#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yug n SER 2 N 0.00 -5.97 -3.63 1.61 7.64 -1.26 -4.93 113.62 107.07 2yug n SER 2 Ca 0.00 -0.04 -0.03 0.00 1.01 0.00 0.00 58.87 59.81 2yug n SER 2 Cb 0.00 -4.96 -0.04 0.00 -1.01 0.00 0.00 64.21 58.20 2yug n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yug s SER 3 N -2.10 -0.08 0.00 6.43 0.01 -1.26 -5.11 113.70 111.59 2yug s SER 3 Ca 0.02 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.37 2yug s SER 3 Cb -0.01 0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.29 2yug s SER 3 CO 0.03 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.22 2yug n GLY 4 N 0.58 -1.48 3.11 3.44 0.00 -1.26 -5.06 105.19 104.52 2yug n GLY 4 Ca -0.02 0.50 0.01 0.00 0.00 0.00 0.00 46.02 46.52 2yug n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yug s SER 5 N -4.00 -1.28 -0.11 1.61 1.04 -1.26 -5.14 113.70 104.56 2yug s SER 5 Ca 0.00 -0.61 -0.17 0.00 0.48 0.00 0.00 55.95 55.65 2yug s SER 5 Cb 0.00 1.64 -0.05 0.00 0.10 0.00 0.00 66.02 67.71 2yug s SER 5 CO 0.00 -0.15 0.43 -0.94 0.98 0.00 0.00 173.24 173.57 2yug s SER 6 N 1.92 6.66 0.00 7.02 1.04 -1.26 -4.34 113.70 124.74 2yug s SER 6 Ca 0.16 0.78 0.00 0.00 0.48 0.00 0.00 55.95 57.37 2yug s SER 6 Cb -0.03 -2.26 0.00 0.00 0.10 0.00 0.00 66.02 63.83 2yug s SER 6 CO -0.09 0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.80 2yug n GLY 7 N 3.07 3.64 3.52 7.32 0.00 -1.26 -5.08 105.19 116.40 2yug n GLY 7 Ca -0.09 -0.92 -0.34 0.00 0.00 0.00 0.00 46.02 44.68 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 3.21 -0.65 0.99 2.96 -1.26 -5.05 118.68 118.87 2yug s LEU 8 Ca 0.00 -0.11 -0.26 0.00 -0.22 0.00 0.00 54.13 53.54 2yug s LEU 8 Cb 0.00 -1.75 -0.02 0.00 0.50 0.00 0.00 46.19 44.92 2yug s LEU 8 CO 0.00 0.22 1.81 -1.81 -1.32 0.00 0.00 176.35 175.25 2yug s ASP 9 N 0.05 5.35 -0.13 3.68 1.11 -1.26 -4.92 116.67 120.56 2yug s ASP 9 Ca -0.01 0.16 0.01 0.00 0.18 0.00 0.00 52.55 52.89 2yug s ASP 9 Cb -0.14 -2.54 -0.01 0.00 1.07 0.00 0.00 42.92 41.31 2yug s ASP 9 CO 0.03 -2.35 -0.15 -0.51 1.18 0.00 0.00 175.17 173.37 2yug s ILE 10 N 8.82 2.87 -0.15 0.77 2.07 -1.26 -2.46 121.20 131.86 2yug s ILE 10 Ca 0.64 -0.73 -0.00 0.00 -1.41 0.00 0.00 60.65 59.16 2yug s ILE 10 Cb -0.12 -2.19 0.03 0.00 0.13 0.00 0.00 42.46 40.32 2yug s ILE 10 CO 0.18 0.53 -0.09 -0.69 -1.91 0.00 0.00 174.94 172.96 2yug s VAL 11 N 0.39 1.29 0.00 4.00 1.01 0.86 -4.96 120.40 122.98 2yug s VAL 11 Ca -0.12 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.26 2yug s VAL 11 Cb -0.16 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 34.88 2yug s VAL 11 CO 0.06 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.04 2yug n GLY 12 N 4.84 0.21 1.41 4.51 0.00 -1.26 -0.98 105.19 113.91 2yug n GLY 12 Ca -0.14 0.71 0.03 0.00 0.00 0.00 0.00 46.02 46.63 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 0.70 -4.18 -0.61 -5.35 -1.26 -5.05 119.36 103.61 2yug n ILE 13 Ca 0.00 -1.79 -0.20 0.00 -0.27 0.00 0.00 62.75 60.50 2yug n ILE 13 Cb 0.00 0.67 -0.16 0.00 -1.74 0.00 0.00 39.64 38.41 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 -1.18 0.73 0.00 4.28 0.52 -0.16 -4.31 118.94 118.83 2yug s TRP 14 Ca 0.35 -0.19 0.05 0.00 0.02 0.00 0.00 56.10 56.33 2yug s TRP 14 Cb 0.38 -0.64 -0.02 0.00 -1.15 0.00 0.00 33.47 32.05 2yug s TRP 14 CO -0.13 -0.17 -0.16 1.67 0.02 0.00 0.00 176.95 178.17 2yug s TRP 15 N 0.81 1.46 0.21 -1.98 1.48 0.14 -0.10 118.94 120.97 2yug s TRP 15 Ca -0.11 -0.30 -0.30 0.00 -1.06 0.00 0.00 56.10 54.33 2yug s TRP 15 Cb -0.14 -0.92 -0.09 0.00 -1.16 0.00 0.00 33.47 31.16 2yug s TRP 15 CO 0.00 -0.00 1.36 0.99 -4.06 0.00 0.00 176.95 175.24 2yug s THR 16 N -0.50 3.03 0.81 0.66 2.01 -1.03 0.44 115.64 121.07 2yug s THR 16 Ca 0.06 0.84 -0.11 0.00 0.31 0.00 0.00 61.69 62.79 2yug s THR 16 Cb -0.07 -3.54 0.08 0.00 0.01 0.00 0.00 72.50 68.98 2yug s THR 16 CO -0.00 0.12 1.09 0.68 -0.69 0.00 0.00 174.62 175.82 2yug s VAL 17 N 0.14 3.09 -0.17 3.82 -7.23 -1.20 -4.86 120.40 113.99 2yug s VAL 17 Ca 0.58 0.35 0.03 0.00 -1.81 0.00 0.00 61.98 61.14 2yug s VAL 17 Cb -0.38 -3.00 -0.13 0.00 0.56 0.00 0.00 36.38 33.44 2yug s VAL 17 CO 0.39 -0.46 -0.12 -1.20 -0.31 0.00 0.00 175.10 173.40 2yug n SER 18 N -3.54 2.42 -3.26 4.85 7.64 -1.26 -5.05 113.62 115.42 2yug n SER 18 Ca 0.07 -0.08 -0.13 0.00 1.01 0.00 0.00 58.87 59.74 2yug n SER 18 Cb 0.55 -0.07 -0.03 0.00 -1.01 0.00 0.00 64.21 63.65 2yug n SER 18 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2yug s ASN 19 N -5.53 0.66 0.20 6.43 4.22 -1.26 -5.04 114.94 114.62 2yug s ASN 19 Ca -0.21 -1.37 -0.11 0.00 -2.14 0.00 0.00 52.86 49.03 2yug s ASN 19 Cb 0.06 0.69 0.17 0.00 1.28 0.00 0.00 41.25 43.45 2yug s ASN 19 CO 0.44 -1.35 1.83 0.15 -2.04 0.00 0.00 177.10 176.13 2yug h PHE 20 N 2.11 0.72 -0.23 1.54 3.57 -1.98 -1.31 116.94 121.37 2yug h PHE 20 Ca -0.29 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.30 2yug h PHE 20 Cb 1.24 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.74 2yug h PHE 20 CO 1.36 0.40 0.29 0.78 -2.23 0.00 0.00 