#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ttc n PRO 2 N 0.00 0.00 -2.40 1.61 -0.04 -1.06 -4.47 135.00 128.64 1ttc n PRO 2 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1ttc n PRO 2 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1ttc n PRO 2 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1ttc n THR 3 N 0.00 0.00 0.00 0.52 -1.04 -1.26 -4.49 114.28 108.01 1ttc n THR 3 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1ttc n THR 3 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1ttc n THR 3 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ttc n GLY 4 N 0.00 0.29 3.16 3.41 0.00 -1.26 -4.82 105.19 105.98 1ttc n GLY 4 Ca 0.00 -1.37 -0.39 0.00 0.00 0.00 0.00 46.02 44.26 1ttc n GLY 4 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ttc s THR 5 N 0.00 4.49 0.00 2.61 2.01 -1.26 -4.35 115.64 119.15 1ttc s THR 5 Ca 0.00 -3.28 0.00 0.00 0.31 0.00 0.00 61.69 58.72 1ttc s THR 5 Cb 0.00 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.69 1ttc s THR 5 CO 0.00 -1.01 0.00 0.61 -0.69 0.00 0.00 174.62 173.53 1ttc n GLY 6 N 3.04 -1.39 0.00 4.40 0.00 -1.26 -4.93 105.19 105.05 1ttc n GLY 6 Ca 0.16 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1ttc n GLY 6 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ttc n GLU 7 N -0.13 0.00 0.00 1.61 2.13 -0.78 -4.66 120.64 118.81 1ttc n GLU 7 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1ttc n GLU 7 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1ttc n GLU 7 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1ttc n SER 8 N 0.00 0.00 -0.04 4.31 7.64 0.77 -4.31 113.62 121.99 1ttc n SER 8 Ca 0.00 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.89 1ttc n SER 8 Cb 0.00 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 1ttc n SER 8 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1ttc n LYS 9 N 0.00 1.86 -2.02 1.43 3.00 -1.24 -2.23 118.16 118.96 1ttc n LYS 9 Ca 0.00 -1.40 -0.14 0.00 -0.00 0.00 0.00 58.31 56.77 1ttc n LYS 9 Cb 0.00 -0.93 0.01 0.00 0.00 0.00 0.00 35.03 34.12 1ttc n LYS 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ttc h PRO 11 N 0.75 0.00 -3.54 0.00 0.13 -1.88 -3.44 132.00 124.02 1ttc h PRO 11 Ca -0.22 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.47 1ttc h PRO 11 Cb 0.52 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.26 1ttc h PRO 11 CO 0.09 0.00 -0.76 -1.17 -0.23 0.00 0.00 178.00 175.93 1ttc s LEU 12 N -5.07 0.59 0.03 1.56 2.96 -1.26 0.48 118.68 117.97 1ttc s LEU 12 Ca 0.09 -0.24 0.06 0.00 -0.22 0.00 0.00 54.13 53.82 1ttc s LEU 12 Cb 0.10 -0.40 -0.02 0.00 0.50 0.00 0.00 46.19 46.37 1ttc s LEU 12 CO 0.63 -0.24 -0.19 -0.32 -1.32 0.00 0.00 176.35 174.91 1ttc s MET 13 N 2.00 1.34 -0.05 1.98 -2.45 -0.60 -4.44 119.30 117.08 1ttc s MET 13 Ca 0.04 -0.83 0.03 0.00 -1.25 0.00 0.00 55.69 53.69 1ttc s MET 13 Cb -0.13 -1.39 0.00 0.00 1.25 0.00 0.00 34.83 34.56 1ttc s MET 13 CO -0.06 0.36 -0.16 0.08 1.05 0.00 0.00 175.02 176.30 1ttc s VAL 14 N -0.70 1.36 -0.05 10.11 1.01 -0.95 -1.28 120.40 129.90 1ttc s VAL 14 Ca 0.06 -0.65 0.05 0.00 0.00 0.00 0.00 61.98 61.44 1ttc s VAL 14 Cb -0.08 -1.19 -0.00 0.00 0.00 0.00 0.00 36.38 35.10 1ttc s VAL 14 CO 0.01 0.40 -0.20 -0.75 0.00 0.00 0.00 175.10 174.56 1ttc s LYS 15 N 0.28 2.08 -0.05 2.72 2.20 -0.29 -1.69 119.74 124.99 1ttc s LYS 15 Ca -0.09 -0.70 0.03 0.00 -0.36 0.00 0.00 55.97 54.85 1ttc s LYS 15 Cb -0.13 -1.77 0.01 0.00 -1.51 0.00 0.00 37.83 34.43 1ttc s LYS 15 CO 0.03 0.27 -0.14 0.08 -0.36 0.00 0.00 175.35 175.23 1ttc s VAL 16 N 0.03 1.21 0.12 4.02 1.01 -0.24 -1.44 120.40 125.12 1ttc s VAL 16 Ca -0.05 -0.56 0.09 0.00 0.00 0.00 0.00 61.98 61.46 1ttc s VAL 16 Cb -0.13 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 1ttc s VAL 16 CO 0.03 0.36 -0.23 -0.76 0.00 0.00 0.00 175.10 174.51 1ttc s LEU 17 N 0.35 2.33 -0.22 3.92 1.43 -0.33 -1.77 118.68 124.39 1ttc s LEU 17 Ca -0.09 -0.74 -0.06 0.00 -1.03 0.00 0.00 54.13 52.21 1ttc s LEU 17 Cb -0.13 -1.00 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 1ttc s LEU 17 CO 0.03 0.09 0.04 -0.62 0.23 0.00 0.00 176.35 176.11 1ttc s ASP 18 N -2.10 5.00 0.00 2.29 -1.08 0.49 -1.02 116.67 120.26 1ttc s ASP 18 Ca 0.11 -0.19 0.27 0.00 -0.52 0.00 0.00 52.55 52.21 1ttc s ASP 18 Cb -0.09 -1.88 0.85 0.00 -1.46 0.00 0.00 