.31 -0.00 0.00 1.25 0.00 0.00 42.46 40.21 2yug s ILE 74 CO -0.04 -0.19 -0.18 0.00 0.24 0.00 0.00 174.94 174.76 2yug s ALA 75 N -2.23 1.61 0.11 2.27 0.00 0.62 -2.16 121.76 121.98 2yug s ALA 75 Ca 0.41 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.58 2yug s ALA 75 Cb -0.07 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.47 2yug s ALA 75 CO 0.28 0.30 0.35 -0.51 0.00 0.00 0.00 175.76 176.17 2yug s LEU 76 N 0.01 4.29 -0.16 0.00 1.43 -1.26 -0.06 118.68 122.94 2yug s LEU 76 Ca -0.04 0.57 -0.02 0.00 -1.03 0.00 0.00 54.13 53.61 2yug s LEU 76 Cb -0.12 -3.18 0.05 0.00 0.03 0.00 0.00 46.19 42.97 2yug s LEU 76 CO 0.02 0.10 0.02 -0.75 0.23 0.00 0.00 176.35 175.97 2yug s LYS 77 N -2.49 0.73 0.73 1.70 2.20 -0.15 -1.85 119.74 120.61 2yug s LYS 77 Ca 0.38 -0.28 -0.16 0.00 -0.36 0.00 0.00 55.97 55.56 2yug s LYS 77 Cb -0.12 -1.78 0.04 0.00 -1.51 0.00 0.00 37.83 34.46 2yug s LYS 77 CO 0.24 -0.52 1.25 -1.54 -0.36 0.00 0.00 175.35 174.42 2yug s SER 78 N 1.87 4.05 0.53 1.43 1.04 0.10 -0.69 113.70 122.03 2yug s SER 78 Ca 0.01 2.51 0.22 0.00 0.48 0.00 0.00 55.95 59.17 2yug s SER 78 Cb -0.15 -2.60 1.41 0.00 0.10 0.00 0.00 66.02 64.77 2yug s SER 78 CO -0.07 -2.37 2.13 1.23 0.98 0.00 0.00 173.24 175.14 2yug h GLY 79 N -0.20 0.00 1.77 7.32 0.00 -1.51 -1.87 103.07 108.58 2yug h GLY 79 Ca -0.49 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.87 2yug h GLY 79 CO 0.49 0.00 0.10 -0.97 0.00 0.00 0.00 176.54 176.16 2yug h TYR 80 N 0.00 0.09 0.00 5.60 0.05 -1.85 -3.46 116.97 117.40 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 0.13 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 37.84 2yug h TYR 80 CO 0.00 0.05 0.00 0.41 -1.05 0.00 0.00 178.16 177.57 2yug n GLY 81 N -1.54 1.41 3.31 3.88 0.00 -0.71 -5.15 105.19 106.38 2yug n GLY 81 Ca -0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.05 1.50 -0.15 1.61 1.02 -1.22 -4.77 119.74 117.68 2yug s LYS 82 Ca 0.00 -1.84 -0.01 0.00 0.02 0.00 0.00 55.97 54.13 2yug s LYS 82 Cb 0.00 -0.05 -0.02 0.00 -0.52 0.00 0.00 37.83 37.24 2yug s LYS 82 CO 0.00 -0.42 -0.10 0.71 -0.92 0.00 0.00 175.35 174.62 2yug s TYR 83 N -3.72 2.88 0.07 3.18 1.51 0.80 0.03 117.35 122.10 2yug s TYR 83 Ca 0.37 -0.63 -0.30 0.00 -1.01 0.00 0.00 57.07 55.50 2yug s TYR 83 Cb 0.06 -1.91 -0.09 0.00 -0.11 0.00 0.00 41.96 39.90 2yug s TYR 83 CO 0.16 -0.23 1.94 -0.51 -1.11 0.00 0.00 175.55 175.80 2yug s LEU 84 N 0.54 4.43 0.04 -1.29 1.43 -0.77 -3.92 118.68 119.14 2yug s LEU 84 Ca -0.07 2.71 0.02 0.00 -1.03 0.00 0.00 54.13 55.77 2yug s LEU 84 Cb -0.15 -3.54 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 2yug s