#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 5ttr h PRO 11 N 0.00 0.62 -5.51 0.00 0.13 -1.91 -3.42 132.00 121.92 5ttr h PRO 11 Ca 0.00 -0.11 -0.68 0.00 -0.87 0.00 0.00 66.00 64.34 5ttr h PRO 11 Cb 0.00 -0.10 -0.33 0.00 0.13 0.00 0.00 31.00 30.70 5ttr h PRO 11 CO 0.00 0.58 -0.88 -0.48 -0.23 0.00 0.00 178.00 176.99 5ttr s LEU 12 N -9.80 2.08 -0.06 1.56 2.34 -1.26 0.45 118.68 113.99 5ttr s LEU 12 Ca -0.13 -0.55 0.01 0.00 0.06 0.00 0.00 54.13 53.52 5ttr s LEU 12 Cb 0.10 -1.40 0.02 0.00 -0.56 0.00 0.00 46.19 44.36 5ttr s LEU 12 CO 0.76 0.18 -0.06 -0.04 -1.06 0.00 0.00 176.35 176.13 5ttr s MET 13 N 0.21 1.07 -0.18 1.48 -1.94 -0.74 -4.55 119.30 114.66 5ttr s MET 13 Ca -0.15 -0.16 -0.07 0.00 -1.71 0.00 0.00 55.69 53.60 5ttr s MET 13 Cb -0.17 -1.07 -0.04 0.00 2.01 0.00 0.00 34.83 35.57 5ttr s MET 13 CO 0.08 -0.11 0.04 0.08 -0.01 0.00 0.00 175.02 175.10 5ttr s VAL 14 N 1.09 4.56 -0.15 -6.03 1.01 -1.26 -0.60 120.40 119.03 5ttr s VAL 14 Ca -0.08 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.79 5ttr s VAL 14 Cb -0.14 -3.05 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 5ttr s VAL 14 CO -0.01 0.46 -0.14 -0.75 0.00 0.00 0.00 175.10 174.66 5ttr s LYS 15 N 0.43 3.29 -0.13 2.72 2.36 0.17 -4.31 119.74 124.27 5ttr s LYS 15 Ca 0.02 -0.72 0.02 0.00 -2.55 0.00 0.00 55.97 52.74 5ttr s LYS 15 Cb -0.13 -2.64 0.01 0.00 -1.05 0.00 0.00 37.83 34.03 5ttr s LYS 15 CO 0.01 0.10 -0.21 0.54 1.55 0.00 0.00 175.35 177.34 5ttr s VAL 16 N 0.63 1.93 0.14 4.02 0.11 -0.98 0.31 120.40 126.56 5ttr s VAL 16 Ca -0.08 -0.90 0.11 0.00 -2.93 0.00 0.00 61.98 58.17 5ttr s VAL 16 Cb -0.16 -1.72 -0.04 0.00 -1.53 0.00 0.00 36.38 32.94 5ttr s VAL 16 CO 0.03 0.53 -0.24 -0.76 -3.33 0.00 0.00 175.10 171.32 5ttr s LEU 17 N 0.84 2.43 -0.51 2.54 1.43 0.00 -2.49 118.68 122.92 5ttr s LEU 17 Ca -0.07 -0.74 -0.19 0.00 -1.03 0.00 0.00 54.13 52.10 5ttr s LEU 17 Cb -0.15 -1.28 0.06 0.00 0.03 0.00 0.00 46.19 44.85 5ttr s LEU 17 CO -0.01 0.16 0.63 -0.62 0.23 0.00 0.00 176.35 176.74 5ttr s ASP 18 N -2.23 6.22 0.07 2.29 -1.08 0.21 0.12 116.67 122.27 5ttr s ASP 18 Ca 0.16 -0.95 0.28 0.00 -0.52 0.00 0.00 52.55 51.53 5ttr s ASP 18 Cb -0.10 -2.29 1.08 0.00 -1.46 0.00 0.00 42.92 40.15 5ttr s ASP 18 CO 0.08 -0.91 1.86 0.00 0.52 0.00 0.00 175.17 176.73 5ttr n ALA 19 N 6.17 2.35 -0.01 3.66 0.00 0.49 -1.91 120.51 131.26 5ttr n ALA 19 Ca -0.07 -0.08 -0.20 0.00 0.00 0.00 0.00 53.44 53.09 5ttr n ALA 19 Cb 0.45 -1.46 -0.14 0.00 0.00 0.00 0.00 19.45 18.31 5ttr n ALA 19 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 5ttr h VAL 20 N 0.00 1.29 -0.02 0.00 -1.51 -1.93 -3.38 116.25 110.70 5ttr h VAL 20 Ca 0.00 -2.40 0.00 0.00 -1.23 0.00 0.00 66.70 63.07 5ttr h VAL 20 Cb 0.58 2.91 0.00 0.00 -2.13 0.00 0.00 31.29 32.65 5ttr h VAL 20 CO 0.00 0.64 -0.17 0.54 -1.23 0.00 0.00 177.57 177.35 5ttr n ARG 21 N -4.18 1.93 -3.23 5.19 1.74 -1.25 -5.01 116.66 111.86 5ttr n ARG 21 Ca -0.20 -1.60 -0.15 0.00 -0.77 0.00 0.00 57.85 55.13 5ttr n ARG 21 Cb 0.77 -1.47 0.08 0.00 -1.02 0.00 0.00 32.46 30.82 5ttr n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 5ttr n GLY 22 N 1.37 -0.54 3.82 -0.13 0.00 -0.80 -5.03 105.19 103.88 5ttr n GLY 22 Ca 0.12 0.21 -0.07 0.00 0.00 0.00 0.00 46.02 46.28 5ttr n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 5ttr s SER 23 N -3.93 -0.25 0.37 1.61 1.04 -1.16 -5.02 113.70 106.36 5ttr s SER 23 Ca 0.15 -0.64 -0.28 0.00 0.48 0.00 0.00 55.95 55.66 5ttr s SER 23 Cb -0.02 0.71 -0.10 0.00 0.10 0.00 0.00 66.02 66.71 5ttr s SER 23 CO 0.67 -1.32 1.40 -2.16 0.98 0.00 0.00 173.24 172.81 5ttr s PRO 24 N -3.93 4.15 -0.71 4.02 0.04 -1.26 -0.62 135.00 136.70 5ttr s PRO 24 Ca 0.12 2.39 -0.27 0.00 0.04 0.00 0.00 61.00 63.28 5ttr s PRO 24 Cb -0.05 -2.96 0.02 0.00 0.04 0.00 0.00 34.50 31.55 5ttr s PRO 24 CO 0.07 -0.43 1.35 0.00 0.04 0.00 0.00 177.00 178.03 5ttr s ALA 25 N -1.15 2.70 0.34 8.56 0.00 -1.04 -4.74 121.76 126.43 5ttr s ALA 25 Ca 