#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 0.56 -4.98 0.00 0.13 -1.89 -3.42 132.00 122.40 5ttr h PRO 11 Ca 0.00 -0.22 -0.66 0.00 -0.87 0.00 0.00 66.00 64.25 5ttr h PRO 11 Cb 0.00 -0.03 -0.35 0.00 0.13 0.00 0.00 31.00 30.75 5ttr h PRO 11 CO 0.00 0.77 -0.85 -1.17 -0.23 0.00 0.00 178.00 176.52 5ttr s LEU 12 N -8.71 2.25 -0.04 1.56 2.96 -1.26 -0.38 118.68 115.05 5ttr s LEU 12 Ca -0.07 -0.73 0.02 0.00 -0.22 0.00 0.00 54.13 53.13 5ttr s LEU 12 Cb 0.13 -1.45 0.01 0.00 0.50 0.00 0.00 46.19 45.38 5ttr s LEU 12 CO 0.80 -0.03 -0.11 -0.04 -1.32 0.00 0.00 176.35 175.65 5ttr s MET 13 N 1.29 1.33 -0.14 1.98 -1.94 -0.27 -4.65 119.30 116.91 5ttr s MET 13 Ca 0.03 -0.36 -0.00 0.00 -1.71 0.00 0.00 55.69 53.64 5ttr s MET 13 Cb -0.14 -1.17 -0.01 0.00 2.01 0.00 0.00 34.83 35.52 5ttr s MET 13 CO -0.12 0.08 -0.13 0.08 -0.01 0.00 0.00 175.02 174.92 5ttr s VAL 14 N 0.44 3.02 -0.18 -6.03 1.01 -1.26 -0.50 120.40 116.90 5ttr s VAL 14 Ca -0.09 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 5ttr s VAL 14 Cb -0.12 -2.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.97 5ttr s VAL 14 CO 0.02 0.51 -0.12 -0.75 0.00 0.00 0.00 175.10 174.76 5ttr s LYS 15 N 0.53 3.27 -0.12 2.72 2.47 0.16 -3.99 119.74 124.77 5ttr s LYS 15 Ca -0.08 -0.71 -0.02 0.00 -1.56 0.00 0.00 55.97 53.60 5ttr s LYS 15 Cb -0.16 -2.74 -0.03 0.00 -1.46 0.00 0.00 37.83 33.44 5ttr s LYS 15 CO 0.04 -0.05 -0.04 0.08 0.16 0.00 0.00 175.35 175.54 5ttr s VAL 16 N 1.01 3.92 0.01 4.02 1.01 -0.23 -1.61 120.40 128.54 5ttr s VAL 16 Ca -0.01 -0.37 0.05 0.00 0.00 0.00 0.00 61.98 61.65 5ttr s VAL 16 Cb -0.15 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 5ttr s VAL 16 CO -0.02 0.54 -0.15 -0.76 0.00 0.00 0.00 175.10 174.70 5ttr s LEU 17 N -0.13 2.09 -0.37 3.92 1.43 -0.80 -2.39 118.68 122.43 5ttr s LEU 17 Ca 0.03 -0.36 -0.16 0.00 -1.03 0.00 0.00 54.13 52.61 5ttr s LEU 17 Cb -0.13 -0.74 -0.00 0.00 0.03 0.00 0.00 46.19 45.35 5ttr s LEU 17 CO 0.02 0.13 0.38 -0.62 0.23 0.00 0.00 176.35 176.50 5ttr s ASP 18 N -0.70 6.18 0.00 2.29 -1.08 -0.36 0.10 116.67 123.11 5ttr s ASP 18 Ca 0.05 -0.38 0.26 0.00 -0.52 0.00 0.00 52.55 51.95 5ttr s ASP 18 Cb -0.07 -2.20 0.61 0.00 -1.46 0.00 0.00 42.92 39.79 5ttr s ASP 18 CO 0.00 -0.41 1.47 0.00 0.52 0.00 0.00 175.17 176.75 5ttr n ALA 19 N 5.44 3.16 -0.04 3.66 0.00 -0.38 -2.81 120.51 129.55 5ttr n ALA 19 Ca -0.09 -0.46 -0.18 0.00 0.00 0.00 0.00 53.44 52.71 5ttr n ALA 19 Cb 0.49 -1.06 -0.13 0.00 0.00 0.00 0.00 19.45 18.74 5ttr n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 5ttr h VAL 20 N 1.52 1.39 -0.48 0.00 2.07 -1.95 -3.38 116.25 115.42 5ttr h VAL 20 Ca 0.00 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.17 5ttr h VAL 20 Cb 0.56 2.96 0.00 0.00 -1.52 0.00 0.00 31.29 33.29 5ttr h VAL 20 CO 0.00 0.58 0.00 -2.11 0.02 0.00 0.00 177.57 176.06 5ttr n ARG 21 N -4.35 3.26 -3.71 1.57 0.00 -1.26 -4.98 116.66 107.20 5ttr n ARG 21 Ca -0.19 -2.62 -0.22 0.00 -0.00 0.00 0.00 57.85 54.82 5ttr n ARG 21 Cb 0.67 -1.68 0.04 0.00 -0.00 0.00 0.00 32.46 31.48 5ttr n ARG 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 5ttr n GLY 22 N 0.62 -0.33 3.66 2.89 0.00 -1.12 -5.01 105.19 105.90 5ttr n GLY 22 Ca 0.21 0.14 -0.09 0.00 0.00 0.00 0.00 46.02 46.27 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 -4.19 -0.08 0.34 1.61 1.04 -1.17 -5.04 113.70 106.21 5ttr s SER 23 Ca 0.11 -0.89 -0.28 0.00 0.48 0.00 0.00 55.95 55.37 5ttr s SER 23 Cb -0.05 0.64 -0.12 0.00 0.10 0.00 0.00 66.02 66.58 5ttr s SER 23 CO 0.81 -1.23 1.37 -2.65 0.98 0.00 0.00 173.24 172.52 5ttr n PRO 24 N -0.42 2.31 -2.62 4.02 -0.02 -1.26 -1.22 135.00 135.79 5ttr n PRO 24 Ca -0.02 0.81 -0.42 0.00 -2.02 0.00 0.00 63.50 61.85 5ttr n PRO 24 Cb 0.61 -2.45 -0.03 0.00 -0.02 0.00 0.00 33.50 31.61 5ttr n PRO 24 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 5ttr s ALA 25 N -0.97 2.97 0.15 3.55 0.00 -1.01 -4.70 