178.31 178.91 2yug h GLY 21 N 0.75 0.00 1.38 2.40 0.00 -2.03 0.38 103.07 105.95 2yug h GLY 21 Ca 0.26 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.33 2yug h GLY 21 CO -0.12 0.00 -1.43 0.83 0.00 0.00 0.00 176.54 175.82 2yug h GLU 22 N 0.00 0.03 -5.82 4.80 5.08 -1.66 -3.42 114.58 113.58 2yug h GLU 22 Ca 0.11 -0.05 -0.37 0.00 -1.00 0.00 0.00 59.36 58.05 2yug h GLU 22 Cb 0.68 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.89 2yug h GLU 22 CO -0.00 0.76 0.93 0.42 -1.00 0.00 0.00 179.01 180.12 2yug s ILE 23 N -2.64 3.54 -0.09 3.13 1.01 0.12 -4.90 121.20 121.38 2yug s ILE 23 Ca -0.03 -0.40 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 2yug s ILE 23 Cb 0.09 -4.23 0.03 0.00 0.01 0.00 0.00 42.46 38.35 2yug s ILE 23 CO 0.82 -1.16 0.36 -0.44 0.00 0.00 0.00 174.94 174.52 2yug s SER 24 N 7.33 -0.32 0.00 3.58 0.01 -1.26 -4.83 113.70 118.21 2yug s SER 24 Ca 0.64 0.48 0.00 0.00 1.31 0.00 0.00 55.95 58.38 2yug s SER 24 Cb -0.06 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.74 2yug s SER 24 CO -0.01 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 173.97 2yug n GLY 25 N 2.15 -1.68 3.72 3.44 0.00 -1.06 -4.82 105.19 106.95 2yug n GLY 25 Ca -0.17 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.05 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 2.09 0.16 2.61 2.01 -1.26 -0.74 115.64 120.50 2yug s THR 26 Ca 0.00 0.06 -0.09 0.00 0.31 0.00 0.00 61.69 61.97 2yug s THR 26 Cb 0.00 -3.04 -0.01 0.00 0.01 0.00 0.00 72.50 69.46 2yug s THR 26 CO 0.00 0.01 0.28 0.27 -0.69 0.00 0.00 174.62 174.49 2yug s ILE 27 N 1.04 0.07 0.01 1.82 -4.36 0.16 -3.29 121.20 116.65 2yug s ILE 27 Ca 0.73 -1.33 0.05 0.00 -0.26 0.00 0.00 60.65 59.83 2yug s ILE 27 Cb -0.49 -1.76 -0.02 0.00 1.25 0.00 0.00 42.46 41.44 2yug s ILE 27 CO 0.34 -0.34 -0.14 0.00 0.24 0.00 0.00 174.94 175.04 2yug s ALA 28 N -3.95 1.16 0.06 2.27 0.00 0.68 -0.93 121.76 121.05 2yug s ALA 28 Ca 0.15 -0.69 0.07 0.00 0.00 0.00 0.00 51.96 51.48 2yug s ALA 28 Cb 0.03 -0.25 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 2yug s ALA 28 CO -0.02 0.26 -0.14 0.42 0.00 0.00 0.00 175.76 176.28 2yug s ILE 29 N -0.54 3.12 -0.16 0.00 1.01 -1.26 -0.52 121.20 122.84 2yug s ILE 29 Ca 0.04 -1.17 -0.00 0.00 0.00 0.00 0.00 60.65 59.52 2yug s ILE 29 Cb -0.06 -2.38 0.04 0.00 0.01 0.00 0.00 42.46 40.07 2yug s ILE 29 CO 0.00 0.26 -0.07 -0.70 0.00 0.00 0.00 174.94 174.43 2yug s GLU 30 N -1.73 1.63 -0.12 2.79 2.12 -1.10 -4.11 118.70 118.19 2yug s GLU 30 Ca 0.17 -0.55 -0.06 0.00 0.36 0.00 0.00 54.97 54.89 2yug s GLU 30 Cb -0.11 -2.05 -0.02 0.00 0.26 0.00 0.00 34.13 32.22 2yug s GLU 30 CO 0.09 -0.40 -0.11 0.52 -0.54 0.00 0.00 175.26 174.82 2yug h MET 31 N 8.09 0.00 -7.24 4.30 2.86 -1.90 -2.02 114.93 119.02 2yug h MET 31 Ca -0.27 0.00 -0.47 0.00 -2.06 0.00 0.00 59.70 56.90 2yug h MET 31 Cb 1.11 0.00 0.10 0.00 0.06 0.00 0.00 31.60 32.87 2yug h MET 31 CO 0.43 0.00 0.16 -0.51 1.06 0.00 0.00 176.91 178.05 2yug s ASP 32 N -5.64 3.97 -1.11 1.22 1.01 -1.22 -4.79 116.67 110.11 2yug s ASP 32 Ca -0.09 -0.43 -0.21 0.00 0.71 0.00 0.00 52.55 52.53 2yug s ASP 32 Cb 0.01 0.21 0.06 0.00 1.01 0.00 0.00 42.92 44.22 2yug s ASP 32 CO 0.13 -2.14 1.53 -0.75 0.21 0.00 0.00 175.17 174.16 2yug s LYS 33 N -5.30 3.73 0.00 8.23 2.20 -1.26 -3.73 119.74 123.61 2yug s LYS 33 Ca 0.69 -1.47 0.00 0.00 -0.36 0.00 0.00 55.97 54.84 2yug s LYS 33 Cb -0.04 -5.39 0.00 0.00 -1.51 0.00 0.00 37.83 30.89 2yug s LYS 33 CO 0.46 -2.20 0.00 0.41 -0.36 0.00 0.00 175.35 173.67 2yug n GLY 34 N 6.28 1.89 3.80 5.54 0.00 -1.26 -4.97 105.19 116.46 2yug n GLY 34 Ca 0.38 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.98 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 -2.02 3.37 0.28 4.61 0.00 -1.24 -3.63 121.76 123.13 2yug s ALA 35 Ca 0.00 0.30 0.12 0.00 0.00 0.00 0.00 51.96 52.38 2yug s ALA 35 Cb 0.00 -2.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 2yug s ALA 35 CO 0.00 0.28 -0.19 0.71 0.00 0.00 0.00 175.76 176.56 2yug s TYR 36 N -1.47 2.32 -0.21 0.00 1.51 -1.25 -3.44 117.35 114.81 2yug s TYR 36 Ca 0.43 -0.32 -0.29 0.00 -1.01 0.00 0.00 57.07 55.88 2yug s TYR 36 Cb -0.19 -1.01 -0.03 0.00 -0.11 0.00 0.00 41.96 40.63 2yug s TYR 36 CO 0.23 0.71 1.60 0.42 -1.11 0.00 0.00 175.55 177.41 2yug s ILE 37 N -2.49 3.71 0.33 2.71 1.01 -1.26 -0.31 121.20 124.90 2yug s ILE 37 Ca 0.30 0.80 0.02 0.00 0.00 0.00 0.00 60.65 61.77 2yug s ILE 37 Cb -0.05 -3.71 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 2yug s ILE 37 CO 0.15 -0.28 0.52 -2.28 0.00 0.00 0.00 174.94 173.05 2yug s HIS 38 N 5.11 3.46 0.16 3.97 2.46 0.95 -4.57 115.29 126.82 2yug s HIS 38 Ca 0.71 0.24 0.11 0.00 0.47 0.00 0.00 55.06 56.59 2yug s HIS 38 Cb -0.25 -1.86 -0.04 0.00 -0.13 0.00 0.00 32.58 30.30 2yug s HIS 38 CO 0.29 0.15 -0.22 0.00 -2.47 0.00 0.00 174.74 172.48 2yug s ALA 39 N -2.26 2.56 0.05 1.58 0.00 -1.26 -2.32 121.76 120.11 2yug s ALA 39 Ca 0.40 -1.52 0.09 0.00 0.00 0.00 0.00 51.96 50.92 2yug s ALA 39 Cb -0.09 -0.44 -0.03 0.00 0.00 0.00 0.00 23.12 22.55 2yug