#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dkw h GLU 2 N 0.00 0.40 -6.94 0.03 5.08 -2.01 -3.44 114.58 107.69 3dkw h GLU 2 Ca 0.00 -0.35 -0.52 0.00 -1.00 0.00 0.00 59.36 57.49 3dkw h GLU 2 Cb 0.00 0.08 0.07 0.00 0.50 0.00 0.00 28.75 29.40 3dkw h GLU 2 CO 0.00 0.99 0.59 -0.59 -1.00 0.00 0.00 179.01 179.00 3dkw s PHE 3 N -3.53 2.91 0.41 4.33 -0.12 -1.26 -5.05 117.98 115.67 3dkw s PHE 3 Ca -0.14 1.45 -0.04 0.00 -0.05 0.00 0.00 56.93 58.15 3dkw s PHE 3 Cb 0.04 -3.60 0.09 0.00 -0.63 0.00 0.00 43.02 38.92 3dkw s PHE 3 CO 0.80 -1.86 0.56 1.04 -0.05 0.00 0.00 175.22 175.71 3dkw n GLN 4 N 0.18 -0.20 0.09 1.99 6.02 -1.26 -5.00 117.38 119.19 3dkw n GLN 4 Ca 0.03 -1.13 -0.07 0.00 -0.01 0.00 0.00 57.00 55.82 3dkw n GLN 4 Cb 0.44 -0.50 -0.03 0.00 1.02 0.00 0.00 30.24 31.17 3dkw n GLN 4 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dkw h ARG 5 N 0.00 0.09 -0.21 -1.09 3.08 -1.98 -3.29 114.38 110.97 3dkw h ARG 5 Ca -0.18 -0.11 -0.18 0.00 0.07 0.00 0.00 59.98 59.58 3dkw h ARG 5 Cb 0.57 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 3dkw h ARG 5 CO 0.16 0.93 -0.59 0.28 -1.07 0.00 0.00 179.97 179.68 3dkw h VAL 6 N 0.04 1.30 0.00 2.04 2.07 -2.00 -3.04 116.25 116.66 3dkw h VAL 6 Ca -0.03 -1.82 -0.02 0.00 0.82 0.00 0.00 66.70 65.65 3dkw h VAL 6 Cb 1.58 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 33.11 3dkw h VAL 6 CO 0.13 0.58 -0.08 0.45 0.02 0.00 0.00 177.57 178.66 3dkw h HIS 7 N 0.51 0.00 0.12 1.57 3.86 -1.95 -2.31 115.15 116.95 3dkw h HIS 7 Ca 0.00 0.00 -0.27 0.00 -1.16 0.00 0.00 60.37 58.94 3dkw h HIS 7 Cb 1.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.64 3dkw h HIS 7 CO 0.06 0.08 -1.23 1.96 0.86 0.00 0.00 177.93 179.66 3dkw h GLN 8 N 0.00 0.27 0.00 2.45 4.20 -1.62 -3.28 115.11 117.14 3dkw h GLN 8 Ca -0.00 -0.46 -0.04 0.00 0.06 0.00 0.00 58.65 58.21 3dkw h GLN 8 Cb 0.31 0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3dkw h GLN 8 CO 0.01 1.22 -0.18 1.96 -0.67 0.00 0.00 178.83 181.16 3dkw h GLN 9 N 0.08 0.00 0.00 1.46 4.20 -1.39 -3.09 115.11 116.37 3dkw h GLN 9 Ca -0.13 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.51 3dkw h GLN 9 Cb 1.96 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.73 3dkw h GLN 9 CO 0.20 0.18 -0.32 -0.07 -0.67 0.00 0.00 178.83 178.16 3dkw h LEU 10 N 0.00 0.00 0.00 1.46 3.38 -1.49 -2.93 115.31 115.72 3dkw h LEU 10 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 3dkw h LEU 10 Cb 0.97 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 3dkw h LEU 10 CO 0.02 0.32 -0.64 -0.07 0.09 0.00 0.00 178.44 178.17 3dkw h LEU 11 N 0.00 0.00 -1.12 1.67 3.38 -1.63 -3.28 115.31 114.33 3dkw h LEU 11 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 3dkw h LEU 11 Cb 0.83 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 3dkw h LEU 11 CO 0.04 0.62 -0.32 -0.61 0.09 0.00 0.00 178.44 178.27 3dkw h GLN 12 N 0.00 0.21 0.00 1.13 5.75 -1.57 -2.63 115.11 118.00 3dkw h GLN 12 Ca -0.01 -0.08 -0.06 0.00 -0.15 0.00 0.00 58.65 58.35 3dkw h GLN 12 Cb 1.48 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 30.01 3dkw h GLN 12 CO 0.08 0.51 -0.28 0.66 -2.65 0.00 0.00 178.83 177.16 3dkw h SER 13 N 0.19 0.00 -4.12 -0.69 4.64 -1.62 -3.40 113.55 108.56 3dkw h SER 13 Ca 0.03 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.85 3dkw h SER 13 Cb 0.66 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.82 3dkw h SER 13 CO 0.05 0.28 0.41 -2.28 -0.87 0.00 0.00 176.83 174.41 3dkw s HIS 14 N -3.36 2.74 0.20 4.77 5.65 -0.99 -4.96 115.29 119.35 3dkw s HIS 14 Ca 0.03 1.55 -0.04 0.00 0.25 0.00 0.00 55.06 56.84 3dkw s HIS 14 Cb 0.09 -3.20 0.15 0.00 -1.18 0.00 0.00 32.58 28.43 3dkw s HIS 14 CO 0.67 -1.43 1.57 1.12 -0.65 0.00 0.00 174.74 176.02 3dkw h HIS 15 N 0.96 0.80 -0.01 3.88 2.07 -1.87 -3.17 115.15 117.81 3dkw h HIS 15 Ca -0.49 -0.23 -0.13 0.00 -2.85 0.00 0.00 60.37 56.67 3dkw h HIS 15 Cb 1.25 -0.17 -0.02 0.00 2.57 0.00 0.00 27.41 31.04 3dkw h HIS 15 CO 0.53 0.95 -0.63 -0.07 -3.07 0.00 0.00 177.93 175.65 3dkw h LEU 16 N 0.56 0.03 -5.65 6.12 3.38 -1.93 -3.33 115.31 114.49 3dkw h LEU 16 Ca 0.05 -0.02 -0.63 0.00 0.09 0.00 0.00 57.88 57.38 3dkw h LEU 16 Cb 0.90 -0.01 -0.40 0.00 0.09 0.00 0.00 40.66 41.24 3dkw h LEU 16 CO 0.08 0.65 -0.38 0.49 0.09 0.00 0.00 178.44 179.37 3dkw n PHE 17 N -3.80 3.77 0.00 1.13 3.01 -1.20 -4.72 117.46 115.66 3dkw n PHE 17 Ca -0.01 -3.81 0.00 0.00 1.01 0.00 0.00 57.45 54.63 3dkw n PHE 17 Cb 0.63 -0.61 0.00 0.00 -0.01 0.00 0.00 39.48 39.48 3dkw n PHE 17 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 3dkw n GLU 18 N 0.06 0.00 0.10 -1.08 2.13 -1.23 -3.70 120.64 116.92 3dkw n GLU 18 Ca 0.32 0.00 0.03 0.00 0.66 0.00 0.00 57.16 58.18 3dkw n GLU 18 Cb 0.38 -0.20 0.42 0.00 0.27 0.00 0.00 31.44 32.31 3dkw n GLU 18 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 3dkw h PRO 19 N 0.00 0.30 -7.03 5.31 0.11 -1.84 -3.44 132.00 125.41 3dkw h PRO 19 Ca 0.00 -0.05 -0.54 0.00 0.11 0.00 0.00 66.00 65.52 3dkw h PRO 19 Cb 0.39 -0.05 0.13 0.00 0.11 0.00 0.00 31.00 31.57 3dkw h PRO 19 CO 0.00 0.34 0.62 -0.51 -0.21 0.00 0.00 178.00 178.23 3dkw s LEU 20 N -9.01 3.92 0.73 2.35 1.02 -1.26 -5.01 118.68 111.42 3dkw s LEU 20 Ca -0.06 2.75 -0.11 0.00 0.02 0.00 0.00 54.13 56.73 3dkw s LEU 20 Cb 0.16 -4.20 0.04 0.00 0.02 0.00 0.00 46.19 42.21 3dkw s LEU 20 CO 0.73 -1.43 1.11 -0.94 0.02 0.00 0.00 176.35 175.84 3dkw s SER 21 N -0.90 5.14 0.48 2.29 1.04 -1.26 -4.83 113.70 115.66 3dkw s SER 21 Ca 0.69 0.97 0.18 0.00 0.48 0.00 0.00 55.95 58.27 3dkw s SER 21 Cb -0.40 -1.68 1.20 0.00 0.10 0.00 0.00 66.02 65.24 3dkw s SER 21 CO 0.48 -1.51 2.05 1.55 0.98 0.00 0.00 173.24 176.80 3dkw h PRO 22 N -0.75 0.00 -0.30 4.02 0.13 -1.97 0.27 132.00 133.40 3dkw h PRO 22 Ca -0.45 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.51 3dkw h PRO 22 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.41 3dkw h PRO 22 CO 0.64 0.13 -0.47 0.28 -0.23 0.00 0.00 178.00 178.35 3dkw h VAL 23 N 0.00 1.28 0.00 1.56 2.07 -1.99 -0.87 116.25 118.31 3dkw h VAL 23 Ca -0.00 -1.66 -0.17 0.00 0.82 0.00 0.00 66.70 65.69 3dkw h VAL 23 Cb 0.25 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 3dkw h VAL 23 CO 0.02 0.54 -0.80 1.56 0.02 0.00 0.00 177.57 178.91 3dkw h GLN 24 N 0.65 0.00 -0.07 1.57 4.20 -1.73 -3.00 115.11 116.72 3dkw h GLN 24 Ca 0.03 0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.58 3dkw h GLN 24 Cb 1.05 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.83 3dkw h GLN 24 CO 0.10 0.80 -0.68 1.25 -0.67 0.00 0.00 178.83 179.64 3dkw h LEU 25 N 0.00 0.37 -0.75 1.46 5.85 -0.40 -1.90 115.31 119.94 3dkw h LEU 25 Ca -0.01 -0.23 -0.13 0.00 0.84 0.00 0.00 57.88 58.35 3dkw h LEU 25 Cb 1.55 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.46 3dkw h LEU 25 CO 0.10 0.94 -0.58 -0.61 -0.34 0.00 0.00 178.44 177.95 3dkw h GLN 26 N 0.22 0.13 0.00 1.25 4.15 -1.17 -1.74 115.11 117.96 3dkw h GLN 26 Ca -0.02 -0.09 -0.16 0.00 0.77 0.00 0.00 58.65 59.16 3dkw h GLN 26 Cb 1.22 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.90 3dkw h GLN 26 CO 0.11 0.68 -0.76 0.93 -1.93 0.00 0.00 178.83 177.86 3dkw h GLU 27 N 0.10 0.00 0.00 1.69 4.39 -1.44 -2.41 114.58 116.92 3dkw h GLU 27 Ca -0.00 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.51 3dkw h GLU 27 Cb 1.05 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 3dkw h GLU 27 CO 0.08 0.76 -0.90 1.25 -1.16 0.00 0.00 179.01 179.05 3dkw h LEU 28 N 0.00 0.00 0.00 1.33 5.85 -1.20 -3.18 115.31 118.11 3dkw h LEU 28 Ca -0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3dkw h LEU 28 Cb 1.52 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.55 3dkw h LEU 28 CO 0.10 0.90 -0.46 0.18 -0.34 0.00 0.00 178.44 178.82 3dkw n LEU 29 N -3.37 0.56 -0.24 2.25 4.77 -0.67 -3.89 117.00 116.42 3dkw n LEU 29 Ca 0.00 0.22 -0.08 0.00 -0.03 0.00 0.00 56.01 56.12 