#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 2.84 -0.08 1.61 2.88 -1.26 -4.79 113.62 114.82 2yug n SER 2 Ca 0.00 -3.46 -0.10 0.00 -1.33 0.00 0.00 58.87 53.98 2yug n SER 2 Cb 0.00 -0.43 -0.03 0.00 -0.75 0.00 0.00 64.21 63.00 2yug n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2yug n SER 3 N -0.74 1.81 0.00 -3.46 2.88 -1.26 -5.12 113.62 107.73 2yug n SER 3 Ca 0.26 0.30 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 2yug n SER 3 Cb 0.86 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 2yug n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yug n GLY 4 N 1.72 3.64 1.62 0.46 0.00 -1.26 -5.12 105.19 106.24 2yug n GLY 4 Ca -0.16 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 0.07 -4.56 1.61 2.88 -1.26 -4.98 113.62 107.38 2yug n SER 5 Ca 0.00 0.08 -0.36 0.00 -1.33 0.00 0.00 58.87 57.26 2yug n SER 5 Cb 0.00 0.03 -0.04 0.00 -0.75 0.00 0.00 64.21 63.45 2yug n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yug s SER 6 N -4.60 5.90 0.00 -3.46 0.01 -1.26 -3.83 113.70 106.47 2yug s SER 6 Ca 0.00 -0.98 0.00 0.00 1.31 0.00 0.00 55.95 56.28 2yug s SER 6 Cb 0.00 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.67 2yug s SER 6 CO 0.00 -2.04 0.00 0.61 0.41 0.00 0.00 173.24 172.22 2yug n GLY 7 N 6.69 0.04 3.60 3.44 0.00 -1.26 -5.11 105.19 112.60 2yug n GLY 7 Ca 0.33 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.78 4.09 -0.19 0.99 0.20 -1.25 -5.02 118.68 115.72 2yug s LEU 8 Ca 0.00 0.53 -0.27 0.00 0.69 0.00 0.00 54.13 55.08 2yug s LEU 8 Cb 0.00 -3.08 -0.00 0.00 -0.43 0.00 0.00 46.19 42.68 2yug s LEU 8 CO 0.00 -0.69 0.93 -0.62 -0.29 0.00 0.00 176.35 175.68 2yug s ASP 9 N 1.74 7.04 -0.06 3.68 -1.08 -1.26 -4.91 116.67 121.81 2yug s ASP 9 Ca 0.33 1.28 0.04 0.00 -0.52 0.00 0.00 52.55 53.68 2yug s ASP 9 Cb -0.13 -2.50 -0.02 0.00 -1.46 0.00 0.00 42.92 38.81 2yug s ASP 9 CO 0.15 -0.51 -0.19 -0.51 0.52 0.00 0.00 175.17 174.62 2yug s ILE 10 N 2.58 2.57 -0.26 4.11 1.10 -1.26 -1.72 121.20 128.32 2yug s ILE 10 Ca 0.41 -0.88 -0.03 0.00 -0.51 0.00 0.00 60.65 59.64 2yug s ILE 10 Cb -0.16 -1.99 0.09 0.00 0.15 0.00 0.00 42.46 40.55 2yug s ILE 10 CO 0.11 0.57 0.10 -0.69 -2.11 0.00 0.00 174.94 172.91 2yug s VAL 11 N -0.30 0.29 0.00 4.00 1.01 0.30 -4.98 120.40 120.73 2yug s VAL 11 Ca 0.01 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.16 2yug s VAL 11 Cb -0.13 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.12 2yug s VAL 11 CO 0.03 -0.57 0.00 0.61 0.00 0.00 0.00 175.10 175.16 2yug n GLY 12 N 5.11 0.56 1.25 4.51 0.00 -1.26 -1.40 105.19 113.96 2yug n GLY 12 Ca -0.05 0.61 0.04 0.00 0.00 0.00 0.00 46.02 46.61 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 0.96 -4.42 -0.61 -5.35 -1.26 -5.05 119.36 103.63 2yug n ILE 13 Ca 0.00 -2.03 -0.20 0.00 -0.27 0.00 0.00 62.75 60.26 2yug n ILE 13 Cb 0.00 0.49 -0.15 0.00 -1.74 0.00 0.00 39.64 38.24 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 -1.49 0.91 -0.02 4.28 0.52 -0.49 -4.38 118.94 118.27 2yug s TRP 14 Ca 0.36 -0.19 0.03 0.00 0.02 0.00 0.00 56.10 56.32 2yug s TRP 14 Cb 0.38 -0.60 -0.00 0.00 -1.15 0.00 0.00 33.47 32.09 2yug s TRP 14 CO -0.12 -0.04 -0.10 1.67 0.02 0.00 0.00 176.95 178.38 2yug s TRP 15 N -0.13 0.98 0.10 -1.98 1.48 0.01 -0.54 118.94 118.86 2yug s TRP 15 Ca 0.02 -0.21 -0.31 0.00 -1.06 0.00 0.00 56.10 54.54 2yug s TRP 15 Cb -0.05 -0.66 -0.08 0.00 -1.16 0.00 0.00 33.47 31.52 2yug s TRP 15 CO -0.00 -0.05 1.54 0.99 -4.06 0.00 0.00 176.95 175.36 2yug s THR 16 N -0.08 3.07 1.33 0.66 2.01 -0.70 -0.51 115.64 121.42 2yug s THR 16 Ca 0.01 0.66 -0.21 0.00 0.31 0.00 0.00 61.69 62.46 2yug s THR 16 Cb -0.06 -3.42 0.33 0.00 0.01 0.00 0.00 72.50 69.36 2yug s THR 16 CO -0.00 0.02 1.00 0.68 -0.69 0.00 0.00 174.62 175.64 2yug s VAL 17 N 1.86 1.40 0.00 3.82 -7.23 -0.96 -4.78 120.40 114.50 2yug s VAL 17 Ca 0.69 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.86 2yug s VAL 17 Cb -0.39 -2.23 0.00 0.00 0.56 0.00 0.00 36.38 34.32 2yug s VAL 17 CO 0.31 0.00 0.00 -1.20 -0.31 0.00 0.00 175.10 173.90 2yug n SER 18 N -5.27 0.03 -4.08 4.85 7.64 -1.26 -5.04 113.62 110.49 2yug n SER 18 Ca 0.12 0.00 -0.23 0.00 1.01 0.00 0.00 58.87 59.78 2yug n SER 18 Cb 0.59 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.71 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 -4.49 2.31 0.24 6.43 4.22 -1.26 -5.00 114.94 117.38 2yug s ASN 19 Ca 0.00 -1.61 -0.06 0.00 -2.14 0.00 0.00 52.86 49.05 2yug s ASN 19 Cb 0.00 0.40 0.22 0.00 1.28 0.00 0.00 41.25 43.16 2yug s ASN 19 CO 0.00 -0.89 1.85 0.15 -2.04 0.00 0.00 177.10 176.17 2yug h PHE 20 N 1.97 1.21 -0.07 1.54 3.04 -1.95 -2.06 116.94 120.63 2yug h PHE 20 Ca -0.35 -0.04 0.02 0.00 3.98 0.00 0.00 57.97 61.58 2yug h PHE 20 Cb 1.26 -0.38 -0.00 0.00 2.56 0.00 0.00 35.95 39.39 2yug h PHE 20 CO 1.26 0.85 0.05 0.78 -2.02 0.00 0.00 178.31 179.24 2yug h GLY 21 N 1.23 0.00 1.75 2.40 0.00 -2.04 -1.50 103.07 104.90 2yug h GLY 21 Ca 0.30 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.39 