LEU 84 CO 0.03 -1.05 -0.08 -0.83 0.23 0.00 0.00 176.35 174.66 2yug s GLY 85 N 3.96 0.50 -0.20 -3.19 0.00 0.23 -4.14 107.32 104.47 2yug s GLY 85 Ca 0.87 -0.69 -0.09 0.00 0.00 0.00 0.00 44.72 44.81 2yug s GLY 85 CO 0.40 -0.72 0.11 -0.26 0.00 0.00 0.00 173.10 172.64 2yug s ILE 86 N -1.13 5.16 1.10 0.90 -4.36 -1.10 -0.70 121.20 121.07 2yug s ILE 86 Ca -0.07 0.10 -0.14 0.00 -0.26 0.00 0.00 60.65 60.29 2yug s ILE 86 Cb -0.08 -3.36 0.24 0.00 1.25 0.00 0.00 42.46 40.51 2yug s ILE 86 CO 0.00 0.42 1.07 0.20 0.24 0.00 0.00 174.94 176.87 2yug s ASN 87 N 0.56 1.69 0.27 4.36 0.01 0.05 -4.71 114.94 117.17 2yug s ASN 87 Ca 0.06 1.18 0.04 0.00 -0.71 0.00 0.00 52.86 53.43 2yug s ASN 87 Cb -0.12 -1.84 0.37 0.00 0.41 0.00 0.00 41.25 40.07 2yug s ASN 87 CO 0.00 -3.71 1.67 -1.28 -1.51 0.00 0.00 177.10 172.27 2yug h SER 88 N -2.29 0.38 0.25 -1.22 0.87 -1.99 -2.85 113.55 106.70 2yug h SER 88 Ca -0.56 -0.16 -0.08 0.00 -1.23 0.00 0.00 61.79 59.76 2yug h SER 88 Cb 1.33 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 63.18 2yug h SER 88 CO 0.52 0.74 -0.34 0.44 -0.53 0.00 0.00 176.83 177.67 2yug h ASP 89 N 0.30 0.14 0.00 6.23 3.32 -2.05 -3.46 116.42 120.90 2yug h ASP 89 Ca 0.03 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.03 2yug h ASP 89 Cb 0.84 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.35 2yug h ASP 89 CO 0.07 0.48 0.00 0.61 -1.72 0.00 0.00 179.24 178.68 2yug n GLY 90 N -0.44 1.65 3.63 2.75 0.00 -1.08 -5.05 105.19 106.66 2yug n GLY 90 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2yug n GLY 90 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2yug s LEU 91 N 0.00 3.25 -0.31 0.99 2.96 -1.26 -1.39 118.68 122.92 2yug s LEU 91 Ca 0.00 -0.23 -0.21 0.00 -0.22 0.00 0.00 54.13 53.47 2yug s LEU 91 Cb 0.00 -1.97 -0.01 0.00 0.50 0.00 0.00 46.19 44.71 2yug s LEU 91 CO 0.00 0.21 0.67 -0.69 -1.32 0.00 0.00 176.35 175.22 2yug s VAL 92 N -1.19 4.90 0.33 1.68 1.01 0.56 -0.77 120.40 126.91 2yug s VAL 92 Ca 0.22 0.93 0.06 0.00 0.00 0.00 0.00 61.98 63.19 2yug s VAL 92 Cb -0.11 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 2yug s VAL 92 CO 0.14 -0.18 0.26 0.68 0.00 0.00 0.00 175.10 176.00 2yug s VAL 93 N 2.71 0.04 -0.30 2.92 -7.23 0.12 -4.36 120.40 114.30 2yug s VAL 93 Ca 0.27 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.42 2yug s VAL 93 Cb -0.15 -2.49 0.19 0.00 0.56 0.00 0.00 36.38 34.49 2yug s VAL 93 CO 0.12 0.00 0.72 -0.83 -0.31 0.00 0.00 175.10 174.80 2yug s GLY 94 N -3.37 -0.95 -0.04 2.32 0.00 -1.14 0.76 107.32 104.91 2yug s GLY 94 Ca 0.40 1.83 0.04 0.00 0.00 0.00 0.00 44.72 46.99 2yug s GLY 94 CO 0.26 3.60 