#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 0.44 -3.28 0.00 0.11 -1.91 -3.43 132.00 123.93 3did h PRO 11 Ca 0.00 -0.03 -0.30 0.00 0.11 0.00 0.00 66.00 65.77 3did h PRO 11 Cb 0.00 -0.10 -0.35 0.00 0.11 0.00 0.00 31.00 30.66 3did h PRO 11 CO 0.00 0.32 -0.68 -1.17 -0.21 0.00 0.00 178.00 176.26 3did s LEU 12 N -9.37 0.42 0.03 2.35 2.96 -1.26 -1.26 118.68 112.54 3did s LEU 12 Ca -0.08 0.19 0.03 0.00 -0.22 0.00 0.00 54.13 54.06 3did s LEU 12 Cb 0.17 0.10 -0.02 0.00 0.50 0.00 0.00 46.19 46.95 3did s LEU 12 CO 0.72 -0.20 -0.10 -0.32 -1.32 0.00 0.00 176.35 175.14 3did s MET 13 N 1.74 0.69 -0.09 1.98 -2.45 -0.82 -4.41 119.30 115.94 3did s MET 13 Ca -0.02 -0.59 0.04 0.00 -1.25 0.00 0.00 55.69 53.87 3did s MET 13 Cb -0.12 -0.62 0.00 0.00 1.25 0.00 0.00 34.83 35.34 3did s MET 13 CO -0.04 0.15 -0.21 0.08 1.05 0.00 0.00 175.02 176.05 3did s VAL 14 N -0.77 1.83 -0.05 10.11 1.01 -1.18 -1.59 120.40 129.76 3did s VAL 14 Ca -0.01 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.11 3did s VAL 14 Cb -0.07 -1.59 -0.00 0.00 0.00 0.00 0.00 36.38 34.72 3did s VAL 14 CO 0.01 0.51 -0.17 -0.75 0.00 0.00 0.00 175.10 174.70 3did s LYS 15 N 0.35 1.82 -0.12 2.72 2.20 -0.48 -1.61 119.74 124.62 3did s LYS 15 Ca -0.16 -0.58 0.02 0.00 -0.36 0.00 0.00 55.97 54.89 3did s LYS 15 Cb -0.17 -1.55 0.01 0.00 -1.51 0.00 0.00 37.83 34.61 3did s LYS 15 CO 0.07 0.20 -0.18 0.08 -0.36 0.00 0.00 175.35 175.16 3did s VAL 16 N 0.16 1.71 0.08 4.02 1.01 -0.28 -1.12 120.40 125.97 3did s VAL 16 Ca -0.06 -0.77 0.06 0.00 0.00 0.00 0.00 61.98 61.21 3did s VAL 16 Cb -0.12 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 3did s VAL 16 CO 0.03 0.48 -0.10 -0.76 0.00 0.00 0.00 175.10 174.75 3did s LEU 17 N 0.92 3.04 -0.47 3.92 1.43 -0.18 -2.09 118.68 125.25 3did s LEU 17 Ca -0.07 -0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 52.52 3did s LEU 17 Cb -0.15 -1.81 0.05 0.00 0.03 0.00 0.00 46.19 44.31 3did s LEU 17 CO -0.02 0.21 0.51 -0.62 0.23 0.00 0.00 176.35 176.66 3did s ASP 18 N -1.98 6.20 0.07 2.29 -1.08 0.18 -1.57 116.67 120.77 3did s ASP 18 Ca 0.20 -0.95 0.27 0.00 -0.52 0.00 0.00 52.55 51.55 3did s ASP 18 Cb -0.11 -2.24 1.05 0.00 -1.46 0.00 0.00 42.92 40.16 3did s ASP 18 CO 0.12 -0.74 1.83 0.00 0.52 0.00 0.00 175.17 176.90 3did n ALA 19 N 5.76 2.22 0.02 3.66 0.00 -0.55 -1.48 120.51 130.13 3did n ALA 19 Ca -0.08 -0.07 -0.20 0.00 0.00 0.00 0.00 53.44 53.09 3did n ALA 19 Cb 0.45 -1.44 -0.14 0.00 0.00 0.00 0.00 19.45 18.32 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 0.00 1.37 0.00 0.00 2.07 -1.93 -3.39 116.25 114.37 3did h VAL 20 Ca 0.00 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.06 3did h VAL 20 Cb 0.54 3.03 0.00 