2yug h GLY 21 CO -0.04 0.00 -1.17 0.83 0.00 0.00 0.00 176.54 176.15 2yug h GLU 22 N 0.00 0.08 -6.00 4.80 4.39 -1.79 -3.41 114.58 112.63 2yug h GLU 22 Ca 0.03 -0.13 -0.59 0.00 0.34 0.00 0.00 59.36 59.01 2yug h GLU 22 Cb 0.14 0.05 -0.11 0.00 -0.10 0.00 0.00 28.75 28.73 2yug h GLU 22 CO -0.00 1.00 1.09 0.42 -1.16 0.00 0.00 179.01 180.36 2yug s ILE 23 N -2.68 3.98 -0.29 3.13 1.01 -0.57 -4.91 121.20 120.87 2yug s ILE 23 Ca -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 60.65 60.34 2yug s ILE 23 Cb 0.09 -4.91 0.17 0.00 0.01 0.00 0.00 42.46 37.82 2yug s ILE 23 CO 0.84 -1.78 0.58 -0.55 0.00 0.00 0.00 174.94 174.03 2yug s SER 24 N 4.10 -1.15 0.00 3.58 0.15 -1.26 -4.92 113.70 114.20 2yug s SER 24 Ca 0.36 0.98 0.00 0.00 0.70 0.00 0.00 55.95 57.99 2yug s SER 24 Cb -0.07 2.08 0.00 0.00 -1.71 0.00 0.00 66.02 66.32 2yug s SER 24 CO 0.04 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 174.84 2yug n GLY 25 N 5.43 -0.65 3.72 9.45 0.00 -0.58 -4.91 105.19 117.66 2yug n GLY 25 Ca -0.04 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 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 2.03 0.08 2.61 2.01 -1.26 0.48 115.64 121.60 2yug s THR 26 Ca 0.00 0.02 -0.08 0.00 0.31 0.00 0.00 61.69 61.94 2yug s THR 26 Cb 0.00 -3.02 -0.00 0.00 0.01 0.00 0.00 72.50 69.49 2yug s THR 26 CO 0.00 0.00 0.18 0.27 -0.69 0.00 0.00 174.62 174.38 2yug s ILE 27 N 1.04 0.14 -0.04 1.82 -4.36 0.28 -3.25 121.20 116.85 2yug s ILE 27 Ca 0.73 -1.18 0.06 0.00 -0.26 0.00 0.00 60.65 60.01 2yug s ILE 27 Cb -0.49 -1.30 -0.01 0.00 1.25 0.00 0.00 42.46 41.90 2yug s ILE 27 CO 0.34 -0.65 -0.23 0.00 0.24 0.00 0.00 174.94 174.64 2yug s ALA 28 N -3.73 1.96 -0.14 2.27 0.00 -1.08 -1.37 121.76 119.68 2yug s ALA 28 Ca 0.04 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.03 2yug s ALA 28 Cb 0.04 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.59 2yug s ALA 28 CO -0.10 0.42 -0.14 0.42 0.00 0.00 0.00 175.76 176.36 2yug s ILE 29 N -0.31 2.87 -0.34 0.00 1.01 -1.26 0.74 121.20 123.90 2yug s ILE 29 Ca 0.02 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 59.96 2yug s ILE 29 Cb -0.11 -2.20 0.08 0.00 0.01 0.00 0.00 42.46 40.24 2yug s ILE 29 CO 0.01 0.52 0.06 -0.70 0.00 0.00 0.00 174.94 174.83 2yug s GLU 30 N 0.52 2.02 -0.03 2.79 2.12 -0.87 -3.36 118.70 121.89 2yug s GLU 30 Ca -0.10 -1.61 -0.21 0.00 0.36 0.00 0.00 54.97 53.42 2yug s GLU 30 Cb -0.16 -3.27 -0.14 0.00 0.26 0.00 0.00 34.13 30.82 2yug s GLU 30 CO 0.04 -0.83 0.91 0.52 -0.54 0.00 0.00 175.26 175.36 2yug h MET 31 N 7.88 -0.34 -7.16 4.30 2.86 -1.85 -1.68 114.93 118.93 2yug h MET 31 Ca -0.14 0.02 -0.47 0.00 -2.06 0.00 0.00 59.70 57.05 2yug h MET 31 Cb 1.04 0.08 0.09 0.00 0.06 0.00 0.00 31.60 32.87 2yug h MET 31 CO 0.57 0.01 0.13 -0.51 1.06 0.00 0.00 176.91 178.17 2yug s ASP 32 N -5.24 4.12 -1.27 1.22 1.01 -1.15 -4.78 116.67 110.57 2yug s ASP 32 Ca -0.12 -0.47 -0.19 0.00 0.71 0.00 0.00 52.55 52.48 2yug s ASP 32 Cb 0.01 0.21 0.04 0.00 1.01 0.00 0.00 42.92 44.19 2yug s ASP 32 CO 0.44 -2.03 1.77 -0.75 0.21 0.00 0.00 175.17 174.81 2yug s LYS 33 N -5.22 3.70 0.00 8.23 2.20 -1.26 -3.53 119.74 123.86 2yug s LYS 33 Ca 0.68 -1.83 0.00 0.00 -0.36 0.00 0.00 55.97 54.46 2yug s LYS 33 Cb -0.04 -5.48 0.00 0.00 -1.51 0.00 0.00 37.83 30.80 2yug s LYS 33 CO 0.46 -2.58 0.00 0.41 -0.36 0.00 0.00 175.35 173.27 2yug n GLY 34 N 5.50 1.39 3.84 5.54 0.00 -1.26 -5.02 105.19 115.18 2yug n GLY 34 Ca 0.48 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.15 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 -1.66 3.56 0.46 4.61 0.00 -1.23 -4.15 121.76 123.35 2yug s ALA 35 Ca 0.00 -0.10 0.04 0.00 0.00 0.00 0.00 51.96 51.90 2yug s ALA 35 Cb 0.00 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.52 2yug s ALA 35 CO 0.00 0.44 0.05 0.71 0.00 0.00 0.00 175.76 176.97 2yug s TYR 36 N -1.49 2.19 -0.31 0.00 1.51 -1.26 -2.84 117.35 115.16 2yug s TYR 36 Ca 0.39 -0.79 -0.29 0.00 -1.01 0.00 0.00 57.07 55.36 2yug s TYR 36 Cb -0.15 -1.74 0.01 0.00 -0.11 0.00 0.00 41.96 39.97 2yug s TYR 36 CO 0.19 0.26 1.12 0.42 -1.11 0.00 0.00 175.55 176.43 2yug s ILE 37 N -2.77 4.44 0.07 2.71 1.01 -1.21 -0.50 121.20 124.94 2yug s ILE 37 Ca 0.23 1.67 -0.02 0.00 0.00 0.00 0.00 60.65 62.53 2yug s ILE 37 Cb 0.05 -4.35 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 2yug s ILE 37 CO 0.12 -0.45 0.25 -2.28 0.00 0.00 0.00 174.94 172.58 2yug s HIS 38 N 3.75 3.52 0.51 3.97 2.46 -0.40 -4.14 115.29 124.95 2yug s HIS 38 Ca 0.48 0.34 0.08 0.00 0.47 0.00 0.00 55.06 56.43 2yug s HIS 38 Cb -0.13 -1.83 0.04 0.00 -0.13 0.00 0.00 32.58 30.53 2yug s HIS 38 CO 0.16 0.56 0.60 0.00 -2.47 0.00 0.00 174.74 173.60 2yug s ALA 39 N -1.52 4.51 -0.07 1.58 0.00 -1.26 -1.77 121.76 123.24 2yug s ALA 39 Ca 0.35 -1.84 -0.06 0.00 0.00 0.00 0.00 51.96 50.41 2yug s ALA 39 Cb -0.13 -1.29 0.02 0.00 0.00 0.00 0.00 23.12 21.72 2yug s ALA 39 CO 0.26 -0.54 0.18 -0.51 0.00 0.00 0.00 175.76 175.15 2yug s LEU 40 N -4.43 1.31 0.38 0.00 1.43 -0.58 -4.74 118.68 112.04 2yug s LEU 40 Ca 0.53 0.34 0.12 0.00 -1.03 0.00 0.00 54.13 54.09 2yug s LEU 40 Cb -0.06 0.63 0.75 0.00 0.03 0.00 0.00 46.19 47.54 2yug s LEU 40 CO 0.33 -0.08 1.85 0.44 0.23 0.00 0.00 176.35 179.12 2yug h ASP 41 N 5.79 0.05 -0.15 2.29 3.32 -1.98 -2.52 116.42 123.21 2yug h ASP 41 Ca -0.26 -0.02 0.04 0.00 0.02 0.00 0.00 57.03 56.82 2yug h ASP 41 Cb 1.20 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 2yug h ASP 41 CO 0.39 0.37 0.12 -1.13 -1.72 0.00 0.00 179.24 177.27 2yug h ASN 42 N 0.05 0.00 0.00 6.45 -1.24 -2.00 -3.45 115.58 115.39 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 0.59 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.64 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 -1.51 1.99 3.40 1.57 0.00 -0.95 -5.14 105.19 104.56 2yug n GLY 43 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 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 1.89 -0.04 0.99 1.43 -1.24 -4.55 118.68 117.15 2yug s LEU 44 Ca 0.00 -1.77 -0.00 0.00 -1.03 0.00 0.00 54.13 51.33 2yug s LEU 44 Cb 0.00 0.29 0.03 0.00 0.03 0.00 0.00 46.19 46.53 2yug s LEU 44 CO 0.00 -1.05 0.00 -0.36 0.23 0.00 0.00 176.35 175.18 2yug s PHE 45 N -3.28 0.40 0.18 0.29 0.40 -1.26 -1.53 117.98 113.18 2yug s PHE 45 Ca 0.32 -0.02 0.08 0.00 -0.60 0.00 0.00 56.93 56.70 2yug s PHE 45 Cb 0.02 -0.53 -0.04 0.00 0.51 0.00 0.00 43.02 42.97 2yug s PHE 45 CO 0.22 -0.19 -0.15 -0.08 0.70 0.00 0.00 175.22 175.72 2yug s THR 46 N 1.39 1.69 -0.02 0.64 -1.32 -0.73 -3.68 115.64 113.62 2yug s THR 46 Ca -0.05 -2.05 -0.30 0.00 -1.21 0.00 0.00 61.69 58.08 2yug s THR 46 Cb -0.13 -1.91 -0.07 0.00 -1.51 0.00 0.00 72.50 68.88 2yug s THR 46 CO -0.02 -0.49 1.76 -0.22 -2.21 0.00 0.00 174.62 173.43 2yug s LEU 47 N -3.00 4.36 0.65 9.08 2.96 -1.26 -1.27 118.68 130.19 2yug s LEU 47 Ca 0.18 2.40 -0.15 0.00 -0.22 0.00 0.00 54.13 56.34 2yug s LEU 47 Cb -0.03 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.12 2yug s LEU 47 CO 0.06 -0.97 1.10 -0.83 -1.32 0.00 0.00 176.35 174.39 2yug s GLY 48 N 3.68 2.15 0.10 7.98 0.00 0.34 -4.79 107.32 116.78 2yug s GLY 48 Ca 0.79 0.52 -0.30 0.00 0.00 0.00 0.00 44.72 45.72 2yug s GLY 48 CO 0.34 0.87 1.12 0.00 0.00 0.00 0.00 173.10 175.42 2yug s ALA 49 N -2.36 3.34 1.15 3.20 0.00 -1.26 -4.16 121.76 121.68 2yug s ALA 49 Ca 0.66 0.78 -0.18 0.00 0.00 0.00 0.00 51.96 53.23 2yug s ALA 49 Cb -0.20 -3.39 0.19 0.00 0.00 0.00 0.00 23.12 19.72 2yug s ALA 49 CO 0.41 -0.30 0.32 -2.30 0.00 0.00 0.00 175.76 173.88 2yug n PRO 50 N 3.26 -2.36 -4.08 0.00 -0.02 -1.26 -4.78 135.00 125.76 2yug n PRO 50 Ca 0.06 -0.68 -0.36 0.00 -2.02 0.00 0.00 63.50 60.50 2yug n PRO 50 Cb 0.47 -1.73 -0.08 0.00 -0.02 0.00 0.00 33.50 32.14 2yug n PRO 50 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2yug s HIS 51 N -2.20 3.35 0.49 6.00 3.76 -1.26 -4.99 115.29 120.44 2yug s HIS 51 Ca 0.54 0.28 0.14 0.00 -0.15 0.00 0.00 55.06 55.87 2yug s HIS 51 Cb -0.12 -1.93 1.15 0.00 1.11 0.00 0.00 32.58 32.79 2yug s HIS 51 CO 0.57 0.48 2.11 0.07 -0.85 0.00 0.00 174.74 177.11 2yug h ARG 52 N 5.54 0.17 -5.88 1.40 -0.00 -1.99 -3.41 114.38 110.21 2yug h ARG 52 Ca -0.48 -0.01 -0.67 0.00 -0.00 0.00 0.00 59.98 58.82 2yug h ARG 52 Cb 1.20 -0.04 -0.11 0.00 -0.00 0.00 0.00 29.97 31.03 2yug h ARG 52 CO 0.61 0.11 -0.56 -1.21 -0.00 0.00 0.00 179.97 178.91 2yug s GLU 53 N -5.20 3.16 0.31 0.08 0.41 -1.26 -5.00 118.70 111.19 2yug s GLU 53 Ca -0.06 -0.35 0.09 0.00 -0.41 0.00 0.00 54.97 54.24 2yug s GLU 53 Cb 0.17 -2.94 0.49 0.00 -1.78 0.00 0.00 34.13 30.08 2yug s GLU 53 CO 0.69 0.70 1.70 -0.24 -0.49 0.00 0.00 175.26 177.63 2yug h VAL 54 N 3.72 1.34 -3.56 2.63 3.04 -2.04 -3.35 116.25 118.03 2yug h VAL 54 Ca -0.51 -1.63 -0.76 0.00 -1.01 0.00 0.00 66.70 62.78 2yug h VAL 54 Cb 1.20 1.82 -0.30 0.00 -2.01 0.00 0.00 31.29 32.00 2yug h VAL 54 CO 0.59 0.47 0.15 1.51 -1.01 0.00 0.00 177.57 179.28 2yug s ASP 55 N -6.89 6.64 0.10 3.17 -4.77 -1.26 -4.98 116.67 108.68 2yug s ASP 55 Ca -0.03 -3.36 -0.10 0.00 -3.30 0.00 0.00 52.55 45.76 2yug s ASP 55 Cb 0.13 -2.10 0.00 0.00 -1.09 0.00 0.00 42.92 39.87 2yug s ASP 55 CO 0.76 -0.33 0.22 -0.70 0.70 0.00 0.00 175.17 175.82 2yug s GLU 56 N -0.86 0.89 0.17 2.11 2.12 -1.26 -4.93 118.70 116.95 2yug s GLU 56 Ca 0.26 -0.94 0.03 0.00 0.36 0.00 0.00 54.97 54.67 2yug s GLU 56 Cb -0.10 0.36 -0.03 0.00 0.26 0.00 0.00 34.13 34.61 2yug s GLU 56 CO -0.09 -0.29 0.31 0.20 -0.54 0.00 0.00 175.26 174.84 2yug s GLY 57 N -2.86 1.62 0.44 -1.50 0.00 -1.26 -4.90 107.32 98.86 2yug s GLY 57 Ca 0.05 -1.05 -0.24 0.00 0.00 0.00 0.00 44.72 43.49 2yug s GLY 57 CO -0.10 -1.05 1.16 2.56 0.00 0.00 0.00 173.10 175.66 2yug s PRO 58 N -3.39 3.86 1.03 2.90 0.04 -1.26 -5.01 135.00 133.17 2yug s PRO 58 Ca 0.35 1.76 -0.12 0.00 0.04 0.00 0.00 61.00 63.04 2yug s PRO 58 Cb -0.11 -2.48 0.19 0.00 0.04 0.00 0.00 34.50 32.15 2yug s PRO 58 CO 0.29 -0.46 1.00 0.45 0.04 0.00 0.00 177.00 178.32 2yug n SER 59 N -0.32 -0.70 -0.13 6.66 2.88 -1.26 -4.64 113.62 