121.76 121.76 5ttr s ALA 25 Ca 0.56 -1.03 -0.20 0.00 0.00 0.00 0.00 51.96 51.28 5ttr s ALA 25 Cb -0.54 -4.03 -0.08 0.00 0.00 0.00 0.00 23.12 18.47 5ttr s ALA 25 CO 0.61 -2.76 0.67 0.96 0.00 0.00 0.00 175.76 175.25 5ttr s ILE 26 N 4.94 4.60 -1.30 0.00 -4.36 -1.26 -4.37 121.20 119.45 5ttr s ILE 26 Ca 0.39 1.33 -0.02 0.00 -0.26 0.00 0.00 60.65 62.08 5ttr s ILE 26 Cb -0.09 -3.93 0.01 0.00 1.25 0.00 0.00 42.46 39.70 5ttr s ILE 26 CO 0.22 0.41 0.90 -0.46 0.24 0.00 0.00 174.94 176.24 5ttr n ASN 27 N 1.28 -2.46 -4.64 4.36 6.94 0.18 -4.89 115.26 116.03 5ttr n ASN 27 Ca -0.06 -0.71 -0.35 0.00 -0.02 0.00 0.00 54.58 53.44 5ttr n ASN 27 Cb 0.50 -4.55 -0.10 0.00 -2.36 0.00 0.00 39.78 33.27 5ttr n ASN 27 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 5ttr s VAL 28 N -3.48 4.47 -0.05 3.53 0.11 -1.26 -4.61 120.40 119.11 5ttr s VAL 28 Ca 0.14 -0.17 -0.30 0.00 -2.93 0.00 0.00 61.98 58.72 5ttr s VAL 28 Cb -0.06 -2.95 -0.03 0.00 -1.53 0.00 0.00 36.38 31.81 5ttr s VAL 28 CO 0.77 0.54 1.12 0.00 -3.33 0.00 0.00 175.10 174.20 5ttr s ALA 29 N -0.23 3.42 -0.12 1.54 0.00 -1.26 0.06 121.76 125.17 5ttr s ALA 29 Ca 0.06 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.62 5ttr s ALA 29 Cb -0.12 -3.47 0.01 0.00 0.00 0.00 0.00 23.12 19.54 5ttr s ALA 29 CO 0.02 -0.63 -0.22 0.08 0.00 0.00 0.00 175.76 175.00 5ttr s VAL 30 N 1.92 2.01 -0.09 0.00 1.01 0.37 -1.46 120.40 124.17 5ttr s VAL 30 Ca 0.53 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 61.58 5ttr s VAL 30 Cb -0.23 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.39 5ttr s VAL 30 CO 0.22 0.55 -0.21 -1.00 0.00 0.00 0.00 175.10 174.66 5ttr s HIS 31 N 0.60 2.25 -0.08 5.22 3.76 -0.51 -0.99 115.29 125.55 5ttr s HIS 31 Ca -0.13 -0.88 0.01 0.00 -0.15 0.00 0.00 55.06 53.92 5ttr s HIS 31 Cb -0.17 -1.53 -0.03 0.00 1.11 0.00 0.00 32.58 31.97 5ttr s HIS 31 CO 0.03 -0.36 -0.11 0.54 -0.85 0.00 0.00 174.74 173.99 5ttr s VAL 32 N 0.37 3.33 0.19 -0.90 0.11 0.30 -1.03 120.40 122.76 5ttr s VAL 32 Ca -0.16 -0.61 0.09 0.00 -2.93 0.00 0.00 61.98 58.37 5ttr s VAL 32 Cb -0.17 -2.35 -0.04 0.00 -1.53 0.00 0.00 36.38 32.29 5ttr s VAL 32 CO 0.07 0.57 -0.09 -0.36 -3.33 0.00 0.00 175.10 171.97 5ttr s PHE 33 N -0.47 2.64 -0.14 1.54 0.08 -0.64 -0.72 117.98 120.27 5ttr s PHE 33 Ca 0.06 -0.22 0.02 0.00 0.12 0.00 0.00 56.93 56.91 5ttr s PHE 33 Cb -0.12 -1.28 0.01 0.00 -0.57 0.00 0.00 43.02 41.07 5ttr s PHE 33 CO 0.02 0.52 -0.20 0.50 -0.10 0.00 0.00 175.22 175.97 5ttr s ARG 34 N -2.91 2.81 0.04 0.44 3.52 0.28 -2.37 118.95 120.76 5ttr s ARG 34 Ca 0.25 -0.77 -0.30 0.00 -0.13 0.00 0.00 55.73 54.78 5ttr s ARG 34 Cb -0.09 -2.33 -0.08 0.00 -1.56 0.00 0.00 34.95 30.90 5ttr s ARG 34 CO 0.16 -0.07 1.80 0.21 -0.81 0.00 0.00 175.30 176.59 5ttr s LYS 35 N 0.96 4.16 0.27 5.12 2.36 -0.59 -0.57 119.74 131.46 5ttr s LYS 35 Ca -0.04 2.46 0.04 0.00 -2.55 0.00 0.00 55.97 55.87 5ttr s LYS 35 Cb -0.15 -3.89 -0.03 0.00 -1.05 0.00 0.00 37.83 32.71 5ttr s LYS 35 CO -0.04 -0.86 0.42 0.00 1.55 0.00 0.00 175.35 176.41 5ttr s ALA 36 N 3.63 3.87 0.00 3.13 0.00 0.40 -4.65 121.76 128.15 5ttr s ALA 36 Ca 0.81 -1.15 0.00 0.00 0.00 0.00 0.00 51.96 51.62 5ttr s ALA 36 Cb -0.41 -1.83 0.00 0.00 0.00 0.00 0.00 23.12 20.88 5ttr s ALA 36 CO 0.36 0.16 0.00 0.00 0.00 0.00 0.00 175.76 176.28 5ttr n ALA 37 N -1.52 0.00 -3.65 0.00 0.00 -1.26 -0.65 120.51 113.43 5ttr n ALA 37 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.98 5ttr n ALA 37 Cb 0.57 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.92 5ttr n ALA 37 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 5ttr s ASP 38 N 0.00 5.48 0.00 0.00 2.15 -1.26 -4.77 116.67 118.28 5ttr s ASP 38 Ca 0.00 -1.94 0.00 0.00 0.43 0.00 0.00 52.55 51.04 5ttr s ASP 38 Cb 0.00 -1.92 0.00 0.00 -0.30 0.00 0.00 42.92 40.70 5ttr s ASP 38 CO 0.00 -0.61 0.00 0.47 -0.17 0.00 0.00 175.17 174.86 5ttr n ASP 39 N 4.76 0.00 -4.76 -0.34 