3dkw n LEU 29 Cb 0.88 -0.25 0.04 0.00 -2.33 0.00 0.00 43.42 41.75 3dkw n LEU 29 CO 0.46 -0.00 0.91 0.00 -1.33 0.00 0.00 177.39 177.43 3dkw h ALA 30 N 2.73 0.87 -1.11 -1.18 0.00 -1.41 -3.11 119.26 116.05 3dkw h ALA 30 Ca 0.00 -0.26 -0.78 0.00 0.00 0.00 0.00 54.91 53.88 3dkw h ALA 30 Cb 0.64 -0.25 -0.28 0.00 0.00 0.00 0.00 17.79 17.90 3dkw h ALA 30 CO 0.00 0.62 0.99 0.45 0.00 0.00 0.00 179.25 181.31 3dkw n SER 31 N -4.26 7.37 -3.93 0.00 2.88 -1.25 -4.95 113.62 109.48 3dkw n SER 31 Ca 0.04 -3.79 -0.10 0.00 -1.33 0.00 0.00 58.87 53.69 3dkw n SER 31 Cb 0.27 -1.08 -0.12 0.00 -0.75 0.00 0.00 64.21 62.54 3dkw n SER 31 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 3dkw s SER 32 N -1.26 0.14 -0.09 -3.46 1.04 -1.18 -4.33 113.70 104.57 3dkw s SER 32 Ca 0.48 -0.31 0.01 0.00 0.48 0.00 0.00 55.95 56.61 3dkw s SER 32 Cb 0.36 0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.59 3dkw s SER 32 CO -0.32 -0.22 -0.10 -1.81 0.98 0.00 0.00 173.24 171.77 3dkw s ASP 33 N -1.02 2.00 -0.62 7.02 1.01 -1.26 -4.93 116.67 118.87 3dkw s ASP 33 Ca -0.11 -0.31 -0.27 0.00 0.71 0.00 0.00 52.55 52.57 3dkw s ASP 33 Cb -0.07 -0.85 0.01 0.00 1.01 0.00 0.00 42.92 43.02 3dkw s ASP 33 CO -0.00 -0.04 1.51 -0.22 0.21 0.00 0.00 175.17 176.62 3dkw s LEU 34 N 1.19 3.31 -0.19 1.23 2.96 -1.26 -3.34 118.68 122.58 3dkw s LEU 34 Ca -0.04 0.12 -0.02 0.00 -0.22 0.00 0.00 54.13 53.97 3dkw s LEU 34 Cb -0.14 -2.79 -0.00 0.00 0.50 0.00 0.00 46.19 43.76 3dkw s LEU 34 CO -0.03 -1.93 -0.11 -0.69 -1.32 0.00 0.00 176.35 172.28 3dkw s VAL 35 N 6.81 2.96 -0.15 1.68 1.01 -1.04 -5.02 120.40 126.66 3dkw s VAL 35 Ca 0.52 -0.65 -0.05 0.00 0.00 0.00 0.00 61.98 61.80 3dkw s VAL 35 Cb -0.11 -2.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 3dkw s VAL 35 CO 0.21 0.48 0.03 0.54 0.00 0.00 0.00 175.10 176.36 3dkw s ASN 36 N 1.13 5.37 0.20 3.32 2.20 -1.26 -2.84 114.94 123.06 3dkw s ASN 36 Ca 0.01 0.07 0.07 0.00 -0.94 0.00 0.00 52.86 52.07 3dkw s ASN 36 Cb -0.14 -1.80 -0.04 0.00 -2.00 0.00 0.00 41.25 37.27 3dkw s ASN 36 CO -0.03 0.24 0.08 -0.76 -2.94 0.00 0.00 177.10 173.69 3dkw s LEU 37 N -0.04 3.55 0.00 3.54 1.43 -0.27 -4.99 118.68 121.90 3dkw s LEU 37 Ca 0.04 -0.33 -0.02 0.00 -1.03 0.00 0.00 54.13 52.80 3dkw s LEU 37 Cb -0.12 -2.14 0.08 0.00 0.03 0.00 0.00 46.19 44.04 3dkw s LEU 37 CO 0.02 0.04 0.54 0.47 0.23 0.00 0.00 176.35 177.65 3dkw n ASP 38 N -0.55 0.53 -4.65 2.29 8.00 -1.26 -2.18 116.55 118.73 3dkw n ASP 38 Ca -0.08 -1.49 -0.43 0.00 0.71 0.00 0.00 54.79 53.49 3dkw n ASP 38 Cb 0.56 -0.37 -0.02 0.00 -0.02 0.00 0.00 41.12 41.27 3dkw n ASP 38 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3dkw s LYS 39 N -3.91 4.12 0.00 -1.24 2.36 -1.26 -2.84 119.74 116.96 3dkw s LYS 39 Ca 0.34 1.45 0.00 0.00 -2.55 0.00 0.00 55.97 55.21 3dkw s LYS 39 Cb -0.02 -3.79 0.00 0.00 -1.05 0.00 0.00 37.83 32.97 3dkw s LYS 39 CO 0.23 -0.85 0.00 0.41 1.55 0.00 0.00 175.35 176.69 3dkw n GLY 40 N 3.84 0.69 3.84 5.54 0.00 -0.31 -4.91 105.19 113.86 3dkw n GLY 40 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 3dkw n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dkw s ALA 41 N -2.00 3.07 -0.14 4.61 0.00 -1.13 -4.78 121.76 121.39 3dkw s ALA 41 Ca 0.00 0.25 -0.08 0.00 0.00 0.00 0.00 51.96 52.13 3dkw s ALA 41 Cb 0.00 -3.11 -0.04 0.00 0.00 0.00 0.00 23.12 19.96 3dkw s ALA 41 CO 0.00 -0.09 0.14 0.71 0.00 0.00 0.00 175.76 176.52 3dkw s TYR 42 N -2.45 3.56 -0.10 0.00 1.51 -1.26 -0.00 117.35 118.60 3dkw s TYR 42 Ca 0.60 0.49 -0.04 0.00 -1.01 0.00 0.00 57.07 57.11 3dkw s TYR 42 Cb -0.10 -2.00 -0.01 0.00 -0.11 0.00 0.00 41.96 39.74 3dkw s TYR 42 CO 0.25 0.63 -0.08 0.28 -1.11 0.00 0.00 175.55 175.51 3dkw h VAL 43 N 4.15 0.00 -3.84 0.71 2.07 -1.89 -3.48 116.25 113.97 3dkw h VAL 43 Ca -0.51 -0.81 -0.24 0.00 0.82 0.00 0.00 66.70 65.95 3dkw h VAL 43 Cb 1.21 0.00 -0.26 0.00 -1.52 0.00 0.00 31.29 30.72 3dkw h VAL 43 CO 0.63 0.00 -0.72 0.72 0.02 0.00 0.00 177.57 178.21 3dkw s PHE 44 N -1.77 0.22 0.07 1.57 -0.71 -1.26 -5.03 117.98 111.07 3dkw s PHE 44 Ca -0.07 -0.18 0.06 0.00 -1.04 0.00 0.00 56.93 55.70 3dkw s PHE 44 Cb 0.01 -0.14 -0.04 0.00 -1.21 0.00 0.00 43.02 41.64 3dkw s PHE 44 CO 0.10 -0.05 -0.08 1.03 -1.34 0.00 0.00 175.22 174.89 3dkw s ARG 45 N -0.49 2.30 0.17 1.99 0.52 -1.26 -0.40 118.95 121.78 3dkw s ARG 45 Ca -0.04 -0.92 -0.31 0.00 -0.52 0.00 0.00 55.73 53.95 3dkw s ARG 45 Cb -0.03 -2.39 -0.09 0.00 0.52 0.00 0.00 34.95 32.96 3dkw s ARG 45 CO -0.00 0.54 1.36 -1.14 0.02 0.00 0.00 175.30 176.08 3dkw s GLN 46 N -2.00 4.34 0.00 3.54 0.74 -1.25 -2.74 119.66 122.30 3dkw s GLN 46 Ca 0.21 2.09 0.00 0.00 0.05 0.00 0.00 55.36 57.71 3dkw s GLN 46 Cb -0.11 -3.21 0.00 0.00 1.10 0.00 0.00 33.01 30.79 3dkw s GLN 46 CO 0.13 -0.35 0.00 0.41 -0.55 0.00 0.00 175.29 174.92 3dkw n GLY 47 N 2.84 2.21 3.79 2.59 0.00 -0.98 -5.02 105.19 110.61 3dkw n GLY 47 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.75 3dkw n GLY 47 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dkw s GLU 48 N -0.17 4.04 0.26 1.61 2.02 -1.11 -4.77 118.70 120.59 3dkw s GLU 48 Ca 0.00 1.45 -0.31 0.00 0.02 0.00 0.00 54.97 56.13 3dkw s GLU 48 Cb 0.00 -2.37 -0.13 0.00 0.10 0.00 0.00 34.13 31.72 3dkw s GLU 48 CO 0.00 -0.24 1.39 -2.30 0.02 0.00 0.00 175.26 174.13 3dkw n PRO 49 N -0.40 2.05 -2.10 0.39 -0.02 -1.26 -0.86 135.00 132.80 3dkw n PRO 49 Ca 0.07 0.73 -0.42 0.00 -2.02 0.00 0.00 63.50 61.85 3dkw n PRO 49 Cb 0.51 -2.37 -0.03 0.00 -0.02 0.00 0.00 33.50 31.59 3dkw n PRO 49 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dkw s ALA 50 N -0.23 2.84 -0.20 3.55 0.00 -0.69 -4.60 121.76 122.42 3dkw s ALA 50 Ca 0.66 0.03 -0.09 0.00 0.00 0.00 0.00 51.96 52.57 3dkw s ALA 50 Cb -0.63 -4.03 0.08 0.00 0.00 0.00 0.00 23.12 18.54 3dkw s ALA 50 CO 0.52 -2.72 0.45 -1.01 0.00 0.00 0.00 175.76 173.00 3dkw s HIS 51 N 6.74 -0.77 0.04 0.00 3.76 -1.26 -4.76 115.29 119.03 3dkw s HIS 51 Ca 0.73 1.52 0.00 0.00 -0.15 0.00 0.00 55.06 57.16 3dkw s HIS 51 Cb -0.19 0.34 0.00 0.00 1.11 0.00 0.00 32.58 33.84 3dkw s HIS 51 CO 0.32 -0.44 0.00 0.00 -0.85 0.00 0.00 174.74 173.77 3dkw n ALA 52 N 4.89 -2.83 -2.73 -1.40 0.00 -1.26 -4.86 120.51 112.32 3dkw n ALA 52 Ca -0.15 0.08 -0.22 0.00 0.00 0.00 0.00 53.44 53.15 3dkw n ALA 52 Cb 0.52 -0.67 -0.01 0.00 0.00 0.00 0.00 19.45 19.29 3dkw n ALA 52 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3dkw s PHE 53 N -0.31 3.41 0.18 0.00 -0.71 0.24 -4.85 117.98 115.93 3dkw s PHE 53 Ca 0.00 0.12 0.09 0.00 -1.04 0.00 0.00 56.93 56.11 3dkw s PHE 53 Cb 0.00 -1.82 -0.04 0.00 -1.21 0.00 0.00 43.02 39.95 3dkw s PHE 53 CO 0.00 0.19 -0.12 0.71 -1.34 0.00 0.00 175.22 174.65 3dkw s TYR 54 N -2.19 2.58 -0.27 3.49 1.51 -1.25 -2.76 117.35 118.45 3dkw s TYR 54 Ca 0.39 -0.24 0.01 0.00 -1.01 0.00 0.00 57.07 56.21 3dkw s TYR 54 Cb -0.09 -1.27 0.08 0.00 -0.11 0.00 0.00 41.96 40.56 3dkw s TYR 54 CO 0.33 0.50 0.01 -0.47 -1.11 0.00 0.00 175.55 174.81 3dkw s TYR 55 N -1.66 2.31 0.23 2.71 6.14 -1.26 -3.18 117.35 122.64 3dkw s TYR 55 Ca 0.24 -1.87 -0.30 0.00 0.64 0.00 0.00 57.07 55.78 3dkw s TYR 55 Cb -0.09 -1.78 -0.09 0.00 0.42 0.00 0.00 41.96 40.42 3dkw s TYR 55 CO 0.14 -0.81 1.25 -1.17 0.64 0.00 0.00 175.55 175.59 3dkw s LEU 56 N 1.41 4.45 -0.10 6.97 0.20 -1.19 -3.02 118.68 127.40 3dkw s LEU 56 Ca 0.01 2.38 0.01 0.00 0.69 0.00 0.00 54.13 57.22 3dkw s LEU 56 Cb -0.18 -3.62 -0.07 0.00 -0.43 0.00 0.00 46.19 41.89 3dkw s LEU 56 CO -0.11 -0.43 -0.09 -0.38 -0.29 0.00 0.00 176.35 175.05 3dkw n ILE 57 N 2.07 0.59 -3.71 6.68 5.41 -1.02 -2.77 119.36 126.60 3dkw n ILE 57 Ca 0.03 -0.23 -0.13 0.00 1.00 0.00 0.00 62.75 63.43 3dkw n ILE 57 Cb 0.43 -0.87 -0.09 0.00 -0.71 0.00 0.00 39.64 38.40 3dkw n ILE 57 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 3dkw s SER 58 N -5.00 -0.48 0.00 4.38 1.04 -1.22 -3.92 113.70 108.49 3dkw s SER 58 Ca -0.14 0.92 