116.10 2yug n SER 59 Ca 0.06 0.18 -0.04 0.00 -1.33 0.00 0.00 58.87 57.73 2yug n SER 59 Cb 0.48 -1.36 0.02 0.00 -0.75 0.00 0.00 64.21 62.60 2yug n SER 59 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2yug h PRO 60 N -2.19 -0.06 0.00 -1.46 0.11 -1.95 -0.47 132.00 125.98 2yug h PRO 60 Ca -0.50 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 2yug h PRO 60 Cb 1.30 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.41 2yug h PRO 60 CO 0.43 -0.04 -0.19 -1.00 -0.21 0.00 0.00 178.00 176.99 2yug h PRO 61 N -0.06 0.00 -0.00 1.05 0.13 -1.91 -2.57 132.00 128.65 2yug h PRO 61 Ca 0.21 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.19 2yug h PRO 61 Cb 0.38 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.49 2yug h PRO 61 CO -0.48 0.19 -0.70 0.93 -0.23 0.00 0.00 178.00 177.71 2yug h GLU 62 N 0.00 0.00 -7.31 0.86 5.08 -1.28 -3.38 114.58 108.55 2yug h GLU 62 Ca -0.00 -0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.88 2yug h GLU 62 Cb 0.50 0.00 0.16 0.00 0.50 0.00 0.00 28.75 29.90 2yug h GLU 62 CO 0.03 0.70 0.22 -0.65 -1.00 0.00 0.00 179.01 178.31 2yug s GLN 63 N -3.41 0.95 0.25 2.33 -0.21 -0.60 -4.57 119.66 114.39 2yug s GLN 63 Ca -0.01 0.86 -0.11 0.00 0.02 0.00 0.00 55.36 56.12 2yug s GLN 63 Cb 0.12 -1.77 -0.01 0.00 1.00 0.00 0.00 33.01 32.35 2yug s GLN 63 CO 0.78 -2.47 0.44 -0.06 -2.12 0.00 0.00 175.29 171.86 2yug s PHE 64 N -2.86 0.48 -0.08 0.91 0.08 -0.47 -3.13 117.98 112.91 2yug s PHE 64 Ca 0.64 -0.83 -0.01 0.00 0.12 0.00 0.00 56.93 56.86 2yug s PHE 64 Cb -0.19 0.10 0.03 0.00 -0.57 0.00 0.00 43.02 42.38 2yug s PHE 64 CO 0.58 -0.97 -0.03 0.99 -0.10 0.00 0.00 175.22 175.70 2yug s THR 65 N -3.97 0.59 -0.07 0.64 2.01 -0.39 -0.55 115.64 113.89 2yug s THR 65 Ca 0.25 -0.02 -0.16 0.00 0.31 0.00 0.00 61.69 62.07 2yug s THR 65 Cb 0.00 -0.69 -0.05 0.00 0.01 0.00 0.00 72.50 71.77 2yug s THR 65 CO 0.10 0.29 0.42 0.00 -0.69 0.00 0.00 174.62 174.74 2yug s ALA 66 N 1.81 3.59 -0.11 7.40 0.00 0.18 -1.27 121.76 133.36 2yug s ALA 66 Ca 0.04 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.76 2yug s ALA 66 Cb -0.12 -2.50 0.02 0.00 0.00 0.00 0.00 23.12 20.52 2yug s ALA 66 CO -0.06 0.22 -0.11 0.08 0.00 0.00 0.00 175.76 175.90 2yug s VAL 67 N -0.13 1.21 0.08 0.00 1.01 -1.04 -1.52 120.40 120.02 2yug s VAL 67 Ca 0.23 -0.43 -0.31 0.00 0.00 0.00 0.00 61.98 61.47 2yug s VAL 67 Cb -0.15 -1.17 -0.08 0.00 0.00 0.00 0.00 36.38 34.97 2yug s VAL 67 CO 0.11 0.39 1.55 -0.54 0.00 0.00 0.00 175.10 176.61 2yug s LYS 68 N 1.41 4.23 0.00 2.72 1.02 -1.26 0.25 119.74 128.11 2yug s LYS 68 Ca 0.01 2.24 0.00 0.00 0.02 0.00 0.00 55.97 58.23 2yug s LYS 68 Cb -0.13 -3.45 0.00 0.00 -0.52 0.00 0.00 37.83 33.73 2yug s LYS 68 CO -0.06 -0.64 0.00 1.28 -0.92 0.00 0.00 175.35 175.01 2yug n LEU 69 N 4.97 0.00 -3.65 3.17 4.77 -0.48 -4.92 117.00 120.86 2yug n LEU 69 Ca 0.14 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.11 2yug n LEU 69 Cb 0.41 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 2yug n LEU 69 CO 0.61 -0.25 1.20 -0.44 -1.33 0.00 0.00 177.39 177.18 2yug s SER 70 N -2.16 -0.00 -1.51 -1.43 0.01 -1.25 -4.98 113.70 102.39 2yug s SER 70 Ca 0.00 0.00 -0.06 0.00 1.31 0.00 0.00 55.95 57.20 2yug s SER 70 Cb 0.00 0.00 0.01 0.00 0.21 0.00 0.00 66.02 66.24 2yug s SER 70 CO 0.00 -0.00 0.75 -0.67 0.41 0.00 0.00 173.24 173.73 2yug n ASP 71 N 0.23 -6.09 -3.28 2.44 2.03 -1.26 -2.69 116.55 107.92 2yug n ASP 71 Ca 0.04 -0.36 -0.15 0.00 0.52 0.00 0.00 54.79 54.83 2yug n ASP 71 Cb 0.57 -4.89 0.08 0.00 -0.72 0.00 0.00 41.12 36.16 2yug n ASP 71 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2yug n SER 72 N -2.64 -5.24 -3.88 1.67 7.64 -1.26 -5.02 113.62 104.88 2yug n SER 72 Ca -0.08 -0.68 -0.22 0.00 1.01 0.00 0.00 58.87 58.90 2yug n SER 72 Cb 0.60 -5.14 -0.17 0.00 -1.01 0.00 0.00 64.21 58.49 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 -4.67 0.99 -0.13 1.43 1.81 -1.10 -4.56 118.95 112.72 2yug s ARG 73 Ca 0.32 -0.11 -0.04 0.00 -1.72 0.00 0.00 55.73 54.18 2yug s ARG 73 Cb -0.04 -1.06 -0.03 0.00 -0.45 0.00 0.00 34.95 33.36 2yug s ARG 73 CO 0.73 -0.16 0.01 0.96 -0.68 0.00 0.00 175.30 176.16 2yug s ILE 74 N 1.30 4.38 -0.75 1.52 -4.36 -1.19 -1.38 121.20 120.71 2yug s ILE 74 Ca -0.05 -0.20 -0.19 0.00 -0.26 0.00 0.00 60.65 59.96 2yug s ILE 74 Cb -0.14 -2.90 0.12 0.00 1.25 0.00 0.00 42.46 40.79 2yug s ILE 74 CO -0.02 0.53 0.91 0.00 0.24 0.00 0.00 174.94 176.60 2yug s ALA 75 N -0.17 3.44 0.66 2.27 0.00 0.14 -2.68 121.76 125.41 2yug s ALA 75 Ca 0.05 -2.50 -0.16 0.00 0.00 0.00 0.00 51.96 49.35 2yug s ALA 75 Cb -0.12 -3.77 -0.00 0.00 0.00 0.00 0.00 23.12 19.23 2yug s ALA 75 CO 0.02 -2.64 1.18 -0.51 0.00 0.00 0.00 175.76 173.81 2yug s LEU 76 N 2.59 3.47 -0.13 0.00 1.43 -1.25 -2.51 118.68 122.29 2yug s LEU 76 Ca 0.22 2.26 -0.05 0.00 -1.03 0.00 0.00 54.13 55.53 2yug s LEU 76 Cb -0.14 -4.58 0.06 0.00 0.03 0.00 0.00 46.19 41.56 2yug s LEU 76 CO -0.01 -1.82 0.28 -0.75 0.23 0.00 0.00 176.35 174.28 2yug s LYS 