#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3did h PRO 11 N 0.00 0.00 -3.15 0.00 0.11 -1.92 -3.42 132.00 123.63 3did h PRO 11 Ca 0.00 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.82 3did h PRO 11 Cb 0.00 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 30.76 3did h PRO 11 CO 0.00 0.04 -0.64 -1.17 -0.21 0.00 0.00 178.00 176.02 3did s LEU 12 N -8.88 0.12 -0.01 2.35 2.96 -1.26 -1.37 118.68 112.59 3did s LEU 12 Ca -0.05 0.30 0.05 0.00 -0.22 0.00 0.00 54.13 54.22 3did s LEU 12 Cb 0.17 0.26 -0.01 0.00 0.50 0.00 0.00 46.19 47.10 3did s LEU 12 CO 0.67 -0.22 -0.17 -0.32 -1.32 0.00 0.00 176.35 174.99 3did s MET 13 N 2.04 1.37 -0.09 1.98 -2.45 -0.44 -4.43 119.30 117.27 3did s MET 13 Ca 0.01 -0.60 0.02 0.00 -1.25 0.00 0.00 55.69 53.87 3did s MET 13 Cb -0.12 -1.32 -0.02 0.00 1.25 0.00 0.00 34.83 34.63 3did s MET 13 CO -0.06 0.36 -0.17 0.08 1.05 0.00 0.00 175.02 176.29 3did s VAL 14 N -0.38 2.79 -0.04 10.11 1.01 -1.03 -1.30 120.40 131.57 3did s VAL 14 Ca 0.06 -0.78 0.03 0.00 0.00 0.00 0.00 61.98 61.29 3did s VAL 14 Cb -0.07 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 34.20 3did s VAL 14 CO -0.01 0.55 -0.13 -0.75 0.00 0.00 0.00 175.10 174.77 3did s LYS 15 N -0.03 1.36 -0.11 2.72 2.20 -0.40 -0.95 119.74 124.53 3did s LYS 15 Ca -0.04 -0.44 0.01 0.00 -0.36 0.00 0.00 55.97 55.13 3did s LYS 15 Cb -0.14 -1.22 0.02 0.00 -1.51 0.00 0.00 37.83 34.98 3did s LYS 15 CO 0.04 0.16 -0.12 0.08 -0.36 0.00 0.00 175.35 175.16 3did s VAL 16 N 0.16 1.27 -0.05 4.02 1.01 -0.55 -1.23 120.40 125.03 3did s VAL 16 Ca -0.04 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.51 3did s VAL 16 Cb -0.10 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.04 3did s VAL 16 CO 0.01 0.40 -0.19 -0.76 0.00 0.00 0.00 175.10 174.57 3did s LEU 17 N 1.34 2.47 -0.46 3.92 1.43 -0.47 -1.56 118.68 125.35 3did s LEU 17 Ca -0.01 -0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 52.54 3did s LEU 17 Cb -0.14 -1.48 0.03 0.00 0.03 0.00 0.00 46.19 44.63 3did s LEU 17 CO -0.06 0.31 0.83 -0.62 0.23 0.00 0.00 176.35 177.05 3did s ASP 18 N -0.52 6.43 0.00 2.29 -1.08 -0.45 -1.21 116.67 122.13 3did s ASP 18 Ca 0.07 -0.08 0.29 0.00 -0.52 0.00 0.00 52.55 52.31 3did s ASP 18 Cb -0.11 -2.41 1.31 0.00 -1.46 0.00 0.00 42.92 40.25 3did s ASP 18 CO 0.01 -0.98 1.95 0.00 0.52 0.00 0.00 175.17 176.68 3did n ALA 19 N 6.89 2.45 -0.00 3.66 0.00 -0.65 -2.01 120.51 130.86 3did n ALA 19 Ca 0.03 -0.13 -0.21 0.00 0.00 0.00 0.00 53.44 53.12 3did n ALA 19 Cb 0.48 -1.46 -0.14 0.00 0.00 0.00 0.00 19.45 18.34 3did n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3did h VAL 20 N 0.03 0.96 -0.01 0.00 2.07 -1.93 -3.40 116.25 113.98 3did h VAL 20 Ca 0.00 -2.37 0.00 0.00 0.82 0.00 0.00 66.70 65.15 3did h VAL 20 Cb 0.42 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 3did h VAL 20 CO 0.00 0.70 -0.71 0.54 0.02 0.00 0.00 177.57 178.12 3did n ARG 21 N -3.91 0.57 -2.94 1.57 1.74 -1.24 -5.03 116.66 107.42 3did n ARG 21 Ca -0.27 -0.46 -0.12 0.00 -0.77 0.00 0.00 57.85 56.23 3did n ARG 21 Cb 0.90 -1.49 0.06 0.00 -1.02 0.00 0.00 32.46 30.91 3did n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3did n GLY 22 N 1.46 -0.72 3.48 -0.13 0.00 -0.85 -5.07 105.19 103.36 3did n GLY 22 Ca 0.07 0.38 -0.10 0.00 0.00 0.00 0.00 46.02 46.37 3did n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3did s SER 23 N -3.39 -0.26 0.50 1.61 1.04 -1.14 -5.04 113.70 107.01 3did s SER 23 Ca 0.34 -0.45 -0.22 0.00 0.48 0.00 0.00 55.95 56.09 3did s SER 23 Cb -0.04 0.56 -0.06 0.00 0.10 0.00 0.00 66.02 66.57 3did s SER 23 CO 0.60 -1.02 1.26 -2.16 0.98 0.00 0.00 173.24 172.90 3did s PRO 24 N -3.86 3.47 -0.40 4.02 0.04 -1.26 -1.34 135.00 135.67 3did s PRO 24 Ca 0.08 2.00 -0.23 0.00 0.04 0.00 0.00 61.00 62.89 3did s PRO 24 Cb -0.00 -2.34 0.02 0.00 0.04 0.00 0.00 34.50 32.21 3did s PRO 24 CO -0.04 -0.85 0.77 0.00 0.04 0.00 