0.00 0.00 0.48 0.00 0.00 55.95 57.21 3dkw s SER 58 Cb 0.04 0.93 0.00 0.00 0.10 0.00 0.00 66.02 67.09 3dkw s SER 58 CO 0.24 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.89 3dkw n GLY 59 N 2.74 -1.36 2.96 7.32 0.00 -1.26 -2.77 105.19 112.81 3dkw n GLY 59 Ca -0.14 -2.08 -0.13 0.00 0.00 0.00 0.00 46.02 43.68 3dkw n GLY 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dkw s VAL 61 N 0.34 1.00 0.06 0.00 1.01 -1.26 -1.71 120.40 119.85 3dkw s VAL 61 Ca -0.02 -0.30 -0.15 0.00 0.00 0.00 0.00 61.98 61.51 3dkw s VAL 61 Cb -0.04 -1.01 -0.06 0.00 0.00 0.00 0.00 36.38 35.27 3dkw s VAL 61 CO -0.01 0.36 0.48 -1.59 0.00 0.00 0.00 175.10 174.33 3dkw s LYS 62 N 1.53 3.99 -0.00 2.72 -2.85 0.72 -3.85 119.74 122.00 3dkw s LYS 62 Ca 0.01 0.49 -0.00 0.00 -1.00 0.00 0.00 55.97 55.47 3dkw s LYS 62 Cb -0.13 -3.15 -0.00 0.00 -2.06 0.00 0.00 37.83 32.49 3dkw s LYS 62 CO -0.06 0.62 -0.00 -0.89 0.10 0.00 0.00 175.35 175.12 3dkw n ILE 63 N 1.50 0.02 -1.51 3.79 2.08 -1.23 -0.05 119.36 123.96 3dkw n ILE 63 Ca -0.11 0.50 0.00 0.00 0.56 0.00 0.00 62.75 63.70 3dkw n ILE 63 Cb 0.52 -1.51 0.00 0.00 -0.75 0.00 0.00 39.64 37.89 3dkw n ILE 63 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3dkw n TYR 64 N -2.29 -3.30 -4.37 1.39 4.11 -1.26 -3.50 117.16 107.94 3dkw n TYR 64 Ca -0.00 1.76 -0.29 0.00 -0.00 0.00 0.00 57.90 59.37 3dkw n TYR 64 Cb 0.00 -2.74 -0.12 0.00 -0.00 0.00 0.00 39.34 36.49 3dkw n TYR 64 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.86 177.89 3dkw s ARG 65 N -3.45 1.57 -0.19 -3.48 0.52 -1.26 -3.15 118.95 109.50 3dkw s ARG 65 Ca 0.00 -1.34 -0.29 0.00 -0.52 0.00 0.00 55.73 53.58 3dkw s ARG 65 Cb 0.00 -1.96 -0.03 0.00 0.52 0.00 0.00 34.95 33.48 3dkw s ARG 65 CO 0.00 0.45 1.49 -0.51 0.02 0.00 0.00 175.30 176.75 3dkw s LEU 66 N -2.26 4.05 0.18 2.53 1.43 -1.26 -2.94 118.68 120.41 3dkw s LEU 66 Ca 0.17 1.70 -0.16 0.00 -1.03 0.00 0.00 54.13 54.81 3dkw s LEU 66 Cb -0.10 -3.53 -0.07 0.00 0.03 0.00 0.00 46.19 42.51 3dkw s LEU 66 CO 0.08 -1.05 0.61 0.28 0.23 0.00 0.00 176.35 176.51 3dkw s THR 67 N 4.44 4.75 -0.66 5.49 -1.32 -1.26 -4.89 115.64 122.19 3dkw s THR 67 Ca 0.66 0.98 -0.17 0.00 -1.21 0.00 0.00 61.69 61.94 3dkw s THR 67 Cb -0.25 -3.77 -0.16 0.00 -1.51 0.00 0.00 72.50 66.81 3dkw s THR 67 CO 0.25 0.21 1.69 -2.65 -2.21 0.00 0.00 174.62 171.91 3dkw n PRO 68 N 0.72 0.00 -2.99 7.08 -0.02 -1.26 -1.93 135.00 136.60 3dkw n PRO 68 Ca -0.04 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.21 3dkw n PRO 68 Cb 0.52 -0.91 0.02 0.00 -0.02 0.00 0.00 33.50 33.10 3dkw n PRO 68 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3dkw n GLU 69 N 5.14 -1.22 0.00 -0.52 4.07 -1.26 -4.87 120.64 121.98 3dkw n GLU 69 Ca 0.44 0.79 0.00 0.00 -0.06 0.00 0.00 57.16 58.32 3dkw n GLU 69 Cb 0.04 -1.42 0.00 0.00 -0.06 0.00 0.00 31.44 30.00 3dkw n GLU 69 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3dkw n GLY 70 N -0.58 0.24 1.55 8.31 0.00 -0.81 -5.11 105.19 108.80 3dkw n GLY 70 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3dkw n GLY 70 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dkw n GLN 71 N -0.33 0.00 -3.54 1.61 6.02 -1.26 -5.06 117.38 114.83 3dkw n GLN 71 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 57.00 56.98 3dkw n GLN 71 Cb 0.00 0.00 0.02 0.00 1.02 0.00 0.00 30.24 31.28 3dkw n GLN 71 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 3dkw n GLU 72 N -2.99 0.44 0.04 -1.09 0.28 -1.26 -4.79 120.64 111.26 3dkw n GLU 72 Ca 0.00 -1.08 0.00 0.00 -0.16 0.00 0.00 57.16 55.92 3dkw n GLU 72 Cb 0.00 1.52 0.00 0.00 1.43 0.00 0.00 31.44 34.39 3dkw n GLU 72 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 3dkw n LYS 73 N -0.66 0.00 -1.96 3.44 4.81 -1.15 -4.62 118.16 118.01 3dkw n LYS 73 Ca -0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 58.31 57.44 3dkw n LYS 73 Cb 0.49 -0.01 -0.00 0.00 0.02 0.00 0.00 35.03 35.53 3dkw n LYS 73 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 3dkw n ILE 74 N -2.75-10.17 -0.06 3.15 5.41 -1.26 -4.90 119.36 108.77 3dkw n ILE 74 Ca 0.00 2.26 -0.11 0.00 1.00 0.00 0.00 62.75 65.90 3dkw n ILE 74 Cb 0.01 -5.22 -0.05 0.00 -0.71 0.00 0.00 39.64 33.67 3dkw n ILE 74 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3dkw n LEU 75 N 1.30 1.60 -4.26 1.39 4.32 -1.26 -4.88 117.00 115.21 3dkw n LEU 75 Ca -0.00 0.08 -0.29 0.00 -0.02 0.00 0.00 56.01 55.77 3dkw n LEU 75 Cb 0.00 -0.38 -0.16 0.00 -1.62 0.00 0.00 43.42 41.27 3dkw n LEU 75 CO 0.00 0.41 -0.55 -1.61 -1.22 0.00 0.00 177.39 174.42 3dkw s GLU 76 N -2.23 1.91 -0.30 3.23 2.02 -1.26 -5.05 118.70 117.02 3dkw s GLU 76 Ca -0.17 -0.84 0.01 0.00 0.02 0.00 0.00 54.97 54.00 3dkw s GLU 76 Cb 0.06 -1.84 0.09 0.00 0.10 0.00 0.00 34.13 32.54 3dkw s GLU 76 CO 0.23 0.50 0.05 0.08 0.02 0.00 0.00 175.26 176.14 3dkw s VAL 77 N -0.54 1.48 0.44 2.63 1.01 -1.26 -3.58 120.40 120.58 3dkw s VAL 77 Ca 0.09 -1.66 -0.15 0.00 0.00 0.00 0.00 61.98 60.25 3dkw s VAL 77 Cb -0.09 -2.03 -0.08 0.00 0.00 0.00 0.00 36.38 34.18 3dkw s VAL 77 CO -0.01 -0.52 0.88 0.28 0.00 0.00 0.00 175.10 175.73 3dkw s THR 78 N 1.33 4.61 0.00 3.92 -1.32 -1.25 -5.06 115.64 117.87 3dkw s THR 78 Ca 0.07 1.04 0.00 0.00 -1.21 0.00 0.00 61.69 61.58 3dkw s THR 78 Cb -0.18 -3.69 0.00 0.00 -1.51 0.00 0.00 72.50 67.12 3dkw s THR 78 CO -0.15 -0.51 0.00 -3.20 -2.21 0.00 0.00 174.62 168.55 3dkw n ASN 79 N -1.17 1.02 -4.80 8.08 4.05 -1.26 -4.06 115.26 117.13 3dkw n ASN 79 Ca 0.05 0.00 -0.35 0.00 0.45 0.00 0.00 54.58 54.73 3dkw n ASN 79 Cb 0.54 0.00 -0.06 0.00 1.23 0.00 0.00 39.78 41.49 3dkw n ASN 79 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 3dkw s GLU 80 N 1.71 4.24 -1.31 1.20 2.02 -1.26 -3.95 118.70 121.37 3dkw s GLU 80 Ca 0.00 1.31 -0.02 0.00 0.02 0.00 0.00 54.97 56.28 3dkw s GLU 80 Cb 0.00 -2.42 0.01 0.00 0.10 0.00 0.00 34.13 31.82 3dkw s GLU 80 CO 0.00 -0.03 0.84 0.54 0.02 0.00 0.00 175.26 176.62 3dkw n ARG 81 N -0.23 -5.62 -3.70 1.61 1.74 -1.11 -5.00 116.66 104.34 3dkw n ARG 81 Ca 0.06 0.69 -0.11 0.00 -0.77 0.00 0.00 57.85 57.72 3dkw n ARG 81 Cb 0.52 -5.43 -0.11 0.00 -1.02 0.00 0.00 32.46 26.41 3dkw n ARG 81 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 3dkw s ASN 82 N -4.19 -0.47 0.15 0.55 0.01 -1.20 -5.02 114.94 104.77 3dkw s ASN 82 Ca 0.11 0.83 -0.30 0.00 -0.71 0.00 0.00 52.86 52.79 3dkw s ASN 82 Cb -0.05 0.72 -0.07 0.00 0.41 0.00 0.00 41.25 42.26 3dkw s ASN 82 CO 0.79 -0.18 0.99 0.42 -1.51 0.00 0.00 177.10 177.60 3dkw s THR 83 N 1.27 4.29 -0.05 1.60 -4.23 -1.26 -3.15 115.64 114.10 3dkw s THR 83 Ca -0.09 1.97 0.05 0.00 -1.18 0.00 0.00 61.69 62.45 3dkw s THR 83 Cb -0.08 -4.26 -0.00 0.00 1.34 0.00 0.00 72.50 69.49 3dkw s THR 83 CO -0.11 0.34 -0.20 0.72 -0.54 0.00 0.00 174.62 174.83 3dkw s PHE 84 N -0.26 2.03 -0.08 3.99 -0.71 -1.19 -4.73 117.98 117.03 3dkw s PHE 84 Ca 0.46 -0.63 -0.00 0.00 -1.04 0.00 0.00 56.93 55.73 3dkw s PHE 84 Cb -0.25 -1.35 0.00 0.00 -1.21 0.00 0.00 43.02 40.20 3dkw s PHE 84 CO 0.31 -0.22 0.01 0.00 -1.34 0.00 0.00 175.22 173.98 3dkw n ALA 85 N 3.16 -0.03 1.31 1.99 0.00 -1.26 -3.96 120.51 121.71 3dkw n ALA 85 Ca -0.18 0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.40 3dkw n ALA 85 Cb 0.53 -0.59 0.36 0.00 0.00 0.00 0.00 19.45 19.75 3dkw n ALA 85 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3dkw n GLU 86 N -1.05 1.90 0.16 0.00 0.00 -1.26 -3.92 120.64 116.48 3dkw n GLU 86 Ca -0.01 -1.32 0.04 0.00 0.00 0.00 0.00 57.16 55.87 3dkw n GLU 86 Cb 0.51 -1.47 0.18 0.00 0.00 0.00 0.00 31.44 30.66 3dkw n GLU 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3dkw h ALA 87 N 4.48 0.82 0.00 -1.84 0.00 -1.97 -2.94 119.26 117.81 3dkw h ALA 87 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3dkw h ALA 87 Cb 0.69 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3dkw h ALA 87 CO 0.00 0.57 -0.10 -1.33 0.00 0.00 0.00 179.25 178.39 3dkw