1.08 -0.96 0.00 0.00 0.00 173.10 177.08 2yug n ARG 95 N 5.41 0.18 -5.20 2.90 1.85 -1.25 -4.67 116.66 115.87 2yug n ARG 95 Ca 0.00 -1.15 -0.31 0.00 -1.00 0.00 0.00 57.85 55.39 2yug n ARG 95 Cb 0.53 0.42 -0.17 0.00 -1.05 0.00 0.00 32.46 32.19 2yug n ARG 95 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2yug s SER 96 N -1.15 2.99 -0.44 2.89 0.15 -1.26 -4.94 113.70 111.96 2yug s SER 96 Ca 0.05 -0.52 0.03 0.00 0.70 0.00 0.00 55.95 56.21 2yug s SER 96 Cb 0.09 -1.09 0.60 0.00 -1.71 0.00 0.00 66.02 63.91 2yug s SER 96 CO -0.03 0.20 1.87 0.47 1.20 0.00 0.00 173.24 176.94 2yug n ASP 97 N 3.24 4.08 -3.69 5.45 8.00 -1.26 -0.14 116.55 132.23 2yug n ASP 97 Ca -0.18 -3.51 -0.10 0.00 0.71 0.00 0.00 54.79 51.71 2yug n ASP 97 Cb 0.52 -0.83 -0.03 0.00 -0.02 0.00 0.00 41.12 40.76 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 -3.10 -1.05 0.31 2.24 0.00 -1.26 -5.02 121.76 113.88 2yug s ALA 98 Ca 0.53 -0.12 -0.24 0.00 0.00 0.00 0.00 51.96 52.14 2yug s ALA 98 Cb 0.45 0.85 -0.10 0.00 0.00 0.00 0.00 23.12 24.32 2yug s ALA 98 CO 0.09 -0.80 0.89 0.42 0.00 0.00 0.00 175.76 176.36 2yug s ILE 99 N -3.85 4.31 0.08 0.00 -1.09 -1.26 -4.87 121.20 114.52 2yug s ILE 99 Ca 0.08 1.67 -0.02 0.00 -2.23 0.00 0.00 60.65 60.15 2yug s ILE 99 Cb -0.01 -3.94 0.01 0.00 -1.58 0.00 0.00 42.46 36.93 2yug s ILE 99 CO -0.04 0.12 0.15 0.61 -1.23 0.00 0.00 174.94 174.54 2yug n GLY 100 N 0.50 2.27 0.20 6.18 0.00 -1.26 -5.02 105.19 108.06 2yug n GLY 100 Ca 0.01 -1.22 -0.08 0.00 0.00 0.00 0.00 46.02 44.73 2yug n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yug h PRO 101 N 0.00 0.47 -0.01 1.61 0.13 -1.97 -2.87 132.00 129.37 2yug h PRO 101 Ca -0.07 -0.29 -0.20 0.00 -0.87 0.00 0.00 66.00 64.57 2yug h PRO 101 Cb 0.27 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.42 2yug h PRO 101 CO 0.09 0.89 -0.87 0.00 -0.23 0.00 0.00 178.00 177.87 2yug h ARG 102 N 0.36 0.26 0.00 0.86 3.08 -1.95 -3.06 114.38 113.94 2yug h ARG 102 Ca 0.01 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.78 2yug h ARG 102 Cb 1.06 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.18 2yug h ARG 102 CO 0.10 0.98 0.00 0.39 -1.07 0.00 0.00 179.97 180.37 2yug n GLU 103 N -3.70 0.12 -2.40 0.04 4.71 -1.19 -2.73 120.64 115.48 2yug n GLU 103 Ca -0.04 0.08 -0.41 0.00 -0.01 0.00 0.00 57.16 56.77 2yug n GLU 103 Cb 0.80 -1.50 -0.04 0.00 -1.01 0.00 0.00 31.44 29.69 2yug n GLU 103 CO 0.00 0.00 0.00 -0.65 0.09 0.00 0.00 177.13 176.57 2yug s GLN 104 N -2.85 4.51 0.33 3.49 -0.21 -1.09 -4.47 119.66 119.37 2yug s GLN 104 Ca 0.16 1.84 0.03 0.00 0.02 0.00 0.00 55.36 57.41 2yug s GLN 104 Cb 0.16 -3.25 -0.06 0.00 1.00 0.00 0.00 33.01 30.86 2yug s GLN 104 CO 0.42 -0.05 0.07 -1.58 -2.12 0.00 0.00 175.29 172.02 2yug s TRP 105 N -0.12 1.91 -0.37 0.91 0.52 -0.92 -2.45 118.94 118.42 2yug s TRP 105 Ca 0.52 -1.01 0.05 0.00 0.02 0.00 0.00 56.10 55.68 2yug s TRP 105 Cb -0.32 -1.24 0.17 0.00 -1.15 0.00 0.00 33.47 30.93 2yug s TRP 105 CO 0.36 -0.05 0.49 -2.00 0.02 0.00 0.00 176.95 175.78 2yug s GLU 106 N -3.89 0.67 0.55 4.98 2.12 -0.34 -3.21 118.70 119.57 2yug s GLU 106 Ca 0.35 -0.37 -0.19 0.00 0.36 0.00 0.00 54.97 55.12 2yug s GLU 106 Cb 0.08 -0.28 -0.08 0.00 0.26 0.00 0.00 34.13 34.12 2yug s GLU 106 CO 0.15 -1.16 0.74 -2.30 -0.54 0.00 0.00 175.26 172.15 2yug n PRO 107 N 4.57 0.76 -3.58 4.30 -0.02 -1.26 -1.71 135.00 138.06 2yug n PRO 107 Ca 0.09 0.29 -0.22 0.00 -2.02 0.00 0.00 63.50 61.64 2yug n PRO 107 Cb 0.51 -1.88 -0.16 0.00 -0.02 0.00 0.00 33.50 31.95 2yug n PRO 107 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2yug s VAL 108 N -1.57 -0.19 -0.03 -1.45 1.01 -1.06 -4.81 120.40 112.31 2yug s VAL 108 Ca 0.70 -0.05 -0.15 0.00 0.00 0.00 0.00 61.98 62.48 2yug s VAL 108 Cb -0.46 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.31 2yug s VAL 108 CO 0.53 -0.18 0.41 -0.36 0.00 0.00 0.00 175.10 175.50 2yug s PHE 109 N 2.22 3.68 -0.30 5.22 0.08 -1.26 0.13 117.98 127.75 2yug s PHE 109 Ca 0.04 0.95 -0.03 0.00 0.12 0.00 0.00 56.93 58.01 2yug s PHE 109 Cb -0.15 -2.33 0.11 0.00 -0.57 0.00 0.00 43.02 40.08 2yug s PHE 109 CO -0.09 0.55 0.15 -1.14 -0.10 0.00 0.00 175.22 174.58 2yug s GLN 110 N -0.73 0.23 -1.21 0.44 0.74 -0.67 -4.89 119.66 113.57 2yug s GLN 110 Ca 0.23 -0.61 -0.00 0.00 0.05 0.00 0.00 55.36 55.04 2yug s GLN 110 Cb -0.16 -1.16 0.00 0.00 1.10 0.00 0.00 33.01 32.79 2yug s GLN 110 CO 0.12 -1.04 1.01 -0.25 -0.55 0.00 0.00 175.29 174.58 2yug n ASP 111 N 5.12 -2.23 0.00 6.67 8.00 -1.26 -2.62 116.55 130.22 2yug n ASP 111 Ca -0.04 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 54.85 2yug n ASP 111 Cb 0.42 -5.13 0.00 0.00 -0.02 0.00 0.00 41.12 36.39 2yug n ASP 111 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2yug n GLY 112 N -1.17 2.39 3.36 0.44 0.00 -1.26 -5.01 105.19 103.95 2yug n GLY 112 Ca -0.28 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 44.91 2yug n GLY 112 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yug s LYS 113 N 0.00 -2.79 0.02 1.61 -0.14 -1.08 -5.01 119.74 112.36 2yug s LYS 113 Ca 0.00 -0.03 -0.20 0.00 -1.36 0.00 0.00 55.97 54.37 2yug s LYS 113 Cb 0.00 -1.41 0.04 0.00 -1.68 0.00 0.00 37.83 34.78 2yug s LYS 113 CO 0.00 -4.74 0.46 0.00 -0.76 0.00 0.00 175.35 170.31 2yug s MET 114 