#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ttw h TYR 4 N 0.00 0.00 0.00 -1.42 3.20 -1.99 0.69 116.97 117.45 1ttw h TYR 4 Ca 0.00 0.00 -0.35 0.00 3.14 0.00 0.00 58.73 61.52 1ttw h TYR 4 Cb 0.00 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.21 1ttw h TYR 4 CO 0.00 0.00 -2.17 0.45 -1.64 0.00 0.00 178.16 174.80 1ttw n SER 5 N -3.55 0.46 0.22 -2.11 2.88 -1.26 -2.79 113.62 107.48 1ttw n SER 5 Ca 0.00 0.13 0.11 0.00 -1.33 0.00 0.00 58.87 57.78 1ttw n SER 5 Cb 0.28 0.52 0.45 0.00 -0.75 0.00 0.00 64.21 64.70 1ttw n SER 5 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1ttw h SER 6 N 0.00 0.00 -0.02 -3.46 0.02 -1.51 0.63 113.55 109.21 1ttw h SER 6 Ca -0.46 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.47 1ttw h SER 6 Cb 2.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.69 1ttw h SER 6 CO 0.04 0.20 -0.06 0.25 -1.14 0.00 0.00 176.83 176.12 1ttw h LEU 7 N 0.00 0.10 -0.95 5.07 5.85 0.27 -2.69 115.31 122.96 1ttw h LEU 7 Ca -0.00 -0.61 -0.04 0.00 0.84 0.00 0.00 57.88 58.06 1ttw h LEU 7 Cb 0.77 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.74 1ttw h LEU 7 CO 0.03 0.69 0.27 -0.07 -0.34 0.00 0.00 178.44 179.02 1ttw h LEU 8 N -0.50 0.94 -0.80 2.25 4.07 -1.49 -1.74 115.31 118.05 1ttw h LEU 8 Ca -0.00 -0.14 0.17 0.00 0.08 0.00 0.00 57.88 57.99 1ttw h LEU 8 Cb 0.68 -0.24 -0.11 0.00 1.08 0.00 0.00 40.66 42.07 1ttw h LEU 8 CO 0.01 0.85 0.28 -0.33 -1.08 0.00 0.00 178.44 178.18 1ttw h GLU 9 N 1.00 0.35 0.00 1.13 5.08 -0.90 -2.50 114.58 118.75 1ttw h GLU 9 Ca 0.23 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.55 1ttw h GLU 9 Cb 0.21 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1ttw h GLU 9 CO -0.02 0.23 -0.71 0.93 -1.00 0.00 0.00 179.01 178.44 1ttw h GLU 10 N 0.37 0.00 0.01 2.33 5.08 -1.03 -3.24 114.58 118.10 1ttw h GLU 10 Ca 0.46 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.66 1ttw h GLU 10 Cb 0.80 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.06 1ttw h GLU 10 CO -0.49 0.06 -0.66 0.35 -1.00 0.00 0.00 179.01 177.27 1ttw h PHE 11 N 0.00 0.65 -0.35 4.33 3.57 -1.38 -2.49 116.94 121.27 1ttw h PHE 11 Ca -0.02 -0.36 0.10 0.00 3.53 0.00 0.00 57.97 61.23 1ttw h PHE 11 Cb 1.08 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.73 1ttw h PHE 11 CO 0.00 1.18 0.29 0.00 -2.23 0.00 0.00 178.31 177.55 1ttw h ALA 12 N 0.32 2.19 -0.89 2.41 0.00 -1.51 -2.92 119.26 118.85 1ttw h ALA 12 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ttw h ALA 12 Cb 1.37 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1ttw h ALA 12 CO 0.13 -0.47 0.00 2.41 0.00 0.00 0.00 179.25 181.32 1ttw n THR 13 N -4.14 0.00 0.00 0.00 -1.04 -1.11 -1.49 114.28 106.50 1ttw n THR 13 Ca 0.06 0.35 0.00 0.00 -2.04 0.00 0.00 64.05 62.42 1ttw n THR 13 Cb 0.46 -1.10 0.00 0.00 -1.82 0.00 0.00 70.33 67.87 1ttw n THR 13 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1ttw n GLU 14 N -1.66 0.00 -0.62 -2.82 4.71 -0.96 -0.04 120.64 119.26 1ttw n GLU 14 Ca 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 57.16 57.16 1ttw n GLU 14 Cb 0.00 -1.11 0.00 0.00 -1.01 0.00 0.00 31.44 29.32 1ttw n GLU 14 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1ttw n LEU 15 N -0.27 0.15 -0.52 -4.62 4.32 -1.10 -5.02 117.00 109.95 1ttw n LEU 15 Ca 0.00 -1.15 0.00 0.00 -0.02 0.00 0.00 56.01 54.84 1ttw n LEU 15 Cb 0.00 -0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1ttw n LEU 15 CO 0.00 0.29 0.00 0.61 -1.22 0.00 0.00 177.39 177.07 1ttw n GLY 16 N 0.05 0.00 3.28 -0.72 0.00 0.95 -4.98 105.19 103.77 1ttw n GLY 16 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 1ttw n GLY 16 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ttw s LEU 17 N 0.00 2.44 0.15 0.99 2.01 -0.56 -5.04 118.68 118.67 1ttw s LEU 17 Ca 0.00 -0.87 -0.22 0.00 0.01 0.00 0.00 54.13 53.05 1ttw s LEU 17 Cb 0.00 -0.63 0.03 0.00 0.01 0.00 0.00 46.19 45.59 1ttw s LEU 17 CO 0.00 -0.13 1.63 1.05 1.01 0.00 0.00 176.35 179.91 1ttw h GLU 18 N 3.26 -0.24 