42.92 40.34 1ttc s ASP 18 CO 0.05 0.02 1.65 0.00 0.52 0.00 0.00 175.17 177.41 1ttc n ALA 19 N 4.55 3.01 -0.04 3.66 0.00 -0.55 -2.01 120.51 129.13 1ttc n ALA 19 Ca -0.17 -0.25 -0.21 0.00 0.00 0.00 0.00 53.44 52.81 1ttc n ALA 19 Cb 0.52 -1.27 -0.13 0.00 0.00 0.00 0.00 19.45 18.57 1ttc n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ttc h VAL 20 N 0.08 0.99 0.00 0.00 2.07 -1.95 -3.40 116.25 114.05 1ttc h VAL 20 Ca 0.00 -2.30 0.00 0.00 0.82 0.00 0.00 66.70 65.22 1ttc h VAL 20 Cb 0.49 2.55 0.00 0.00 -1.52 0.00 0.00 31.29 32.81 1ttc h VAL 20 CO 0.00 0.58 -1.09 0.54 0.02 0.00 0.00 177.57 177.62 1ttc n ARG 21 N -4.11 0.07 -2.89 1.57 1.74 -1.26 -5.02 116.66 106.77 1ttc n ARG 21 Ca -0.27 -0.02 -0.11 0.00 -0.77 0.00 0.00 57.85 56.67 1ttc n ARG 21 Cb 0.80 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.80 1ttc n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ttc n GLY 22 N 1.47 -0.30 3.65 -0.13 0.00 -0.85 -5.04 105.19 103.99 1ttc n GLY 22 Ca 0.03 0.09 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 1ttc n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ttc s SER 23 N -3.67 -0.02 0.58 1.61 1.04 -1.08 -5.00 113.70 107.16 1ttc s SER 23 Ca 0.13 -0.94 -0.20 0.00 0.48 0.00 0.00 55.95 55.43 1ttc s SER 23 Cb -0.02 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 1ttc s SER 23 CO 0.51 -1.24 1.25 -2.16 0.98 0.00 0.00 173.24 172.58 1ttc s PRO 24 N -3.77 2.99 -0.49 4.02 0.04 -1.26 -0.38 135.00 136.15 1ttc s PRO 24 Ca 0.21 1.94 -0.20 0.00 0.04 0.00 0.00 61.00 62.99 1ttc s PRO 24 Cb -0.02 -2.01 0.05 0.00 0.04 0.00 0.00 34.50 32.55 1ttc s PRO 24 CO 0.10 -1.22 0.65 0.00 0.04 0.00 0.00 177.00 176.57 1ttc s ALA 25 N -1.49 3.36 0.11 8.56 0.00 -0.73 -4.63 121.76 126.93 1ttc s ALA 25 Ca 0.76 -1.58 -0.06 0.00 0.00 0.00 0.00 51.96 51.09 1ttc s ALA 25 Cb -0.33 -3.36 -0.06 0.00 0.00 0.00 0.00 23.12 19.37 1ttc s ALA 25 CO 0.37 -1.98 0.37 0.42 0.00 0.00 0.00 175.76 174.94 1ttc s ILE 26 N 2.76 5.17 -1.37 0.00 1.01 -1.26 -4.35 121.20 123.15 1ttc s ILE 26 Ca 0.18 0.14 -0.02 0.00 0.00 0.00 0.00 60.65 60.94 1ttc s ILE 26 Cb -0.17 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.68 1ttc s ILE 26 CO 0.14 0.13 0.32 -3.20 0.00 0.00 0.00 174.94 172.34 1ttc n ASN 27 N 0.39 -5.29 -4.67 3.58 5.15 -0.71 -4.94 115.26 108.77 1ttc n ASN 27 Ca -0.05 -0.16 -0.39 0.00 -0.60 0.00 0.00 54.58 53.38 1ttc n ASN 27 Cb 0.52 -4.22 -0.06 0.00 -0.53 0.00 0.00 39.78 35.49 1ttc n ASN 27 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1ttc s VAL 28 N -3.00 5.07 0.33 3.44 1.01 -1.26 -4.72 120.40 121.27 1ttc s VAL 28 Ca 0.16 1.08 -0.20 0.00 0.00 0.00 0.00 61.98 63.02 1ttc s VAL 28 Cb -0.07 -3.90 -0.10 0.00 0.00 0.00 0.00 36.38 32.32 1ttc s VAL 28 CO 0.20 0.16 0.84 0.00 0.00 0.00 0.00 175.10 176.30 1ttc s ALA 29 N 1.64 3.24 -0.11 5.51 0.00 -1.26 -0.44 121.76 130.34 1ttc s ALA 29 Ca 0.27 0.29 -0.24 0.00 0.00 0.00 0.00 51.96 52.28 1ttc s ALA 29 Cb -0.16 -2.99 0.06 0.00 0.00 0.00 0.00 23.12 20.03 1ttc s ALA 29 CO 0.10 0.24 0.57 0.00 0.00 0.00 0.00 175.76 176.67 1ttc s MET 30 N -2.57 0.84 -0.03 0.00 0.23 0.34 -0.92 119.30 117.19 1ttc s MET 30 Ca 0.53 0.38 0.07 0.00 -1.03 0.00 0.00 55.69 55.64 1ttc s MET 30 Cb -0.13 0.39 -0.02 0.00 -1.53 0.00 0.00 34.83 33.54 1ttc s MET 30 CO 0.19 -0.20 -0.25 -1.01 -2.03 0.00 0.00 175.02 171.71 1ttc s HIS 31 N -0.64 2.34 -0.08 3.16 3.76 -0.72 -1.47 115.29 121.64 1ttc s HIS 31 Ca -0.07 -0.52 0.03 0.00 -0.15 0.00 0.00 55.06 54.35 1ttc s HIS 31 Cb -0.03 -1.51 -0.02 0.00 1.11 0.00 0.00 32.58 32.13 1ttc s HIS 31 CO 0.05 -0.09 -0.17 0.08 -0.85 0.00 0.00 174.74 173.76 1ttc s VAL 32 N -0.47 2.78 0.13 -0.90 1.01 0.18 -1.22 120.40 121.91 1ttc s VAL 32 Ca 0.06 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.31 1ttc s VAL 32 Cb -0.11 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 1ttc s VAL 32 CO 0.00 0.56 -0.16 -0.36 0.00 0.00 0.00 175.10 175.14 1ttc s PHE 33 N -0.15 1.55 -0.06 5.22 0.08 -0.11 -1.15 117.98 123.35 1ttc s PHE 33 Ca -0.02 -0.51 0.03 0.00 0.12 0.00 0.00 56.93 56.56 1ttc s PHE 33 Cb -0.14 -0.81 0.00 0.00 -0.57 0.00 0.00 43.02 41.51 1ttc s PHE 33 CO 0.04 0.20 -0.17 0.50 -0.10 0.00 0.00 175.22 175.68 1ttc s ARG 34 N -2.54 2.04 0.01 0.44 3.52 0.42 -1.13 118.95 121.71 1ttc s ARG 34 Ca 0.10 -0.59 -0.30 0.00 -0.13 0.00 