N -5.27 0.94 -0.28 1.68 0.23 -1.24 -1.67 119.30 113.68 2yug s MET 114 Ca 0.70 -0.22 0.01 0.00 -1.03 0.00 0.00 55.69 55.14 2yug s MET 114 Cb -0.10 0.42 0.16 0.00 -1.53 0.00 0.00 34.83 33.79 2yug s MET 114 CO 0.56 -0.32 0.47 0.00 -2.03 0.00 0.00 175.02 173.70 2yug s ALA 115 N -2.14 -1.57 0.10 3.16 0.00 0.12 -0.13 121.76 121.29 2yug s ALA 115 Ca -0.07 0.87 -0.31 0.00 0.00 0.00 0.00 51.96 52.45 2yug s ALA 115 Cb -0.01 -2.06 -0.10 0.00 0.00 0.00 0.00 23.12 20.95 2yug s ALA 115 CO 0.00 -1.54 1.82 -1.17 0.00 0.00 0.00 175.76 174.87 2yug s LEU 116 N 2.65 4.40 -0.27 0.00 2.96 -1.26 -2.55 118.68 124.61 2yug s LEU 116 Ca 0.13 2.69 -0.13 0.00 -0.22 0.00 0.00 54.13 56.60 2yug s LEU 116 Cb -0.13 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 2yug s LEU 116 CO -0.24 -0.99 0.26 -0.22 -1.32 0.00 0.00 176.35 173.84 2yug s LEU 117 N 3.06 4.05 1.01 -0.68 2.96 -0.69 -3.61 118.68 124.78 2yug s LEU 117 Ca 0.81 0.15 -0.12 0.00 -0.22 0.00 0.00 54.13 54.75 2yug s LEU 117 Cb -0.44 -2.25 0.20 0.00 0.50 0.00 0.00 46.19 44.19 2yug s LEU 117 CO 0.36 -0.08 1.08 0.00 -1.32 0.00 0.00 176.35 176.39 2yug s ALA 118 N 1.74 0.72 0.12 5.97 0.00 0.20 -1.20 121.76 129.31 2yug s ALA 118 Ca 0.11 -0.05 0.31 0.00 0.00 0.00 0.00 51.96 52.32 2yug s ALA 118 Cb -0.16 -3.23 1.64 0.00 0.00 0.00 0.00 23.12 21.37 2yug s ALA 118 CO 0.10 -3.02 1.95 1.03 0.00 0.00 0.00 175.76 175.82 2yug h SER 119 N -2.03 0.00 -0.55 0.00 0.87 -1.72 -1.08 113.55 109.05 2yug h SER 119 Ca -0.54 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 59.87 2yug h SER 119 Cb 1.31 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.18 2yug h SER 119 CO 0.52 0.00 0.19 -3.20 -0.53 0.00 0.00 176.83 173.81 2yug n ASN 120 N -2.62 4.17 -3.74 6.23 5.15 -1.26 -4.89 115.26 118.31 2yug n ASN 120 Ca -0.02 -2.89 -0.28 0.00 -0.60 0.00 0.00 54.58 50.80 2yug n ASN 120 Cb 0.09 -0.68 0.04 0.00 -0.53 0.00 0.00 39.78 38.69 2yug n ASN 120 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2yug n SER 121 N 0.01 -5.27 -3.98 1.20 3.41 -0.41 -4.98 113.62 103.61 2yug n SER 121 Ca 0.30 -0.66 -0.15 0.00 -0.26 0.00 0.00 58.87 58.09 2yug n SER 121 Cb 1.12 -4.20 -0.14 0.00 -0.26 0.00 0.00 64.21 60.74 2yug n SER 121 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2yug s PHE 123 N -0.36 3.67 0.62 0.00 0.08 -1.26 0.59 117.98 121.32 2yug s PHE 123 Ca -0.00 1.22 -0.19 0.00 0.12 0.00 0.00 56.93 58.08 2yug s PHE 123 Cb -0.04 -2.66 -0.02 0.00 -0.57 0.00 0.00 43.02 39.74 2yug s PHE 123 CO -0.00 0.30 1.29 0.96 -0.10 0.00 0.00 175.22 177.66 2yug s ILE 124 N 0.00 2.16 -0.28 0.64 -4.36 -1.24 -1.29 121.20 116.84 2yug s ILE 124 