77 N -3.74 0.18 0.60 1.70 2.20 -0.40 -2.19 119.74 118.10 2yug s LYS 77 Ca 0.73 0.74 -0.18 0.00 -0.36 0.00 0.00 55.97 56.90 2yug s LYS 77 Cb -0.27 -0.02 -0.03 0.00 -1.51 0.00 0.00 37.83 36.00 2yug s LYS 77 CO 0.39 -0.25 1.21 -1.54 -0.36 0.00 0.00 175.35 174.79 2yug s SER 78 N 2.18 5.13 0.52 1.43 1.04 0.28 -1.26 113.70 123.02 2yug s SER 78 Ca -0.02 2.38 0.20 0.00 0.48 0.00 0.00 55.95 59.00 2yug s SER 78 Cb -0.12 -2.60 1.38 0.00 0.10 0.00 0.00 66.02 64.79 2yug s SER 78 CO -0.09 -1.63 2.14 1.23 0.98 0.00 0.00 173.24 175.86 2yug h GLY 79 N 0.80 0.00 1.91 7.32 0.00 -1.67 -1.73 103.07 109.70 2yug h GLY 79 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 2yug h GLY 79 CO 0.55 0.00 0.06 -0.97 0.00 0.00 0.00 176.54 176.18 2yug h TYR 80 N 0.00 0.11 0.00 5.60 0.05 -1.87 -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 0.10 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.80 2yug h TYR 80 CO 0.00 0.07 0.00 0.41 -1.05 0.00 0.00 178.16 177.59 2yug n GLY 81 N -1.53 1.22 3.22 3.88 0.00 -0.65 -5.16 105.19 106.18 2yug n GLY 81 Ca -0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.00 1.08 -0.25 1.61 1.02 -1.21 -4.83 119.74 117.16 2yug s LYS 82 Ca 0.00 -1.53 -0.10 0.00 0.02 0.00 0.00 55.97 54.36 2yug s LYS 82 Cb 0.00 -0.12 -0.05 0.00 -0.52 0.00 0.00 37.83 37.15 2yug s LYS 82 CO 0.00 -0.18 0.16 0.71 -0.92 0.00 0.00 175.35 175.12 2yug s TYR 83 N -3.78 3.26 -0.25 3.18 2.02 0.19 1.00 117.35 122.97 2yug s TYR 83 Ca 0.25 0.14 -0.28 0.00 -0.37 0.00 0.00 57.07 56.81 2yug s TYR 83 Cb 0.07 -2.30 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 2yug s TYR 83 CO 0.04 -0.05 2.04 -0.51 -1.57 0.00 0.00 175.55 175.51 2yug s LEU 84 N 1.34 3.51 -0.03 -1.29 1.43 -0.93 -4.22 118.68 118.50 2yug s LEU 84 Ca 0.07 1.71 -0.00 0.00 -1.03 0.00 0.00 54.13 54.88 2yug s LEU 84 Cb -0.15 -3.52 0.03 0.00 0.03 0.00 0.00 46.19 42.59 2yug s LEU 84 CO 0.07 -1.82 0.02 -0.83 0.23 0.00 0.00 176.35 174.02 2yug s GLY 85 N 7.26 0.19 1.00 -3.19 0.00 -0.47 -4.21 107.32 107.90 2yug s GLY 85 Ca 0.92 0.22 -0.12 0.00 0.00 0.00 0.00 44.72 45.74 2yug s GLY 85 CO 0.35 0.72 1.08 -0.26 0.00 0.00 0.00 173.10 174.98 2yug s ILE 86 N 1.16 2.27 0.47 0.90 -4.36 -0.96 -2.73 121.20 117.94 2yug s ILE 86 Ca -0.08 0.09 0.07 0.00 -0.26 0.00 0.00 60.65 60.46 2yug s ILE 86 Cb -0.13 -2.40 0.02 0.00 1.25 0.00 0.00 42.46 41.20 2yug s ILE 86 CO -0.02 -0.11 0.64 0.20 0.24 0.00 0.00 174.94 175.88 2yug s ASN 87 N -3.09 5.50 0.21 4.36 0.01 0.51 -4.81 114.94 117.64 2yug s ASN 87 Ca 0.66 -0.39 0.06 0.00 -0.71 0.00 0.00 52.86 52.48 2yug s ASN 87 Cb -0.21 -0.59 0.15 0.00 0.41 0.00 0.00 41.25 41.01 2yug s ASN 87 CO 0.59 -0.91 1.48 0.77 -1.51 0.00 0.00 177.10 177.53 2yug h SER 88 N 0.46 0.16 -0.05 -1.22 4.64 -1.97 -3.23 113.55 112.34 2yug h SER 88 Ca -0.39 -0.11 -0.25 0.00 -0.47 0.00 0.00 61.79 60.56 2yug h SER 88 Cb 1.28 -0.05 0.02 0.00 -0.31 0.00 0.00 62.40 63.34 2yug h SER 88 CO 0.46 0.84 -0.95 -0.78 -0.87 0.00 0.00 176.83 175.53 2yug h ASP 89 N 0.08 0.93 0.00 4.97 1.82 -2.05 -3.48 116.42 118.70 2yug h ASP 89 Ca -0.02 -0.69 0.00 0.00 -0.39 0.00 0.00 57.03 55.93 2yug h ASP 89 Cb 1.31 -0.28 0.00 0.00 0.68 0.00 0.00 39.33 41.04 2yug h ASP 89 CO 0.11 1.49 0.00 0.61 -1.61 0.00 0.00 179.24 179.84 2yug n GLY 90 N 0.94 0.24 3.03 -0.78 0.00 -1.22 -5.09 105.19 102.32 2yug n GLY 90 Ca -0.10 -0.27 -0.13 0.00 0.00 0.00 0.00 46.02 45.53 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 0.48 -0.15 0.99 2.96 -1.26 -3.69 118.68 118.01 2yug s LEU 91 Ca 0.00 0.48 -0.29 0.00 -0.22 0.00 0.00 54.13 54.10 2yug s LEU 91 Cb 0.00 0.67 -0.02 0.00 0.50 0.00 0.00 46.19 47.34 2yug s LEU 91 CO 0.00 -0.16 1.29 -0.69 -1.32 0.00 0.00 176.35 175.47 2yug s VAL 92 N 1.22 4.22 0.32 1.68 1.01 -0.87 -0.36 120.40 127.61 2yug s VAL 92 Ca -0.09 1.48 0.04 0.00 0.00 0.00 0.00 61.98 63.41 2yug s VAL 92 Cb -0.10 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 2yug s VAL 92 CO -0.08 -0.12 0.19 0.68 0.00 0.00 0.00 175.10 175.77 2yug s VAL 93 N 3.46 0.23 -0.35 2.92 -7.23 -1.10 -4.26 120.40 114.06 2yug s VAL 93 Ca 0.56 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.77 2yug s VAL 93 Cb -0.23 -2.48 0.16 0.00 0.56 0.00 0.00 36.38 34.40 2yug s VAL 93 CO 0.16 0.00 0.45 -0.83 -0.31 0.00 0.00 175.10 174.57 2yug s GLY 94 N -3.39 -0.50 -0.05 2.32 0.00 -1.26 -1.37 107.32 103.07 2yug s GLY 94 Ca 0.36 -0.30 0.16 0.00 0.00 0.00 0.00 44.72 44.94 2yug s GLY 94 CO 0.20 3.06 1.13 -0.96 0.00 0.00 0.00 173.10 176.54 2yug n ARG 95 N 4.65 0.28 -4.78 2.90 1.85 -1.26 -4.85 116.66 115.45 2yug n ARG 95 Ca 0.08 -1.78 -0.27 0.00 -1.00 0.00 0.00 57.85 54.88 2yug n ARG 95 Cb 0.49 0.02 -0.17 0.00 -1.05 0.00 0.00 32.46 31.76 2yug n ARG 95 CO 0.00 0.00 0.00 -1.12 -0.01 0.00 0.00 177.63 176.50 2yug s SER 96 N -1.81 2.16 -0.44 2.89 0.01 -1.26 -4.98 113.70 110.27 2yug s SER 96 Ca 0.20 -0.37 0.03 0.00 1.31 0.00 0.00 55.95 57.12 2yug s SER 96 Cb 0.26 -0.93 0.60 0.00 0.21 0.00 0.00 66.02 66.15 2yug s SER 96 CO -0.10 0.08 