0.00 55.73 54.80 1ttc s ARG 34 Cb -0.06 -1.66 -0.05 0.00 -1.56 0.00 0.00 34.95 31.61 1ttc s ARG 34 CO 0.04 0.14 1.29 0.21 -0.81 0.00 0.00 175.30 176.18 1ttc s LYS 35 N 0.36 4.34 0.52 5.12 2.20 -0.68 -0.46 119.74 131.15 1ttc s LYS 35 Ca -0.12 1.85 0.09 0.00 -0.36 0.00 0.00 55.97 57.43 1ttc s LYS 35 Cb -0.15 -3.48 0.05 0.00 -1.51 0.00 0.00 37.83 32.75 1ttc s LYS 35 CO 0.04 -0.44 0.65 0.00 -0.36 0.00 0.00 175.35 175.24 1ttc s ALA 36 N 1.87 4.58 0.23 3.13 0.00 -0.77 -4.73 121.76 126.07 1ttc s ALA 36 Ca 0.60 -1.90 -0.18 0.00 0.00 0.00 0.00 51.96 50.49 1ttc s ALA 36 Cb -0.30 -1.35 0.23 0.00 0.00 0.00 0.00 23.12 21.70 1ttc s ALA 36 CO 0.26 -0.62 1.56 0.00 0.00 0.00 0.00 175.76 176.96 1ttc h ALA 37 N 0.43 0.14 0.00 0.00 0.00 -1.96 0.25 119.26 118.13 1ttc h ALA 37 Ca -0.34 0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1ttc h ALA 37 Cb 1.29 0.98 0.00 0.00 0.00 0.00 0.00 17.79 20.06 1ttc h ALA 37 CO 0.45 -0.63 0.00 -0.40 0.00 0.00 0.00 179.25 178.68 1ttc n ASP 38 N -5.47 0.00 0.00 0.00 5.75 -1.26 -4.85 116.55 110.72 1ttc n ASP 38 Ca 0.10 -0.38 0.00 0.00 -0.01 0.00 0.00 54.79 54.49 1ttc n ASP 38 Cb 0.40 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.49 1ttc n ASP 38 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1ttc n ASP 39 N -1.00 0.00 -4.91 -1.12 -0.08 0.88 -5.02 116.55 105.31 1ttc n ASP 39 Ca 0.09 0.00 -0.27 0.00 -1.51 0.00 0.00 54.79 53.10 1ttc n ASP 39 Cb 0.04 -0.42 0.07 0.00 2.34 0.00 0.00 41.12 43.15 1ttc n ASP 39 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 1ttc s THR 40 N -3.32 2.44 -0.40 5.18 -4.23 -1.26 -4.77 115.64 109.29 1ttc s THR 40 Ca 0.00 -0.09 -0.16 0.00 -1.18 0.00 0.00 61.69 60.26 1ttc s THR 40 Cb 0.00 -3.09 0.01 0.00 1.34 0.00 0.00 72.50 70.76 1ttc s THR 40 CO 0.00 -0.11 0.38 0.26 -0.54 0.00 0.00 174.62 174.62 1ttc s TRP 41 N -3.34 3.20 -0.07 3.99 0.52 -1.26 -1.85 118.94 120.13 1ttc s TRP 41 Ca 0.60 -0.34 -0.21 0.00 0.02 0.00 0.00 56.10 56.17 1ttc s TRP 41 Cb -0.11 -2.76 -0.04 0.00 -1.15 0.00 0.00 33.47 29.41 1ttc s TRP 41 CO 0.47 -0.61 0.60 -2.00 0.02 0.00 0.00 176.95 175.44 1ttc s GLU 42 N 2.00 4.38 0.26 4.98 2.12 0.40 -4.85 118.70 127.98 1ttc s GLU 42 Ca 0.10 0.71 -0.31 0.00 0.36 0.00 0.00 54.97 55.83 1ttc s GLU 42 Cb -0.17 -3.42 -0.13 0.00 0.26 0.00 0.00 34.13 30.67 1ttc s GLU 42 CO 0.12 0.17 1.45 -2.30 -0.54 0.00 0.00 175.26 174.17 1ttc n PRO 43 N 3.48 2.21 0.00 4.30 -0.02 -1.26 -0.44 135.00 143.27 1ttc n PRO 43 Ca -0.04 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1ttc n PRO 43 Cb 0.51 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1ttc n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1ttc n PHE 44 N 1.91 0.00 -3.61 6.00 7.35 -0.30 -4.79 117.46 124.01 1ttc n PHE 44 Ca 0.10 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.73 1ttc n PHE 44 Cb 0.33 0.04 -0.02 0.00 0.35 0.00 0.00 39.48 40.19 1ttc n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1ttc s ALA 45 N -1.59 -1.77 0.05 3.13 0.00 -1.04 -5.00 121.76 115.55 1ttc s ALA 45 Ca 0.00 0.64 -0.27 0.00 0.00 0.00 0.00 51.96 52.33 1ttc s ALA 45 Cb 0.00 0.51 0.09 0.00 0.00 0.00 0.00 23.12 23.72 1ttc s ALA 45 CO 0.00 -0.84 0.88 -1.54 0.00 0.00 0.00 175.76 174.26 1ttc s SER 46 N -2.68 -0.33 0.00 0.00 1.04 -1.26 0.52 113.70 110.98 1ttc s SER 46 Ca 0.08 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.40 1ttc s SER 46 Cb -0.01 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.54 1ttc s SER 46 CO -0.04 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.06 1ttc n GLY 47 N -0.31 -1.32 3.00 7.32 0.00 -0.54 -5.01 105.19 108.33 1ttc n GLY 47 Ca -0.09 -0.95 -0.12 0.00 0.00 0.00 0.00 46.02 44.87 1ttc n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ttc s LYS 48 N -0.98 0.39 0.47 1.61 -2.85 -1.26 -0.50 119.74 116.62 1ttc s LYS 48 Ca 0.00 -0.57 -0.23 0.00 -1.00 0.00 0.00 55.97 54.17 1ttc s LYS 48 Cb 0.00 -0.14 -0.07 0.00 -2.06 0.00 0.00 37.83 35.56 1ttc s LYS 48 CO 0.00 0.02 1.24 0.95 0.10 0.00 0.00 175.35 177.66 1ttc s THR 49 N -1.14 2.75 0.53 3.79 -4.23 0.42 -4.78 115.64 112.98 1ttc s THR 49 Ca -0.10 0.58 -0.09 0.00 -1.18 0.00 0.00 61.69 60.90 1ttc s THR 49 Cb -0.08 -3.30 0.12 0.00 1.34 0.00 0.00 72.50 70.58 1ttc s THR 49 CO -0.00 0.01 0.68 -1.54 -0.54 0.00 0.00 174.62 173.23 1ttc n SER 50 N -0.53 -0.19 