0.00 177.00 176.92 3did s ALA 25 N -1.43 3.37 -0.11 8.56 0.00 -0.60 -4.67 121.76 126.88 3did s ALA 25 Ca 0.67 -0.81 -0.04 0.00 0.00 0.00 0.00 51.96 51.78 3did s ALA 25 Cb -0.34 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.35 3did s ALA 25 CO 0.41 -1.66 0.02 0.42 0.00 0.00 0.00 175.76 174.96 3did s ILE 26 N 3.15 4.49 -1.45 0.00 1.01 -1.26 -4.32 121.20 122.83 3did s ILE 26 Ca 0.30 -0.17 -0.10 0.00 0.00 0.00 0.00 60.65 60.69 3did s ILE 26 Cb -0.13 -2.93 0.04 0.00 0.01 0.00 0.00 42.46 39.45 3did s ILE 26 CO 0.19 0.57 0.97 -3.20 0.00 0.00 0.00 174.94 173.47 3did n ASN 27 N 2.51 -5.74 -4.83 3.58 4.05 -0.59 -4.96 115.26 109.27 3did n ASN 27 Ca -0.18 -0.55 -0.37 0.00 0.45 0.00 0.00 54.58 53.92 3did n ASN 27 Cb 0.53 -4.56 -0.06 0.00 1.23 0.00 0.00 39.78 36.92 3did n ASN 27 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3did s VAL 28 N -3.26 5.21 0.15 3.44 1.01 -1.26 -4.77 120.40 120.92 3did s VAL 28 Ca 0.54 0.61 -0.30 0.00 0.00 0.00 0.00 61.98 62.84 3did s VAL 28 Cb -0.25 -3.61 -0.07 0.00 0.00 0.00 0.00 36.38 32.45 3did s VAL 28 CO 0.67 0.56 1.06 0.00 0.00 0.00 0.00 175.10 177.39 3did s ALA 29 N -0.84 3.33 -0.11 5.51 0.00 -1.26 -1.94 121.76 126.45 3did s ALA 29 Ca 0.20 0.74 0.01 0.00 0.00 0.00 0.00 51.96 52.91 3did s ALA 29 Cb -0.15 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.66 3did s ALA 29 CO 0.09 -0.15 -0.13 0.08 0.00 0.00 0.00 175.76 175.65 3did s VAL 30 N -0.11 1.33 -0.09 0.00 1.01 -0.75 -1.23 120.40 120.56 3did s VAL 30 Ca 0.49 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.97 3did s VAL 30 Cb -0.27 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.85 3did s VAL 30 CO 0.33 0.41 -0.19 -1.00 0.00 0.00 0.00 175.10 174.65 3did s HIS 31 N 1.15 2.64 -0.08 5.22 3.76 -0.65 -2.23 115.29 125.11 3did s HIS 31 Ca -0.04 -0.69 0.02 0.00 -0.15 0.00 0.00 55.06 54.20 3did s HIS 31 Cb -0.14 -1.72 -0.02 0.00 1.11 0.00 0.00 32.58 31.81 3did s HIS 31 CO -0.03 -0.20 -0.13 0.08 -0.85 0.00 0.00 174.74 173.60 3did s VAL 32 N 0.06 3.10 0.27 -0.90 1.01 0.14 -1.21 120.40 122.87 3did s VAL 32 Ca -0.08 -0.69 0.11 0.00 0.00 0.00 0.00 61.98 61.32 3did s VAL 32 Cb -0.15 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 3did s VAL 32 CO 0.05 0.57 -0.17 -0.36 0.00 0.00 0.00 175.10 175.19 3did s PHE 33 N -0.35 2.14 -0.02 5.22 0.08 -0.45 -0.90 117.98 123.70 3did s PHE 33 Ca 0.04 -0.42 0.05 0.00 0.12 0.00 0.00 56.93 56.72 3did s PHE 33 Cb -0.13 -0.98 -0.01 0.00 -0.57 0.00 0.00 43.02 41.34 3did s PHE 33 CO 0.02 0.61 -0.18 0.50 -0.10 0.00 0.00 175.22 176.07 3did s ARG 34 N -3.56 1.56 -0.10 0.44 3.52 -0.21 -1.76 118.95 118.84 3did s ARG 34 Ca 0.28 -0.66 -0.29 0.00 -0.13 0.00 0.00 55.73 54.93 3did s ARG 34 Cb -0.03 -1.48 -0.04 0.00 -1.56 0.00 0.00 34.95 31.84 3did s ARG 34 CO 0.13 0.37 1.54 0.21 -0.81 0.00 0.00 175.30 176.75 3did s LYS 35 N -0.35 4.16 0.70 5.12 2.47 -0.62 -1.39 119.74 129.83 3did s LYS 35 Ca 0.05 2.00 -0.01 0.00 -1.56 0.00 0.00 55.97 56.45 3did s LYS 35 Cb -0.08 -3.93 0.11 0.00 -1.46 0.00 0.00 37.83 32.47 3did s LYS 35 CO -0.00 -0.85 0.98 0.00 0.16 0.00 0.00 175.35 175.64 3did s ALA 36 N 3.99 3.63 0.26 3.13 0.00 -0.34 -4.81 121.76 127.63 3did s ALA 36 Ca 0.68 -1.59 -0.06 0.00 0.00 0.00 0.00 51.96 50.99 3did s ALA 36 Cb -0.29 -2.09 0.49 0.00 0.00 0.00 0.00 23.12 21.23 3did s ALA 36 CO 0.25 -1.38 1.62 0.00 0.00 0.00 0.00 175.76 176.25 3did h ALA 37 N -0.49 0.85 -0.29 0.00 0.00 -1.94 -1.18 119.26 116.20 3did h ALA 37 Ca -0.38 0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3did h ALA 37 Cb 1.27 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.52 3did h ALA 37 CO 0.43 -0.44 0.00 -0.40 0.00 0.00 0.00 179.25 178.84 3did n ASP 38 N -5.38 3.07 -0.17 0.00 5.68 -1.26 -4.87 116.55 113.61 3did n ASP 38 Ca 0.15 -2.38 -0.02 0.00 -0.50 0.00 0.00 54.79 52.04 3did n ASP 38 Cb 0.52 -0.53 -0.01 0.00 -1.14 0.00 0.00 41.12 39.96 3did n ASP 