#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 0.60 -0.04 0.03 5.08 -2.01 -3.23 114.58 115.01 3dkw h GLU 2 Ca 0.00 -0.67 -0.24 0.00 -1.00 0.00 0.00 59.36 57.45 3dkw h GLU 2 Cb 0.00 0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.46 3dkw h GLU 2 CO 0.00 1.27 -0.93 0.74 -1.00 0.00 0.00 179.01 179.09 3dkw h PHE 3 N 0.33 0.88 -0.04 4.33 0.04 -2.02 -3.29 116.94 117.17 3dkw h PHE 3 Ca -0.12 -0.45 -0.04 0.00 2.80 0.00 0.00 57.97 60.16 3dkw h PHE 3 Cb 1.69 -0.11 -0.01 0.00 2.20 0.00 0.00 35.95 39.72 3dkw h PHE 3 CO 0.09 1.28 -0.17 1.96 -0.60 0.00 0.00 178.31 180.87 3dkw h GLN 4 N 0.37 0.07 0.00 1.51 4.20 -1.92 -1.83 115.11 117.51 3dkw h GLN 4 Ca -0.09 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.50 3dkw h GLN 4 Cb 1.57 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 29.32 3dkw h GLN 4 CO 0.18 0.23 -0.52 0.00 -0.67 0.00 0.00 178.83 178.05 3dkw h ARG 5 N 0.06 0.00 0.03 1.46 3.08 -1.63 -3.30 114.38 114.08 3dkw h ARG 5 Ca 0.01 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 3dkw h ARG 5 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.38 3dkw h ARG 5 CO 0.02 0.52 -0.02 0.28 -1.07 0.00 0.00 179.97 179.70 3dkw h VAL 6 N 0.00 1.39 -0.91 2.04 2.07 -1.41 -3.37 116.25 116.05 3dkw h VAL 6 Ca -0.01 -1.53 -0.71 0.00 0.82 0.00 0.00 66.70 65.28 3dkw h VAL 6 Cb 1.17 2.38 -0.10 0.00 -1.52 0.00 0.00 31.29 33.23 3dkw h VAL 6 CO 0.07 0.38 2.30 1.41 0.02 0.00 0.00 177.57 181.75 3dkw n HIS 7 N -4.79 4.17 0.00 1.57 8.25 -0.99 -4.36 115.22 119.08 3dkw n HIS 7 Ca -0.09 -2.97 0.00 0.00 -0.26 0.00 0.00 57.72 54.41 3dkw n HIS 7 Cb 0.32 -2.45 0.00 0.00 1.12 0.00 0.00 29.99 28.99 3dkw n HIS 7 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3dkw n GLN 8 N 6.66 2.15 -0.10 -0.41 6.02 -1.26 -4.68 117.38 125.76 3dkw n GLN 8 Ca 0.47 0.00 -0.07 0.00 -0.01 0.00 0.00 57.00 57.39 3dkw n GLN 8 Cb 0.42 -0.81 0.10 0.00 1.02 0.00 0.00 30.24 30.98 3dkw n GLN 8 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 177.06 178.01 3dkw h GLN 9 N 0.00 0.80 -0.32 -1.09 4.20 -1.92 -1.87 115.11 114.91 3dkw h GLN 9 Ca 0.00 -0.29 -0.06 0.00 0.06 0.00 0.00 58.65 58.36 3dkw h GLN 9 Cb 0.00 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.71 3dkw h GLN 9 CO 0.00 0.90 -0.06 -0.07 -0.67 0.00 0.00 178.83 178.94 3dkw h LEU 10 N 0.72 0.49 -0.63 1.46 3.38 -1.93 -2.28 115.31 116.53 3dkw h LEU 10 Ca 0.11 -0.11 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 3dkw h LEU 10 Cb 0.65 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 3dkw h LEU 10 CO 0.05 0.60 -0.67 -0.07 0.09 0.00 0.00 178.44 178.44 3dkw h LEU 11 N 0.49 0.11 -1.29 1.67 -0.00 -1.76 -3.00 115.31 111.54 3dkw h LEU 11 Ca 0.10 -0.07 -0.07 0.00 -0.00 0.00 0.00 57.88 57.84 3dkw h LEU 11 Cb 0.41 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.02 3dkw h LEU 11 CO 0.02 0.75 -0.32 1.56 -0.00 0.00 0.00 178.44 180.45 3dkw h GLN 12 N 0.07 0.00 0.00 1.13 4.20 -0.79 -2.26 115.11 117.46 3dkw h GLN 12 Ca -0.01 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 3dkw h GLN 12 Cb 1.19 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 3dkw h GLN 12 CO 0.09 0.32 -0.18 0.66 -0.67 0.00 0.00 178.83 179.05 3dkw h SER 13 N 0.00 0.00 -4.16 1.46 4.64 -1.32 -3.36 113.55 110.81 3dkw h SER 13 Ca -0.00 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.82 3dkw h SER 13 Cb 0.67 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.83 3dkw h SER 13 CO 0.04 0.18 0.38 -2.28 -0.87 0.00 0.00 176.83 174.29 3dkw s HIS 14 N -3.52 2.89 0.00 4.77 5.04 -0.85 -4.96 115.29 118.67 3dkw s HIS 14 Ca 0.02 1.53 0.21 0.00 -1.54 0.00 0.00 55.06 55.28 3dkw s HIS 14 Cb 0.09 -3.07 0.59 0.00 0.04 0.00 0.00 32.58 30.22 3dkw s HIS 14 CO 0.63 -1.21 1.68 1.12 -2.34 0.00 0.00 174.74 174.62 3dkw h HIS 15 N 0.64 0.00 0.00 3.88 2.07 -1.86 -2.68 115.15 117.20 3dkw h HIS 15 Ca -0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.04 3dkw h HIS 15 Cb 1.23 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.21 3dkw h HIS 15 CO 0.57 0.31 -0.46 1.28 -3.07 0.00 0.00 177.93 176.56 3dkw n LEU 16 N -3.33 0.74 0.00 6.12 4.77 -1.26 -3.96 117.00 120.09 3dkw n LEU 16 Ca 0.01 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 3dkw n LEU 16 Cb 0.54 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 3dkw n LEU 16 CO 0.36 -0.09 0.44 0.49 -1.33 0.00 0.00 177.39 177.25 3dkw n PHE 17 N -2.17 0.00 -0.00 -1.77 3.01 -1.20 -4.75 117.46 110.57 3dkw n PHE 17 Ca 0.04 -0.38 -0.17 0.00 1.01 0.00 0.00 57.45 57.94 3dkw n PHE 17 Cb 0.44 -0.04 -0.14 0.00 -0.01 0.00 0.00 39.48 39.73 3dkw n PHE 17 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 3dkw h GLU 18 N 0.00 0.17 0.00 -1.08 4.81 -1.60 -3.32 114.58 113.57 3dkw h GLU 18 Ca 0.00 -0.29 -0.04 0.00 -0.13 0.00 0.00 59.36 58.90 3dkw h GLU 18 Cb 0.51 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 3dkw h GLU 18 CO 0.00 1.13 -0.20 -1.35 -0.73 0.00 0.00 179.01 177.86 3dkw h PRO 19 N -0.63 0.00 -7.04 0.92 0.11 -1.85 -3.44 132.00 120.07 3dkw h PRO 19 Ca -0.08 0.00 -0.51 0.00 0.11 0.00 0.00 66.00 65.52 3dkw h PRO 19 Cb 1.34 0.00 0.07 0.00 0.11 0.00 0.00 31.00 32.53 3dkw h PRO 19 CO 0.09 0.20 0.48 -0.51 -0.21 0.00 0.00 178.00 178.04 3dkw s LEU 20 N -7.81 3.90 0.47 2.35 1.43 -1.25 -5.02 118.68 112.76 3dkw s LEU 20 Ca -0.03 2.31 -0.19 0.00 -1.03 0.00 0.00 54.13 55.18 3dkw s LEU 20 Cb 0.14 -4.37 -0.10 0.00 0.03 0.00 0.00 46.19 41.89 3dkw s LEU 20 CO 0.65 -1.10 0.97 -0.94 0.23 0.00 0.00 176.35 176.16 3dkw s SER 21 N -1.47 6.76 0.54 2.29 1.04 -1.26 -4.88 113.70 116.72 3dkw s SER 21 Ca 0.68 1.67 0.29 0.00 0.48 0.00 0.00 55.95 59.07 3dkw s SER 21 Cb -0.28 -2.53 1.46 0.00 0.10 0.00 0.00 66.02 64.76 3dkw s SER 21 CO 0.33 -0.49 1.93 -0.65 0.98 0.00 0.00 173.24 175.34 3dkw h PRO 22 N 1.51 0.00 -0.30 4.02 0.11 -1.95 0.99 132.00 136.37 3dkw h PRO 22 Ca -0.48 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.46 3dkw h PRO 22 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 3dkw h PRO 22 CO 0.61 0.00 -0.48 0.28 -0.21 0.00 0.00 178.00 178.20 3dkw h VAL 23 N 0.00 1.28 -0.08 3.15 2.07 -1.99 -2.37 116.25 118.31 3dkw h VAL 23 Ca 0.33 -1.67 -0.18 0.00 0.82 0.00 0.00 66.70 65.99 3dkw h VAL 23 Cb 1.37 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 32.71 3dkw h VAL 23 CO -0.00 0.54 -0.72 1.56 0.02 0.00 0.00 177.57 178.97 3dkw h GLN 24 N 0.63 0.41 -0.03 1.57 4.20 -1.22 -2.78 115.11 117.89 3dkw h GLN 24 Ca 0.03 -0.33 -0.10 0.00 0.06 0.00 0.00 58.65 58.30 3dkw h GLN 24 Cb 1.06 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 3dkw h GLN 24 CO 0.11 0.97 -0.47 1.25 -0.67 0.00 0.00 178.83 180.02 3dkw h LEU 25 N 0.28 0.08 0.00 1.46 5.85 -1.23 -0.44 115.31 121.31 3dkw h LEU 25 Ca -0.03 -0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 3dkw h LEU 25 Cb 1.30 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 42.30 3dkw h LEU 25 CO 0.12 0.54 -0.13 -0.61 -0.34 0.00 0.00 178.44 178.02 3dkw h GLN 26 N 0.06 0.00 0.00 1.25 4.15 -1.39 -3.13 115.11 116.06 3dkw h GLN 26 Ca 0.00 0.00 -0.18 0.00 0.77 0.00 0.00 58.65 59.24 3dkw h GLN 26 Cb 0.85 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.51 3dkw h GLN 26 CO 0.06 0.10 -1.57 -1.91 -1.93 0.00 0.00 178.83 173.58 3dkw n GLU 27 N -3.11 0.63 0.06 1.69 2.13 -1.05 -3.84 120.64 117.15 3dkw n GLU 27 Ca 0.03 0.16 -0.10 0.00 0.66 0.00 0.00 57.16 57.92 3dkw n GLU 27 Cb 0.57 -1.75 0.02 0.00 0.27 0.00 0.00 31.44 30.55 3dkw n GLU 27 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3dkw h LEU 28 N 0.00 0.44 -0.08 4.31 5.85 -1.12 -3.07 115.31 121.64 3dkw h LEU 28 Ca -0.19 -0.31 0.00 0.00 0.84 0.00 0.00 57.88 58.22 3dkw h LEU 28 Cb 1.61 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.51 3dkw h LEU 28 CO 0.04 1.06 0.00 0.18 -0.34 0.00 0.00 178.44 179.38 3dkw n LEU 29 N -3.80 0.56 0.16 2.25 