0.00 1.70 9.09 -1.94 -3.45 114.58 123.00 1ttw h GLU 18 Ca -0.40 0.02 0.00 0.00 0.05 0.00 0.00 59.36 59.03 1ttw h GLU 18 Cb 1.20 0.05 0.00 0.00 -1.65 0.00 0.00 28.75 28.36 1ttw h GLU 18 CO 0.53 -0.16 0.00 0.39 0.05 0.00 0.00 179.01 179.82 1ttw n GLU 19 N -5.37 0.00 -2.81 1.06 1.02 -1.26 -5.07 120.64 108.21 1ttw n GLU 19 Ca -0.01 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.71 1ttw n GLU 19 Cb 0.29 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.67 1ttw n GLU 19 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1ttw s ILE 20 N 0.00 4.86 -0.03 -3.67 1.01 -1.26 -4.95 121.20 117.16 1ttw s ILE 20 Ca 0.00 1.82 -0.26 0.00 0.00 0.00 0.00 60.65 62.21 1ttw s ILE 20 Cb 0.00 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.22 1ttw s ILE 20 CO 0.00 0.06 0.81 -1.61 0.00 0.00 0.00 174.94 174.21 1ttw s GLU 21 N 1.79 4.49 0.05 2.79 8.01 -1.26 -5.01 118.70 129.56 1ttw s GLU 21 Ca 0.44 1.10 0.09 0.00 0.01 0.00 0.00 54.97 56.61 1ttw s GLU 21 Cb -0.18 -3.45 -0.03 0.00 -4.31 0.00 0.00 34.13 26.16 1ttw s GLU 21 CO 0.17 0.03 -0.26 0.95 0.01 0.00 0.00 175.26 176.17 1ttw s THR 22 N 0.83 2.10 0.00 3.63 -4.23 -1.26 -4.38 115.64 112.32 1ttw s THR 22 Ca 0.43 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.53 1ttw s THR 22 Cb -0.19 -1.80 0.00 0.00 1.34 0.00 0.00 72.50 71.85 1ttw s THR 22 CO 0.22 0.32 0.00 -0.46 -0.54 0.00 0.00 174.62 174.16 1ttw n ASN 23 N 1.69 -0.57 0.10 3.99 0.23 -0.95 -4.89 115.26 114.86 1ttw n ASN 23 Ca -0.17 -0.33 -0.03 0.00 -0.53 0.00 0.00 54.58 53.52 1ttw n ASN 23 Cb 0.52 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 38.25 1ttw n ASN 23 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1ttw h GLU 24 N 0.00 0.00 -0.90 -3.83 3.07 -2.01 -0.39 114.58 110.52 1ttw h GLU 24 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ttw h GLU 24 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1ttw h GLU 24 CO 0.00 0.77 0.00 1.28 -1.40 0.00 0.00 179.01 179.66 1ttw n LEU 25 N -3.49 0.99 -1.75 1.33 4.32 -1.26 -4.91 117.00 112.22 1ttw n LEU 25 Ca -0.00 -0.50 -0.03 0.00 -0.02 0.00 0.00 56.01 55.46 1ttw n LEU 25 Cb 0.78 -0.44 -0.01 0.00 -1.62 0.00 0.00 43.42 42.13 1ttw n LEU 25 CO 0.44 0.23 -0.03 0.61 -1.22 0.00 0.00 177.39 177.42 1ttw n GLY 26 N 0.09 -0.08 3.70 -0.72 0.00 -0.16 -4.48 105.19 103.54 1ttw n GLY 26 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ttw n GLY 26 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ttw s HIS 27 N -1.69 3.35 0.27 1.61 5.04 -1.26 -4.47 115.29 118.14 1ttw s HIS 27 Ca 0.00 1.35 0.02 0.00 -1.54 0.00 0.00 55.06 54.89 1ttw s HIS 27 Cb 0.00 -3.35 -0.04 0.00 0.04 0.00 0.00 32.58 29.23 1ttw s HIS 27 CO 0.00 -0.99 0.14 0.20 -2.34 0.00 0.00 174.74 171.75 1ttw s GLY 28 N 1.27 1.84 0.04 1.59 0.00 -0.65 -2.25 107.32 109.17 1ttw s GLY 28 Ca 0.55 -1.79 -0.07 0.00 0.00 0.00 0.00 44.72 43.41 1ttw s GLY 28 CO 0.24 -1.54 0.14 0.00 0.00 0.00 0.00 173.10 171.94 1ttw s ALA 29 N -3.77 -0.19 0.02 3.20 0.00 -1.26 -0.57 121.76 119.20 1ttw s ALA 29 Ca 0.37 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.89 1ttw s ALA 29 Cb 0.06 0.28 -0.02 0.00 0.00 0.00 0.00 23.12 23.45 1ttw s ALA 29 CO 0.16 -0.35 -0.06 0.08 0.00 0.00 0.00 175.76 175.58 1ttw s VAL 30 N -2.73 0.44 -0.09 0.00 1.01 0.80 -4.89 120.40 114.94 1ttw s VAL 30 Ca -0.04 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.21 1ttw s VAL 30 Cb -0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 1ttw s VAL 30 CO -0.05 -0.19 0.00 -0.89 0.00 0.00 0.00 175.10 173.97 1ttw s THR 31 N -0.87 4.33 -0.04 3.92 2.01 -1.26 -0.92 115.64 122.82 1ttw s THR 31 Ca -0.06 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 61.74 1ttw s THR 31 Cb -0.07 -2.82 0.00 0.00 0.01 0.00 0.00 72.50 69.62 1ttw s THR 31 CO 0.00 0.60 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.77 1ttw s ILE 32 N -0.86 1.17 -1.12 1.82 1.01 0.15 -4.67 121.20 118.69 1ttw s ILE 32 Ca 0.13 -0.57 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 1ttw s