#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dtd s PHE 2 N 0.00 3.53 0.62 1.61 0.40 -1.26 -4.97 117.98 117.91 2dtd s PHE 2 Ca 0.00 -2.22 0.30 0.00 -0.60 0.00 0.00 56.93 54.41 2dtd s PHE 2 Cb 0.00 -3.28 1.66 0.00 0.51 0.00 0.00 43.02 41.91 2dtd s PHE 2 CO 0.00 -0.97 2.01 0.66 0.70 0.00 0.00 175.22 177.62 2dtd h SER 3 N 8.18 0.00 0.91 1.36 4.64 -2.01 -1.40 113.55 125.23 2dtd h SER 3 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2dtd h SER 3 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 2dtd h SER 3 CO 0.75 0.00 0.00 -2.24 -0.87 0.00 0.00 176.83 174.47 2dtd h ASP 4 N 0.00 0.00 1.32 4.97 2.03 -1.94 -2.88 116.42 119.92 2dtd h ASP 4 Ca 0.09 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.39 2dtd h ASP 4 Cb 0.70 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.20 2dtd h ASP 4 CO -0.00 0.00 -0.03 0.18 -1.03 0.00 0.00 179.24 178.36 2dtd n LEU 5 N -2.33 0.60 -4.74 0.15 4.77 -0.53 -4.72 117.00 110.20 2dtd n LEU 5 Ca 0.03 0.54 -0.42 0.00 -0.03 0.00 0.00 56.01 56.13 2dtd n LEU 5 Cb 0.28 -0.36 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2dtd n LEU 5 CO 0.23 -0.13 1.28 -0.60 -1.33 0.00 0.00 177.39 176.83 2dtd s ARG 6 N -3.08 4.13 0.00 3.23 3.52 -1.09 -1.96 118.95 123.70 2dtd s ARG 6 Ca 0.11 2.57 0.00 0.00 -0.13 0.00 0.00 55.73 58.28 2dtd s ARG 6 Cb 0.14 -3.05 0.00 0.00 -1.56 0.00 0.00 34.95 30.49 2dtd s ARG 6 CO 0.58 -0.66 0.00 -0.25 -0.81 0.00 0.00 175.30 174.17 2dtd n ASP 7 N 2.76 0.00 -4.78 -2.12 10.43 0.09 -4.88 116.55 118.05 2dtd n ASP 7 Ca 0.10 0.00 -0.37 0.00 2.57 0.00 0.00 54.79 57.10 2dtd n ASP 7 Cb 0.37 -1.14 -0.04 0.00 1.84 0.00 0.00 41.12 42.15 2dtd n ASP 7 CO 0.00 0.00 0.00 -0.54 -1.07 0.00 0.00 177.20 175.59 2dtd s LYS 8 N -0.33 4.13 -0.35 -1.24 1.02 -0.83 -4.57 119.74 117.58 2dtd s LYS 8 Ca 0.00 1.55 -0.24 0.00 0.02 0.00 0.00 55.97 57.29 2dtd s LYS 8 Cb 0.00 -2.54 0.01 0.00 -0.52 0.00 0.00 37.83 34.78 2dtd s LYS 8 CO 0.00 -0.18 0.84 0.08 -0.92 0.00 0.00 175.35 175.18 2dtd s VAL 9 N -1.64 4.69 -0.16 3.17 1.01 -1.26 -0.40 120.40 125.81 2dtd s VAL 9 Ca 0.58 1.09 0.01 0.00 0.00 0.00 0.00 61.98 63.66 2dtd s VAL 9 Cb -0.23 -4.24 0.01 0.00 0.00 0.00 0.00 36.38 31.91 2dtd s VAL 9 CO 0.29 -0.43 -0.17 -0.69 0.00 0.00 0.00 175.10 174.10 2dtd s VAL 10 N 3.21 2.40 -0.18 2.92 1.01 0.11 -1.48 120.40 128.39 2dtd s VAL 10 Ca 0.34 -0.85 -0.07 0.00 0.00 0.00 0.00 61.98 61.41 2dtd s VAL 10 Cb -0.13 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2dtd s VAL 10 CO 0.16 0.52 0.04 -0.63 0.00 0.00 0.00 175.10 175.20 2dtd s ILE 11 N 1.00 4.59 -0.10 2.22 1.01 0.33 -1.08 121.20 129.17 2dtd s ILE 11 Ca -0.02 -0.10 0.02 0.00 0.00 0.00 0.00 60.65 60.54 2dtd s ILE 11 Cb -0.15 -3.06 0.02 0.00 0.01 0.00 0.00 42.46 39.28 2dtd s ILE 11 CO -0.04 0.46 -0.14 -0.69 0.00 0.00 0.00 174.94 174.53 2dtd s VAL 12 N 0.41 1.35 0.01 2.92 1.01 -0.66 0.54 120.40 125.98 2dtd s VAL 12 Ca 0.02 -0.56 -0.08 0.00 0.00 0.00 0.00 61.98 61.36 2dtd s VAL 12 Cb -0.13 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 34.95 2dtd s VAL 12 CO 0.01 0.41 0.29 0.42 0.00 0.00 0.00 175.10 176.23 2dtd s THR 13 N 1.01 5.26 -1.11 3.92 -4.23 -0.75 -0.86 115.64 118.89 2dtd s THR 13 Ca -0.07 0.28 -0.02 0.00 -1.18 0.00 0.00 61.69 60.70 2dtd s THR 13 Cb -0.15 -3.58 0.00 0.00 1.34 0.00 0.00 72.50 70.12 2dtd s THR 13 CO -0.01 0.40 0.93 0.61 -0.54 0.00 0.00 174.62 176.01 2dtd n GLY 14 N 1.23 -0.30 1.29 3.99 0.00 -0.25 -2.15 105.19 108.99 2dtd n GLY 14 Ca -0.12 0.07 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 2dtd n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dtd n ALA 15 N -4.00 4.25 1.16 4.61 0.00 -1.26 -4.08 120.51 121.18 2dtd n ALA 15 Ca -0.21 -2.91 0.13 0.00 0.00 0.00 0.00 53.44 50.45 2dtd n ALA 15 Cb 0.63 -0.85 0.34 0.00 0.00 0.00 0.00 19.45 19.57 2dtd n ALA 15 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2dtd n SER 16 N -0.97 0.81 -3.66 0.00 3.41 -1.26 -3.80 113.62 108.15 2dtd n SER 16 Ca 0.35 -0.64 -0.09 0.00 -0.26 0.00 0.00 58.87 58.24 2dtd n SER 16 Cb 1.11 0.16 -0.02 0.00 -0.26 0.00 0.00 64.21 65.21 2dtd n SER 16 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 2dtd s MET 17 N -2.68 1.47 4.87 4.33 -2.45 -1.26 -4.71 119.30 118.87 2dtd s MET 17 Ca 0.20 -0.72 0.00 0.00 -1.25 0.00 0.00 55.69 53.92 2dtd s MET 17 Cb 0.19 0.56 0.00 0.00 1.25 0.00 0.00 34.83 36.83 2dtd s MET 17 CO 0.58 -0.66 0.00 0.41 1.05 0.00 0.00 175.02 176.40 2dtd n GLY 18 N -0.42 3.19 0.16 2.11 0.00 -1.26 -2.48 105.19 106.50 2dtd n GLY 18 Ca -0.09 -0.06 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 2dtd n GLY 18 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2dtd h ILE 19 N 0.00 1.13 -0.65 -0.61 2.04 -1.91 -1.67 117.51 115.83 2dtd h ILE 19 Ca 0.00 -0.31 0.03 0.00 1.00 0.00 0.00 64.86 65.58 2dtd h ILE 19 Cb 0.00 0.70 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 2dtd h ILE 19 CO 0.00 0.13 0.43 1.23 0.00 0.00 0.00 178.15 179.94 2dtd h GLY 20 N 0.44 0.88 1.29 5.37 0.00 -1.68 -1.06 103.07 108.31 2dtd h GLY 20 Ca 0.12 -0.30 -0.23 0.00 0.00 0.00 0.00 47.33 46.92 2dtd h GLY 20 CO -0.02 0.26 -0.85 -0.09 0.00 0.00 0.00 176.54 175.85 2dtd h ARG 21 N 0.77 0.68 -0.23 4.80 2.43 -1.16 -2.06 114.38 119.61 2dtd h ARG 21 Ca 0.26 -0.61 -0.06 0.00 -0.81 0.00 0.00 59.98 58.77 2dtd h ARG 21 Cb 0.08 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2dtd h ARG 21 CO -0.07 1.21 -0.10 0.00 -1.51 0.00 0.00 179.97 179.50 2dtd h ALA 22 N 0.60 1.40 -0.21 2.80 0.00 -0.73 -0.58 119.26 122.54 2dtd h ALA 22 Ca -0.07 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.54 2dtd h ALA 22 Cb 1.47 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 2dtd h ALA 22 CO 0.17 0.41 -0.15 0.82 0.00 0.00 0.00 179.25 180.50 2dtd h ILE 23 N 0.35 1.32 -0.54 0.00 2.04 -1.13 -1.49 117.51 118.06 2dtd h ILE 23 Ca 0.07 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 64.65 2dtd h ILE 23 Cb 0.40 1.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.15 2dtd h ILE 23 CO 0.02 0.38 0.27 0.00 0.00 0.00 0.00 178.15 178.82 2dtd h ALA 24 N 0.68 0.69 -0.08 1.87 0.00 -1.09 -2.31 119.26 119.02 2dtd h ALA 24 Ca 0.04 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2dtd h ALA 24 Cb 0.66 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2dtd h ALA 24 CO 0.04 0.25 -0.20 0.93 0.00 0.00 0.00 179.25 180.27 2dtd h GLU 25 N 0.72 0.14 -0.17 0.00 5.08 -1.04 -1.62 114.58 117.69 2dtd h GLU 25 Ca 0.19 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.39 2dtd h GLU 25 Cb 0.11 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2dtd h GLU 25 CO -0.02 0.34 -0.37 -0.09 -1.00 0.00 0.00 179.01 177.87 2dtd h ARG 26 N 0.13 0.56 -0.37 2.33 9.65 -0.98 -1.97 114.38 123.72 2dtd h ARG 26 Ca 0.02 -0.37 -0.07 0.00 -1.10 0.00 0.00 59.98 58.47 2dtd h ARG 26 Cb 0.44 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.05 2dtd h ARG 26 CO 0.03 0.98 -0.05 0.74 2.80 0.00 0.00 179.97 184.47 2dtd h PHE 27 N 0.21 0.65 -0.53 2.20 -1.00 -1.19 -0.87 116.94 116.41 2dtd h PHE 27 Ca 0.00 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 60.67 2dtd h PHE 27 Cb 0.97 -0.18 -0.02 0.00 3.61 0.00 0.00 35.95 40.32 2dtd h PHE 27 CO 0.09 0.66 0.25 0.28 -1.61 0.00 0.00 178.31 177.98 2dtd h VAL 28 N 0.58 1.20 0.00 -0.55 2.07 -1.23 -0.82 116.25 117.50 2dtd h VAL 28 Ca 0.11 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 2dtd h VAL 28 Cb 0.44 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 2dtd h VAL 28 CO 0.02 0.23 -0.08 0.44 0.02 0.00 0.00 177.57 178.20 2dtd h ASP 29 N 0.72 0.00 -0.02 0.57 3.32 -0.64 -0.07 116.42 120.29 2dtd h ASP 29 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 2dtd h ASP 29 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2dtd h ASP 29 CO -0.02 0.08 0.00 -0.62 -1.72 0.00 0.00 179.24 176.96 2dtd n GLU 30 N -3.80 1.26 -0.99 3.56 -0.58 -0.40 -4.89 120.64 114.80 2dtd n GLU 30 Ca -0.02 -0.38 0.00 0.00 -0.42 0.00 0.00 57.16 56.34 2dtd n GLU 30 Cb 0.18 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 2dtd n GLU 30 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2dtd n GLY 31 N 1.02 0.44 3.89 0.62 0.00 -0.04 -3.22 105.19 107.90 2dtd n GLY 31 Ca 0.20 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.33 2dtd n GLY 31 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dtd s SER 32 N -2.54 4.93 -0.54 1.61 0.01 -0.44 -0.73 113.70 116.00 2dtd s SER 32 Ca 0.00 0.93 -0.16 0.00 1.31 0.00 0.00 55.95 58.03 2dtd s SER 32 Cb 0.00 -1.56 0.12 0.00 0.21 0.00 0.00 66.02 64.79 2dtd s SER 32 CO 0.00 -1.65 0.50 -0.54 0.41 0.00 0.00 173.24 171.96 2dtd s LYS 33 N -5.48 2.99 -0.16 12.44 1.02 0.46 -4.59 119.74 126.42 2dtd s LYS 33 Ca 0.60 -1.64 -0.12 0.00 0.02 0.00 0.00 55.97 54.83 2dtd s LYS 33 Cb -0.11 -4.28 -0.05 0.00 -0.52 0.00 0.00 37.83 