4.77 -1.18 -3.03 117.00 116.73 3dkw n LEU 29 Ca -0.04 0.56 0.02 0.00 -0.03 0.00 0.00 56.01 56.52 3dkw n LEU 29 Cb 0.74 -0.40 0.21 0.00 -2.33 0.00 0.00 43.42 41.64 3dkw n LEU 29 CO 0.48 -0.18 0.56 0.00 -1.33 0.00 0.00 177.39 176.92 3dkw h ALA 30 N 2.61 0.89 0.01 -1.18 0.00 -1.64 -3.25 119.26 116.71 3dkw h ALA 30 Ca 0.00 -0.47 -0.32 0.00 0.00 0.00 0.00 54.91 54.12 3dkw h ALA 30 Cb 0.62 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 3dkw h ALA 30 CO 0.00 0.64 -1.95 0.43 0.00 0.00 0.00 179.25 178.37 3dkw n SER 31 N -3.55 0.82 -4.80 0.00 7.64 -1.19 -4.94 113.62 107.60 3dkw n SER 31 Ca -0.00 0.27 -0.34 0.00 1.01 0.00 0.00 58.87 59.80 3dkw n SER 31 Cb 0.60 0.12 -0.04 0.00 -1.01 0.00 0.00 64.21 63.88 3dkw n SER 31 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3dkw s SER 32 N -6.05 6.39 0.07 6.43 1.04 -1.17 -5.00 113.70 115.42 3dkw s SER 32 Ca -0.09 1.90 0.09 0.00 0.48 0.00 0.00 55.95 58.33 3dkw s SER 32 Cb 0.07 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.60 3dkw s SER 32 CO 0.81 -0.75 -0.24 -1.81 0.98 0.00 0.00 173.24 172.23 3dkw s ASP 33 N -2.03 3.38 0.04 7.02 1.01 -1.25 -4.92 116.67 119.92 3dkw s ASP 33 Ca 0.67 -0.59 -0.30 0.00 0.71 0.00 0.00 52.55 53.03 3dkw s ASP 33 Cb -0.16 -0.36 -0.04 0.00 1.01 0.00 0.00 42.92 43.38 3dkw s ASP 33 CO 0.20 0.23 1.06 -0.22 0.21 0.00 0.00 175.17 176.65 3dkw s LEU 34 N -1.54 4.38 -0.16 1.23 2.96 -1.26 -2.70 118.68 121.59 3dkw s LEU 34 Ca 0.13 1.81 0.01 0.00 -0.22 0.00 0.00 54.13 55.87 3dkw s LEU 34 Cb -0.10 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 43.03 3dkw s LEU 34 CO 0.04 -0.32 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.86 3dkw s VAL 35 N 0.91 2.13 -0.26 1.68 1.01 -0.36 -4.99 120.40 120.53 3dkw s VAL 35 Ca 0.54 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.60 3dkw s VAL 35 Cb -0.24 -1.88 0.05 0.00 0.00 0.00 0.00 36.38 34.31 3dkw s VAL 35 CO 0.29 0.54 -0.10 0.21 0.00 0.00 0.00 175.10 176.04 3dkw s ASN 36 N 1.07 4.34 0.24 3.32 3.84 -1.26 -1.16 114.94 125.33 3dkw s ASN 36 Ca -0.01 -1.22 0.08 0.00 0.21 0.00 0.00 52.86 51.92 3dkw s ASN 36 Cb -0.14 -1.58 -0.04 0.00 -0.55 0.00 0.00 41.25 38.94 3dkw s ASN 36 CO -0.07 -0.17 0.11 -0.76 -2.79 0.00 0.00 177.10 173.41 3dkw s LEU 37 N 1.18 3.57 0.00 3.21 2.01 -1.07 -5.06 118.68 122.52 3dkw s LEU 37 Ca -0.05 -0.37 0.00 0.00 0.01 0.00 0.00 54.13 53.71 3dkw s LEU 37 Cb -0.19 -2.12 0.00 0.00 0.01 0.00 0.00 46.19 43.89 3dkw s LEU 37 CO -0.05 -0.00 0.00 0.47 1.01 0.00 0.00 176.35 177.78 3dkw n ASP 38 N -0.90 0.00 -4.70 2.29 8.00 -1.26 -3.01 116.55 116.97 3dkw n ASP 38 Ca -0.08 -0.74 -0.42 0.00 0.71 0.00 0.00 54.79 54.26 3dkw n ASP 38 Cb 0.58 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.65 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 -1.00 4.38 -0.30 -1.24 2.20 -1.26 -3.34 119.74 119.17 3dkw s LYS 39 Ca 0.00 1.80 -0.01 0.00 -0.36 0.00 0.00 55.97 57.39 3dkw s LYS 39 Cb 0.00 -3.43 0.00 0.00 -1.51 0.00 0.00 37.83 32.90 3dkw s LYS 39 CO 0.00 -0.36 0.17 0.41 -0.36 0.00 0.00 175.35 175.21 3dkw n GLY 40 N 3.34 0.53 3.71 5.54 0.00 -0.65 -4.99 105.19 112.67 3dkw n GLY 40 Ca 0.10 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.83 3.36 -0.13 4.61 0.00 -1.21 -4.91 121.76 120.64 3dkw s ALA 41 Ca 0.09 -0.89 -0.20 0.00 0.00 0.00 0.00 51.96 50.96 3dkw s ALA 41 Cb -0.04 -1.44 -0.03 0.00 0.00 0.00 0.00 23.12 21.60 3dkw s ALA 41 CO 0.11 0.64 0.59 0.71 0.00 0.00 0.00 175.76 177.80 3dkw s TYR 42 N -1.05 3.48 -0.08 0.00 1.51 -1.26 -2.51 117.35 117.44 3dkw s TYR 42 Ca 0.18 0.99 -0.01 0.00 -1.01 0.00 0.00 57.07 57.22 3dkw s TYR 42 Cb -0.12 -2.70 -0.01 0.00 -0.11 0.00 0.00 41.96 39.03 3dkw s TYR 42 CO 0.09 0.02 0.04 0.28 -1.11 0.00 0.00 175.55 174.87 3dkw h VAL 43 N 4.90 0.00 -3.31 0.71 2.07 -1.88 -3.48 116.25 115.27 3dkw h VAL 43 Ca -0.38 -0.81 -0.24 0.00 0.82 0.00 0.00 66.70 66.10 3dkw h VAL 43 Cb 1.17 0.00 -0.31 0.00 -1.52 0.00 0.00 31.29 30.63 3dkw h VAL 43 CO 0.76 0.00 -0.60 0.72 0.02 0.00 0.00 177.57 178.47 3dkw s PHE 44 N -1.58 -0.15 0.30 1.57 -0.71 -1.26 -5.03 117.98 111.12 3dkw s PHE 44 Ca -0.01 0.43 -0.08 0.00 -1.04 0.00 0.00 56.93 56.23 3dkw s PHE 44 Cb 0.00 -0.06 -0.06 0.00 -1.21 0.00 0.00 43.02 41.69 3dkw s PHE 44 CO 0.02 -0.14 0.62 -0.98 -1.34 0.00 0.00 175.22 173.39 3dkw s ARG 45 N 0.92 3.74 0.04 1.99 1.70 -1.26 -1.76 118.95 124.31 3dkw s ARG 45 Ca -0.07 0.24 -0.31 0.00 -0.47 0.00 0.00 55.73 55.13 3dkw s ARG 45 Cb -0.09 -2.57 -0.06 0.00 -0.57 0.00 0.00 34.95 31.66 3dkw s ARG 45 CO -0.04 0.18 1.32 -1.14 -1.08 0.00 0.00 175.30 174.54 3dkw s GLN 46 N -3.36 4.34 0.00 3.89 0.74 -1.23 -2.94 119.66 121.09 3dkw s GLN 46 Ca 0.47 1.91 0.00 0.00 0.05 0.00 0.00 55.36 57.79 3dkw s GLN 46 Cb -0.11 -3.43 0.00 0.00 1.10 0.00 0.00 33.01 30.58 3dkw s GLN 46 CO 0.27 -0.44 0.00 0.41 -0.55 0.00 0.00 175.29 174.98 3dkw n GLY 47 N 3.46 3.01 3.37 2.59 0.00 -0.78 -4.92 105.19 111.92 3dkw n GLY 47 Ca 0.11 -0.09 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 3dkw n GLY 47 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3dkw s GLU 48 N 0.00 -2.55 -0.18 1.61 2.56 -1.15 -4.33 118.70 114.66 3dkw s GLU 48 Ca 0.00 0.08 -0.29 0.00 0.00 0.00 0.00 54.97 54.76 3dkw s GLU 48 Cb 0.00 -1.43 -0.02 0.00 2.00 0.00 0.00 34.13 34.68 3dkw s GLU 48 CO 0.00 -4.61 1.42 -1.25 -0.56 0.00 0.00 175.26 170.26 3dkw s PRO 49 N -5.16 4.06 -0.19 4.30 0.04 -1.26 -2.52 135.00 134.26 3dkw s PRO 49 Ca 0.69 1.67 -0.06 0.00 0.04 0.00 0.00 61.00 63.35 3dkw s PRO 49 Cb -0.12 -3.89 -0.03 0.00 0.04 0.00 0.00 34.50 30.50 3dkw s PRO 49 CO 0.57 -0.95 0.03 0.00 0.04 0.00 0.00 177.00 176.70 3dkw s ALA 50 N 4.15 3.20 -0.34 8.56 0.00 -1.06 -4.90 121.76 131.37 3dkw s ALA 50 Ca 0.62 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.75 3dkw s ALA 50 Cb -0.23 -1.84 0.19 0.00 0.00 0.00 0.00 23.12 21.24 3dkw s ALA 50 CO 0.22 0.01 1.16 0.72 0.00 0.00 0.00 175.76 177.87 3dkw n HIS 51 N 3.91 -1.19 -3.22 0.00 8.25 -1.26 -4.76 115.22 116.95 3dkw n HIS 51 Ca -0.17 -1.17 0.03 0.00 -0.26 0.00 0.00 57.72 56.16 3dkw n HIS 51 Cb 0.52 1.33 -0.04 0.00 1.12 0.00 0.00 29.99 32.92 3dkw n HIS 51 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3dkw s ALA 52 N 0.09 -3.20 0.20 -1.41 0.00 -1.26 -2.38 121.76 113.81 3dkw s ALA 52 Ca 0.10 1.83 -0.08 0.00 0.00 0.00 0.00 51.96 53.81 3dkw s ALA 52 Cb 0.20 -2.26 -0.07 0.00 0.00 0.00 0.00 23.12 20.99 3dkw s ALA 52 CO -0.05 -0.97 0.50 -0.59 0.00 0.00 0.00 175.76 174.65 3dkw s PHE 53 N 2.11 3.44 0.17 0.00 -0.71 -0.58 -4.89 117.98 117.52 3dkw s PHE 53 Ca 0.00 0.77 0.08 0.00 -1.04 0.00 0.00 56.93 56.75 3dkw s PHE 53 Cb -0.02 -2.18 -0.04 0.00 -1.21 0.00 0.00 43.02 39.57 3dkw s PHE 53 CO -0.16 0.32 -0.07 0.71 -1.34 0.00 0.00 175.22 174.67 3dkw s TYR 54 N -1.77 2.71 -0.18 3.49 1.51 -1.24 -2.36 117.35 119.51 3dkw s TYR 54 Ca 0.45 -0.19 0.01 0.00 -1.01 0.00 0.00 57.07 56.33 3dkw s TYR 54 Cb -0.11 -1.33 0.03 0.00 -0.11 0.00 0.00 41.96 40.44 3dkw s TYR 54 CO 0.22 0.50 -0.13 -0.47 -1.11 0.00 0.00 175.55 174.57 3dkw s TYR 55 N -1.65 2.36 0.03 2.71 6.14 -1.12 -3.16 117.35 122.66 3dkw s TYR 55 Ca 0.25 -1.45 -0.20 0.00 0.64 0.00 0.00 57.07 56.31 3dkw s TYR 55 Cb -0.09 -1.66 -0.06 0.00 0.42 0.00 0.00 41.96 40.57 3dkw s TYR 55 CO 0.16 -0.72 0.59 -1.17 0.64 0.00 0.00 175.55 175.05 3dkw s LEU 56 N 1.42 4.46 -0.16 6.97 2.96 -1.16 -2.42 118.68 130.75 3dkw s LEU 56 Ca 0.02 1.21 -0.07 0.00 -0.22 0.00 0.00 54.13 55.06 3dkw s LEU 56 Cb -0.14 -2.92 -0.07 0.00 0.50 0.00 0.00 46.19 43.55 3dkw s LEU 56 CO -0.10 0.16 -0.21 -0.38 -1.32 0.00 0.00 176.35 174.51 3dkw n ILE 57 N 2.37 0.90 -3.78 6.68 -0.00 -1.19 -2.30 119.36 122.04 3dkw n ILE 57 Ca -0.08 -0.24 -0.14 0.00 -0.00 0.00 0.00 62.75 62.29 3dkw n ILE 57 Cb 0.51 -1.67 -0.15 0.00 -0.00 0.00 0.00 39.64 38.33 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 -6.39 0.03 0.00 4.38 1.04 -1.26 -4.24 113.70 107.26 3dkw s SER 58 Ca -0.23 0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.29 3dkw s SER 58 Cb 0.09 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.19 3dkw s SER 58 CO 0.29 -0.12 0.00 0.61 0.98 0.00 0.00 173.24 175.01 3dkw n GLY 59 N 4.03 0.26 2.91 7.32 0.00 -1.26 -3.13 105.19 115.31 3dkw n GLY 59 Ca -0.25 -2.28 -0.14 0.00 0.00 0.00 0.00 46.02 43.35 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 1.04 1.58 0.08 0.00 1.01 -1.13 -2.71 120.40 120.26 3dkw s VAL 61 Ca -0.08 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.20 3dkw s VAL 61 Cb -0.11 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 3dkw s VAL 61 CO -0.05 0.46 0.16 -1.59 0.00 0.00 0.00 175.10 174.08 3dkw s LYS 62 N 0.81 3.21 -0.08 2.72 -2.85 0.14 -2.61 119.74 121.09 3dkw s LYS 62 Ca -0.10 -0.56 -0.09 0.00 -1.00 0.00 0.00 55.97 54.22 3dkw s LYS 62 Cb -0.16 -2.90 -0.03 0.00 -2.06 0.00 0.00 37.83 32.68 3dkw s LYS 62 CO 0.01 0.58 -0.18 -0.89 0.10 0.00 0.00 175.35 174.97 3dkw n ILE 63 N 0.28 0.94 -0.99 3.79 5.41 -1.26 -0.76 119.36 126.77 3dkw n ILE 63 Ca -0.07 0.27 0.09 0.00 1.00 0.00 0.00 62.75 64.04 3dkw n ILE 63 Cb 0.52 -1.91 -0.04 0.00 -0.71 0.00 0.00 39.64 37.49 3dkw n ILE 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3dkw n TYR 64 N -3.64 -1.96 -4.58 1.39 4.11 -1.26 -4.04 117.16 107.18 3dkw n TYR 64 Ca -0.07 1.06 -0.26 0.00 -0.00 0.00 0.00 57.90 58.63 3dkw n TYR 64 Cb 0.26 -1.79 -0.11 0.00 -0.00 0.00 0.00 39.34 37.71 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 -4.08 1.88 -0.34 -3.48 0.52 -0.76 -3.50 118.95 109.18 3dkw s ARG 65 Ca 0.00 -2.07 0.16 0.00 -0.52 0.00 0.00 55.73 53.30 3dkw s ARG 65 Cb 0.00 -1.40 0.43 0.00 0.52 0.00 0.00 34.95 34.50 3dkw s ARG 65 CO 0.00 -0.11 1.00 1.47 0.02 0.00 0.00 175.30 177.68 3dkw n LEU 66 N -0.90 0.73 0.00 2.53 -0.00 -1.26 -3.59 117.00 114.52 3dkw n LEU 66 Ca -0.05 -3.81 -0.16 0.00 -0.00 0.00 0.00 56.01 51.99 3dkw n LEU 66 Cb 0.67 0.41 -0.14 0.00 -0.00 0.00 0.00 43.42 44.36 3dkw n LEU 66 CO 0.47 1.71 -0.65 0.71 -0.00 0.00 0.00 177.39 179.63 3dkw h THR 67 N 2.62 0.77 -1.52 1.47 1.35 -1.93 -3.46 112.91 112.21 3dkw h THR 67 Ca -0.11 -2.53 0.00 0.00 -0.55 0.00 0.00 66.41 63.22 3dkw h THR 67 Cb 1.17 2.51 0.00 0.00 -1.73 0.00 0.00 68.15 70.10 3dkw h THR 67 CO 0.40 0.74 0.00 -2.65 -0.25 0.00 0.00 175.52 173.76 3dkw n PRO 68 N -3.32 0.77 -0.81 4.72 -0.02 -1.26 -4.77 135.00 130.31 3dkw n PRO 68 Ca -0.24 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 60.82 3dkw n PRO 68 Cb 1.05 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 34.45 3dkw n PRO 68 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dkw n GLU 69 N -0.36 0.81 0.00 -0.52 1.02 -1.26 -4.81 120.64 115.52 3dkw n GLU 69 Ca 0.00 -1.41 0.00 0.00 -0.02 0.00 0.00 57.16 55.73 3dkw n GLU 69 Cb 0.00 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 28.73 3dkw n GLU 69 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dkw n GLY 70 N 4.69 0.42 7.00 0.62 0.00 -1.26 -5.01 105.19 111.64 3dkw n GLY 70 Ca 0.47 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 0.00 -3.53 1.61 1.13 -1.26 -4.85 117.38 110.48 3dkw n GLN 71 Ca 0.00 0.00 -0.21 0.00 -1.94 0.00 0.00 57.00 54.85 3dkw n GLN 71 Cb 0.00 0.00 -0.14 0.00 0.11 0.00 0.00 30.24 30.21 3dkw n GLN 71 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3dkw s GLU 72 N 0.00 0.15 -0.32 -1.09 2.12 -1.26 -4.82 118.70 113.48 3dkw s GLU 72 Ca 0.00 0.06 -0.11 0.00 0.36 0.00 0.00 54.97 55.28 3dkw s GLU 72 Cb 0.00 -1.39 -0.01 0.00 0.26 0.00 0.00 34.13 32.99 3dkw s GLU 72 CO 0.00 -0.69 0.19 -1.59 -0.54 0.00 0.00 175.26 172.63 3dkw s LYS 73 N 2.26 3.41 -0.00 4.30 -2.85 -1.24 -4.98 119.74 120.64 3dkw s LYS 73 Ca 0.05 -0.68 -0.30 0.00 -1.00 0.00 0.00 55.97 54.05 3dkw s LYS 73 Cb -0.16 -3.66 -0.03 0.00 -2.06 0.00 0.00 37.83 31.92 3dkw s LYS 73 CO -0.13 -0.42 1.00 0.42 0.10 0.00 0.00 175.35 176.32 3dkw s ILE 74 N 1.66 4.80 -0.21 3.79 -1.09 -1.26 -1.83 121.20 127.05 3dkw s ILE 74 Ca 0.05 2.01 -0.13 0.00 -2.23 0.00 0.00 60.65 60.36 3dkw s ILE 74 Cb -0.17 -4.29 -0.19 0.00 -1.58 0.00 0.00 42.46 36.23 3dkw s ILE 74 CO 0.08 0.15 0.03 0.18 -1.23 0.00 0.00 174.94 174.15 3dkw n LEU 75 N 3.97 2.23 -3.66 2.97 4.32 -1.26 -4.93 117.00 120.63 3dkw n LEU 75 Ca 0.06 0.27 -0.14 0.00 -0.02 0.00 0.00 56.01 56.18 3dkw n LEU 75 Cb 0.50 -0.96 -0.08 0.00 -1.62 0.00 0.00 43.42 41.27 3dkw n LEU 75 CO 0.52 0.58 0.25 -1.83 -1.22 0.00 0.00 177.39 175.69 3dkw s GLU 76 N -2.47 0.73 -0.18 3.23 -1.05 -1.26 -5.05 118.70 112.65 3dkw s GLU 76 Ca -0.31 0.51 -0.08 0.00 -0.15 0.00 0.00 54.97 54.94 3dkw s GLU 76 Cb 0.09 0.35 -0.04 0.00 -0.44 0.00 0.00 34.13 34.09 3dkw s GLU 76 CO 0.61 -0.15 0.08 0.08 0.95 0.00 0.00 175.26 176.83 3dkw s VAL 77 N -0.27 4.94 -0.22 1.83 1.01 -1.26 -4.06 120.40 122.37 3dkw s VAL 77 Ca -0.04 0.02 -0.10 0.00 0.00 0.00 0.00 61.98 61.86 3dkw s VAL 77 Cb -0.03 -3.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.07 3dkw s VAL 77 CO 0.03 0.46 0.13 -0.89 0.00 0.00 0.00 175.10 174.83 3dkw s THR 78 N 0.31 5.17 0.00 3.92 2.01 -1.07 -5.05 115.64 120.93 3dkw s THR 78 Ca 0.05 0.11 0.00 0.00 0.31 0.00 0.00 61.69 62.15 3dkw s THR 78 Cb -0.12 -3.39 0.00 0.00 0.01 0.00 0.00 72.50 69.00 3dkw s THR 78 CO -0.00 0.38 0.00 0.59 -0.69 0.00 0.00 174.62 174.90 3dkw n ASN 79 N 4.05 0.76 -4.79 3.53 4.13 -1.26 -2.85 115.26 118.83 3dkw n ASN 79 Ca -0.16 -0.83 -0.33 0.00 1.68 0.00 0.00 54.58 54.94 3dkw n ASN 79 Cb 0.52 0.00 0.02 0.00 -1.54 0.00 0.00 39.78 38.78 3dkw n ASN 79 CO 0.00 0.00 0.00 -1.83 0.28 0.00 0.00 177.26 175.71 3dkw s GLU 80 N -1.29 3.18 -1.79 3.52 -1.05 -1.26 -3.41 118.70 116.61 3dkw s GLU 80 Ca 0.00 1.35 0.00 0.00 -0.15 0.00 0.00 54.97 56.17 3dkw s GLU 80 Cb 0.00 -2.00 0.00 0.00 -0.44 0.00 0.00 34.13 31.69 3dkw s GLU 80 CO 0.00 -0.94 0.00 0.54 0.95 0.00 0.00 175.26 175.81 3dkw n ARG 81 N -1.96 -1.64 -3.89 -4.83 1.74 -0.97 -4.98 116.66 100.12 3dkw n ARG 81 Ca 0.10 1.01 -0.11 0.00 -0.77 0.00 0.00 57.85 58.08 3dkw n ARG 81 Cb 0.52 -5.65 -0.13 0.00 -1.02 0.00 0.00 32.46 26.18 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 -2.09 0.05 0.11 0.55 0.02 -1.22 -5.04 114.94 107.32 3dkw s ASN 82 Ca 0.00 -0.09 0.02 0.00 -1.02 0.00 0.00 52.86 51.77 3dkw s ASN 82 Cb 0.00 0.02 -0.04 0.00 0.02 0.00 0.00 41.25 41.25 3dkw s ASN 82 CO 0.00 -0.06 0.21 0.42 0.02 0.00 0.00 177.10 177.70 3dkw s THR 83 N -0.28 5.13 0.06 1.60 -4.23 -1.26 -2.98 115.64 113.67 3dkw s THR 83 Ca -0.03 -0.66 0.02 0.00 -1.18 0.00 0.00 61.69 59.84 3dkw s THR 83 Cb -0.02 -3.57 -0.03 0.00 1.34 0.00 0.00 72.50 70.22 3dkw s THR 83 CO -0.00 0.01 -0.07 0.72 -0.54 0.00 0.00 174.62 174.73 3dkw s PHE 84 N -1.62 0.72 -1.19 3.99 -0.71 -1.19 -4.84 117.98 113.13 3dkw s PHE 84 Ca 0.33 -0.61 -0.06 0.00 -1.04 0.00 0.00 56.93 55.55 3dkw s PHE 84 Cb -0.12 -0.43 0.01 0.00 -1.21 0.00 0.00 43.02 41.27 3dkw s PHE 84 CO 0.27 -0.11 1.03 0.00 -1.34 0.00 0.00 175.22 175.07 3dkw n ALA 85 N 1.06 -1.34 0.83 1.99 0.00 -1.26 -3.64 120.51 118.15 3dkw n ALA 85 Ca -0.20 0.27 0.11 0.00 0.00 0.00 0.00 53.44 53.62 3dkw n ALA 85 Cb 0.56 -4.36 0.10 0.00 0.00 0.00 0.00 19.45 15.75 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 -4.39 0.11 0.00 0.00 0.28 -1.26 -3.88 120.64 111.50 3dkw n GLU 86 Ca -0.06 0.00 0.14 0.00 -0.16 0.00 0.00 57.16 57.09 3dkw n GLU 86 Cb 0.58 -1.54 0.61 0.00 1.43 0.00 0.00 31.44 32.52 3dkw n GLU 86 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3dkw n ALA 87 N -1.63 2.63 0.23 -1.84 0.00 -1.26 -3.81 120.51 114.83 3dkw n ALA 87 Ca 0.04 -0.39 0.12 0.00 0.00 0.00 0.00 53.44 53.21 3dkw n ALA 87 Cb 0.37 -1.24 0.47 0.00 0.00 0.00 0.00 19.45 19.05 3dkw n ALA 87 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 3dkw h MET 88 N 1.76 