ILE 32 Cb -0.11 -1.02 0.14 0.00 0.01 0.00 0.00 42.46 41.48 1ttw s ILE 32 CO 0.02 0.35 0.36 0.47 0.00 0.00 0.00 174.94 176.14 1ttw n ASP 33 N 3.25 -1.42 0.00 3.58 8.00 -1.26 -1.33 116.55 127.37 1ttw n ASP 33 Ca -0.18 -0.57 0.00 0.00 0.71 0.00 0.00 54.79 54.74 1ttw n ASP 33 Cb 0.53 -1.28 0.00 0.00 -0.02 0.00 0.00 41.12 40.35 1ttw n ASP 33 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 1ttw n LYS 34 N -3.27 0.00 -0.04 -1.24 0.00 -1.26 -4.57 118.16 107.78 1ttw n LYS 34 Ca 0.07 0.00 -0.04 0.00 -0.00 0.00 0.00 58.31 58.34 1ttw n LYS 34 Cb 0.43 -3.06 -0.05 0.00 -0.00 0.00 0.00 35.03 32.36 1ttw n LYS 34 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1ttw n ILE 35 N -1.95 0.47 -3.66 0.58 5.41 -0.52 -5.02 119.36 114.67 1ttw n ILE 35 Ca 0.00 -0.26 -0.37 0.00 1.00 0.00 0.00 62.75 63.12 1ttw n ILE 35 Cb 0.00 -0.82 -0.10 0.00 -0.71 0.00 0.00 39.64 38.01 1ttw n ILE 35 CO 0.00 0.00 0.00 0.26 0.00 0.00 0.00 176.55 176.81 1ttw s TRP 36 N -2.16 3.27 -0.26 1.39 0.23 -0.44 -4.95 118.94 116.02 1ttw s TRP 36 Ca -0.05 0.15 -0.09 0.00 -2.03 0.00 0.00 56.10 54.08 1ttw s TRP 36 Cb 0.02 -2.29 -0.04 0.00 0.03 0.00 0.00 33.47 31.19 1ttw s TRP 36 CO 0.26 -0.02 0.13 0.08 0.96 0.00 0.00 176.95 178.36 1ttw s VAL 37 N 1.25 4.90 -0.31 4.03 1.01 -1.26 0.33 120.40 130.35 1ttw s VAL 37 Ca 0.07 0.03 -0.09 0.00 0.00 0.00 0.00 61.98 61.99 1ttw s VAL 37 Cb -0.14 -3.31 -0.00 0.00 0.00 0.00 0.00 36.38 32.93 1ttw s VAL 37 CO 0.06 0.31 0.14 -0.69 0.00 0.00 0.00 175.10 174.92 1ttw s VAL 38 N 1.55 4.50 0.03 2.92 1.01 -0.09 -4.34 120.40 125.97 1ttw s VAL 38 Ca 0.06 -0.50 -0.23 0.00 0.00 0.00 0.00 61.98 61.31 1ttw s VAL 38 Cb -0.15 -3.31 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 1ttw s VAL 38 CO 0.07 0.04 0.70 -1.00 0.00 0.00 0.00 175.10 174.92 1ttw s HIS 39 N 1.59 3.72 -0.03 5.22 3.76 -0.04 -0.14 115.29 129.36 1ttw s HIS 39 Ca 0.04 1.37 0.07 0.00 -0.15 0.00 0.00 55.06 56.40 1ttw s HIS 39 Cb -0.17 -2.74 -0.02 0.00 1.11 0.00 0.00 32.58 30.76 1ttw s HIS 39 CO 0.06 0.30 -0.26 -0.51 -0.85 0.00 0.00 174.74 173.48 1ttw s LEU 40 N -0.11 2.06 -0.28 0.89 1.43 0.26 0.07 118.68 123.00 1ttw s LEU 40 Ca 0.36 -0.49 -0.20 0.00 -1.03 0.00 0.00 54.13 52.77 1ttw s LEU 40 Cb -0.20 -1.35 0.09 0.00 0.03 0.00 0.00 46.19 44.76 1ttw s LEU 40 CO 0.21 0.29 0.77 0.00 0.23 0.00 0.00 176.35 177.85 1ttw s ALA 41 N -0.44 -1.90 0.30 4.21 0.00 -0.13 -1.64 121.76 122.17 1ttw s ALA 41 Ca 0.05 2.20 -0.29 0.00 0.00 0.00 0.00 51.96 53.92 1ttw s ALA 41 Cb -0.11 -1.37 -0.10 0.00 0.00 0.00 0.00 23.12 21.53 1ttw s ALA 41 CO 0.01 -0.35 1.35 -1.25 0.00 0.00 0.00 175.76 175.52 1ttw s PRO 42 N 1.01 4.32 -0.00 0.00 0.05 -1.26 0.09 135.00 139.21 1ttw s PRO 42 Ca -0.05 2.25 0.01 0.00 0.05 0.00 0.00 61.00 63.25 1ttw s PRO 42 Cb -0.05 -3.08 -0.01 0.00 0.05 0.00 0.00 34.50 31.41 1ttw s PRO 42 CO -0.11 -0.27 0.02 1.51 0.05 0.00 0.00 177.00 178.21 1ttw n ILE 43 N 1.28 0.00 -3.26 0.56 3.06 0.18 -4.83 119.36 116.35 1ttw n ILE 43 Ca 0.02 -0.42 -0.01 0.00 -2.50 0.00 0.00 62.75 59.84 1ttw n ILE 43 Cb 0.41 0.92 0.00 0.00 0.54 0.00 0.00 39.64 41.52 1ttw n ILE 43 CO 0.00 0.00 0.00 0.59 -2.50 0.00 0.00 176.55 174.64 1ttw n ASN 44 N -1.09 -0.17 0.09 9.51 3.02 -1.19 -5.00 115.26 120.43 1ttw n ASN 44 Ca 0.00 -1.15 -0.03 0.00 -0.03 0.00 0.00 54.58 53.37 1ttw n ASN 44 Cb 0.01 0.29 -0.06 0.00 -0.61 0.00 0.00 39.78 39.41 1ttw n ASN 44 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1ttw h GLU 45 N 0.00 0.00 0.00 3.52 4.39 -2.04 -3.31 114.58 117.15 1ttw h GLU 45 Ca -0.03 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1ttw h GLU 45 Cb 0.