0.15 3.99 3.41 -0.32 -1.74 113.62 118.39 1ttc n SER 50 Ca 0.07 -1.19 0.12 0.00 -0.26 0.00 0.00 58.87 57.61 1ttc n SER 50 Cb 0.46 -0.53 0.54 0.00 -0.26 0.00 0.00 64.21 64.42 1ttc n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1ttc h GLU 51 N 0.00 0.00 -0.65 4.33 5.08 -1.94 -2.14 114.58 119.26 1ttc h GLU 51 Ca -0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1ttc h GLU 51 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1ttc h GLU 51 CO 0.16 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.04 1ttc n SER 52 N -2.30 3.82 -0.02 1.42 3.41 -1.26 -4.87 113.62 113.82 1ttc n SER 52 Ca 0.01 -2.00 -0.00 0.00 -0.26 0.00 0.00 58.87 56.62 1ttc n SER 52 Cb 0.18 -0.43 -0.00 0.00 -0.26 0.00 0.00 64.21 63.70 1ttc n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ttc n GLY 53 N 1.58 0.47 3.68 5.00 0.00 -0.80 -4.83 105.19 110.29 1ttc n GLY 53 Ca 0.23 -0.21 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 1ttc n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ttc s GLU 54 N -0.49 2.45 -0.16 1.61 2.02 -1.26 -1.08 118.70 121.79 1ttc s GLU 54 Ca 0.00 -1.13 -0.02 0.00 0.02 0.00 0.00 54.97 53.84 1ttc s GLU 54 Cb 0.00 -2.36 0.05 0.00 0.10 0.00 0.00 34.13 31.92 1ttc s GLU 54 CO 0.00 0.44 0.01 -1.17 0.02 0.00 0.00 175.26 174.56 1ttc s LEU 55 N -3.11 1.09 0.36 1.80 0.20 -0.68 -1.17 118.68 117.17 1ttc s LEU 55 Ca 0.28 -0.59 0.05 0.00 0.69 0.00 0.00 54.13 54.56 1ttc s LEU 55 Cb -0.09 -0.61 -0.07 0.00 -0.43 0.00 0.00 46.19 45.00 1ttc s LEU 55 CO 0.19 -0.25 0.04 -1.00 -0.29 0.00 0.00 176.35 175.04 1ttc s HIS 56 N 1.85 2.13 -0.91 5.38 3.76 -1.26 -2.25 115.29 123.99 1ttc s HIS 56 Ca 0.01 -0.88 -0.02 0.00 -0.15 0.00 0.00 55.06 54.02 1ttc s HIS 56 Cb -0.15 -1.44 0.00 0.00 1.11 0.00 0.00 32.58 32.10 1ttc s HIS 56 CO -0.07 0.14 0.33 0.41 -0.85 0.00 0.00 174.74 174.69 1ttc n GLY 57 N -0.79 -0.02 0.16 -2.22 0.00 -1.26 -4.94 105.19 96.13 1ttc n GLY 57 Ca -0.03 -0.27 -0.17 0.00 0.00 0.00 0.00 46.02 45.55 1ttc n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1ttc h LEU 58 N -0.75 0.64 0.00 0.99 3.38 -1.86 -3.37 115.31 114.34 1ttc h LEU 58 Ca -0.31 -0.68 -0.28 0.00 0.09 0.00 0.00 57.88 56.70 1ttc h LEU 58 Cb 1.21 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 41.70 1ttc h LEU 58 CO 0.33 1.22 -0.19 1.07 0.09 0.00 0.00 178.44 180.96 1ttc n THR 59 N -4.18 0.00 -4.50 0.22 5.66 -1.26 -4.01 114.28 106.20 1ttc n THR 59 Ca -0.09 -1.66 -0.24 0.00 -3.05 0.00 0.00 64.05 59.01 1ttc n THR 59 Cb 0.65 0.97 -0.10 0.00 -1.55 0.00 0.00 70.33 70.30 1ttc n THR 59 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1ttc s THR 60 N -2.85 2.06 0.27 1.09 -4.23 -1.26 0.27 115.64 110.99 1ttc s THR 60 Ca 0.27 -2.19 0.02 0.00 -1.18 0.00 0.00 61.69 58.61 1ttc s THR 60 Cb -0.00 -2.55 0.05 0.00 1.34 0.00 0.00 72.50 71.34 1ttc s THR 60 CO 0.19 -0.25 1.70 -0.33 -0.54 0.00 0.00 174.62 175.39 1ttc h GLU 61 N 2.13 0.49 -0.27 3.99 4.39 -1.91 -2.25 114.58 121.13 1ttc h GLU 61 Ca -0.41 -0.19 -0.15 0.00 0.34 0.00 0.00 59.36 58.95 1ttc h GLU 61 Cb 1.25 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 1ttc h GLU 61 CO 0.69 0.72 -0.43 0.93 -1.16 0.00 0.00 179.01 179.76 1ttc h GLU 62 N 0.42 0.68 -0.04 2.33 4.39 -1.98 -3.28 114.58 117.10 1ttc h GLU 62 Ca 0.06 -0.37 -0.21 0.00 0.34 0.00 0.00 59.36 59.18 1ttc h GLU 62 Cb 0.71 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 1ttc h GLU 62 CO 0.05 0.98 -0.86 1.49 -1.16 0.00 0.00 179.01 179.51 1ttc h GLU 63 N 0.55 0.45 -5.43 2.33 4.81 -1.75 -3.41 114.58 112.14 1ttc h GLU 63 Ca 0.04 -0.43 -0.69 0.00 -0.13 0.00 0.00 59.36 58.15 1ttc h GLU 63 Cb 0.97 0.11 -0.08 0.00 0.63 0.00 0.00 28.75 30.38 1ttc h GLU 63 CO 0.09 1.08 2.37 0.34 -0.73 0.00 0.00 179.01 182.16 1ttc n PHE 64 N -3.80 4.43 -2.52 0.92 7.35 -0.85 -4.97 117.46 118.03 1ttc n PHE 64 Ca -0.06 -2.88 -0.22 0.00 -0.76 0.00 0.00 57.45 53.52 1ttc n PHE 64 Cb 0.79 -2.60 0.05 0.00 0.35 0.00 0.00 39.48 38.06 1ttc n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 1ttc s VAL 65 N 3.91 2.55 0.23 -2.13 -7.23 -1.26 -4.87 120.40 111.59 1ttc s VAL 65 Ca 0.52 -0.56 -0.32 0.00 -1.81 0.00 0.00 61.98 59.82 1ttc s VAL 65 Cb 0.06 -2.99 -0.13 0.00 0.56 0.00 0.00 36.38 33.88 1ttc s VAL 65 CO 0.04 0.00 1.60 -0.62 -0.31 0.00 0.00 175.10 175.81 1ttc n GLU 66 N -2.51 2.48 -3.24 