s ALA 39 CO 0.35 0.49 -0.26 -0.51 0.00 0.00 0.00 175.76 175.82 2yug s LEU 40 N -2.42 2.18 0.27 0.00 1.43 0.60 -4.90 118.68 115.84 2yug s LEU 40 Ca 0.19 -0.60 0.03 0.00 -1.03 0.00 0.00 54.13 52.71 2yug s LEU 40 Cb -0.09 -1.28 0.39 0.00 0.03 0.00 0.00 46.19 45.23 2yug s LEU 40 CO 0.09 0.25 1.70 -2.24 0.23 0.00 0.00 176.35 176.38 2yug h ASP 41 N 4.72 0.46 -0.05 2.29 3.04 -1.98 -2.67 116.42 122.22 2yug h ASP 41 Ca -0.47 -0.17 0.02 0.00 -3.24 0.00 0.00 57.03 53.17 2yug h ASP 41 Cb 1.14 -0.13 -0.00 0.00 -1.04 0.00 0.00 39.33 39.31 2yug h ASP 41 CO 0.43 0.75 0.05 -1.13 -2.04 0.00 0.00 179.24 177.30 2yug h ASN 42 N 0.39 0.00 0.00 4.15 -1.24 -1.98 -3.45 115.58 113.45 2yug h ASN 42 Ca 0.05 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.06 2yug h ASN 42 Cb 0.73 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.78 2yug h ASN 42 CO 0.06 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.81 2yug n GLY 43 N -1.40 1.97 3.51 1.57 0.00 -1.01 -5.12 105.19 104.72 2yug n GLY 43 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 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 2.03 -0.02 0.99 1.43 -1.24 -4.32 118.68 117.55 2yug s LEU 44 Ca 0.00 -1.62 -0.00 0.00 -1.03 0.00 0.00 54.13 51.48 2yug s LEU 44 Cb 0.00 -0.18 0.02 0.00 0.03 0.00 0.00 46.19 46.06 2yug s LEU 44 CO 0.00 -0.87 0.03 -0.36 0.23 0.00 0.00 176.35 175.37 2yug s PHE 45 N -3.22 0.01 0.07 0.29 0.40 -1.24 -0.29 117.98 114.00 2yug s PHE 45 Ca 0.25 0.11 0.00 0.00 -0.60 0.00 0.00 56.93 56.69 2yug s PHE 45 Cb 0.04 -0.17 -0.04 0.00 0.51 0.00 0.00 43.02 43.36 2yug s PHE 45 CO 0.14 -0.07 -0.04 -0.08 0.70 0.00 0.00 175.22 175.87 2yug s THR 46 N 0.77 0.40 -0.21 0.64 -1.32 -0.98 -3.39 115.64 111.54 2yug s THR 46 Ca -0.06 -1.84 -0.29 0.00 -1.21 0.00 0.00 61.69 58.28 2yug s THR 46 Cb -0.09 -1.56 -0.02 0.00 -1.51 0.00 0.00 72.50 69.31 2yug s THR 46 CO -0.02 -0.94 1.54 -0.22 -2.21 0.00 0.00 174.62 172.77 2yug s LEU 47 N -2.94 3.95 0.67 9.08 2.96 -1.26 -0.03 118.68 131.10 2yug s LEU 47 Ca 0.08 1.61 -0.13 0.00 -0.22 0.00 0.00 54.13 55.48 2yug s LEU 47 Cb 0.07 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.22 2yug s LEU 47 CO -0.08 -1.17 1.07 -0.83 -1.32 0.00 0.00 176.35 174.03 2yug s GLY 48 N 3.76 1.90 0.47 7.98 0.00 0.58 -4.83 107.32 117.18 2yug s GLY 48 Ca 0.68 0.30 -0.24 0.00 0.00 0.00 0.00 44.72 45.46 2yug s GLY 48 CO 0.27 0.63 1.40 0.00 0.00 0.00 0.00 173.10 175.40 2yug n ALA 49 N -2.72 1.85 -1.40 3.20 0.00 -1.26 -3.79 120.51 116.38 2yug n ALA 49 Ca 0.09 0.22 -0.30 0.00 0.00 0.00 0.00 53.44 53.45 2yug n ALA 49 Cb 0.53 -2.37 0.12 0.00 0.00 0.00 0.00 19.45 17.73 2yug n ALA 49 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2yug s PRO 50 N -2.53 1.51 0.15 0.00 0.04 -1.26 -4.60 135.00 128.31 2yug s PRO 50 Ca 0.64 0.63 -0.13 0.00 0.04 0.00 0.00 61.00 62.18 2yug s PRO 50 Cb -0.45 -1.85 -0.07 0.00 0.04 0.00 0.00 34.50 32.17 2yug s PRO 50 CO 0.56 -2.02 0.53 -1.01 0.04 0.00 0.00 177.00 175.09 2yug s HIS 51 N -3.08 3.57 0.01 0.56 3.76 -1.24 -4.96 115.29 113.90 2yug s HIS 51 Ca 0.63 0.99 0.05 0.00 -0.15 0.00 0.00 55.06 56.57 2yug s HIS 51 Cb -0.16 -2.32 -0.24 0.00 1.11 0.00 0.00 32.58 30.97 2yug s HIS 51 CO 0.55 0.41 0.85 -0.09 -0.85 0.00 0.00 174.74 175.62 2yug h ARG 52 N 3.40 0.10 -7.20 1.40 2.43 -1.97 -3.47 114.38 109.08 2yug h ARG 52 Ca -0.48 -0.17 -0.50 0.00 -0.81 0.00 0.00 59.98 58.02 2yug h ARG 52 Cb 1.19 0.06 0.05 0.00 -0.42 0.00 0.00 29.97 30.86 2yug h ARG 52 CO 0.66 0.87 0.29 -1.21 -1.51 0.00 0.00 179.97 179.07 2yug s GLU 53 N -2.63 3.42 -0.06 0.20 2.02 -1.26 -5.02 118.70 115.38 2yug s GLU 53 Ca -0.06 0.44 -0.15 0.00 0.02 0.00 0.00 54.97 55.23 2yug s GLU 53 Cb 0.08 -2.20 -0.30 0.00 0.10 0.00 0.00 34.13 31.81 2yug s GLU 53 CO 0.83 -0.51 0.69 0.28 0.02 0.00 0.00 175.26 176.57 2yug h VAL 54 N -0.16 1.07 -3.42 2.63 2.07 -2.06 -3.42 116.25 112.96 2yug h VAL 54 Ca -0.45 -2.50 -0.71 0.00 0.82 0.00 0.00 66.70 63.86 2yug h VAL 54 Cb 1.21 2.83 -0.32 0.00 -1.52 0.00 0.00 31.29 33.49 2yug h VAL 54 CO 0.62 0.78 -0.42 -0.62 0.02 0.00 0.00 177.57 177.95 2yug s ASP 55 N -7.20 5.53 -0.02 0.57 2.15 -1.26 -4.96 116.67 111.48 2yug s ASP 55 Ca -0.16 -2.13 -0.25 0.00 0.43 0.00 0.00 52.55 50.43 2yug s ASP 55 Cb 0.04 -1.93 0.06 0.00 -0.30 0.00 0.00 42.92 40.79 2yug s ASP 55 CO 0.83 -0.59 0.56 -0.70 -0.17 0.00 0.00 175.17 175.10 2yug s GLU 56 N 1.02 0.97 0.28 4.34 2.56 -1.26 -4.87 118.70 121.73 2yug s GLU 56 Ca 0.09 0.03 0.01 0.00 0.00 0.00 0.00 54.97 55.11 2yug s GLU 56 Cb -0.23 0.45 -0.03 0.00 2.00 0.00 0.00 34.13 36.31 2yug s GLU 56 CO -0.03 -0.31 0.45 0.20 -0.56 0.00 0.00 175.26 175.02 2yug s GLY 57 N -1.42 1.42 1.02 -1.50 0.00 -1.26 -4.85 107.32 100.73 2yug s GLY 57 Ca -0.10 -0.98 -0.14 0.00 0.00 0.00 0.00 44.72 43.50 2yug s GLY 57 CO 0.06 -0.94 1.11 2.56 0.00 0.00 0.00 173.10 175.89 2yug s PRO 58 N -3.96 0.27 0.70 2.90 0.04 -1.26 -5.05 135.00 128.64 2yug s PRO 58 Ca 0.38 0.31 -0.11 0.00 0.04 0.00 0.00 61.00 61.62 2yug s PRO 58 Cb -0.10 -1.74 0.01 0.00 0.04 0.00 0.00 34.50 32.72 