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1ttw h GLU 45 CO 0.04 0.75 -1.36 1.63 -1.16 0.00 0.00 179.01 178.90 1ttw n LYS 46 N -3.27 0.46 -3.89 2.33 4.76 -1.26 -5.03 118.16 112.26 1ttw n LYS 46 Ca -0.00 -0.05 -0.10 0.00 -2.87 0.00 0.00 58.31 55.30 1ttw n LYS 46 Cb 0.86 -1.61 -0.09 0.00 -1.84 0.00 0.00 35.03 32.35 1ttw n LYS 46 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 1ttw s GLU 47 N -3.33 0.66 0.32 1.97 -1.05 -1.25 -1.62 118.70 114.41 1ttw s GLU 47 Ca -0.01 -0.75 0.10 0.00 -0.15 0.00 0.00 54.97 54.16 1ttw s GLU 47 Cb 0.13 0.26 -0.06 0.00 -0.44 0.00 0.00 34.13 34.03 1ttw s GLU 47 CO 0.84 -0.18 -0.11 -0.48 0.95 0.00 0.00 175.26 176.28 1ttw s LEU 48 N -2.24 2.74 -0.03 1.83 0.05 -0.22 0.49 118.68 121.31 1ttw s LEU 48 Ca -0.03 -1.10 0.07 0.00 0.05 0.00 0.00 54.13 53.12 1ttw s LEU 48 Cb 0.00 -1.11 -0.02 0.00 -2.05 0.00 0.00 46.19 43.01 1ttw s LEU 48 CO -0.05 -0.12 -0.25 0.54 -0.55 0.00 0.00 176.35 175.91 1ttw s VAL 49 N -2.55 2.14 -0.12 1.48 0.11 0.11 -0.75 120.40 120.83 1ttw s VAL 49 Ca 0.32 -1.07 0.02 0.00 -2.93 0.00 0.00 61.98 58.32 1ttw s VAL 49 Cb -0.01 -1.75 -0.01 0.00 -1.53 0.00 0.00 36.38 33.08 1ttw s VAL 49 CO 0.17 0.58 -0.17 0.00 -3.33 0.00 0.00 175.10 172.34 1ttw s ALA 50 N -0.55 2.46 0.19 1.54 0.00 -0.81 -0.95 121.76 123.65 1ttw s ALA 50 Ca 0.08 -0.92 -0.14 0.00 0.00 0.00 0.00 51.96 50.98 1ttw s ALA 50 Cb -0.11 -1.06 0.01 0.00 0.00 0.00 0.00 23.12 21.97 1ttw s ALA 50 CO -0.00 0.28 0.44 -0.59 0.00 0.00 0.00 175.76 175.88 1ttw s PHE 51 N 0.30 0.13 -0.03 0.00 -0.12 0.11 -1.13 117.98 117.24 1ttw s PHE 51 Ca -0.13 -0.49 -0.29 0.00 -0.05 0.00 0.00 56.93 55.98 1ttw s PHE 51 Cb -0.16 0.21 0.09 0.00 -0.63 0.00 0.00 43.02 42.53 1ttw s PHE 51 CO 0.07 -0.87 0.80 0.00 -0.05 0.00 0.00 175.22 175.16 1ttw s MET 52 N -3.93 0.92 0.18 1.99 0.23 -0.62 -0.86 119.30 117.22 1ttw s MET 52 Ca 0.14 -0.04 -0.29 0.00 -1.03 0.00 0.00 55.69 54.47 1ttw s MET 52 Cb 0.00 0.43 -0.08 0.00 -1.53 0.00 0.00 34.83 33.66 1ttw s MET 52 CO 0.00 -0.34 0.92 -0.98 -2.03 0.00 0.00 175.02 172.59 1ttw s ARG 53 N -2.09 4.76 0.00 3.16 3.03 -1.26 -1.89 118.95 124.66 1ttw s ARG 53 Ca -0.03 1.43 0.00 0.00 2.03 0.00 0.00 55.73 59.16 1ttw s ARG 53 Cb -0.01 -3.31 0.00 0.00 -1.03 0.00 0.00 34.95 30.60 1ttw s ARG 53 CO -0.01 0.42 0.54 0.00 -1.13 0.00 0.00 175.30 175.12 1ttw n ALA 54 N 1.97 1.65 -1.01 7.88 0.00 -0.62 -4.82 120.51 125.56 1ttw n ALA 54 Ca -0.01 -0.54 0.12 0.00 0.00 0.00 0.00 53.44 53.01 1ttw n ALA 54 Cb 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.87 1ttw n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ttw n GLY 55 N -0.14 -2.96 3.53 0.00 0.00 -1.26 -4.62 105.19 99.74 1ttw n GLY 55 Ca 0.00 -1.18 -0.35 0.00 0.00 0.00 0.00 46.02 44.49 1ttw n GLY 55 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ttw n ILE 56 N -3.68 1.57 -1.95 -0.61 2.08 -1.26 -3.41 119.36 112.09 1ttw n ILE 56 Ca -0.06 -0.30 -0.42 0.00 0.56 0.00 0.00 62.75 62.54 1ttw n ILE 56 Cb 0.48 -0.88 -0.03 0.00 -0.75 0.00 0.00 39.64 38.47 1ttw n ILE 56 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1ttw s LEU 57 N -2.19 4.37 0.28 1.39 2.96 -1.09 -4.77 118.68 119.63 1ttw s LEU 57 Ca 0.67 2.66 -0.04 0.00 -0.22 0.00 0.00 54.13 57.19 1ttw s LEU 57 Cb -0.30 -3.61 0.55 0.00 0.50 0.00 0.00 46.19 43.34 1ttw s LEU 57 CO 0.57 -0.79 1.59 0.71 -1.32 0.00 0.00 176.35 177.11 1ttw h THR 58 N 3.82 0.14 0.00 3.68 1.35 -1.90 -3.42 112.91 116.58 1ttw h THR 58 Ca -0.44 -0.01 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 1ttw h THR 58 Cb 1.21 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 67.73 1ttw h THR 58 CO 0.86 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 176.75 1ttw n GLY 59 N -1.50 0.96 0.00 5.82 0.00 -1.26 -5.14 105.19 104.07 1ttw n GLY 59 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1ttw n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ttw n GLN 60 N 0.00 -1.33 -0.52 1.61 0.00 -1.26 -5.08 117.38 110.79 1ttw n GLN 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.00 1ttw n GLN 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1ttw n GLN 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1ttw n SER 61 N 0.14 -2.16 0.12 2.61 3.41 -1.26 -4.52 113.62 111.96 1ttw n SER 61 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1ttw n SER 61 Cb 0.00 -2.14 0.01 0.00 -0.26 0.00 0.00 64.21 