0.00 -1.52 0.00 0.00 31.29 33.34 3did h VAL 20 CO 0.00 0.68 -0.96 0.54 0.02 0.00 0.00 177.57 177.85 3did n ARG 21 N -4.13 0.08 -2.65 1.57 1.74 -1.23 -5.02 116.66 107.01 3did n ARG 21 Ca -0.18 -0.01 -0.10 0.00 -0.77 0.00 0.00 57.85 56.79 3did n ARG 21 Cb 0.80 -1.51 0.05 0.00 -1.02 0.00 0.00 32.46 30.78 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 1.47 -0.46 3.44 -0.13 0.00 -0.55 -5.07 105.19 103.88 3did n GLY 22 Ca 0.04 0.29 -0.09 0.00 0.00 0.00 0.00 46.02 46.25 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 -3.25 -0.11 0.57 1.61 1.04 -1.08 -5.03 113.70 107.44 3did s SER 23 Ca 0.30 -0.67 -0.20 0.00 0.48 0.00 0.00 55.95 55.86 3did s SER 23 Cb -0.04 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.55 3did s SER 23 CO 0.49 -0.98 1.26 -2.16 0.98 0.00 0.00 173.24 172.83 3did s PRO 24 N -3.92 3.06 -0.40 4.02 0.04 -1.26 -0.65 135.00 135.89 3did s PRO 24 Ca 0.13 1.98 -0.17 0.00 0.04 0.00 0.00 61.00 62.98 3did s PRO 24 Cb 0.01 -2.08 0.01 0.00 0.04 0.00 0.00 34.50 32.48 3did s PRO 24 CO -0.01 -1.18 0.45 0.00 0.04 0.00 0.00 177.00 176.30 3did s ALA 25 N -1.46 3.44 -0.09 8.56 0.00 -0.89 -4.62 121.76 126.70 3did s ALA 25 Ca 0.75 -1.35 -0.01 0.00 0.00 0.00 0.00 51.96 51.35 3did s ALA 25 Cb -0.34 -3.02 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 3did s ALA 25 CO 0.39 -1.45 -0.03 0.42 0.00 0.00 0.00 175.76 175.09 3did s ILE 26 N 2.21 4.00 -1.36 0.00 1.01 -1.26 -4.40 121.20 121.39 3did s ILE 26 Ca 0.14 -0.36 -0.09 0.00 0.00 0.00 0.00 60.65 60.34 3did s ILE 26 Cb -0.16 -2.67 0.01 0.00 0.01 0.00 0.00 42.46 39.65 3did s ILE 26 CO 0.14 0.59 1.18 -3.20 0.00 0.00 0.00 174.94 173.64 3did n ASN 27 N 2.37 -6.28 -4.74 3.58 5.15 -0.50 -4.96 115.26 109.88 3did n ASN 27 Ca -0.18 -0.55 -0.36 0.00 -0.60 0.00 0.00 54.58 52.89 3did n ASN 27 Cb 0.53 -5.01 -0.07 0.00 -0.53 0.00 0.00 39.78 34.70 3did n ASN 27 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3did s VAL 28 N -3.32 5.32 0.31 3.44 1.01 -1.26 -4.79 120.40 121.10 3did s VAL 28 Ca 0.58 0.50 -0.28 0.00 0.00 0.00 0.00 61.98 62.78 3did s VAL 28 Cb -0.26 -3.61 -0.09 0.00 0.00 0.00 0.00 36.38 32.42 3did s VAL 28 CO 0.73 0.41 1.12 0.00 0.00 0.00 0.00 175.10 177.36 3did s ALA 29 N 0.33 3.35 -0.05 5.51 0.00 -1.26 -1.41 121.76 128.24 3did s ALA 29 Ca 0.16 0.91 0.02 0.00 0.00 0.00 0.00 51.96 53.05 3did s ALA 29 Cb -0.13 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.67 3did s ALA 29 CO 0.03 -0.24 -0.08 0.08 0.00 0.00 0.00 175.76 175.55 3did s VAL 30 N -1.24 0.79 -0.09 0.00 1.01 -0.42 -1.61 120.40 118.85 3did s VAL 30 Ca 0.48 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 62.18 3did s VAL 30 Cb -0.31 -0.75 -0.02 0.00 0.00 0.00 0.00 36.38 