2yug s PRO 58 CO 0.32 -2.79 1.08 -1.54 0.04 0.00 0.00 177.00 174.11 2yug s SER 59 N -3.72 5.46 0.18 6.66 1.04 -1.26 -4.87 113.70 117.18 2yug s SER 59 Ca 0.66 1.10 -0.14 0.00 0.48 0.00 0.00 55.95 58.05 2yug s SER 59 Cb -0.16 -1.91 0.16 0.00 0.10 0.00 0.00 66.02 64.22 2yug s SER 59 CO 0.56 -1.32 1.70 -0.65 0.98 0.00 0.00 173.24 174.51 2yug h PRO 60 N -0.62 0.16 0.00 4.02 0.11 -1.96 -1.56 132.00 132.15 2yug h PRO 60 Ca -0.45 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.57 2yug h PRO 60 Cb 1.25 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2yug h PRO 60 CO 0.64 0.10 -0.41 -1.00 -0.21 0.00 0.00 178.00 177.12 2yug h PRO 61 N 0.16 0.00 -0.05 1.05 0.13 -1.94 -3.07 132.00 128.28 2yug h PRO 61 Ca 0.23 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.24 2yug h PRO 61 Cb 0.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 2yug h PRO 61 CO -0.34 0.41 -0.52 0.93 -0.23 0.00 0.00 178.00 178.24 2yug h GLU 62 N 0.00 0.15 -7.24 0.86 5.08 -1.58 -3.30 114.58 108.54 2yug h GLU 62 Ca -0.00 -0.09 -0.50 0.00 -1.00 0.00 0.00 59.36 57.77 2yug h GLU 62 Cb 0.96 0.01 0.08 0.00 0.50 0.00 0.00 28.75 30.29 2yug h GLU 62 CO 0.05 0.63 0.37 -0.65 -1.00 0.00 0.00 179.01 178.42 2yug s GLN 63 N -3.89 3.08 0.03 2.33 -0.21 -0.67 -4.73 119.66 115.59 2yug s GLN 63 Ca -0.03 1.15 0.02 0.00 0.02 0.00 0.00 55.36 56.52 2yug s GLN 63 Cb 0.13 -2.00 -0.02 0.00 1.00 0.00 0.00 33.01 32.12 2yug s GLN 63 CO 0.77 -1.00 -0.06 -0.06 -2.12 0.00 0.00 175.29 172.82 2yug s PHE 64 N -2.63 0.51 -0.28 0.91 0.08 -0.11 -3.21 117.98 113.25 2yug s PHE 64 Ca 0.62 -0.38 -0.11 0.00 0.12 0.00 0.00 56.93 57.18 2yug s PHE 64 Cb -0.16 -0.32 -0.05 0.00 -0.57 0.00 0.00 43.02 41.93 2yug s PHE 64 CO 0.44 -0.08 0.21 0.99 -0.10 0.00 0.00 175.22 176.68 2yug s THR 65 N -1.02 5.30 0.10 0.64 2.01 -0.46 0.35 115.64 122.56 2yug s THR 65 Ca -0.08 0.17 -0.12 0.00 0.31 0.00 0.00 61.69 61.97 2yug s THR 65 Cb -0.08 -3.56 -0.06 0.00 0.01 0.00 0.00 72.50 68.82 2yug s THR 65 CO 0.00 0.22 0.47 0.00 -0.69 0.00 0.00 174.62 174.62 2yug s ALA 66 N 1.78 3.66 -0.07 7.40 0.00 0.08 -0.57 121.76 134.04 2yug s ALA 66 Ca 0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 51.96 51.76 2yug s ALA 66 Cb -0.16 -2.40 0.04 0.00 0.00 0.00 0.00 23.12 20.60 2yug s ALA 66 CO 0.11 0.51 0.12 0.08 0.00 0.00 0.00 175.76 176.57 2yug s VAL 67 N -1.38 -0.20 0.47 0.00 1.01 -0.17 -2.55 120.40 117.59 2yug s VAL 67 Ca 0.34 0.38 -0.23 0.00 0.00 0.00 0.00 61.98 62.47 2yug s VAL 67 Cb -0.15 -0.23 -0.07 0.00 0.00 0.00 0.00 36.38 35.93 2yug s VAL 67 CO 0.18 0.16 1.17 -0.54 0.00 0.00 0.00 175.10 176.07 2yug s LYS 68 N 2.21 3.71 0.00 2.72 1.02 -1.26 -0.15 119.74 127.99 2yug s LYS 68 Ca 0.04 1.79 0.00 0.00 0.02 0.00 0.00 55.97 57.82 2yug s LYS 68 Cb -0.12 -2.38 0.00 0.00 -0.52 0.00 0.00 37.83 34.81 2yug s LYS 68 CO -0.05 -0.60 0.00 1.28 -0.92 0.00 0.00 175.35 175.07 2yug n LEU 69 N -0.55 0.00 0.00 3.17 4.77 -0.74 -4.90 117.00 118.75 2yug n LEU 69 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2yug n LEU 69 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2yug n LEU 69 CO 0.48 -0.33 0.00 -0.24 -1.33 0.00 0.00 177.39 175.96 2yug n SER 70 N -2.00 0.00 -2.88 -1.43 2.88 -1.24 -4.98 113.62 103.97 2yug n SER 70 Ca 0.00 0.00 -0.22 0.00 -1.33 0.00 0.00 58.87 57.32 2yug n SER 70 Cb 0.00 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 63.49 2yug n SER 70 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2yug n ASP 71 N 0.00 -6.13 -3.47 -3.46 9.92 -1.26 -2.03 116.55 110.13 2yug n ASP 71 Ca 0.00 -0.23 -0.21 0.00 -0.53 0.00 0.00 54.79 53.82 2yug n ASP 71 Cb 0.00 -4.97 0.08 0.00 -0.64 0.00 0.00 41.12 35.59 2yug n ASP 71 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 2yug n SER 72 N -2.41 -4.75 -4.20 -2.24 2.88 -1.26 -5.00 113.62 96.63 2yug n SER 72 Ca -0.14 -0.55 -0.31 0.00 -1.33 0.00 0.00 58.87 56.53 2yug n SER 72 Cb 0.64 -4.96 -0.17 0.00 -0.75 0.00 0.00 64.21 58.97 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 -5.94 2.92 0.11 -1.46 1.81 -0.86 -4.26 118.95 111.27 2yug s ARG 73 Ca 0.37 -0.83 0.10 0.00 -1.72 0.00 0.00 55.73 53.64 2yug s ARG 73 Cb -0.16 -2.22 -0.04 0.00 -0.45 0.00 0.00 34.95 32.08 2yug s ARG 73 CO 0.71 0.16 -0.24 0.96 -0.68 0.00 0.00 175.30 176.21 2yug s ILE 74 N 0.38 2.40 -0.20 1.52 -4.36 -1.17 -1.79 121.20 117.98 2yug s ILE 74 Ca -0.18 -1.60 -0.07 0.00 -0.26 0.00 0.00 60.65 58.54 2yug s ILE 74 Cb -0.18 -2.05 -0.04 0.00 1.25 0.00 0.00 42.46 41.45 2yug s ILE 74 CO 0.08 0.16 0.07 0.00 0.24 0.00 0.00 174.94 175.49 2yug s ALA 75 N -1.02 3.34 -0.14 2.27 0.00 0.78 -2.69 121.76 124.30 2yug s ALA 75 Ca 0.14 -0.86 -0.11 0.00 0.00 0.00 0.00 51.96 51.14 2yug s ALA 75 Cb -0.10 -1.98 -0.05 0.00 0.00 0.00 0.00 23.12 20.99 2yug s ALA 75 CO 0.06 -0.02 0.22 -0.51 0.00 0.00 0.00 175.76 175.51 2yug s LEU 76 N 0.75 4.31 -0.21 0.00 1.43 -1.25 -1.00 118.68 122.71 2yug s LEU 76 Ca 0.04 0.48 0.01 0.00 -1.03 0.00 0.00 54.13 53.63 2yug s LEU 76 Cb -0.13 -2.23 0.03 0.00 0.03 0.00 0.00 46.19 43.88 2yug s LEU 76 CO 0.02 0.25 -0.15 -0.75 0.23 0.00 0.00 176.35 175.94 2yug s LYS 77 N -0.23 2.80 0.69 1.70 2.20 0.26 -2.33 119.74 124.83 2yug s LYS 77 Ca 0.15 -0.97 -0.16 0.00 -0.36 0.00 0.00 55.97 54.62 2yug s LYS 77 Cb -0.13 -2.73 0.02 0.00 -1.51 0.00 0.00 37.83 33.48 2yug s LYS 77 CO 0.04 -0.33 1.24 -1.54 -0.36 0.00 0.00 175.35 174.41 2yug s SER 78 N 1.26 4.37 0.51 1.43 1.04 0.27 -1.36 113.70 121.22 2yug s SER 78 Ca 0.01 2.48 0.16 0.00 0.48 0.00 0.00 55.95 59.07 2yug s SER 78 Cb -0.15 -2.60 1.25 0.00 0.10 0.00 0.00 66.02 64.61 2yug s SER 78 CO -0.09 -2.15 2.14 1.23 0.98 0.00 0.00 173.24 175.34 2yug h GLY 79 N 0.09 0.04 1.92 7.32 0.00 -1.63 -1.29 103.07 109.51 2yug h GLY 79 Ca -0.49 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 2yug h GLY 79 CO 0.51 0.01 -0.08 -0.97 0.00 0.00 0.00 176.54 176.01 2yug h TYR 80 N 0.03 0.10 0.00 5.60 0.05 -1.86 -3.46 116.97 117.43 2yug h TYR 80 Ca 0.02 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.80 2yug h TYR 80 Cb 0.04 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 37.75 2yug h TYR 80 CO -0.00 0.19 0.00 0.41 -1.05 0.00 0.00 178.16 177.71 2yug n GLY 81 N -1.17 1.48 3.31 3.88 0.00 -0.49 -5.15 105.19 107.05 2yug n GLY 81 Ca -0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.07 1.44 -0.13 1.61 1.02 -1.23 -4.77 119.74 117.60 2yug s LYS 82 Ca 0.00 -1.79 -0.06 0.00 0.02 0.00 0.00 55.97 54.14 2yug s LYS 82 Cb 0.00 -0.13 -0.04 0.00 -0.52 0.00 0.00 37.83 37.14 2yug s LYS 82 CO 0.00 -0.36 0.08 0.71 -0.92 0.00 0.00 175.35 174.86 2yug s TYR 83 N -3.77 3.36 -0.67 3.18 2.02 0.40 0.94 117.35 122.81 2yug s TYR 83 Ca 0.37 0.29 -0.26 0.00 -0.37 0.00 0.00 57.07 57.10 2yug s TYR 83 Cb 0.07 -1.95 -0.02 0.00 -0.40 0.00 0.00 41.96 39.66 2yug s TYR 83 CO 0.15 0.47 1.78 -0.51 -1.57 0.00 0.00 175.55 175.87 2yug s LEU 84 N -0.51 3.26 -0.12 -1.29 1.43 -0.99 -3.88 118.68 116.59 2yug s LEU 84 Ca 0.11 0.07 0.01 0.00 -1.03 0.00 0.00 54.13 53.29 2yug s LEU 84 Cb -0.12 -2.54 -0.01 0.00 0.03 0.00 0.00 46.19 43.56 2yug s LEU 84 CO 0.02 -2.33 -0.17 -0.83 0.23 0.00 0.00 176.35 173.27 2yug s GLY 85 N 7.42 1.46 0.14 -3.19 0.00 0.73 -4.04 107.32 109.83 2yug s GLY 85 Ca 0.63 -0.94 -0.30 0.00 0.00 0.00 0.00 44.72 44.10 2yug s GLY 85 CO 0.17 -0.20 1.22 -0.26 0.00 0.00 0.00 173.10 174.03 2yug s ILE 86 N 0.43 3.67 0.99 0.90 -4.36 -1.11 -2.71 121.20 119.01 2yug s ILE 86 Ca -0.13 1.31 -0.16 0.00 -0.26 0.00 0.00 60.65 61.42 2yug s ILE 86 Cb -0.17 -3.84 0.20 0.00 1.25 0.00 0.00 42.46 39.90 2yug s ILE 86 CO 0.06 0.16 1.23 0.20 0.24 0.00 0.00 174.94 176.83 2yug s ASN 87 N 0.53 2.83 0.24 4.36 0.01 -0.96 -4.80 114.94 117.16 2yug s ASN 87 Ca 0.56 0.53 -0.05 0.00 -0.71 0.00 0.00 52.86 53.19 2yug s ASN 87 Cb -0.32 -0.77 0.24 0.00 0.41 0.00 0.00 41.25 40.81 2yug s ASN 87 CO 0.34 -2.93 1.78 0.28 -1.51 0.00 0.00 177.10 175.06 2yug h SER 88 N -1.77 0.97 0.33 -1.22 0.02 -1.96 -2.47 113.55 107.46 2yug h SER 88 Ca -0.46 -0.18 -0.10 0.00 -0.84 0.00 0.00 61.79 60.22 2yug h SER 88 Cb 1.28 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.55 2yug h SER 88 CO 0.45 0.91 -0.41 0.44 -1.14 0.00 0.00 176.83 177.08 2yug h ASP 89 N 1.00 0.11 0.00 3.07 3.32 -2.03 -3.47 116.42 118.43 2yug h ASP 89 Ca 0.22 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2yug h ASP 89 Cb 0.29 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.81 2yug h ASP 89 CO -0.01 0.52 0.00 0.61 -1.72 0.00 0.00 179.24 178.64 2yug n GLY 90 N -0.27 1.92 3.56 2.75 0.00 -0.93 -4.93 105.19 107.30 2yug n GLY 90 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 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 3.61 -0.32 0.99 2.96 -1.26 0.87 118.68 125.53 2yug s LEU 91 Ca 0.00 -0.03 -0.28 0.00 -0.22 0.00 0.00 54.13 53.60 2yug s LEU 91 Cb 0.00 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.74 2yug s LEU 91 CO 0.00 0.13 2.02 -0.69 -1.32 0.00 0.00 176.35 176.49 2yug s VAL 92 N 0.63 3.24 0.26 1.68 1.01 0.01 -2.26 120.40 124.98 2yug s VAL 92 Ca 0.02 0.24 0.06 0.00 0.00 0.00 0.00 61.98 62.29 2yug s VAL 92 Cb -0.13 -3.36 -0.06 0.00 0.00 0.00 0.00 36.38 32.83 2yug s VAL 92 CO 0.02 -0.25 -0.05 0.68 0.00 0.00 0.00 175.10 175.50 2yug s VAL 93 N 8.08 1.45 -0.31 2.92 -7.23 -1.10 -3.67 120.40 120.54 2yug s VAL 93 Ca 0.89 -2.10 -0.02 0.00 -1.81 0.00 0.00 61.98 58.94 2yug s VAL 93 Cb -0.25 -2.39 0.12 0.00 0.56 0.00 0.00 36.38 34.42 2yug s VAL 93 CO 0.33 -0.33 0.19 -0.83 -0.31 0.00 0.00 175.10 174.15 2yug s GLY 94 N -3.39 0.49 -0.43 2.32 0.00 -1.26 -0.20 107.32 104.85 2yug s GLY 94 Ca 0.29 -1.21 0.08 0.00 0.00 0.00 0.00 44.72 43.88 2yug s GLY 94 CO 0.10 2.19 0.85 0.54 0.00 0.00 0.00 173.10 176.78 2yug n ARG 95 N 4.85 0.90 -3.64 2.90 1.74 -1.25 -4.80 116.66 117.37 2yug n ARG 95 Ca 0.01 -2.57 -0.06 0.00 -0.77 0.00 0.00 57.85 54.46 2yug n ARG 95 Cb 0.41 -1.35 -0.07 0.00 -1.02 0.00 0.00 32.46 30.43 2yug n ARG 95 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2yug s SER 96 N -1.69 -0.45 -0.44 0.55 0.15 -1.26 -4.97 113.70 105.59 2yug s SER 96 Ca 0.32 0.79 0.03 0.00 0.70 0.00 0.00 55.95 57.80 2yug