n MET 88 N -3.37 0.19 0.03 0.00 2.81 -1.25 -4.13 117.12 111.40 3dkw n MET 88 Ca 0.01 0.14 -0.02 0.00 -1.81 0.00 0.00 57.70 56.02 3dkw n MET 88 Cb 0.63 -1.70 -0.01 0.00 -0.71 0.00 0.00 33.22 31.43 3dkw n MET 88 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 3dkw h MET 89 N 0.00 -0.09 -2.79 0.03 -1.53 -1.72 -3.27 114.93 105.56 3dkw h MET 89 Ca 0.00 0.01 -0.78 0.00 -3.44 0.00 0.00 59.70 55.48 3dkw h MET 89 Cb 0.67 0.02 -0.21 0.00 -0.55 0.00 0.00 31.60 31.53 3dkw h MET 89 CO 0.00 -0.06 1.53 1.97 0.14 0.00 0.00 176.91 180.48 3dkw n PHE 90 N -2.46 2.61 -2.86 1.39 1.16 -1.26 -4.70 117.46 111.33 3dkw n PHE 90 Ca -0.01 -2.67 0.00 0.00 -1.87 0.00 0.00 57.45 52.90 3dkw n PHE 90 Cb 0.04 -1.53 0.01 0.00 -1.61 0.00 0.00 39.48 36.39 3dkw n PHE 90 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 3dkw s MET 91 N -2.13 0.41 0.00 3.97 0.00 -1.23 -5.04 119.30 115.28 3dkw s MET 91 Ca 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 55.69 55.90 3dkw s MET 91 Cb 0.13 0.03 0.00 0.00 0.00 0.00 0.00 34.83 34.99 3dkw s MET 91 CO -0.03 -0.57 0.00 -0.25 0.00 0.00 0.00 175.02 174.18 3dkw n ASP 92 N 3.66 0.00 -1.30 1.11 8.00 -1.26 -4.62 116.55 122.14 3dkw n ASP 92 Ca 0.09 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.57 3dkw n ASP 92 Cb 0.61 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.72 3dkw n ASP 92 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3dkw n THR 93 N 0.00 -0.77 0.00 -3.53 -2.24 -1.26 -5.06 114.28 101.43 3dkw n THR 93 Ca 0.00 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3dkw n THR 93 Cb 0.00 -2.83 0.00 0.00 -2.10 0.00 0.00 70.33 65.40 3dkw n THR 93 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3dkw n PRO 94 N -1.36 0.00 -4.28 -0.78 -0.04 -1.26 -4.74 135.00 122.54 3dkw n PRO 94 Ca -0.03 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.26 3dkw n PRO 94 Cb 0.52 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.87 3dkw n PRO 94 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3dkw s ASN 95 N -1.00 2.11 -0.15 3.54 0.02 -1.26 -1.71 114.94 116.49 3dkw s ASN 95 Ca 0.00 -0.94 -0.29 0.00 -1.02 0.00 0.00 52.86 50.61 3dkw s ASN 95 Cb 0.00 -0.07 -0.04 0.00 0.02 0.00 0.00 41.25 41.16 3dkw s ASN 95 CO 0.00 -0.21 1.71 -0.31 0.02 0.00 0.00 177.10 178.31 3dkw s TYR 96 N -2.76 1.92 -1.27 2.20 2.02 -0.04 -4.61 117.35 114.82 3dkw s TYR 96 Ca 0.15 0.36 0.25 0.00 -0.37 0.00 0.00 57.07 57.47 3dkw s TYR 96 Cb -0.01 -3.98 0.50 0.00 -0.40 0.00 0.00 41.96 38.07 3dkw s TYR 96 CO 0.03 -3.51 1.41 1.55 -1.57 0.00 0.00 175.55 173.45 3dkw n VAL 97 N 6.18 0.00 -4.19 0.71 3.14 -1.26 -2.33 118.33 120.58 3dkw n VAL 97 Ca 0.19 -0.05 -0.17 0.00 -2.96 0.00 0.00 64.34 61.36 3dkw n VAL 97 Cb 0.44 0.40 -0.11 0.00 -1.06 0.00 0.00 33.84 33.50 3dkw n VAL 97 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3dkw s ALA 98 N -2.83 1.25 0.56 1.55 0.00 -1.26 -4.94 121.76 116.08 3dkw s ALA 98 Ca 0.15 -1.15 -0.00 0.00 0.00 0.00 0.00 51.96 50.96 3dkw s ALA 98 Cb 0.18 -0.05 0.07 0.00 0.00 0.00 0.00 23.12 23.32 3dkw s ALA 98 CO 0.65 0.08 0.50 2.41 0.00 0.00 0.00 175.76 179.40 3dkw n THR 99 N 0.82 0.00 -3.64 0.00 -1.04 -1.19 -3.78 114.28 105.45 3dkw n THR 99 Ca -0.18 -0.79 -0.08 0.00 -2.04 0.00 0.00 64.05 60.96 3dkw n THR 99 Cb 0.56 -1.13 -0.07 0.00 -1.82 0.00 0.00 70.33 67.87 3dkw n THR 99 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dkw s ALA 100 N -2.96 -1.88 -0.02 2.41 0.00 0.46 -4.48 121.76 115.28 3dkw s ALA 100 Ca 0.33 2.34 -0.01 0.00 0.00 0.00 0.00 51.96 54.62 3dkw s ALA 100 Cb -0.02 -1.39 0.03 0.00 0.00 0.00 0.00 23.12 21.73 3dkw s ALA 100 CO 0.22 -0.37 0.05 -1.14 0.00 0.00 0.00 175.76 174.52 3dkw s GLN 101 N 1.37 -0.01 -0.12 0.00 0.74 0.93 -2.89 119.66 119.67 3dkw s GLN 101 Ca -0.08 0.19 -0.15 0.00 0.05 0.00 0.00 55.36 55.38 3dkw s GLN 101 Cb -0.05 -0.20 -0.05 0.00 1.10 0.00 0.00 33.01 33.82 3dkw s GLN 101 CO -0.16 -0.14 0.34 0.00 -0.55 0.00 0.00 175.29 174.79 3dkw s ALA 102 N 0.92 3.60 -0.24 1.58 0.00 1.00 -0.20 121.76 128.41 3dkw s ALA 102 Ca -0.08 -0.37 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 3dkw s ALA 102 Cb -0.11 -2.42 0.01 0.00 0.00 0.00 0.00 23.12 20.60 3dkw s ALA 102 CO -0.03 0.16 -0.04 0.14 0.00 0.00 0.00 175.76 175.99 3dkw s VAL 103 N 0.17 3.19 0.02 0.00 -7.23 -0.69 -1.16 120.40 114.69 3dkw s VAL 103 Ca 0.20 -0.74 0.00 0.00 -1.81 0.00 0.00 61.98 59.63 3dkw s VAL 103 Cb -0.14 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.27 3dkw s VAL 103 CO 0.07 0.30 0.00 0.55 -0.31 0.00 0.00 175.10 175.71 3dkw n VAL 104 N 4.75 -1.26 -1.10 1.32 3.14 -1.26 -3.93 118.33 119.99 3dkw n VAL 104 Ca -0.17 0.15 -0.43 0.00 -2.96 0.00 0.00 64.34 60.93 3dkw n VAL 104 Cb 0.49 -1.08 -0.06 0.00 -1.06 0.00 0.00 33.84 32.13 3dkw n VAL 104 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 3dkw n PRO 105 N -0.48 0.00 -4.21 1.45 -0.02 -1.26 -4.53 135.00 125.95 3dkw n PRO 105 Ca 0.00 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.33 3dkw n PRO 105 Cb 0.00 -0.96 -0.11 0.00 -0.02 0.00 0.00 33.50 32.41 3dkw n PRO 105 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3dkw s SER 106 N 1.67 1.69 -0.06 2.55 0.01 -0.93 -4.58 113.70 114.05 3dkw s SER 106 Ca 0.66 -0.86 0.01 0.00 1.31 0.00 0.00 55.95 57.07 3dkw s SER 106 Cb -0.94 -0.02 0.02 0.00 0.21 0.00 0.00 66.02 65.29 3dkw s SER 106 CO 0.50 -0.25 -0.06 -1.58 0.41 0.00 0.00 173.24 172.27 3dkw s GLN 107 N -2.99 1.05 0.06 12.44 0.74 -1.12 -1.11 119.66 128.73 3dkw s GLN 107 Ca 0.09 -0.15 -0.05 0.00 0.05 0.00 0.00 55.36 55.31 3dkw s GLN 107 Cb -0.02 -1.06 -0.02 0.00 1.10 0.00 0.00 33.01 33.00 3dkw s GLN 107 CO 0.01 -0.12 0.08 -0.48 -0.55 0.00 0.00 175.29 174.22 3dkw s LEU 108 N 1.15 1.96 0.00 3.68 0.05 -1.13 -2.44 118.68 121.95 3dkw s LEU 108 Ca -0.07 -0.78 -0.08 0.00 0.05 0.00 0.00 54.13 53.25 3dkw s LEU 108 Cb -0.14 0.59 0.17 0.00 -2.05 0.00 0.00 46.19 44.75 3dkw s LEU 108 CO -0.01 -0.63 1.04 0.49 -0.55 0.00 0.00 176.35 176.69 3dkw n PHE 109 N 0.16 -3.52 -3.35 3.48 3.01 -1.17 -2.49 117.46 113.59 3dkw n PHE 109 Ca -0.15 -1.29 -0.26 0.00 1.01 0.00 0.00 57.45 56.76 3dkw n PHE 109 Cb 0.61 -0.79 -0.08 0.00 -0.01 0.00 0.00 39.48 39.21 3dkw n PHE 109 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3dkw n ARG 110 N -3.10 0.94 -2.73 -1.08 3.00 -1.21 -4.30 116.66 108.18 3dkw n ARG 110 Ca 0.15 -3.54 -0.43 0.00 -0.00 0.00 0.00 57.85 54.03 3dkw n ARG 110 Cb 0.52 -1.60 -0.03 0.00 0.00 0.00 0.00 32.46 31.35 3dkw n ARG 110 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 3dkw s PHE 111 N -1.04 3.19 0.51 -0.14 0.40 -1.11 -4.09 117.98 115.69 3dkw s PHE 111 Ca 0.34 1.12 -0.20 0.00 -0.60 0.00 0.00 56.93 57.60 3dkw s PHE 111 Cb 0.11 -3.51 -0.07 0.00 0.51 0.00 0.00 43.02 40.05 3dkw s PHE 111 CO -0.13 -0.68 1.06 0.45 0.70 0.00 0.00 175.22 176.62 3dkw s SER 112 N 1.59 6.16 0.17 1.36 0.15 -1.26 -0.59 113.70 121.29 3dkw s SER 112 Ca 0.42 1.97 -0.00 0.00 0.70 0.00 0.00 55.95 59.03 3dkw s SER 112 Cb -0.13 -2.56 0.04 0.00 -1.71 0.00 0.00 66.02 61.66 3dkw s SER 112 CO 0.13 -0.91 1.42 0.78 1.20 0.00 0.00 173.24 175.86 3dkw h ASN 113 N 1.38 0.42 0.97 5.45 2.35 -1.89 -3.01 115.58 121.26 3dkw h ASN 113 Ca -0.49 -0.29 -0.03 0.00 -0.55 0.00 0.00 56.30 54.93 3dkw h ASN 113 Cb 1.23 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 39.47 3dkw h ASN 113 CO 0.58 1.04 -0.16 0.11 -1.65 0.00 0.00 177.43 177.36 3dkw h LYS 114 N 0.22 0.00 0.00 0.81 1.57 -1.98 -2.89 116.57 114.30 3dkw h LYS 114 Ca -0.04 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 3dkw h LYS 114 Cb 1.36 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.65 3dkw h LYS 114 CO 0.13 0.16 -0.91 0.00 -0.57 0.00 0.00 179.45 178.26 3dkw h ALA 115 N 1.84 0.66 0.00 3.86 0.00 -1.95 -3.31 119.26 120.36 3dkw h ALA 115 Ca -0.00 -0.49 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 3dkw h ALA 115 Cb 0.69 