61.82 1ttw n SER 61 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 1ttw h GLN 62 N 0.00 0.00 -0.65 4.33 3.07 -1.99 -3.32 115.11 116.55 1ttw h GLN 62 Ca 0.00 0.00 0.06 0.00 0.09 0.00 0.00 58.65 58.80 1ttw h GLN 62 Cb 0.36 0.00 -0.08 0.00 0.08 0.00 0.00 27.48 27.84 1ttw h GLN 62 CO 0.00 0.66 -0.38 1.28 0.09 0.00 0.00 178.83 180.47 1ttw n LEU 63 N -3.31 -0.69 -0.29 0.06 4.77 -1.26 -0.77 117.00 115.51 1ttw n LEU 63 Ca 0.01 1.19 -0.03 0.00 -0.03 0.00 0.00 56.01 57.16 1ttw n LEU 63 Cb 0.78 -0.17 0.09 0.00 -2.33 0.00 0.00 43.42 41.79 1ttw n LEU 63 CO 0.42 -0.96 1.20 1.88 -1.33 0.00 0.00 177.39 178.60 1ttw h TYR 64 N 0.00 0.98 -0.43 -1.77 -1.99 -1.95 -1.70 116.97 110.11 1ttw h TYR 64 Ca 0.10 0.03 -0.10 0.00 2.00 0.00 0.00 58.73 60.76 1ttw h TYR 64 Cb 0.27 -0.33 -0.01 0.00 2.00 0.00 0.00 36.73 38.66 1ttw h TYR 64 CO -0.70 0.58 -0.11 -0.44 -0.00 0.00 0.00 178.16 177.48 1ttw h ASP 65 N 1.03 0.83 0.39 3.88 5.19 -1.06 0.13 116.42 126.81 1ttw h ASP 65 Ca 0.32 -0.36 -0.02 0.00 -0.62 0.00 0.00 57.03 56.35 1ttw h ASP 65 Cb -0.02 -0.23 -0.00 0.00 0.18 0.00 0.00 39.33 39.26 1ttw h ASP 65 CO -0.10 1.01 -0.21 0.40 -3.12 0.00 0.00 179.24 177.21 1ttw h ILE 66 N 0.65 0.57 -1.00 0.35 2.04 -1.07 -2.93 117.51 116.12 1ttw h ILE 66 Ca 0.11 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.18 1ttw h ILE 66 Cb 0.64 0.57 -0.11 0.00 -0.74 0.00 0.00 36.82 37.18 1ttw h ILE 66 CO 0.04 0.00 0.61 -0.07 0.00 0.00 0.00 178.15 178.74 1ttw h LEU 67 N -0.56 0.72 -1.72 1.44 -0.00 -0.99 0.77 115.31 114.98 1ttw h LEU 67 Ca -0.05 0.10 -0.04 0.00 -0.00 0.00 0.00 57.88 57.90 1ttw h LEU 67 Cb 0.44 -0.02 -0.01 0.00 -0.00 0.00 0.00 40.66 41.07 1ttw h LEU 67 CO 0.07 0.22 -0.18 0.03 -0.00 0.00 0.00 178.44 178.58 1ttw h ARG 68 N 0.69 0.00 -0.52 1.13 3.08 -1.01 -2.86 114.38 114.88 1ttw h ARG 68 Ca 0.59 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.64 1ttw h ARG 68 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.07 1ttw h ARG 68 CO -0.39 0.18 0.00 1.63 -1.07 0.00 0.00 179.97 180.32 1ttw n LYS 69 N -3.85 2.58 -1.81 0.04 5.02 0.26 -4.68 118.16 115.73 1ttw n LYS 69 Ca -0.02 -2.41 -0.34 0.00 -2.02 0.00 0.00 58.31 53.52 1ttw n LYS 69 Cb 0.27 -1.51 -0.02 0.00 -0.02 0.00 0.00 35.03 33.75 1ttw n LYS 69 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1ttw n ASN 70 N 1.46 7.25 -4.91 4.39 5.15 -0.70 -4.92 115.26 122.99 1ttw n ASN 70 Ca 0.21 -3.26 -0.20 0.00 -0.60 0.00 0.00 54.58 50.73 1ttw n ASN 70 Cb 0.59 -1.27 -0.02 0.00 -0.53 0.00 0.00 39.78 38.55 1ttw n ASN 70 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1ttw s LEU 71 N -2.44 3.52 0.61 1.20 1.43 -1.26 -5.05 118.68 116.69 1ttw s LEU 71 Ca 0.55 -0.60 -0.10 0.00 -1.03 0.00 0.00 54.13 52.95 1ttw s LEU 71 Cb 0.29 -2.26 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1ttw s LEU 71 CO -0.18 -0.62 1.00 0.72 0.23 0.00 0.00 176.35 177.50 1ttw s PHE 72 N -2.40 3.60 -0.01 0.29 -0.12 -1.26 -5.08 117.98 113.00 1ttw s PHE 72 Ca 0.49 1.21 -0.06 0.00 -0.05 0.00 0.00 56.93 58.51 1ttw s PHE 72 Cb -0.06 -2.68 0.00 0.00 -0.63 0.00 0.00 43.02 39.66 1ttw s PHE 72 CO 0.29 -0.66 0.13 0.45 -0.05 0.00 0.00 175.22 175.38 1ttw s SER 73 N -4.18 0.00 0.45 1.98 0.15 -1.26 -4.99 113.70 105.86 1ttw s SER 73 Ca 0.54 -0.12 0.31 0.00 0.70 0.00 0.00 55.95 57.38 1ttw s SER 73 Cb -0.11 0.22 1.54 0.00 -1.71 0.00 0.00 66.02 65.96 1ttw s SER 73 CO 0.53 -0.30 1.94 1.55 1.20 0.00 0.00 173.24 178.16 1ttw h PRO 74 N 4.65 0.00 -6.33 5.44 0.14 -2.08 -3.44 132.00 130.38 1ttw h PRO 74 Ca -0.30 0.00 -0.60 0.00 0.14 0.00 0.00 66.00 65.24 1ttw h PRO 74 Cb 1.20 0.00 -0.11 0.00 0.14 0.00 0.00 31.00 32.23 1ttw h PRO 74 CO 0.41 0.00 -0.65 -0.51 0.14 0.00 0.00 178.00 177.38 1ttw s LEU 75 N -5.30 3.35 0.56 1.56 2.01 -1.26 -5.10 118.68 114.50 1ttw s LEU 75 Ca -0.01 -0.38 -0.03 0.00 0.01 0.00 0.00 54.13 53.72 1ttw s LEU 75 Cb 0.09 -2.00 0.02 0.00 0.01 0.00 0.00 46.19 44.31 1ttw s LEU 75 CO 0.36 0.09 0.83 -0.44 1.01 0.00 0.00 176.35 178.20 