s SER 96 Cb 0.28 0.97 0.62 0.00 -1.71 0.00 0.00 66.02 66.17 2yug s SER 96 CO -0.11 -0.13 1.88 0.47 1.20 0.00 0.00 173.24 176.55 2yug n ASP 97 N 2.80 3.92 -4.28 5.45 8.00 -1.26 -0.45 116.55 130.73 2yug n ASP 97 Ca -0.15 -3.53 -0.15 0.00 0.71 0.00 0.00 54.79 51.67 2yug n ASP 97 Cb 0.57 -0.83 -0.10 0.00 -0.02 0.00 0.00 41.12 40.73 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 -3.14 1.55 -1.03 2.24 0.00 -1.26 -5.01 121.76 115.11 2yug s ALA 98 Ca 0.54 -1.72 -0.06 0.00 0.00 0.00 0.00 51.96 50.72 2yug s ALA 98 Cb 0.45 0.75 0.26 0.00 0.00 0.00 0.00 23.12 24.58 2yug s ALA 98 CO 0.10 -0.37 1.00 -0.89 0.00 0.00 0.00 175.76 175.60 2yug n ILE 99 N -0.35 3.98 -2.47 0.00 5.41 -1.26 -4.74 119.36 119.93 2yug n ILE 99 Ca -0.04 -5.31 -0.25 0.00 1.00 0.00 0.00 62.75 58.16 2yug n ILE 99 Cb 0.64 -2.48 0.12 0.00 -0.71 0.00 0.00 39.64 37.22 2yug n ILE 99 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2yug s GLY 100 N 0.54 1.76 0.18 7.39 0.00 -1.26 -4.84 107.32 111.09 2yug s GLY 100 Ca 0.30 -1.66 -0.15 0.00 0.00 0.00 0.00 44.72 43.22 2yug s GLY 100 CO -0.09 -1.04 1.67 -2.55 0.00 0.00 0.00 173.10 171.09 2yug h PRO 101 N -0.74 0.06 -0.08 2.90 0.11 -1.96 0.58 132.00 132.87 2yug h PRO 101 Ca -0.37 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.71 2yug h PRO 101 Cb 1.26 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2yug h PRO 101 CO 0.39 0.04 -0.05 0.00 -0.21 0.00 0.00 178.00 178.17 2yug h ARG 102 N 0.06 0.11 -0.01 1.05 3.08 -1.93 -1.79 114.38 114.96 2yug h ARG 102 Ca 0.24 -0.02 -0.16 0.00 0.07 0.00 0.00 59.98 60.12 2yug h ARG 102 Cb 0.37 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 2yug h ARG 102 CO -0.45 0.18 -0.73 0.93 -1.07 0.00 0.00 179.97 178.83 2yug h GLU 103 N 0.11 0.05 -6.99 0.04 3.07 -1.10 -2.95 114.58 106.81 2yug h GLU 103 Ca 0.03 -0.05 -0.53 0.00 -0.50 0.00 0.00 59.36 58.31 2yug h GLU 103 Cb 0.17 0.01 0.11 0.00 -0.84 0.00 0.00 28.75 28.20 2yug h GLU 103 CO 0.01 0.76 0.62 -0.65 -1.40 0.00 0.00 179.01 178.34 2yug s GLN 104 N -3.38 3.63 0.24 2.33 -0.21 -0.26 -4.41 119.66 117.59 2yug s GLN 104 Ca -0.01 2.20 0.03 0.00 0.02 0.00 0.00 55.36 57.60 2yug s GLN 104 Cb 0.12 -2.54 -0.05 0.00 1.00 0.00 0.00 33.01 31.54 2yug s GLN 104 CO 0.79 -0.79 0.02 -1.58 -2.12 0.00 0.00 175.29 171.61 2yug s TRP 105 N -1.30 1.57 -0.34 0.91 0.52 -1.10 -3.80 118.94 115.41 2yug s TRP 105 Ca 0.63 -0.98 0.01 0.00 0.02 0.00 0.00 56.10 55.79 2yug s TRP 105 Cb -0.39 -0.92 0.15 0.00 -1.15 0.00 0.00 33.47 31.15 2yug s TRP 105 CO 0.49 -0.10 0.32 -2.00 0.02 0.00 0.00 176.95 175.68 2yug s GLU 106 N -3.90 0.51 0.65 4.98 2.12 -0.63 -3.01 118.70 119.43 2yug s GLU 106 Ca 0.30 -0.66 -0.16 0.00 0.36 0.00 0.00 54.97 54.82 2yug s GLU 106 Cb 0.06 -0.77 -0.00 0.00 0.26 0.00 0.00 34.13 33.68 2yug s GLU 106 CO 0.10 -1.14 1.13 -1.25 -0.54 0.00 0.00 175.26 173.56 2yug s PRO 107 N 1.72 2.78 0.17 4.30 0.04 -1.26 -2.74 135.00 140.02 2yug s PRO 107 Ca 0.14 1.48 0.06 0.00 0.04 0.00 0.00 61.00 62.73 2yug s PRO 107 Cb -0.16 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.40 2yug s PRO 107 CO -0.14 -1.28 -0.13 0.08 0.04 0.00 0.00 177.00 175.57 2yug s VAL 108 N -2.20 1.47 -0.24 -0.36 1.01 -1.16 -4.93 120.40 114.00 2yug s VAL 108 Ca 0.69 -2.05 -0.03 0.00 0.00 0.00 0.00 61.98 60.59 2yug s VAL 108 Cb -0.22 -1.87 0.12 0.00 0.00 0.00 0.00 36.38 34.41 2yug s VAL 108 CO 0.40 -0.60 0.33 -0.36 0.00 0.00 0.00 175.10 174.87 2yug s PHE 109 N -2.90 -0.66 -0.08 5.22 0.08 -1.26 -3.54 117.98 114.84 2yug s PHE 109 Ca 0.18 0.57 -0.02 0.00 0.12 0.00 0.00 56.93 57.78 2yug s PHE 109 Cb -0.01 -0.13 0.03 0.00 -0.57 0.00 0.00 43.02 42.35 2yug s PHE 109 CO 0.04 -0.72 0.01 -1.14 -0.10 0.00 0.00 175.22 173.31 2yug s GLN 110 N 2.47 0.53 -1.77 0.44 0.74 -1.17 -4.80 119.66 116.11 2yug s GLN 110 Ca 0.11 0.11 0.00 0.00 0.05 0.00 0.00 55.36 55.63 2yug s GLN 110 Cb -0.15 -0.99 0.00 0.00 1.10 0.00 0.00 33.01 32.96 2yug s GLN 110 CO -0.17 -0.33 0.00 -0.25 -0.55 0.00 0.00 175.29 173.99 2yug n ASP 111 N 5.16 -5.69 0.00 6.67 8.00 -1.26 -1.24 116.55 128.19 2yug n ASP 111 Ca -0.07 0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.49 2yug n ASP 111 Cb 0.50 -4.78 0.00 0.00 -0.02 0.00 0.00 41.12 36.82 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 -0.93 2.98 3.32 0.44 0.00 -1.26 -5.04 105.19 104.70 2yug n GLY 112 Ca -0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.13 -2.90 -0.24 1.61 1.02 -0.37 -5.02 119.74 113.71 2yug s LYS 113 Ca 0.00 0.07 -0.29 0.00 0.02 0.00 0.00 55.97 55.77 2yug s LYS 113 Cb 0.00 -1.39 0.16 0.00 -0.52 0.00 0.00 37.83 36.09 2yug s LYS 113 CO 0.00 -4.84 1.21 0.00 -0.92 0.00 0.00 175.35 170.80 2yug s MET 114 N -5.16 0.29 -0.25 1.68 0.23 -1.26 -3.02 119.30 111.81 2yug s MET 114 Ca 0.69 0.11 -0.19 0.00 -1.03 0.00 0.00 55.69 55.27 2yug s MET 114 Cb -0.12 0.14 0.07 0.00 -1.53 0.00 0.00 34.83 33.39 2yug s MET 114 CO 0.57 -0.08 0.63 0.00 -2.03 0.00 0.00 175.02 174.11 2yug s ALA 115 N -0.87 -1.62 -0.54 3.16 0.00 -1.23 -2.45 121.76 118.20 2yug s ALA 115 Ca 0.04 1.98 -0.28 0.00 