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3dkw h ALA 115 CO 0.02 0.58 -0.54 -0.92 0.00 0.00 0.00 179.25 178.39 3dkw h TYR 116 N 0.00 0.00 0.00 0.00 3.20 -1.38 -3.25 116.97 115.54 3dkw h TYR 116 Ca -0.07 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.71 3dkw h TYR 116 Cb 1.37 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.62 3dkw h TYR 116 CO 0.00 0.31 -0.43 -0.07 -1.64 0.00 0.00 178.16 176.33 3dkw h LEU 117 N 0.00 0.00 -0.91 2.82 3.38 -1.62 -3.29 115.31 115.69 3dkw h LEU 117 Ca -0.02 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.00 3dkw h LEU 117 Cb 1.26 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.94 3dkw h LEU 117 CO 0.04 0.43 0.57 0.03 0.09 0.00 0.00 178.44 179.60 3dkw h ARG 118 N 0.00 1.03 0.00 1.13 3.08 -1.65 -1.59 114.38 116.38 3dkw h ARG 118 Ca -0.00 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.88 3dkw h ARG 118 Cb 1.29 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 3dkw h ARG 118 CO 0.06 0.68 -0.51 1.96 -1.07 0.00 0.00 179.97 181.08 3dkw h GLN 119 N 1.06 0.00 0.00 0.04 7.50 -1.74 -3.44 115.11 118.53 3dkw h GLN 119 Ca 0.39 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.54 3dkw h GLN 119 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.67 3dkw h GLN 119 CO -0.16 0.51 0.00 1.28 -1.50 0.00 0.00 178.83 178.96 3dkw n LEU 120 N -3.55 0.00 0.00 1.46 4.77 -0.61 -4.63 117.00 114.45 3dkw n LEU 120 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3dkw n LEU 120 Cb 0.61 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 3dkw n LEU 120 CO 0.40 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.46 3dkw n GLN 121 N 0.00 0.00 -3.12 3.23 6.02 -1.18 -3.22 117.38 119.10 3dkw n GLN 121 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.69 3dkw n GLN 121 Cb 0.00 0.00 -0.05 0.00 1.02 0.00 0.00 30.24 31.21 3dkw n GLN 121 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3dkw n ASP 122 N 2.65 4.61 -3.52 1.08 2.03 -1.26 -4.95 116.55 117.18 3dkw n ASP 122 Ca 0.00 -3.56 -0.29 0.00 0.52 0.00 0.00 54.79 51.45 3dkw n ASP 122 Cb 0.00 -0.72 -0.13 0.00 -0.72 0.00 0.00 41.12 39.54 3dkw n ASP 122 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 3dkw s ASN 123 N -2.73 3.29 0.06 1.67 3.04 -1.20 -5.04 114.94 114.04 3dkw s ASN 123 Ca 0.43 -1.79 -0.29 0.00 0.04 0.00 0.00 52.86 51.24 3dkw s ASN 123 Cb 0.20 -0.43 -0.18 0.00 -1.54 0.00 0.00 41.25 39.31 3dkw s ASN 123 CO -0.06 -0.37 1.58 0.71 -3.04 0.00 0.00 177.10 175.92 3dkw h THR 124 N 5.70 0.55 -0.42 -5.21 1.35 -1.93 -2.66 112.91 110.29 3dkw h THR 124 Ca -0.06 -0.10 0.05 0.00 -0.55 0.00 0.00 66.41 65.74 3dkw h THR 124 Cb 0.99 0.60 -0.04 0.00 -1.73 0.00 0.00 68.15 67.96 3dkw h THR 124 CO 0.36 0.02 0.17 -0.65 -0.25 0.00 0.00 175.52 175.17 3dkw h PRO 125 N -0.67 0.34 -0.09 4.72 0.11 -2.00 -2.74 132.00 131.67 3dkw h PRO 125 Ca -0.06 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.03 3dkw h PRO 125 Cb 0.50 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 31.53 3dkw h PRO 125 CO 0.10 0.23 0.05 1.25 -0.21 0.00 0.00 178.00 179.42 3dkw h LEU 126 N 0.35 0.11 -0.80 2.35 5.85 -1.94 -1.02 115.31 120.21 3dkw h LEU 126 Ca 0.19 -0.04 0.12 0.00 0.84 0.00 0.00 57.88 58.98 3dkw h LEU 126 Cb 0.15 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.07 3dkw h LEU 126 CO -0.17 0.12 0.41 0.00 -0.34 0.00 0.00 178.44 178.46 3dkw h ALA 127 N 0.99 1.15 -0.14 1.25 0.00 -1.28 0.06 119.26 121.29 3dkw h ALA 127 Ca 0.03 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 3dkw h ALA 127 Cb 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3dkw h ALA 127 CO -0.01 -0.03 -0.60 -0.07 0.00 0.00 0.00 179.25 178.54 3dkw h LEU 128 N 0.65 0.53 -0.52 0.00 3.38 -1.25 -2.99 115.31 115.10 3dkw h LEU 128 Ca 0.41 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 3dkw h LEU 128 Cb 0.49 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3dkw h LEU 128 CO -0.31 1.01 0.09 0.00 0.09 0.00 0.00 178.44 179.32 3dkw h ALA 129 N 1.00 0.69 -0.85 1.53 0.00 0.03 -1.21 119.26 120.45 3dkw h ALA 129 Ca -0.00 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.68 3dkw h ALA 129 Cb 1.14 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.69 3dkw h ALA 129 CO 0.11 0.42 0.56 -0.07 0.00 0.00 0.00 179.25 180.27 3dkw h LEU 130 N 0.75 0.97 -1.09 0.00 3.38 -1.01 -1.19 115.31 117.11 3dkw h LEU 130 Ca 0.16 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 3dkw h LEU 130 Cb 0.39 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3dkw h LEU 130 CO 0.01 0.70 -0.34 -0.07 0.09 0.00 0.00 178.44 178.83 3dkw h LEU 131 N 1.15 0.00 -0.37 1.67 3.38 -1.36 -2.97 115.31 116.80 3dkw h LEU 131 Ca 0.32 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 58.12 3dkw h LEU 131 Cb -0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 3dkw h LEU 131 CO -0.07 0.34 -0.43 0.00 0.09 0.00 0.00 178.44 178.36 3dkw h ALA 132 N 1.66 0.55 -0.20 1.53 0.00 -0.06 -1.05 119.26 121.69 3dkw h ALA 132 Ca -0.00 -0.47 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 3dkw h ALA 132 Cb 0.80 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 3dkw h ALA 132 CO 0.04 0.68 -0.27 0.87 0.00 0.00 0.00 179.25 180.57 3dkw h LYS 133 N 0.74 0.39 0.01 0.00 1.79 -1.24 -1.69 116.57 116.56 3dkw h LYS 133 Ca 0.05 -0.14 -0.19 0.00 -2.18 0.00 0.00 60.65 58.19 3dkw h LYS 133 Cb 1.03 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.64 3dkw h LYS 133 CO 0.10 0.63 -0.87 -0.07 -1.08 0.00 0.00 179.45 178.17 3dkw h LEU 134 N 0.34 0.09 -0.25 2.94 3.38 -1.42 -2.94 115.31 117.46 3dkw h LEU 134 Ca 0.05 -0.08 -0.20 0.00 0.09 0.00 0.00 57.88 57.74 3dkw h LEU 134 Cb 0.66 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.39 3dkw h LEU 134 CO 0.05 0.91 -0.67 0.28 0.09 0.00 0.00 178.44 179.10 3dkw h SER 135 N 0.03 0.92 0.69 -0.43 0.02 -0.91 -3.05 113.55 110.82 3dkw h SER 135 Ca -0.02 -0.55 -0.09 0.00 -0.84 0.00 0.00 61.79 60.28 3dkw h SER 135 Cb 1.51 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.77 3dkw h SER 135 CO 0.12 1.35 -0.44 0.00 -1.14 0.00 0.00 176.83 176.72 3dkw h THR 136 N 0.58 1.09 -0.17 -2.27 1.03 -1.37 -2.51 112.91 109.29 3dkw h THR 136 Ca -0.02 -1.62 0.00 0.00 -0.01 0.00 0.00 66.41 64.76 3dkw h THR 136 Cb 1.29 1.93 0.00 0.00 -1.07 0.00 0.00 68.15 70.30 3dkw h THR 136 CO 0.14 0.43 0.00 0.54 -0.01 0.00 0.00 175.52 176.62 3dkw n ARG 137 N -3.70 1.53 -0.10 0.00 1.74 -1.11 -3.40 116.66 111.62 3dkw n ARG 137 Ca -0.01 -0.80 -0.15 0.00 -0.77 0.00 0.00 57.85 56.12 3dkw n ARG 137 Cb 0.51 -1.29 -0.14 0.00 -1.02 0.00 0.00 32.46 30.53 3dkw n ARG 137 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3dkw n LEU 138 N 0.07 1.66 0.00 0.55 4.77 -0.95 -3.26 117.00 119.85 3dkw n LEU 138 Ca 0.12 -0.01 0.15 0.00 -0.03 0.00 0.00 56.01 56.24 3dkw n LEU 138 Cb 0.23 -0.31 0.84 0.00 -2.33 0.00 0.00 43.42 41.84 3dkw n LEU 138 CO 0.09 0.72 1.03 1.41 -1.33 0.00 0.00 177.39 179.32 3dkw n HIS 139 N -3.07 0.00 -0.04 -1.77 8.25 -1.20 -1.46 115.22 115.93 3dkw n HIS 139 Ca -0.37 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.07 3dkw n HIS 139 Cb 1.06 -0.08 -0.08 0.00 1.12 0.00 0.00 29.99 32.01 3dkw n HIS 139 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3dkw n GLN 140 N -1.08 1.63 -0.08 -0.41 6.02 -1.23 -4.16 117.38 118.08 3dkw n GLN 140 Ca 0.20 -0.04 -0.22 0.00 -0.01 0.00 0.00 57.00 56.93 3dkw n GLN 140 Cb 0.14 -1.27 -0.12 0.00 1.02 0.00 0.00 30.24 30.01 3dkw n GLN 140 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3dkw n ARG 141 N -2.21 0.62 -0.04 -1.09 1.74 -1.19 -3.45 116.66 111.04 3dkw n ARG 141 Ca -0.12 0.49 -0.02 0.00 -0.77 0.00 0.00 57.85 57.44 3dkw n ARG 141 Cb 0.65 -1.74 0.24 0.00 -1.02 0.00 0.00 32.46 30.59 3dkw n ARG 141 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3dkw h ILE 142 N -0.72 1.22 -0.16 0.55 2.04 -1.53 -1.69 117.51 117.21 3dkw h ILE 142 Ca -0.37 -0.90 -0.08 0.00 1.00 0.00 0.00 64.86 64.51 3dkw h ILE 142 Cb 1.50 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 3dkw h ILE 142 CO -0.14 0.31 -0.25 -0.78 0.00 0.00 0.00 178.15 177.29 3dkw h ASP 143 N 0.58 0.28 0.70 1.72 3.58 -1.73 -1.76 116.42 119.79 3dkw h ASP 143 Ca 0.12 -0.09 -0.16 0.00 0.42 0.00 0.00 57.03 57.32 3dkw h ASP 143 Cb 0.40 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.35 3dkw h ASP 143 CO 0.02 0.54 -0.75 -0.33 -2.88 0.00 0.00 179.24 175.84 3dkw h GLU 144 N 0.26 0.03 -0.18 0.28 5.08 -1.44 -3.00 114.58 115.61 3dkw h GLU 144 Ca 0.04 -0.03 -0.21 0.00 -1.00 0.00 0.00 59.36 58.16 3dkw h GLU 144 Cb 0.58 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.85 3dkw h GLU 144 CO 0.04 0.76 -0.71 0.82 -1.00 0.00 0.00 179.01 178.93 3dkw h ILE 145 N 0.02 1.28 0.00 3.13 1.08 -0.89 -2.95 117.51 119.18 3dkw h ILE 145 Ca -0.01 -1.92 0.00 0.00 -0.39 0.00 0.00 64.86 62.54 3dkw h ILE 145 Cb 1.32 1.89 0.00 0.00 -3.07 0.00 0.00 36.82 36.96 3dkw h ILE 145 CO 0.10 0.61 0.00 -0.33 -0.69 0.00 0.00 178.15 177.84 3dkw h GLU 146 N 0.55 0.00 0.12 2.37 5.08 -1.35 -0.43 114.58 120.93 3dkw h GLU 146 Ca -0.03 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.99 3dkw h GLU 146 Cb 1.32 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.56 3dkw h GLU 146 CO 0.15 0.00 -1.79 1.79 -1.00 0.00 0.00 179.01 178.15 3dkw h THR 147 N 0.00 0.85 0.00 1.13 1.35 -1.48 -3.30 112.91 111.46 3dkw h THR 147 Ca 0.00 -2.54 -0.25 0.00 -0.55 0.00 0.00 66.41 63.08 3dkw h THR 147 Cb 0.58 2.62 -0.05 0.00 -1.73 0.00 0.00 68.15 69.57 3dkw h THR 147 CO 0.00 0.82 -1.93 0.00 -0.25 0.00 0.00 175.52 174.16 3dkw n LEU 148 N -3.44 0.41 -0.18 3.87 -0.00 -1.12 -3.04 117.00 113.50 3dkw n LEU 148 Ca -0.25 0.19 -0.10 0.00 -0.00 0.00 0.00 56.01 55.85 3dkw n LEU 148 Cb 1.05 0.25 0.01 0.00 -0.00 0.00 0.00 43.42 44.73 3dkw n LEU 148 CO 0.47 0.31 0.77 0.77 -0.00 0.00 0.00 177.39 179.71 3dkw h SER 149 N 0.00 0.96 1.00 1.45 4.64 -1.27 0.88 113.55 121.21 3dkw h SER 149 Ca -0.32 -0.33 -0.11 0.00 -0.47 0.00 0.00 61.79 60.56 3dkw h SER 149 Cb 1.85 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 63.66 3dkw h SER 149 CO 0.04 1.06 -0.52 -0.07 -0.87 0.00 0.00 176.83 176.47 3dkw h LEU 150 N 0.83 0.00 -0.34 5.97 3.38 -1.73 -2.62 115.31 120.81 3dkw h LEU 150 Ca 0.14 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 3dkw h LEU 150 Cb 0.60 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3dkw h LEU 150 CO 0.04 0.52 -0.09 0.11 0.09 0.00 0.00 178.44 179.10 3dkw h LYS 151 N 0.00 0.66 0.00 1.13 1.57 -1.37 -1.74 116.57 116.82 3dkw h LYS 151 Ca -0.01 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.47 3dkw h LYS 151 Cb 1.16 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.43 3dkw h LYS 151 CO 0.07 0.83 -0.22 -0.91 -0.57 0.00 0.00 179.45 178.65 3dkw h ASN 152 N 0.44 0.00 0.03 0.86 2.35 -0.79 0.09 115.58 118.56 3dkw h ASN 152 Ca 0.08 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.69 3dkw h ASN 152 Cb 0.60 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.96 3dkw h ASN 152 CO 0.04 0.22 -0.48 0.00 -1.65 0.00 0.00 177.43 175.56 3dkw h ALA 153 N 1.78 0.80 0.00 -0.83 0.00 -1.12 -2.00 119.26 117.89 3dkw h ALA 153 Ca -0.00 -0.47 -0.11 0.00 0.00 0.00 0.00 54.91 54.33 3dkw h ALA 153 Cb 0.46 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3dkw h ALA 153 CO 0.03 0.67 -0.50 1.79 0.00 0.00 0.00 179.25 181.23 3dkw h THR 154 N 0.41 0.90 -0.27 0.00 1.35 -0.68 -3.11 112.91 111.52 3dkw h THR 154 Ca 0.02 -2.14 -0.18 0.00 -0.55 0.00 0.00 66.41 63.56 3dkw h THR 154 Cb 0.99 2.35 -0.00 0.00 -1.73 0.00 0.00 68.15 69.76 3dkw h THR 154 CO 0.09 0.49 -0.55 0.45 -0.25 0.00 0.00 175.52 175.75 3dkw h HIS 155 N 0.00 1.01 -0.36 4.73 -0.00 -0.79 -3.22 115.15 116.52 3dkw h HIS 155 Ca -0.01 -0.36 -0.10 0.00 -0.00 0.00 0.00 60.37 59.90 3dkw h HIS 155 Cb 1.31 -0.19 -0.01 0.00 -0.00 0.00 0.00 27.41 28.52 3dkw h HIS 155 CO 0.00 1.17 -0.18 0.00 -0.00 0.00 0.00 177.93 178.91 3dkw h ARG 156 N 0.62 0.76 -0.18 2.45 3.08 -1.39 -2.35 114.38 117.37 3dkw h ARG 156 Ca 0.01 -0.34 0.04 0.00 0.07 0.00 0.00 59.98 59.77 3dkw h ARG 156 Cb 1.14 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 31.13 3dkw h ARG 156 CO 0.12 0.95 -0.08 0.28 -1.07 0.00 0.00 179.97 180.17 3dkw h VAL 157 N 0.55 0.73 0.00 2.04 2.07 -1.60 -0.35 116.25 119.69 3dkw h VAL 157 Ca 0.08 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.52 3dkw h VAL 157 Cb 0.73 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 3dkw h VAL 157 CO 0.05 0.00 -0.40 0.58 0.02 0.00 0.00 177.57 177.82 3dkw h VAL 158 N -0.06 1.03 -0.09 2.57 2.07 -1.58 -2.91 116.25 117.27 3dkw h VAL 158 Ca 0.10 -1.51 -0.13 0.00 0.82 0.00 0.00 66.70 65.98 3dkw h VAL 158 Cb 0.21 1.88 0.01 0.00 -1.52 0.00 0.00 31.29 31.87 3dkw h VAL 158 CO -0.22 0.39 -0.45 0.03 0.02 0.00 0.00 177.57 177.34 3dkw h ARG 159 N 0.00 0.47 0.00 1.57 3.08 -0.81 -3.03 114.38 115.65 3dkw h ARG 159 Ca -0.00 -0.38 0.00 0.00 0.07 0.00 0.00 59.98 59.67 3dkw h ARG 159 Cb 0.85 0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.98 3dkw h ARG 159 CO 0.05 1.01 0.00 1.88 -1.07 0.00 0.00 179.97 181.84 3dkw h TYR 160 N 0.04 0.00 0.22 3.04 0.05 -1.08 -2.88 116.97 116.35 3dkw h TYR 160 Ca -0.03 0.00 -0.33 0.00 0.05 0.00 0.00 58.73 58.42 3dkw h TYR 160 Cb 1.09 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.86 3dkw h TYR 160 CO 0.12 0.00 -1.53 -0.07 -1.05 0.00 0.00 178.16 175.63 3dkw h LEU 161 N 0.00 0.71 -0.16 3.88 3.38 -1.49 -3.29 115.31 118.34 3dkw h LEU 161 Ca 0.00 -0.84 -0.08 0.00 0.09 0.00 0.00 57.88 57.05 3dkw h LEU 161 Cb 0.53 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3dkw h LEU 161 CO 0.00 1.67 -0.38 -0.07 0.09 0.00 0.00 178.44 179.75 3dkw h LEU 162 N 0.12 0.00 -0.87 1.67 3.38 -1.48 -3.18 115.31 114.95 3dkw h LEU 162 Ca -0.26 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.59 3dkw h LEU 162 Cb 2.12 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.86 3dkw h LEU 162 CO 0.24 0.38 -0.39 0.71 0.09 0.00 0.00 178.44 179.47 3dkw h THR 163 N 0.00 1.30 -0.19 0.22 1.35 -1.61 -2.59 112.91 111.39 3dkw h THR 163 Ca -0.00 -1.51 0.00 0.00 -0.55 0.00 0.00 66.41 64.35 3dkw h THR 163 Cb 1.23 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 3dkw h THR 163 CO 0.05 0.46 0.00 0.18 -0.25 0.00 0.00 175.52 175.96 3dkw n LEU 164 N -4.04 2.01 -4.17 3.87 4.77 -1.22 -4.53 117.00 113.70 3dkw n LEU 164 Ca -0.01 -0.83 -0.43 0.00 -0.03 0.00 0.00 56.01 54.70 3dkw n LEU 164 Cb 0.48 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 3dkw n LEU 164 CO 0.43 0.42 0.91 0.00 -1.33 0.00 0.00 177.39 177.81 3dkw n ALA 165 N 0.55 4.63 -0.01 -1.18 0.00 -0.98 -4.21 120.51 119.32 3dkw n ALA 165 Ca 0.17 -4.73 0.00 0.00 0.00 0.00 0.00 53.44 48.88 3dkw n ALA 165 Cb 0.39 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.49 3dkw n ALA 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dkw n ALA 166 N 2.03 0.00 -0.08 0.00 0.00 -1.26 -4.90 120.51 116.30 3dkw n ALA 166 Ca 0.25 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.59 3dkw n ALA 166 Cb 0.36 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.66 3dkw n ALA 166 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3dkw n HIS 167 N 0.00 0.31 -2.70 0.00 8.25 -1.26 -4.62 115.22 115.19 3dkw n HIS 167 Ca 0.00 0.11 -0.07 0.00 -0.26 0.00 0.00 57.72 57.50 3dkw n HIS 167 Cb 0.00 -1.06 0.05 0.00 1.12 0.00 0.00 29.99 30.10 3dkw n HIS 167 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dkw n ALA 168 N -2.70 2.96 -1.73 -1.41 0.00 -1.26 -5.12 120.51 111.26 3dkw n ALA 168 Ca -0.28 -2.74 -0.40 0.00 0.00 0.00 0.00 53.44 50.02 3dkw n ALA 168 Cb 1.12 -0.93 0.03 0.00 0.00 0.00 0.00 19.45 19.67 3dkw n ALA 168 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3dkw n PRO 169 N -0.29 1.86 -0.08 0.00 -0.02 -1.26 -4.37 135.00 130.84 3dkw n PRO 169 Ca 