38 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3did n ASP 39 N 0.34 -4.66 -4.96 -1.12 9.92 -0.45 -5.04 116.55 110.59 3did n ASP 39 Ca 0.13 0.06 -0.22 0.00 -0.53 0.00 0.00 54.79 54.23 3did n ASP 39 Cb 0.64 -2.36 0.01 0.00 -0.64 0.00 0.00 41.12 38.77 3did n ASP 39 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3did s THR 40 N -1.62 3.90 -0.30 -3.53 -4.23 -1.26 -4.80 115.64 103.80 3did s THR 40 Ca 0.00 -0.58 -0.26 0.00 -1.18 0.00 0.00 61.69 59.67 3did s THR 40 Cb 0.00 -3.43 0.01 0.00 1.34 0.00 0.00 72.50 70.42 3did s THR 40 CO 0.00 -0.28 0.92 0.26 -0.54 0.00 0.00 174.62 174.98 3did s TRP 41 N -2.52 3.20 -0.16 3.99 0.52 -1.26 -1.20 118.94 121.52 3did s TRP 41 Ca 0.49 1.04 -0.15 0.00 0.02 0.00 0.00 56.10 57.49 3did s TRP 41 Cb -0.10 -3.39 -0.04 0.00 -1.15 0.00 0.00 33.47 28.79 3did s TRP 41 CO 0.37 -0.62 0.36 -2.00 0.02 0.00 0.00 176.95 175.08 3did s GLU 42 N 3.23 4.27 0.15 4.98 2.12 -0.49 -4.89 118.70 128.07 3did s GLU 42 Ca 0.38 0.21 -0.34 0.00 0.36 0.00 0.00 54.97 55.58 3did s GLU 42 Cb -0.14 -3.45 -0.14 0.00 0.26 0.00 0.00 34.13 30.66 3did s GLU 42 CO 0.13 0.17 1.50 -2.30 -0.54 0.00 0.00 175.26 174.22 3did n PRO 43 N 3.75 1.90 -0.01 4.30 -0.02 -1.26 -1.05 135.00 142.61 3did n PRO 43 Ca -0.10 0.68 -0.02 0.00 -2.02 0.00 0.00 63.50 62.04 3did n PRO 43 Cb 0.52 -2.41 -0.01 0.00 -0.02 0.00 0.00 33.50 31.58 3did n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3did n PHE 44 N 3.04 0.00 -3.49 6.00 7.35 -0.08 -4.84 117.46 125.44 3did n PHE 44 Ca 0.17 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.74 3did n PHE 44 Cb 0.27 -0.07 -0.03 0.00 0.35 0.00 0.00 39.48 40.00 3did n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3did s ALA 45 N -2.04 -1.77 0.18 3.13 0.00 -1.04 -5.02 121.76 115.20 3did s ALA 45 Ca -0.03 1.01 -0.12 0.00 0.00 0.00 0.00 51.96 52.82 3did s ALA 45 Cb 0.01 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.44 3did s ALA 45 CO 0.04 -0.60 0.38 -1.54 0.00 0.00 0.00 175.76 174.03 3did s SER 46 N -2.13 -0.07 -0.02 0.00 1.04 -1.26 0.27 113.70 111.53 3did s SER 46 Ca 0.00 -0.73 -0.09 0.00 0.48 0.00 0.00 55.95 55.61 3did s SER 46 Cb -0.01 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.63 3did s SER 46 CO -0.05 -0.96 0.38 0.61 0.98 0.00 0.00 173.24 174.20 3did n GLY 47 N -0.26 0.37 3.13 7.32 0.00 -0.95 -4.98 105.19 109.82 3did n GLY 47 Ca -0.08 -0.87 -0.22 0.00 0.00 0.00 0.00 46.02 44.85 3did n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3did s LYS 48 N -2.00 1.14 0.54 1.61 1.02 -1.26 -1.80 119.74 118.98 3did s LYS 48 Ca 0.09 -0.59 -0.21 0.00 0.02 0.00 0.00 55.97 55.28 3did s LYS 48 Cb -0.00 -1.12 -0.05 0.00 -0.52 0.00 0.00 37.83 36.14 3did s LYS 48 CO -0.01 0.30 1.24 0.95 -0.92 0.00 0.00 175.35 176.92 3did s THR 49 N -0.47 2.58 0.20 2.17 -4.23 -0.82 -4.82 115.64 110.25 3did s THR 49 Ca 0.05 0.40 -0.03 0.00 -1.18 0.00 0.00 61.69 60.93 3did s THR 49 Cb -0.06 -3.19 0.04 0.00 1.34 0.00 0.00 72.50 70.63 3did s THR 49 CO -0.00 -0.04 0.27 -1.54 -0.54 0.00 0.00 174.62 172.77 3did n SER 50 N -1.11 0.07 0.31 3.99 3.41 -0.39 -1.55 113.62 118.35 3did n SER 50 Ca 0.11 -1.12 0.20 0.00 -0.26 0.00 0.00 58.87 57.79 3did n SER 50 Cb 0.48 -0.20 0.96 0.00 -0.26 0.00 0.00 64.21 65.18 3did n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3did h GLU 51 N 0.00 0.00 -0.15 4.33 4.39 -1.93 -2.21 114.58 119.01 3did h GLU 51 Ca -0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.61 3did h GLU 51 Cb 0.