35.30 3did s VAL 30 CO 0.40 0.27 -0.18 -1.00 0.00 0.00 0.00 175.10 174.60 3did s HIS 31 N 0.65 2.66 -0.09 5.22 3.76 -0.57 -1.90 115.29 125.02 3did s HIS 31 Ca -0.11 -0.58 0.00 0.00 -0.15 0.00 0.00 55.06 54.23 3did s HIS 31 Cb -0.14 -1.71 -0.03 0.00 1.11 0.00 0.00 32.58 31.82 3did s HIS 31 CO 0.02 -0.13 -0.09 0.08 -0.85 0.00 0.00 174.74 173.77 3did s VAL 32 N -0.06 3.53 0.13 -0.90 1.01 -0.72 -1.07 120.40 122.32 3did s VAL 32 Ca -0.04 -0.53 0.08 0.00 0.00 0.00 0.00 61.98 61.49 3did s VAL 32 Cb -0.14 -2.45 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 3did s VAL 32 CO 0.04 0.57 -0.19 -0.36 0.00 0.00 0.00 175.10 175.16 3did s PHE 33 N -0.45 1.80 -0.04 5.22 0.08 -0.16 -1.52 117.98 122.91 3did s PHE 33 Ca 0.06 -0.45 0.06 0.00 0.12 0.00 0.00 56.93 56.73 3did s PHE 33 Cb -0.12 -0.94 -0.01 0.00 -0.57 0.00 0.00 43.02 41.38 3did s PHE 33 CO 0.02 0.27 -0.23 0.50 -0.10 0.00 0.00 175.22 175.68 3did s ARG 34 N -2.38 2.16 0.27 0.44 3.52 -0.44 -1.64 118.95 120.89 3did s ARG 34 Ca 0.11 -0.82 -0.30 0.00 -0.13 0.00 0.00 55.73 54.59 3did s ARG 34 Cb -0.08 -1.92 -0.11 0.00 -1.56 0.00 0.00 34.95 31.29 3did s ARG 34 CO 0.05 0.40 1.54 0.21 -0.81 0.00 0.00 175.30 176.69 3did s LYS 35 N -0.26 4.18 0.50 5.12 2.20 0.02 -1.69 119.74 129.81 3did s LYS 35 Ca 0.01 2.47 0.08 0.00 -0.36 0.00 0.00 55.97 58.16 3did s LYS 35 Cb -0.12 -3.06 0.08 0.00 -1.51 0.00 0.00 37.83 33.22 3did s LYS 35 CO 0.02 -0.55 0.63 0.00 -0.36 0.00 0.00 175.35 175.08 3did n ALA 36 N 2.32 1.01 -0.05 3.13 0.00 -0.77 -4.79 120.51 121.36 3did n ALA 36 Ca 0.08 -1.85 -0.13 0.00 0.00 0.00 0.00 53.44 51.54 3did n ALA 36 Cb 0.38 0.56 -0.07 0.00 0.00 0.00 0.00 19.45 20.32 3did n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3did h ALA 37 N 0.27 0.18 0.00 0.00 0.00 -1.95 -2.91 119.26 114.84 3did h ALA 37 Ca -0.25 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3did h ALA 37 Cb 1.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3did h ALA 37 CO 0.37 -0.01 0.00 -0.40 0.00 0.00 0.00 179.25 179.20 3did n ASP 38 N -4.66 0.00 -0.83 0.00 5.68 -1.26 -4.84 116.55 110.64 3did n ASP 38 Ca -0.06 -1.00 -0.09 0.00 -0.50 0.00 0.00 54.79 53.14 3did n ASP 38 Cb 0.30 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.26 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 -0.70 -3.75 -4.85 -1.12 8.00 -1.10 -5.04 116.55 107.99 3did n ASP 39 Ca 0.06 0.14 -0.31 0.00 0.71 0.00 0.00 54.79 55.38 3did n ASP 39 Cb 0.03 -2.42 -0.05 0.00 -0.02 0.00 0.00 41.12 38.65 3did n ASP 39 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3did s THR 40 N -2.38 5.00 -0.15 -3.53 -4.23 -1.26 -4.87 115.64 104.21 3did s THR 40 Ca 0.00 -0.49 -0.29 0.00 -1.18 0.00 0.00 61.69 59.73 3did s