0.00 -0.04 0.00 2.86 -1.91 -2.62 114.93 114.98 3dkw h MET 88 Ca 0.00 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.54 3dkw h MET 88 Cb 0.39 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 3dkw h MET 88 CO 0.00 0.17 -0.44 0.52 1.06 0.00 0.00 176.91 178.21 3dkw h MET 89 N 0.00 0.08 0.00 1.72 2.86 -1.85 -3.20 114.93 114.54 3dkw h MET 89 Ca -0.00 -0.04 -0.22 0.00 -2.06 0.00 0.00 59.70 57.38 3dkw h MET 89 Cb 0.74 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.36 3dkw h MET 89 CO 0.02 0.51 -1.84 1.19 1.06 0.00 0.00 176.91 177.85 3dkw n PHE 90 N -4.01 0.53 -2.49 -0.22 3.01 -1.14 -4.84 117.46 108.30 3dkw n PHE 90 Ca -0.02 0.18 -0.43 0.00 1.01 0.00 0.00 57.45 58.19 3dkw n PHE 90 Cb 0.48 -0.98 -0.02 0.00 -0.01 0.00 0.00 39.48 38.94 3dkw n PHE 90 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 3dkw s MET 91 N -2.85 3.87 -0.95 -1.08 -1.94 -1.00 -4.90 119.30 110.45 3dkw s MET 91 Ca -0.06 1.05 -0.11 0.00 -1.71 0.00 0.00 55.69 54.86 3dkw s MET 91 Cb 0.09 -3.87 -0.08 0.00 2.01 0.00 0.00 34.83 32.97 3dkw s MET 91 CO 0.83 -1.18 2.12 -0.25 -0.01 0.00 0.00 175.02 176.53 3dkw n ASP 92 N 7.66 4.46 -3.89 3.03 8.00 -1.26 -4.81 116.55 129.73 3dkw n ASP 92 Ca 0.14 -2.46 -0.23 0.00 0.71 0.00 0.00 54.79 52.95 3dkw n ASP 92 Cb 0.47 -1.16 -0.17 0.00 -0.02 0.00 0.00 41.12 40.24 3dkw n ASP 92 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3dkw s THR 93 N 3.76 0.69 -1.46 -3.53 -4.23 -1.26 -5.00 115.64 104.61 3dkw s THR 93 Ca 0.47 -0.17 0.29 0.00 -1.18 0.00 0.00 61.69 61.10 3dkw s THR 93 Cb 0.12 -0.72 0.52 0.00 1.34 0.00 0.00 72.50 73.76 3dkw s THR 93 CO 0.00 0.28 2.00 -0.81 -0.54 0.00 0.00 174.62 175.55 3dkw n PRO 94 N 4.38 0.44 -4.27 3.99 -0.04 -1.26 -4.67 135.00 133.56 3dkw n PRO 94 Ca -0.19 0.01 -0.26 0.00 -0.04 0.00 0.00 63.50 63.02 3dkw n PRO 94 Cb 0.51 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.38 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 -2.54 4.41 0.19 3.54 0.02 -1.26 -2.57 114.94 116.73 3dkw s ASN 95 Ca 0.28 -0.54 -0.28 0.00 -1.02 0.00 0.00 52.86 51.30 3dkw s ASN 95 Cb 0.19 -0.80 -0.08 0.00 0.02 0.00 0.00 41.25 40.58 3dkw s ASN 95 CO 0.43 0.09 0.87 -0.47 0.02 0.00 0.00 177.10 178.04 3dkw s TYR 96 N -1.79 3.94 -0.11 2.20 5.04 -1.05 -4.76 117.35 120.82 3dkw s TYR 96 Ca 0.26 1.78 0.15 0.00 -2.44 0.00 0.00 57.07 56.81 3dkw s TYR 96 Cb -0.09 -2.89 -0.04 0.00 0.35 0.00 0.00 41.96 39.30 3dkw s TYR 96 CO 0.17 0.46 1.21 -0.39 -1.34 0.00 0.00 175.55 175.66 3dkw h VAL 97 N 3.31 0.85 -4.45 3.14 -1.51 -1.94 -2.07 116.25 113.59 3dkw h VAL 97 Ca -0.46 -2.30 -0.21 0.00 -1.23 0.00 0.00 66.70 62.50 3dkw h VAL 97 Cb 1.20 2.35 -0.14 0.00 -2.13 0.00 0.00 31.29 32.57 3dkw h VAL 97 CO 0.67 0.48 -0.57 0.00 -1.23 0.00 0.00 177.57 176.92 3dkw s ALA 98 N -2.91 0.94 0.69 5.19 0.00 -1.26 -4.91 121.76 119.50 3dkw s ALA 98 Ca 0.01 -1.55 -0.02 0.00 0.00 0.00 0.00 51.96 50.40 3dkw s ALA 98 Cb 0.08 1.22 0.10 0.00 0.00 0.00 0.00 23.12 24.53 3dkw s ALA 98 CO 0.78 -0.59 0.70 2.41 0.00 0.00 0.00 175.76 179.05 3dkw n THR 99 N -0.24 0.00 -3.69 0.00 -1.04 -1.23 -3.53 114.28 104.56 3dkw n THR 99 Ca -0.00 -0.95 -0.10 0.00 -2.04 0.00 0.00 64.05 60.95 3dkw n THR 99 Cb 0.65 -1.18 -0.10 0.00 -1.82 0.00 0.00 70.33 67.88 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 -3.22 -1.25 -0.08 2.41 0.00 -0.73 -4.50 121.76 114.39 3dkw s ALA 100 Ca 0.44 1.67 -0.19 0.00 0.00 0.00 0.00 51.96 53.89 3dkw s ALA 100 Cb -0.02 -1.00 0.04 0.00 0.00 0.00 0.00 23.12 22.14 3dkw s ALA 100 CO 0.30 -0.28 0.44 -1.14 0.00 0.00 0.00 175.76 175.08 3dkw s GLN 101 N 1.18 0.70 -0.15 0.00 0.74 0.06 -2.58 119.66 119.60 3dkw s GLN 101 Ca -0.07 0.22 -0.04 0.00 0.05 0.00 0.00 55.36 55.51 3dkw s GLN 101 Cb -0.07 0.33 -0.03 0.00 1.10 0.00 0.00 33.01 34.34 3dkw s GLN 101 CO -0.11 -0.17 -0.00 0.00 -0.55 0.00 0.00 175.29 174.46 3dkw s ALA 102 N -0.70 3.16 -0.23 1.58 0.00 -1.04 0.25 121.76 124.78 3dkw s ALA 102 Ca -0.08 -0.79 0.18 0.00 0.00 0.00 0.00 51.96 51.27 3dkw s ALA 102 Cb -0.03 -1.64 0.21 0.00 0.00 0.00 0.00 23.12 21.66 3dkw s ALA 102 CO 0.04 0.27 1.53 -0.39 0.00 0.00 0.00 175.76 177.20 3dkw h VAL 103 N 4.91 0.55 -3.97 0.00 -1.51 -1.88 -1.72 116.25 112.63 3dkw h VAL 103 Ca -0.36 -1.74 -0.17 0.00 -1.23 0.00 0.00 66.70 63.20 3dkw h VAL 103 Cb 1.18 2.24 -0.21 0.00 -2.13 0.00 0.00 31.29 32.37 3dkw h VAL 103 CO 0.64 0.31 -0.70 0.68 -1.23 0.00 0.00 177.57 177.27 3dkw s VAL 104 N -3.09 0.11 -0.36 7.19 -7.23 -1.26 -4.60 120.40 111.17 3dkw s VAL 104 Ca 0.05 -0.88 -0.40 0.00 -1.81 0.00 0.00 61.98 58.94 3dkw s VAL 104 Cb 0.07 -0.26 -0.16 0.00 0.56 0.00 0.00 36.38 36.60 3dkw s VAL 104 CO 0.71 -0.48 1.92 -2.65 -0.31 0.00 0.00 175.10 174.29 3dkw n PRO 105 N 1.65 0.80 -4.23 4.82 -0.02 -1.26 -4.47 135.00 132.30 3dkw n PRO 105 Ca -0.24 0.27 -0.18 0.00 -2.02 0.00 0.00 63.50 61.33 3dkw n PRO 105 Cb 0.55 -2.02 -0.11 0.00 -0.02 0.00 0.00 33.50 31.89 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 4.93 1.94 -0.17 2.55 0.01 -1.16 -4.68 113.70 117.11 3dkw s SER 106 Ca 1.06 -0.76 -0.03 0.00 1.31 0.00 0.00 55.95 57.53 3dkw s SER 106 Cb -1.14 -0.07 -0.02 0.00 0.21 0.00 0.00 66.02 65.00 3dkw s SER 106 CO 0.63 -0.12 -0.05 -1.58 0.41 0.00 0.00 173.24 172.53 3dkw s GLN 107 N -2.40 3.54 0.03 12.44 0.74 -1.18 -2.61 119.66 130.22 3dkw s GLN 107 Ca 0.06 -0.58 0.03 0.00 0.05 0.00 0.00 55.36 54.92 3dkw s GLN 107 Cb -0.06 -2.89 -0.02 0.00 1.10 0.00 0.00 33.01 31.14 3dkw s GLN 107 CO 0.03 0.12 -0.10 -0.51 -0.55 0.00 0.00 175.29 174.28 3dkw s LEU 108 N 0.67 2.16 0.13 3.68 1.02 -0.31 -3.14 118.68 122.89 3dkw s LEU 108 Ca -0.03 -0.41 -0.13 0.00 0.02 0.00 0.00 54.13 53.59 3dkw s LEU 108 Cb -0.15 -0.38 -0.07 0.00 0.02 0.00 0.00 46.19 45.62 3dkw s LEU 108 CO 0.02 -0.04 0.51 -0.36 0.02 0.00 0.00 176.35 176.50 3dkw s PHE 109 N -0.86 3.59 -0.83 0.29 0.40 -1.01 -1.22 117.98 118.33 3dkw s PHE 109 Ca -0.02 0.97 -0.00 0.00 -0.60 0.00 0.00 56.93 57.28 3dkw s PHE 109 Cb -0.07 -2.30 0.20 0.00 0.51 0.00 0.00 43.02 41.36 3dkw s PHE 109 CO 0.01 0.45 0.69 0.50 0.70 0.00 0.00 175.22 177.57 3dkw s ARG 110 N -1.97 3.05 0.11 0.44 3.52 -1.10 -2.79 118.95 120.21 3dkw s ARG 110 Ca 0.37 -3.23 -0.30 0.00 -0.13 0.00 0.00 55.73 52.44 3dkw s ARG 110 Cb -0.15 -3.83 -0.06 0.00 -1.56 0.00 0.00 34.95 29.36 3dkw s ARG 110 CO 0.19 -1.26 1.05 -0.06 -0.81 0.00 0.00 175.30 174.41 3dkw s PHE 111 N -1.26 3.65 0.33 5.12 0.40 -1.00 -3.96 117.98 121.26 3dkw s PHE 111 Ca 0.26 1.63 -0.27 0.00 -0.60 0.00 0.00 56.93 57.95 3dkw s PHE 111 Cb -0.08 -3.20 -0.09 0.00 0.51 0.00 0.00 43.02 40.15 3dkw s PHE 111 CO -0.12 -0.37 1.02 0.45 0.70 0.00 0.00 175.22 176.90 3dkw s SER 112 N 0.30 7.15 -0.03 1.36 0.15 -1.26 -1.53 113.70 119.84 3dkw s SER 112 Ca 0.51 2.03 -0.22 0.00 0.70 0.00 0.00 55.95 58.96 3dkw s SER 112 Cb -0.26 -2.60 -0.23 0.00 -1.71 0.00 0.00 66.02 61.22 3dkw s SER 112 CO 0.31 -0.21 1.07 0.78 1.20 0.00 0.00 173.24 176.39 3dkw h ASN 113 N 3.21 0.35 -0.48 5.45 2.35 -1.81 -2.96 115.58 121.69 3dkw h ASN 113 Ca -0.47 -0.76 -0.10 0.00 -0.55 0.00 0.00 56.30 54.42 3dkw h ASN 113 Cb 1.21 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.45 3dkw h ASN 113 CO 0.65 1.06 -0.08 0.50 -1.65 0.00 0.00 177.43 177.91 3dkw h LYS 114 N -0.32 0.94 -0.24 0.81 3.64 -1.94 -2.37 116.57 117.08 3dkw h LYS 114 Ca -0.05 -0.32 -0.07 0.00 -1.27 0.00 0.00 60.65 58.94 3dkw h LYS 114 Cb 1.11 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.84 3dkw h LYS 114 CO 0.08 0.98 -0.17 0.00 -2.27 0.00 0.00 179.45 178.06 3dkw h ALA 115 N 1.05 1.26 -0.21 5.00 0.00 -1.94 -2.37 119.26 122.04 3dkw h ALA 115 Ca 0.14 -0.28 -0.21 0.00 0.00 0.00 0.00 54.91 54.56 3dkw h ALA 115 Cb 0.61 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.29 3dkw h ALA 115 CO 0.04 0.49 -0.67 -0.92 0.00 0.00 0.00 179.25 178.19 3dkw h TYR 116 