0.00 0.00 0.00 51.96 53.70 2yug s ALA 115 Cb -0.01 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 21.96 2yug s ALA 115 CO -0.05 -0.32 1.43 -1.17 0.00 0.00 0.00 175.76 175.65 2yug s LEU 116 N 0.89 3.43 -0.07 0.00 2.96 -1.26 -2.97 118.68 121.65 2yug s LEU 116 Ca -0.04 0.38 -0.19 0.00 -0.22 0.00 0.00 54.13 54.06 2yug s LEU 116 Cb -0.05 -3.12 -0.05 0.00 0.50 0.00 0.00 46.19 43.48 2yug s LEU 116 CO -0.08 -1.69 0.53 -0.22 -1.32 0.00 0.00 176.35 173.57 2yug s LEU 117 N 6.08 4.34 0.90 -0.68 2.96 -1.11 -3.05 118.68 128.12 2yug s LEU 117 Ca 0.55 0.96 -0.13 0.00 -0.22 0.00 0.00 54.13 55.29 2yug s LEU 117 Cb -0.11 -2.79 0.14 0.00 0.50 0.00 0.00 46.19 43.92 2yug s LEU 117 CO 0.26 0.04 1.19 0.00 -1.32 0.00 0.00 176.35 176.52 2yug s ALA 118 N 0.27 2.12 -1.01 5.97 0.00 0.10 -1.60 121.76 127.61 2yug s ALA 118 Ca 0.28 -0.73 0.15 0.00 0.00 0.00 0.00 51.96 51.66 2yug s ALA 118 Cb -0.16 -2.95 0.63 0.00 0.00 0.00 0.00 23.12 20.64 2yug s ALA 118 CO 0.13 -2.17 1.47 0.45 0.00 0.00 0.00 175.76 175.64 2yug n SER 119 N -3.66 0.00 -1.57 0.00 2.88 -1.25 -2.42 113.62 107.60 2yug n SER 119 Ca 0.09 0.49 0.00 0.00 -1.33 0.00 0.00 58.87 58.12 2yug n SER 119 Cb 0.60 -0.49 0.25 0.00 -0.75 0.00 0.00 64.21 63.82 2yug n SER 119 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2yug n ASN 120 N -1.49 4.20 -3.64 -3.46 0.23 -1.26 -4.90 115.26 104.93 2yug n ASN 120 Ca 0.04 -2.76 -0.21 0.00 -0.53 0.00 0.00 54.58 51.11 2yug n ASN 120 Cb 0.17 -0.66 0.05 0.00 -2.08 0.00 0.00 39.78 37.27 2yug n ASN 120 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 2yug n SER 121 N 0.21 -2.22 -3.68 0.53 7.64 -1.02 -5.00 113.62 110.09 2yug n SER 121 Ca 0.24 -0.74 -0.14 0.00 1.01 0.00 0.00 58.87 59.25 2yug n SER 121 Cb 1.01 -4.41 -0.09 0.00 -1.01 0.00 0.00 64.21 59.71 2yug n SER 121 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2yug n PHE 123 N 2.77 -3.91 -4.08 0.00 3.72 -1.20 0.03 117.46 114.79 2yug n PHE 123 Ca -0.14 -1.00 -0.14 0.00 -0.05 0.00 0.00 57.45 56.13 2yug n PHE 123 Cb 0.56 -1.15 -0.12 0.00 -0.94 0.00 0.00 39.48 37.83 2yug n PHE 123 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 2yug s ILE 124 N -3.00 0.55 0.28 4.37 -4.36 -1.17 -0.99 121.20 116.88 2yug s ILE 124 Ca 0.72 -0.98 -0.20 0.00 -0.26 0.00 0.00 60.65 59.93 2yug s ILE 124 Cb -0.07 -0.60 0.05 0.00 1.25 0.00 0.00 42.46 43.09 2yug s ILE 124 CO 0.55 -0.31 0.83 0.00 0.24 0.00 0.00 174.94 176.25 2yug s ARG 125 N -1.39 1.76 0.21 0.37 1.70 -0.67 -4.87 118.95 116.07 2yug s ARG 125 Ca -0.08 -1.05 0.10 0.00 -0.47 0.00 0.00 55.73 54.23 2yug s ARG 125 Cb -0.09 0.55 -0.05 0.00 -0.57 0.00 0.00 34.95 34.79 2yug s ARG 125 CO 0.00 -0.82 -0.20 0.00 -1.08 0.00 0.00 175.30 173.21 2yug s ASN 127 N -2.98 4.98 0.28 0.00 0.01 -1.11 -4.94 114.94 111.19 2yug s ASN 127 Ca 0.22 -0.95 0.05 0.00 -0.71 0.00 0.00 52.86 51.47 2yug s ASN 127 Cb -0.06 0.45 0.42 0.00 0.41 0.00 0.00 41.25 42.48 2yug s ASN 127 CO 0.10 -1.41 1.69 -0.33 -1.51 0.00 0.00 177.10 175.64 2yug h GLU 128 N 0.16 0.32 -0.02 -0.60 5.08 -2.02 -2.83 114.58 114.66 2yug h GLU 128 Ca -0.29 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 57.82 2yug h GLU 128 Cb 1.29 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2yug h GLU 128 CO 0.41 0.66 -0.49 0.00 -1.00 0.00 0.00 179.01 178.59 2yug h ALA 129 N 1.33 1.15 0.00 3.43 0.00 -2.02 -3.47 119.26 119.68 2yug h ALA 129 Ca 0.03 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2yug h ALA 129 Cb 0.80 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2yug h ALA 129 CO 0.06 0.62 0.00 0.41 0.00 0.00 0.00 179.25 180.34 2yug n GLY 130 N -0.10 1.90 3.26 0.00 0.00 -1.07 -4.98 105.19 104.20 2yug n GLY 130 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.00 5.62 -0.44 1.61 1.11 -1.26 -4.23 116.67 117.07 2yug s ASP 131 Ca 0.00 -1.56 -0.26 0.00 0.18 0.00 0.00 52.55 50.91 2yug s ASP 131 Cb 0.00 -1.98 0.02 0.00 1.07 0.00 0.00 42.92 42.04 2yug s ASP 131 CO 0.00 -0.55 0.94 -0.63 1.18 0.00 0.00 175.17 176.12 2yug s ILE 132 N 1.40 4.47 0.22 0.77 1.01 -1.22 -2.73 121.20 125.13 2yug s ILE 132 Ca 0.03 0.87 0.01 0.00 0.00 0.00 0.00 60.65 61.57 2yug s ILE 132 Cb -0.23 -4.43 -0.05 0.00 0.01 0.00 0.00 42.46 37.76 2yug s ILE 132 CO 0.01 -0.79 0.07 -1.83 0.00 0.00 0.00 174.94 172.40 2yug s GLU 133 N 3.76 1.29 -0.09 2.79 4.04 -0.39 -0.81 118.70 129.30 2yug s GLU 133 Ca 0.38 -1.67 -0.24 0.00 0.04 0.00 0.00 54.97 53.47 2yug s GLU 133 Cb -0.10 -0.21 -0.03 0.00 0.02 0.00 0.00 34.13 33.81 2yug s GLU 133 CO 0.25 -0.25 0.76 0.00 -1.84 0.00 0.00 175.26 174.18 2yug s ALA 134 N -3.76 3.36 0.59 -0.84 0.00 0.25 -1.66 121.76 119.70 2yug s ALA 134 Ca 0.33 0.14 0.03 0.00 0.00 0.00 0.00 51.96 52.46 2yug s ALA 134 Cb 0.07 -3.06 0.07 0.00 0.00 0.00 0.00 23.12 20.20 2yug s ALA 134 CO 0.10 -0.26 0.82 0.15 0.00 0.00 0.00 175.76 176.58 2yug s LYS 135 N 1.16 2.26 1.30 0.00 -0.14 -0.16 -4.96 119.74 119.20 2yug s LYS 135 Ca 0.39 -1.07 -0.17 0.00 -1.36 0.00 0.00 55.97 53.76 2yug s LYS 135 Cb -0.18 -2.49 0.33 0.00 -1.68 0.00 0.00 37.83 33.81 2yug s LYS 