32.87 2dtd s LYS 33 CO 0.50 -1.31 0.22 0.08 -0.92 0.00 0.00 175.35 173.92 2dtd s VAL 34 N 1.68 5.35 -0.16 3.17 1.01 -1.26 -0.71 120.40 129.48 2dtd s VAL 34 Ca 0.04 0.40 -0.00 0.00 0.00 0.00 0.00 61.98 62.42 2dtd s VAL 34 Cb -0.29 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.57 2dtd s VAL 34 CO 0.04 0.45 -0.09 -0.63 0.00 0.00 0.00 175.10 174.87 2dtd s ILE 35 N 0.13 1.31 -0.19 2.22 1.09 -0.24 -1.38 121.20 124.14 2dtd s ILE 35 Ca 0.14 -0.64 -0.24 0.00 -1.10 0.00 0.00 60.65 58.81 2dtd s ILE 35 Cb -0.12 -1.37 -0.02 0.00 -1.06 0.00 0.00 42.46 39.89 2dtd s ILE 35 CO 0.02 0.26 0.76 -0.62 -0.10 0.00 0.00 174.94 175.26 2dtd s ASP 36 N 1.57 6.84 -0.38 3.58 3.68 0.84 -1.65 116.67 131.14 2dtd s ASP 36 Ca 0.02 1.03 -0.09 0.00 2.13 0.00 0.00 52.55 55.64 2dtd s ASP 36 Cb -0.14 -2.41 0.05 0.00 -1.45 0.00 0.00 42.92 38.96 2dtd s ASP 36 CO -0.09 -0.37 0.20 -0.76 0.13 0.00 0.00 175.17 174.28 2dtd s LEU 37 N 2.16 4.78 0.16 -1.34 1.43 -0.04 -0.47 118.68 125.36 2dtd s LEU 37 Ca 0.34 -1.24 -0.22 0.00 -1.03 0.00 0.00 54.13 51.98 2dtd s LEU 37 Cb -0.16 -1.96 0.06 0.00 0.03 0.00 0.00 46.19 44.16 2dtd s LEU 37 CO 0.11 -0.43 0.58 -0.94 0.23 0.00 0.00 176.35 175.90 2dtd s SER 38 N 1.72 -0.52 0.28 2.29 1.04 -1.03 -1.09 113.70 116.38 2dtd s SER 38 Ca 0.01 -0.05 0.15 0.00 0.48 0.00 0.00 55.95 56.54 2dtd s SER 38 Cb -0.21 0.59 0.20 0.00 0.10 0.00 0.00 66.02 66.70 2dtd s SER 38 CO 0.04 -0.96 1.50 0.16 0.98 0.00 0.00 173.24 174.95 2dtd h ILE 39 N 2.04 1.03 -3.13 -1.02 3.07 -1.74 -1.38 117.51 116.38 2dtd h ILE 39 Ca -0.34 -2.23 -0.57 0.00 1.55 0.00 0.00 64.86 63.28 2dtd h ILE 39 Cb 1.30 2.35 -0.03 0.00 -0.27 0.00 0.00 36.82 40.17 2dtd h ILE 39 CO 0.39 0.54 -0.30 -1.00 -1.05 0.00 0.00 178.15 176.73 2dtd s HIS 40 N -3.11 3.47 -0.10 0.16 3.76 -1.26 -4.80 115.29 113.40 2dtd s HIS 40 Ca 0.02 0.54 -0.28 0.00 -0.15 0.00 0.00 55.06 55.20 2dtd s HIS 40 Cb 0.09 -2.00 -0.02 0.00 1.11 0.00 0.00 32.58 31.76 2dtd s HIS 40 CO 0.74 0.40 0.92 0.34 -0.85 0.00 0.00 174.74 176.29 2dtd s ASP 41 N -2.59 7.15 0.00 1.40 3.68 -1.26 -4.81 116.67 120.24 2dtd s ASP 41 Ca 0.41 1.41 0.29 0.00 2.13 0.00 0.00 52.55 56.78 2dtd s ASP 41 Cb -0.12 -2.51 1.70 0.00 -1.45 0.00 0.00 42.92 40.54 2dtd s ASP 41 CO 0.25 -0.37 2.07 -0.81 0.13 0.00 0.00 175.17 176.44 2dtd n PRO 42 N 4.77 0.95 0.00 4.34 -0.04 -1.26 -4.98 135.00 138.78 2dtd n PRO 42 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 2dtd n PRO 42 Cb 0.49 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 2dtd n PRO 42 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dtd n GLY 43 N 0.87 3.34 3.63 0.55 0.00 -1.26 -4.43 105.19 107.87 2dtd n GLY 43 Ca 0.21 -0.22 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2dtd n GLY 43 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dtd s GLU 44 N 0.00 3.72 -0.05 1.61 -6.30 -1.26 -4.96 118.70 111.46 2dtd s GLU 44 Ca 0.00 1.73 -0.15 0.00 -2.50 0.00 0.00 54.97 54.06 2dtd s GLU 44 Cb 0.00 -4.09 0.03 0.00 0.00 0.00 0.00 34.13 30.07 2dtd s GLU 44 CO 0.00 -1.39 0.33 0.00 0.02 0.00 0.00 175.26 174.22 2dtd s ALA 45 N 5.56 -0.84 -2.00 6.30 0.00 -1.26 -5.03 121.76 124.49 2dtd s ALA 45 Ca 0.76 0.53 0.28 0.00 0.00 0.00 0.00 51.96 53.53 2dtd s ALA 45 Cb -0.26 -0.10 1.65 0.00 0.00 0.00 0.00 23.12 24.41 2dtd s ALA 45 CO 0.31 -0.24 2.01 1.63 0.00 0.00 0.00 175.76 179.47 2dtd n LYS 46 N 1.68 0.89 -4.40 0.00 5.02 -1.26 -4.81 118.16 115.27 2dtd n LYS 46 Ca -0.19 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 55.89 2dtd n LYS 46 Cb 0.56 -1.48 -0.10 0.00 -0.02 0.00 0.00 35.03 33.99 2dtd n LYS 46 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2dtd s TYR 47 N -2.00 1.93 0.65 2.13 -0.85 -1.26 -4.99 117.35 112.96 2dtd s TYR 47 Ca 0.41 -0.55 -0.14 0.00 -0.52 0.00 0.00 57.07 56.27 2dtd s TYR 47 Cb 0.19 -0.95 -0.01 0.00 0.38 0.00 0.00 41.96 41.58 2dtd s TYR 47 CO 0.32 0.43 1.08 -0.51 -1.52 0.00 0.00 175.55 175.34 2dtd s ASP 48 N -3.40 5.35 0.00 -0.18 -0.00 -0.48 -4.90 116.67 113.06 2dtd s ASP 48 Ca 0.26 1.86 0.00 0.00 -0.00 0.00 0.00 52.55 54.67 2dtd s ASP 48 Cb -0.00 -2.53 -0.00 0.00 -0.00 0.00 0.00 42.92 40.38 2dtd s ASP 48 CO 0.10 -1.46 -0.01 -2.28 -0.00 0.00 0.00 175.17 171.52 2dtd s HIS 49 N -2.54 0.13 -0.08 4.23 5.65 -1.26 -0.11 115.29 121.30 2dtd s HIS 49 Ca 0.64 -0.09 -0.01 0.00 0.25 0.00 0.00 55.06 55.85 2dtd s HIS 49 Cb -0.17 -0.08 0.03 0.00 -1.18 0.00 0.00 32.58 31.17 2dtd s HIS 49 CO 0.43 -0.02 -0.02 0.42 -0.65 0.00 0.00 174.74 174.89 2dtd s ILE 50 N -0.22 0.56 0.00 0.89 1.01 0.38 -4.91 121.20 118.92 2dtd s ILE 50 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 60.65 60.34 2dtd s ILE 50 Cb -0.02 -0.67 -0.08 0.00 0.01 0.00 0.00 42.46 41.70 2dtd s ILE 50 CO -0.00 0.29 1.95 -0.70 0.00 0.00 0.00 174.94 176.48 2dtd s GLU 51 N 1.85 4.06 -0.22 2.79 2.12 -1.25 -2.47 118.70 125.57 2dtd s GLU 51 Ca 0.04 2.51 -0.17 0.00 0.36 0.00 0.00 54.97 57.72 2dtd s GLU 51 Cb -0.12 -4.16 0.06 0.00 0.26 0.00 0.00 34.13 30.17 2dtd s GLU 51 CO -0.06 -1.04 0.57 0.00 -0.54 0.00 0.00 175.26 174.19 2dtd s ASP 53 N 0.91 6.15 0.65 0.00 -1.08 -1.26 -2.23 116.67 119.81 2dtd s ASP 53 Ca -0.05 -0.89 0.37 0.00 -0.52 0.00 0.00 52.55 51.46 2dtd s ASP 53 Cb -0.05 -2.19 2.07 0.00 -1.46 0.00 0.00 42.92 41.28 2dtd s ASP 53 CO -0.08 -0.54 2.21 -0.37 0.52 0.00 0.00 175.17 176.91 2dtd h VAL 54 N 5.69 0.13 -0.01 1.11 -1.51 -1.94 0.07 116.25 119.80 2dtd h VAL 54 Ca -0.27 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 2dtd h VAL 54 Cb 1.11 0.89 0.00 0.00 -2.13 0.00 0.00 31.29 31.17 2dtd h VAL 54 CO 0.78 0.00 -0.10 0.35 -1.23 0.00 0.00 177.57 177.37 2dtd n THR 55 N -3.23 0.00 -3.38 7.19 -2.24 -1.26 -4.40 114.28 106.96 2dtd n THR 55 Ca -0.02 -0.12 -0.45 0.00 -2.27 0.00 0.00 64.05 61.20 2dtd n THR 55 Cb 0.19 0.12 -0.05 0.00 -2.10 0.00 0.00 70.33 68.48 2dtd n THR 55 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2dtd s ASN 56 N -2.30 6.17 0.43 3.42 3.84 0.01 -4.96 114.94 121.55 2dtd s ASN 56 Ca 0.32 -2.06 0.17 0.00 0.21 0.00 0.00 52.86 51.51 2dtd s ASN 56 Cb 0.20 -2.15 1.08 0.00 -0.55 0.00 0.00 41.25 39.84 2dtd s ASN 56 CO 0.44 -0.74 1.90 1.55 -2.79 0.00 0.00 177.10 177.46 2dtd h PRO 57 N 8.48 0.38 -0.20 0.43 0.13 -1.83 -0.41 132.00 138.98 2dtd h PRO 57 Ca -0.18 -0.02 -0.15 0.00 -0.87 0.00 0.00 66.00 64.78 2dtd h PRO 57 Cb 1.08 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 2dtd h PRO 57 CO 0.93 0.25 -0.50 -0.44 -0.23 0.00 0.00 178.00 178.00 2dtd h ASP 58 N 0.39 0.60 -0.18 1.44 3.45 -1.93 -1.67 116.42 118.51 2dtd h ASP 58 Ca 0.40 -0.30 -0.13 0.00 0.43 0.00 0.00 57.03 57.43 2dtd h ASP 58 Cb 0.97 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 39.58 2dtd h ASP 58 CO -0.13 1.00 -0.39 -0.61 -1.57 0.00 0.00 179.24 177.54 2dtd h GLN 59 N 0.43 0.59 0.24 3.56 4.15 -1.57 -2.70 115.11 119.80 2dtd h GLN 59 Ca 0.02 -0.38 -0.01 0.00 0.77 0.00 0.00 58.65 59.04 2dtd h GLN 59 Cb 1.03 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.77 2dtd h GLN 59 CO 0.09 1.00 -0.13 0.28 -1.93 0.00 0.00 178.83 178.15 2dtd h VAL 60 N 0.25 0.74 -0.31 2.39 2.07 -1.05 -0.46 116.25 119.88 2dtd h VAL 60 Ca 0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 2dtd h VAL 60 Cb 0.99 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 2dtd h VAL 60 CO 0.09 0.00 0.04 0.50 0.02 0.00 0.00 177.57 178.21 2dtd h LYS 61 N -0.34 0.14 -0.86 1.57 3.64 -1.39 -1.50 116.57 117.83 2dtd h LYS 61 Ca -0.03 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2dtd h LYS 61 Cb 0.27 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 2dtd h LYS 61 CO 0.04 0.09 0.53 0.00 -2.27 0.00 0.00 179.45 177.84 2dtd h ALA 62 N 1.24 1.10 -0.18 5.00 0.00 -1.30 -0.84 119.26 124.28 2dtd h ALA 62 Ca 0.14 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 2dtd h ALA 62 Cb 0.17 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2dtd h ALA 62 CO -0.21 0.54 -0.26 0.77 0.00 0.00 0.00 179.25 180.10 2dtd h SER 63 N 1.18 0.32 0.88 0.00 0.02 -0.70 -1.61 113.55 113.64 2dtd h SER 63 Ca 0.31 -0.10 -0.17 0.00 -0.84 0.00 0.00 61.79 60.99 2dtd h SER 63 Cb -0.07 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 2dtd h SER 63 CO -0.06 0.58 -0.81 0.40 -1.14 0.00 0.00 176.83 175.81 2dtd h ILE 64 N 0.29 1.54 -0.09 3.27 2.04 -0.64 -2.21 117.51 121.70 2dtd h ILE 64 Ca 0.05 -2.80 -0.22 0.00 1.00 0.00 0.00 64.86 62.89 2dtd h ILE 64 Cb 0.61 2.53 0.01 0.00 -0.74 0.00 0.00 36.82 39.22 2dtd h ILE 64 CO 0.04 0.79 -0.82 0.44 0.00 0.00 0.00 178.15 178.60 2dtd h ASP 65 N 0.00 0.76 -0.54 1.72 3.32 -0.95 -1.99 116.42 118.73 2dtd h ASP 65 Ca -0.01 -0.52 -0.02 0.00 0.02 0.00 0.00 57.03 56.50 2dtd h ASP 65 Cb 1.46 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 2dtd h ASP 65 CO 0.10 1.31 0.25 -0.74 -1.72 0.00 0.00 179.24 178.45 2dtd h HIS 66 