N 0.39 1.08 -0.40 0.00 3.20 -1.33 -2.90 116.97 117.01 3dkw h TYR 116 Ca 0.07 -0.44 -0.06 0.00 3.14 0.00 0.00 58.73 61.44 3dkw h TYR 116 Cb 0.53 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.60 3dkw h TYR 116 CO 0.01 1.27 -0.00 -0.07 -1.64 0.00 0.00 178.16 177.73 3dkw h LEU 117 N 0.59 0.61 -0.96 2.82 3.38 -1.25 -2.20 115.31 118.30 3dkw h LEU 117 Ca -0.02 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.72 3dkw h LEU 117 Cb 1.29 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 3dkw h LEU 117 CO 0.14 0.69 -0.30 0.03 0.09 0.00 0.00 178.44 179.09 3dkw h ARG 118 N 0.61 0.40 -0.11 1.13 3.08 -1.41 -1.50 114.38 116.59 3dkw h ARG 118 Ca 0.13 -0.16 -0.14 0.00 0.07 0.00 0.00 59.98 59.88 3dkw h ARG 118 Cb 0.39 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 3dkw h ARG 118 CO 0.01 0.66 -0.55 1.96 -1.07 0.00 0.00 179.97 180.98 3dkw h GLN 119 N 0.35 0.31 0.34 0.04 4.20 -1.23 -3.32 115.11 115.81 3dkw h GLN 119 Ca 0.05 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 3dkw h GLN 119 Cb 0.70 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.51 3dkw h GLN 119 CO 0.05 0.78 -0.16 -0.07 -0.67 0.00 0.00 178.83 178.76 3dkw h LEU 120 N 0.24 -0.39 0.00 1.46 3.38 -1.15 -3.43 115.31 115.42 3dkw h LEU 120 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dkw h LEU 120 Cb 1.04 0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3dkw h LEU 120 CO 0.09 0.06 0.00 0.00 0.09 0.00 0.00 178.44 178.68 3dkw n GLN 121 N -5.08 0.00 0.00 1.13 6.02 -0.59 -4.49 117.38 114.37 3dkw n GLN 121 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.93 3dkw n GLN 121 Cb 0.19 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.45 3dkw n GLN 121 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3dkw n ASP 122 N 0.00 0.00 0.00 1.08 9.92 -1.26 -4.78 116.55 121.50 3dkw n ASP 122 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 3dkw n ASP 122 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 3dkw n ASP 122 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3dkw n ASN 123 N 2.62 0.00 -0.03 -2.24 3.02 -1.26 -5.03 115.26 112.33 3dkw n ASN 123 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.54 3dkw n ASN 123 Cb 0.00 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.03 3dkw n ASN 123 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3dkw n THR 124 N 0.00 0.98 0.00 3.41 -2.24 -1.26 -4.29 114.28 110.88 3dkw n THR 124 Ca 0.00 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 3dkw n THR 124 Cb 0.00 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.77 3dkw n THR 124 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3dkw n PRO 125 N -2.68 0.00 0.04 -0.78 -0.02 -1.26 0.32 135.00 130.62 3dkw n PRO 125 Ca -0.17 0.57 -0.02 0.00 -2.02 0.00 0.00 63.50 61.86 3dkw n PRO 125 Cb 0.90 -1.14 0.25 0.00 -0.02 0.00 0.00 33.50 33.50 3dkw n PRO 125 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3dkw h LEU 126 N 0.00 0.41 0.24 2.45 3.38 -1.86 -1.86 115.31 118.06 3dkw h LEU 126 Ca 0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3dkw h LEU 126 Cb 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3dkw h LEU 126 CO 0.00 0.63 -0.11 0.00 0.09 0.00 0.00 178.44 179.05 3dkw h ALA 127 N 1.41 -0.32 -0.29 1.53 0.00 -1.69 -2.60 119.26 117.31 3dkw h ALA 127 Ca 0.06 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3dkw h ALA 127 Cb 0.58 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3dkw h ALA 127 CO 0.04 -0.65 -0.32 -0.07 0.00 0.00 0.00 179.25 178.25 3dkw h LEU 128 N -0.36 0.63 -0.84 0.00 3.38 -0.09 -2.88 115.31 115.14 3dkw h LEU 128 Ca -0.03 -0.25 0.10 0.00 0.09 0.00 0.00 57.88 57.79 3dkw h LEU 128 Cb 0.28 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 40.78 3dkw h LEU 128 CO 0.05 0.91 0.48 0.00 0.09 0.00 0.00 178.44 179.97 3dkw h ALA 129 N 1.13 1.22 -0.31 1.53 0.00 -1.20 -1.34 119.26 120.30 3dkw h ALA 129 Ca 0.06 0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.83 3dkw h ALA 129 Cb 0.80 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3dkw h ALA 129 CO 0.07 0.09 -0.51 -0.07 0.00 0.00 0.00 179.25 178.82 3dkw h LEU 130 N 0.79 0.97 -2.35 0.00 3.38 -1.36 -2.94 115.31 113.81 3dkw h LEU 130 Ca 0.41 -0.51 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 3dkw h LEU 130 Cb 0.41 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 3dkw h LEU 130 CO -0.26 1.30 -0.00 -0.07 0.09 0.00 0.00 178.44 179.50 3dkw h LEU 131 N 0.69 0.00 0.10 1.67 3.38 -1.12 -1.39 115.31 118.63 3dkw h LEU 131 Ca 0.02 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.75 3dkw h LEU 131 Cb 1.12 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.89 3dkw h LEU 131 CO 0.12 0.00 -1.03 0.00 0.09 0.00 0.00 178.44 177.62 3dkw h ALA 132 N 2.00 -0.01 0.00 1.53 0.00 -1.10 -2.90 119.26 118.78 3dkw h ALA 132 Ca -0.00 -0.71 -0.16 0.00 0.00 0.00 0.00 54.91 54.04 3dkw h ALA 132 Cb 0.21 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3dkw h ALA 132 CO 0.00 0.55 -0.76 0.87 0.00 0.00 0.00 179.25 179.91 3dkw h LYS 133 N 0.08 0.00 -0.02 0.00 1.79 -1.42 -2.71 116.57 114.28 3dkw h LYS 133 Ca -0.16 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.17 3dkw h LYS 133 Cb 1.73 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 32.37 3dkw h LYS 133 CO 0.20 0.76 -0.65 -0.07 -1.08 0.00 0.00 179.45 178.61 3dkw h LEU 134 N 0.00 0.12 0.14 2.94 3.38 -1.35 -2.64 115.31 117.90 3dkw h LEU 134 Ca -0.01 -0.07 -0.23 0.00 0.09 0.00 0.00 57.88 57.66 3dkw h LEU 134 Cb 1.41 -0.03 0.03 0.00 0.09 0.00 0.00 40.66 42.15 3dkw h LEU 134 CO 0.10 0.73 -0.99 0.77 0.09 0.00 0.00 178.44 179.15 3dkw h SER 135 N 0.07 0.63 -0.41 -0.43 4.64 -1.50 -3.10 113.55 113.45 3dkw h SER 135 Ca -0.01 -0.90 -0.07 0.00 -0.47 0.00 0.00 61.79 60.34 3dkw h SER 135 Cb 1.16 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 63.03 3dkw h SER 135 CO 0.09 1.47 0.01 0.71 -0.87 0.00 0.00 176.83 178.24 3dkw h THR 136 N -0.12 1.24 -0.19 2.95 1.35 -1.53 -2.67 112.91 113.94 3dkw h THR 136 Ca -0.16 -1.00 -0.11 0.00 -0.55 0.00 0.00 66.41 64.59 3dkw h THR 136 Cb 1.74 0.87 -0.01 0.00 -1.73 0.00 0.00 68.15 69.02 3dkw h THR 136 CO 0.19 0.35 -0.35 -0.09 -0.25 0.00 0.00 175.52 175.37 3dkw h ARG 137 N 0.75 0.41 -0.18 4.72 2.43 -1.57 -2.77 114.38 118.17 3dkw h ARG 137 Ca 0.15 -0.18 -0.03 0.00 -0.81 0.00 0.00 59.98 59.10 3dkw h ARG 137 Cb 0.45 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 3dkw h ARG 137 CO 0.02 0.71 -0.01 -0.07 -1.51 0.00 0.00 179.97 179.11 3dkw h LEU 138 N 0.35 0.32 -1.21 3.80 3.38 -1.41 -2.18 115.31 118.35 3dkw h LEU 138 Ca 0.04 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.69 3dkw h LEU 138 Cb 0.79 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.41 3dkw h LEU 138 CO 0.06 0.57 0.46 0.45 0.09 0.00 0.00 178.44 180.07 3dkw h HIS 139 N 0.06 0.96 0.00 1.13 3.86 -1.44 0.40 115.15 120.12 3dkw h HIS 139 Ca 0.05 0.01 -0.09 0.00 -1.16 0.00 0.00 60.37 59.18 3dkw h HIS 139 Cb 0.41 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.55 3dkw h HIS 139 CO 0.04 0.63 -0.42 1.96 0.86 0.00 0.00 177.93 181.00 3dkw h GLN 140 N 1.02 0.00 0.03 2.45 4.20 -1.39 -2.03 115.11 119.39 3dkw h GLN 140 Ca 0.27 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.71 3dkw h GLN 140 Cb -0.07 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 3dkw h GLN 140 CO -0.05 0.42 -1.42 0.00 -0.67 0.00 0.00 178.83 177.10 3dkw h ARG 141 N 0.00 0.07 -0.50 1.46 3.08 -0.61 -3.21 114.38 114.67 3dkw h ARG 141 Ca -0.00 -0.12 -0.11 0.00 0.07 0.00 0.00 59.98 59.81 3dkw h ARG 141 Cb 0.78 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.86 3dkw h ARG 141 CO 0.05 0.85 -0.12 0.82 -1.07 0.00 0.00 179.97 180.50 3dkw h ILE 142 N 0.02 1.27 -0.01 2.04 2.04 -0.08 -2.13 117.51 120.66 3dkw h ILE 142 Ca -0.18 -1.25 -0.06 0.00 1.00 0.00 0.00 64.86 64.37 3dkw