1.88 -0.67 0.41 0.00 0.00 173.24 174.84 2yug n ASP 97 N 3.63 4.15 -1.09 2.44 2.03 -1.26 0.53 116.55 126.99 2yug n ASP 97 Ca -0.21 -3.52 0.00 0.00 0.52 0.00 0.00 54.79 51.58 2yug n ASP 97 Cb 0.52 -0.84 0.00 0.00 -0.72 0.00 0.00 41.12 40.09 2yug n ASP 97 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2yug n ALA 98 N -1.00 0.00 -3.74 -1.67 0.00 -1.26 -4.98 120.51 107.86 2yug n ALA 98 Ca 0.56 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.71 2yug n ALA 98 Cb 1.49 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.81 2yug n ALA 98 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2yug s ILE 99 N -1.79 1.81 0.02 0.00 1.01 -1.26 -4.68 121.20 116.31 2yug s ILE 99 Ca 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 60.65 57.48 2yug s ILE 99 Cb 0.00 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.24 2yug s ILE 99 CO 0.00 -0.97 0.03 0.61 0.00 0.00 0.00 174.94 174.61 2yug n GLY 100 N 2.91 1.65 0.19 6.18 0.00 -1.26 -4.96 105.19 109.90 2yug n GLY 100 Ca 0.15 -2.09 0.04 0.00 0.00 0.00 0.00 46.02 44.11 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 0.00 0.03 1.61 0.13 -1.99 -2.79 132.00 128.99 2yug h PRO 101 Ca -0.01 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.90 2yug h PRO 101 Cb 0.04 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.15 2yug h PRO 101 CO 0.01 0.38 -1.01 0.00 -0.23 0.00 0.00 178.00 177.15 2yug h ARG 102 N 0.00 0.08 0.00 0.86 3.08 -1.95 -3.19 114.38 113.27 2yug h ARG 102 Ca -0.00 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 59.92 2yug h ARG 102 Cb 0.73 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2yug h ARG 102 CO 0.05 1.02 0.00 0.93 -1.07 0.00 0.00 179.97 180.90 2yug h GLU 103 N 0.03 0.00 -7.26 0.04 3.07 -1.69 -2.56 114.58 106.21 2yug h GLU 103 Ca -0.04 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 58.32 2yug h GLU 103 Cb 1.74 0.00 0.08 0.00 -0.84 0.00 0.00 28.75 29.72 2yug h GLU 103 CO 0.14 0.00 0.37 -0.65 -1.40 0.00 0.00 179.01 177.48 2yug s GLN 104 N -3.26 3.18 0.28 2.33 -0.21 -1.07 -4.02 119.66 116.90 2yug s GLN 104 Ca 0.07 1.08 0.02 0.00 0.02 0.00 0.00 55.36 56.55 2yug s GLN 104 Cb 0.10 -2.02 -0.03 0.00 1.00 0.00 0.00 33.01 32.06 2yug s GLN 104 CO 0.55 -0.91 0.26 -1.58 -2.12 0.00 0.00 175.29 171.49 2yug s TRP 105 N -2.73 1.41 -0.29 0.91 0.52 -1.09 -3.86 118.94 113.81 2yug s TRP 105 Ca 0.61 -1.48 -0.00 0.00 0.02 0.00 0.00 56.10 55.25 2yug s TRP 105 Cb -0.15 -0.54 0.14 0.00 -1.15 0.00 0.00 33.47 31.77 2yug s TRP 105 CO 0.45 -0.84 0.32 -2.00 0.02 0.00 0.00 176.95 174.90 2yug s GLU 106 N -3.66 0.34 0.04 4.98 -6.30 -0.97 -3.19 118.70 109.94 2yug s GLU 106 Ca 0.38 -0.08 -0.31 0.00 -2.50 0.00 0.00 54.97 52.46 2yug s GLU 106 Cb 0.03 -0.59 -0.06 0.00 0.00 0.00 0.00 34.13 33.51 2yug s GLU 106 CO 0.21 -1.02 1.40 -1.25 0.02 0.00 0.00 175.26 174.61 2yug s PRO 107 N 2.40 4.30 0.24 4.30 0.04 -1.26 -2.53 135.00 142.48 2yug s PRO 107 Ca 0.09 2.00 0.09 0.00 0.04 0.00 0.00 61.00 63.23 2yug s PRO 107 Cb -0.14 -3.47 -0.04 0.00 0.04 0.00 0.00 34.50 30.89 2yug s PRO 107 CO -0.32 -0.52 -0.04 0.08 0.04 0.00 0.00 177.00 176.24 2yug s VAL 108 N 1.97 3.35 -0.02 -0.36 1.01 -1.18 -4.99 120.40 120.17 2yug s VAL 108 Ca 0.64 -1.84 0.01 0.00 0.00 0.00 0.00 61.98 60.79 2yug s VAL 108 Cb -0.33 -2.75 0.02 0.00 0.00 0.00 0.00 36.38 33.32 2yug s VAL 108 CO 0.28 -0.29 -0.02 -0.36 0.00 0.00 0.00 175.10 174.71 2yug s PHE 109 N -2.13 0.39 -0.28 5.22 0.08 -1.26 -2.67 117.98 117.33 2yug s PHE 109 Ca 0.29 -0.05 -0.04 0.00 0.12 0.00 0.00 56.93 57.25 2yug s PHE 109 Cb -0.07 -0.40 0.10 0.00 -0.57 0.00 0.00 43.02 42.08 2yug s PHE 109 CO 0.18 -0.10 0.14 -1.14 -0.10 0.00 0.00 175.22 174.20 2yug s GLN 110 N 0.69 0.19 -1.36 0.44 0.74 -0.87 -4.87 119.66 114.61 2yug s GLN 110 Ca -0.07 -0.44 -0.08 0.00 0.05 0.00 0.00 55.36 54.81 2yug s GLN 110 Cb -0.10 -1.19 0.02 0.00 1.10 0.00 0.00 33.01 32.84 2yug s GLN 110 CO -0.01 -0.98 1.14 -0.25 -0.55 0.00 0.00 175.29 174.64 2yug n ASP 111 N 5.26 -5.70 0.00 6.67 9.92 -1.26 -2.23 116.55 129.21 2yug n ASP 111 Ca -0.06 -0.58 0.00 0.00 -0.53 0.00 0.00 54.79 53.63 2yug n ASP 111 Cb 0.43 -4.93 0.00 0.00 -0.64 0.00 0.00 41.12 35.98 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 -1.88 2.81 3.34 0.44 0.00 -1.26 -5.03 105.19 103.60 2yug n GLY 112 Ca -0.02 -0.74 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 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 -2.41 -0.00 1.61 1.02 -0.95 -5.01 119.74 114.00 2yug s LYS 113 Ca 0.00 0.42 -0.24 0.00 0.02 0.00 0.00 55.97 56.17 2yug s LYS 113 Cb 0.00 -1.41 0.05 0.00 -0.52 0.00 0.00 37.83 35.95 2yug s LYS 113 CO 0.00 -4.60 0.55 0.00 -0.92 0.00 0.00 175.35 170.37 2yug s MET 114 N -4.79 0.98 -0.21 1.68 0.23 -1.26 -2.06 119.30 113.88 2yug s MET 114 Ca 0.68 -0.03 -0.05 0.00 -1.03 0.00 0.00 55.69 55.26 2yug s MET 114 Cb -0.18 0.45 0.10 0.00 -1.53 0.00 0.00 34.83 33.67 2yug s MET 114 CO 0.61 -0.32 0.39 0.00 -2.03 0.00 0.00 175.02 173.66 2yug s ALA 115 N -1.74 -1.06 -0.73 3.16 0.00 -1.09 -1.96 121.76 118.34 2yug s ALA 115 Ca -0.09 1.23 -0.26 0.00 0.00 0.00 0.00 51.96 52.84 2yug s ALA 115 Cb -0.01 -1.41 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 2yug s ALA 115 CO 0.04 -0.92 1.91 -1.17 0.00 0.00 0.00 175.76 175.62 2yug s LEU 116 N 2.57 3.24 -0.17 0.00 2.96 -1.26 -3.08 118.68 122.94 2yug s LEU 116 Ca 0.04 -0.06 -0.28 0.00 -0.22 0.00 0.00 54.13 53.61 2yug s LEU 116 Cb -0.13 -2.54 -0.01 0.00 0.50 0.00 0.00 46.19 44.01 2yug s LEU 116 CO -0.13 -2.55 0.95 -0.22 -1.32 0.00 0.00 176.35 173.08 2yug s LEU 117 N 9.58 4.18 1.21 -0.68 2.96 -1.05 -3.55 118.68 131.33 2yug s LEU 117 Ca 0.69 1.36 -0.13 0.00 -0.22 0.00 0.00 54.13 55.82 2yug s LEU 117 Cb -0.10 -3.43 0.31 0.00 0.50 0.00 0.00 46.19 43.46 2yug s LEU 117 CO 0.12 -0.50 0.99 0.00 -1.32 0.00 0.00 176.35 175.64 2yug n ALA 118 N 5.48 -3.21 0.83 5.97 0.00 -0.83 -2.29 120.51 126.46 2yug n ALA 118 Ca 0.08 -1.28 0.10 0.00 0.00 0.00 0.00 53.44 52.34 2yug n ALA 118 Cb 0.48 -1.96 0.47 0.00 0.00 0.00 0.00 19.45 18.44 2yug n ALA 118 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2yug n SER 119 N -5.04 0.00 -1.83 0.00 2.88 -1.25 -2.84 113.62 105.54 2yug n SER 119 Ca 0.02 0.26 -0.07 0.00 -1.33 0.00 0.00 58.87 57.75 2yug n SER 119 Cb 0.54 -0.40 0.24 0.00 -0.75 0.00 0.00 64.21 63.84 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 -1.40 4.25 -3.10 -3.46 0.23 -1.26 -4.88 115.26 105.63 2yug n ASN 120 Ca 0.07 -3.05 -0.22 0.00 -0.53 0.00 0.00 54.58 50.85 2yug n ASN 120 Cb 0.20 -0.72 0.01 0.00 -2.08 0.00 0.00 39.78 37.20 2yug n ASN 120 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 2yug n SER 121 N -0.18 -4.95 -3.70 0.53 3.41 -1.13 -4.96 113.62 102.63 2yug n SER 121 Ca 0.36 -0.28 -0.19 0.00 -0.26 0.00 0.00 58.87 58.50 2yug n SER 121 Cb 1.25 -4.05 -0.18 0.00 -0.26 0.00 0.00 64.21 60.98 2yug n SER 121 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2yug n PHE 123 N 5.06 0.09 -4.27 0.00 3.72 -1.23 -1.96 117.46 118.87 2yug n PHE 123 Ca -0.08 0.20 -0.23 0.00 -0.05 0.00 0.00 57.45 57.29 2yug n PHE 123 Cb 0.50 -1.89 -0.07 0.00 -0.94 0.00 0.00 39.48 37.08 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 -2.55 3.57 -0.06 4.37 -4.36 -1.23 -0.88 121.20 120.06 2yug s ILE 124 Ca 0.67 -1.82 -0.31 0.00 -0.26 0.00 0.00 60.65 58.94 2yug s ILE 124 Cb -0.24 -2.90 0.11 0.00 1.25 0.00 0.00 42.46 40.68 2yug s ILE 124 CO 0.61 -0.35 1.07 0.00 0.24 0.00 0.00 174.94 176.51 2yug s ARG 125 N -3.62 0.61 0.12 0.37 1.70 -0.97 -4.80 118.95 112.35 2yug s ARG 125 Ca 0.31 -0.26 0.04 0.00 -0.47 0.00 0.00 55.73 55.35 2yug s ARG 125 Cb -0.07 0.26 -0.04 0.00 -0.57 0.00 0.00 34.95 34.53 2yug s ARG 125 CO 0.20 -0.27 0.12 0.00 -1.08 0.00 0.00 175.30 174.27 2yug s ASN 127 N -2.77 5.02 -0.06 0.00 0.01 0.86 -4.99 114.94 113.01 2yug s ASN 127 Ca 0.31 -0.86 0.10 0.00 -0.71 0.00 0.00 52.86 51.70 2yug s ASN 127 Cb -0.11 -0.15 -0.23 0.00 0.41 0.00 0.00 41.25 41.16 2yug s ASN 127 CO 0.23 -0.92 0.61 1.21 -1.51 0.00 0.00 177.10 176.72 2yug n GLU 128 N -1.78 0.65 -0.23 -0.60 0.00 -1.26 -4.17 120.64 113.25 2yug n GLU 128 Ca 0.05 0.29 -0.07 0.00 0.00 0.00 0.00 57.16 57.43 2yug n GLU 128 Cb 0.62 -1.78 0.04 0.00 0.00 0.00 0.00 31.44 30.32 2yug n GLU 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2yug h ALA 129 N 0.88 0.84 0.00 4.31 0.00 -2.05 -3.46 119.26 119.77 2yug h ALA 129 Ca -0.31 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2yug h ALA 129 Cb 2.02 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2yug h ALA 129 CO 0.08 0.43 0.00 0.41 0.00 0.00 0.00 179.25 180.17 2yug n GLY 130 N -0.89 0.18 3.41 0.00 0.00 -1.26 -5.15 105.19 101.48 2yug n GLY 130 Ca 0.05 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.48 -0.36 1.61 1.11 -1.26 -4.90 116.67 112.39 2yug s ASP 131 Ca 0.00 0.54 0.02 0.00 0.18 0.00 0.00 52.55 53.28 2yug s ASP 131 Cb 0.00 0.53 0.11 0.00 1.07 0.00 0.00 42.92 44.63 2yug s ASP 131 CO 0.00 -0.50 0.12 -0.63 1.18 0.00 0.00 175.17 175.34 2yug s ILE 132 N -1.06 1.56 0.54 0.77 1.01 -1.24 -0.10 121.20 122.68 2yug s ILE 132 Ca -0.11 -2.09 0.02 0.00 0.00 0.00 0.00 60.65 58.48 2yug s ILE 132 Cb -0.02 -2.14 0.02 0.00 0.01 0.00 0.00 42.46 40.32 2yug s ILE 132 CO 0.07 -0.71 0.18 -1.83 0.00 0.00 0.00 174.94 172.65 2yug s GLU 133 N 0.98 2.23 -0.25 2.79 -1.05 -1.12 -2.05 118.70 120.23 2yug s GLU 133 Ca 0.12 -2.28 -0.10 0.00 -0.15 0.00 0.00 54.97 52.57 2yug s GLU 133 Cb -0.20 -1.76 -0.04 0.00 -0.44 0.00 0.00 34.13 31.69 2yug s GLU 133 CO -0.13 -0.52 0.14 0.00 0.95 0.00 0.00 175.26 175.71 2yug s ALA 134 N -2.86 3.45 0.95 -0.84 0.00 -1.24 -2.28 121.76 118.94 2yug s ALA 134 Ca 0.15 -1.01 -0.15 0.00 0.00 0.00 0.00 51.96 50.95 2yug s ALA 134 Cb -0.01 -2.28 0.18 0.00 0.00 0.00 0.00 23.12 21.00 2yug s ALA 134 CO 0.09 -0.36 1.25 0.15 0.00 0.00 0.00 175.76 176.89 2yug s LYS 135 N 1.39 0.76 1.43 0.00 1.02 -0.05 -4.90 119.74 119.38 2yug s LYS 135 Ca 0.07 -0.19 -0.22 0.00 0.02 0.00 0.00 55.97 55.64 2yug s LYS 135 Cb -0.15 -1.84 0.37 