9.92 0.17 -4.91 116.55 121.39 5ttr n ASP 39 Ca -0.05 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 53.81 5ttr n ASP 39 Cb 0.41 -1.57 -0.06 0.00 -0.64 0.00 0.00 41.12 39.26 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 -0.91 4.07 -0.21 -3.53 2.01 -1.21 -4.77 115.64 111.09 5ttr s THR 40 Ca 0.00 1.97 -0.20 0.00 0.31 0.00 0.00 61.69 63.77 5ttr s THR 40 Cb 0.00 -4.21 -0.03 0.00 0.01 0.00 0.00 72.50 68.27 5ttr s THR 40 CO 0.00 0.39 0.61 0.26 -0.69 0.00 0.00 174.62 175.19 5ttr s TRP 41 N -1.30 3.36 -0.11 4.92 0.52 -1.26 0.15 118.94 125.22 5ttr s TRP 41 Ca 0.44 0.88 -0.04 0.00 0.02 0.00 0.00 56.10 57.40 5ttr s TRP 41 Cb -0.24 -2.78 -0.04 0.00 -1.15 0.00 0.00 33.47 29.26 5ttr s TRP 41 CO 0.30 -0.18 0.03 -1.21 0.02 0.00 0.00 176.95 175.91 5ttr s GLU 42 N 1.95 3.22 -0.09 4.98 2.02 0.27 -4.79 118.70 126.25 5ttr s GLU 42 Ca 0.27 -0.35 -0.34 0.00 0.02 0.00 0.00 54.97 54.57 5ttr s GLU 42 Cb -0.16 -2.92 -0.12 0.00 0.10 0.00 0.00 34.13 31.03 5ttr s GLU 42 CO 0.10 0.65 1.88 -2.30 0.02 0.00 0.00 175.26 175.61 5ttr n PRO 43 N 2.33 2.15 -0.04 0.39 -0.02 -1.26 1.00 135.00 139.55 5ttr n PRO 43 Ca -0.19 0.79 -0.05 0.00 -2.02 0.00 0.00 63.50 62.04 5ttr n PRO 43 Cb 0.54 -2.63 -0.04 0.00 -0.02 0.00 0.00 33.50 31.35 5ttr n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 5ttr n PHE 44 N 6.58 0.00 -3.95 6.00 -0.00 0.10 -4.81 117.46 121.39 5ttr n PHE 44 Ca 0.23 0.00 -0.08 0.00 -0.00 0.00 0.00 57.45 57.59 5ttr n PHE 44 Cb 0.29 -0.29 -0.04 0.00 -0.00 0.00 0.00 39.48 39.44 5ttr n PHE 44 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 5ttr s ALA 45 N -2.15 -0.58 -0.23 3.13 0.00 -0.61 -4.96 121.76 116.37 5ttr s ALA 45 Ca -0.08 -0.67 -0.27 0.00 0.00 0.00 0.00 51.96 50.94 5ttr s ALA 45 Cb 0.02 0.99 0.10 0.00 0.00 0.00 0.00 23.12 24.24 5ttr s ALA 45 CO 0.19 -0.91 0.91 -1.12 0.00 0.00 0.00 175.76 174.83 5ttr s SER 46 N -2.98 -0.54 -0.02 0.00 0.01 -1.26 -0.54 113.70 108.37 5ttr s SER 46 Ca 0.18 0.92 -0.29 0.00 1.31 0.00 0.00 55.95 58.07 5ttr s SER 46 Cb -0.02 0.89 0.11 0.00 0.21 0.00 0.00 66.02 67.20 5ttr s SER 46 CO 0.08 -0.26 1.30 -0.83 0.41 0.00 0.00 173.24 173.93 5ttr s GLY 47 N -0.13 -0.23 0.02 3.44 0.00 -0.16 -4.99 107.32 105.27 5ttr s GLY 47 Ca -0.00 0.27 0.04 0.00 0.00 0.00 0.00 44.72 45.03 5ttr s GLY 47 CO -0.01 3.77 -0.07 0.54 0.00 0.00 0.00 173.10 177.33 5ttr s LYS 48 N -2.13 2.48 0.36 2.90 1.02 -1.26 0.14 119.74 123.26 5ttr s LYS 48 Ca 0.24 -0.77 -0.26 0.00 0.02 0.00 0.00 55.97 55.20 5ttr s LYS 48 Cb 0.01 -2.47 -0.09 0.00 -0.52 0.00 0.00 37.83 34.77 5ttr s LYS 48 CO -0.02 0.59 1.08 0.99 -0.92 0.00 0.00 175.35 177.06 5ttr s THR 49 N -1.03 3.59 0.65 2.17 2.01 0.11 -4.39 115.64 118.75 5ttr s THR 49 Ca 0.18 1.33 0.01 0.00 0.31 0.00 0.00 61.69 63.52 5ttr s THR 49 Cb -0.11 -3.75 0.09 0.00 0.01 0.00 0.00 72.50 68.74 5ttr s THR 49 CO 0.08 0.12 0.90 -0.44 -0.69 0.00 0.00 174.62 174.60 5ttr s SER 50 N -1.32 4.72 0.62 3.53 0.01 -1.11 -0.65 113.70 119.51 5ttr s SER 50 Ca 0.54 -0.28 0.29 0.00 1.31 0.00 0.00 55.95 57.81 5ttr s SER 50 Cb -0.26 -0.29 1.55 0.00 0.21 0.00 0.00 66.02 67.23 5ttr s SER 50 CO 0.33 -1.58 1.92 -0.33 0.41 0.00 0.00 173.24 173.99 5ttr h GLU 51 N -0.27 0.00 -0.53 12.44 5.08 -1.91 0.28 114.58 129.66 5ttr h GLU 51 Ca -0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 5ttr h GLU 51 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 5ttr h GLU 51 CO 0.44 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.32 5ttr n SER 52 N -3.35 2.87 0.00 1.42 3.41 -1.26 -4.71 113.62 112.01 5ttr n SER 52 Ca 0.03 -2.06 0.00 0.00 -0.26 0.00 0.00 58.87 56.58 5ttr n SER 52 Cb 0.51 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 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 1.23 1.52 3.60 5.00 0.00 0.97 -4.91 105.19 112.61 5ttr n GLY 53 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.07 3.66 0.15 1.61 2.12 -1.26 -1.07 118.70 