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 3did h GLU 51 CO 0.07 0.01 0.00 -1.13 -1.16 0.00 0.00 179.01 176.80 3did n SER 52 N -3.14 1.94 -0.06 1.42 3.41 -1.26 -4.87 113.62 111.07 3did n SER 52 Ca -0.01 -1.71 -0.01 0.00 -0.26 0.00 0.00 58.87 56.88 3did n SER 52 Cb 0.18 -0.09 -0.00 0.00 -0.26 0.00 0.00 64.21 64.04 3did n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3did n GLY 53 N 1.20 0.46 3.69 5.00 0.00 -0.83 -4.85 105.19 109.87 3did n GLY 53 Ca 0.17 -0.17 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3did n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3did s GLU 54 N -0.75 2.69 -0.28 1.61 2.02 -1.26 -1.49 118.70 121.24 3did s GLU 54 Ca 0.00 -0.72 -0.00 0.00 0.02 0.00 0.00 54.97 54.26 3did s GLU 54 Cb 0.00 -2.62 0.08 0.00 0.10 0.00 0.00 34.13 31.70 3did s GLU 54 CO 0.00 0.58 0.05 -1.17 0.02 0.00 0.00 175.26 174.74 3did s LEU 55 N -1.98 2.39 0.35 1.80 2.96 -0.12 -1.26 118.68 122.81 3did s LEU 55 Ca 0.23 -1.46 0.07 0.00 -0.22 0.00 0.00 54.13 52.76 3did s LEU 55 Cb -0.12 -0.96 -0.02 0.00 0.50 0.00 0.00 46.19 45.59 3did s LEU 55 CO 0.15 -0.36 0.34 -1.00 -1.32 0.00 0.00 176.35 174.16 3did s HIS 56 N 1.54 2.91 -0.01 5.38 3.76 -1.26 -2.45 115.29 125.16 3did s HIS 56 Ca 0.05 -0.31 0.00 0.00 -0.15 0.00 0.00 55.06 54.65 3did s HIS 56 Cb -0.18 -1.89 0.00 0.00 1.11 0.00 0.00 32.58 31.63 3did s HIS 56 CO -0.16 0.10 0.00 0.41 -0.85 0.00 0.00 174.74 174.24 3did n GLY 57 N -1.45 0.48 0.31 -2.22 0.00 -1.26 -4.96 105.19 96.09 3did n GLY 57 Ca -0.01 -0.16 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 3did n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3did h LEU 58 N 0.00 0.94 0.00 0.99 3.38 -1.87 -3.47 115.31 115.28 3did h LEU 58 Ca -0.00 -0.09 -0.21 0.00 0.09 0.00 0.00 57.88 57.67 3did h LEU 58 Cb 0.02 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.48 3did h LEU 58 CO 0.00 0.76 -0.11 1.07 0.09 0.00 0.00 178.44 180.25 3did n THR 59 N -4.46 0.00 -4.36 0.22 5.66 -1.26 -4.81 114.28 105.26 3did n THR 59 Ca 0.07 -1.34 -0.21 0.00 -3.05 0.00 0.00 64.05 59.52 3did n THR 59 Cb 0.08 0.82 -0.11 0.00 -1.55 0.00 0.00 70.33 69.58 3did n THR 59 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3did s THR 60 N -2.72 1.92 0.27 1.09 -4.23 -1.26 -4.68 115.64 106.04 3did s THR 60 Ca 0.22 -2.12 0.01 0.00 -1.18 0.00 0.00 61.69 58.61 3did s THR 60 Cb -0.01 -2.01 0.26 0.00 1.34 0.00 0.00 72.50 72.08 3did s THR 60 CO 0.16 -0.43 1.76 -0.08 -0.54 0.00 0.00 174.62 175.49 3did h GLU 61 N 2.81 0.63 -0.64 3.99 4.81 -2.00 -1.95 114.58 122.23 3did h GLU 61 Ca -0.40 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.74 3did h GLU 61 Cb 1.22 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.43 3did h GLU 61 CO 0.57 0.41 0.22 1.49 -0.73 0.00 0.00 179.01 180.97 3did h GLU 62 N 0.64 0.98 0.00 1.92 4.57 -2.05 -3.19 114.58 117.46 3did h GLU 62 Ca 0.49 -0.20 -0.11 0.00 -1.18 0.00 0.00 59.36 58.37 3did h GLU 62 Cb 0.72 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.15 3did h GLU 62 CO -0.38 0.85 -0.51 0.93 -1.18 0.00 0.00 179.01 178.73 3did h GLU 63 N 0.92 0.00 -3.77 1.92 5.08 -1.86 -3.40 114.58 113.47 3did h GLU 63 Ca 0.21 0.00 -0.76 0.00 -1.00 0.00 0.00 59.36 57.81 3did h GLU 63 Cb 0.26 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.35 3did h GLU 63 CO -0.01 0.51 1.77 0.34 -1.00 0.00 0.00 179.01 180.62 3did n PHE 64 N -3.63 3.42 -1.93 4.33 7.35 -0.78 -4.99 117.46 121.23 3did n PHE 64 Ca -0.01 -2.93 -0.30 0.00 -0.76 0.00 0.00 57.45 53.46 3did n PHE 64 Cb 0.58 -1.96 0.05 0.00 0.35 0.00 0.00 39.48 38.50 3did n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 3did s VAL 65 N 0.45 3.40 0.50 -2.13 -7.23 -1.26 -4.94 120.40 109.18 3did s VAL 65 Ca 0.40 0.41 -0.22 0.00 -1.81 0.00 0.00 61.98 60.76 3did s VAL 65 Cb 0.06 -3.44 -0.08 0.00 0.56 0.00 0.00 36.38 33.48 3did s VAL 65 CO 0.01 -0.57 1.01 -0.62 -0.31 0.00 0.00 175.10 174.62 3did n GLU 66 N -2.99 1.24 -3.73 4.82 1.02 -1.26 -4.54 120.64 115.19 3did n GLU 66 Ca 0.07 0.45 0.00 0.00 -0.02 0.00 0.00 57.16 57.66 3did n GLU 66 Cb 0.57 -2.13 0.00 0.00 -0.02 0.00 0.00 31.44 29.86 3did n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3did n GLY 67 N 1.19 -1.64 3.40 0.62 0.00 -0.72 -4.82 105.19 103.21 3did n GLY 67 Ca 0.11 -1.30 -0.35 0.00 0.00 0.00 0.00 46.02 44.48 3did