Ca 0.32 0.11 -0.21 0.00 -0.26 0.00 0.00 60.65 60.61 2yug s ILE 124 Cb -0.18 -3.04 0.10 0.00 1.25 0.00 0.00 42.46 40.59 2yug s ILE 124 CO 0.18 -0.02 0.85 -0.60 0.24 0.00 0.00 174.94 175.58 2yug s ARG 125 N -3.29 0.62 0.78 0.37 6.06 -0.83 -4.81 118.95 117.85 2yug s ARG 125 Ca 0.80 0.88 -0.09 0.00 -2.50 0.00 0.00 55.73 54.82 2yug s ARG 125 Cb -0.37 0.23 0.10 0.00 0.06 0.00 0.00 34.95 34.97 2yug s ARG 125 CO 0.40 -0.10 1.11 0.00 -2.50 0.00 0.00 175.30 174.20 2yug s ASN 127 N -4.64 3.83 -0.00 0.00 0.01 -1.22 -4.87 114.94 108.05 2yug s ASN 127 Ca 0.64 -1.71 0.07 0.00 -0.71 0.00 0.00 52.86 51.16 2yug s ASN 127 Cb -0.09 0.65 -0.24 0.00 0.41 0.00 0.00 41.25 41.99 2yug s ASN 127 CO 0.47 -0.94 0.82 -0.33 -1.51 0.00 0.00 177.10 175.62 2yug h GLU 128 N 1.40 0.06 0.16 -0.60 5.08 -2.00 -3.37 114.58 115.32 2yug h GLU 128 Ca -0.41 -0.10 -0.25 0.00 -1.00 0.00 0.00 59.36 57.60 2yug h GLU 128 Cb 1.31 0.04 0.03 0.00 0.50 0.00 0.00 28.75 30.63 2yug h GLU 128 CO 0.68 0.77 -1.08 0.00 -1.00 0.00 0.00 179.01 178.38 2yug h ALA 129 N 0.85 -0.09 0.00 3.43 0.00 -2.03 -3.48 119.26 117.94 2yug h ALA 129 Ca -0.22 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 53.94 2yug h ALA 129 Cb 1.96 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.87 2yug h ALA 129 CO 0.11 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.29 2yug n GLY 130 N 1.59 0.36 2.66 0.00 0.00 -1.26 -5.01 105.19 103.53 2yug n GLY 130 Ca -0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.01 2.16 -0.20 1.61 1.01 -1.26 -4.69 116.67 115.29 2yug s ASP 131 Ca 0.00 -0.63 -0.26 0.00 0.71 0.00 0.00 52.55 52.37 2yug s ASP 131 Cb 0.00 0.05 -0.01 0.00 1.01 0.00 0.00 42.92 43.98 2yug s ASP 131 CO 0.00 -0.37 0.88 -0.63 0.21 0.00 0.00 175.17 175.26 2yug s ILE 132 N 2.23 4.82 0.19 0.77 1.01 -1.23 -3.46 121.20 125.53 2yug s ILE 132 Ca 0.06 1.70 0.01 0.00 0.00 0.00 0.00 60.65 62.42 2yug s ILE 132 Cb -0.16 -4.17 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 2yug s ILE 132 CO -0.19 -0.05 0.05 -1.83 0.00 0.00 0.00 174.94 172.92 2yug s GLU 133 N 2.58 1.17 -0.34 2.79 -1.05 -0.65 -0.32 118.70 122.88 2yug s GLU 133 Ca 0.38 -1.59 -0.24 0.00 -0.15 0.00 0.00 54.97 53.38 2yug s GLU 133 Cb -0.16 -0.13 0.01 0.00 -0.44 0.00 0.00 34.13 33.41 2yug s GLU 133 CO 0.10 -0.22 0.81 0.00 0.95 0.00 0.00 175.26 176.89 2yug s ALA 134 N -3.80 3.47 1.29 -0.84 0.00 -0.49 -1.96 121.76 119.44 2yug s ALA 134 Ca 0.29 -0.51 -0.21 0.00 0.00 0.00 0.00 51.96 51.52 2yug s ALA 134 Cb 0.07 -3.36 0.32 0.00 0.00 0.00 0.00 23.12 20.15 2yug s ALA 134 CO 0.07 -1.37 1.08 0.21 0.00 0.00 0.00 175.76 175.74 2yug s LYS 135 N 