0.06 0.67 -0.14 0.00 -2.02 0.00 0.00 63.50 62.07 3dkw n PRO 169 Cb 0.82 -2.50 -0.05 0.00 -0.02 0.00 0.00 33.50 31.75 3dkw n PRO 169 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dkw n GLY 170 N 0.76 -0.38 3.77 -1.23 0.00 -1.26 -4.85 105.19 102.00 3dkw n GLY 170 Ca 0.08 -0.18 -0.07 0.00 0.00 0.00 0.00 46.02 45.85 3dkw n GLY 170 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dkw s GLU 171 N -2.55 1.58 0.46 1.61 2.02 0.11 -4.95 118.70 116.97 3dkw s GLU 171 Ca -0.26 -0.83 0.30 0.00 0.02 0.00 0.00 54.97 54.20 3dkw s GLU 171 Cb 0.07 0.56 1.17 0.00 0.10 0.00 0.00 34.13 36.04 3dkw s GLU 171 CO 0.35 -0.72 1.88 -0.91 0.02 0.00 0.00 175.26 175.88 3dkw h ASN 172 N 2.00 0.00 0.00 -0.19 2.35 -1.99 -3.13 115.58 114.61 3dkw h ASN 172 Ca -0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.53 3dkw h ASN 172 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 3dkw h ASN 172 CO 0.26 0.00 -0.47 0.00 -1.65 0.00 0.00 177.43 175.57 3dkw s ARG 174 N -1.60 0.80 0.03 0.00 0.52 -1.18 -2.93 118.95 114.59 3dkw s ARG 174 Ca 0.00 -1.22 0.03 0.00 -0.52 0.00 0.00 55.73 54.03 3dkw s ARG 174 Cb 0.02 -0.31 -0.02 0.00 0.52 0.00 0.00 34.95 35.16 3dkw s ARG 174 CO 0.13 0.02 -0.09 0.08 0.02 0.00 0.00 175.30 175.46 3dkw s VAL 175 N -3.01 0.69 -0.11 3.52 1.01 -1.25 0.04 120.40 121.30 3dkw s VAL 175 Ca 0.07 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.21 3dkw s VAL 175 Cb 0.01 -0.67 -0.01 0.00 0.00 0.00 0.00 36.38 35.71 3dkw s VAL 175 CO -0.03 -0.11 -0.07 -0.33 0.00 0.00 0.00 175.10 174.56 3dkw h GLU 176 N 5.08 0.00 -3.25 2.72 5.08 -1.88 -3.43 114.58 118.90 3dkw h GLU 176 Ca -0.34 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.56 3dkw h GLU 176 Cb 1.19 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.44 3dkw h GLU 176 CO 0.44 0.00 0.46 1.51 -1.00 0.00 0.00 179.01 180.42 3dkw n ILE 177 N -4.54 0.00 -2.73 3.13 3.06 -1.26 -4.83 119.36 112.19 3dkw n ILE 177 Ca -0.03 0.00 -0.41 0.00 -2.50 0.00 0.00 62.75 59.81 3dkw n ILE 177 Cb 0.11 -0.27 -0.05 0.00 0.54 0.00 0.00 39.64 39.97 3dkw n ILE 177 CO 0.00 0.00 0.00 -2.84 -2.50 0.00 0.00 176.55 171.21 3dkw s PRO 178 N 2.02 4.76 -0.53 9.51 0.02 -1.26 -4.64 135.00 144.88 3dkw s PRO 178 Ca 0.59 1.48 0.04 0.00 0.02 0.00 0.00 61.00 63.13 3dkw s PRO 178 Cb -0.81 -3.33 0.14 0.00 0.02 0.00 0.00 34.50 30.51 3dkw s PRO 178 CO 0.42 0.33 0.28 0.08 -0.33 0.00 0.00 177.00 177.78 3dkw s VAL 179 N -0.48 2.47 0.85 3.83 1.01 -1.24 -4.98 120.40 121.87 3dkw s VAL 179 Ca 0.45 -3.34 -0.11 0.00 0.00 0.00 0.00 61.98 58.98 3dkw s VAL 179 Cb -0.25 -2.71 0.11 0.00 0.00 0.00 0.00 36.38 33.53 3dkw s VAL 179 CO 0.31 -0.84 1.10 0.00 0.00 0.00 0.00 175.10 175.67 3dkw s ALA 180 N -0.35 1.77 -0.73 5.51 0.00 -1.26 -4.71 121.76 121.99 3dkw s ALA 180 Ca 0.18 0.22 0.24 0.00 0.00 0.00 0.00 51.96 52.61 3dkw s ALA 180 Cb -0.23 -3.29 0.91 0.00 0.00 0.00 0.00 23.12 20.52 3dkw s ALA 180 CO -0.02 -2.23 1.75 1.63 0.00 0.00 0.00 175.76 176.89 3dkw n LYS 181 N -3.83 0.17 0.00 0.00 5.02 -1.26 -3.57 118.16 114.68 3dkw n LYS 181 Ca 0.09 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.62 3dkw n LYS 181 Cb 0.53 -1.74 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 3dkw n LYS 181 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dkw n GLN 182 N -2.03 2.07 -0.18 1.97 10.64 -1.26 -3.91 117.38 124.67 3dkw n GLN 182 Ca 0.05 0.00 -0.09 0.00 -1.83 0.00 0.00 57.00 55.13 3dkw n GLN 182 Cb 0.32 -0.81 0.01 0.00 -0.86 0.00 0.00 30.24 28.90 3dkw n GLN 182 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 3dkw h LEU 183 N 0.00 0.80 0.00 2.61 3.38 -1.96 -1.06 115.31 119.07 3dkw h LEU 183 Ca 0.00 -0.24 -0.15 0.00 0.09 0.00 0.00 57.88 57.58 3dkw h LEU 183 Cb 0.63 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 3dkw h LEU 183 CO 0.00 0.83 -1.74 0.52 0.09 0.00 0.00 178.44 178.15 3dkw n VAL 184 N -4.43 0.87 0.32 1.22 0.31 -1.23 -4.03 118.33 111.37 3dkw n VAL 184 Ca 0.02 -0.66 0.15 0.00 -0.01 0.00 0.00 64.34 63.83 3dkw n VAL 184 Cb 0.24 -0.45 0.64 0.00 -0.91 0.00 0.00 33.84 33.35 3dkw n VAL 184 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3dkw h ALA 185 N 1.54 1.00 -0.17 3.52 0.00 -1.59 -1.40 119.26 122.15 3dkw h ALA 185 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3dkw h ALA 185 Cb 1.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.31 3dkw h ALA 185 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 3dkw n GLY 186 N -0.24 1.00 0.01 0.00 0.00 -0.44 -4.08 105.19 101.45 3dkw n GLY 186 Ca 0.01 -0.63 0.04 0.00 0.00 0.00 0.00 46.02 45.43 3dkw n GLY 186 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3dkw n HIS 187 N 1.08 0.00 0.95 1.61 -0.00 -0.56 -4.49 115.22 113.81 3dkw n HIS 187 Ca 0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 57.72 57.89 3dkw n HIS 187 Cb 0.53 -0.31 0.01 0.00 -0.00 0.00 0.00 29.99 30.22 3dkw n HIS 187 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.34 177.81 3dkw n LEU 188 N -1.99 2.35 -3.71 0.27 -0.00 -1.00 -4.86 117.00 108.06 3dkw n LEU 188 Ca -0.05 -1.18 -0.07 0.00 -0.00 0.00 0.00 56.01 54.71 3dkw n LEU 188 Cb 0.40 -0.51 0.00 0.00 -0.00 0.00 0.00 43.42 43.31 3dkw n LEU 188 CO 0.24 0.42 -0.03 -1.54 -0.00 0.00 0.00 177.39 176.47 3dkw n SER 189 N 0.30 -0.59 0.00 1.45 3.41 -1.26 -4.74 113.62 112.18 3dkw n SER 189 Ca 0.01 -0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 3dkw n SER 189 Cb 0.43 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 3dkw n SER 189 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3dkw n ILE 190 N -1.60 0.00 -3.72 -1.33 5.41 -1.26 -5.13 119.36 111.72 3dkw n ILE 190 Ca -0.02 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.61 3dkw n ILE 190 Cb 0.09 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 38.92 3dkw n ILE 190 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 3dkw s GLN 191 N 2.68 0.46 0.44 0.38 -0.21 -1.26 -5.04 119.66 117.10 3dkw s GLN 191 Ca 0.00 0.65 0.12 0.00 0.02 0.00 0.00 55.36 56.15 3dkw s GLN 191 Cb 0.00 0.16 0.99 0.00 1.00 0.00 0.00 33.01 35.16 3dkw s GLN 191 CO 0.00 -0.09 2.03 -1.35 -2.12 0.00 0.00 175.29 173.76 3dkw h PRO 192 N 6.01 0.41 -0.06 2.91 0.11 -1.92 -1.40 132.00 138.04 3dkw h PRO 192 Ca -0.30 -0.02 -0.17 0.00 0.11 0.00 0.00 66.00 65.61 3dkw h PRO 192 Cb 1.18 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 3dkw h PRO 192 CO 0.26 0.27 -0.71 0.93 -0.21 0.00 0.00 178.00 178.54 3dkw h GLU 193 N 0.42 0.32 -0.05 1.05 5.08 -1.96 -3.20 114.58 116.24 3dkw h GLU 193 Ca 0.20 -0.26 -0.23 0.00 -1.00 0.00 0.00 59.36 58.07 3dkw h GLU 193 Cb 0.26 0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.57 3dkw h GLU 193 CO -0.05 0.90 -0.89 1.79 -1.00 0.00 0.00 179.01 179.76 3dkw h THR 194 N 0.22 1.33 -0.71 1.13 1.35 -1.75 -3.17 112.91 111.31 3dkw h THR 194 Ca -0.02 -2.22 0.04 0.00 -0.55 0.00 0.00 66.41 63.65 3dkw h THR 194 Cb 1.27 2.25 -0.04 0.00 -1.73 0.00 0.00 68.15 69.90 3dkw h THR 194 CO 0.12 0.68 0.47 0.15 -0.25 0.00 0.00 175.52 176.69 3dkw h PHE 195 N 0.36 0.81 0.00 4.73 3.57 -1.32 0.39 116.94 125.48 3dkw h PHE 195 Ca -0.08 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.36 3dkw h PHE 195 Cb 1.52 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 39.98 3dkw h PHE 195 CO 0.07 0.46 -0.42 0.66 -2.23 0.00 0.00 178.31 176.86 3dkw h SER 196 N 0.83 0.00 0.62 0.41 4.64 -1.56 -2.44 113.55 116.05 3dkw h SER 196 Ca 0.29 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.33 3dkw h SER 196 Cb 0.11 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 3dkw h SER 196 CO -0.09 0.42 -1.31 0.03 -0.87 0.00 0.00 176.83 175.01 3dkw h ARG 197 N 0.00 0.23 -0.33 4.77 3.08 -1.12 -2.93 114.38 118.09 3dkw h ARG 197 Ca -0.00 -0.40 -0.12 0.00 0.07 0.00 0.00 59.98 59.52 3dkw h ARG 197 Cb 0.93 0.15 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 3dkw h ARG 197 CO 0.05 1.16 -0.26 0.82 -1.07 0.00 0.00 179.97 