n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3did s ILE 68 N -2.65 3.71 0.05 -0.61 1.01 -1.26 -0.73 121.20 120.72 3did s ILE 68 Ca 0.00 -0.39 0.09 0.00 0.00 0.00 0.00 60.65 60.35 3did s ILE 68 Cb 0.00 -2.67 -0.03 0.00 0.01 0.00 0.00 42.46 39.77 3did s ILE 68 CO 0.00 0.43 -0.26 -0.31 0.00 0.00 0.00 174.94 174.80 3did s TYR 69 N 1.10 2.34 -0.09 3.97 2.02 -0.51 -1.59 117.35 124.58 3did s TYR 69 Ca 0.02 -0.40 0.04 0.00 -0.37 0.00 0.00 57.07 56.36 3did s TYR 69 Cb -0.14 -1.39 -0.00 0.00 -0.40 0.00 0.00 41.96 40.02 3did s TYR 69 CO 0.01 0.14 -0.23 0.21 -1.57 0.00 0.00 175.55 174.10 3did s LYS 70 N -1.27 2.90 -0.25 -0.62 2.20 -0.72 -1.88 119.74 120.10 3did s LYS 70 Ca 0.12 -0.85 -0.08 0.00 -0.36 0.00 0.00 55.97 54.80 3did s LYS 70 Cb -0.10 -2.22 -0.03 0.00 -1.51 0.00 0.00 37.83 33.97 3did s LYS 70 CO 0.02 0.19 0.08 0.08 -0.36 0.00 0.00 175.35 175.37 3did s VAL 71 N 0.30 4.44 -0.20 4.02 1.01 -0.65 -1.34 120.40 127.97 3did s VAL 71 Ca -0.17 -0.13 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 3did s VAL 71 Cb -0.17 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 33.13 3did s VAL 71 CO 0.08 0.34 -0.07 -0.70 0.00 0.00 0.00 175.10 174.75 3did s GLU 72 N 1.54 3.35 -0.20 2.72 2.12 -0.35 -1.68 118.70 126.20 3did s GLU 72 Ca 0.06 -0.65 -0.05 0.00 0.36 0.00 0.00 54.97 54.69 3did s GLU 72 Cb -0.15 -2.91 -0.02 0.00 0.26 0.00 0.00 34.13 31.30 3did s GLU 72 CO 0.04 -0.13 0.01 0.42 -0.54 0.00 0.00 175.26 175.06 3did s ILE 73 N 1.27 3.98 -0.08 -3.70 1.01 0.00 -1.63 121.20 122.05 3did s ILE 73 Ca 0.03 -0.30 -0.30 0.00 0.00 0.00 0.00 60.65 60.08 3did s ILE 73 Cb -0.14 -2.81 -0.02 0.00 0.01 0.00 0.00 42.46 39.50 3did s ILE 73 CO -0.03 0.42 1.10 -1.81 0.00 0.00 0.00 174.94 174.62 3did s ASP 74 N 1.06 7.15 0.00 3.58 1.01 -0.37 -1.58 116.67 127.52 3did s ASP 74 Ca 0.02 1.67 0.00 0.00 0.71 0.00 0.00 52.55 54.95 3did s ASP 74 Cb -0.14 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.23 3did s ASP 74 CO 0.02 -0.51 0.58 0.35 0.21 0.00 0.00 175.17 175.82 3did n THR 75 N 4.57 0.34 -0.13 -1.27 -2.24 -0.84 -4.68 114.28 110.03 3did n THR 75 Ca 0.10 -0.44 -0.09 0.00 -2.27 0.00 0.00 64.05 61.35 3did n THR 75 Cb 0.47 1.00 -0.07 0.00 -2.10 0.00 0.00 70.33 69.64 3did n THR 75 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3did h LYS 76 N 0.00 -0.20 -0.21 -0.78 3.64 -1.78 -3.22 116.57 114.01 3did h LYS 76 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3did h LYS 76 Cb 0.53 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 3did h LYS 76 CO 0.00 -0.14 0.00 -1.13 -2.27 0.00 0.00 179.45 175.91 3did n SER 77 N -4.48 3.03 0.23 4.20 3.41 -1.26 -4.42 113.62 114.33 3did n SER 77 Ca -0.02 -1.91 0.12 0.00 -0.26 0.00 0.00 58.87 56.81 3did n SER 77 Cb 0.22 -0.13 0.73 0.00 -0.26 0.00 0.00 64.21 64.77 3did n SER 77 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3did h TYR 78 N 3.99 0.00 -0.01 7.33 3.20 -1.88 -2.66 116.97 126.94 3did h TYR 78 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3did h TYR 78 Cb 0.89 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.16 3did h TYR 78 CO 0.13 0.00 -0.62 0.91 -1.64 0.00 0.00 178.16 176.94 3did n TRP 79 N -4.27 0.00 -0.30 -3.82 7.02 -1.26 -4.70 117.44 110.10 3did n TRP 79 Ca -0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.47 3did n TRP 79 Cb 0.17 -0.02 0.19 0.00 -2.42 0.00 0.00 31.31 29.24 3did n TRP 79 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 3did h LYS 80 N 1.56 1.12 0.00 -0.99 3.64 -1.67 0.22 116.57 120.45 3did h LYS 80 Ca 0.00 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3did h LYS 80 Cb 0.66 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 3did h LYS 80 CO 0.00 0.74 0.00 0.00 -2.27 0.00 0.00 179.45 177.92 3did h ALA 81 N 1.47 1.00 0.00 5.00 0.00 -1.84 0.17 119.26 125.06 3did h ALA 81 Ca 0.34 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.19 3did h ALA 81 Cb -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3did h ALA 81 CO -0.09 0.00 -0.29 -0.07 0.00 0.00 0.00 179.25 178.80 3did h LEU 82 N 0.00 0.00 0.00 0.00 3.38 -1.29 -3.48 115.31 113.92 3did h LEU 82 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3did h LEU 82 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3did h LEU 82 CO 0.00 0.29 0.00 0.61 0.09 0.00 0.00 178.44 179.43 3did n GLY 83 N 0.91 0.58 3.04 0.83 0.00 0.05 -5.07 105.19 105.53 3did n GLY 83 Ca 0.02 -0.63 -0.21 0.00 0.00 0.00 0.00 46.02 45.20 3did n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3did s ILE 84 N -2.00 0.92 -0.16 -0.61 1.01 -1.25 -5.07 121.20 114.04 3did s ILE 84 Ca 0.00 -0.46 -0.14 0.00 0.00 0.00 0.00 60.65 60.05 3did s ILE 84 Cb 0.00 -0.79 -0.05 0.00 0.01 0.00 0.00 42.46 41.63 3did s ILE 84 CO 0.00 0.27 0.32 -0.55 0.00 0.00 0.00 174.94 174.98 3did s SER 85 N 0.00 6.46 0.86 3.58 0.15 -1.26 -4.36 113.70 119.14 3did s SER 85 Ca -0.00 0.54 -0.13 0.00 0.70 0.00 0.00 55.95 57.06 3did s SER 85 Cb -0.07 -2.20 0.12 0.00 -1.71 0.00 0.00 66.02 62.16 3did s SER 85 CO 0.00 0.08 1.20 -2.16 1.20 0.00 0.00 173.24 173.56 3did s PRO 86 N 0.52 1.51 0.60 5.44 0.04 -1.26 -4.96 135.00 136.89 3did s PRO 86 Ca 0.18 0.05 0.30 0.00 0.04 0.00 0.00 61.00 61.57 3did s PRO 86 Cb -0.13 -1.90 1.74 0.00 0.04 0.00 0.00 34.50 34.24 3did s PRO 86 CO 0.05 -1.90 2.12 0.00 0.04 0.00 0.00 177.00 177.31 3did h MET 87 N -1.28 0.00 -1.96 4.56 -0.00 -1.47 -3.44 114.93 111.34 3did h MET 87 Ca -0.46 0.00 0.03 0.00 -0.00 0.00 0.00 59.70 59.27 3did h MET 87 Cb 1.31 0.00 -0.19 0.00 -0.00 0.00 0.00 31.60 32.72 3did h MET 87 CO 0.60 0.00 0.39 -1.58 -0.00 0.00 0.00 176.91 176.32 3did s HIS 88 N -4.55 -0.47 -1.19 -0.10 5.65 -1.26 -5.07 115.29 108.29 3did s HIS 88 Ca -0.05 0.69 0.12 0.00 0.25 0.00 0.00 55.06 56.08 3did s HIS 88 Cb 0.15 0.46 0.57 0.00 -1.18 0.00 0.00 32.58 32.58 3did s HIS 88 CO 0.51 -0.51 1.36 -0.85 -0.65 0.00 0.00 174.74 174.60 3did n GLU 89 N 0.51 0.08 -4.28 2.88 0.00 -1.26 -4.71 120.64 113.86 3did n GLU 89 Ca -0.13 0.23 -0.15 0.00 0.00 0.00 0.00 57.16 57.11 3did n GLU 89 Cb 0.59 -1.50 -0.10 0.00 0.00 0.00 0.00 31.44 30.43 3did n GLU 89 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 3did s HIS 90 N -2.81 1.38 -0.17 -1.84 3.76 -1.26 -1.98 115.29 112.36 3did s HIS 90 Ca 0.09 -0.81 -0.04 0.00 -0.15 0.00 0.00 55.06 54.14 3did s HIS 90 Cb 0.08 -0.73 -0.03 0.00 1.11 0.00 0.00 32.58 33.01 3did s HIS 90 CO 0.21 0.05 -0.03 0.00 -0.85 0.00 0.00 174.74 174.12 3did s ALA 91 N -3.35 3.00 -0.03 -1.40 0.00 -0.62 -4.88 121.76 114.48 3did s ALA 91 Ca 0.21 -0.88 0.06 0.00 0.00 0.00 0.00 51.96 51.35 3did s ALA 91 Cb 0.04 -1.63 -0.01 0.00 0.00 0.00 0.00 23.12 21.52 3did s ALA 91 CO 0.03 0.08 -0.22 -1.83 0.00 0.00 0.00 175.76 173.82 3did s GLU 92 N 0.59 1.99 -0.08 0.00 1.03 -1.26 -0.82 118.70 120.15 3did s GLU 92 Ca -0.02 -0.80 -0.00 0.00 0.03 0.00 0.00 54.97 54.17 3did s GLU 92 Cb -0.14 -1.83 0.02 0.00 -0.80 0.00 0.00 34.13 31.38 3did s GLU 92 CO 0.02 0.43 -0.06 0.14 -1.33 0.00 0.00 175.26 174.47 3did s VAL 93 N -0.37 0.81 -0.16 1.83 -7.23 -0.67 -5.01 120.40 109.59 3did s VAL 93 Ca 0.04 -0.19 -0.11 0.00 -1.81 0.00 0.00 61.98 59.92 3did s VAL 93 Cb -0.10 -0.84 -0.05 0.00 0.56 0.00 0.00 36.38 35.95 3did s VAL 93 CO 0.01 0.32 0.19 -0.69 -0.31 0.00 0.00 175.10 174.61 3did s VAL 94 N 1.49 5.38 0.04 1.32 1.01 -1.26 -1.64 120.40 126.74 3did s VAL 94 Ca -0.00 0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.31 3did s VAL 94 Cb -0.13 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 3did s VAL 94 CO -0.04 0.47 -0.05 0.72 0.00 0.00 0.00 175.10 176.20 3did s PHE 95 N 0.04 0.48 -0.24 5.22 -0.12 -0.79 -5.03 117.98 117.54 3did s PHE 95 Ca 0.13 -0.66 -0.11 0.00 -0.05 0.00 0.00 56.93 56.24 3did s PHE 95 Cb -0.12 -0.31 -0.05 0.00 -0.63 0.00 0.00 43.02 41.91 3did s PHE 95 CO 0.02 -0.19 0.20 0.99 -0.05 0.00 0.00 175.22 