h ILE 142 Cb 1.93 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 39.00 3dkw h ILE 142 CO 0.12 0.44 -0.27 0.44 0.00 0.00 0.00 178.15 178.87 3dkw h ASP 143 N 0.84 0.02 0.15 1.72 3.32 -1.48 0.37 116.42 121.36 3dkw h ASP 143 Ca 0.13 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.04 3dkw h ASP 143 Cb 0.66 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.19 3dkw h ASP 143 CO 0.05 0.29 -0.49 -0.33 -1.72 0.00 0.00 179.24 177.04 3dkw h GLU 144 N 0.02 0.39 0.05 3.56 5.08 -1.44 -2.00 114.58 120.24 3dkw h GLU 144 Ca 0.00 -0.22 -0.26 0.00 -1.00 0.00 0.00 59.36 57.88 3dkw h GLU 144 Cb 0.49 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.77 3dkw h GLU 144 CO 0.04 0.80 -1.09 0.82 -1.00 0.00 0.00 179.01 178.57 3dkw h ILE 145 N 0.31 1.36 -0.12 3.13 2.04 -0.80 -1.87 117.51 121.55 3dkw h ILE 145 Ca 0.02 -2.49 -0.06 0.00 1.00 0.00 0.00 64.86 63.32 3dkw h ILE 145 Cb 0.98 2.56 -0.01 0.00 -0.74 0.00 0.00 36.82 39.60 3dkw h ILE 145 CO 0.08 0.75 -0.18 -0.33 0.00 0.00 0.00 178.15 178.47 3dkw h GLU 146 N 0.25 0.20 0.10 2.37 5.08 -0.87 0.11 114.58 121.82 3dkw h GLU 146 Ca -0.13 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.01 3dkw h GLU 146 Cb 1.75 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 30.98 3dkw h GLU 146 CO 0.20 0.39 -0.79 1.79 -1.00 0.00 0.00 179.01 179.60 3dkw h THR 147 N 0.19 1.44 -0.22 1.13 1.35 -1.38 -3.17 112.91 112.25 3dkw h THR 147 Ca 0.04 -2.45 -0.09 0.00 -0.55 0.00 0.00 66.41 63.35 3dkw h THR 147 Cb 0.44 3.09 -0.01 0.00 -1.73 0.00 0.00 68.15 69.94 3dkw h THR 147 CO 0.03 0.67 -0.26 -0.07 -0.25 0.00 0.00 175.52 175.64 3dkw h LEU 148 N -0.53 0.42 -0.97 3.87 3.38 -1.28 -0.14 115.31 120.05 3dkw h LEU 148 Ca -0.16 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.62 3dkw h LEU 148 Cb 1.51 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 42.12 3dkw h LEU 148 CO 0.08 0.68 0.17 -1.28 0.09 0.00 0.00 178.44 178.18 3dkw h SER 149 N 0.37 0.85 1.19 -0.43 0.87 -0.91 0.48 113.55 115.98 3dkw h SER 149 Ca 0.05 -0.15 -0.12 0.00 -1.23 0.00 0.00 61.79 60.34 3dkw h SER 149 Cb 0.66 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 62.38 3dkw h SER 149 CO 0.05 0.81 -0.59 -0.07 -0.53 0.00 0.00 176.83 176.50 3dkw h LEU 150 N 0.89 0.00 0.04 2.23 3.38 -1.45 -2.70 115.31 117.70 3dkw h LEU 150 Ca 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 3dkw h LEU 150 Cb 0.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.03 3dkw h LEU 150 CO -0.01 0.59 -0.02 0.11 0.09 0.00 0.00 178.44 179.21 3dkw h LYS 151 N 0.00 -0.05 -0.03 1.13 1.57 -0.32 -1.41 116.57 117.47 3dkw h LYS 151 Ca -0.01 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 3dkw h LYS 151 Cb 1.35 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.66 3dkw h LYS 151 CO 0.08 0.41 -0.13 -0.91 -0.57 0.00 0.00 179.45 178.32 3dkw h ASN 152 N -0.52 0.04 -0.28 0.86 -0.26 -1.00 -0.11 115.58 114.31 3dkw h ASN 152 Ca -0.00 -0.01 -0.19 0.00 -0.56 0.00 0.00 56.30 55.54 3dkw h ASN 152 Cb 0.47 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 3dkw h ASN 152 CO 0.01 0.18 -0.57 0.00 -1.06 0.00 0.00 177.43 175.98 3dkw h ALA 153 N 1.83 0.44 -0.06 -0.83 0.00 -1.41 -2.53 119.26 116.69 3dkw h ALA 153 Ca 0.01 -0.52 -0.19 0.00 0.00 0.00 0.00 54.91 54.20 3dkw h ALA 153 Cb 0.26 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3dkw h ALA 153 CO 0.02 0.67 -0.78 1.79 0.00 0.00 0.00 179.25 180.95 3dkw h THR 154 N 0.66 1.38 -0.23 0.00 1.35 -0.82 -3.11 112.91 112.14 3dkw h THR 154 Ca 0.01 -2.22 -0.02 0.00 -0.55 0.00 0.00 66.41 63.63 3dkw h THR 154 Cb 1.18 2.18 -0.01 0.00 -1.73 0.00 0.00 68.15 69.78 3dkw h THR 154 CO 0.13 0.67 0.05 0.45 -0.25 0.00 0.00 175.52 176.56 3dkw h HIS 155 N 0.27 0.40 0.00 4.73 -0.00 -1.04 -2.55 115.15 116.95 3dkw h HIS 155 Ca -0.04 -0.05 -0.01 0.00 -0.00 0.00 0.00 60.37 60.27 3dkw h HIS 155 Cb 1.37 -0.11 -0.00 0.00 -0.00 0.00 0.00 27.41 28.67 3dkw h HIS 155 CO 0.05 0.48 -0.06 0.00 -0.00 0.00 0.00 177.93 178.41 3dkw h ARG 156 N 0.20 0.00 0.20 2.45 3.08 -1.50 -1.83 114.38 116.97 3dkw h ARG 156 Ca 0.07 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.81 3dkw h ARG 156 Cb 0.29 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.36 3dkw h ARG 156 CO 0.00 0.06 -1.45 0.28 -1.07 0.00 0.00 179.97 177.79 3dkw h VAL 157 N 0.00 1.18 -0.12 2.04 2.07 -1.44 -3.05 116.25 116.94 3dkw h VAL 157 Ca -0.00 -2.57 -0.06 0.00 0.82 0.00 0.00 66.70 64.89 3dkw h VAL 157 Cb 0.31 2.94 -0.00 0.00 -1.52 0.00 0.00 31.29 33.02 3dkw h VAL 157 CO 0.01 0.80 -0.15 0.58 0.02 0.00 0.00 177.57 178.82 3dkw h VAL 158 N -0.01 1.37 -0.48 2.57 2.07 -1.23 -2.77 116.25 117.76 3dkw h VAL 158 Ca -0.27 -1.37 -0.02 0.00 0.82 0.00 0.00 66.70 65.86 3dkw h VAL 158 Cb 2.01 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 33.76 3dkw h VAL 158 CO 0.20 0.39 0.22 0.03 0.02 0.00 0.00 177.57 178.43 3dkw h ARG 159 N -0.10 0.67 -0.01 1.57 2.47 -1.50 -0.94 114.38 116.54 3dkw h ARG 159 Ca 0.01 -0.08 -0.09 0.00 -1.26 0.00 0.00 59.98 58.56 3dkw h ARG 159 Cb 0.71 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.88 3dkw h ARG 159 CO 0.04 0.53 -0.44 -0.92 0.56 0.00 0.00 179.97 179.74 3dkw h TYR 160 N 0.67 0.03 0.00 3.04 3.20 -1.51 -2.15 116.97 120.25 3dkw h TYR 160 Ca 0.17 -0.01 -0.16 0.00 3.14 0.00 0.00 58.73 61.87 3dkw h TYR 160 Cb 0.09 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 3dkw h TYR 160 CO 0.01 0.46 -0.76 -0.07 -1.64 0.00 0.00 178.16 176.16 3dkw h LEU 161 N 0.02 0.00 -0.74 2.82 3.38 -1.02 -3.11 115.31 116.66 3dkw h LEU 161 Ca -0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 3dkw h LEU 161 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 3dkw h LEU 161 CO 0.06 0.76 -0.57 -0.07 0.09 0.00 0.00 178.44 178.71 3dkw h LEU 162 N 0.00 0.20 -0.85 1.67 3.38 -0.76 -2.74 115.31 116.21 3dkw h LEU 162 Ca -0.01 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3dkw h LEU 162 Cb 1.48 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 3dkw h LEU 162 CO 0.10 0.73 -0.39 0.71 0.09 0.00 0.00 178.44 179.68 3dkw h THR 163 N 0.14 0.89 0.00 0.22 1.35 -1.40 -1.15 112.91 112.96 3dkw h THR 163 Ca -0.00 -1.59 0.00 0.00 -0.55 0.00 0.00 66.41 64.26 3dkw h THR 163 Cb 1.05 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 69.44 3dkw h THR 163 CO 0.09 0.38 -0.23 0.18 -0.25 0.00 0.00 175.52 175.68 3dkw n LEU 164 N -3.50 0.52 -0.12 3.87 4.77 -1.09 -2.63 117.00 118.82 3dkw n LEU 164 Ca -0.00 0.38 -0.15 0.00 -0.03 0.00 0.00 56.01 56.21 3dkw n LEU 164 Cb 0.53 -0.32 -0.14 0.00 -2.33 0.00 0.00 43.42 41.16 3dkw n LEU 164 CO 0.37 -0.05 -1.26 0.00 -1.33 0.00 0.00 177.39 175.11 3dkw n ALA 165 N -1.68 1.46 -0.02 -1.18 0.00 -1.05 -3.61 120.51 114.42 3dkw n ALA 165 Ca 0.05 -1.19 -0.16 0.00 0.00 0.00 0.00 53.44 52.15 3dkw n ALA 165 Cb 0.39 -0.14 -0.12 0.00 0.00 0.00 0.00 19.45 19.58 3dkw n ALA 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dkw h ALA 166 N 0.39 0.02 -0.07 0.00 0.00 -1.32 -3.26 119.26 115.02 3dkw h ALA 166 Ca -0.56 -0.49 -0.22 0.00 0.00 0.00 0.00 54.91 53.63 3dkw h ALA 166 Cb 2.03 0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.85 3dkw h ALA 166 CO -0.04 0.11 -0.86 1.25 0.00 0.00 0.00 179.25 179.71 3dkw h HIS 167 N -0.55 0.81 -3.41 0.00 6.17 -1.74 -3.39 115.15 113.05 3dkw h HIS 167 Ca -0.04 -0.39 -0.65 0.00 0.71 0.00 0.00 60.37 59.99 3dkw h HIS 167 Cb 1.07 -0.11 -0.40 0.00 2.52 0.00 0.00 27.41 30.49 3dkw h HIS 167 CO 0.19 1.20 -0.55 0.00 0.71 0.00 0.00 177.93 179.48 3dkw s ALA 168 N -3.51 3.42 0.70 5.26 0.00 -1.24 -5.09 121.76 121.30 3dkw s ALA 168 Ca -0.08 -3.32 -0.12 0.00 0.00 0.00 0.00 51.96 48.45 3dkw s ALA 168 Cb 0.09 -2.30 0.01 0.00 0.00 0.00 0.00 23.12 20.93 3dkw s ALA 168 CO 0.88 -2.05 1.07 -1.25 0.00 0.00 0.00 175.76 174.41 3dkw s PRO 169 N -0.33 2.82 0.00 0.00 0.04 -1.23 -4.31 135.00 131.99 