123.84 5ttr s GLU 54 Ca 0.00 -0.41 -0.30 0.00 0.36 0.00 0.00 54.97 54.62 5ttr s GLU 54 Cb 0.00 -3.02 -0.07 0.00 0.26 0.00 0.00 34.13 31.30 5ttr s GLU 54 CO 0.00 0.36 1.02 -1.25 -0.54 0.00 0.00 175.26 174.85 5ttr s PRO 55 N 0.07 4.67 0.15 4.30 0.04 -1.26 -2.76 135.00 140.21 5ttr s PRO 55 Ca 0.03 1.56 -0.30 0.00 0.04 0.00 0.00 61.00 62.33 5ttr s PRO 55 Cb -0.13 -3.33 -0.08 0.00 0.04 0.00 0.00 34.50 31.00 5ttr s PRO 55 CO 0.02 0.18 1.27 -1.01 0.04 0.00 0.00 177.00 177.50 5ttr s HIS 56 N -0.17 3.34 -1.14 0.56 3.76 -1.26 -4.55 115.29 115.83 5ttr s HIS 56 Ca 0.48 1.23 -0.23 0.00 -0.15 0.00 0.00 55.06 56.39 5ttr s HIS 56 Cb -0.26 -3.54 -0.00 0.00 1.11 0.00 0.00 32.58 29.89 5ttr s HIS 56 CO 0.32 -1.69 0.78 0.41 -0.85 0.00 0.00 174.74 173.71 5ttr n GLY 57 N 2.75 -0.98 0.23 -2.22 0.00 -1.26 -4.97 105.19 98.74 5ttr n GLY 57 Ca 0.07 0.44 -0.08 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.97 -0.47 -8.74 0.99 3.38 -1.82 -3.48 115.31 103.20 5ttr h LEU 58 Ca -0.67 0.02 -0.35 0.00 0.09 0.00 0.00 57.88 56.97 5ttr h LEU 58 Cb 1.36 0.12 -0.14 0.00 0.09 0.00 0.00 40.66 42.09 5ttr h LEU 58 CO 0.48 -0.18 -0.55 0.28 0.09 0.00 0.00 178.44 178.56 5ttr s THR 59 N -3.51 0.00 0.35 0.22 -1.32 -1.26 -4.73 115.64 105.39 5ttr s THR 59 Ca -0.08 -1.99 0.09 0.00 -1.21 0.00 0.00 61.69 58.50 5ttr s THR 59 Cb 0.01 -2.50 -0.06 0.00 -1.51 0.00 0.00 72.50 68.44 5ttr s THR 59 CO 0.24 0.00 -0.04 0.42 -2.21 0.00 0.00 174.62 173.03 5ttr s THR 60 N -3.81 2.36 -1.28 5.08 -4.23 -1.26 -4.68 115.64 107.81 5ttr s THR 60 Ca 0.40 -2.09 0.16 0.00 -1.18 0.00 0.00 61.69 58.98 5ttr s THR 60 Cb 0.05 -2.74 0.23 0.00 1.34 0.00 0.00 72.50 71.38 5ttr s THR 60 CO 0.20 -0.18 1.49 -1.84 -0.54 0.00 0.00 174.62 173.74 5ttr n GLU 61 N -0.88 0.15 0.02 3.99 0.28 -1.26 -1.09 120.64 121.85 5ttr n GLU 61 Ca -0.05 0.16 -0.01 0.00 -0.16 0.00 0.00 57.16 57.11 5ttr n GLU 61 Cb 0.63 -1.50 -0.09 0.00 1.43 0.00 0.00 31.44 31.91 5ttr n GLU 61 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 5ttr n GLU 62 N -1.36 0.62 -0.00 3.44 4.71 -1.26 -4.08 120.64 122.71 5ttr n GLU 62 Ca 0.06 0.22 0.10 0.00 -0.01 0.00 0.00 57.16 57.53 5ttr n GLU 62 Cb 0.15 -1.79 -0.14 0.00 -1.01 0.00 0.00 31.44 28.65 5ttr n GLU 62 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 5ttr n GLU 63 N -2.89 0.36 -2.60 3.49 0.28 -0.89 -4.66 120.64 113.73 5ttr n GLU 63 Ca -0.11 -0.09 -0.43 0.00 -0.16 0.00 0.00 57.16 56.38 5ttr n GLU 63 Cb 0.87 -1.49 -0.01 0.00 1.43 0.00 0.00 31.44 32.23 5ttr n GLU 63 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 5ttr s PHE 64 N -3.19 2.77 0.56 -1.84 5.36 -0.25 -4.94 117.98 116.43 5ttr s PHE 64 Ca 0.01 -1.45 -0.05 0.00 -0.96 0.00 0.00 56.93 54.48 5ttr s PHE 64 Cb 0.15 -4.71 0.00 0.00 -0.34 0.00 0.00 43.02 38.12 5ttr s PHE 64 CO 0.87 -1.81 0.85 0.14 -1.46 0.00 0.00 175.22 173.81 5ttr s VAL 65 N 4.23 3.83 0.55 3.12 -7.23 -1.26 -4.97 120.40 118.67 5ttr s VAL 65 Ca 0.51 -0.06 -0.20 0.00 -1.81 0.00 0.00 61.98 60.42 5ttr s VAL 65 Cb 0.02 -3.50 -0.07 0.00 0.56 0.00 0.00 36.38 33.40 5ttr s VAL 65 CO 0.03 -0.48 0.95 1.21 -0.31 0.00 0.00 175.10 176.49 5ttr n GLU 66 N -2.47 1.02 0.00 4.82 2.13 -1.26 -4.82 120.64 120.07 5ttr n GLU 66 Ca 0.04 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.24 5ttr n GLU 66 Cb 0.57 -2.10 0.00 0.00 0.27 0.00 0.00 31.44 30.18 5ttr n GLU 66 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 5ttr n GLY 67 N 1.29 0.56 3.61 8.31 0.00 -1.00 -4.97 105.19 112.99 5ttr n GLY 67 Ca 0.12 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.64 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 -2.00 5.17 0.21 -0.61 1.09 -1.26 -0.36 121.20 123.44 5ttr s ILE 68 Ca 0.00 0.59 0.09 0.00 -1.10 0.00 0.00 60.65 60.22 5ttr s ILE 68 Cb 0.00 -3.70 -0.04 0.00 -1.06 0.00 0.00 42.46 37.65 5ttr s ILE 68 CO 0.00 0.16 -0.03 -0.31 -0.10 0.00 0.00 174.94 174.66 5ttr s TYR 69 N 2.04 2.73 -0.12 3.97 