0.52 -1.22 -0.27 0.00 0.00 0.00 0.00 51.96 50.99 5ttr s ALA 25 Cb -0.43 -4.25 -0.09 0.00 0.00 0.00 0.00 23.12 18.35 5ttr s ALA 25 CO 0.58 -3.31 1.08 0.42 0.00 0.00 0.00 175.76 174.53 5ttr s ILE 26 N 6.11 3.56 -1.53 0.00 1.01 -1.26 -4.09 121.20 125.00 5ttr s ILE 26 Ca 0.40 1.38 -0.13 0.00 0.00 0.00 0.00 60.65 62.30 5ttr s ILE 26 Cb -0.09 -3.80 0.08 0.00 0.01 0.00 0.00 42.46 38.66 5ttr s ILE 26 CO 0.17 0.19 0.92 0.59 0.00 0.00 0.00 174.94 176.80 5ttr n ASN 27 N 0.55 -4.14 -4.84 3.58 3.02 -0.15 -4.92 115.26 108.35 5ttr n ASN 27 Ca 0.02 -0.82 -0.38 0.00 -0.03 0.00 0.00 54.58 53.38 5ttr n ASN 27 Cb 0.47 -3.75 -0.06 0.00 -0.61 0.00 0.00 39.78 35.83 5ttr n ASN 27 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 5ttr s VAL 28 N -3.36 5.07 -0.01 2.41 0.11 -1.26 -4.74 120.40 118.62 5ttr s VAL 28 Ca 0.58 0.76 -0.27 0.00 -2.93 0.00 0.00 61.98 60.13 5ttr s VAL 28 Cb -0.30 -3.68 -0.04 0.00 -1.53 0.00 0.00 36.38 30.83 5ttr s VAL 28 CO 0.84 0.56 0.83 0.00 -3.33 0.00 0.00 175.10 174.01 5ttr s ALA 29 N -1.10 3.27 -0.20 1.54 0.00 -1.26 -0.86 121.76 123.16 5ttr s ALA 29 Ca 0.24 0.34 -0.00 0.00 0.00 0.00 0.00 51.96 52.54 5ttr s ALA 29 Cb -0.16 -3.13 0.02 0.00 0.00 0.00 0.00 23.12 19.85 5ttr s ALA 29 CO 0.13 -0.11 -0.15 0.08 0.00 0.00 0.00 175.76 175.71 5ttr s VAL 30 N 0.64 2.40 -0.16 0.00 1.01 -0.58 -1.38 120.40 122.32 5ttr s VAL 30 Ca 0.44 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.48 5ttr s VAL 30 Cb -0.20 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 5ttr s VAL 30 CO 0.24 0.46 -0.00 -1.00 0.00 0.00 0.00 175.10 174.79 5ttr s HIS 31 N 1.32 3.10 -0.06 5.22 3.76 -0.79 -1.56 115.29 126.29 5ttr s HIS 31 Ca 0.04 -0.17 0.02 0.00 -0.15 0.00 0.00 55.06 54.81 5ttr s HIS 31 Cb -0.14 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.52 5ttr s HIS 31 CO -0.10 0.03 -0.12 0.08 -0.85 0.00 0.00 174.74 173.78 5ttr s VAL 32 N 0.36 3.26 0.32 -0.90 1.01 0.35 -1.51 120.40 123.30 5ttr s VAL 32 Ca -0.02 -0.64 0.07 0.00 0.00 0.00 0.00 61.98 61.39 5ttr s VAL 32 Cb -0.14 -2.30 -0.06 0.00 0.00 0.00 0.00 36.38 33.88 5ttr s VAL 32 CO 0.02 0.59 -0.03 -0.36 0.00 0.00 0.00 175.10 175.31 5ttr s PHE 33 N -0.65 2.14 -0.06 5.22 0.08 -0.59 -0.90 117.98 123.22 5ttr s PHE 33 Ca 0.10 -0.70 0.01 0.00 0.12 0.00 0.00 56.93 56.46 5ttr s PHE 33 Cb -0.11 -1.31 0.02 0.00 -0.57 0.00 0.00 43.02 41.05 5ttr s PHE 33 CO 0.01 0.32 -0.07 0.50 -0.10 0.00 0.00 175.22 175.88 5ttr s ARG 34 N -3.73 1.15 0.13 0.44 3.52 0.13 -2.23 118.95 118.36 5ttr s ARG 34 Ca 0.32 -0.20 -0.31 0.00 -0.13 0.00 0.00 55.73 55.42 5ttr s ARG 34 Cb 0.05 -1.10 -0.10 0.00 -1.56 0.00 0.00 34.95 32.24 5ttr s ARG 34 CO 0.15 -0.09 1.83 0.15 -0.81 0.00 0.00 175.30 176.53 5ttr s LYS 35 N 1.01 4.14 0.34 5.12 3.01 -0.19 -1.55 119.74 131.62 5ttr s LYS 35 Ca -0.09 2.60 -0.03 0.00 -1.01 0.00 0.00 55.97 57.44 5ttr s LYS 35 Cb -0.14 -3.58 -0.04 0.00 -1.01 0.00 0.00 37.83 33.05 5ttr s LYS 35 CO -0.00 -0.84 0.59 0.00 0.51 0.00 0.00 175.35 175.61 5ttr s ALA 36 N 2.70 3.61 0.01 5.17 0.00 0.44 -4.73 121.76 128.95 5ttr s ALA 36 Ca 0.81 -0.66 -0.01 0.00 0.00 0.00 0.00 51.96 52.10 5ttr s ALA 36 Cb -0.46 -2.29 -0.00 0.00 0.00 0.00 0.00 23.12 20.36 5ttr s ALA 36 CO 0.36 0.06 0.15 0.00 0.00 0.00 0.00 175.76 176.34 5ttr n ALA 37 N -1.42 -0.03 -1.65 0.00 0.00 -1.26 -1.65 120.51 114.49 5ttr n ALA 37 Ca -0.02 0.04 -0.40 0.00 0.00 0.00 0.00 53.44 53.05 5ttr n ALA 37 Cb 0.55 0.03 -0.01 0.00 0.00 0.00 0.00 19.45 20.02 5ttr n ALA 37 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 5ttr n ASP 38 N -2.88 6.78 0.00 0.00 8.00 -1.26 -4.77 116.55 122.41 5ttr n ASP 38 Ca 0.00 -2.80 0.00 0.00 0.71 0.00 0.00 54.79 52.70 5ttr n ASP 38 Cb 0.01 -1.55 0.00 0.00 -0.02 0.00 0.00 41.12 39.56 5ttr n ASP 38 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 5ttr n ASP 39 N 4.10 0.00 -4.79 -2.24 9.92 -0.66 -4.92 116.55 117.96 5ttr n ASP 39 Ca 0.64 0.00 -0.36 0.00 -0.53 0.00 0.00 54.79 54.54 5ttr n ASP 