N 0.41 0.78 -0.11 4.55 -0.00 -1.24 -1.24 115.15 118.30 2dtd h HIS 66 Ca -0.06 -0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.26 2dtd h HIS 66 Cb 1.44 -0.24 -0.00 0.00 -0.00 0.00 0.00 27.41 28.60 2dtd h HIS 66 CO 0.07 0.61 0.03 0.82 -0.00 0.00 0.00 177.93 179.47 2dtd h ILE 67 N 0.73 1.19 -0.30 6.26 2.04 -1.35 -1.39 117.51 124.68 2dtd h ILE 67 Ca 0.18 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 2dtd h ILE 67 Cb 0.13 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2dtd h ILE 67 CO -0.02 0.17 0.13 0.15 0.00 0.00 0.00 178.15 178.58 2dtd h PHE 68 N -0.02 0.45 0.00 1.37 3.04 -1.25 0.19 116.94 120.72 2dtd h PHE 68 Ca 0.03 -0.03 -0.12 0.00 3.98 0.00 0.00 57.97 61.84 2dtd h PHE 68 Cb 0.24 -0.14 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 2dtd h PHE 68 CO 0.00 0.43 -0.55 0.87 -2.02 0.00 0.00 178.31 177.04 2dtd h LYS 69 N 0.34 0.00 0.18 1.11 1.57 -1.27 0.55 116.57 119.05 2dtd h LYS 69 Ca 0.10 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.58 2dtd h LYS 69 Cb 0.16 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.49 2dtd h LYS 69 CO -0.01 0.55 -1.33 1.49 -0.57 0.00 0.00 179.45 179.58 2dtd h GLU 70 N 0.00 0.39 0.00 3.15 4.81 -1.05 -3.38 114.58 118.50 2dtd h GLU 70 Ca -0.01 -0.65 -0.17 0.00 -0.13 0.00 0.00 59.36 58.40 2dtd h GLU 70 Cb 0.99 0.24 -0.03 0.00 0.63 0.00 0.00 28.75 30.58 2dtd h GLU 70 CO 0.07 1.31 -2.17 0.66 -0.73 0.00 0.00 179.01 178.15 2dtd n TYR 71 N -3.61 0.00 0.00 0.92 4.01 0.65 -5.01 117.16 114.11 2dtd n TYR 71 Ca -0.12 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.62 2dtd n TYR 71 Cb 1.05 -0.72 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 2dtd n TYR 71 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2dtd n GLY 72 N 1.50 0.76 3.82 2.72 0.00 0.19 -5.00 105.19 109.18 2dtd n GLY 72 Ca -0.17 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.86 2dtd n GLY 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dtd s SER 73 N -2.27 -0.03 -0.14 1.61 1.04 -1.23 -4.99 113.70 107.70 2dtd s SER 73 Ca 0.00 -0.25 -0.04 0.00 0.48 0.00 0.00 55.95 56.14 2dtd s SER 73 Cb 0.00 0.21 0.07 0.00 0.10 0.00 0.00 66.02 66.40 2dtd s SER 73 CO 0.00 -0.41 0.20 -0.63 0.98 0.00 0.00 173.24 173.37 2dtd s ILE 74 N -2.25 -0.30 -0.21 -1.02 1.01 -1.26 -4.63 121.20 112.53 2dtd s ILE 74 Ca 0.22 0.15 0.09 0.00 0.00 0.00 0.00 60.65 61.11 2dtd s ILE 74 Cb 0.01 -0.47 -0.20 0.00 0.01 0.00 0.00 42.46 41.82 2dtd s ILE 74 CO -0.01 -0.00 -0.07 -1.20 0.00 0.00 0.00 174.94 173.65 2dtd n SER 75 N 5.33 1.22 -3.96 3.58 7.64 -0.55 -4.15 113.62 122.72 2dtd n SER 75 Ca -0.05 -0.06 -0.18 0.00 1.01 0.00 0.00 58.87 59.58 2dtd n SER 75 Cb 0.50 0.30 -0.15 0.00 -1.01 0.00 0.00 64.21 63.85 2dtd n SER 75 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2dtd s VAL 76 N -2.47 0.57 -0.17 0.44 1.01 -0.87 0.33 120.40 119.25 2dtd s VAL 76 Ca -0.21 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2dtd s VAL 76 Cb 0.07 -0.52 0.03 0.00 0.00 0.00 0.00 36.38 35.96 2dtd s VAL 76 CO 0.67 0.19 -0.12 -0.22 0.00 0.00 0.00 175.10 175.61 2dtd s LEU 77 N 0.18 1.88 -0.38 3.92 2.96 -0.87 -0.51 118.68 125.86 2dtd s LEU 77 Ca -0.02 -0.63 -0.09 0.00 -0.22 0.00 0.00 54.13 53.17 2dtd s LEU 77 Cb -0.07 -1.18 0.05 0.00 0.50 0.00 0.00 46.19 45.50 2dtd s LEU 77 CO -0.00 -0.10 0.20 -0.69 -1.32 0.00 0.00 176.35 174.44 2dtd s VAL 78 N 1.47 4.17 -0.34 1.68 1.01 0.19 -1.00 120.40 127.58 2dtd s VAL 78 Ca 0.03 -1.20 -0.25 0.00 0.00 0.00 0.00 61.98 60.56 2dtd s VAL 78 Cb -0.14 -3.45 0.01 0.00 0.00 0.00 0.00 36.38 32.80 2dtd s VAL 78 CO -0.10 -0.35 0.86 0.20 0.00 0.00 0.00 175.10 175.72 2dtd s ASN 79 N 1.75 6.68 0.00 3.32 0.01 -0.28 -1.81 114.94 124.61 2dtd s ASN 79 Ca 0.01 0.62 0.00 0.00 -0.71 0.00 0.00 52.86 52.79 2dtd s ASN 79 Cb -0.21 -2.44 0.00 0.00 0.41 0.00 0.00 41.25 39.01 2dtd s ASN 79 CO 0.03 -0.74 0.00 -3.20 -1.51 0.00 0.00 177.10 171.68 2dtd n ASN 80 N 6.50 1.93 -4.25 -1.22 5.15 -1.23 -0.65 115.26 121.50 2dtd n ASN 80 Ca 0.06 0.00 -0.56 0.00 -0.60 0.00 0.00 54.58 53.47 2dtd n ASN 80 Cb 0.48 0.04 -0.08 0.00 -0.53 0.00 0.00 39.78 39.69 2dtd n ASN 80 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2dtd n ALA 81 N -1.84 -3.17 -3.84 5.20 0.00 -0.92 -4.91 120.51 111.05 2dtd n ALA 81 Ca 0.00 0.55 -0.05 0.00 0.00 0.00 0.00 53.44 53.94 2dtd n ALA 81 Cb 0.23 -1.67 0.01 0.00 0.00 0.00 0.00 19.45 18.03 2dtd n ALA 81 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2dtd s GLY 82 N 0.38 0.11 0.25 0.00 0.00 -1.26 -4.55 107.32 102.24 2dtd s GLY 82 Ca 0.87 -0.36 -0.18 0.00 0.00 0.00 0.00 44.72 45.05 2dtd s GLY 82 CO 0.57 1.25 0.61 -0.26 0.00 0.00 0.00 173.10 175.26 2dtd s ILE 83 N -2.46 0.01 -0.21 0.90 -4.36 -1.26 -5.00 121.20 108.82 2dtd s ILE 83 Ca 0.18 -0.98 -0.19 0.00 -0.26 0.00 0.00 60.65 59.40 2dtd s ILE 83 Cb -0.03 -1.89 0.05 0.00 1.25 0.00 0.00 42.46 41.85 2dtd s ILE 83 CO 0.06 -0.03 0.56 -0.70 0.24 0.00 0.00 174.94 175.07 2dtd s GLU 84 N -3.92 0.65 0.04 0.37 2.12 -1.26 -4.90 118.70 111.80 2dtd s GLU 84 Ca 0.13 0.77 -0.04 0.00 0.36 0.00 0.00 54.97 56.19 2dtd s GLU 84 Cb -0.03 0.32 -0.02 0.00 0.26 0.00 0.00 34.13 34.65 2dtd s GLU 84 CO 0.04 -0.08 0.05 -1.54 -0.54 0.00 0.00 175.26 173.19 2dtd s SER 85 N 0.29 0.27 0.14 -1.70 1.04 -1.26 -5.13 113.70 107.36 2dtd s SER 85 Ca -0.00 -0.67 0.07 0.00 0.48 0.00 0.00 55.95 55.83 2dtd s SER 85 Cb -0.04 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.25 2dtd s SER 85 CO 0.01 -0.52 -0.04 -0.31 0.98 0.00 0.00 173.24 173.36 2dtd s TYR 86 N -2.92 2.81 0.00 5.02 2.02 -1.26 -4.80 117.35 118.22 2dtd s TYR 86 Ca -0.02 -0.14 0.00 0.00 -0.37 0.00 0.00 57.07 56.54 2dtd s TYR 86 Cb 0.01 -1.40 0.00 0.00 -0.40 0.00 0.00 41.96 40.16 2dtd s TYR 86 CO -0.06 0.49 0.00 0.41 -1.57 0.00 0.00 175.55 174.82 2dtd n GLY 87 N 0.21 3.87 3.78 0.71 0.00 -0.11 -4.89 105.19 108.77 2dtd n GLY 87 Ca -0.11 -0.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.93 2dtd n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dtd s LYS 88 N -2.37 2.84 0.62 1.61 1.02 -1.26 -4.40 119.74 117.80 2dtd s LYS 88 Ca 0.00 1.32 0.29 0.00 0.02 0.00 0.00 55.97 57.60 2dtd s LYS 88 Cb 0.00 -1.96 1.58 0.00 -0.52 0.00 0.00 37.83 36.93 2dtd s LYS 88 CO 0.00 -1.21 1.95 0.97 -0.92 0.00 0.00 175.35 176.14 2dtd h ILE 89 N -0.05 0.22 0.07 2.17 2.10 -1.96 -1.55 117.51 118.51 2dtd h ILE 89 Ca -0.46 0.00 -0.25 0.00 1.08 0.00 0.00 64.86 65.22 2dtd h ILE 89 Cb 1.24 0.68 0.02 0.00 -1.09 0.00 0.00 36.82 37.67 2dtd h ILE 89 CO 0.54 0.00 -1.03 -0.33 -1.08 0.00 0.00 178.15 176.25 2dtd h GLU 90 N 0.00 0.58 0.08 2.19 4.39 -2.02 -3.40 114.58 116.40 2dtd h GLU 90 Ca 0.10 -0.72 -0.32 0.00 0.34 0.00 0.00 59.36 58.77 2dtd h GLU 90 Cb 0.84 0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 29.69 2dtd h GLU 90 CO -0.00 1.30 -1.73 -1.13 -1.16 0.00 0.00 179.01 176.29 2dtd n SER 91 N -3.92 2.03 -4.71 1.42 3.41 -0.64 -4.91 113.62 106.31 2dtd n SER 91 Ca -0.12 0.29 -0.43 0.00 -0.26 0.00 0.00 58.87 58.34 2dtd n SER 91 Cb 0.89 -0.91 -0.03 0.00 -0.26 0.00 0.00 64.21 63.90 2dtd n SER 91 CO 0.00 0.00 0.00 0.80 -0.16 0.00 0.00 175.04 175.68 2dtd n MET 92 N -3.84 2.45 -1.57 4.33 0.00 -0.89 -4.93 117.12 112.68 2dtd n MET 92 Ca -0.32 0.88 -0.34 0.00 -0.00 0.00 0.00 57.70 57.92 2dtd n MET 92 Cb 0.92 -2.64 0.07 0.00 0.00 0.00 0.00 33.22 31.57 2dtd n MET 92 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 175.97 174.43 2dtd s SER 93 N 0.64 4.55 0.37 6.12 1.04 -1.26 -4.87 113.70 120.29 2dtd s SER 93 Ca 0.70 2.24 0.08 0.00 0.48 0.00 0.00 55.95 59.44 2dtd s SER 93 Cb -0.57 -2.58 0.71 0.00 0.10 0.00 0.00 66.02 63.69 2dtd s SER 93 CO 0.44 -2.01 1.89 0.24 0.98 0.00 0.00 173.24 174.78 2dtd h MET 94 N -0.12 0.33 -0.50 4.02 0.00 -1.94 -1.96 114.93 114.75 2dtd h MET 94 Ca -0.47 -0.08 -0.04 0.00 0.00 0.00 0.00 59.70 59.11 2dtd h MET 94 Cb 1.28 -0.04 -0.02 0.00 0.00 0.00 0.00 31.60 32.81 2dtd h MET 94 CO 0.51 0.44 0.14 0.78 0.00 0.00 0.00 176.91 178.79 2dtd h GLY 95 N 0.78 0.85 1.61 8.32 0.00 -1.99 -0.87 103.07 111.77 2dtd h GLY 95 Ca 0.06 -0.52 -0.12 0.00 0.00 0.00 0.00 47.33 46.75 2dtd h GLY 95 CO 0.02 0.48 -0.41 -2.09 0.00 0.00 0.00 176.54 174.55 2dtd h GLU 96 N 0.69 0.43 -0.27 4.80 4.57 -1.85 -1.33 114.58 121.61 2dtd h GLU 96 Ca 0.16 -0.21 -0.08 0.00 -1.18 0.00 0.00 59.36 58.04 2dtd h GLU 96 Cb 0.30 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.88 2dtd h GLU 96 CO -0.00 0.76 -0.16 2.35 -1.18 0.00 0.00 179.01 180.78 2dtd h TRP 97 N 0.36 0.68 -0.38 0.92 7.01 -1.12 -2.51 115.95 120.91 2dtd h TRP 97 Ca 0.03 -0.18 -0.11 0.00 2.11 0.00 0.00 58.89 60.74 2dtd h TRP 97 Cb 0.87 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.76 2dtd h TRP 97 CO 0.03 0.85 -0.22 0.00 -2.79 0.00 0.00 178.44 176.31 2dtd h ARG 98 N 0.32 0.74 -0.63 2.65 