176.19 3did s THR 96 N -2.09 5.33 0.38 -4.49 2.01 -1.26 -1.43 115.64 114.10 3did s THR 96 Ca -0.08 0.27 0.01 0.00 0.31 0.00 0.00 61.69 62.20 3did s THR 96 Cb -0.05 -3.54 0.01 0.00 0.01 0.00 0.00 72.50 68.92 3did s THR 96 CO -0.03 0.32 0.08 0.00 -0.69 0.00 0.00 174.62 174.30 3did n ALA 97 N 4.42 0.40 0.10 7.40 0.00 0.09 -4.37 120.51 128.55 3did n ALA 97 Ca -0.14 -1.68 0.01 0.00 0.00 0.00 0.00 53.44 51.63 3did n ALA 97 Cb 0.52 0.86 0.05 0.00 0.00 0.00 0.00 19.45 20.88 3did n ALA 97 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3did n ASN 98 N -1.40 0.00 0.00 0.00 4.13 -1.26 -1.75 115.26 114.98 3did n ASN 98 Ca -0.12 0.19 0.00 0.00 1.68 0.00 0.00 54.58 56.33 3did n ASN 98 Cb 0.47 -0.23 0.00 0.00 -1.54 0.00 0.00 39.78 38.49 3did n ASN 98 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 3did n ASP 99 N -1.23 0.00 0.07 6.41 5.68 -1.26 -4.58 116.55 121.65 3did n ASP 99 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.30 3did n ASP 99 Cb 0.01 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 3did n ASP 99 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3did n SER 100 N 0.04 0.47 -4.43 -1.12 7.64 -1.26 -5.13 113.62 109.83 3did n SER 100 Ca 0.00 0.23 -0.21 0.00 1.01 0.00 0.00 58.87 59.90 3did n SER 100 Cb 0.00 -0.03 -0.10 0.00 -1.01 0.00 0.00 64.21 63.07 3did n SER 100 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3did s GLY 101 N -4.53 1.93 -0.13 0.23 0.00 -1.26 -5.05 107.32 98.51 3did s GLY 101 Ca 0.00 -1.97 -0.06 0.00 0.00 0.00 0.00 44.72 42.69 3did s GLY 101 CO 0.00 -1.82 0.10 2.56 0.00 0.00 0.00 173.10 173.94 3did s PRO 102 N -3.82 3.48 0.30 2.90 0.04 -1.26 -5.11 135.00 131.54 3did s PRO 102 Ca 0.33 -0.23 0.09 0.00 0.04 0.00 0.00 61.00 61.22 3did s PRO 102 Cb 0.07 -3.12 -0.06 0.00 0.04 0.00 0.00 34.50 31.42 3did s PRO 102 CO 0.13 0.64 -0.10 1.03 0.04 0.00 0.00 177.00 178.75 3did s ARG 103 N -0.66 1.66 -0.14 4.56 1.81 -1.26 -4.90 118.95 120.02 3did s ARG 103 Ca 0.12 -1.83 -0.08 0.00 -1.72 0.00 0.00 55.73 52.22 3did s ARG 103 Cb -0.12 -1.45 -0.04 0.00 -0.45 0.00 0.00 34.95 32.89 3did s ARG 103 CO 0.02 0.13 0.14 1.03 -0.68 0.00 0.00 175.30 175.94 3did s ARG 104 N -3.65 3.61 -0.08 3.54 0.52 -0.45 -4.94 118.95 117.51 3did s ARG 104 Ca 0.30 -0.14 0.04 0.00 -0.52 0.00 0.00 55.73 55.41 3did s ARG 104 Cb 0.02 -3.24 -0.02 0.00 0.52 0.00 0.00 34.95 32.23 3did s ARG 104 CO 0.14 0.67 -0.18 0.71 0.02 0.00 0.00 175.30 176.66 3did s TYR 105 N -0.73 2.63 -0.14 -0.53 2.02 -0.47 -1.89 117.35 118.24 3did s TYR 105 Ca 0.14 -0.52 0.02 0.00 -0.37 0.00 0.00 57.07 56.34 3did s TYR 105 Cb -0.12 -1.68 0.01 0.00 -0.40 0.00 0.00 41.96 39.78 3did s TYR 105 CO 0.03 -0.08 -0.20 0.99 -1.57 0.00 0.00 175.55 174.71 3did s THR 106 N -0.21 1.94 -0.33 -0.71 2.01 -0.44 -1.33 115.64 116.57 3did s THR 106 Ca -0.01 -0.91 -0.11 0.00 0.31 0.00 0.00 61.69 60.98 3did s THR 106 Cb -0.13 -1.73 -0.00 0.00 0.01 0.00 0.00 72.50 70.64 3did s THR 106 CO 0.03 0.53 0.19 -0.63 -0.69 0.00 0.00 174.62 174.05 3did s ILE 107 N 0.89 4.84 -0.16 1.82 -1.09 -0.42 -1.10 121.20 125.99 3did s ILE 107 Ca -0.06 -0.42 -0.05 0.00 -2.23 0.00 0.00 60.65 57.89 3did s ILE 107 Cb -0.15 -3.52 -0.03 0.00 -1.58 0.00 0.00 42.46 37.18 3did s ILE 107 CO -0.03 -0.01 0.00 0.00 -1.23 0.00 0.00 174.94 173.67 3did s ALA 108 N 1.64 3.17 -0.09 9.38 0.00 -0.69 -1.28 121.76 133.89 3did s ALA 108 Ca 0.05 -0.79 0.02 0.00 0.00 0.00 0.00 51.96 51.24 3did s ALA 108 Cb -0.17 -1.68 0.01 0.00 0.00 0.00 0.00 23.12 21.27 3did s ALA 108 CO 0.08 0.23 -0.16 0.00 0.00 0.00 0.00 175.76 175.91 3did s ALA 109 N 0.28 1.59 -0.37 0.00 0.00 -0.37 -1.09 121.76 121.81 3did s ALA 109 Ca -0.01 -0.63 -0.11 0.00 0.00 0.00 0.00 51.96 51.22 3did s ALA 109 Cb -0.13 -0.70 0.03 0.00 0.00 0.00 0.00 23.12 22.31 3did s ALA 109 CO 0.02 0.09 0.20 -1.64 0.00 0.00 0.00 175.76 174.43 3did s MET 110 N 0.70 2.86 -0.17 0.00 -1.94 -0.58 -1.37 