39 Cb 0.30 -1.60 -0.06 0.00 -0.64 0.00 0.00 41.12 39.11 5ttr n ASP 39 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 5ttr s THR 40 N -0.66 4.19 -0.26 -3.53 2.01 -1.22 -4.77 115.64 111.41 5ttr s THR 40 Ca 0.00 1.72 -0.13 0.00 0.31 0.00 0.00 61.69 63.60 5ttr s THR 40 Cb 0.00 -3.91 -0.05 0.00 0.01 0.00 0.00 72.50 68.55 5ttr s THR 40 CO 0.00 0.05 0.26 0.26 -0.69 0.00 0.00 174.62 174.50 5ttr s TRP 41 N -1.71 3.27 -0.17 4.92 0.52 -1.26 0.16 118.94 124.68 5ttr s TRP 41 Ca 0.53 0.29 -0.07 0.00 0.02 0.00 0.00 56.10 56.87 5ttr s TRP 41 Cb -0.17 -2.42 -0.04 0.00 -1.15 0.00 0.00 33.47 29.69 5ttr s TRP 41 CO 0.22 -0.10 0.08 -1.83 0.02 0.00 0.00 176.95 175.34 5ttr s GLU 42 N 1.59 3.83 0.13 4.98 -1.05 -0.59 -4.81 118.70 122.77 5ttr s GLU 42 Ca 0.11 -0.30 -0.32 0.00 -0.15 0.00 0.00 54.97 54.31 5ttr s GLU 42 Cb -0.15 -3.19 -0.11 0.00 -0.44 0.00 0.00 34.13 30.23 5ttr s GLU 42 CO 0.09 0.40 1.79 -0.35 0.95 0.00 0.00 175.26 178.13 5ttr n PRO 43 N 3.16 2.66 -0.02 -4.83 -0.04 -1.26 0.22 135.00 134.88 5ttr n PRO 43 Ca -0.17 0.96 -0.03 0.00 -0.04 0.00 0.00 63.50 64.22 5ttr n PRO 43 Cb 0.53 -2.83 -0.03 0.00 -0.04 0.00 0.00 33.50 31.13 5ttr n PRO 43 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 5ttr n PHE 44 N 5.11 0.00 -3.85 0.54 7.35 -0.08 -4.83 117.46 121.70 5ttr n PHE 44 Ca 0.18 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.79 5ttr n PHE 44 Cb 0.35 -0.20 -0.02 0.00 0.35 0.00 0.00 39.48 39.96 5ttr n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 5ttr s ALA 45 N -2.10 -1.13 -0.12 3.13 0.00 -0.26 -4.96 121.76 116.32 5ttr s ALA 45 Ca -0.05 -0.33 -0.30 0.00 0.00 0.00 0.00 51.96 51.28 5ttr s ALA 45 Cb 0.02 0.88 0.10 0.00 0.00 0.00 0.00 23.12 24.11 5ttr s ALA 45 CO 0.14 -1.00 0.85 -1.12 0.00 0.00 0.00 175.76 174.62 5ttr s SER 46 N -2.92 -0.52 0.03 0.00 0.01 -1.26 0.13 113.70 109.18 5ttr s SER 46 Ca 0.12 0.60 -0.03 0.00 1.31 0.00 0.00 55.95 57.94 5ttr s SER 46 Cb -0.05 0.47 0.01 0.00 0.21 0.00 0.00 66.02 66.66 5ttr s SER 46 CO 0.06 -0.45 0.15 0.61 0.41 0.00 0.00 173.24 174.02 5ttr n GLY 47 N 0.93 1.31 3.07 3.44 0.00 -0.60 -4.94 105.19 108.38 5ttr n GLY 47 Ca -0.14 -0.97 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 5ttr n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 5ttr s LYS 48 N -2.01 0.22 0.62 1.61 0.00 -1.26 -1.53 119.74 117.39 5ttr s LYS 48 Ca 0.03 0.48 -0.18 0.00 0.00 0.00 0.00 55.97 56.31 5ttr s LYS 48 Cb -0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 37.83 37.71 5ttr s LYS 48 CO 0.01 -0.14 0.85 0.25 0.00 0.00 0.00 175.35 176.33 5ttr n THR 49 N 3.97 3.32 -3.37 3.79 -2.24 -0.04 -4.19 114.28 115.52 5ttr n THR 49 Ca -0.23 -0.48 -0.07 0.00 -2.27 0.00 0.00 64.05 61.00 5ttr n THR 49 Cb 0.54 -1.03 0.01 0.00 -2.10 0.00 0.00 70.33 67.75 5ttr n THR 49 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 5ttr n SER 50 N -0.63 1.16 -0.23 3.42 3.41 -0.87 -0.98 113.62 118.90 5ttr n SER 50 Ca 0.13 -1.53 0.19 0.00 -0.26 0.00 0.00 58.87 57.40 5ttr n SER 50 Cb 0.48 -0.06 0.52 0.00 -0.26 0.00 0.00 64.21 64.89 5ttr n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 5ttr h GLU 51 N 0.00 0.39 -0.05 4.33 5.08 -1.92 -2.41 114.58 120.00 5ttr h GLU 51 Ca -0.10 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 5ttr h GLU 51 Cb 0.38 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.54 5ttr h GLU 51 CO 0.15 0.26 0.00 -1.13 -1.00 0.00 0.00 179.01 177.28 5ttr n SER 52 N -4.50 1.05 0.00 1.42 3.41 -1.26 -4.61 113.62 109.13 5ttr n SER 52 Ca 0.19 -1.44 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 5ttr n SER 52 Cb 0.68 -0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 5ttr n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 5ttr n GLY 53 N 1.08 1.05 3.62 5.00 0.00 -0.91 -4.74 105.19 110.29 5ttr n GLY 53 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 5ttr n GLY 53 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 5ttr s GLU 54 N -0.63 3.08 0.19 1.61 