3.08 -1.09 -2.95 114.38 116.50 2dtd h ARG 98 Ca 0.06 -0.29 0.02 0.00 0.07 0.00 0.00 59.98 59.83 2dtd h ARG 98 Cb 0.69 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.66 2dtd h ARG 98 CO 0.05 0.90 0.40 -0.09 -1.07 0.00 0.00 179.97 180.15 2dtd h ARG 99 N 0.65 0.78 -0.97 0.04 2.43 -1.15 0.16 114.38 116.33 2dtd h ARG 99 Ca 0.09 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 2dtd h ARG 99 Cb 0.72 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.05 2dtd h ARG 99 CO 0.06 0.51 0.62 0.82 -1.51 0.00 0.00 179.97 180.47 2dtd h ILE 100 N 0.80 1.25 -0.53 1.20 2.04 -1.33 -1.24 117.51 119.71 2dtd h ILE 100 Ca 0.25 -0.50 -0.11 0.00 1.00 0.00 0.00 64.86 65.49 2dtd h ILE 100 Cb -0.03 -0.14 -0.02 0.00 -0.74 0.00 0.00 36.82 35.89 2dtd h ILE 100 CO -0.08 0.25 -0.11 0.40 0.00 0.00 0.00 178.15 178.61 2dtd h ILE 101 N 1.32 1.27 -0.49 -0.67 1.08 -1.20 -1.19 117.51 117.62 2dtd h ILE 101 Ca 0.35 -1.26 0.00 0.00 -0.39 0.00 0.00 64.86 63.56 2dtd h ILE 101 Cb -0.11 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 34.59 2dtd h ILE 101 CO -0.07 0.44 0.32 0.44 -0.69 0.00 0.00 178.15 178.59 2dtd h ASP 102 N 0.88 0.57 0.01 1.72 3.45 -0.04 0.38 116.42 123.40 2dtd h ASP 102 Ca 0.14 -0.02 -0.00 0.00 0.43 0.00 0.00 57.03 57.57 2dtd h ASP 102 Cb 0.67 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 39.30 2dtd h ASP 102 CO 0.05 0.43 -0.01 0.58 -1.57 0.00 0.00 179.24 178.72 2dtd h VAL 103 N 0.67 1.54 0.00 -1.35 2.07 -1.20 -0.86 116.25 117.12 2dtd h VAL 103 Ca 0.18 -1.96 -0.04 0.00 0.82 0.00 0.00 66.70 65.70 2dtd h VAL 103 Cb -0.06 2.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 2dtd h VAL 103 CO -0.04 0.49 -0.20 0.78 0.02 0.00 0.00 177.57 178.62 2dtd h ASN 104 N -0.90 0.00 0.00 0.57 4.21 -1.27 -3.24 115.58 114.95 2dtd h ASN 104 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 2dtd h ASN 104 Cb 0.81 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.01 2dtd h ASN 104 CO 0.00 0.20 -0.11 -0.11 -1.29 0.00 0.00 177.43 176.12 2dtd n LEU 105 N -3.33 0.84 0.12 1.61 7.94 0.08 -4.62 117.00 119.65 2dtd n LEU 105 Ca 0.00 0.11 0.13 0.00 -1.11 0.00 0.00 56.01 55.15 2dtd n LEU 105 Cb 0.44 -0.30 0.65 0.00 0.53 0.00 0.00 43.42 44.74 2dtd n LEU 105 CO 0.33 -0.62 1.13 -0.26 -1.11 0.00 0.00 177.39 176.86 2dtd h PHE 106 N -0.11 0.04 -0.31 1.96 0.04 -1.16 0.21 116.94 117.61 2dtd h PHE 106 Ca 0.00 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.70 2dtd h PHE 106 Cb 0.11 -0.01 -0.02 0.00 2.20 0.00 0.00 35.95 38.23 2dtd h PHE 106 CO -0.05 0.02 -0.11 0.78 -0.60 0.00 0.00 178.31 178.35 2dtd h GLY 107 N 0.04 0.56 1.06 -1.45 0.00 -1.18 0.13 103.07 102.23 2dtd h GLY 107 Ca 0.12 -0.38 -0.19 0.00 0.00 0.00 0.00 47.33 46.89 2dtd h GLY 107 CO -0.01 0.35 -0.62 -0.97 0.00 0.00 0.00 176.54 175.29 2dtd h TYR 108 N 0.48 0.95 -0.63 5.60 -1.99 -1.20 -2.46 116.97 117.73 2dtd h TYR 108 Ca 0.09 -0.40 -0.05 0.00 2.00 0.00 0.00 58.73 60.37 2dtd h TYR 108 Cb 0.48 -0.16 -0.03 0.00 2.00 0.00 0.00 36.73 39.03 2dtd h TYR 108 CO 0.02 1.21 0.20 -0.92 -0.00 0.00 0.00 178.16 178.66 2dtd h TYR 109 N 0.43 1.02 0.25 4.88 5.03 -0.89 -1.14 116.97 126.55 2dtd h TYR 109 Ca -0.03 -0.10 -0.01 0.00 2.58 0.00 0.00 58.73 61.16 2dtd h TYR 109 Cb 1.25 -0.29 0.00 0.00 1.55 0.00 0.00 36.73 39.24 2dtd h TYR 109 CO 0.09 0.83 -0.12 1.88 -1.32 0.00 0.00 178.16 179.53 2dtd h TYR 110 N 0.91 -0.31 -0.58 -3.82 0.05 -0.77 0.60 116.97 113.04 2dtd h TYR 110 Ca 0.20 -0.01 0.06 0.00 0.05 0.00 0.00 58.73 59.03 2dtd h TYR 110 Cb 0.29 0.10 -0.05 0.00 1.01 0.00 0.00 36.73 38.09 2dtd h TYR 110 CO 0.02 -0.00 0.30 0.00 -1.05 0.00 0.00 178.16 177.43 2dtd h ALA 111 N 0.02 0.76 -0.22 3.88 0.00 -1.44 -2.32 119.26 119.94 2dtd h ALA 111 Ca -0.03 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2dtd h ALA 111 Cb 0.45 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2dtd h ALA 111 CO 0.06 -0.04 0.07 0.77 0.00 0.00 0.00 179.25 180.10 2dtd h SER 112 N 0.57 0.32 -0.72 0.00 0.02 -1.19 -1.65 113.55 110.90 2dtd h SER 112 Ca 0.26 -0.20 0.10 0.00 -0.84 0.00 0.00 61.79 61.11 2dtd h SER 112 Cb 0.18 -0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.56 2dtd h SER 112 CO -0.18 0.44 0.35 0.50 -1.14 0.00 0.00 176.83 176.80 2dtd h LYS 113 N 0.19 0.58 0.00 3.45 3.64 -0.52 -1.24 116.57 122.67 2dtd h LYS 113 Ca 0.07 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.20 2dtd h LYS 113 Cb 0.23 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 2dtd h LYS 113 CO -0.00 0.38 -1.28 0.74 -2.27 0.00 0.00 179.45 177.02 2dtd h PHE 114 N 0.60 0.00 0.04 1.91 -1.00 -1.40 -3.37 116.94 113.71 2dtd h PHE 114 Ca 0.36 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.91 2dtd h PHE 114 Cb 0.39 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.94 2dtd h PHE 114 CO -0.11 0.83 -1.00 0.00 -1.61 0.00 0.00 178.31 176.42 2dtd h ALA 115 N 1.17 0.35 -0.57 2.45 0.00 -1.11 -3.36 119.26 118.19 2dtd h ALA 115 Ca -0.14 -0.77 0.10 0.00 0.00 0.00 0.00 54.91 54.09 2dtd h ALA 115 Cb 1.76 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 19.44 2dtd h ALA 115 CO 0.08 0.91 0.14 0.82 0.00 0.00 0.00 179.25 181.21 2dtd h ILE 116 N 0.13 0.70 -0.16 0.00 2.04 -1.39 0.60 117.51 119.43 2dtd h ILE 116 Ca -0.08 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 65.73 2dtd h ILE 116 Cb 1.67 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.13 2dtd h ILE 116 CO 0.16 0.05 0.13 -0.65 0.00 0.00 0.00 178.15 177.84 2dtd h PRO 117 N 0.28 0.00 0.14 2.37 0.11 -1.78 -1.34 132.00 131.79 2dtd h PRO 117 Ca 0.29 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 66.05 2dtd h PRO 117 Cb 0.40 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 2dtd h PRO 117 CO -0.36 0.00 -1.81 1.88 -0.21 0.00 0.00 178.00 177.51 2dtd h TYR 118 N 0.00 0.55 -0.57 0.65 0.99 -1.49 -3.38 116.97 113.72 2dtd h TYR 118 Ca 0.07 -0.40 -0.02 0.00 2.00 0.00 0.00 58.73 60.38 2dtd h TYR 118 Cb 0.33 -0.02 -0.03 0.00 1.00 0.00 0.00 36.73 38.01 2dtd h TYR 118 CO 0.00 1.64 0.29 0.52 -0.00 0.00 0.00 178.16 180.61 2dtd h MET 119 N 0.08 0.81 0.00 4.88 2.86 -0.32 -2.44 114.93 120.80 2dtd h MET 119 Ca -0.36 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 2dtd h MET 119 Cb 2.06 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 33.57 2dtd h MET 119 CO 0.14 0.64 0.00 0.44 1.06 0.00 0.00 176.91 179.19 2dtd n ILE 120 N -4.57 0.70 1.18 -1.22 -5.35 -0.56 -0.31 119.36 109.23 2dtd n ILE 120 Ca 0.03 0.18 0.13 0.00 -0.27 0.00 0.00 62.75 62.82 2dtd n ILE 120 Cb 0.10 -1.04 0.33 0.00 -1.74 0.00 0.00 39.64 37.30 2dtd n ILE 120 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2dtd n ARG 121 N -1.24 0.67 -3.22 6.28 1.74 -0.92 -4.87 116.66 115.10 2dtd n ARG 121 Ca 0.04 -0.40 -0.18 0.00 -0.77 0.00 0.00 57.85 56.54 2dtd n ARG 121 Cb 0.06 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.01 2dtd n ARG 121 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2dtd s SER 122 N -2.61 5.80 -0.20 0.55 0.01 0.58 -5.07 113.70 112.77 2dtd s SER 122 Ca 0.21 -0.28 -0.23 0.00 1.31 0.00 0.00 55.95 56.96 2dtd s SER 122 Cb 0.19 -0.97 -0.02 0.00 0.21 0.00 0.00 66.02 65.44 2dtd s SER 122 CO 0.56 -0.61 0.75 -0.60 0.41 0.00 0.00 173.24 173.75 2dtd s ARG 123 N -4.28 4.23 -1.16 12.44 3.52 -1.26 -4.34 118.95 128.10 2dtd s ARG 123 Ca 0.50 0.84 -0.22 0.00 -0.13 0.00 0.00 55.73 56.72 2dtd s ARG 123 Cb -0.10 -3.59 -0.00 0.00 -1.56 0.00 0.00 34.95 29.70 2dtd s ARG 123 CO 0.32 -0.34 0.77 -0.25 -0.81 0.00 0.00 175.30 174.99 2dtd n ASP 124 N 5.36 -5.00 -4.76 -2.12 8.00 -1.26 -4.95 116.55 111.81 2dtd n ASP 124 Ca 0.02 -1.06 -0.32 0.00 0.71 0.00 0.00 54.79 54.15 2dtd n ASP 124 Cb 0.49 -3.12 0.08 0.00 -0.02 0.00 0.00 41.12 38.56 2dtd n ASP 124 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2dtd s PRO 125 N -6.22 2.31 -0.02 -0.24 0.04 -1.24 -4.92 135.00 124.71 2dtd s PRO 125 Ca 0.47 1.26 -0.02 0.00 0.04 0.00 0.00 61.00 62.75 2dtd s PRO 125 Cb -0.18 -1.90 0.01 0.00 0.04 0.00 0.00 34.50 32.47 2dtd s PRO 125 CO 0.88 -1.61 0.05 0.45 0.04 0.00 0.00 177.00 176.81 2dtd s SER 126 N -3.11 -0.05 -0.08 6.66 0.15 0.15 -2.57 113.70 114.84 2dtd s SER 126 Ca 0.63 0.10 0.05 0.00 0.70 0.00 0.00 55.95 57.43 2dtd s SER 126 Cb -0.19 0.10 -0.00 0.00 -1.71 0.00 0.00 66.02 64.22 2dtd s SER 126 CO 0.52 -0.02 -0.24 -0.63 1.20 0.00 0.00 173.24 174.07 2dtd s ILE 127 N 0.06 2.06 -0.14 6.45 1.01 -0.28 -2.05 121.20 128.31 2dtd s ILE 127 Ca -0.00 -1.04 0.01 0.00 0.00 0.00 0.00 60.65 59.62 2dtd s ILE 127 Cb -0.01 -1.76 0.02 0.00 0.01 0.00 0.00 42.46 40.72 2dtd s ILE 127 CO -0.00 0.56 -0.17 -0.69 0.00 0.00 0.00 174.94 174.64 2dtd s VAL 128 N 0.12 1.74 -0.19 2.92 1.01 -0.17 -1.53 120.40 124.30 2dtd s VAL 128 Ca -0.12 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.02 2dtd s VAL 128 Cb -0.16 