4.82 1.02 -1.26 -4.81 120.64 117.15 1ttc n GLU 66 Ca 0.08 0.89 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 1ttc n GLU 66 Cb 0.60 -2.67 0.00 0.00 -0.02 0.00 0.00 31.44 29.35 1ttc n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ttc n GLY 67 N 3.04 -1.47 3.50 0.62 0.00 -1.23 -4.99 105.19 104.67 1ttc n GLY 67 Ca 0.13 -1.04 -0.34 0.00 0.00 0.00 0.00 46.02 44.77 1ttc n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ttc s ILE 68 N -2.23 4.12 0.14 -0.61 1.01 -1.26 -1.12 121.20 121.25 1ttc s ILE 68 Ca 0.00 -0.27 0.10 0.00 0.00 0.00 0.00 60.65 60.49 1ttc s ILE 68 Cb 0.00 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 1ttc s ILE 68 CO 0.00 0.45 -0.23 -0.31 0.00 0.00 0.00 174.94 174.85 1ttc s TYR 69 N 0.70 2.39 -0.09 3.97 1.51 0.64 -1.68 117.35 124.79 1ttc s TYR 69 Ca 0.00 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 55.73 1ttc s TYR 69 Cb -0.14 -1.27 0.02 0.00 -0.11 0.00 0.00 41.96 40.46 1ttc s TYR 69 CO 0.02 0.38 -0.10 0.21 -1.11 0.00 0.00 175.55 174.95 1ttc s LYS 70 N -2.19 1.61 -0.25 -0.62 2.20 -0.28 -0.66 119.74 119.55 1ttc s LYS 70 Ca 0.16 -0.33 -0.07 0.00 -0.36 0.00 0.00 55.97 55.37 1ttc s LYS 70 Cb -0.10 -1.51 -0.03 0.00 -1.51 0.00 0.00 37.83 34.69 1ttc s LYS 70 CO 0.08 -0.14 0.07 0.08 -0.36 0.00 0.00 175.35 175.09 1ttc s VAL 71 N 1.23 4.30 -0.26 4.02 1.01 0.79 -0.94 120.40 130.55 1ttc s VAL 71 Ca -0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 61.98 61.73 1ttc s VAL 71 Cb -0.14 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.25 1ttc s VAL 71 CO -0.03 0.33 -0.04 -0.70 0.00 0.00 0.00 175.10 174.66 1ttc s GLU 72 N 1.61 2.74 -0.24 2.72 2.12 -0.35 -0.96 118.70 126.34 1ttc s GLU 72 Ca 0.06 -1.05 -0.13 0.00 0.36 0.00 0.00 54.97 54.22 1ttc s GLU 72 Cb -0.15 -3.05 -0.04 0.00 0.26 0.00 0.00 34.13 31.15 1ttc s GLU 72 CO 0.04 -0.46 0.27 0.42 -0.54 0.00 0.00 175.26 174.99 1ttc s ILE 73 N 1.31 5.27 -1.36 -3.70 1.01 0.45 -1.75 121.20 122.43 1ttc s ILE 73 Ca -0.01 0.39 -0.17 0.00 0.00 0.00 0.00 60.65 60.86 1ttc s ILE 73 Cb -0.17 -3.60 0.06 0.00 0.01 0.00 0.00 42.46 38.75 1ttc s ILE 73 CO -0.03 0.26 1.92 0.47 0.00 0.00 0.00 174.94 177.56 1ttc n ASP 74 N 4.71 4.53 0.15 3.58 8.00 -0.10 -1.73 116.55 135.68 1ttc n ASP 74 Ca -0.12 -2.89 0.00 0.00 0.71 0.00 0.00 54.79 52.50 1ttc n ASP 74 Cb 0.51 -1.71 0.21 0.00 -0.02 0.00 0.00 41.12 40.11 1ttc n ASP 74 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1ttc h THR 75 N 4.98 1.31 -0.48 -3.53 1.35 -1.86 -3.24 112.91 111.44 1ttc h THR 75 Ca 0.49 -1.95 0.02 0.00 -0.55 0.00 0.00 66.41 64.42 1ttc h THR 75 Cb 0.78 2.08 -0.03 0.00 -1.73 0.00 0.00 68.15 69.25 1ttc h THR 75 CO 1.62 0.54 0.29 0.50 -0.25 0.00 0.00 175.52 178.23 1ttc h LYS 76 N 0.00 0.58 -0.74 4.72 3.64 -1.77 -2.66 116.57 120.34 1ttc h LYS 76 Ca -0.01 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 1ttc h LYS 76 Cb 1.03 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.69 1ttc h LYS 76 CO 0.07 0.38 0.28 0.66 -2.27 0.00 0.00 179.45 178.57 1ttc h SER 77 N 0.59 1.03 0.11 4.20 4.64 -1.88 -1.51 113.55 120.73 1ttc h SER 77 Ca 0.19 -0.18 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 1ttc h SER 77 Cb -0.02 -0.27 -0.03 0.00 -0.31 0.00 0.00 62.40 61.78 1ttc h SER 77 CO -0.07 0.94 -0.23 0.22 -0.87 0.00 0.00 176.83 176.81 1ttc h TYR 78 N 1.07 -0.62 -0.36 4.77 3.20 -1.53 -1.65 116.97 121.85 1ttc h TYR 78 Ca 0.24 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.97 1ttc h TYR 78 Cb 0.24 0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.76 1ttc h TYR 78 CO 0.02 -0.33 -0.38 -1.49 -1.64 0.00 0.00 178.16 174.33 1ttc h TRP 79 N -0.43 1.03 -0.14 -3.82 4.06 -1.39 -2.92 115.95 112.33 1ttc h TRP 79 Ca 0.03 -0.30 -0.03 0.00 2.06 0.00 0.00 58.89 60.65 1ttc h TRP 79 Cb 0.45 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.39 1ttc h TRP 79 CO -0.22 1.10 -0.06 0.87 -3.56 0.00 0.00 178.44 176.58 1ttc h LYS 80 N 0.70 0.20 -0.06 0.49 1.57 -1.11 -1.16 116.57 117.20 1ttc h LYS 80 Ca 0.06 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.75 1ttc h LYS 80 Cb 0.96 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.22 1ttc h LYS 80 CO 0.09 0.28 -0.23 0.00 -0.57 0.00 0.00 179.45 179.01 1ttc h ALA 81 N 1.75 1.50 -0.28 3.86 0.00 -1.10 -2.62 119.26 122.37 1ttc h ALA 81 Ca 0.05 