2.02 0.20 -1.54 117.35 126.65 5ttr s TYR 69 Ca 0.15 -0.19 -0.00 0.00 -0.37 0.00 0.00 57.07 56.66 5ttr s TYR 69 Cb -0.16 -1.28 0.02 0.00 -0.40 0.00 0.00 41.96 40.14 5ttr s TYR 69 CO 0.10 0.56 -0.10 0.21 -1.57 0.00 0.00 175.55 174.75 5ttr s LYS 70 N -3.20 1.76 -0.19 -0.62 2.20 -1.00 -1.00 119.74 117.69 5ttr s LYS 70 Ca 0.28 -0.34 -0.04 0.00 -0.36 0.00 0.00 55.97 55.50 5ttr s LYS 70 Cb -0.08 -1.74 -0.02 0.00 -1.51 0.00 0.00 37.83 34.48 5ttr s LYS 70 CO 0.18 -0.25 -0.02 0.08 -0.36 0.00 0.00 175.35 174.98 5ttr s VAL 71 N 1.63 3.87 -0.20 4.02 1.01 0.76 -1.62 120.40 129.87 5ttr s VAL 71 Ca 0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 61.67 5ttr s VAL 71 Cb -0.13 -2.73 0.01 0.00 0.00 0.00 0.00 36.38 33.53 5ttr s VAL 71 CO -0.09 0.45 -0.13 -0.70 0.00 0.00 0.00 175.10 174.63 5ttr s GLU 72 N 0.82 3.11 -0.27 2.72 2.12 -0.20 -0.58 118.70 126.43 5ttr s GLU 72 Ca -0.00 -0.77 -0.09 0.00 0.36 0.00 0.00 54.97 54.47 5ttr s GLU 72 Cb -0.14 -2.76 -0.04 0.00 0.26 0.00 0.00 34.13 31.45 5ttr s GLU 72 CO 0.02 -0.22 0.13 0.42 -0.54 0.00 0.00 175.26 175.06 5ttr s ILE 73 N 1.36 4.75 -1.18 -3.70 1.01 0.78 -1.42 121.20 122.80 5ttr s ILE 73 Ca 0.05 -0.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.47 5ttr s ILE 73 Cb -0.14 -3.25 0.07 0.00 0.01 0.00 0.00 42.46 39.15 5ttr s ILE 73 CO -0.09 0.29 1.60 -0.62 0.00 0.00 0.00 174.94 176.12 5ttr s ASP 74 N 1.68 6.72 0.07 3.58 2.15 -0.54 -1.91 116.67 128.43 5ttr s ASP 74 Ca 0.07 -2.11 -0.21 0.00 0.43 0.00 0.00 52.55 50.73 5ttr s ASP 74 Cb -0.16 -2.56 -0.11 0.00 -0.30 0.00 0.00 42.92 39.80 5ttr s ASP 74 CO 0.07 -1.26 1.54 0.74 -0.17 0.00 0.00 175.17 176.09 5ttr h THR 75 N 5.97 1.22 -0.95 1.71 2.02 -1.89 -3.25 112.91 117.74 5ttr h THR 75 Ca 0.34 -0.71 0.06 0.00 0.77 0.00 0.00 66.41 66.87 5ttr h THR 75 Cb 0.93 1.36 -0.06 0.00 -1.74 0.00 0.00 68.15 68.63 5ttr h THR 75 CO 1.42 0.22 0.61 0.50 0.37 0.00 0.00 175.52 178.64 5ttr h LYS 76 N 0.08 1.09 -0.28 6.66 3.64 -1.70 -1.83 116.57 124.23 5ttr h LYS 76 Ca 0.05 -0.07 -0.14 0.00 -1.27 0.00 0.00 60.65 59.22 5ttr h LYS 76 Cb 0.30 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 5ttr h LYS 76 CO 0.00 0.72 -0.41 0.77 -2.27 0.00 0.00 179.45 178.26 5ttr h SER 77 N 1.12 0.72 -0.45 4.20 0.02 -1.87 0.05 113.55 117.33 5ttr h SER 77 Ca 0.41 -0.33 -0.02 0.00 -0.84 0.00 0.00 61.79 61.01 5ttr h SER 77 Cb 0.15 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.47 5ttr h SER 77 CO -0.17 1.04 0.21 0.22 -1.14 0.00 0.00 176.83 176.99 5ttr h TYR 78 N 0.55 0.65 -0.01 3.45 3.20 -1.38 -1.76 116.97 121.67 5ttr h TYR 78 Ca 0.04 -0.03 -0.21 0.00 3.14 0.00 0.00 58.73 61.67 5ttr h TYR 78 Cb 0.94 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 39.01 5ttr h TYR 78 CO 0.04 0.53 -0.89 -1.49 -1.64 0.00 0.00 178.16 174.72 5ttr h TRP 79 N 0.58 0.52 -0.03 -3.82 -0.00 -1.32 -3.25 115.95 108.63 5ttr h TRP 79 Ca 0.15 -0.28 -0.11 0.00 -0.00 0.00 0.00 58.89 58.66 5ttr h TRP 79 Cb 0.13 -0.06 -0.01 0.00 -0.00 0.00 0.00 29.16 29.21 5ttr h TRP 79 CO -0.01 1.08 -0.50 0.87 -0.00 0.00 0.00 178.44 179.88 5ttr h LYS 80 N 0.21 0.07 0.00 0.49 1.57 -0.71 -1.37 116.57 116.82 5ttr h LYS 80 Ca -0.06 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 5ttr h LYS 80 Cb 1.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.82 5ttr h LYS 80 CO 0.15 0.56 0.00 0.00 -0.57 0.00 0.00 179.45 179.59 5ttr h ALA 81 N 1.43 1.00 -0.23 3.86 0.00 -1.36 -2.06 119.26 121.91 5ttr h ALA 81 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 5ttr h ALA 81 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 5ttr h ALA 81 CO 0.07 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.60 5ttr n LEU 82 N -2.49 2.65 0.00 0.00 4.77 -1.14 -4.95 117.00 115.84 5ttr n LEU 82 Ca 0.02 -1.07 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 5ttr n LEU 82 Cb 0.28 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 5ttr n LEU 82 CO 0.23 