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 2dtd s VAL 128 CO 0.07 0.49 0.07 0.20 0.00 0.00 0.00 175.10 175.92 2dtd s ASN 129 N 1.17 5.62 -0.30 3.32 0.01 0.40 -1.13 114.94 124.03 2dtd s ASN 129 Ca -0.01 0.06 -0.24 0.00 -0.71 0.00 0.00 52.86 51.97 2dtd s ASN 129 Cb -0.14 -1.97 0.00 0.00 0.41 0.00 0.00 41.25 39.55 2dtd s ASN 129 CO -0.07 0.15 0.80 -0.63 -1.51 0.00 0.00 177.10 175.85 2dtd s ILE 130 N 0.50 4.79 0.00 0.60 -1.09 0.18 -1.16 121.20 125.02 2dtd s ILE 130 Ca 0.03 1.25 0.00 0.00 -2.23 0.00 0.00 60.65 59.70 2dtd s ILE 130 Cb -0.13 -4.15 0.00 0.00 -1.58 0.00 0.00 42.46 36.60 2dtd s ILE 130 CO 0.01 -0.24 0.00 -0.24 -1.23 0.00 0.00 174.94 173.24 2dtd n SER 131 N 6.21 0.00 -3.59 3.58 2.88 0.19 -4.86 113.62 118.03 2dtd n SER 131 Ca 0.04 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.54 2dtd n SER 131 Cb 0.48 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.92 2dtd n SER 131 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dtd s SER 132 N -0.25 -0.17 0.39 -3.46 0.15 -1.25 -4.60 113.70 104.51 2dtd s SER 132 Ca 0.00 -0.04 0.28 0.00 0.70 0.00 0.00 55.95 56.89 2dtd s SER 132 Cb 0.00 0.21 1.28 0.00 -1.71 0.00 0.00 66.02 65.80 2dtd s SER 132 CO 0.00 -0.35 1.84 1.62 1.20 0.00 0.00 173.24 177.55 2dtd h VAL 133 N 2.00 0.00 0.00 4.45 3.04 -1.03 -1.87 116.25 122.84 2dtd h VAL 133 Ca -0.15 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.32 2dtd h VAL 133 Cb 1.19 0.99 0.00 0.00 -2.01 0.00 0.00 31.29 31.46 2dtd h VAL 133 CO 0.25 0.00 0.00 0.00 -1.01 0.00 0.00 177.57 176.81 2dtd n GLN 134 N -2.54 0.86 0.00 4.17 6.02 -1.23 -1.31 117.38 123.35 2dtd n GLN 134 Ca 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 57.00 57.14 2dtd n GLN 134 Cb 0.19 -1.16 0.71 0.00 1.02 0.00 0.00 30.24 30.99 2dtd n GLN 134 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2dtd n ALA 135 N -0.66 2.68 0.02 -1.58 0.00 -0.70 -4.47 120.51 115.79 2dtd n ALA 135 Ca 0.07 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2dtd n ALA 135 Cb 0.03 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.09 2dtd n ALA 135 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dtd n SER 136 N -0.92 0.12 -4.54 0.00 2.88 -0.43 -4.87 113.62 105.86 2dtd n SER 136 Ca 0.17 0.07 -0.34 0.00 -1.33 0.00 0.00 58.87 57.44 2dtd n SER 136 Cb 0.24 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.59 2dtd n SER 136 CO 0.00 0.00 0.00 0.27 -1.23 0.00 0.00 175.04 174.08 2dtd s ILE 137 N -1.23 4.21 0.41 2.46 -4.36 -0.76 -5.10 121.20 116.82 2dtd s ILE 137 Ca 0.00 -0.24 0.07 0.00 -0.26 0.00 0.00 60.65 60.22 2dtd s ILE 137 Cb 0.00 -2.87 -0.04 0.00 1.25 0.00 0.00 42.46 40.79 2dtd s ILE 137 CO 0.00 0.47 0.22 0.27 0.24 0.00 0.00 174.94 176.14 2dtd s ILE 138 N 0.46 2.43 0.31 8.37 -4.36 -1.26 -3.54 121.20 123.61 2dtd s ILE 138 Ca -0.01 -1.62 0.08 0.00 -0.26 0.00 0.00 60.65 58.85 2dtd s ILE 138 Cb -0.14 -3.00 -0.04 0.00 1.25 0.00 0.00 42.46 40.54 2dtd s ILE 138 CO 0.02 -0.01 0.15 0.42 0.24 0.00 0.00 174.94 175.76 2dtd s THR 139 N -2.56 3.39 0.38 8.37 -4.23 -1.26 -5.10 115.64 114.63 2dtd s THR 139 Ca 0.42 -1.64 -0.20 0.00 -1.18 0.00 0.00 61.69 59.10 2dtd s THR 139 Cb 0.02 -3.05 -0.10 0.00 1.34 0.00 0.00 72.50 70.71 2dtd s THR 139 CO 0.24 -0.24 0.88 -0.75 -0.54 0.00 0.00 174.62 174.21 2dtd s LYS 140 N -3.84 4.20 -1.68 3.99 2.20 -1.26 -4.03 119.74 119.32 2dtd s LYS 140 Ca 0.36 1.01 -0.02 0.00 -0.36 0.00 0.00 55.97 56.96 2dtd s LYS 140 Cb -0.05 -2.34 0.00 0.00 -1.51 0.00 0.00 37.83 33.94 2dtd s LYS 140 CO 0.23 0.07 0.23 0.09 -0.36 0.00 0.00 175.35 175.61 2dtd n ASN 141 N -0.39 -5.96 -1.52 1.43 3.02 -1.26 -4.89 115.26 105.69 2dtd n ASN 141 Ca 0.05 -0.12 -0.03 0.00 -0.03 0.00 0.00 54.58 54.45 2dtd n ASN 141 Cb 0.53 -4.89 0.09 0.00 -0.61 0.00 0.00 39.78 34.90 2dtd n ASN 141 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dtd n ALA 142 N -2.60 3.50 -0.28 5.41 0.00 -1.26 -0.93 120.51 124.36 2dtd n ALA 142 Ca -0.19 -3.10 -0.07 0.00 0.00 0.00 0.00 53.44 50.07 2dtd n ALA 142 Cb 0.66 -0.52 -0.07 0.00 0.00 0.00 0.00 19.45 19.52 2dtd n ALA 142 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dtd n SER 143 N -0.55 -0.70 -0.20 0.00 2.88 -1.26 -0.29 113.62 113.50 2dtd n SER 143 Ca 0.20 1.43 -0.07 0.00 -1.33 0.00 0.00 58.87 59.10 2dtd n SER 143 Cb 0.89 -0.28 0.03 0.00 -0.75 0.00 0.00 64.21 64.09 2dtd n SER 143 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dtd h ALA 144 N 0.07 0.73 0.14 -1.46 0.00 -1.90 -1.37 119.26 115.47 2dtd h ALA 144 Ca 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2dtd h ALA 144 Cb 0.27 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2dtd h ALA 144 CO -0.62 0.27 -0.07 -0.92 0.00 0.00 0.00 179.25 177.91 2dtd h TYR 145 N 0.77 -0.17 -0.85 0.00 3.20 -1.64 -1.38 116.97 116.89 2dtd h TYR 145 Ca 0.20 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.08 2dtd h TYR 145 Cb 0.08 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 2dtd h TYR 145 CO -0.01 -0.04 0.56 0.28 -1.64 0.00 0.00 178.16 177.32 2dtd h VAL 146 N -0.27 1.20 -0.31 1.81 2.07 -0.60 -1.80 116.25 118.35 2dtd h VAL 146 Ca -0.02 -0.39 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 2dtd h VAL 146 Cb 0.22 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.94 2dtd h VAL 146 CO 0.03 0.21 0.09 0.74 0.02 0.00 0.00 177.57 178.66 2dtd h THR 147 N 1.14 1.21 -0.45 2.57 2.02 -1.16 -2.21 112.91 116.03 2dtd h THR 147 Ca 0.32 -0.70 -0.02 0.00 0.77 0.00 0.00 66.41 66.78 2dtd h THR 147 Cb -0.11 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 2dtd h THR 147 CO -0.08 0.23 0.19 0.77 0.37 0.00 0.00 175.52 177.00 2dtd h SER 148 N 0.35 0.57 0.60 4.18 4.64 -0.87 -0.50 113.55 122.52 2dtd h SER 148 Ca 0.10 -0.06 -0.13 0.00 -0.47 0.00 0.00 61.79 61.23 2dtd h SER 148 Cb 0.27 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2dtd h SER 148 CO -0.00 0.51 -0.62 0.11 -0.87 0.00 0.00 176.83 175.97 2dtd h LYS 149 N 0.63 0.01 -0.14 4.77 1.79 -1.11 -0.82 116.57 121.71 2dtd h LYS 149 Ca 0.16 -0.01 -0.20 0.00 -2.18 0.00 0.00 60.65 58.41 2dtd h LYS 149 Cb 0.12 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.78 2dtd h LYS 149 CO -0.02 0.63 -0.71 0.45 -1.08 0.00 0.00 179.45 178.71 2dtd h HIS 150 N 0.01 0.98 -0.98 -1.35 3.86 -0.90 -3.13 115.15 113.65 2dtd h HIS 150 Ca -0.01 -0.44 0.01 0.00 -1.16 0.00 0.00 60.37 58.77 2dtd h HIS 150 Cb 1.09 -0.15 -0.05 0.00 1.06 0.00 0.00 27.41 29.36 2dtd h HIS 150 CO 0.00 1.26 0.63 0.00 0.86 0.00 0.00 177.93 180.68 2dtd h ALA 151 N 0.52 1.24 -0.82 2.45 0.00 -0.84 -1.41 119.26 120.40 2dtd h ALA 151 Ca -0.05 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.82 2dtd h ALA 151 Cb 1.35 -0.40 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 2dtd h ALA 151 CO 0.15 0.65 0.54 0.28 0.00 0.00 0.00 179.25 180.86 2dtd h VAL 152 N 1.33 1.11 -0.65 0.00 2.07 -1.13 -0.94 116.25 118.04 2dtd h VAL 152 Ca 0.36 -0.34 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 2dtd h VAL 152 Cb -0.13 0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 29.65 2dtd h VAL 152 CO -0.07 0.18 0.34 0.40 0.02 0.00 0.00 177.57 178.43 2dtd h ILE 153 N 0.98 1.21 -0.73 4.57 1.08 -1.21 -1.05 117.51 122.36 2dtd h ILE 153 Ca 0.33 -0.55 -0.06 0.00 -0.39 0.00 0.00 64.86 64.19 2dtd h ILE 153 Cb 0.09 0.39 -0.03 0.00 -3.07 0.00 0.00 36.82 34.20 2dtd h ILE 153 CO -0.10 0.23 0.21 1.23 -0.69 0.00 0.00 178.15 179.03 2dtd h GLY 154 N 0.88 1.23 1.15 5.37 0.00 -0.93 -1.92 103.07 108.86 2dtd h GLY 154 Ca 0.23 -0.74 -0.09 0.00 0.00 0.00 0.00 47.33 46.72 2dtd h GLY 154 CO -0.03 0.69 0.00 -2.00 0.00 0.00 0.00 176.54 175.20 2dtd h LEU 155 N 1.09 0.99 -0.03 3.11 5.85 -0.90 -2.14 115.31 123.28 2dtd h LEU 155 Ca 0.23 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.68 2dtd h LEU 155 Cb 0.33 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 2dtd h LEU 155 CO -0.00 1.04 0.02 0.74 -0.34 0.00 0.00 178.44 179.90 2dtd h THR 156 N 0.93 1.05 -0.46 1.05 2.02 -0.95 -0.87 112.91 115.67 2dtd h THR 156 Ca 0.17 -0.14 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 2dtd h THR 156 Cb 0.54 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 2dtd h THR 156 CO 0.03 0.04 0.26 0.11 0.37 0.00 0.00 175.52 176.33 2dtd h LYS 157 N -0.01 0.64 -0.47 6.66 1.57 -1.26 -0.75 116.57 122.95 2dtd h LYS 157 Ca 0.01 -0.07 -0.10 0.00 -1.87 0.00 0.00 60.65 58.62 2dtd h LYS 157 Cb 0.05 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 2dtd h LYS 157 CO -0.00 0.50 -0.12 0.66 -0.57 0.00 0.00 179.45 179.92 2dtd h SER 158 N 0.61 0.87 -0.53 0.86 4.64 -1.29 0.73 113.55 119.44 2dtd h SER 158 Ca 0.16 -0.27 -0.12 0.00 -0.47 0.00 0.00 61.79 61.09 2dtd h SER 158 Cb 0.04 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 61.88 2dtd h SER 158 CO -0.03 1.00 -0.13 0.40 -0.87 0.00 0.00 176.83 177.20 2dtd h ILE 