3dkw s PRO 169 Ca 0.18 1.07 0.00 0.00 0.04 0.00 0.00 61.00 62.28 3dkw s PRO 169 Cb -0.23 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.34 3dkw s PRO 169 CO -0.02 -1.20 0.00 0.41 0.04 0.00 0.00 177.00 176.23 3dkw n GLY 170 N -1.58 -1.32 3.34 0.56 0.00 -1.26 -5.11 105.19 99.82 3dkw n GLY 170 Ca 0.08 0.73 -0.20 0.00 0.00 0.00 0.00 46.02 46.63 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 1.66 1.31 0.33 1.61 2.02 -1.25 -5.04 118.70 119.34 3dkw s GLU 171 Ca 0.00 -1.51 0.11 0.00 0.02 0.00 0.00 54.97 53.59 3dkw s GLU 171 Cb 0.00 -1.20 0.59 0.00 0.10 0.00 0.00 34.13 33.61 3dkw s GLU 171 CO 0.00 0.22 1.75 -0.97 0.02 0.00 0.00 175.26 176.28 3dkw h ASN 172 N 2.84 0.04 0.01 -0.19 -1.24 -2.01 -2.93 115.58 112.09 3dkw h ASN 172 Ca -0.40 -0.02 0.00 0.00 0.71 0.00 0.00 56.30 56.60 3dkw h ASN 172 Cb 1.22 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 40.26 3dkw h ASN 172 CO 0.58 0.47 -0.12 0.00 -1.29 0.00 0.00 177.43 177.07 3dkw s ARG 174 N -2.15 2.09 -0.30 0.00 0.52 -1.11 -3.97 118.95 114.03 3dkw s ARG 174 Ca 0.29 -0.74 -0.11 0.00 -0.52 0.00 0.00 55.73 54.65 3dkw s ARG 174 Cb 0.20 -1.80 0.12 0.00 0.52 0.00 0.00 34.95 33.98 3dkw s ARG 174 CO 0.39 0.31 0.66 0.08 0.02 0.00 0.00 175.30 176.75 3dkw s VAL 175 N -0.07 -0.80 0.65 3.52 1.01 -1.26 -3.93 120.40 119.54 3dkw s VAL 175 Ca -0.03 0.00 -0.18 0.00 0.00 0.00 0.00 61.98 61.77 3dkw s VAL 175 Cb -0.12 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 3dkw s VAL 175 CO 0.03 0.00 1.23 -0.62 0.00 0.00 0.00 175.10 175.74 3dkw n GLU 176 N 5.22 1.01 -0.02 2.72 1.02 -1.26 -3.12 120.64 126.21 3dkw n GLU 176 Ca -0.14 0.40 -0.12 0.00 -0.02 0.00 0.00 57.16 57.29 3dkw n GLU 176 Cb 0.51 -2.47 -0.10 0.00 -0.02 0.00 0.00 31.44 29.36 3dkw n GLU 176 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3dkw h ILE 177 N 0.42 1.30 -0.03 -3.67 2.04 -1.98 -3.46 117.51 112.13 3dkw h ILE 177 Ca -0.50 -1.64 0.00 0.00 1.00 0.00 0.00 64.86 63.71 3dkw h ILE 177 Cb 1.34 2.31 0.00 0.00 -0.74 0.00 0.00 36.82 39.73 3dkw h ILE 177 CO 0.52 0.38 -0.08 -0.81 0.00 0.00 0.00 178.15 178.17 3dkw n PRO 178 N -4.76 2.09 0.00 2.37 -0.04 -1.26 -5.02 135.00 128.38 3dkw n PRO 178 Ca -0.08 -1.70 0.00 0.00 -0.04 0.00 0.00 63.50 61.68 3dkw n PRO 178 Cb 0.33 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 3dkw n PRO 178 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 3dkw n VAL 179 N 1.03 0.00 -1.04 0.52 0.31 -1.26 -5.11 118.33 112.79 3dkw n VAL 179 Ca 0.14 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.16 3dkw n VAL 179 Cb 0.56 -0.64 0.25 0.00 -0.91 0.00 0.00 33.84 33.10 3dkw n VAL 179 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3dkw s ALA 180 N -2.36 0.51 -0.13 3.52 0.00 -1.26 -4.98 121.76 117.06 3dkw s ALA 180 Ca 0.00 -0.96 0.17 0.00 0.00 0.00 0.00 51.96 51.17 3dkw s ALA 180 Cb 0.00 -2.88 -0.11 0.00 0.00 0.00 0.00 23.12 20.13 3dkw s ALA 180 CO 0.00 -3.68 0.89 0.87 0.00 0.00 0.00 175.76 173.84 3dkw h LYS 181 N -2.66 0.00 0.00 0.00 1.57 -1.99 -3.34 116.57 110.15 3dkw h LYS 181 Ca -0.44 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.31 3dkw h LYS 181 Cb 1.29 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.60 3dkw h LYS 181 CO 0.33 0.30 -0.96 1.96 -0.57 0.00 0.00 179.45 180.51 3dkw h GLN 182 N 0.00 0.00 -0.05 3.15 4.20 -1.98 -3.32 115.11 117.11 3dkw h GLN 182 Ca -0.14 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.38 3dkw h GLN 182 Cb 1.55 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.32 3dkw h GLN 182 CO 0.05 0.04 -0.79 -0.07 -0.67 0.00 0.00 178.83 177.39 3dkw h LEU 183 N 0.00 0.43 -0.52 1.46 3.38 -1.96 -3.19 115.31 114.91 3dkw h LEU 183 Ca -0.02 -0.30 -0.15 0.00 0.09 0.00 0.00 57.88 57.49 3dkw h LEU 183 Cb 1.08 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 3dkw h LEU 183 CO 0.01 1.06 -0.74 0.58 0.09 0.00 0.00 178.44 179.44 3dkw h VAL 184 N 0.22 1.52 0.00 1.22 2.07 -1.69 -3.00 116.25 116.60 3dkw h VAL 184 Ca -0.04 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 64.95 3dkw h VAL 184 Cb 1.38 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 33.52 3dkw h VAL 184 CO 0.13 0.72 0.00 0.00 0.02 0.00 0.00 177.57 178.44 3dkw n ALA 185 N -2.40 2.48 -0.77 1.67 0.00 -1.21 -4.22 120.51 116.07 3dkw n ALA 185 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3dkw n ALA 185 Cb 0.72 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 19.07 3dkw n ALA 185 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dkw n GLY 186 N 0.54 -0.63 3.94 0.00 0.00 -1.13 -4.68 105.19 103.23 3dkw n GLY 186 Ca 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.81 3dkw n GLY 186 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3dkw s HIS 187 N -0.80 2.78 0.00 1.61 5.04 -1.26 -4.59 115.29 118.08 3dkw s HIS 187 Ca 0.00 0.33 0.00 0.00 -1.54 0.00 0.00 55.06 53.85 3dkw s HIS 187 Cb 0.00 -3.15 0.00 0.00 0.04 0.00 0.00 32.58 29.47 3dkw s HIS 187 CO 0.00 -1.39 0.00 1.28 -2.34 0.00 0.00 174.74 172.29 3dkw n LEU 188 N -2.86 0.00 -3.57 8.88 4.77 -1.26 -4.51 117.00 118.45 3dkw n LEU 188 Ca 0.09 0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.81 3dkw n LEU 188 Cb 0.60 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.74 3dkw n LEU 188 CO 0.50 0.00 0.13 -1.54 -1.33 0.00 0.00 177.39 175.15 3dkw n SER 189 N 0.00 -5.62 -4.18 -1.43 3.41 -1.26 -4.86 113.62 99.67 3dkw n SER 189 Ca 0.00 -0.55 -0.33 0.00 -0.26 0.00 0.00 58.87 57.72 3dkw n SER 189 Cb 0.00 -4.48 -0.16 0.00 -0.26 0.00 0.00 64.21 59.31 3dkw n SER 189 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3dkw s ILE 190 N -3.25 2.39 0.48 -1.33 1.01 -1.26 -4.86 121.20 114.38 3dkw s ILE 190 Ca 0.54 -0.83 -0.23 0.00 0.00 0.00 0.00 60.65 60.13 3dkw s ILE 190 Cb -0.26 -2.02 -0.07 0.00 0.01 0.00 0.00 42.46 40.13 3dkw s ILE 190 CO 0.67 0.51 1.23 -1.10 0.00 0.00 0.00 174.94 176.25 3dkw s GLN 191 N 1.23 3.57 0.50 2.79 -0.21 -1.26 -4.79 119.66 121.49 3dkw s GLN 191 Ca 0.03 1.93 0.23 0.00 0.02 0.00 0.00 55.36 57.57 3dkw s GLN 191 Cb -0.14 -2.37 1.30 0.00 1.00 0.00 0.00 33.01 32.80 3dkw s GLN 191 CO -0.09 -0.75 1.97 -1.35 -2.12 0.00 0.00 175.29 172.95 3dkw h PRO 192 N 1.88 0.12 0.03 2.91 0.11 -1.98 0.51 132.00 135.58 3dkw h PRO 192 Ca -0.50 -0.01 -0.22 0.00 0.11 0.00 0.00 66.00 65.39 3dkw h PRO 192 Cb 1.26 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 3dkw h PRO 192 CO 0.59 0.08 -0.99 0.93 -0.21 0.00 0.00 178.00 178.40 3dkw h GLU 193 N 0.12 0.11 0.09 1.05 5.08 -1.99 -3.27 114.58 115.78 3dkw h GLU 193 Ca 0.29 -0.16 -0.28 0.00 -1.00 0.00 0.00 59.36 58.21 3dkw h GLU 193 Cb 0.98 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 3dkw h GLU 193 CO -0.04 1.01 -1.39 1.79 -1.00 0.00 0.00 179.01 179.38 3dkw h THR 194 N 0.04 1.30 -0.63 1.13 1.35 -1.52 -3.31 112.91 111.29 3dkw h THR 194 Ca -0.05 -2.95 -0.03 0.00 -0.55 0.00 0.00 66.41 62.84 3dkw h THR 194 Cb 1.70 2.79 -0.03 0.00 -1.73 0.00 0.00 68.15 70.88 3dkw h THR 194 CO 0.14 0.83 0.28 0.15 -0.25 0.00 0.00 175.52 176.68 3dkw h PHE 195 N 0.05 0.90 0.00 4.73 3.57 -1.07 -0.88 116.94 124.24 3dkw h PHE 195 Ca -0.18 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.28 3dkw h PHE 195 Cb 1.97 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 40.43 3dkw h PHE 195 CO 0.05 0.67 0.00 0.66 -2.23 0.00 0.00 178.31 177.46 3dkw h SER 196 N 0.89 0.00 0.07 0.41 4.64 -1.67 -3.18 113.55 114.72 3dkw h SER 196 Ca 0.22 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.29 3dkw h SER 196 Cb 0.13 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 3dkw h SER 196 CO -0.02 0.00 -1.31 0.03 -0.87 0.00 0.00 176.83 174.65 3dkw h ARG 197 N 0.00 0.14 -0.28 4.77 3.08 -1.30 -3.29 114.38 117.51 3dkw h ARG 197 Ca 0.00 -0.25 0.07 0.00 0.07 0.00 0.00 59.98 59.87 3dkw h ARG 197 Cb 0.53 0.09 -0.07 0.00 0.08 0.00 0.00 29.97 30.60 3dkw h ARG 