2.12 -1.26 -2.32 118.70 121.49 5ttr s GLU 54 Ca 0.00 -0.46 -0.30 0.00 0.36 0.00 0.00 54.97 54.57 5ttr s GLU 54 Cb 0.00 -2.77 -0.08 0.00 0.26 0.00 0.00 34.13 31.54 5ttr s GLU 54 CO 0.00 0.59 1.10 -1.25 -0.54 0.00 0.00 175.26 175.17 5ttr s PRO 55 N -0.60 4.60 0.63 4.30 0.04 -1.26 -2.06 135.00 140.65 5ttr s PRO 55 Ca 0.09 1.74 -0.11 0.00 0.04 0.00 0.00 61.00 62.76 5ttr s PRO 55 Cb -0.12 -3.26 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 5ttr s PRO 55 CO 0.02 0.09 1.04 -1.01 0.04 0.00 0.00 177.00 177.18 5ttr s HIS 56 N -0.37 3.59 -0.32 0.56 3.76 -1.26 -4.61 115.29 116.63 5ttr s HIS 56 Ca 0.49 1.27 -0.10 0.00 -0.15 0.00 0.00 55.06 56.57 5ttr s HIS 56 Cb -0.30 -2.75 0.01 0.00 1.11 0.00 0.00 32.58 30.65 5ttr s HIS 56 CO 0.36 -0.75 0.32 0.41 -0.85 0.00 0.00 174.74 174.23 5ttr n GLY 57 N -2.75 -0.29 0.17 -2.22 0.00 -1.26 -4.91 105.19 93.93 5ttr n GLY 57 Ca 0.06 0.44 -0.14 0.00 0.00 0.00 0.00 46.02 46.39 5ttr n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 5ttr h LEU 58 N 0.69 -0.30 -8.67 0.99 3.38 -1.81 -3.47 115.31 106.12 5ttr h LEU 58 Ca -0.31 -0.13 -0.32 0.00 0.09 0.00 0.00 57.88 57.21 5ttr h LEU 58 Cb 0.71 0.08 -0.13 0.00 0.09 0.00 0.00 40.66 41.41 5ttr h LEU 58 CO 0.15 -0.04 -0.46 0.42 0.09 0.00 0.00 178.44 178.61 5ttr s THR 59 N -5.26 0.00 0.20 0.22 -4.23 -1.26 -4.74 115.64 100.57 5ttr s THR 59 Ca -0.15 -1.88 0.11 0.00 -1.18 0.00 0.00 61.69 58.59 5ttr s THR 59 Cb 0.03 -2.50 -0.04 0.00 1.34 0.00 0.00 72.50 71.33 5ttr s THR 59 CO 0.60 0.00 -0.23 0.42 -0.54 0.00 0.00 174.62 174.88 5ttr s THR 60 N -3.69 2.27 0.55 3.99 -4.23 -1.26 -4.66 115.64 108.61 5ttr s THR 60 Ca 0.37 -2.05 0.27 0.00 -1.18 0.00 0.00 61.69 59.10 5ttr s THR 60 Cb 0.03 -2.09 0.39 0.00 1.34 0.00 0.00 72.50 72.18 5ttr s THR 60 CO 0.19 -0.18 1.98 1.05 -0.54 0.00 0.00 174.62 177.12 5ttr h GLU 61 N 3.13 0.00 0.00 3.99 4.11 -1.99 0.11 114.58 123.93 5ttr h GLU 61 Ca -0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 5ttr h GLU 61 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 5ttr h GLU 61 CO 0.49 0.00 -0.60 1.05 0.07 0.00 0.00 179.01 180.02 5ttr h GLU 62 N 0.00 0.00 -0.02 1.06 9.09 -2.05 -3.29 114.58 119.37 5ttr h GLU 62 Ca 0.23 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.64 5ttr h GLU 62 Cb 1.02 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.12 5ttr h GLU 62 CO -0.00 0.00 -0.27 -0.85 0.05 0.00 0.00 179.01 177.94 5ttr n GLU 63 N -2.79 1.65 -2.50 1.06 0.28 0.29 -4.64 120.64 113.98 5ttr n GLU 63 Ca 0.02 -1.34 -0.43 0.00 -0.16 0.00 0.00 57.16 55.25 5ttr n GLU 63 Cb 0.53 -1.44 0.00 0.00 1.43 0.00 0.00 31.44 31.96 5ttr n GLU 63 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 5ttr n PHE 64 N 0.51 4.49 -2.27 -1.84 7.35 -0.55 -4.96 117.46 120.18 5ttr n PHE 64 Ca 0.11 -2.94 -0.26 0.00 -0.76 0.00 0.00 57.45 53.59 5ttr n PHE 64 Cb 0.50 -2.53 0.05 0.00 0.35 0.00 0.00 39.48 37.85 5ttr n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 5ttr s VAL 65 N 3.51 2.88 0.62 -2.13 -7.23 -1.26 -4.97 120.40 111.83 5ttr s VAL 65 Ca 0.51 -0.13 -0.18 0.00 -1.81 0.00 0.00 61.98 60.37 5ttr s VAL 65 Cb 0.05 -3.20 -0.02 0.00 0.56 0.00 0.00 36.38 33.76 5ttr s VAL 65 CO 0.04 -0.22 1.22 -0.70 -0.31 0.00 0.00 175.10 175.14 5ttr s GLU 66 N -5.14 2.77 0.00 4.82 2.12 -1.26 -4.80 118.70 117.20 5ttr s GLU 66 Ca 0.57 1.85 0.00 0.00 0.36 0.00 0.00 54.97 57.76 5ttr s GLU 66 Cb -0.11 -1.90 0.00 0.00 0.26 0.00 0.00 34.13 32.38 5ttr s GLU 66 CO 0.45 -1.37 0.00 0.41 -0.54 0.00 0.00 175.26 174.21 5ttr n GLY 67 N 0.54 0.77 3.58 -1.50 0.00 -0.84 -4.95 105.19 102.80 5ttr n GLY 67 Ca 0.14 -1.25 -0.39 0.00 0.00 0.00 0.00 46.02 44.52 5ttr n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5ttr s ILE 68 N -1.97 5.23 0.20 -0.61 1.01 -1.26 0.13 121.20 123.94 5ttr s ILE 68 Ca 0.00 0.25 0.07 0.00 0.00 0.00 0.00 60.65 60.97 5ttr s ILE 68 Cb 0.00 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 5ttr s ILE 68 CO 0.00 0.13 0.09 -0.31 0.00 0.00 0.00 174.94 174.85 5ttr s TYR 69 N 1.92 2.97 -0.19 3.97 1.51 0.23 -1.02 117.35 126.75 5ttr s TYR 69 Ca 0.11 -0.11 0.01 0.00 -1.01 0.00 0.00 57.07 56.07 5ttr s TYR 69 Cb -0.16 -1.39 0.03 0.00 -0.11 0.00 0.00 41.96 40.33 5ttr s TYR 69 CO 0.11 0.54 -0.15 0.21 -1.11 0.00 0.00 175.55 175.14 5ttr s LYS 70 N -3.33 2.47 -0.30 -0.62 2.20 -0.95 -1.81 119.74 117.40 5ttr s LYS 70 Ca 0.30 -0.82 -0.10 0.00 -0.36 0.00 0.00 55.97 55.00 5ttr s LYS 70 Cb -0.09 -2.44 -0.02 0.00 -1.51 0.00 0.00 37.83 33.78 5ttr s LYS 70 CO 0.22 -0.31 0.15 0.08 -0.36 0.00 0.00 175.35 175.13 5ttr s VAL 71 N 1.35 4.73 -0.21 4.02 1.01 -0.19 -1.54 120.40 129.58 5ttr s VAL 71 Ca 0.02 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 61.68 5ttr s VAL 71 Cb -0.15 -3.36 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 5ttr s VAL 71 CO -0.10 0.12 -0.05 -0.70 0.00 0.00 0.00 175.10 174.38 5ttr s GLU 72 N 1.65 3.41 -0.19 2.72 2.12 -0.57 0.72 118.70 128.55 5ttr s GLU 72 Ca 0.05 -0.62 -0.06 0.00 0.36 0.00 0.00 54.97 54.71 5ttr s GLU 72 Cb -0.17 -2.98 -0.03 0.00 0.26 0.00 0.00 34.13 31.21 5ttr s GLU 72 CO 0.07 -0.13 0.02 0.42 -0.54 0.00 0.00 175.26 175.10 5ttr s ILE 73 N 1.31 4.28 -1.31 -3.70 1.01 0.21 -1.88 121.20 121.12 5ttr s ILE 73 Ca 0.04 -0.21 -0.18 0.00 0.00 0.00 0.00 60.65 60.30 5ttr s ILE 73 Cb -0.14 -2.92 0.05 0.00 0.01 0.00 0.00 42.46 39.45 5ttr s ILE 73 CO -0.02 0.45 1.85 -0.67 0.00 0.00 0.00 174.94 176.55 5ttr n ASP 74 N 3.84 4.53 0.08 3.58 -0.08 -0.48 -2.24 116.55 125.78 5ttr n ASP 74 Ca -0.17 -2.88 -0.08 0.00 -1.51 0.00 0.00 54.79 50.15 5ttr n ASP 74 Cb 0.52 -1.72 -0.07 0.00 2.34 0.00 0.00 41.12 42.19 5ttr n ASP 74 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 5ttr h THR 75 N 5.30 1.61 -0.14 5.18 1.35 -1.88 -3.33 112.91 121.01 5ttr h THR 75 Ca 0.45 -3.09 0.03 0.00 -0.55 0.00 0.00 66.41 63.25 5ttr h THR 75 Cb 0.83 2.73 -0.02 0.00 -1.73 0.00 0.00 68.15 69.95 5ttr h THR 75 CO 1.53 0.89 -0.03 0.50 -0.25 0.00 0.00 175.52 178.16 5ttr h LYS 76 N 0.03 0.01 -0.29 4.72 1.63 -1.73 -2.42 116.57 118.52 5ttr h LYS 76 Ca -0.04 -0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.68 5ttr h LYS 76 Cb 1.69 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 33.30 5ttr h LYS 76 CO 0.14 0.01 -0.17 0.77 -3.45 0.00 0.00 179.45 176.74 5ttr h SER 77 N 0.01 0.52 0.22 4.20 0.02 -1.88 -1.17 113.55 115.46 5ttr h SER 77 Ca 0.06 -0.15 0.01 0.00 -0.84 0.00 0.00 61.79 60.87 5ttr h SER 77 Cb 0.09 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.45 5ttr h SER 77 CO -0.13 0.71 -0.52 0.22 -1.14 0.00 0.00 176.83 175.96 5ttr h TYR 78 N 0.48 -1.50 -0.46 3.45 3.20 -1.55 -1.78 116.97 118.81 5ttr h TYR 78 Ca 0.08 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.85 5ttr h TYR 78 Cb 0.58 0.63 -0.01 0.00 1.54 0.00 0.00 36.73 39.46 5ttr h TYR 78 CO 0.02 -0.62 -0.22 -1.49 -1.64 0.00 0.00 178.16 174.22 5ttr h TRP 79 N -0.82 1.11 -0.41 -3.82 -0.00 -1.53 -3.20 115.95 107.30 5ttr h TRP 79 Ca -0.02 -0.27 -0.03 0.00 -0.00 0.00 0.00 58.89 58.57 5ttr h TRP 79 Cb 0.79 -0.26 -0.02 0.00 -0.00 0.00 0.00 29.16 29.67 5ttr h TRP 79 CO -0.40 1.09 0.15 0.87 -0.00 0.00 0.00 178.44 180.15 5ttr h LYS 80 N 0.82 0.61 0.00 0.49 1.57 -1.04 -2.43 116.57 116.59 5ttr h LYS 80 Ca 0.10 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 5ttr h LYS 80 Cb 0.80 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.01 5ttr h LYS 80 CO 0.07 0.59 0.04 0.00 -0.57 0.00 0.00 179.45 179.57 5ttr n ALA 81 N -2.31 0.93 0.23 3.86 0.00 -0.68 -0.07 120.51 122.46 5ttr n ALA 81 Ca -0.00 0.01 0.07 0.00 0.00 0.00 0.00 53.44 53.51 5ttr n ALA 81 Cb 0.15 -0.94 0.11 0.00 0.00 0.00 0.00 19.45 18.77 5ttr n ALA 81 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 5ttr n LEU 82 N -1.50 2.53 0.00 0.00 4.77 -0.94 -4.96 117.00 116.90 5ttr n LEU 82 Ca -0.00 -1.42 0.00 0.00 -0.03 0.00 0.00 56.01 54.56 5ttr n LEU 82 Cb 0.04 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 