159 N 0.78 1.27 -0.32 0.95 2.04 -1.00 0.96 117.51 122.18 2dtd h ILE 159 Ca 0.13 -1.29 0.01 0.00 1.00 0.00 0.00 64.86 64.70 2dtd h ILE 159 Cb 0.63 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2dtd h ILE 159 CO 0.04 0.46 0.21 0.00 0.00 0.00 0.00 178.15 178.85 2dtd h ALA 160 N 0.91 0.41 -0.20 1.87 0.00 -0.71 -1.94 119.26 119.60 2dtd h ALA 160 Ca 0.13 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 2dtd h ALA 160 Cb 0.71 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 2dtd h ALA 160 CO 0.05 -0.14 -0.57 1.25 0.00 0.00 0.00 179.25 179.84 2dtd h LEU 161 N 0.42 0.71 -0.75 0.00 5.85 -0.72 -2.09 115.31 118.73 2dtd h LEU 161 Ca 0.12 -0.39 -0.13 0.00 0.84 0.00 0.00 57.88 58.32 2dtd h LEU 161 Cb -0.04 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 2dtd h LEU 161 CO -0.04 1.12 -0.57 0.44 -0.34 0.00 0.00 178.44 179.06 2dtd h ASP 162 N 0.48 0.19 -0.10 1.25 3.32 -0.67 -3.33 116.42 117.56 2dtd h ASP 162 Ca 0.01 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.95 2dtd h ASP 162 Cb 1.13 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.63 2dtd h ASP 162 CO 0.11 0.72 0.00 -1.22 -1.72 0.00 0.00 179.24 177.13 2dtd n TYR 163 N -3.89 0.12 -2.14 4.55 4.02 -0.74 -5.00 117.16 114.08 2dtd n TYR 163 Ca -0.02 -0.15 -0.37 0.00 -0.01 0.00 0.00 57.90 57.35 2dtd n TYR 163 Cb 0.59 -0.01 0.01 0.00 -0.02 0.00 0.00 39.34 39.90 2dtd n TYR 163 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dtd s ALA 164 N -0.88 2.86 -2.04 -0.72 0.00 -0.79 -1.92 121.76 118.28 2dtd s ALA 164 Ca 0.14 1.00 0.25 0.00 0.00 0.00 0.00 51.96 53.36 2dtd s ALA 164 Cb 0.09 -3.42 0.52 0.00 0.00 0.00 0.00 23.12 20.31 2dtd s ALA 164 CO 0.13 -0.86 1.42 -0.35 0.00 0.00 0.00 175.76 176.10 2dtd n PRO 165 N -0.81 1.18 -0.24 0.00 -0.04 -1.26 -4.87 135.00 128.95 2dtd n PRO 165 Ca 0.09 -0.82 -0.05 0.00 -0.04 0.00 0.00 63.50 62.67 2dtd n PRO 165 Cb 0.48 -1.48 0.05 0.00 -0.04 0.00 0.00 33.50 32.51 2dtd n PRO 165 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2dtd h LEU 166 N 2.01 0.79 -8.26 1.53 7.12 -1.83 -3.43 115.31 113.23 2dtd h LEU 166 Ca 0.00 -0.03 -0.46 0.00 0.13 0.00 0.00 57.88 57.52 2dtd h LEU 166 Cb 0.62 -0.20 -0.27 0.00 -0.53 0.00 0.00 40.66 40.28 2dtd h LEU 166 CO 0.00 0.58 -0.80 -0.22 -0.13 0.00 0.00 178.44 177.87 2dtd s LEU 167 N -10.12 2.10 0.12 2.25 0.20 -0.81 -3.73 118.68 108.68 2dtd s LEU 167 Ca -0.13 -0.35 0.04 0.00 0.69 0.00 0.00 54.13 54.38 2dtd s LEU 167 Cb 0.14 -0.66 -0.04 0.00 -0.43 0.00 0.00 46.19 45.20 2dtd s LEU 167 CO 0.77 0.10 0.07 -0.13 -0.29 0.00 0.00 176.35 176.87 2dtd s ARG 168 N -0.72 2.76 -0.09 1.98 0.52 -1.06 -3.71 118.95 118.62 2dtd s ARG 168 Ca 0.04 -0.82 -0.04 0.00 -0.52 0.00 0.00 55.73 54.39 2dtd s ARG 168 Cb -0.07 -2.62 0.05 0.00 0.52 0.00 0.00 34.95 32.83 2dtd s ARG 168 CO 0.00 0.53 0.18 0.00 0.02 0.00 0.00 175.30 176.03 2dtd s ASN 170 N 1.92 0.94 0.21 0.00 0.01 -0.58 -0.47 114.94 116.98 2dtd s ASN 170 Ca -0.02 -1.32 0.09 0.00 -0.71 0.00 0.00 52.86 50.90 2dtd s ASN 170 Cb -0.12 0.20 -0.05 0.00 0.41 0.00 0.00 41.25 41.70 2dtd s ASN 170 CO -0.07 -0.71 -0.17 0.00 -1.51 0.00 0.00 177.10 174.65 2dtd s ALA 171 N -3.83 2.15 -0.09 0.60 0.00 -0.05 -0.45 121.76 120.09 2dtd s ALA 171 Ca 0.34 -1.65 0.04 0.00 0.00 0.00 0.00 51.96 50.69 2dtd s ALA 171 Cb 0.07 -0.15 -0.00 0.00 0.00 0.00 0.00 23.12 23.04 2dtd s ALA 171 CO 0.10 0.15 -0.24 0.08 0.00 0.00 0.00 175.76 175.86 2dtd s VAL 172 N -2.63 2.11 -0.74 0.00 1.01 -0.31 -0.75 120.40 119.09 2dtd s VAL 172 Ca 0.22 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.19 2dtd s VAL 172 Cb -0.03 -1.80 0.18 0.00 0.00 0.00 0.00 36.38 34.74 2dtd s VAL 172 CO 0.08 0.56 0.57 0.00 0.00 0.00 0.00 175.10 176.32 2dtd s PRO 174 N -0.97 4.20 0.00 0.00 0.05 -1.26 -1.52 135.00 135.51 2dtd s PRO 174 Ca 0.23 1.10 0.00 0.00 0.05 0.00 0.00 61.00 62.38 2dtd s PRO 174 Cb -0.12 -2.18 0.00 0.00 0.05 0.00 0.00 34.50 32.25 2dtd s PRO 174 CO -0.10 -0.05 0.00 0.00 0.05 0.00 0.00 177.00 176.90 2dtd n ALA 175 N -0.71 0.00 -2.23 8.56 0.00 -0.87 -0.69 120.51 124.57 2dtd n ALA 175 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.08 2dtd n ALA 175 Cb 0.54 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.96 2dtd n ALA 175 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2dtd s THR 176 N 3.83 3.90 0.06 0.00 2.01 -1.26 -4.88 115.64 119.30 2dtd s THR 176 Ca 0.00 1.14 0.09 0.00 0.31 0.00 0.00 61.69 63.23 2dtd s THR 176 Cb 0.00 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 2dtd s THR 176 CO 0.00 -0.08 -0.24 -0.63 -0.69 0.00 0.00 174.62 172.98 2dtd s ILE 177 N 3.40 1.98 -0.89 1.82 -1.09 -1.26 -0.33 121.20 124.82 2dtd s ILE 177 Ca 0.63 -1.38 -0.25 0.00 -2.23 0.00 0.00 60.65 57.43 2dtd s ILE 177 Cb -0.28 -1.71 -0.04 0.00 -1.58 0.00 0.00 42.46 38.85 2dtd s ILE 177 CO 0.23 0.26 1.92 -0.62 -1.23 0.00 0.00 174.94 175.49 2dtd s ASP 178 N -1.36 5.21 0.21 3.58 -1.08 0.10 -4.67 116.67 118.68 2dtd s ASP 178 Ca 0.10 -0.66 0.02 0.00 -0.52 0.00 0.00 52.55 51.49 2dtd s ASP 178 Cb -0.10 -2.56 -0.05 0.00 -1.46 0.00 0.00 42.92 38.76 2dtd s ASP 178 CO 0.03 -2.67 0.02 0.42 0.52 0.00 0.00 175.17 173.49 2dtd s THR 179 N 9.79 0.75 0.29 1.71 -4.23 -1.26 -4.50 115.64 118.20 2dtd s THR 179 Ca 0.69 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.18 2dtd s THR 179 Cb -0.07 -2.31 0.20 0.00 1.34 0.00 0.00 72.50 71.66 2dtd s THR 179 CO -0.00 -0.31 1.89 -0.65 -0.54 0.00 0.00 174.62 175.00 2dtd h PRO 180 N 2.55 0.93 -0.33 3.99 0.11 -1.98 -1.57 132.00 135.70 2dtd h PRO 180 Ca -0.38 -0.13 0.01 0.00 0.11 0.00 0.00 66.00 65.61 2dtd h PRO 180 Cb 1.22 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2dtd h PRO 180 CO 0.63 0.73 0.21 -0.07 -0.21 0.00 0.00 178.00 179.28 2dtd h LEU 181 N 0.92 0.35 -1.55 2.35 -0.00 -1.96 0.12 115.31 115.54 2dtd h LEU 181 Ca 0.22 -0.01 -0.04 0.00 -0.00 0.00 0.00 57.88 58.05 2dtd h LEU 181 Cb 0.12 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 40.69 2dtd h LEU 181 CO -0.03 0.26 -0.19 0.58 -0.00 0.00 0.00 178.44 179.06 2dtd h VAL 182 N 0.43 1.15 -0.42 1.22 2.07 -1.75 0.75 116.25 119.70 2dtd h VAL 182 Ca 0.12 -0.72 -0.06 0.00 0.82 0.00 0.00 66.70 66.87 2dtd h VAL 182 Cb -0.03 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.06 2dtd h VAL 182 CO -0.04 0.21 0.03 0.03 0.02 0.00 0.00 177.57 177.82 2dtd h ARG 183 N 0.05 0.72 -0.71 1.57 2.47 -0.22 -1.78 114.38 116.49 2dtd h ARG 183 Ca 0.01 -0.22 -0.05 0.00 -1.26 0.00 0.00 59.98 58.46 2dtd h ARG 183 Cb 0.36 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.58 2dtd h ARG 183 CO 0.03 0.78 0.24 -0.22 0.56 0.00 0.00 179.97 181.36 2dtd h LYS 184 N 0.56 1.08 -0.40 0.04 3.64 0.36 -1.59 116.57 120.27 2dtd h LYS 184 Ca 0.12 -0.22 0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2dtd h LYS 184 Cb 0.44 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.07 2dtd h LYS 184 CO 0.02 0.92 0.21 0.00 -2.27 0.00 0.00 179.45 178.33 2dtd h ALA 185 N 1.11 0.50 -0.10 5.00 0.00 -0.64 0.21 119.26 125.34 2dtd h ALA 185 Ca 0.23 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2dtd h ALA 185 Cb 0.27 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2dtd h ALA 185 CO -0.01 -0.14 0.06 0.00 0.00 0.00 0.00 179.25 179.15 2dtd h ALA 186 N 1.20 0.12 -0.60 0.00 0.00 -1.06 -2.94 119.26 115.99 2dtd h ALA 186 Ca 0.17 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.11 2dtd h ALA 186 Cb 0.06 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 2dtd h ALA 186 CO -0.11 -0.36 0.29 1.49 0.00 0.00 0.00 179.25 180.56 2dtd h GLU 187 N 0.09 0.51 0.00 0.00 4.81 -0.88 0.23 114.58 119.35 2dtd h GLU 187 Ca 0.03 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2dtd h GLU 187 Cb 0.04 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.30 2dtd h GLU 187 CO -0.01 0.34 0.00 1.28 -0.73 0.00 0.00 179.01 179.89 2dtd n LEU 188 N -4.89 0.02 -0.07 1.64 4.77 0.03 0.32 117.00 118.81 2dtd n LEU 188 Ca 0.07 0.51 -0.10 0.00 -0.03 0.00 0.00 56.01 56.46 2dtd n LEU 188 Cb 0.20 -0.51 -0.06 0.00 -2.33 0.00 0.00 43.42 40.72 2dtd n LEU 188 CO 0.27 -0.49 -0.93 1.21 -1.33 0.00 0.00 177.39 176.12 2dtd n GLU 189 N -1.53 0.32 -0.11 3.23 2.13 0.18 -4.77 120.64 120.10 2dtd n GLU 189 Ca 0.00 0.08 0.04 0.00 0.66 0.00 0.00 57.16 57.95 2dtd n GLU 189 Cb 0.02 -1.21 0.10 0.00 0.27 0.00 0.00 31.44 30.62 2dtd n GLU 189 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05 2dtd n VAL 190 N -3.00 0.85 -0.03 6.31 0.24 0.57 -5.11 118.33 118.16 2dtd n VAL 190 Ca -0.23 -0.92 0.00 0.00 -2.04 0.00 0.00 64.34 61.14 2dtd n VAL 190 Cb 0.73 0.60 0.00 0.00 -1.47 0.00 0.00 33.84 33.71 2dtd n VAL 190 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dtd n GLY 191 N 0.29 -3.65 0.03 7.63 0.00 0.15 -4.56 105.19 105.07 2dtd n GLY 191 Ca 0.08 -1.92 0.14 0.00 0.00 0.00 0.00 