0.54 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 5ttr n GLY 83 N 1.33 1.38 3.83 -0.72 0.00 -0.77 -5.04 105.19 105.21 5ttr n GLY 83 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.86 4.76 -0.40 -0.61 1.01 -0.53 -4.98 121.20 117.58 5ttr s ILE 84 Ca 0.00 1.01 -0.12 0.00 0.00 0.00 0.00 60.65 61.54 5ttr s ILE 84 Cb 0.00 -3.79 0.04 0.00 0.01 0.00 0.00 42.46 38.72 5ttr s ILE 84 CO 0.00 0.28 0.25 -0.94 0.00 0.00 0.00 174.94 174.53 5ttr s SER 85 N -1.61 5.82 0.66 3.58 1.04 -1.26 -3.20 113.70 118.72 5ttr s SER 85 Ca 0.38 -1.14 -0.11 0.00 0.48 0.00 0.00 55.95 55.56 5ttr s SER 85 Cb -0.16 -2.05 -0.01 0.00 0.10 0.00 0.00 66.02 63.89 5ttr s SER 85 CO 0.20 -0.46 1.06 -2.16 0.98 0.00 0.00 173.24 172.85 5ttr s PRO 86 N 1.55 3.21 -0.13 4.02 0.04 -1.26 -4.96 135.00 137.47 5ttr s PRO 86 Ca 0.03 0.58 -0.17 0.00 0.04 0.00 0.00 61.00 61.48 5ttr s PRO 86 Cb -0.21 -2.06 -0.15 0.00 0.04 0.00 0.00 34.50 32.13 5ttr s PRO 86 CO 0.06 -0.80 0.40 0.35 0.04 0.00 0.00 177.00 177.05 5ttr h PHE 87 N -0.48 0.00 -3.58 0.56 3.57 -1.66 -3.47 116.94 111.87 5ttr h PHE 87 Ca -0.45 0.00 -0.52 0.00 3.53 0.00 0.00 57.97 60.54 5ttr h PHE 87 Cb 1.22 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.94 5ttr h PHE 87 CO 0.58 0.62 0.29 -1.01 -2.23 0.00 0.00 178.31 176.56 5ttr s HIS 88 N -1.99 3.86 0.37 0.41 3.76 -1.26 -4.96 115.29 115.49 5ttr s HIS 88 Ca -0.13 1.75 0.12 0.00 -0.15 0.00 0.00 55.06 56.65 5ttr s HIS 88 Cb -0.01 -2.95 0.73 0.00 1.11 0.00 0.00 32.58 31.46 5ttr s HIS 88 CO 0.41 0.33 1.84 0.93 -0.85 0.00 0.00 174.74 177.40 5ttr h GLU 89 N 5.02 0.04 -2.14 1.40 4.39 -1.98 -3.35 114.58 117.96 5ttr h GLU 89 Ca -0.44 -0.01 0.34 0.00 0.34 0.00 0.00 59.36 59.58 5ttr h GLU 89 Cb 1.21 -0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.79 5ttr h GLU 89 CO 0.70 0.38 0.89 -3.38 -1.16 0.00 0.00 179.01 176.43 5ttr s HIS 90 N -4.27 0.03 -0.01 4.33 -3.43 -1.26 -3.75 115.29 106.93 5ttr s HIS 90 Ca -0.03 -0.15 0.07 0.00 -0.80 0.00 0.00 55.06 54.14 5ttr s HIS 90 Cb 0.14 0.56 -0.02 0.00 -1.43 0.00 0.00 32.58 31.84 5ttr s HIS 90 CO 0.73 -0.29 -0.21 0.00 -2.00 0.00 0.00 174.74 172.97 5ttr s ALA 91 N -2.03 1.75 0.01 -1.38 0.00 -0.80 -4.93 121.76 114.37 5ttr s ALA 91 Ca 0.29 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.34 5ttr s ALA 91 Cb -0.01 -0.44 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 5ttr s ALA 91 CO -0.00 0.43 -0.02 -2.00 0.00 0.00 0.00 175.76 174.16 5ttr s GLU 92 N -0.55 0.18 -0.20 0.00 2.12 -1.26 -0.15 118.70 118.84 5ttr s GLU 92 Ca 0.08 -0.22 0.01 0.00 0.36 0.00 0.00 54.97 55.20 5ttr s GLU 92 Cb -0.08 -0.07 0.04 0.00 0.26 0.00 0.00 34.13 34.28 5ttr s GLU 92 CO -0.01 0.01 -0.11 0.08 -0.54 0.00 0.00 175.26 174.70 5ttr s VAL 93 N -0.44 1.69 -0.25 3.70 1.01 0.25 -4.94 120.40 121.42 5ttr s VAL 93 Ca -0.04 -1.02 -0.07 0.00 0.00 0.00 0.00 61.98 60.85 5ttr s VAL 93 Cb -0.03 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 5ttr s VAL 93 CO -0.00 0.19 0.05 -0.69 0.00 0.00 0.00 175.10 174.64 5ttr s VAL 94 N 1.38 4.07 0.14 2.92 1.01 -1.26 -0.17 120.40 128.49 5ttr s VAL 94 Ca -0.01 -0.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 5ttr s VAL 94 Cb -0.16 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 5ttr s VAL 94 CO -0.08 0.33 0.04 0.72 0.00 0.00 0.00 175.10 176.10 5ttr s PHE 95 N 1.57 0.97 -0.25 5.22 -0.71 -0.17 -4.96 117.98 119.64 5ttr s PHE 95 Ca 0.06 -1.17 -0.16 0.00 -1.04 0.00 0.00 56.93 54.62 5ttr s PHE 95 Cb -0.15 -0.55 -0.04 0.00 -1.21 0.00 0.00 43.02 41.07 5ttr s PHE 95 CO 0.02 -0.42 0.40 0.99 -1.34 0.00 0.00 175.22 174.87 5ttr s THR 96 N -3.93 5.16 0.15 -4.49 2.01 -1.26 0.63 115.64 113.91 5ttr s THR 96 Ca 0.24 0.65 0.06 0.00 0.31 0.00 0.00 61.69 62.95 5ttr s THR 96 Cb 0.07 -3.73 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 5ttr s THR 96 CO 0.02 0.17 0.03 0.00 -0.69 0.00 0.00 174.62 174.15 5ttr s ALA 97 N 1.94 3.32 -0.86 