0.00 -0.52 0.00 0.00 37.83 35.69 2yug s LYS 135 CO 0.06 -2.37 0.90 0.09 -0.92 0.00 0.00 175.35 173.12 2yug n ASN 136 N -3.79 -3.74 0.27 2.83 4.13 -1.26 -3.50 115.26 110.20 2yug n ASN 136 Ca 0.13 -0.74 0.13 0.00 1.68 0.00 0.00 54.58 55.78 2yug n ASN 136 Cb 0.60 -1.06 0.82 0.00 -1.54 0.00 0.00 39.78 38.60 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 -3.49 0.00 -6.24 3.52 1.57 -1.96 -3.34 116.57 106.64 2yug h LYS 137 Ca -0.45 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 57.75 2yug h LYS 137 Cb 1.34 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.67 2yug h LYS 137 CO 0.30 0.00 1.24 0.25 -0.57 0.00 0.00 179.45 180.67 2yug n THR 138 N -4.05 0.60 -3.26 -0.16 -2.24 -1.26 -4.79 114.28 99.11 2yug n THR 138 Ca -0.02 -0.19 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 2yug n THR 138 Cb 0.12 -2.16 -0.08 0.00 -2.10 0.00 0.00 70.33 66.12 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 5.17 3.48 0.47 6.98 0.00 -1.26 -4.92 121.76 131.68 2yug s ALA 139 Ca 0.94 -1.02 0.08 0.00 0.00 0.00 0.00 51.96 51.96 2yug s ALA 139 Cb -0.54 -2.99 0.03 0.00 0.00 0.00 0.00 23.12 19.62 2yug s ALA 139 CO 0.45 -1.18 0.62 0.20 0.00 0.00 0.00 175.76 175.85 2yug s GLY 140 N 1.75 1.90 0.41 0.00 0.00 -1.26 -4.98 107.32 105.14 2yug s GLY 140 Ca 0.18 -1.83 0.11 0.00 0.00 0.00 0.00 44.72 43.18 2yug s GLY 140 CO 0.13 -1.58 1.96 0.83 0.00 0.00 0.00 173.10 174.43 2yug h GLU 141 N 0.52 0.20 0.02 2.90 5.08 -1.97 -2.35 114.58 118.98 2yug h GLU 141 Ca -0.37 -0.04 -0.21 0.00 -1.00 0.00 0.00 59.36 57.74 2yug h GLU 141 Cb 1.28 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 2yug h GLU 141 CO 0.45 0.31 -1.00 0.93 -1.00 0.00 0.00 179.01 178.70 2yug h GLU 142 N 0.19 0.05 -0.16 2.33 4.39 -1.99 -3.23 114.58 116.16 2yug h GLU 142 Ca 0.04 -0.08 0.04 0.00 0.34 0.00 0.00 59.36 59.70 2yug h GLU 142 Cb 0.31 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 2yug h GLU 142 CO 0.02 1.00 0.11 0.93 -1.16 0.00 0.00 179.01 179.91 2yug h GLU 143 N 0.02 0.05 -6.97 2.33 3.07 -1.73 -3.43 114.58 107.91 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 1.74 -0.01 0.14 0.00 -0.84 0.00 0.00 28.75 29.77 2yug h GLU 143 CO 0.14 0.04 0.55 -1.33 -1.40 0.00 0.00 179.01 177.00 2yug n MET 144 N -4.50 1.73 -4.25 2.33 2.81 -1.19 -4.77 117.12 109.29 2yug n MET 144 Ca 0.01 0.63 -0.15 0.00 -1.81 0.00 0.00 57.70 56.37 2yug n MET 144 Cb 0.20 -2.51 -0.10 0.00 -0.71 0.00 0.00 33.22 30.10 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 -1.28 1.23 -0.94 2.02 -4.36 -0.83 -4.91 121.20 112.14 2yug s ILE 145 Ca 0.69 -1.97 -0.13 0.00 -0.26 0.00 0.00 60.65 58.98 2yug s ILE 145 Cb -0.44 -1.76 0.23 0.00 1.25 0.00 0.00 42.46 41.74 2yug s ILE 145 CO 0.52 -0.65 0.93 -0.54 0.24 0.00 0.00 174.94 175.43 2yug s LYS 146 N -3.44 3.82 -0.55 0.37 1.02 -0.63 -4.41 119.74 115.91 2yug s LYS 146 Ca 0.15 -2.66 -0.28 0.00 0.02 0.00 0.00 55.97 53.19 2yug s LYS 146 Cb 0.00 -4.53 0.02 0.00 -0.52 0.00 0.00 37.83 32.80 2yug s LYS 146 CO 0.02 -1.33 1.38 0.42 -0.92 0.00 0.00 175.35 174.92 2yug s ILE 147 N -0.06 3.83 0.60 2.17 1.01 -1.26 -2.05 121.20 125.45 2yug s ILE 147 Ca 0.24 0.73 0.09 0.00 0.00 0.00 0.00 60.65 61.72 2yug s ILE 147 Cb -0.09 -4.45 0.10 0.00 0.01 0.00 0.00 42.46 38.02 2yug s ILE 147 CO -0.08 -1.15 0.83 -0.13 0.00 0.00 0.00 174.94 174.41 2yug s ARG 148 N 5.37 2.19 -0.25 2.79 0.52 0.23 -2.27 118.95 127.53 2yug s ARG 148 Ca 0.52 -1.66 -0.18 0.00 -0.52 0.00 0.00 55.73 53.88 2yug s ARG 148 Cb -0.11 -2.61 0.07 0.00 0.52 0.00 0.00 34.95 32.82 2yug s ARG 148 CO 0.26 -0.98 0.64 0.45 0.02 0.00 0.00 175.30 175.69 2yug s SER 149 N -4.71 -0.77 -0.42 0.23 0.15 0.33 -2.62 113.70 105.88 2yug s SER 149 Ca 0.63 1.35 0.05 0.00 0.70 0.00 0.00 55.95 58.68 2yug s SER 149 Cb -0.05 1.29 0.59 0.00 -1.71 0.00 0.00 66.02 66.14 2yug s SER 149 CO 0.40 -0.23 1.77 0.00 1.20 0.00 0.00 173.24 176.38 2yug s ALA 151 N -3.36 2.09 -0.53 0.00 0.00 -1.26 -4.97 121.76 113.72 2yug s ALA 151 Ca 0.54 -0.37 -0.29 0.00 0.00 0.00 0.00 51.96 51.84 2yug s ALA 151 Cb 0.46 -3.06 0.03 0.00 0.00 0.00 0.00 23.12 20.54 2yug s ALA 151 CO 0.06 -1.94 1.18 -1.21 0.00 0.00 0.00 175.76 173.85 2yug s GLU 152 N -5.24 3.60 1.31 0.00 8.01 -1.26 -4.99 118.70 120.13 2yug s GLU 152 Ca 0.62 0.41 -0.19 0.00 0.01 0.00 0.00 54.97 55.82 2yug s GLU 152 Cb -0.14 -3.97 0.33 0.00 -4.31 0.00 0.00 34.13 26.03 2yug s GLU 152 CO 0.53 -1.56 0.99 1.03 0.01 0.00 0.00 175.26 176.26 2yug s ARG 153 N 4.76 -2.06 -0.43 1.61 0.52 -1.26 -5.01 118.95 117.08 2yug s ARG 153 Ca 0.46 0.30 0.03 0.00 -0.52 0.00 0.00 55.73 56.00 2yug s ARG 153 Cb -0.07 -1.47 0.12 0.00 0.52 0.00 0.00 34.95 34.05 2yug s ARG 153 CO 0.29 -4.34 0.17 -1.21 0.02 0.00 0.00 175.30 170.22 2yug s GLU 154 N -4.95 1.64 0.00 3.54 2.02 -1.26 -5.30 118.70 114.38 2yug s GLU 154 Ca 0.69 -2.19 0.00 0.00 0.02 0.00 0.00 54.97 53.49 2yug s GLU 154 Cb -0.16 -3.08 0.00 0.00 0.10 0.00 0.00 34.13 30.99 2yug s GLU 154 CO 0.59 -1.05 0.00 2.41 0.02 0.00 0.00 175.26 177.24