THR 40 Cb 0.00 -3.39 -0.00 0.00 1.34 0.00 0.00 72.50 70.44 3did s THR 40 CO 0.00 0.20 1.03 0.26 -0.54 0.00 0.00 174.62 175.57 3did s TRP 41 N -1.39 3.43 -0.18 3.99 0.52 -1.26 -1.84 118.94 122.21 3did s TRP 41 Ca 0.30 1.53 -0.07 0.00 0.02 0.00 0.00 56.10 57.87 3did s TRP 41 Cb -0.13 -3.23 -0.04 0.00 -1.15 0.00 0.00 33.47 28.92 3did s TRP 41 CO 0.22 -0.38 0.07 -2.00 0.02 0.00 0.00 176.95 174.89 3did s GLU 42 N 2.47 3.94 0.26 4.98 2.12 -0.68 -4.91 118.70 126.88 3did s GLU 42 Ca 0.47 -0.32 -0.30 0.00 0.36 0.00 0.00 54.97 55.18 3did s GLU 42 Cb -0.17 -3.22 -0.14 0.00 0.26 0.00 0.00 34.13 30.86 3did s GLU 42 CO 0.14 0.32 1.26 -2.30 -0.54 0.00 0.00 175.26 174.13 3did n PRO 43 N 3.41 1.77 0.00 4.30 -0.02 -1.26 -1.33 135.00 141.86 3did n PRO 43 Ca -0.17 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 3did n PRO 43 Cb 0.52 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 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 1.16 0.00 -3.61 6.00 7.35 -0.57 -4.83 117.46 122.96 3did n PHE 44 Ca 0.10 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.78 3did n PHE 44 Cb 0.31 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.13 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 -1.51 -2.20 0.29 3.13 0.00 -1.19 -4.99 121.76 115.29 3did s ALA 45 Ca 0.00 1.34 -0.20 0.00 0.00 0.00 0.00 51.96 53.10 3did s ALA 45 Cb 0.00 -0.01 0.05 0.00 0.00 0.00 0.00 23.12 23.16 3did s ALA 45 CO 0.00 -0.77 0.82 -1.54 0.00 0.00 0.00 175.76 174.27 3did s SER 46 N -2.47 -0.12 0.00 0.00 1.04 -1.26 -1.75 113.70 109.14 3did s SER 46 Ca 0.12 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.76 3did s SER 46 Cb 0.02 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.85 3did s SER 46 CO -0.04 -1.37 0.00 0.61 0.98 0.00 0.00 173.24 173.42 3did n GLY 47 N -0.51 -1.47 3.22 7.32 0.00 -0.80 -5.00 105.19 107.95 3did n GLY 47 Ca -0.06 -1.05 -0.24 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.21 1.24 0.67 1.61 1.02 -1.26 -1.29 119.74 120.52 3did s LYS 48 Ca 0.00 -0.88 -0.17 0.00 0.02 0.00 0.00 55.97 54.94 3did s LYS 48 Cb 0.00 -1.33 0.01 0.00 -0.52 0.00 0.00 37.83 35.99 3did s LYS 48 CO 0.00 0.34 1.23 0.95 -0.92 0.00 0.00 175.35 176.94 3did s THR 49 N -0.82 2.35 0.93 2.17 -4.23 -0.50 -4.84 115.64 110.70 3did s THR 49 Ca 0.06 0.19 -0.15 0.00 -1.18 0.00 0.00 61.69 60.61 3did s THR 49 Cb -0.08 -2.92 0.21 0.00 1.34 0.00 0.00 72.50 71.05 3did s THR 49 CO 0.02 -0.07 1.26 -1.54 -0.54 0.00 0.00 174.62 173.75 3did n SER 50 N -2.22 0.12 0.33 3.99 3.41 0.14 -1.41 113.62 117.98 3did n SER 50 Ca 0.14 -1.47 0.22 0.00 -0.26 0.00 0.00 58.87 57.50 3did n SER 50 Cb 0.50 -0.96 1.19 0.00 -0.26 0.00 0.00 64.21 64.67 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 -0.23 4.33 5.08 -1.95 -1.46 114.58 120.36 3did h GLU 51 Ca -0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 3did h GLU 51 Cb 1.