7.40 0.00 0.52 -4.65 121.76 129.42 5ttr s ALA 97 Ca 0.17 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.86 5ttr s ALA 97 Cb -0.15 -1.14 0.00 0.00 0.00 0.00 0.00 23.12 21.83 5ttr s ALA 97 CO 0.09 0.54 0.00 0.09 0.00 0.00 0.00 175.76 176.49 5ttr n ASN 98 N -0.01 -3.08 0.09 0.00 3.02 -1.26 -2.39 115.26 111.63 5ttr n ASN 98 Ca -0.10 0.26 -0.04 0.00 -0.03 0.00 0.00 54.58 54.67 5ttr n ASN 98 Cb 0.54 -2.73 -0.01 0.00 -0.61 0.00 0.00 39.78 36.97 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 0.00 -0.64 6.41 2.03 -1.91 -3.26 116.42 119.05 5ttr h ASP 99 Ca -0.22 0.00 -0.32 0.00 -0.73 0.00 0.00 57.03 55.76 5ttr h ASP 99 Cb 1.05 0.00 -0.19 0.00 -0.83 0.00 0.00 39.33 39.36 5ttr h ASP 99 CO 0.27 0.83 0.24 -1.20 -1.03 0.00 0.00 179.24 178.36 5ttr n SER 100 N -3.46 3.11 0.00 4.15 7.64 -1.26 -4.99 113.62 118.80 5ttr n SER 100 Ca -0.00 -3.68 0.00 0.00 1.01 0.00 0.00 58.87 56.20 5ttr n SER 100 Cb 0.82 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 5ttr n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 5ttr n GLY 101 N -1.09 3.02 3.75 0.23 0.00 -1.23 -5.05 105.19 104.81 5ttr n GLY 101 Ca 0.45 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 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 -2.75 4.36 0.33 1.61 0.04 -1.26 -4.27 135.00 133.06 5ttr s PRO 102 Ca 0.00 2.13 0.03 0.00 0.04 0.00 0.00 61.00 63.20 5ttr s PRO 102 Cb 0.00 -3.15 -0.05 0.00 0.04 0.00 0.00 34.50 31.34 5ttr s PRO 102 CO 0.00 -0.26 0.10 1.03 0.04 0.00 0.00 177.00 177.91 5ttr s ARG 103 N -0.54 1.67 -0.16 4.56 1.81 -1.26 -4.80 118.95 120.23 5ttr s ARG 103 Ca 0.55 -1.96 -0.01 0.00 -1.72 0.00 0.00 55.73 52.60 5ttr s ARG 103 Cb -0.38 -0.56 -0.01 0.00 -0.45 0.00 0.00 34.95 33.55 5ttr s ARG 103 CO 0.42 -0.33 -0.12 0.50 -0.68 0.00 0.00 175.30 175.09 5ttr s ARG 104 N -3.86 3.30 -0.07 3.54 3.52 0.62 -4.85 118.95 121.15 5ttr s ARG 104 Ca 0.33 -0.70 0.01 0.00 -0.13 0.00 0.00 55.73 55.24 5ttr s ARG 104 Cb 0.06 -2.71 -0.03 0.00 -1.56 0.00 0.00 34.95 30.72 5ttr s ARG 104 CO 0.15 0.02 -0.09 0.71 -0.81 0.00 0.00 175.30 175.29 5ttr s TYR 105 N 0.83 2.88 -0.15 5.12 1.51 0.49 -1.46 117.35 126.55 5ttr s TYR 105 Ca -0.04 -0.06 0.01 0.00 -1.01 0.00 0.00 57.07 55.97 5ttr s TYR 105 Cb -0.15 -1.70 0.02 0.00 -0.11 0.00 0.00 41.96 40.01 5ttr s TYR 105 CO 0.00 0.26 -0.18 0.99 -1.11 0.00 0.00 175.55 175.52 5ttr s THR 106 N -0.70 1.82 -0.17 -0.71 2.01 -0.66 -1.11 115.64 116.12 5ttr s THR 106 Ca 0.11 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.31 5ttr s THR 106 Cb -0.11 -1.66 0.00 0.00 0.01 0.00 0.00 72.50 70.74 5ttr s THR 106 CO 0.01 0.50 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.65 5ttr s ILE 107 N 1.26 2.51 -0.21 1.82 1.01 0.34 -1.63 121.20 126.29 5ttr s ILE 107 Ca 0.02 -0.81 -0.08 0.00 0.00 0.00 0.00 60.65 59.78 5ttr s ILE 107 Cb -0.14 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 5ttr s ILE 107 CO -0.09 0.52 0.07 0.00 0.00 0.00 0.00 174.94 175.43 5ttr s ALA 108 N 1.01 3.31 -0.06 9.38 0.00 -0.83 0.39 121.76 134.96 5ttr s ALA 108 Ca -0.02 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.07 5ttr s ALA 108 Cb -0.15 -2.01 -0.02 0.00 0.00 0.00 0.00 23.12 20.94 5ttr s ALA 108 CO -0.04 -0.12 -0.16 0.00 0.00 0.00 0.00 175.76 175.44 5ttr s ALA 109 N 0.93 2.55 -0.27 0.00 0.00 -0.63 -2.37 121.76 121.96 5ttr s ALA 109 Ca 0.04 -0.99 -0.03 0.00 0.00 0.00 0.00 51.96 50.99 5ttr s ALA 109 Cb -0.14 -0.93 0.03 0.00 0.00 0.00 0.00 23.12 22.08 5ttr s ALA 109 CO 0.03 0.49 -0.02 -0.51 0.00 0.00 0.00 175.76 175.75 5ttr s LEU 110 N -0.49 3.49 -0.00 0.00 1.43 -0.79 -1.91 118.68 120.41 5ttr s LEU 110 Ca 0.06 -0.93 -0.05 0.00 -1.03 0.00 0.00 54.13 52.18 5ttr s LEU 110 Cb -0.12 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 5ttr s LEU 110 CO 0.01 -0.17 0.23 -0.76 0.23 0.00 0.00 176.35 175.90 5ttr s LEU 111 N 1.34 4.37 -0.02 1.79 1.02 0.11 -2.91 118.68 124.40 5ttr s LEU 