1ttw s SER 76 N -2.94 5.47 0.00 2.29 0.01 -1.26 -4.09 113.70 113.19 1ttw s SER 76 Ca 0.28 0.42 0.00 0.00 1.31 0.00 0.00 55.95 57.95 1ttw s SER 76 Cb -0.09 -1.40 0.00 0.00 0.21 0.00 0.00 66.02 64.73 1ttw s SER 76 CO 0.19 -1.06 0.00 0.61 0.41 0.00 0.00 173.24 173.38 1ttw n GLY 77 N -2.45 0.59 3.73 3.44 0.00 -1.26 -5.01 105.19 104.22 1ttw n GLY 77 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1ttw n GLY 77 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ttw n VAL 78 N -2.35 3.16 -3.82 1.61 0.31 -1.26 -4.95 118.33 111.04 1ttw n VAL 78 Ca 0.00 -0.50 -0.36 0.00 -0.01 0.00 0.00 64.34 63.47 1ttw n VAL 78 Cb 0.05 -1.67 -0.07 0.00 -0.91 0.00 0.00 33.84 31.25 1ttw n VAL 78 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1ttw s ILE 79 N -1.25 5.41 0.13 2.52 -1.09 -1.26 -4.44 121.20 121.23 1ttw s ILE 79 Ca 0.66 0.18 0.09 0.00 -2.23 0.00 0.00 60.65 59.35 1ttw s ILE 79 Cb -0.45 -3.42 -0.04 0.00 -1.58 0.00 0.00 42.46 36.97 1ttw s ILE 79 CO 0.54 0.52 -0.21 -0.13 -1.23 0.00 0.00 174.94 174.43 1ttw s ARG 80 N -0.26 1.24 -0.02 2.79 1.81 0.20 -4.92 118.95 119.78 1ttw s ARG 80 Ca 0.11 -1.29 0.06 0.00 -1.72 0.00 0.00 55.73 52.89 1ttw s ARG 80 Cb -0.11 -1.48 -0.01 0.00 -0.45 0.00 0.00 34.95 32.90 1ttw s ARG 80 CO 0.01 0.33 -0.20 0.00 -0.68 0.00 0.00 175.30 174.76 1ttw s ALA 82 N -0.42 2.44 -0.12 0.00 0.00 0.04 -4.99 121.76 118.72 1ttw s ALA 82 Ca 0.06 -1.95 -0.07 0.00 0.00 0.00 0.00 51.96 50.01 1ttw s ALA 82 Cb -0.08 0.20 -0.04 0.00 0.00 0.00 0.00 23.12 23.19 1ttw s ALA 82 CO -0.00 -0.07 0.12 -0.51 0.00 0.00 0.00 175.76 175.29 1ttw s LEU 83 N -3.47 4.28 0.43 0.00 1.43 -1.26 0.38 118.68 120.45 1ttw s LEU 83 Ca 0.31 0.41 -0.23 0.00 -1.03 0.00 0.00 54.13 53.59 1ttw s LEU 83 Cb 0.04 -2.04 -0.12 0.00 0.03 0.00 0.00 46.19 44.10 1ttw s LEU 83 CO 0.13 0.39 0.66 -0.67 0.23 0.00 0.00 176.35 177.09 1ttw n ASP 84 N 2.09 -0.38 -0.34 2.29 2.03 -0.67 -4.91 116.55 116.65 1ttw n ASP 84 Ca -0.20 0.93 -0.07 0.00 0.52 0.00 0.00 54.79 55.97 1ttw n ASP 84 Cb 0.55 -1.17 -0.05 0.00 -0.72 0.00 0.00 41.12 39.72 1ttw n ASP 84 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 1ttw n LYS 85 N 0.43 -0.32 -0.76 -0.67 0.00 -1.26 -0.77 118.16 114.80 1ttw n LYS 85 Ca 0.11 1.26 -0.13 0.00 -0.00 0.00 0.00 58.31 59.55 1ttw n LYS 85 Cb 0.40 -1.86 0.05 0.00 -0.00 0.00 0.00 35.03 33.62 1ttw n LYS 85 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1ttw n ASP 86 N -5.08 5.53 -1.76 -5.58 -0.08 -1.26 -4.91 116.55 103.39 1ttw n ASP 86 Ca 0.03 -2.91 -0.15 0.00 -1.51 0.00 0.00 54.79 50.26 1ttw n ASP 86 Cb 0.25 -0.95 -0.05 0.00 2.34 0.00 0.00 41.12 42.71 1ttw n ASP 86 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1ttw n ASP 87 N 0.30 -4.15 -4.78 1.67 9.92 0.05 -4.99 116.55 114.56 1ttw n ASP 87 Ca 0.26 0.29 -0.39 0.00 -0.53 0.00 0.00 54.79 54.42 1ttw n ASP 87 Cb 0.68 -3.70 -0.06 0.00 -0.64 0.00 0.00 41.12 37.40 1ttw n ASP 87 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 1ttw s HIS 88 N -2.43 3.87 0.30 1.24 3.76 -1.26 -2.67 115.29 118.10 1ttw s HIS 88 Ca 0.00 1.57 -0.30 0.00 -0.15 0.00 0.00 55.06 56.18 1ttw s HIS 88 Cb 0.00 -2.74 -0.12 0.00 1.11 0.00 0.00 32.58 30.83 1ttw s HIS 88 CO 0.00 0.49 1.57 0.91 -0.85 0.00 0.00 174.74 176.87 1ttw n TRP 89 N 1.77 2.83 -4.95 1.40 7.02 -1.22 -1.68 117.44 122.62 1ttw n TRP 89 Ca -0.06 0.28 -0.32 0.00 -1.02 0.00 0.00 57.50 56.39 1ttw n TRP 89 Cb 0.49 -2.58 -0.17 0.00 -2.42 0.00 0.00 31.31 26.63 1ttw n TRP 89 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 1ttw s LEU 90 N -0.60 2.08 0.14 -0.99 0.20 0.16 -1.58 118.68 118.09 1ttw s LEU 90 Ca 0.63 -0.57 0.09 0.00 0.69 0.00 0.00 54.13 54.98 1ttw s LEU 90 Cb -0.50 -1.40 -0.04 0.00 -0.43 0.00 0.00 46.19 43.81 1ttw s LEU 90 CO 0.50 0.12 -0.18 -0.76 -0.29 0.00 0.00 176.35 175.74 1ttw s LEU 91 N 0.57 2.68 0.10 -0.68 1.43 -0.79 -0.78 118.68 121.21 1ttw s LEU 91 Ca -0.13 -0.63 -0.25 0.00 -1.03 0.00 0.00 54.13 52.09 1ttw s LEU 91 Cb -0.17 -1.48 0.08 0.00 0.03 0.00 0.00 