197 CO 0.00 1.12 -0.18 0.82 -1.07 0.00 0.00 179.97 180.65 3dkw h ILE 198 N -0.55 0.48 0.00 2.04 2.04 -1.23 1.20 117.51 121.49 3dkw h ILE 198 Ca -0.31 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.53 3dkw h ILE 198 Cb 1.58 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 38.14 3dkw h ILE 198 CO -0.03 0.00 -0.09 0.24 0.00 0.00 0.00 178.15 178.27 3dkw h MET 199 N -0.16 0.00 0.11 2.37 2.86 -1.74 -1.67 114.93 116.70 3dkw h MET 199 Ca 0.15 0.00 -0.31 0.00 -2.06 0.00 0.00 59.70 57.49 3dkw h MET 199 Cb 0.39 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 3dkw h MET 199 CO -0.38 0.09 -1.60 1.25 1.06 0.00 0.00 176.91 177.33 3dkw h HIS 200 N 0.00 0.43 -0.41 -0.22 -0.00 -1.11 -3.17 115.15 110.66 3dkw h HIS 200 Ca -0.00 -0.31 -0.09 0.00 -0.00 0.00 0.00 60.37 59.96 3dkw h HIS 200 Cb 0.18 -0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.55 3dkw h HIS 200 CO 0.00 1.63 -0.12 0.00 -0.00 0.00 0.00 177.93 179.44 3dkw h ARG 201 N -0.24 0.74 0.00 5.26 3.08 0.15 -0.93 114.38 122.45 3dkw h ARG 201 Ca -0.35 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.41 3dkw h ARG 201 Cb 1.82 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.80 3dkw h ARG 201 CO 0.05 0.84 -0.18 1.25 -1.07 0.00 0.00 179.97 180.85 3dkw h LEU 202 N 0.67 0.00 0.00 3.04 6.46 -1.47 -3.23 115.31 120.77 3dkw h LEU 202 Ca 0.11 0.00 -0.15 0.00 -0.12 0.00 0.00 57.88 57.72 3dkw h LEU 202 Cb 0.59 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.50 3dkw h LEU 202 CO 0.04 0.18 -1.21 1.23 -0.62 0.00 0.00 178.44 178.06 3dkw h GLY 203 N 3.65 0.00 2.00 3.75 0.00 -1.46 -3.32 103.07 107.70 3dkw h GLY 203 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3dkw h GLY 203 CO 0.02 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.78 3dkw n ASP 204 N -2.96 0.52 -0.34 0.19 9.92 -0.38 -2.32 116.55 121.19 3dkw n ASP 204 Ca -0.07 0.61 0.14 0.00 -0.53 0.00 0.00 54.79 54.94 3dkw n ASP 204 Cb 0.81 -0.72 0.63 0.00 -0.64 0.00 0.00 41.12 41.19 3dkw n ASP 204 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3dkw n GLU 205 N -2.05 1.46 -2.61 -1.24 1.02 -1.25 -4.91 120.64 111.06 3dkw n GLU 205 Ca 0.03 -0.67 -0.02 0.00 -0.02 0.00 0.00 57.16 56.48 3dkw n GLU 205 Cb 0.26 -1.47 0.01 0.00 -0.02 0.00 0.00 31.44 30.22 3dkw n GLU 205 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dkw n GLY 206 N 1.11 0.80 0.36 0.62 0.00 -0.98 -4.97 105.19 102.12 3dkw n GLY 206 Ca 0.20 -0.59 -0.02 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.77 0.13 -3.85 -0.61 5.41 -1.26 -4.82 119.36 111.60 3dkw n ILE 207 Ca 0.00 -0.04 -0.36 0.00 1.00 0.00 0.00 62.75 63.35 3dkw n ILE 207 Cb 0.51 -0.94 -0.13 0.00 -0.71 0.00 0.00 39.64 38.36 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 -2.05 3.48 0.30 1.39 1.01 -1.25 -2.26 121.20 121.83 3dkw s ILE 208 Ca -0.03 -0.84 -0.29 0.00 0.00 0.00 0.00 60.65 59.48 3dkw s ILE 208 Cb 0.01 -2.79 -0.10 0.00 0.01 0.00 0.00 42.46 39.59 3dkw s ILE 208 CO 0.05 0.13 1.14 -2.28 0.00 0.00 0.00 174.94 173.97 3dkw s HIS 209 N 1.42 3.46 -0.13 3.97 5.65 -0.45 -4.51 115.29 124.70 3dkw s HIS 209 Ca 0.01 1.65 0.00 0.00 0.25 0.00 0.00 55.06 56.97 3dkw s HIS 209 Cb -0.17 -3.35 -0.01 0.00 -1.18 0.00 0.00 32.58 27.87 3dkw s HIS 209 CO -0.01 -0.80 -0.15 -0.51 -0.65 0.00 0.00 174.74 172.63 3dkw s LEU 210 N -1.58 2.59 0.00 8.88 1.43 -1.26 -3.35 118.68 125.39 3dkw s LEU 210 Ca 0.46 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 3dkw s LEU 210 Cb -0.33 -1.58 0.00 0.00 0.03 0.00 0.00 46.19 44.32 3dkw s LEU 210 CO 0.43 0.15 0.00 0.47 0.23 0.00 0.00 176.35 177.63 3dkw n ASP 211 N 3.62 0.96 0.00 2.29 8.00 -1.26 -5.08 116.55 125.09 3dkw n ASP 211 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 3dkw n ASP 211 Cb 0.53 0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 3dkw n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dkw n GLY 212 N 1.34 3.42 5.06 0.44 0.00 -1.26 -4.99 105.19 109.19 3dkw n GLY 212 Ca 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.46 3dkw n GLY 212 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dkw n ARG 213 N 0.00 0.00 -2.17 1.61 1.74 -1.26 -4.87 116.66 111.71 3dkw n ARG 213 Ca 0.00 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 3dkw n ARG 213 Cb 0.00 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.43 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 0.00 4.07 -0.82 5.56 2.02 -1.26 -4.79 118.70 123.48 3dkw s GLU 214 Ca 0.00 2.02 -0.12 0.00 0.02 0.00 0.00 54.97 56.90 3dkw s GLU 214 Cb 0.00 -2.78 0.21 0.00 0.10 0.00 0.00 34.13 31.66 3dkw s GLU 214 CO 0.00 -0.36 0.74 0.42 0.02 0.00 0.00 175.26 176.08 3dkw s ILE 215 N -1.30 5.32 0.31 -1.63 1.09 -1.18 -4.49 121.20 119.33 3dkw s ILE 215 Ca 0.55 -2.64 -0.28 0.00 -1.10 0.00 0.00 60.65 57.19 3dkw s ILE 215 Cb -0.35 -4.30 -0.09 0.00 -1.06 0.00 0.00 42.46 36.65 3dkw s ILE 215 CO 0.45 -1.02 1.06 -0.94 -0.10 0.00 0.00 174.94 174.40 3dkw s SER 216 N 1.82 7.15 -0.13 3.58 1.04 -1.21 -4.08 113.70 121.88 3dkw s SER 216 Ca 0.19 2.15 0.01 0.00 0.48 0.00 0.00 55.95 58.78 3dkw s SER 216 Cb -0.12 -2.61 -0.01 0.00 0.10 0.00 0.00 66.02 63.38 3dkw s SER 216 CO -0.08 -0.22 -0.16 -0.63 0.98 0.00 0.00 173.24 173.13 3dkw s ILE 217 N -1.33 2.78 -0.21 -1.02 1.01 -0.64 -1.34 121.20 120.45 3dkw s ILE 217 Ca 0.48 -0.76 -0.20 0.00 0.00 0.00 0.00 60.65 60.17 3dkw s ILE 217 Cb -0.28 -2.15 -0.18 0.00 0.01 0.00 0.00 42.46 39.87 3dkw s ILE 217 CO 0.36 0.53 0.13 0.18 0.00 0.00 0.00 174.94 176.14 3dkw n LEU 218 N 3.60 1.87 -4.12 2.97 4.77 -0.96 -4.00 117.00 121.13 3dkw n LEU 218 Ca -0.18 0.42 -0.33 0.00 -0.03 0.00 0.00 56.01 55.88 3dkw n LEU 218 Cb 0.53 -0.95 -0.14 0.00 -2.33 0.00 0.00 43.42 40.53 3dkw n LEU 218 CO 0.30 0.28 -0.41 -1.81 -1.33 0.00 0.00 177.39 174.42 3dkw s ASP 219 N -6.89 4.63 0.10 -1.43 1.01 -1.21 -4.98 116.67 107.89 3dkw s ASP 219 Ca -0.30 -1.30 0.12 0.00 0.71 0.00 0.00 52.55 51.78 3dkw s ASP 219 Cb 0.07 -1.63 -0.15 0.00 1.01 0.00 0.00 42.92 42.22 3dkw s ASP 219 CO 0.57 -0.22 1.07 -0.09 0.21 0.00 0.00 175.17 176.71 3dkw h ARG 220 N 7.89 0.00 0.00 8.23 2.43 -1.91 -3.27 114.38 127.75 3dkw h ARG 220 Ca -0.21 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.96 3dkw h ARG 220 Cb 1.05 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.60 3dkw h ARG 220 CO 0.50 0.65 -0.01 0.93 -1.51 0.00 0.00 179.97 180.53 3dkw h GLU 221 N 0.00 0.00 0.12 0.20 5.08 -2.00 -3.28 114.58 114.71 3dkw h GLU 221 Ca -0.11 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.91 3dkw h GLU 221 Cb 1.73 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.97 3dkw h GLU 221 CO 0.09 0.01 -1.79 0.00 -1.00 0.00 0.00 179.01 176.32 3dkw h ARG 222 N 0.00 0.26 -0.08 2.33 3.08 -2.00 -3.36 114.38 114.61 3dkw h ARG 222 Ca -0.00 -0.45 -0.03 0.00 0.07 0.00 0.00 59.98 59.57 3dkw h ARG 222 Cb 0.82 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.03 3dkw h ARG 222 CO 0.00 1.13 -0.11 -0.07 -1.07 0.00 0.00 179.97 179.84 3dkw h LEU 223 N 0.07 0.11 -0.72 3.04 3.38 -1.61 -1.86 115.31 117.72 3dkw h LEU 223 Ca -0.35 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3dkw h LEU 223 Cb 2.05 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.77 3dkw h LEU 223 CO 0.13 0.24 0.00 -0.62 0.09 0.00 0.00 178.44 178.28 3dkw n GLU 224 N -4.34 1.16 0.00 1.13 1.02 -1.24 -3.11 120.64 115.26 3dkw n GLU 224 Ca -0.02 -0.16 0.00 0.00 -0.02 0.00 0.00 57.16 56.97 3dkw n GLU 224 Cb 0.22 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 3dkw n GLU 224 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dkw s PHE 226 N -0.66 3.54 -1.42 0.00 0.08 -1.15 -5.14 117.98 113.22 3dkw s PHE 226 Ca 0.00 1.67 0.11 0.00 0.12 0.00 0.00 56.93 58.83 3dkw s PHE 226 Cb 0.00 -3.32 0.09 0.00 -0.57 0.00 0.00 43.02 39.22 3dkw s PHE 226 CO 0.00 -0.67 0.86 0.39 -0.10 0.00 0.00 175.22 175.70