5ttr n LEU 82 CO 0.00 0.55 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 5ttr n GLY 83 N 0.73 2.30 3.77 -0.72 0.00 0.90 -5.03 105.19 107.14 5ttr n GLY 83 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 5ttr n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 5ttr s ILE 84 N -2.34 4.26 -0.45 -0.61 1.01 -1.07 -4.98 121.20 117.03 5ttr s ILE 84 Ca 0.00 1.82 -0.10 0.00 0.00 0.00 0.00 60.65 62.37 5ttr s ILE 84 Cb 0.00 -4.17 0.09 0.00 0.01 0.00 0.00 42.46 38.39 5ttr s ILE 84 CO 0.00 0.45 0.31 -0.44 0.00 0.00 0.00 174.94 175.27 5ttr s SER 85 N -1.25 5.74 0.75 3.58 0.01 -1.26 -3.30 113.70 117.97 5ttr s SER 85 Ca 0.40 -1.63 -0.11 0.00 1.31 0.00 0.00 55.95 55.91 5ttr s SER 85 Cb -0.23 -2.03 0.04 0.00 0.21 0.00 0.00 66.02 64.01 5ttr s SER 85 CO 0.28 -0.62 1.08 -2.16 0.41 0.00 0.00 173.24 172.23 5ttr s PRO 86 N 1.44 2.47 -0.04 12.44 0.04 -1.26 -5.02 135.00 145.07 5ttr s PRO 86 Ca 0.04 0.84 -0.24 0.00 0.04 0.00 0.00 61.00 61.68 5ttr s PRO 86 Cb -0.25 -1.95 -0.23 0.00 0.04 0.00 0.00 34.50 32.12 5ttr s PRO 86 CO 0.02 -1.40 1.05 0.35 0.04 0.00 0.00 177.00 177.06 5ttr h PHE 87 N -0.93 0.30 -3.25 0.56 3.57 -1.78 -3.47 116.94 111.94 5ttr h PHE 87 Ca -0.45 -0.16 -0.58 0.00 3.53 0.00 0.00 57.97 60.31 5ttr h PHE 87 Cb 1.24 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.89 5ttr h PHE 87 CO 0.55 0.95 -0.05 -1.01 -2.23 0.00 0.00 178.31 176.51 5ttr s HIS 88 N -3.19 3.72 0.20 0.41 3.76 -1.26 -4.98 115.29 113.95 5ttr s HIS 88 Ca -0.15 1.18 -0.05 0.00 -0.15 0.00 0.00 55.06 55.88 5ttr s HIS 88 Cb 0.01 -2.52 0.15 0.00 1.11 0.00 0.00 32.58 31.33 5ttr s HIS 88 CO 0.75 0.46 1.62 0.93 -0.85 0.00 0.00 174.74 177.65 5ttr h GLU 89 N 5.18 0.82 0.00 1.40 4.39 -1.99 -3.37 114.58 121.01 5ttr h GLU 89 Ca -0.47 -0.33 0.20 0.00 0.34 0.00 0.00 59.36 59.09 5ttr h GLU 89 Cb 1.21 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.78 5ttr h GLU 89 CO 0.67 0.96 0.56 -2.39 -1.16 0.00 0.00 179.01 177.64 5ttr n HIS 90 N -4.11 -0.61 -5.25 4.33 1.44 -1.26 -3.66 115.22 106.10 5ttr n HIS 90 Ca 0.00 -0.65 -0.32 0.00 -2.01 0.00 0.00 57.72 54.75 5ttr n HIS 90 Cb 0.44 0.30 -0.17 0.00 0.12 0.00 0.00 29.99 30.68 5ttr n HIS 90 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 5ttr s ALA 91 N -1.72 2.16 0.07 1.59 0.00 -0.95 -4.95 121.76 117.96 5ttr s ALA 91 Ca 0.19 -1.03 0.07 0.00 0.00 0.00 0.00 51.96 51.20 5ttr s ALA 91 Cb -0.01 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 5ttr s ALA 91 CO 0.01 0.39 -0.20 -1.21 0.00 0.00 0.00 175.76 174.75 5ttr s GLU 92 N -0.04 1.17 -0.22 0.00 8.01 -1.26 0.66 118.70 127.02 5ttr s GLU 92 Ca -0.07 -1.03 0.02 0.00 0.01 0.00 0.00 54.97 53.90 5ttr s GLU 92 Cb -0.15 -1.34 0.04 0.00 -4.31 0.00 0.00 34.13 28.38 5ttr s GLU 92 CO 0.05 0.32 -0.12 0.08 0.01 0.00 0.00 175.26 175.60 5ttr s VAL 93 N -1.01 1.87 -0.26 2.63 1.01 0.22 -4.95 120.40 119.90 5ttr s VAL 93 Ca 0.06 -1.20 -0.07 0.00 0.00 0.00 0.00 61.98 60.76 5ttr s VAL 93 Cb -0.09 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.35 5ttr s VAL 93 CO 0.03 0.16 0.08 -0.69 0.00 0.00 0.00 175.10 174.67 5ttr s VAL 94 N 1.29 4.24 0.16 2.92 1.01 -1.26 -1.02 120.40 127.74 5ttr s VAL 94 Ca -0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 5ttr s VAL 94 Cb -0.17 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 5ttr s VAL 94 CO -0.08 0.27 0.07 0.72 0.00 0.00 0.00 175.10 176.08 5ttr s PHE 95 N 1.59 1.01 -0.18 5.22 -0.71 -0.75 -4.98 117.98 119.18 5ttr s PHE 95 Ca 0.06 -1.24 -0.12 0.00 -1.04 0.00 0.00 56.93 54.58 5ttr s PHE 95 Cb -0.16 -0.55 -0.05 0.00 -1.21 0.00 0.00 43.02 41.06 5ttr s PHE 95 CO 0.03 -0.50 0.23 0.99 -1.34 0.00 0.00 175.22 174.63 5ttr s THR 96 N -4.01 5.35 0.02 -4.49 2.01 -1.26 0.78 115.64 114.03 5ttr s THR 96 Ca 0.28 0.40 0.08 0.00 0.31 0.00 0.00 61.69 62.76 5ttr s THR 96 Cb 0.07 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.99 5ttr s THR 96 CO 0.05 0.40 -0.23 0.00 -0.69 0.00 0.00 174.62 174.16 5ttr s ALA 