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1ttc h ALA 81 Cb 0.23 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ttc h ALA 81 CO 0.01 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.91 1ttc n LEU 82 N -4.22 2.43 -0.90 0.00 4.32 -0.57 -4.95 117.00 113.11 1ttc n LEU 82 Ca -0.02 -1.05 -0.08 0.00 -0.02 0.00 0.00 56.01 54.84 1ttc n LEU 82 Cb 0.32 -0.18 -0.01 0.00 -1.62 0.00 0.00 43.42 41.93 1ttc n LEU 82 CO 0.38 0.52 -0.10 0.61 -1.22 0.00 0.00 177.39 177.58 1ttc n GLY 83 N 1.28 0.12 3.28 -0.72 0.00 -0.98 -5.04 105.19 103.14 1ttc n GLY 83 Ca 0.17 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1ttc n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ttc s ILE 84 N -2.39 2.09 -0.61 -0.61 1.01 -0.55 -5.01 121.20 115.12 1ttc s ILE 84 Ca 0.00 -1.06 -0.24 0.00 0.00 0.00 0.00 60.65 59.35 1ttc s ILE 84 Cb 0.00 -1.75 0.05 0.00 0.01 0.00 0.00 42.46 40.77 1ttc s ILE 84 CO 0.00 0.57 1.00 -0.55 0.00 0.00 0.00 174.94 175.96 1ttc s SER 85 N -0.21 6.26 0.57 3.58 0.15 -1.26 -3.42 113.70 119.37 1ttc s SER 85 Ca -0.02 -0.58 -0.06 0.00 0.70 0.00 0.00 55.95 55.99 1ttc s SER 85 Cb -0.13 -2.45 -0.00 0.00 -1.71 0.00 0.00 66.02 61.72 1ttc s SER 85 CO 0.03 -1.39 0.89 -2.16 1.20 0.00 0.00 173.24 171.81 1ttc s PRO 86 N 4.24 3.10 -0.17 5.44 0.04 -1.26 -4.94 135.00 141.45 1ttc s PRO 86 Ca 0.28 0.10 -0.23 0.00 0.04 0.00 0.00 61.00 61.20 1ttc s PRO 86 Cb -0.13 -2.28 -0.23 0.00 0.04 0.00 0.00 34.50 31.90 1ttc s PRO 86 CO 0.16 -0.59 0.43 0.35 0.04 0.00 0.00 177.00 177.39 1ttc h PHE 87 N -0.11 0.08 -3.97 0.56 3.57 -1.77 -3.48 116.94 111.83 1ttc h PHE 87 Ca -0.46 -0.06 -0.45 0.00 3.53 0.00 0.00 57.97 60.53 1ttc h PHE 87 Cb 1.24 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 1ttc h PHE 87 CO 0.51 1.36 0.34 -1.01 -2.23 0.00 0.00 178.31 177.28 1ttc s HIS 88 N -2.34 3.50 0.20 0.41 3.76 -1.26 -4.98 115.29 114.57 1ttc s HIS 88 Ca -0.24 1.69 0.03 0.00 -0.15 0.00 0.00 55.06 56.39 1ttc s HIS 88 Cb 0.03 -2.88 0.11 0.00 1.11 0.00 0.00 32.58 30.96 1ttc s HIS 88 CO 0.65 0.05 1.46 0.93 -0.85 0.00 0.00 174.74 176.99 1ttc h GLU 89 N 2.54 0.22 -2.12 1.40 4.39 -1.98 -3.39 114.58 115.64 1ttc h GLU 89 Ca -0.48 -0.19 0.28 0.00 0.34 0.00 0.00 59.36 59.31 1ttc h GLU 89 Cb 1.19 0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 29.81 1ttc h GLU 89 CO 0.63 0.87 0.78 -3.38 -1.16 0.00 0.00 179.01 176.75 1ttc s HIS 90 N -3.48 0.02 -0.05 4.33 -3.43 -1.26 -3.97 115.29 107.45 1ttc s HIS 90 Ca -0.03 -0.22 0.06 0.00 -0.80 0.00 0.00 55.06 54.06 1ttc s HIS 90 Cb 0.11 0.60 -0.02 0.00 -1.43 0.00 0.00 32.58 31.84 1ttc s HIS 90 CO 0.81 -0.48 -0.23 0.00 -2.00 0.00 0.00 174.74 172.85 1ttc s ALA 91 N -2.19 2.27 -0.00 -1.38 0.00 -0.71 -4.91 121.76 114.84 1ttc s ALA 91 Ca 0.24 -1.05 0.07 0.00 0.00 0.00 0.00 51.96 51.22 1ttc s ALA 91 Cb -0.00 -0.72 -0.02 0.00 0.00 0.00 0.00 23.12 22.38 1ttc s ALA 91 CO 0.01 0.46 -0.21 -1.21 0.00 0.00 0.00 175.76 174.80 1ttc s GLU 92 N -0.33 1.61 -0.15 0.00 2.02 -1.26 -0.41 118.70 120.19 1ttc s GLU 92 Ca 0.02 -0.79 -0.00 0.00 0.02 0.00 0.00 54.97 54.22 1ttc s GLU 92 Cb -0.12 -1.60 0.03 0.00 0.10 0.00 0.00 34.13 32.54 1ttc s GLU 92 CO 0.02 0.43 -0.08 0.08 0.02 0.00 0.00 175.26 175.73 1ttc s VAL 93 N -0.56 1.22 -0.14 2.63 1.01 -0.13 -4.97 120.40 119.46 1ttc s VAL 93 Ca 0.08 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1ttc s VAL 93 Cb -0.08 -1.28 0.01 0.00 0.00 0.00 0.00 36.38 35.03 1ttc s VAL 93 CO -0.00 0.28 -0.21 -0.69 0.00 0.00 0.00 175.10 174.48 1ttc s VAL 94 N 1.61 2.16 0.19 2.92 1.01 -1.26 -0.15 120.40 126.88 1ttc s VAL 94 Ca 0.03 -0.95 -0.15 0.00 0.00 0.00 0.00 61.98 60.91 1ttc s VAL 94 Cb -0.14 -1.87 0.02 0.00 0.00 0.00 0.00 36.38 34.39 1ttc s VAL 94 CO -0.08 0.54 0.45 0.72 0.00 0.00 0.00 175.10 176.73 1ttc s PHE 95 N 0.81 0.04 -0.18 5.22 -0.71 0.16 -5.00 117.98 118.31 1ttc s PHE 95 Ca -0.07 -0.39 -0.10 0.00 -1.04 0.00 0.00 56.93 55.33 1ttc s PHE 95 Cb -0.16 0.26 -0.05 0.00 -1.21 0.00 0.00 43.02 41.87 1ttc s PHE 95 CO -0.01 -0.86 0.16 0.99 -1.34 0.00 0.00 175.22 174.16 1ttc s THR 96 N -3.90 5.40 0.25 -4.49 2.01 -1.26 -0.26 115.64 113.38 1ttc s THR 96 Ca 0.12 0.27 0.08 0.00 0.31 0.00 0.00 61.69 62.47 1ttc s THR 96 Cb 0.00 -3.49 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 1ttc s THR 96 CO -0.02 0.45 0.07 0.00 -0.69 0.00 0.00 174.62 