46.19 44.65 1ttw s LEU 91 CO 0.04 0.16 0.73 -1.66 0.23 0.00 0.00 176.35 175.84 1ttw s TRP 92 N -1.32 -0.44 0.04 0.29 1.48 -0.37 -1.59 118.94 117.03 1ttw s TRP 92 Ca 0.19 0.24 -0.00 0.00 -1.06 0.00 0.00 56.10 55.47 1ttw s TRP 92 Cb -0.10 0.56 -0.03 0.00 -1.16 0.00 0.00 33.47 32.74 1ttw s TRP 92 CO 0.11 -0.75 -0.03 0.45 -4.06 0.00 0.00 176.95 172.66 1ttw s SER 93 N -2.66 0.40 -0.02 -2.66 0.15 -0.28 -0.63 113.70 108.01 1ttw s SER 93 Ca 0.03 -0.71 0.03 0.00 0.70 0.00 0.00 55.95 56.00 1ttw s SER 93 Cb -0.01 0.13 -0.00 0.00 -1.71 0.00 0.00 66.02 64.43 1ttw s SER 93 CO -0.10 -0.41 -0.10 -1.58 1.20 0.00 0.00 173.24 172.24 1ttw s GLN 94 N -2.47 0.97 -0.01 5.44 0.74 -1.26 -1.92 119.66 121.15 1ttw s GLN 94 Ca -0.06 -0.36 -0.03 0.00 0.05 0.00 0.00 55.36 54.96 1ttw s GLN 94 Cb -0.03 -0.91 -0.00 0.00 1.10 0.00 0.00 33.01 33.17 1ttw s GLN 94 CO -0.04 0.18 0.06 -0.51 -0.55 0.00 0.00 175.29 174.43 1ttw s LEU 95 N -0.03 1.81 -0.07 3.68 1.43 0.07 -4.55 118.68 121.02 1ttw s LEU 95 Ca 0.00 -0.12 -0.30 0.00 -1.03 0.00 0.00 54.13 52.68 1ttw s LEU 95 Cb -0.07 0.33 -0.03 0.00 0.03 0.00 0.00 46.19 46.46 1ttw s LEU 95 CO 0.00 -0.20 1.17 0.21 0.23 0.00 0.00 176.35 177.76 1ttw s ASN 96 N -0.76 7.08 0.42 2.29 3.84 -1.26 -1.06 114.94 125.48 1ttw s ASN 96 Ca -0.08 1.75 0.23 0.00 0.21 0.00 0.00 52.86 54.96 1ttw s ASN 96 Cb -0.05 -2.56 0.78 0.00 -0.55 0.00 0.00 41.25 38.87 1ttw s ASN 96 CO 0.00 -0.57 1.76 0.40 -2.79 0.00 0.00 177.10 175.90 1ttw h ILE 97 N 5.07 0.58 0.00 -5.21 2.04 -1.66 -2.53 117.51 115.79 1ttw h ILE 97 Ca -0.33 -1.27 -0.05 0.00 1.00 0.00 0.00 64.86 64.22 1ttw h ILE 97 Cb 1.15 1.87 -0.01 0.00 -0.74 0.00 0.00 36.82 39.09 1ttw h ILE 97 CO 0.88 0.25 -1.21 -3.20 0.00 0.00 0.00 178.15 174.87 1ttw n ASN 98 N -3.36 0.77 -0.30 1.72 2.85 -1.26 -4.14 115.26 111.54 1ttw n ASN 98 Ca 0.01 0.31 0.14 0.00 -0.11 0.00 0.00 54.58 54.93 1ttw n ASN 98 Cb 0.48 0.52 0.63 0.00 1.24 0.00 0.00 39.78 42.64 1ttw n ASN 98 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1ttw n ASP 99 N -2.69 0.97 -4.09 1.20 8.00 -0.97 -4.88 116.55 114.08 1ttw n ASP 99 Ca -0.03 -1.22 -0.32 0.00 0.71 0.00 0.00 54.79 53.93 1ttw n ASP 99 Cb 0.63 0.00 -0.16 0.00 -0.02 0.00 0.00 41.12 41.58 1ttw n ASP 99 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ttw s THR 100 N -2.10 2.02 0.66 -3.53 2.01 -1.13 -5.00 115.64 108.57 1ttw s THR 100 Ca 0.38 -1.09 -0.07 0.00 0.31 0.00 0.00 61.69 61.23 1ttw s THR 100 Cb 0.21 -1.92 0.04 0.00 0.01 0.00 0.00 72.50 70.84 1ttw s THR 100 CO 0.38 0.37 0.98 -0.94 -0.69 0.00 0.00 174.62 174.72 1ttw s SER 101 N 1.27 5.13 0.42 3.53 1.04 -1.26 -4.88 113.70 118.95 1ttw s SER 101 Ca 0.01 0.59 0.11 0.00 0.48 0.00 0.00 55.95 57.14 1ttw s SER 101 Cb -0.15 -1.37 0.91 0.00 0.10 0.00 0.00 66.02 65.52 1ttw s SER 101 CO -0.11 -1.39 2.00 1.23 0.98 0.00 0.00 173.24 175.95 1ttw h GLY 102 N -0.45 0.25 2.00 7.32 0.00 -1.83 -1.17 103.07 109.18 1ttw h GLY 102 Ca -0.45 -0.12 -0.10 0.00 0.00 0.00 0.00 47.33 46.66 1ttw h GLY 102 CO 0.61 0.12 -0.46 -0.91 0.00 0.00 0.00 176.54 175.90 1ttw h THR 103 N 0.23 0.84 -0.51 4.70 1.35 -1.93 -2.21 112.91 115.38 1ttw h THR 103 Ca 0.05 -1.99 -0.06 0.00 -0.55 0.00 0.00 66.41 63.86 1ttw h THR 103 Cb 0.21 2.27 -0.02 0.00 -1.73 0.00 0.00 68.15 68.88 1ttw h THR 103 CO 0.01 0.45 0.07 1.56 -0.25 0.00 0.00 175.52 177.35 1ttw h GLN 104 N 0.00 0.85 -0.32 4.72 4.20 -1.69 -1.98 115.11 120.89 1ttw h GLN 104 Ca -0.00 -0.23 0.01 0.00 0.06 0.00 0.00 58.65 58.48 1ttw h GLN 104 Cb 1.23 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.90 1ttw h GLN 104 CO 0.06 0.85 0.20 1.25 -0.67 0.00 0.00 178.83 180.52 1ttw h LEU 105 N 0.73 0.35 -1.20 1.46 6.46 -1.02 0.14 115.31 122.23 1ttw h LEU 105 Ca 0.15 -0.00 0.06 0.00 -0.12 0.00 0.00 57.88 57.97 1ttw h LEU 105 Cb 0.42 -0.08 -0.05 0.00 -0.73 0.00 0.00 40.66 40.21 1ttw h LEU 105 CO 0.01 0.25 0.56 0.00 -0.62 0.00 0.00 178.44 178.64 1ttw h ALA 106 N 1.13 1.54 -0.97 1.25 0.00 -1.35 0.56 119.26 121.41 1ttw h