180.67 3dkw h ILE 198 N 0.06 1.29 0.00 2.04 2.04 -0.92 -2.74 117.51 119.29 3dkw h ILE 198 Ca -0.15 -1.42 0.00 0.00 1.00 0.00 0.00 64.86 64.29 3dkw h ILE 198 Cb 1.97 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 39.51 3dkw h ILE 198 CO 0.18 0.46 0.00 0.23 0.00 0.00 0.00 178.15 179.03 3dkw n MET 199 N -4.24 0.21 0.02 2.37 2.81 -0.93 -2.70 117.12 114.65 3dkw n MET 199 Ca -0.03 0.35 -0.18 0.00 -1.81 0.00 0.00 57.70 56.03 3dkw n MET 199 Cb 0.46 -1.84 -0.12 0.00 -0.71 0.00 0.00 33.22 31.01 3dkw n MET 199 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 3dkw h HIS 200 N 0.00 0.53 -0.15 2.03 6.17 -1.29 -2.72 115.15 119.72 3dkw h HIS 200 Ca 0.00 -0.32 -0.17 0.00 0.71 0.00 0.00 60.37 60.59 3dkw h HIS 200 Cb 0.49 -0.05 0.01 0.00 2.52 0.00 0.00 27.41 30.38 3dkw h HIS 200 CO 0.00 1.18 -0.56 0.00 0.71 0.00 0.00 177.93 179.27 3dkw h ARG 201 N -0.27 0.65 0.00 5.26 3.08 -1.50 -2.84 114.38 118.76 3dkw h ARG 201 Ca -0.09 -0.49 -0.04 0.00 0.07 0.00 0.00 59.98 59.42 3dkw h ARG 201 Cb 1.39 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.53 3dkw h ARG 201 CO 0.12 1.11 -0.20 -0.07 -1.07 0.00 0.00 179.97 179.86 3dkw h LEU 202 N 0.32 0.00 -0.07 3.04 3.38 -1.65 -2.76 115.31 117.58 3dkw h LEU 202 Ca -0.03 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.74 3dkw h LEU 202 Cb 1.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 3dkw h LEU 202 CO 0.12 0.20 -0.98 1.23 0.09 0.00 0.00 178.44 179.09 3dkw h GLY 203 N 1.46 0.04 2.00 0.83 0.00 -1.37 -2.77 103.07 103.26 3dkw h GLY 203 Ca -0.00 -0.10 -0.16 0.00 0.00 0.00 0.00 47.33 47.07 3dkw h GLY 203 CO 0.03 0.09 -0.76 -0.55 0.00 0.00 0.00 176.54 175.34 3dkw h ASP 204 N 0.01 0.00 -0.35 0.19 3.32 -1.25 -3.25 116.42 115.09 3dkw h ASP 204 Ca -0.02 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.92 3dkw h ASP 204 Cb 1.72 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 41.25 3dkw h ASP 204 CO 0.13 0.76 -0.14 -0.33 -1.72 0.00 0.00 179.24 177.94 3dkw h GLU 205 N 0.00 0.81 0.00 3.56 5.08 -1.55 -3.47 114.58 119.00 3dkw h GLU 205 Ca -0.01 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 3dkw h GLU 205 Cb 1.44 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.63 3dkw h GLU 205 CO 0.10 0.90 0.00 0.41 -1.00 0.00 0.00 179.01 179.42 3dkw n GLY 206 N -0.37 1.96 0.40 -3.84 0.00 -1.23 -5.03 105.19 97.09 3dkw n GLY 206 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 3dkw n GLY 206 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dkw n ILE 207 N -0.59 0.56 -4.48 -0.61 5.41 -1.19 -4.80 119.36 113.67 3dkw n ILE 207 Ca 0.00 -0.17 -0.33 0.00 1.00 0.00 0.00 62.75 63.25 3dkw n ILE 207 Cb 0.00 -1.29 -0.16 0.00 -0.71 0.00 0.00 39.64 37.48 3dkw n ILE 207 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 3dkw s ILE 208 N -2.19 2.18 0.12 1.39 1.01 -1.05 -2.80 121.20 119.85 3dkw s ILE 208 Ca -0.14 -0.93 0.06 0.00 0.00 0.00 0.00 60.65 59.64 3dkw s ILE 208 Cb 0.05 -1.89 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 3dkw s ILE 208 CO 0.20 0.54 -0.01 -1.00 0.00 0.00 0.00 174.94 174.67 3dkw s HIS 209 N 0.96 2.91 -0.24 3.97 3.76 -1.24 -2.98 115.29 122.44 3dkw s HIS 209 Ca -0.03 -0.08 -0.21 0.00 -0.15 0.00 0.00 55.06 54.59 3dkw s HIS 209 Cb -0.15 -1.48 -0.02 0.00 1.11 0.00 0.00 32.58 32.05 3dkw s HIS 209 CO -0.05 0.48 0.65 -0.51 -0.85 0.00 0.00 174.74 174.46 3dkw s LEU 210 N -2.48 4.08 0.00 0.89 1.43 -1.26 -4.08 118.68 117.26 3dkw s LEU 210 Ca 0.26 0.78 0.01 0.00 -1.03 0.00 0.00 54.13 54.14 3dkw s LEU 210 Cb -0.11 -2.90 -0.00 0.00 0.03 0.00 0.00 46.19 43.21 3dkw s LEU 210 CO 0.18 -0.36 0.02 0.47 0.23 0.00 0.00 176.35 176.89 3dkw n ASP 211 N 5.58 2.86 -4.57 2.29 8.00 -1.13 -5.02 116.55 124.57 3dkw n ASP 211 Ca -0.00 -2.91 -0.28 0.00 0.71 0.00 0.00 54.79 52.30 3dkw n ASP 211 Cb 0.49 0.41 -0.05 0.00 -0.02 0.00 0.00 41.12 41.95 3dkw n ASP 211 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3dkw s GLY 212 N -3.37 0.26 -1.79 0.44 0.00 -1.26 -3.63 107.32 97.97 3dkw s GLY 212 Ca 0.03 -1.83 0.00 0.00 0.00 0.00 0.00 44.72 42.92 3dkw s GLY 212 CO 0.02 3.46 0.00 0.54 0.00 0.00 0.00 173.10 177.12 3dkw n ARG 213 N 8.62 -1.42 -3.97 2.90 1.74 -1.26 -4.98 116.66 118.30 3dkw n ARG 213 Ca 0.42 1.03 -0.09 0.00 -0.77 0.00 0.00 57.85 58.44 3dkw n ARG 213 Cb 0.47 -5.47 -0.10 0.00 -1.02 0.00 0.00 32.46 26.34 3dkw n ARG 213 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3dkw s GLU 214 N -4.33 0.45 -0.18 5.56 2.02 -1.24 -3.62 118.70 117.36 3dkw s GLU 214 Ca 0.00 -0.70 -0.00 0.00 0.02 0.00 0.00 54.97 54.28 3dkw s GLU 214 Cb 0.00 0.17 0.00 0.00 0.10 0.00 0.00 34.13 34.40 3dkw s GLU 214 CO 0.00 -0.09 -0.14 0.42 0.02 0.00 0.00 175.26 175.46 3dkw s ILE 215 N -2.10 2.61 -0.48 -1.63 1.01 -1.26 -2.82 121.20 116.53 3dkw s ILE 215 Ca -0.10 -0.77 -0.17 0.00 0.00 0.00 0.00 60.65 59.61 3dkw s ILE 215 Cb -0.05 -2.13 0.06 0.00 0.01 0.00 0.00 42.46 40.36 3dkw s ILE 215 CO -0.03 0.50 0.51 -0.94 0.00 0.00 0.00 174.94 174.98 3dkw s SER 216 N 1.15 6.19 -0.36 3.58 1.04 -1.26 -3.85 113.70 120.20 3dkw s SER 216 Ca 0.01 -1.07 -0.21 0.00 0.48 0.00 0.00 55.95 55.15 3dkw s SER 216 Cb -0.14 -2.24 0.01 0.00 0.10 0.00 0.00 66.02 63.75 3dkw s SER 216 CO -0.06 -0.76 0.69 -0.63 0.98 0.00 0.00 173.24 173.47 3dkw s ILE 217 N 2.15 4.83 -0.15 -1.02 1.01 -1.15 -3.66 121.20 123.20 3dkw s ILE 217 Ca 0.10 0.68 -0.15 0.00 0.00 0.00 0.00 60.65 61.29 3dkw s ILE 217 Cb -0.21 -4.13 -0.11 0.00 0.01 0.00 0.00 42.46 38.01 3dkw s ILE 217 CO 0.10 -0.37 0.13 -0.07 0.00 0.00 0.00 174.94 174.73 3dkw h LEU 218 N 9.53 0.00-10.20 2.97 3.38 -1.63 -3.31 115.31 116.06 3dkw h LEU 218 Ca -0.26 -0.32 -0.50 0.00 0.09 0.00 0.00 57.88 56.90 3dkw h LEU 218 Cb 1.10 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.86 3dkw h LEU 218 CO 0.87 0.98 -0.09 -1.81 0.09 0.00 0.00 178.44 178.47 3dkw s ASP 219 N -6.13 6.35 0.00 -0.43 1.01 -1.26 -4.79 116.67 111.42 3dkw s ASP 219 Ca -0.17 0.68 0.00 0.00 0.71 0.00 0.00 52.55 53.77 3dkw s ASP 219 Cb 0.02 -2.13 0.00 0.00 1.01 0.00 0.00 42.92 41.82 3dkw s ASP 219 CO 0.37 -0.32 0.20 0.54 0.21 0.00 0.00 175.17 176.17 3dkw n ARG 220 N -1.54 0.35 -0.11 8.23 1.74 -1.26 -4.68 116.66 119.38 3dkw n ARG 220 Ca -0.02 -0.20 -0.24 0.00 -0.77 0.00 0.00 57.85 56.62 3dkw n ARG 220 Cb 0.55 -0.65 -0.11 0.00 -1.02 0.00 0.00 32.46 31.23 3dkw n ARG 220 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3dkw n GLU 221 N -0.11 0.57 -0.25 5.56 1.02 -1.26 -3.72 120.64 122.45 3dkw n GLU 221 Ca 0.00 0.50 -0.07 0.00 -0.02 0.00 0.00 57.16 57.57 3dkw n GLU 221 Cb 0.10 -1.68 0.04 0.00 -0.02 0.00 0.00 31.44 29.88 3dkw n GLU 221 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dkw h ARG 222 N -1.00 1.08 -0.83 3.49 3.08 -1.97 0.14 114.38 118.36 3dkw h ARG 222 Ca -0.44 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 59.37 3dkw h ARG 222 Cb 1.39 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 31.24 3dkw h ARG 222 CO -0.27 0.93 0.50 -0.07 -1.07 0.00 0.00 179.97 179.99 3dkw h LEU 223 N 1.01 1.01 -0.14 3.04 3.38 -1.83 0.68 115.31 122.46 3dkw h LEU 223 Ca 0.22 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 3dkw h LEU 223 Cb 0.31 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3dkw h LEU 223 CO -0.01 0.78 -0.47 -0.08 0.09 0.00 0.00 178.44 178.76 3dkw h GLU 224 N 1.14 0.00 0.16 1.13 4.81 -1.58 -2.93 114.58 117.31 3dkw h GLU 224 Ca 0.30 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 59.22 3dkw h GLU 224 Cb -0.03 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.36 3dkw h GLU 224 CO -0.05 0.47 -1.43 0.00 -0.73 0.00 0.00 179.01 177.26 3dkw n PHE 226 N -3.56 3.01 1.72 0.00 3.72 0.23 -5.06 117.46 117.52 3dkw n PHE 226 Ca -0.14 -2.57 0.14 0.00 -0.05 0.00 0.00 57.45 54.82 3dkw n PHE 226 Cb 1.05 -1.16 0.81 0.00 -0.94 0.00 0.00 39.48 39.24 3dkw n PHE 226 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80