46.02 44.32 2dtd n GLY 191 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dtd n SER 192 N -0.32 0.13 -4.57 1.61 3.41 -1.26 -4.27 113.62 108.35 2dtd n SER 192 Ca 0.00 -0.14 -0.39 0.00 -0.26 0.00 0.00 58.87 58.09 2dtd n SER 192 Cb 0.00 -0.25 -0.03 0.00 -0.26 0.00 0.00 64.21 63.67 2dtd n SER 192 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2dtd s ASP 193 N -2.64 4.96 0.62 4.04 -1.08 -1.26 -4.84 116.67 116.47 2dtd s ASP 193 Ca 0.25 1.11 0.31 0.00 -0.52 0.00 0.00 52.55 53.70 2dtd s ASP 193 Cb 0.20 -2.51 1.71 0.00 -1.46 0.00 0.00 42.92 40.86 2dtd s ASP 193 CO 0.49 -2.47 1.96 1.55 0.52 0.00 0.00 175.17 177.21 2dtd h PRO 194 N 17.01 0.00 0.09 4.34 0.13 -1.97 -1.62 132.00 149.99 2dtd h PRO 194 Ca -0.29 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.55 2dtd h PRO 194 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.35 2dtd h PRO 194 CO 1.12 0.00 -1.46 0.52 -0.23 0.00 0.00 178.00 177.95 2dtd h MET 195 N 0.00 0.20 -0.23 0.86 2.86 -1.98 -2.80 114.93 113.84 2dtd h MET 195 Ca 0.00 -0.34 -0.17 0.00 -2.06 0.00 0.00 59.70 57.13 2dtd h MET 195 Cb 0.47 0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.26 2dtd h MET 195 CO 0.00 1.05 -0.55 0.00 1.06 0.00 0.00 176.91 178.48 2dtd h ARG 196 N 0.05 0.68 -0.52 1.72 3.08 -1.70 -2.36 114.38 115.34 2dtd h ARG 196 Ca -0.21 -0.43 0.05 0.00 0.07 0.00 0.00 59.98 59.46 2dtd h ARG 196 Cb 1.98 0.05 -0.03 0.00 0.08 0.00 0.00 29.97 32.05 2dtd h ARG 196 CO 0.15 1.05 0.34 0.82 -1.07 0.00 0.00 179.97 181.27 2dtd h ILE 197 N 0.52 1.01 -0.18 2.04 2.04 -1.40 0.47 117.51 122.01 2dtd h ILE 197 Ca 0.01 -0.18 -0.15 0.00 1.00 0.00 0.00 64.86 65.54 2dtd h ILE 197 Cb 1.12 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 2dtd h ILE 197 CO 0.11 0.09 -0.52 -0.08 0.00 0.00 0.00 178.15 177.76 2dtd h GLU 198 N 0.51 0.52 -0.13 2.37 4.57 -1.15 -0.55 114.58 120.72 2dtd h GLU 198 Ca 0.22 -0.31 -0.15 0.00 -1.18 0.00 0.00 59.36 57.94 2dtd h GLU 198 Cb 0.22 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 2dtd h GLU 198 CO -0.06 0.91 -0.57 -0.22 -1.18 0.00 0.00 179.01 177.89 2dtd h LYS 199 N 0.40 0.39 0.14 1.92 3.64 -0.65 -1.58 116.57 120.83 2dtd h LYS 199 Ca 0.01 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.13 2dtd h LYS 199 Cb 1.04 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 2dtd h LYS 199 CO 0.10 0.85 -0.07 -0.22 -2.27 0.00 0.00 179.45 177.84 2dtd h LYS 200 N 0.30 -0.18 -0.69 1.90 1.63 -0.74 -1.37 116.57 117.42 2dtd h LYS 200 Ca 0.00 0.01 0.06 0.00 -0.85 0.00 0.00 60.65 59.87 2dtd h LYS 200 Cb 1.08 0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 32.71 2dtd h LYS 200 CO 0.10 0.14 0.46 0.82 -3.45 0.00 0.00 179.45 177.51 2dtd h ILE 201 N -0.51 1.02 -0.64 2.00 1.08 -1.09 -0.69 117.51 118.68 2dtd h ILE 201 Ca -0.02 -0.25 -0.09 0.00 -0.39 0.00 0.00 64.86 64.11 2dtd h ILE 201 Cb 0.40 0.24 -0.02 0.00 -3.07 0.00 0.00 36.82 34.36 2dtd h ILE 201 CO 0.03 0.13 0.04 -1.28 -0.69 0.00 0.00 178.15 176.39 2dtd h SER 202 N 0.72 1.07 -0.51 1.72 0.87 -1.10 -0.02 113.55 116.30 2dtd h SER 202 Ca 0.30 -0.29 -0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2dtd h SER 202 Cb 0.25 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 2dtd h SER 202 CO -0.10 1.09 0.31 -0.08 -0.53 0.00 0.00 176.83 177.53 2dtd h GLU 203 N 1.01 0.69 -0.39 2.24 4.81 0.01 -0.87 114.58 122.07 2dtd h GLU 203 Ca 0.19 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 2dtd h GLU 203 Cb 0.52 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 2dtd h GLU 203 CO 0.02 0.49 0.19 -1.49 -0.73 0.00 0.00 179.01 177.50 2dtd h TRP 204 N 0.68 0.56 -0.82 0.92 6.55 -1.03 -2.69 115.95 120.12 2dtd h TRP 204 Ca 0.18 -0.02 0.10 0.00 0.95 0.00 0.00 58.89 60.10 2dtd h TRP 204 Cb -0.02 -0.17 -0.08 0.00 -0.86 0.00 0.00 29.16 28.03 2dtd h TRP 204 CO -0.03 0.46 0.45 0.78 -1.05 0.00 0.00 178.44 179.05 2dtd h GLY 205 N 0.49 1.27 2.00 1.49 0.00 -0.49 -0.09 103.07 107.75 2dtd h GLY 205 Ca 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.17 2dtd h GLY 205 CO -0.02 0.09 0.00 1.42 0.00 0.00 0.00 176.54 178.03 2dtd n HIS 206 N -4.78 0.25 0.19 5.60 8.25 -0.38 -1.58 115.22 122.77 2dtd n HIS 206 Ca 0.14 0.10 0.11 0.00 -0.26 0.00 0.00 57.72 57.80 2dtd n HIS 206 Cb 0.30 -0.66 0.12 0.00 1.12 0.00 0.00 29.99 30.88 2dtd n HIS 206 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 2dtd h GLU 207 N 0.00 0.00 -6.44 -0.41 4.39 -0.76 -3.45 114.58 107.91 2dtd h GLU 207 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 2dtd h GLU 207 Cb 0.30 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.92 2dtd h GLU 207 CO 0.00 0.04 0.19 -1.01 -1.16 0.00 0.00 179.01 177.07 2dtd s HIS 208 N -3.22 3.83 0.48 4.33 3.76 -0.62 -4.87 115.29 118.98 2dtd s HIS 208 Ca 0.05 1.59 0.21 0.00 -0.15 0.00 0.00 55.06 56.77 2dtd s HIS 208 Cb 0.06 -2.82 1.23 0.00 1.11 0.00 0.00 32.58 32.16 2dtd s HIS 208 CO 0.70 0.39 1.94 -1.35 -0.85 0.00 0.00 174.74 175.57 2dtd h PRO 209 N 4.97 0.21 0.00 8.40 0.11 -1.74 0.36 132.00 144.30 2dtd h PRO 209 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2dtd h PRO 209 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2dtd h PRO 209 CO 0.68 0.14 0.00 -1.33 -0.21 0.00 0.00 178.00 177.28 2dtd n MET 210 N -4.42 0.30 -1.61 1.05 2.81 -0.81 -4.87 117.12 109.56 2dtd n MET 210 Ca 0.14 0.10 -0.17 0.00 -1.81 0.00 0.00 57.70 55.96 2dtd n MET 210 Cb 0.62 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.57 2dtd n MET 210 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2dtd n GLN 211 N -1.22 -1.18 -3.59 0.03 1.13 0.13 -4.96 117.38 107.72 2dtd n GLN 211 Ca 0.09 1.04 -0.09 0.00 -1.94 0.00 0.00 57.00 56.09 2dtd n GLN 211 Cb 0.11 -5.27 -0.02 0.00 0.11 0.00 0.00 30.24 25.17 2dtd n GLN 211 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 2dtd s ARG 212 N -3.63 1.38 0.61 -1.09 1.70 -0.62 -4.30 118.95 113.01 2dtd s ARG 212 Ca 0.00 -0.62 -0.06 0.00 -0.47 0.00 0.00 55.73 54.58 2dtd s ARG 212 Cb 0.00 0.56 0.02 0.00 -0.57 0.00 0.00 34.95 34.96 2dtd s ARG 212 CO 0.00 -0.61 0.92 0.96 -1.08 0.00 0.00 175.30 175.48 2dtd s ILE 213 N -3.69 3.33 0.64 4.99 -4.36 -1.26 -4.72 121.20 116.12 2dtd s ILE 213 Ca 0.05 -0.09 -0.08 0.00 -0.26 0.00 0.00 60.65 60.28 2dtd s ILE 213 Cb -0.03 -3.34 0.01 0.00 1.25 0.00 0.00 42.46 40.36 2dtd s ILE 213 CO -0.05 -0.35 0.98 -0.83 0.24 0.00 0.00 174.94 174.93 2dtd s GLY 214 N -4.35 1.62 0.04 6.27 0.00 0.55 -4.83 107.32 106.62 2dtd s GLY 214 Ca 0.55 -0.58 0.01 0.00 0.00 0.00 0.00 44.72 44.71 2dtd s GLY 214 CO 0.45 -0.26 0.08 0.54 0.00 0.00 0.00 173.10 173.91 2dtd s LYS 215 N -5.14 2.98 0.35 2.90 1.02 -1.26 0.03 119.74 120.62 2dtd s LYS 215 Ca 0.56 -0.59 0.08 0.00 0.02 0.00 0.00 55.97 56.03 2dtd s LYS 215 Cb -0.11 -2.79 0.79 0.00 -0.52 0.00 0.00 37.83 35.20 2dtd s LYS 215 CO 0.47 0.60 1.86 -1.35 -0.92 0.00 0.00 175.35 176.02 2dtd h PRO 216 N 3.63 0.70 -0.06 -1.68 0.11 -1.93 -1.15 132.00 131.63 2dtd h PRO 216 Ca -0.48 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2dtd h PRO 216 Cb 1.17 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 2dtd h PRO 216 CO 0.65 0.46 -0.04 1.96 -0.21 0.00 0.00 178.00 180.83 2dtd h GLN 217 N 0.72 0.08 0.00 1.05 7.50 -1.93 -1.25 115.11 121.28 2dtd h GLN 217 Ca 0.46 -0.01 -0.13 0.00 0.50 0.00 0.00 58.65 59.47 2dtd h GLN 217 Cb 0.71 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 28.21 2dtd h GLN 217 CO -0.22 0.12 -0.60 0.93 -1.50 0.00 0.00 178.83 177.57 2dtd h GLU 218 N 0.08 0.00 -0.02 1.46 5.08 -1.61 -0.77 114.58 118.79 2dtd h GLU 218 Ca 0.02 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.13 2dtd h GLU 218 Cb 0.