119.30 118.79 3did s MET 110 Ca -0.13 -1.06 -0.06 0.00 -1.71 0.00 0.00 55.69 52.73 3did s MET 110 Cb -0.16 -3.70 -0.04 0.00 2.01 0.00 0.00 34.83 32.94 3did s MET 110 CO 0.03 -0.67 0.03 -0.51 -0.01 0.00 0.00 175.02 173.89 3did s LEU 111 N 1.55 3.67 0.19 -0.03 1.43 -0.35 -2.15 118.68 122.99 3did s LEU 111 Ca 0.02 0.03 0.08 0.00 -1.03 0.00 0.00 54.13 53.23 3did s LEU 111 Cb -0.19 -1.91 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 3did s LEU 111 CO 0.06 0.18 -0.15 -0.44 0.23 0.00 0.00 176.35 176.23 3did s SER 112 N 0.34 2.58 0.45 2.29 0.01 -0.92 -1.63 113.70 116.81 3did s SER 112 Ca 0.01 -0.97 0.20 0.00 1.31 0.00 0.00 55.95 56.50 3did s SER 112 Cb -0.13 -0.14 1.16 0.00 0.21 0.00 0.00 66.02 67.13 3did s SER 112 CO 0.01 -0.13 1.88 -0.65 0.41 0.00 0.00 173.24 174.76 3did h PRO 113 N 2.77 0.31 0.00 12.44 0.11 -1.99 -3.10 132.00 142.53 3did h PRO 113 Ca -0.39 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3did h PRO 113 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3did h PRO 113 CO 0.59 0.20 -0.03 0.66 -0.21 0.00 0.00 178.00 179.21 3did n TYR 114 N -4.46 0.00 -3.58 0.65 4.01 -1.26 -1.06 117.16 111.46 3did n TYR 114 Ca 0.18 -0.80 -0.11 0.00 -0.16 0.00 0.00 57.90 57.01 3did n TYR 114 Cb 0.71 -0.12 -0.04 0.00 -0.31 0.00 0.00 39.34 39.58 3did n TYR 114 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3did s SER 115 N -2.25 -0.33 0.17 7.72 0.15 -1.17 -5.02 113.70 112.97 3did s SER 115 Ca 0.22 -0.25 -0.23 0.00 0.70 0.00 0.00 55.95 56.39 3did s SER 115 Cb 0.19 0.52 0.06 0.00 -1.71 0.00 0.00 66.02 65.08 3did s SER 115 CO 0.02 -0.90 0.67 -0.72 1.20 0.00 0.00 173.24 173.51 3did s TYR 116 N -3.80 -0.42 -0.16 3.44 -0.85 -1.26 -2.18 117.35 112.12 3did s TYR 116 Ca 0.03 0.15 -0.03 0.00 -0.52 0.00 0.00 57.07 56.71 3did s TYR 116 Cb 0.01 0.60 0.05 0.00 0.38 0.00 0.00 41.96 43.00 3did s TYR 116 CO -0.11 -0.91 0.04 -1.54 -1.52 0.00 0.00 175.55 171.51 3did s SER 117 N -2.77 2.50 0.03 -0.18 1.04 -0.92 -5.02 113.70 108.38 3did s SER 117 Ca 0.04 -0.62 0.07 0.00 0.48 0.00 0.00 55.95 55.93 3did s SER 117 Cb -0.02 -0.49 -0.02 0.00 0.10 0.00 0.00 66.02 65.59 3did s SER 117 CO -0.07 -0.29 -0.21 0.28 0.98 0.00 0.00 173.24 173.93 3did s THR 118 N 1.94 1.66 -0.03 2.02 -1.32 -1.26 -1.53 115.64 117.12 3did s THR 118 Ca 0.01 -1.11 0.01 0.00 -1.21 0.00 0.00 61.69 59.39 3did s THR 118 Cb -0.16 -1.42 0.02 0.00 -1.51 0.00 0.00 72.50 69.42 3did s THR 118 CO -0.07 0.28 -0.04 -0.89 -2.21 0.00 0.00 174.62 171.68 3did s THR 119 N -0.71 0.47 -0.26 5.08 2.01 -0.25 -5.02 115.64 116.96 3did s THR 119 Ca 0.08 -0.13 -0.10 0.00 0.31 0.00 0.00 61.69 61.84 3did s THR 119 Cb -0.09 -0.48 -0.05 0.00 0.01 0.00 0.00 72.50 71.90 3did s THR 119 CO 0.01 0.19 0.16 0.00 -0.69 0.00 0.00 174.62 174.29 3did s ALA 120 N 0.62 3.46 -0.26 7.40 0.00 -1.26 -1.71 121.76 130.02 3did s ALA 120 Ca -0.08 -1.05 -0.08 0.00 0.00 0.00 0.00 51.96 50.75 3did s ALA 120 Cb -0.11 -2.35 -0.03 0.00 0.00 0.00 0.00 23.12 20.63 3did s ALA 120 CO -0.00 -0.45 0.09 0.08 0.00 0.00 0.00 175.76 175.48 3did s VAL 121 N 1.57 4.42 -0.17 0.00 1.01 -0.26 -4.99 120.40 121.98 3did s VAL 121 Ca 0.07 -0.20 0.01 0.00 0.00 0.00 0.00 61.98 61.86 3did s VAL 121 Cb -0.15 -3.11 0.01 0.00 0.00 0.00 0.00 36.38 33.13 3did s VAL 121 CO 0.08 0.28 -0.18 -0.69 0.00 0.00 0.00 175.10 174.60 3did s VAL 122 N 1.62 2.32 0.11 2.92 1.01 -1.26 -1.33 120.40 125.79 3did s VAL 122 Ca 0.06 -0.86 0.07 0.00 0.00 0.00 0.00 61.98 61.24 3did s VAL 122 Cb -0.16 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 3did s VAL 122 CO 0.05 0.52 -0.17 0.42 0.00 0.00 0.00 175.10 175.92 3did s THR 123 N 1.13 1.49 0.00 3.92 -4.23 -0.79 -4.98 115.64 112.18 3did s THR 123 Ca 0.01 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 3did s THR 123 Cb -0.14 -1.46 0.00 0.00 1.34 0.00 0.00 72.50 72.24 3did s THR 123 CO -0.07 -0.21 0.42 -3.20 -0.54 0.00 0.00 174.62 171.02