97 N 0.46 2.36 -1.17 7.40 0.00 0.35 -4.76 121.76 126.41 5ttr s ALA 97 Ca 0.13 -1.18 0.00 0.00 0.00 0.00 0.00 51.96 50.91 5ttr s ALA 97 Cb -0.12 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.38 5ttr s ALA 97 CO 0.02 0.55 0.00 0.09 0.00 0.00 0.00 175.76 176.41 5ttr n ASN 98 N 1.95 -3.53 -0.12 0.00 3.02 -1.26 -1.98 115.26 113.33 5ttr n ASN 98 Ca -0.17 0.25 -0.09 0.00 -0.03 0.00 0.00 54.58 54.54 5ttr n ASN 98 Cb 0.52 -3.16 -0.01 0.00 -0.61 0.00 0.00 39.78 36.51 5ttr n ASN 98 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 5ttr h ASP 99 N 0.00 0.51 -0.87 6.41 2.03 -1.91 -2.67 116.42 119.93 5ttr h ASP 99 Ca -0.27 -0.18 -0.46 0.00 -0.73 0.00 0.00 57.03 55.39 5ttr h ASP 99 Cb 1.00 -0.13 -0.27 0.00 -0.83 0.00 0.00 39.33 39.10 5ttr h ASP 99 CO 0.35 0.56 0.59 -1.54 -1.03 0.00 0.00 179.24 178.17 5ttr n SER 100 N -4.66 3.84 0.00 4.15 3.41 -1.26 -5.00 113.62 114.11 5ttr n SER 100 Ca -0.01 -3.42 0.00 0.00 -0.26 0.00 0.00 58.87 55.19 5ttr n SER 100 Cb 0.15 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 63.30 5ttr n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 5ttr n GLY 101 N -0.92 2.50 3.74 5.00 0.00 -1.01 -5.02 105.19 109.47 5ttr n GLY 101 Ca 0.53 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.16 5ttr n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 5ttr s PRO 102 N -2.74 4.25 0.19 1.61 0.04 -1.26 -4.31 135.00 132.78 5ttr s PRO 102 Ca 0.00 2.32 0.01 0.00 0.04 0.00 0.00 61.00 63.36 5ttr s PRO 102 Cb 0.00 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.37 5ttr s PRO 102 CO 0.00 -0.48 0.06 0.50 0.04 0.00 0.00 177.00 177.12 5ttr s ARG 103 N 0.13 1.15 -0.18 4.56 6.06 -1.26 -4.61 118.95 124.80 5ttr s ARG 103 Ca 0.63 -1.58 -0.02 0.00 -2.50 0.00 0.00 55.73 52.25 5ttr s ARG 103 Cb -0.42 -0.06 -0.01 0.00 0.06 0.00 0.00 34.95 34.51 5ttr s ARG 103 CO 0.39 -0.24 -0.07 0.50 -2.50 0.00 0.00 175.30 173.38 5ttr s ARG 104 N -4.01 3.42 -0.14 5.12 3.52 0.60 -4.91 118.95 122.55 5ttr s ARG 104 Ca 0.30 -0.63 -0.04 0.00 -0.13 0.00 0.00 55.73 55.22 5ttr s ARG 104 Cb 0.07 -2.86 -0.03 0.00 -1.56 0.00 0.00 34.95 30.57 5ttr s ARG 104 CO 0.07 0.01 0.00 0.71 -0.81 0.00 0.00 175.30 175.28 5ttr s TYR 105 N 0.91 3.12 -0.25 5.12 1.51 0.17 -1.83 117.35 126.11 5ttr s TYR 105 Ca -0.01 -0.06 -0.01 0.00 -1.01 0.00 0.00 57.07 55.97 5ttr s TYR 105 Cb -0.15 -1.95 0.03 0.00 -0.11 0.00 0.00 41.96 39.79 5ttr s TYR 105 CO 0.00 0.15 -0.07 0.99 -1.11 0.00 0.00 175.55 175.52 5ttr s THR 106 N 0.03 2.76 -0.26 -0.71 2.01 -0.32 -1.78 115.64 117.38 5ttr s THR 106 Ca 0.02 -1.09 -0.10 0.00 0.31 0.00 0.00 61.69 60.84 5ttr s THR 106 Cb -0.13 -2.42 -0.04 0.00 0.01 0.00 0.00 72.50 69.92 5ttr s THR 106 CO 0.02 0.19 0.15 -0.63 -0.69 0.00 0.00 174.62 173.65 5ttr s ILE 107 N 1.30 5.02 -0.16 1.82 1.01 0.23 -0.94 121.20 129.49 5ttr s ILE 107 Ca -0.01 0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.68 5ttr s ILE 107 Cb -0.17 -3.37 -0.02 0.00 0.01 0.00 0.00 42.46 38.91 5ttr s ILE 107 CO -0.05 0.30 -0.06 0.00 0.00 0.00 0.00 174.94 175.13 5ttr s ALA 108 N 1.53 2.88 -0.11 9.38 0.00 -0.73 0.47 121.76 135.18 5ttr s ALA 108 Ca 0.07 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.16 5ttr s ALA 108 Cb -0.15 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.47 5ttr s ALA 108 CO 0.07 0.14 -0.15 0.00 0.00 0.00 0.00 175.76 175.82 5ttr s ALA 109 N 0.50 2.55 -0.32 0.00 0.00 0.15 -1.93 121.76 122.72 5ttr s ALA 109 Ca -0.05 -0.92 -0.06 0.00 0.00 0.00 0.00 51.96 50.93 5ttr s ALA 109 Cb -0.15 -1.10 0.02 0.00 0.00 0.00 0.00 23.12 21.90 5ttr s ALA 109 CO 0.03 0.31 0.09 -1.17 0.00 0.00 0.00 175.76 175.02 5ttr s LEU 110 N 0.15 4.06 0.04 0.00 2.96 0.19 -0.82 118.68 125.26 5ttr s LEU 110 Ca -0.08 -0.92 -0.12 0.00 -0.22 0.00 0.00 54.13 52.79 5ttr s LEU 110 Cb -0.15 -1.87 -0.06 0.00 0.50 0.00 0.00 46.19 44.61 5ttr s LEU 110 CO 0.05 -0.26 0.40 -0.76 -1.32 0.00 0.00 176.35 174.46 5ttr s LEU 111 N 1.45 4.40 0.01 -0.68 2.01 0.12 -2.55 118.68 123.44 5ttr s LEU 111 Ca 0.00 0.86 -0.23 0.00 0.01 0.00 0.00 54.13 54.77 5ttr s LEU 111 Cb -0.18 -2.79 0.05 0.00 0.01 0.00 0.00 46.19 43.28 5ttr s LEU 111 CO 0.02 0.24 0.53 -0.94 1.01 0.00 0.00 176.35 177.21 5ttr s SER 112 N -1.44 -0.45 0.30 2.29 1.04 -1.09 -0.38 113.70 113.96 5ttr s SER 112 Ca 0.29 0.30 0.03 0.00 0.48 0.00 0.00 55.95 57.05 5ttr s SER 112 Cb -0.15 0.47 0.75 0.00 0.10 0.00 0.00 66.02 67.20 5ttr s SER 112 CO 0.16 -0.65 1.63 -0.65 0.98 0.00 0.00 173.24 174.71 5ttr h PRO 113 N 3.02 0.16 -0.22 4.02 0.11 -1.98 -2.91 132.00 134.19 5ttr h PRO 113 Ca -0.30 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.80 5ttr h PRO 113 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 5ttr h PRO 113 CO 0.40 0.10 0.00 0.66 -0.21 0.00 0.00 178.00 178.96 5ttr n TYR 114 N -5.27 0.30 -3.65 0.65 4.02 -1.26 -2.03 117.16 109.92 5ttr n TYR 114 Ca 0.23 -0.45 -0.10 0.00 -0.01 0.00 0.00 57.90 57.56 5ttr n TYR 114 Cb 0.73 -0.03 -0.05 0.00 -0.02 0.00 0.00 39.34 39.97 5ttr n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 5ttr s SER 115 N -0.97 -0.21 -0.02 7.72 0.15 -1.10 -4.98 113.70 114.29 5ttr s SER 115 Ca 0.16 -0.34 -0.22 0.00 0.70 0.00 0.00 55.95 56.24 5ttr s SER 115 Cb 0.08 0.47 0.05 0.00 -1.71 0.00 0.00 66.02 64.91 5ttr s SER 115 CO 0.11 -0.85 0.49 -0.72 1.20 0.00 0.00 173.24 173.47 5ttr s TYR 116 N -3.81 -0.41 0.23 3.44 1.13 -1.26 -2.67 117.35 114.00 5ttr s TYR 116 Ca 0.03 0.66 0.08 0.00 -1.41 0.00 0.00 57.07 56.42 5ttr s TYR 116 Cb 0.02 0.25 -0.05 0.00 -1.10 0.00 0.00 41.96 41.08 5ttr s TYR 116 CO -0.12 -0.51 -0.12 -1.12 -2.51 0.00 0.00 175.55 171.17 5ttr s SER 117 N -1.32 2.66 -0.00 -0.18 0.01 -1.06 -4.93 113.70 108.88 5ttr s SER 117 Ca -0.12 -1.07 0.02 0.00 1.31 0.00 0.00 55.95 56.10 5ttr s SER 117 Cb -0.03 -0.15 -0.00 0.00 0.21 0.00 0.00 66.02 66.05 5ttr s SER 117 CO 0.06 -0.21 -0.06 0.42 0.41 0.00 0.00 173.24 173.86 5ttr s THR 118 N -2.97 0.48 -0.02 1.44 -4.23 -1.26 -0.64 115.64 108.44 5ttr s THR 118 Ca 0.25 -0.27 0.02 0.00 -1.18 0.00 0.00 61.69 60.51 5ttr s THR 118 Cb 0.00 -0.40 0.01 0.00 1.34 0.00 0.00 72.50 73.45 5ttr s THR 118 CO 0.08 0.13 -0.05 -0.89 -0.54 0.00 0.00 174.62 173.35 5ttr s THR 119 N -0.15 0.52 0.10 3.99 2.01 -0.81 -4.98 115.64 116.31 5ttr s THR 119 Ca 0.02 -0.19 0.05 0.00 0.31 0.00 0.00 61.69 61.88 5ttr s THR 119 Cb -0.02 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.95 5ttr s THR 119 CO -0.00 0.18 0.02 0.00 -0.69 0.00 0.00 174.62 174.14 5ttr s ALA 120 N 0.40 3.35 -0.22 7.40 0.00 -1.26 -1.77 121.76 129.66 5ttr s ALA 120 Ca -0.05 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.79 5ttr s ALA 120 Cb -0.09 -1.23 0.06 0.00 0.00 0.00 0.00 23.12 21.86 5ttr s ALA 120 CO -0.00 0.67 -0.05 0.08 0.00 0.00 0.00 175.76 176.46 5ttr s VAL 121 N -1.40 1.46 -0.16 0.00 1.01 -0.11 -4.96 120.40 116.24 5ttr s VAL 121 Ca 0.27 -1.13 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 5ttr s VAL 121 Cb -0.11 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 5ttr s VAL 121 CO 0.19 -0.07 -0.06 -0.69 0.00 0.00 0.00 175.10 174.48 5ttr s VAL 122 N 1.44 3.66 -0.12 2.92 1.01 -1.26 -1.17 120.40 126.87 5ttr s VAL 122 Ca -0.05 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.49 5ttr s VAL 122 Cb -0.18 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 5ttr s VAL 122 CO -0.07 0.49 -0.13 -0.89 0.00 0.00 0.00 175.10 174.51 5ttr s THR 123 N 0.48 3.09 -0.37 3.92 2.01 -0.76 -4.95 115.64 119.06 5ttr s THR 123 Ca -0.05 -0.65 -0.10 0.00 0.31 0.00 0.00 61.69 61.20 5ttr s THR 123 Cb -0.15 -2.29 0.03 0.00 0.01 0.00 0.00 72.50 70.11 5ttr s THR 123 CO 0.03 0.53 0.18 0.21 -0.69 0.00 0.00 174.62 174.88 5ttr s ASN 124 N 0.25 5.61 0.00 3.53 2.47 -1.26 -0.29 114.94 125.25 5ttr s ASN 124 Ca -0.09 -1.08 0.00 0.00 0.42 0.00 0.00 52.86 52.12 5ttr s ASN 124 Cb -0.15 -1.98 0.00 0.00 -1.45 0.00 0.00 41.25 37.67 5ttr s ASN 124 CO 0.05 -0.38 0.00 -0.81 -3.72 0.00 0.00 177.10 172.24