3.09 -1.92 1.40 0.00 2.36 -0.41 -4.85 119.74 119.41 2yug s LYS 135 Ca 0.33 -0.15 -0.21 0.00 -2.55 0.00 0.00 55.97 53.39 2yug s LYS 135 Cb -0.13 -1.52 0.36 0.00 -1.05 0.00 0.00 37.83 35.49 2yug s LYS 135 CO 0.15 -4.15 0.93 -0.80 1.55 0.00 0.00 175.35 173.02 2yug s ASN 136 N -3.85 -0.92 0.12 1.43 0.02 -1.26 -3.98 114.94 106.50 2yug s ASN 136 Ca 0.72 1.05 -0.18 0.00 -1.02 0.00 0.00 52.86 53.43 2yug s ASN 136 Cb -0.08 -1.54 -0.03 0.00 0.02 0.00 0.00 41.25 39.61 2yug s ASN 136 CO 0.56 -5.30 1.71 0.11 0.02 0.00 0.00 177.10 174.19 2yug h LYS 137 N -3.38 0.45 -6.81 -0.60 1.57 -1.96 -3.36 116.57 102.49 2yug h LYS 137 Ca -0.48 -0.06 -0.53 0.00 -1.87 0.00 0.00 60.65 57.70 2yug h LYS 137 Cb 1.35 -0.08 0.09 0.00 0.08 0.00 0.00 32.23 33.66 2yug h LYS 137 CO 0.33 0.41 0.90 2.41 -0.57 0.00 0.00 179.45 182.93 2yug n THR 138 N -4.78 1.02 -3.75 -0.16 -1.04 -1.26 -4.78 114.28 99.53 2yug n THR 138 Ca -0.01 -0.25 -0.37 0.00 -2.04 0.00 0.00 64.05 61.37 2yug n THR 138 Cb 0.10 -1.99 -0.12 0.00 -1.82 0.00 0.00 70.33 66.49 2yug n THR 138 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yug s ALA 139 N 0.01 3.07 0.88 2.41 0.00 -1.26 -4.95 121.76 121.92 2yug s ALA 139 Ca 0.64 -1.52 -0.11 0.00 0.00 0.00 0.00 51.96 50.96 2yug s ALA 139 Cb -0.49 -2.19 0.17 0.00 0.00 0.00 0.00 23.12 20.61 2yug s ALA 139 CO 0.48 -1.03 1.22 0.20 0.00 0.00 0.00 175.76 176.63 2yug s GLY 140 N 1.48 1.77 0.46 0.00 0.00 -1.26 -4.90 107.32 104.88 2yug s GLY 140 Ca 0.02 -1.35 0.12 0.00 0.00 0.00 0.00 44.72 43.50 2yug s GLY 140 CO 0.03 -0.65 2.09 0.83 0.00 0.00 0.00 173.10 175.40 2yug h GLU 141 N -1.28 0.24 0.01 2.90 5.08 -1.98 -1.71 114.58 117.84 2yug h GLU 141 Ca -0.42 -0.02 -0.22 0.00 -1.00 0.00 0.00 59.36 57.70 2yug h GLU 141 Cb 1.25 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 2yug h GLU 141 CO 0.39 0.18 -1.05 0.93 -1.00 0.00 0.00 179.01 178.46 2yug h GLU 142 N 0.25 0.02 -0.10 2.33 5.08 -2.00 -3.24 114.58 116.92 2yug h GLU 142 Ca 0.07 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2yug h GLU 142 Cb 0.00 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 2yug h GLU 142 CO -0.01 1.00 0.08 0.93 -1.00 0.00 0.00 179.01 180.01 2yug h GLU 143 N 0.01 0.00 -6.96 2.33 3.07 -1.66 -3.43 114.58 107.94 2yug h GLU 143 Ca -0.03 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.27 2yug h GLU 143 Cb 1.80 0.00 0.15 0.00 -0.84 0.00 0.00 28.75 29.85 2yug h GLU 143 CO 0.13 0.00 0.47 -1.33 -1.40 0.00 0.00 179.01 176.88 2yug n MET 144 N -4.23 1.49 -4.43 2.33 2.81 -1.17 -4.88 117.12 109.05 2yug n MET 144 Ca -0.01 0.55 -0.21 0.00 -1.81 0.00 0.00 57.70 56.23 2yug n MET 144 