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.38 3did h GLU 51 CO 0.29 0.00 0.00 -1.13 -1.00 0.00 0.00 179.01 177.17 3did n SER 52 N -3.07 2.38 -0.30 1.42 3.41 -1.26 -4.84 113.62 111.36 3did n SER 52 Ca -0.03 -1.82 -0.04 0.00 -0.26 0.00 0.00 58.87 56.72 3did n SER 52 Cb 0.09 -0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 63.88 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 1.28 0.68 3.62 5.00 0.00 -0.55 -4.84 105.19 110.38 3did n GLY 53 Ca 0.17 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 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 -1.97 2.31 -0.22 1.61 2.02 -1.26 -1.13 118.70 120.06 3did s GLU 54 Ca 0.00 -0.94 -0.00 0.00 0.02 0.00 0.00 54.97 54.05 3did s GLU 54 Cb 0.00 -2.41 0.06 0.00 0.10 0.00 0.00 34.13 31.88 3did s GLU 54 CO 0.00 0.53 -0.03 -1.17 0.02 0.00 0.00 175.26 174.61 3did s LEU 55 N -2.21 2.17 0.30 1.80 2.96 -0.63 -0.68 118.68 122.38 3did s LEU 55 Ca 0.23 -1.07 0.07 0.00 -0.22 0.00 0.00 54.13 53.15 3did s LEU 55 Cb -0.11 -1.02 -0.03 0.00 0.50 0.00 0.00 46.19 45.53 3did s LEU 55 CO 0.15 -0.25 0.22 -1.00 -1.32 0.00 0.00 176.35 174.15 3did s HIS 56 N 1.52 2.96 0.00 5.38 3.76 -1.26 -3.10 115.29 124.56 3did s HIS 56 Ca -0.04 -0.22 0.00 0.00 -0.15 0.00 0.00 55.06 54.64 3did s HIS 56 Cb -0.18 -1.59 0.00 0.00 1.11 0.00 0.00 32.58 31.92 3did s HIS 56 CO -0.07 0.36 0.00 0.41 -0.85 0.00 0.00 174.74 174.59 3did n GLY 57 N -1.25 0.48 0.28 -2.22 0.00 -1.26 -4.96 105.19 96.27 3did n GLY 57 Ca -0.05 -0.55 -0.05 0.00 0.00 0.00 0.00 46.02 45.37 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 0.84 -8.50 0.99 3.38 -1.85 -3.47 115.31 106.70 3did h LEU 58 Ca 0.00 -0.07 -0.26 0.00 0.09 0.00 0.00 57.88 57.65 3did h LEU 58 Cb 0.00 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 40.46 3did h LEU 58 CO 0.00 0.66 -0.19 0.28 0.09 0.00 0.00 178.44 179.28 3did s THR 59 N -5.97 0.00 0.22 0.22 -1.32 -1.26 -4.85 115.64 102.68 3did s THR 59 Ca -0.13 -1.58 0.09 0.00 -1.21 0.00 0.00 61.69 58.85 3did s THR 59 Cb 0.14 -2.62 -0.04 0.00 -1.51 0.00 0.00 72.50 68.47 3did s THR 59 CO 0.78 0.00 -0.03 0.42 -2.21 0.00 0.00 174.62 173.58 3did s THR 60 N -3.11 3.43 0.47 5.08 -4.23 -1.26 -4.73 115.64 111.29 3did s THR 60 Ca 0.30 -1.73 0.24 0.00 -1.18 0.00 0.00 61.69 59.33 3did s THR 60 Cb -0.00 -2.77 0.43 0.00 1.34 0.00 0.00 72.50 71.50 3did s THR 60 CO 0.19 -0.23 1.85 -0.08 -0.54 0.00 0.00 174.62 175.81 3did h GLU 61 N 2.38 0.22 0.00 3.99 4.22 -2.00 -0.44 114.58 122.96 3did h GLU 61 Ca -0.46 -0.01 -0.01 0.00 0.08 0.00 