174.43 1ttc s ALA 97 N 0.20 3.32 0.00 7.40 0.00 -0.27 -4.93 121.76 127.48 1ttc s ALA 97 Ca 0.11 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.53 1ttc s ALA 97 Cb -0.12 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 22.02 1ttc s ALA 97 CO -0.00 0.29 0.00 0.09 0.00 0.00 0.00 175.76 176.14 1ttc n ASN 98 N -0.89 0.00 0.00 0.00 3.02 -1.26 -3.47 115.26 112.65 1ttc n ASN 98 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 1ttc n ASN 98 Cb 0.58 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.75 1ttc n ASN 98 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1ttc n ASP 99 N 5.11 0.00 0.15 6.41 8.00 -1.26 -2.72 116.55 132.23 1ttc n ASP 99 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 54.79 55.50 1ttc n ASP 99 Cb 0.00 0.00 0.21 0.00 -0.02 0.00 0.00 41.12 41.31 1ttc n ASP 99 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1ttc h SER 100 N 0.00 0.00 0.00 -2.24 0.02 -1.94 -3.49 113.55 105.91 1ttc h SER 100 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ttc h SER 100 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1ttc h SER 100 CO 0.00 0.57 0.00 0.61 -1.14 0.00 0.00 176.83 176.87 1ttc n GLY 101 N 0.13 2.50 3.83 -3.77 0.00 -1.10 -5.00 105.19 101.78 1ttc n GLY 101 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 1ttc n GLY 101 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1ttc s PRO 102 N -0.34 4.14 0.11 1.61 0.01 -1.26 -4.82 135.00 134.46 1ttc s PRO 102 Ca 0.00 0.85 -0.25 0.00 0.01 0.00 0.00 61.00 61.61 1ttc s PRO 102 Cb 0.00 -2.51 0.08 0.00 0.01 0.00 0.00 34.50 32.08 1ttc s PRO 102 CO 0.00 0.18 0.78 0.50 0.01 0.00 0.00 177.00 178.47 1ttc s ARG 103 N -2.73 1.14 -0.29 5.54 3.52 -1.26 -4.12 118.95 120.75 1ttc s ARG 103 Ca 0.53 -0.49 -0.08 0.00 -0.13 0.00 0.00 55.73 55.56 1ttc s ARG 103 Cb -0.12 0.48 -0.00 0.00 -1.56 0.00 0.00 34.95 33.75 1ttc s ARG 103 CO 0.18 -0.51 0.10 0.50 -0.81 0.00 0.00 175.30 174.76 1ttc s ARG 104 N -3.46 3.29 -0.07 5.12 3.52 -1.12 -4.82 118.95 121.41 1ttc s ARG 104 Ca 0.05 -0.73 0.03 0.00 -0.13 0.00 0.00 55.73 54.95 1ttc s ARG 104 Cb -0.02 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.93 1ttc s ARG 104 CO -0.07 -0.38 -0.17 0.71 -0.81 0.00 0.00 175.30 174.57 1ttc s TYR 105 N 1.56 2.66 -0.20 5.12 1.51 0.18 0.10 117.35 128.27 1ttc s TYR 105 Ca 0.04 -0.45 0.00 0.00 -1.01 0.00 0.00 57.07 55.65 1ttc s TYR 105 Cb -0.17 -1.68 0.02 0.00 -0.11 0.00 0.00 41.96 40.02 1ttc s TYR 105 CO 0.04 -0.04 -0.16 0.99 -1.11 0.00 0.00 175.55 175.28 1ttc s THR 106 N -0.27 2.33 -0.23 -0.71 2.01 0.23 -1.55 115.64 117.45 1ttc s THR 106 Ca 0.01 -0.93 -0.06 0.00 0.31 0.00 0.00 61.69 61.02 1ttc s THR 106 Cb -0.13 -2.04 -0.02 0.00 0.01 0.00 0.00 72.50 70.32 1ttc s THR 106 CO 0.03 0.45 0.02 -0.63 -0.69 0.00 0.00 174.62 173.79 1ttc s ILE 107 N 1.31 3.89 -0.05 1.82 1.01 -0.40 -0.28 121.20 128.49 1ttc s ILE 107 Ca 0.04 -0.32 0.03 0.00 0.00 0.00 0.00 60.65 60.40 1ttc s ILE 107 Cb -0.14 -2.79 -0.03 0.00 0.01 0.00 0.00 42.46 39.51 1ttc s ILE 107 CO -0.10 0.38 -0.14 0.00 0.00 0.00 0.00 174.94 175.08 1ttc s ALA 108 N 1.50 2.69 -0.04 9.38 0.00 0.11 -1.14 121.76 134.26 1ttc s ALA 108 Ca 0.06 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 51.08 1ttc s ALA 108 Cb -0.15 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 21.98 1ttc s ALA 108 CO 0.01 0.55 -0.15 0.00 0.00 0.00 0.00 175.76 176.17 1ttc s ALA 109 N -0.73 1.35 -0.21 0.00 0.00 -0.52 -1.27 121.76 120.38 1ttc s ALA 109 Ca 0.11 -0.57 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1ttc s ALA 109 Cb -0.11 -0.48 0.02 0.00 0.00 0.00 0.00 23.12 22.56 1ttc s ALA 109 CO 0.01 0.22 -0.14 -1.17 0.00 0.00 0.00 175.76 174.68 1ttc s LEU 110 N 0.17 2.65 -0.09 0.00 2.96 -0.13 -1.18 118.68 123.06 1ttc s LEU 110 Ca -0.06 -0.79 -0.01 0.00 -0.22 0.00 0.00 54.13 53.05 1ttc s LEU 110 Cb -0.12 -1.56 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 1ttc s LEU 110 CO 0.02 -0.06 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.21 1ttc s LEU 111 N 1.29 3.45 0.07 -0.68 1.43 -0.19 -1.83 118.68 122.22 1ttc s LEU 111 Ca 0.02 0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.22 1ttc s LEU 111 Cb -0.15 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.25 1ttc s LEU 111 CO -0.09 0.36 -0.07 -0.44 0.23 0.00 0.00 176.35 176.35 1ttc