Cb 0.19 -2.45 -0.10 0.00 -0.71 0.00 0.00 33.22 30.16 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 -1.33 0.88 -0.30 2.02 -4.36 0.82 -4.94 121.20 113.99 2yug s ILE 145 Ca 0.72 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 59.14 2yug s ILE 145 Cb -0.43 -2.65 0.08 0.00 1.25 0.00 0.00 42.46 40.70 2yug s ILE 145 CO 0.49 0.00 -0.03 -0.54 0.24 0.00 0.00 174.94 175.10 2yug s LYS 146 N -3.89 1.89 -0.30 0.37 1.02 -1.08 -3.70 119.74 114.05 2yug s LYS 146 Ca 0.34 -1.60 -0.16 0.00 0.02 0.00 0.00 55.97 54.57 2yug s LYS 146 Cb 0.07 -3.04 -0.02 0.00 -0.52 0.00 0.00 37.83 34.32 2yug s LYS 146 CO 0.15 -0.74 0.44 0.42 -0.92 0.00 0.00 175.35 174.70 2yug s ILE 147 N 1.01 5.11 0.14 2.17 1.01 -1.26 -1.94 121.20 127.43 2yug s ILE 147 Ca 0.00 0.52 0.06 0.00 0.00 0.00 0.00 60.65 61.23 2yug s ILE 147 Cb -0.20 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 2yug s ILE 147 CO -0.06 0.01 0.04 -0.13 0.00 0.00 0.00 174.94 174.80 2yug s ARG 148 N 2.20 2.61 0.07 2.79 0.52 -0.33 -2.91 118.95 123.89 2yug s ARG 148 Ca 0.17 -0.93 0.06 0.00 -0.52 0.00 0.00 55.73 54.51 2yug s ARG 148 Cb -0.16 -2.52 -0.03 0.00 0.52 0.00 0.00 34.95 32.77 2yug s ARG 148 CO 0.11 0.50 -0.15 0.45 0.02 0.00 0.00 175.30 176.22 2yug s SER 149 N -2.72 1.83 -0.28 0.23 0.15 0.85 -1.45 113.70 112.31 2yug s SER 149 Ca 0.28 -0.60 0.09 0.00 0.70 0.00 0.00 55.95 56.42 2yug s SER 149 Cb -0.11 -0.08 0.47 0.00 -1.71 0.00 0.00 66.02 64.60 2yug s SER 149 CO 0.20 -0.03 1.36 0.00 1.20 0.00 0.00 173.24 175.97 2yug n ALA 151 N -1.05 -2.61 -3.42 0.00 0.00 -1.26 -4.96 120.51 107.22 2yug n ALA 151 Ca 0.32 -0.82 -0.43 0.00 0.00 0.00 0.00 53.44 52.50 2yug n ALA 151 Cb 0.89 -0.07 -0.07 0.00 0.00 0.00 0.00 19.45 20.20 2yug n ALA 151 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2yug s GLU 152 N -4.14 2.71 0.18 0.00 0.41 -1.26 -5.03 118.70 111.57 2yug s GLU 152 Ca 0.36 -1.71 -0.22 0.00 -0.41 0.00 0.00 54.97 52.99 2yug s GLU 152 Cb -0.06 -4.08 -0.08 0.00 -1.78 0.00 0.00 34.13 28.13 2yug s GLU 152 CO 0.30 -1.23 0.73 1.03 -0.49 0.00 0.00 175.26 175.59 2yug s ARG 153 N 1.47 4.36 -0.30 1.61 0.52 -1.26 -5.05 118.95 120.31 2yug s ARG 153 Ca 0.04 0.96 -0.12 0.00 -0.52 0.00 0.00 55.73 56.10 2yug s ARG 153 Cb -0.28 -3.06 0.18 0.00 0.52 0.00 0.00 34.95 32.31 2yug s ARG 153 CO 0.01 0.49 1.02 -2.00 0.02 0.00 0.00 175.30 174.84 2yug s GLU 154 N -1.56 0.20 0.00 3.54 2.12 -1.26 -5.30 118.70 116.44 2yug s GLU 154 Ca 0.39 0.32 0.01 0.00 0.36 0.00 0.00 54.97 56.04 2yug s GLU 154 Cb -0.19 0.17 0.03 0.00 0.26 0.00 0.00 34.13 34.40 2yug s GLU 154 CO 0.23 -0.26 0.53 0.25 -0.54 0.00 0.00 175.26 175.46