0.00 59.36 58.96 3did h GLU 61 Cb 1.23 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 3did h GLU 61 CO 0.58 0.14 -0.67 0.93 -2.18 0.00 0.00 179.01 177.82 3did h GLU 62 N 0.22 0.00 0.00 1.92 3.07 -2.04 -3.25 114.58 114.50 3did h GLU 62 Ca 0.49 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.35 3did h GLU 62 Cb 1.52 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.43 3did h GLU 62 CO -0.13 0.03 -1.05 0.39 -1.40 0.00 0.00 179.01 176.86 3did n GLU 63 N -2.85 0.55 -2.53 2.33 1.02 -0.28 -4.69 120.64 114.19 3did n GLU 63 Ca 0.01 0.08 -0.43 0.00 -0.02 0.00 0.00 57.16 56.80 3did n GLU 63 Cb 0.56 -1.77 0.01 0.00 -0.02 0.00 0.00 31.44 30.22 3did n GLU 63 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3did n PHE 64 N -2.52 2.78 -1.83 -0.32 7.35 -0.59 -4.94 117.46 117.39 3did n PHE 64 Ca 0.00 -2.74 -0.29 0.00 -0.76 0.00 0.00 57.45 53.66 3did n PHE 64 Cb 0.53 -1.75 0.10 0.00 0.35 0.00 0.00 39.48 38.70 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 -0.50 2.02 0.31 -2.13 -7.23 -1.26 -4.99 120.40 106.61 3did s VAL 65 Ca 0.37 0.01 -0.29 0.00 -1.81 0.00 0.00 61.98 60.26 3did s VAL 65 Cb 0.08 -2.96 -0.10 0.00 0.56 0.00 0.00 36.38 33.96 3did s VAL 65 CO 0.03 -0.01 1.39 -1.61 -0.31 0.00 0.00 175.10 174.59 3did s GLU 66 N -5.52 4.28 0.00 4.82 2.02 -1.26 -4.91 118.70 118.13 3did s GLU 66 Ca 0.62 2.31 0.00 0.00 0.02 0.00 0.00 54.97 57.92 3did s GLU 66 Cb -0.12 -3.07 0.00 0.00 0.10 0.00 0.00 34.13 31.05 3did s GLU 66 CO 0.50 -0.33 0.00 0.41 0.02 0.00 0.00 175.26 175.86 3did n GLY 67 N 1.25 -1.17 3.46 -1.39 0.00 -1.25 -5.04 105.19 101.05 3did n GLY 67 Ca 0.03 -1.15 -0.33 0.00 0.00 0.00 0.00 46.02 44.57 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 -3.00 3.52 0.04 -0.61 1.01 -1.26 -0.88 121.20 120.02 3did s ILE 68 Ca 0.00 -0.50 0.07 0.00 0.00 0.00 0.00 60.65 60.22 3did s ILE 68 Cb 0.00 -2.50 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 3did s ILE 68 CO 0.00 0.52 -0.21 -0.31 0.00 0.00 0.00 174.94 174.95 3did s TYR 69 N 0.15 1.82 -0.06 3.97 2.02 -0.23 -0.80 117.35 124.22 3did s TYR 69 Ca -0.04 -0.38 0.05 0.00 -0.37 0.00 0.00 57.07 56.34 3did s TYR 69 Cb -0.14 -1.09 -0.01 0.00 -0.40 0.00 0.00 41.96 40.33 3did s TYR 69 CO 0.04 0.09 -0.22 0.21 -1.57 0.00 0.00 175.55 174.09 3did s LYS 70 N -1.18 2.44 -0.21 -0.62 2.20 -0.65 -1.55 119.74 120.18 3did s LYS 70 Ca 0.07 -0.81 -0.04 0.00 -0.36 0.00 0.00 55.97 54.83 3did s LYS 70 Cb -0.09 -2.02 -0.02 0.00 -1.51 0.00 0.00 37.83 34.20 3did s LYS 70 CO 0.02 0.29 -0.02 0.08 -0.36 0.00 0.00 175.35 175.36 3did s VAL 71 N 0.03 3.70 -0.22 4.02 1.01 -0.46 -0.99 120.40 127.49 3did s VAL 71 Ca -0.07 -0.39 -0.02 0.00 0.00 0.00 0.00 61.98 61.49 3did s VAL 71 