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.39 2dtd h GLU 218 CO 0.01 0.60 -0.98 0.28 -1.00 0.00 0.00 179.01 177.91 2dtd h VAL 219 N 0.00 1.31 -0.28 3.13 2.07 -1.28 -3.14 116.25 118.06 2dtd h VAL 219 Ca -0.01 -2.27 -0.03 0.00 0.82 0.00 0.00 66.70 65.21 2dtd h VAL 219 Cb 1.08 2.34 -0.02 0.00 -1.52 0.00 0.00 31.29 33.17 2dtd h VAL 219 CO 0.08 0.70 0.04 0.00 0.02 0.00 0.00 177.57 178.40 2dtd h ALA 220 N 0.53 1.54 -0.52 1.67 0.00 -0.93 -1.95 119.26 119.60 2dtd h ALA 220 Ca -0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2dtd h ALA 220 Cb 1.62 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 2dtd h ALA 220 CO 0.19 0.34 0.23 0.77 0.00 0.00 0.00 179.25 180.78 2dtd h SER 221 N 0.41 0.70 -0.62 0.00 0.02 -1.10 -0.25 113.55 112.71 2dtd h SER 221 Ca 0.09 -0.15 -0.08 0.00 -0.84 0.00 0.00 61.79 60.82 2dtd h SER 221 Cb 0.21 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 2dtd h SER 221 CO 0.00 0.65 0.08 0.00 -1.14 0.00 0.00 176.83 176.43 2dtd h ALA 222 N 1.07 0.94 -0.35 3.77 0.00 -1.40 -1.82 119.26 121.47 2dtd h ALA 222 Ca 0.18 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2dtd h ALA 222 Cb 0.16 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2dtd h ALA 222 CO -0.02 0.65 0.04 0.28 0.00 0.00 0.00 179.25 180.20 2dtd h VAL 223 N 0.99 1.25 -0.65 0.00 2.07 -1.07 -1.76 116.25 117.08 2dtd h VAL 223 Ca 0.19 -0.88 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 2dtd h VAL 223 Cb 0.46 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 2dtd h VAL 223 CO 0.02 0.30 0.34 0.00 0.02 0.00 0.00 177.57 178.24 2dtd h ALA 224 N 0.89 0.83 0.12 1.67 0.00 -0.95 -1.42 119.26 120.41 2dtd h ALA 224 Ca 0.10 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2dtd h ALA 224 Cb 0.39 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2dtd h ALA 224 CO 0.01 0.37 -0.08 0.35 0.00 0.00 0.00 179.25 179.90 2dtd h PHE 225 N 0.89 -0.20 0.00 0.00 3.04 -1.15 -2.09 116.94 117.43 2dtd h PHE 225 Ca 0.23 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 62.15 2dtd h PHE 225 Cb 0.07 0.07 -0.00 0.00 2.56 0.00 0.00 35.95 38.65 2dtd h PHE 225 CO -0.00 -0.13 -0.14 -0.07 -2.02 0.00 0.00 178.31 175.95 2dtd h LEU 226 N -0.20 0.00 0.00 0.59 3.38 -1.19 -2.15 115.31 115.75 2dtd h LEU 226 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2dtd h LEU 226 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2dtd h LEU 226 CO 0.01 0.14 -0.27 0.00 0.09 0.00 0.00 178.44 178.41 2dtd h ALA 227 N 1.86 0.85 -2.04 1.53 0.00 -0.98 -3.45 119.26 117.04 2dtd h ALA 227 Ca -0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 2dtd h ALA 227 Cb 0.31 0.00 0.08 0.00 0.00 0.00 0.00 17.79 18.18 2dtd h ALA 227 CO 0.02 0.00 0.16 -1.54 0.00 0.00 0.00 179.25 177.89 2dtd s SER 228 N -5.50 4.74 0.26 0.00 1.04 -0.81 -4.79 113.70 108.64 2dtd s SER 228 Ca 0.06 0.21 0.22 0.00 0.48 0.00 0.00 55.95 56.93 2dtd s SER 228 Cb 0.08 -0.84 0.99 0.00 0.10 0.00 0.00 66.02 66.35 2dtd s SER 228 CO 0.69 -1.61 1.68 0.54 0.98 0.00 0.00 173.24 175.52 2dtd n ARG 229 N -2.83 0.17 0.26 4.02 5.12 -1.26 -1.81 116.66 120.33 2dtd n ARG 229 Ca 0.09 0.47 0.18 0.00 -1.93 0.00 0.00 57.85 56.66 2dtd n ARG 229 Cb 0.60 -1.87 0.82 0.00 -1.16 0.00 0.00 32.46 30.85 2dtd n ARG 229 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2dtd h GLU 230 N 0.00 0.00 -0.48 5.56 4.39 -1.93 -1.74 114.58 120.38 2dtd h GLU 230 Ca 0.00 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.48 2dtd h GLU 230 Cb 0.27 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.79 2dtd h GLU 230 CO 0.00 0.00 0.08 0.00 -1.16 0.00 0.00 179.01 177.93 2dtd n ALA 231 N -2.00 4.39 -0.08 3.43 0.00 -0.75 -4.79 120.51 120.71 2dtd n ALA 231 Ca -0.01 -2.95 0.25 0.00 0.00 0.00 0.00 53.44 50.73 2dtd n ALA 231 Cb 0.19 -0.89 0.71 0.00 0.00 0.00 0.00 19.45 19.46 2dtd n ALA 231 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2dtd h SER 232 N 1.19 0.00 -0.31 0.00 4.64 -1.45 0.40 113.55 118.02 2dtd h SER 232 Ca 0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.58 2dtd h SER 232 Cb 1.89 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.97 2dtd h SER 232 CO 0.52 0.00 0.00 0.33 -0.87 0.00 0.00 176.83 176.81 2dtd n PHE 233 N -4.24 1.12 -3.87 4.77 -0.00 -1.26 -4.92 117.46 109.06 2dtd n PHE 233 Ca 0.14 -0.88 -0.35 0.00 -0.00 0.00 0.00 57.45 56.36 2dtd n PHE 233 Cb 0.80 -0.35 -0.14 0.00 -0.00 0.00 0.00 39.48 39.79 2dtd n PHE 233 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 2dtd s ILE 234 N -2.84 3.49 -0.17 -2.13 1.01 0.13 -5.08 121.20 115.61 2dtd s ILE 234 Ca 0.44 -0.59 -0.23 0.00 0.00 0.00 0.00 60.65 60.27 2dtd s ILE 234 Cb 0.36 -2.67 0.06 0.00 0.01 0.00 0.00 42.46 40.22 2dtd s ILE 234 CO 0.10 0.31 0.60 0.28 0.00 0.00 0.00 174.94 176.22 2dtd s THR 235 N 1.47 0.01 0.00 2.92 -1.32 -1.26 -4.74 115.64 112.71 2dtd s THR 235 Ca 0.04 -0.05 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 2dtd s THR 235 Cb -0.15 -0.86 0.00 0.00 -1.51 0.00 0.00 72.50 69.98 2dtd s THR 235 CO -0.02 -0.02 0.00 0.61 -2.21 0.00 0.00 174.62 172.98 2dtd n GLY 236 N 2.19 0.71 3.86 6.08 0.00 0.38 -4.98 105.19 113.43 2dtd n GLY 236 Ca -0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 2dtd n GLY 236 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dtd s THR 237 N -2.64 2.37 -0.11 2.61 -1.32 -1.26 -4.59 115.64 110.69 2dtd s THR 237 Ca 0.00 -1.44 0.03 0.00 -1.21 0.00 0.00 61.69 59.07 2dtd s THR 237 Cb 0.00 -2.81 0.00 0.00 -1.51 0.00 0.00 72.50 68.18 2dtd s THR 237 CO 0.00 0.00 -0.22 0.00 -2.21 0.00 0.00 174.62 172.19 2dtd s LEU 239 N 0.46 4.51 -0.10 0.00 2.96 0.08 -4.87 118.68 121.71 2dtd s LEU 239 Ca -0.15 -0.26 -0.30 0.00 -0.22 0.00 0.00 54.13 53.20 2dtd s LEU 239 Cb -0.17 -2.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.95 2dtd s LEU 239 CO 0.06 -0.56 1.07 -0.31 -1.32 0.00 0.00 176.35 175.29 2dtd s TYR 240 N 2.40 3.40 -0.73 5.38 2.02 -1.26 -1.01 117.35 127.54 2dtd s TYR 240 Ca 0.18 1.47 0.04 0.00 -0.37 0.00 0.00 57.07 58.38 2dtd s TYR 240 Cb -0.16 -3.27 0.23 0.00 -0.40 0.00 0.00 41.96 38.37 2dtd s TYR 240 CO 0.14 -0.57 0.74 0.28 -1.57 0.00 0.00 175.55 174.57 2dtd n VAL 241 N 4.65 2.47 -1.06 0.71 0.31 -0.57 -4.87 118.33 119.98 2dtd n VAL 241 Ca 0.10 -5.17 0.05 0.00 -0.01 0.00 0.00 64.34 59.31 2dtd n VAL 241 Cb 0.48 -2.16 0.07 0.00 -0.91 0.00 0.00 33.84 31.32 2dtd n VAL 241 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2dtd n ASP 242 N 1.39 1.63 -1.45 4.52 3.85 -1.26 -2.05 116.55 123.18 2dtd n ASP 242 Ca 0.26 -2.51 -0.15 0.00 -0.71 0.00 0.00 54.79 51.68 2dtd n ASP 242 Cb 0.38 -0.27 -0.06 0.00 -1.35 0.00 0.00 41.12 39.82 2dtd n ASP 242 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2dtd n GLY 243 N -0.86 1.41 1.12 6.12 0.00 -1.26 -0.73 105.19 110.98 2dtd n GLY 243 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2dtd n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dtd n GLY 244 N -0.29 0.73 0.20 -0.02 0.00 -1.26 -1.93 105.19 102.63 2dtd n GLY 244 Ca -0.15 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 2dtd n GLY 244 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2dtd h LEU 245 N 0.00 -0.17 -0.30 0.99 5.85 -1.27 -2.56 115.31 117.86 2dtd h LEU 245 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2dtd h LEU 245 Cb 0.00 0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2dtd h LEU 245 CO 0.00 -0.05 0.00 -1.54 -0.34 0.00 0.00 178.44 176.51 2dtd n SER 246 N -5.21 0.25 -0.72 1.25 3.41 -1.26 -2.65 113.62 108.68 2dtd n SER 246 Ca 0.05 0.57 0.08 0.00 -0.26 0.00 0.00 58.87 59.31 2dtd n SER 246 Cb 0.27 -0.62 0.12 0.00 -0.26 0.00 0.00 64.21 63.72 2dtd n SER 246 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2dtd n ILE 247 N -1.78 0.38 -3.58 -1.33 -6.64 -0.97 -4.96 119.36 100.47 2dtd n ILE 247 Ca 0.03 -0.69 -0.38 0.00 -1.77 0.00 0.00 62.75 59.93 2dtd n ILE 247 Cb 0.17 1.01 -0.11 0.00 -1.44 0.00 0.00 39.64 39.27 2dtd n ILE 247 CO 0.00 0.00 0.00 -0.60 -1.77 0.00 0.00 176.55 174.18 2dtd s ARG 248 N -1.18 3.90 0.08 6.28 3.52 -1.09 -5.08 118.95 125.38 2dtd s ARG 248 Ca 0.23 -0.36 -0.25 0.00 -0.13 0.00 0.00 55.73 55.23 2dtd s ARG 248 Cb 0.14 -3.68 -0.06 0.00 -1.56 0.00 0.00 34.95 29.80 2dtd s ARG 248 CO 0.20 -0.21 0.77 0.00 -0.81 0.00 0.00 175.30 175.25 2dtd s ALA 249 N 1.76 3.39 0.00 6.12 0.00 -1.26 -4.94 121.76 126.82 2dtd s ALA 249 Ca 0.07 0.30 -0.01 0.00 0.00 0.00 0.00 51.96 52.32 2dtd s ALA 249 Cb -0.16 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 2dtd s ALA 249 CO 0.11 0.12 1.93 -0.35 0.00 0.00 0.00 175.76 177.57 2dtd n PRO 250 N 2.50 0.99 -4.03 0.00 -0.04 -1.26 -4.79 135.00 128.38 2dtd n PRO 250 Ca -0.03 -0.15 -0.34 0.00 -0.04 0.00 0.00 63.50 62.94 2dtd n PRO 250 Cb 0.50 -1.23 -0.15 0.00 -0.04 0.00 0.00 33.50 32.57 2dtd n PRO 250 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2dtd s ILE 251 N 0.51 2.63 0.76 0.52 -1.09 -1.26 -5.11 121.20 118.16 2dtd s ILE 251 Ca 0.10 -0.77 -0.12 0.00 -2.23 0.00 0.00 60.65 57.62 2dtd s ILE 251 Cb 0.05 -2.16 0.06 0.00 -1.58 0.00 0.00 42.46 38.82 2dtd s ILE 251 CO 0.00 0.47 1.13 -0.94 -1.23 0.00 0.00 174.94 174.36 2dtd s SER 252 N 1.37 4.31 0.09 3.58 1.04 -1.26 -5.07 113.70 117.75 2dtd s SER 252 Ca 0.05 2.03 -0.00 0.00 0.48 0.00 0.00 55.95 58.51 2dtd s SER 252 Cb -0.14 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.39 2dtd s SER 252 CO -0.09 -2.17 -0.02 0.42 0.98 0.00 0.00 173.24 172.37 2dtd s THR 253 N -2.55 0.33 0.28 2.02 -4.23 -1.26 -5.12 115.64 105.11 2dtd s THR 253 Ca 0.66 -1.87 -0.30 0.00 -1.18 0.00 0.00 61.69 59.00 2dtd s THR 253 Cb -0.21 -1.71 -0.12 0.00 1.34 0.00 0.00 72.50 71.80 2dtd s THR 253 CO 0.51 -0.82 1.60 -2.65 -0.54 0.00 0.00 174.62 172.72 2dtd n PRO 254 N 0.01 2.68 0.00 3.99 -0.02 -1.26 -5.34 135.00 135.06 2dtd n PRO 254 Ca -0.11 0.95 0.06 0.00 -2.02 0.00 0.00 63.50 62.38 2dtd n PRO 254 Cb 0.62 -2.74 0.05 0.00 -0.02 0.00 0.00 33.50 31.41 2dtd n PRO 254 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57