ALA 106 Ca 0.12 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1ttw h ALA 106 Cb -0.03 -0.26 -0.07 0.00 0.00 0.00 0.00 17.79 17.43 1ttw h ALA 106 CO -0.04 0.34 0.62 1.03 0.00 0.00 0.00 179.25 181.20 1ttw h SER 107 N 0.98 0.96 -0.01 0.00 0.87 -0.50 -0.82 113.55 115.04 1ttw h SER 107 Ca 0.36 0.02 -0.17 0.00 -1.23 0.00 0.00 61.79 60.77 1ttw h SER 107 Cb 0.17 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.95 1ttw h SER 107 CO -0.13 0.59 -0.60 0.58 -0.53 0.00 0.00 176.83 176.74 1ttw h VAL 108 N 1.08 1.32 -0.17 2.23 2.07 0.28 -0.04 116.25 123.02 1ttw h VAL 108 Ca 0.44 -1.85 -0.06 0.00 0.82 0.00 0.00 66.70 66.05 1ttw h VAL 108 Cb 0.26 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 1ttw h VAL 108 CO -0.20 0.58 -0.14 -0.07 0.02 0.00 0.00 177.57 177.76 1ttw h LEU 109 N 0.46 0.27 0.04 2.57 3.38 0.00 0.27 115.31 122.29 1ttw h LEU 109 Ca -0.00 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ttw h LEU 109 Cb 1.16 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1ttw h LEU 109 CO 0.12 0.43 -0.02 0.74 0.09 0.00 0.00 178.44 179.80 1ttw h THR 110 N 0.26 1.25 -0.13 0.22 2.02 -0.70 0.23 112.91 116.07 1ttw h THR 110 Ca 0.05 -0.94 0.04 0.00 0.77 0.00 0.00 66.41 66.33 1ttw h THR 110 Cb 0.41 1.87 -0.01 0.00 -1.74 0.00 0.00 68.15 68.68 1ttw h THR 110 CO 0.02 0.24 0.11 0.28 0.37 0.00 0.00 175.52 176.54 1ttw h SER 111 N -0.46 0.00 0.47 4.18 0.02 -0.37 0.14 113.55 117.53 1ttw h SER 111 Ca -0.01 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1ttw h SER 111 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 1ttw h SER 111 CO 0.01 0.00 -0.23 0.25 -1.14 0.00 0.00 176.83 175.72 1ttw h LEU 112 N 0.00 -0.54 -1.63 5.07 5.85 0.65 -2.17 115.31 122.55 1ttw h LEU 112 Ca 0.06 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.78 1ttw h LEU 112 Cb 0.29 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1ttw h LEU 112 CO -0.00 -0.14 0.35 0.58 -0.34 0.00 0.00 178.44 178.89 1ttw h VAL 113 N -1.05 0.97 -0.08 1.05 2.07 -0.24 -1.93 116.25 117.03 1ttw h VAL 113 Ca -0.07 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.33 1ttw h VAL 113 Cb 0.57 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 1ttw h VAL 113 CO 0.11 0.08 -0.08 0.44 0.02 0.00 0.00 177.57 178.14 1ttw h ASP 114 N 0.45 -0.25 -0.59 0.57 3.32 -0.51 -2.30 116.42 117.11 1ttw h ASP 114 Ca 0.23 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.32 1ttw h ASP 114 Cb 0.33 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 1ttw h ASP 114 CO -0.06 -0.11 0.34 0.50 -1.72 0.00 0.00 179.24 178.19 1ttw h LYS 115 N -0.10 0.84 -0.06 3.56 3.11 -0.91 -2.10 116.57 120.91 1ttw h LYS 115 Ca 0.06 -0.08 -0.07 0.00 -2.81 0.00 0.00 60.65 57.75 1ttw h LYS 115 Cb 0.19 -0.17 -0.01 0.00 -1.00 0.00 0.00 32.23 31.24 1ttw h LYS 115 CO -0.15 0.61 -0.28 0.00 -2.81 0.00 0.00 179.45 176.83 1ttw h ALA 116 N 1.53 1.42 -0.07 5.00 0.00 -0.83 -1.30 119.26 125.01 1ttw h ALA 116 Ca 0.22 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1ttw h ALA 116 Cb 0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1ttw h ALA 116 CO -0.04 0.42 -0.10 0.28 0.00 0.00 0.00 179.25 179.81 1ttw h VAL 117 N 0.10 1.40 -0.34 0.00 2.07 -0.95 -0.27 116.25 118.25 1ttw h VAL 117 Ca 0.02 -1.34 -0.02 0.00 0.82 0.00 0.00 66.70 66.17 1ttw h VAL 117 Cb 0.55 2.14 -0.02 0.00 -1.52 0.00 0.00 31.29 32.44 1ttw h VAL 117 CO 0.04 0.37 0.14 0.74 0.02 0.00 0.00 177.57 178.88 1ttw h THR 118 N -0.29 1.13 0.00 2.57 2.02 -1.28 -1.20 112.91 115.86 1ttw h THR 118 Ca 0.01 -0.42 -0.09 0.00 0.77 0.00 0.00 66.41 66.67 1ttw h THR 118 Cb 0.65 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1ttw h THR 118 CO 0.02 0.16 -0.44 -0.07 0.37 0.00 0.00 175.52 175.56 1ttw h LEU 119 N 0.48 0.00 -1.86 2.58 3.38 -1.11 -3.51 115.31 115.26 1ttw h LEU 119 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1ttw h LEU 119 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1ttw h LEU 119 CO -0.01 0.44 0.00 -1.20 0.09 0.00 0.00 178.44 177.76