135 CO 0.18 -0.92 0.97 -0.80 -0.76 0.00 0.00 175.35 174.02 2yug s ASN 136 N -4.55 -0.11 0.54 2.83 -0.87 -1.26 -3.26 114.94 108.26 2yug s ASN 136 Ca 0.61 1.26 0.20 0.00 -1.57 0.00 0.00 52.86 53.36 2yug s ASN 136 Cb -0.08 -1.91 1.44 0.00 -0.02 0.00 0.00 41.25 40.68 2yug s ASN 136 CO 0.40 -4.83 2.18 0.11 -2.57 0.00 0.00 177.10 172.38 2yug h LYS 137 N -3.06 0.00 -6.47 -0.60 1.57 -1.96 -3.33 116.57 102.73 2yug h LYS 137 Ca -0.56 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 57.67 2yug h LYS 137 Cb 1.34 0.00 0.04 0.00 0.08 0.00 0.00 32.23 33.69 2yug h LYS 137 CO 0.42 0.00 1.04 0.25 -0.57 0.00 0.00 179.45 180.58 2yug n THR 138 N -4.33 0.31 -3.22 -0.16 -2.24 -1.26 -4.79 114.28 98.60 2yug n THR 138 Ca -0.03 -0.06 -0.45 0.00 -2.27 0.00 0.00 64.05 61.25 2yug n THR 138 Cb 0.10 -1.95 -0.06 0.00 -2.10 0.00 0.00 70.33 66.32 2yug n THR 138 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2yug s ALA 139 N 2.52 3.48 1.04 6.98 0.00 -1.26 -4.93 121.76 129.59 2yug s ALA 139 Ca 0.83 -2.14 -0.17 0.00 0.00 0.00 0.00 51.96 50.49 2yug s ALA 139 Cb -0.56 -3.34 0.22 0.00 0.00 0.00 0.00 23.12 19.44 2yug s ALA 139 CO 0.40 -2.08 1.21 0.20 0.00 0.00 0.00 175.76 175.49 2yug s GLY 140 N 3.17 1.67 0.15 0.00 0.00 -1.26 -4.94 107.32 106.11 2yug s GLY 140 Ca 0.09 -0.99 -0.11 0.00 0.00 0.00 0.00 44.72 43.72 2yug s GLY 140 CO 0.07 -0.21 1.54 0.83 0.00 0.00 0.00 173.10 175.33 2yug h GLU 141 N -1.97 0.96 0.00 2.90 5.08 -1.98 -2.99 114.58 116.58 2yug h GLU 141 Ca -0.46 -0.40 -0.13 0.00 -1.00 0.00 0.00 59.36 57.37 2yug h GLU 141 Cb 1.27 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 2yug h GLU 141 CO 0.41 1.07 -0.61 0.93 -1.00 0.00 0.00 179.01 179.81 2yug h GLU 142 N 0.81 0.00 -0.28 2.33 5.08 -1.96 -3.12 114.58 117.44 2yug h GLU 142 Ca 0.11 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.55 2yug h GLU 142 Cb 0.76 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 2yug h GLU 142 CO 0.06 0.61 0.20 0.93 -1.00 0.00 0.00 179.01 179.81 2yug h GLU 143 N 0.00 0.00 -6.42 2.33 4.39 -1.89 -3.42 114.58 109.57 2yug h GLU 143 Ca -0.01 -0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.16 2yug h GLU 143 Cb 1.22 -0.00 0.03 0.00 -0.10 0.00 0.00 28.75 29.90 2yug h GLU 143 CO 0.08 0.00 1.16 -1.33 -1.16 0.00 0.00 179.01 177.76 2yug n MET 144 N -4.46 2.77 -3.94 2.33 2.81 -1.18 -4.84 117.12 110.62 2yug n MET 144 Ca 0.04 1.01 -0.22 0.00 -1.81 0.00 0.00 57.70 56.71 2yug n MET 144 Cb 0.36 -2.93 -0.05 0.00 -0.71 0.00 0.00 33.22 29.89 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 3.56 3.05 -0.36 2.02 -4.36 -1.03 -4.90 121.20 119.19 2yug s ILE 145 Ca 0.86 -1.55 0.01 0.00 -0.26 0.00 0.00 60.65 59.71 2yug s ILE 145 Cb -0.48 -3.04 0.10 0.00 1.25 0.00 0.00 42.46 40.29 2yug s ILE 145 CO 0.41 -0.14 0.10 -0.54 0.24 0.00 0.00 174.94 175.01 2yug s LYS 146 N -3.93 1.73 -0.05 0.37 1.02 -0.76 -4.61 119.74 113.51 2yug s LYS 146 Ca 0.40 -1.82 -0.30 0.00 0.02 0.00 0.00 55.97 54.27 2yug s LYS 146 Cb -0.03 -3.34 -0.03 0.00 -0.52 0.00 0.00 37.83 33.92 2yug s LYS 146 CO 0.24 -0.97 1.08 0.42 -0.92 0.00 0.00 175.35 175.21 2yug s ILE 147 N 1.01 4.55 -0.02 2.17 1.01 -1.26 -2.69 121.20 125.97 2yug s ILE 147 Ca 0.09 1.84 0.06 0.00 0.00 0.00 0.00 60.65 62.64 2yug s ILE 147 Cb -0.20 -4.18 -0.01 0.00 0.01 0.00 0.00 42.46 38.07 2yug s ILE 147 CO -0.06 0.04 -0.21 -0.13 0.00 0.00 0.00 174.94 174.58 2yug s ARG 148 N 1.77 1.75 0.15 2.79 0.52 0.32 -3.22 118.95 123.03 2yug s ARG 148 Ca 0.53 -0.75 0.08 0.00 -0.52 0.00 0.00 55.73 55.07 2yug s ARG 148 Cb -0.22 -1.67 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 2yug s ARG 148 CO 0.22 0.43 -0.10 0.45 0.02 0.00 0.00 175.30 176.33 2yug s SER 149 N -0.44 4.30 -0.15 0.23 0.15 0.17 -0.23 113.70 117.74 2yug s SER 149 Ca 0.07 -0.51 0.18 0.00 0.70 0.00 0.00 55.95 56.39 2yug s SER 149 Cb -0.09 -0.76 0.44 0.00 -1.71 0.00 0.00 66.02 63.91 2yug s SER 149 CO -0.00 0.13 1.18 0.00 1.20 0.00 0.00 173.24 175.75 2yug n ALA 151 N -0.37 -1.01 -2.13 0.00 0.00 -1.26 -4.97 120.51 110.77 2yug n ALA 151 Ca 0.15 -1.22 -0.42 0.00 0.00 0.00 0.00 53.44 51.95 2yug n ALA 151 Cb 0.92 -0.05 -0.03 0.00 0.00 0.00 0.00 19.45 20.30 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 -4.99 4.19 0.54 0.00 2.02 -1.26 -5.01 118.70 114.19 2yug s GLU 152 Ca 0.52 2.02 -0.07 0.00 0.02 0.00 0.00 54.97 57.47 2yug s GLU 152 Cb -0.01 -3.92 0.12 0.00 0.10 0.00 0.00 34.13 30.41 2yug s GLU 152 CO 0.37 -0.81 0.73 0.54 0.02 0.00 0.00 175.26 176.10 2yug n ARG 153 N 6.99 -0.46 -0.93 1.61 1.74 -1.26 -5.01 116.66 119.33 2yug n ARG 153 Ca 0.16 -1.36 -0.05 0.00 -0.77 0.00 0.00 57.85 55.83 2yug n ARG 153 Cb 0.43 -0.68 0.18 0.00 -1.02 0.00 0.00 32.46 31.37 2yug n ARG 153 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2yug n GLU 154 N -2.50 2.01 0.00 5.56 -0.58 -1.26 -5.30 120.64 118.58 2yug n GLU 154 Ca 0.10 -3.36 0.00 0.00 -0.42 0.00 0.00 57.16 53.48 2yug n GLU 154 Cb 0.35 -1.84 0.00 0.00 -0.57 0.00 0.00 31.44 29.38 2yug n GLU 154 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06