s SER 112 N -0.78 0.94 0.22 2.29 0.01 0.01 -1.48 113.70 114.91 1ttc s SER 112 Ca 0.12 -0.82 -0.09 0.00 1.31 0.00 0.00 55.95 56.47 1ttc s SER 112 Cb -0.11 0.08 0.31 0.00 0.21 0.00 0.00 66.02 66.51 1ttc s SER 112 CO 0.02 -0.38 1.73 -0.65 0.41 0.00 0.00 173.24 174.38 1ttc h PRO 113 N 3.61 0.37 -0.33 12.44 0.11 -1.99 -2.78 132.00 143.43 1ttc h PRO 113 Ca -0.35 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 1ttc h PRO 113 Cb 1.18 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1ttc h PRO 113 CO 0.55 0.25 0.00 0.66 -0.21 0.00 0.00 178.00 179.25 1ttc n TYR 114 N -5.03 0.82 -3.58 0.65 4.02 -1.26 -2.03 117.16 110.75 1ttc n TYR 114 Ca 0.10 -0.71 -0.12 0.00 -0.01 0.00 0.00 57.90 57.16 1ttc n TYR 114 Cb 0.31 -0.20 -0.05 0.00 -0.02 0.00 0.00 39.34 39.38 1ttc n TYR 114 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1ttc s SER 115 N -1.47 -0.37 -0.07 7.72 1.04 -1.05 -4.97 113.70 114.53 1ttc s SER 115 Ca 0.36 -0.03 -0.25 0.00 0.48 0.00 0.00 55.95 56.50 1ttc s SER 115 Cb 0.26 0.49 0.06 0.00 0.10 0.00 0.00 66.02 66.92 1ttc s SER 115 CO 0.13 -0.79 0.58 -0.72 0.98 0.00 0.00 173.24 173.42 1ttc s TYR 116 N -3.06 -0.54 0.05 5.02 -0.85 -1.26 -0.81 117.35 115.90 1ttc s TYR 116 Ca -0.02 1.00 0.03 0.00 -0.52 0.00 0.00 57.07 57.57 1ttc s TYR 116 Cb 0.00 0.30 -0.02 0.00 0.38 0.00 0.00 41.96 42.62 1ttc s TYR 116 CO -0.07 -0.51 -0.10 -1.54 -1.52 0.00 0.00 175.55 171.82 1ttc s SER 117 N -0.97 1.14 0.00 -0.18 1.04 -0.76 -4.99 113.70 108.98 1ttc s SER 117 Ca -0.10 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 55.78 1ttc s SER 117 Cb -0.02 -0.00 -0.00 0.00 0.10 0.00 0.00 66.02 66.10 1ttc s SER 117 CO 0.07 -0.14 -0.01 0.28 0.98 0.00 0.00 173.24 174.41 1ttc s THR 118 N -1.28 0.07 0.06 2.02 -1.32 -1.26 -0.96 115.64 112.97 1ttc s THR 118 Ca -0.07 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.21 1ttc s THR 118 Cb -0.10 -0.10 -0.04 0.00 -1.51 0.00 0.00 72.50 70.76 1ttc s THR 118 CO 0.01 -0.09 -0.05 -0.89 -2.21 0.00 0.00 174.62 171.39 1ttc s THR 119 N -0.31 0.41 0.04 5.08 2.01 -0.40 -4.99 115.64 117.48 1ttc s THR 119 Ca -0.03 -1.63 0.09 0.00 0.31 0.00 0.00 61.69 60.43 1ttc s THR 119 Cb -0.02 -1.28 -0.03 0.00 0.01 0.00 0.00 72.50 71.18 1ttc s THR 119 CO -0.00 -0.81 -0.25 0.00 -0.69 0.00 0.00 174.62 172.87 1ttc s ALA 120 N -3.15 2.31 -0.20 7.40 0.00 -1.26 -0.71 121.76 126.15 1ttc s ALA 120 Ca 0.03 -1.25 0.01 0.00 0.00 0.00 0.00 51.96 50.75 1ttc s ALA 120 Cb 0.02 -0.52 0.03 0.00 0.00 0.00 0.00 23.12 22.65 1ttc s ALA 120 CO -0.06 0.54 -0.16 0.08 0.00 0.00 0.00 175.76 176.16 1ttc s VAL 121 N -0.82 2.02 -0.17 0.00 1.01 0.62 -4.98 120.40 118.09 1ttc s VAL 121 Ca 0.12 -1.12 -0.03 0.00 0.00 0.00 0.00 61.98 60.95 1ttc s VAL 121 Cb -0.10 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 1ttc s VAL 121 CO 0.02 0.35 -0.06 -0.69 0.00 0.00 0.00 175.10 174.72 1ttc s VAL 122 N 1.26 3.59 0.21 2.92 1.01 -1.26 -0.60 120.40 127.52 1ttc s VAL 122 Ca 0.01 -0.46 0.10 0.00 0.00 0.00 0.00 61.98 61.63 1ttc s VAL 122 Cb -0.15 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 1ttc s VAL 122 CO -0.10 0.48 -0.12 -0.89 0.00 0.00 0.00 175.10 174.47 1ttc s THR 123 N 0.66 2.98 -0.83 3.92 2.01 0.11 -5.02 115.64 119.48 1ttc s THR 123 Ca -0.03 -1.87 -0.24 0.00 0.31 0.00 0.00 61.69 59.85 1ttc s THR 123 Cb -0.15 -2.50 -0.23 0.00 0.01 0.00 0.00 72.50 69.63 1ttc s THR 123 CO 0.02 -0.20 1.92 0.59 -0.69 0.00 0.00 174.62 176.27 1ttc n ASN 124 N -0.17 0.91 -0.12 3.53 3.02 -1.26 -2.79 115.26 118.38 1ttc n ASN 124 Ca -0.10 -2.35 -0.26 0.00 -0.03 0.00 0.00 54.58 51.85 1ttc n ASN 124 Cb 0.57 -1.45 -0.11 0.00 -0.61 0.00 0.00 39.78 38.18 1ttc n ASN 124 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1ttc n PRO 125 N 7.69 0.59 0.00 3.52 -0.05 -1.26 -4.77 135.00 140.72 1ttc n PRO 125 Ca 0.37 0.37 0.00 0.00 -0.05 0.00 0.00 63.50 64.19 1ttc n PRO 125 Cb 0.46 -1.60 0.00 0.00 -0.05 0.00 0.00 33.50 32.32 1ttc n PRO 125 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 175.50 176.62 1ttc n LYS 126 N -4.21 0.00 0.00 0.54 4.81 -1.26 -5.06 118.16 112.98 1ttc n LYS 126 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 56.99 1ttc n LYS 126 Cb 0.83 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.88 1ttc n LYS 126 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72