111 Ca -0.01 0.49 -0.11 0.00 0.02 0.00 0.00 54.13 54.52 5ttr s LEU 111 Cb -0.17 -2.63 0.01 0.00 0.02 0.00 0.00 46.19 43.42 5ttr s LEU 111 CO -0.02 0.26 0.23 -0.44 0.02 0.00 0.00 176.35 176.40 5ttr s SER 112 N -1.75 -0.11 0.37 2.29 0.01 -0.69 -1.24 113.70 112.59 5ttr s SER 112 Ca 0.27 0.01 0.18 0.00 1.31 0.00 0.00 55.95 57.71 5ttr s SER 112 Cb -0.13 0.29 1.11 0.00 0.21 0.00 0.00 66.02 67.50 5ttr s SER 112 CO 0.16 -0.38 1.71 1.55 0.41 0.00 0.00 173.24 176.69 5ttr h PRO 113 N 4.23 0.35 -0.22 12.44 0.13 -1.98 -1.95 132.00 144.99 5ttr h PRO 113 Ca -0.30 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 5ttr h PRO 113 Cb 1.19 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.24 5ttr h PRO 113 CO 0.40 0.23 0.00 0.66 -0.23 0.00 0.00 178.00 179.06 5ttr n TYR 114 N -4.81 0.46 -3.47 1.56 4.02 -1.26 -1.61 117.16 112.05 5ttr n TYR 114 Ca 0.30 -0.66 -0.15 0.00 -0.01 0.00 0.00 57.90 57.38 5ttr n TYR 114 Cb 0.98 -0.12 -0.04 0.00 -0.02 0.00 0.00 39.34 40.14 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 -1.46 -0.60 0.01 7.72 0.15 -0.73 -4.98 113.70 113.81 5ttr s SER 115 Ca 0.25 0.32 -0.20 0.00 0.70 0.00 0.00 55.95 57.03 5ttr s SER 115 Cb 0.18 0.57 0.04 0.00 -1.71 0.00 0.00 66.02 65.09 5ttr s SER 115 CO 0.10 -0.80 0.43 -0.72 1.20 0.00 0.00 173.24 173.45 5ttr s TYR 116 N -2.57 -0.32 0.02 3.44 -0.85 -1.26 -1.70 117.35 114.11 5ttr s TYR 116 Ca -0.04 0.41 0.03 0.00 -0.52 0.00 0.00 57.07 56.95 5ttr s TYR 116 Cb -0.01 0.22 -0.01 0.00 0.38 0.00 0.00 41.96 42.54 5ttr s TYR 116 CO -0.03 -0.53 -0.10 -1.12 -1.52 0.00 0.00 175.55 172.26 5ttr s SER 117 N -1.65 1.11 0.01 -0.18 0.01 -1.14 -4.95 113.70 106.90 5ttr s SER 117 Ca -0.09 -0.33 0.06 0.00 1.31 0.00 0.00 55.95 56.89 5ttr s SER 117 Cb -0.02 -0.07 -0.02 0.00 0.21 0.00 0.00 66.02 66.13 5ttr s SER 117 CO 0.02 0.00 -0.17 0.42 0.41 0.00 0.00 173.24 173.92 5ttr s THR 118 N -0.67 1.34 -0.00 1.44 -4.23 -1.26 -1.88 115.64 110.38 5ttr s THR 118 Ca -0.01 -0.86 0.01 0.00 -1.18 0.00 0.00 61.69 59.65 5ttr s THR 118 Cb -0.06 -1.15 -0.00 0.00 1.34 0.00 0.00 72.50 72.63 5ttr s THR 118 CO 0.00 0.27 -0.04 -0.89 -0.54 0.00 0.00 174.62 173.42 5ttr s THR 119 N -0.56 0.29 -0.04 3.99 2.01 -1.00 -4.97 115.64 115.35 5ttr s THR 119 Ca 0.06 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 61.85 5ttr s THR 119 Cb -0.07 -0.26 -0.03 0.00 0.01 0.00 0.00 72.50 72.15 5ttr s THR 119 CO 0.00 0.05 -0.02 0.00 -0.69 0.00 0.00 174.62 173.96 5ttr s ALA 120 N -0.17 3.19 -0.22 7.40 0.00 -1.26 -1.96 121.76 128.74 5ttr s ALA 120 Ca 0.00 -0.89 0.01 0.00 0.00 0.00 0.00 51.96 51.08 5ttr s ALA 120 Cb -0.02 -1.34 0.05 0.00 0.00 0.00 0.00 23.12 21.81 5ttr s ALA 120 CO -0.00 0.61 -0.11 0.08 0.00 0.00 0.00 175.76 176.34 5ttr s VAL 121 N -0.95 1.79 -0.16 0.00 1.01 -0.65 -4.99 120.40 116.46 5ttr s VAL 121 Ca 0.16 -1.17 -0.05 0.00 0.00 0.00 0.00 61.98 60.92 5ttr s VAL 121 Cb -0.11 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.37 5ttr s VAL 121 CO 0.05 0.13 -0.01 -0.69 0.00 0.00 0.00 175.10 174.58 5ttr s VAL 122 N 1.32 4.16 0.00 2.92 1.01 -1.26 -1.66 120.40 126.89 5ttr s VAL 122 Ca -0.03 -0.26 0.00 0.00 0.00 0.00 0.00 61.98 61.69 5ttr s VAL 122 Cb -0.17 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.37 5ttr s VAL 122 CO -0.08 0.49 0.00 0.41 0.00 0.00 0.00 175.10 175.92 5ttr n THR 123 N 3.47 0.00 -2.75 3.92 -1.04 -0.54 -4.96 114.28 112.39 5ttr n THR 123 Ca -0.17 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.79 5ttr n THR 123 Cb 0.52 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 69.05 5ttr n THR 123 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 5ttr n ASN 124 N -2.50 -3.17 0.00 8.00 0.23 -1.26 -0.27 115.26 116.29 5ttr n ASN 124 Ca 0.00 -2.81 0.00 0.00 -0.53 0.00 0.00 54.58 51.24 5ttr n ASN 124 Cb 0.00 1.67 0.00 0.00 -2.08 0.00 0.00 39.78 39.37 5ttr n ASN 124 CO 0.00 0.00 0.00 -2.65 -0.93 0.00 0.00 177.26 173.68