Cb -0.14 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.57 3did s VAL 71 CO 0.04 0.42 -0.08 -1.61 0.00 0.00 0.00 175.10 173.88 3did s GLU 72 N 1.19 3.19 -0.21 2.72 2.02 -0.24 -1.32 118.70 126.05 3did s GLU 72 Ca 0.03 -0.74 -0.07 0.00 0.02 0.00 0.00 54.97 54.20 3did s GLU 72 Cb -0.15 -2.92 -0.04 0.00 0.10 0.00 0.00 34.13 31.13 3did s GLU 72 CO 0.00 -0.25 0.06 0.42 0.02 0.00 0.00 175.26 175.52 3did s ILE 73 N 1.41 4.57 -0.19 -1.63 1.01 0.25 -1.51 121.20 125.11 3did s ILE 73 Ca 0.04 -0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.30 3did s ILE 73 Cb -0.14 -3.09 -0.01 0.00 0.01 0.00 0.00 42.46 39.22 3did s ILE 73 CO -0.05 0.41 1.28 -1.81 0.00 0.00 0.00 174.94 174.76 3did s ASP 74 N 0.90 6.89 0.00 3.58 1.11 -0.63 -1.21 116.67 127.32 3did s ASP 74 Ca 0.04 1.62 0.00 0.00 0.18 0.00 0.00 52.55 54.39 3did s ASP 74 Cb -0.14 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.31 3did s ASP 74 CO 0.03 -0.82 0.31 0.35 1.18 0.00 0.00 175.17 176.21 3did n THR 75 N 5.52 0.00 -0.10 -1.27 -2.24 -0.81 -4.68 114.28 110.71 3did n THR 75 Ca 0.14 -0.41 -0.11 0.00 -2.27 0.00 0.00 64.05 61.40 3did n THR 75 Cb 0.45 1.14 -0.06 0.00 -2.10 0.00 0.00 70.33 69.76 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 -0.37 -0.25 -0.78 3.64 -1.78 -2.93 116.57 114.10 3did h LYS 76 Ca 0.00 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3did h LYS 76 Cb 0.07 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 3did h LYS 76 CO 0.00 -0.25 0.00 -1.13 -2.27 0.00 0.00 179.45 175.80 3did n SER 77 N -5.42 2.65 -0.04 4.20 3.41 -1.26 -4.43 113.62 112.73 3did n SER 77 Ca -0.02 -1.95 0.24 0.00 -0.26 0.00 0.00 58.87 56.88 3did n SER 77 Cb 0.35 -0.17 0.72 0.00 -0.26 0.00 0.00 64.21 64.86 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 1.59 0.00 -0.21 7.33 3.20 -1.84 -2.23 116.97 124.81 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 0.66 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.93 3did h TYR 78 CO 0.17 0.00 0.00 0.91 -1.64 0.00 0.00 178.16 177.60 3did n TRP 79 N -3.98 0.26 -0.16 -3.82 5.03 -1.26 -4.65 117.44 108.86 3did n TRP 79 Ca 0.13 -0.16 -0.09 0.00 3.03 0.00 0.00 57.50 60.41 3did n TRP 79 Cb 0.80 -0.00 0.06 0.00 -1.03 0.00 0.00 31.31 31.13 3did n TRP 79 CO 0.00 0.00 0.00 -0.22 -0.03 0.00 0.00 177.69 177.44 3did h LYS 80 N 3.61 0.96 0.00 -0.99 3.64 -1.61 -2.39 116.57 119.79 3did h LYS 80 Ca 0.00 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 3did h LYS 80 Cb 0.82 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 3did h LYS 80 CO 0.00 1.00 0.00 0.00 -2.27 0.00 0.00 179.45 178.18 3did n ALA 81 N -2.49 1.67 0.70 5.00 0.00 -1.26 -1.53 120.51 122.60 3did n ALA 81 Ca 0.02 0.06 0.12 0.00 0.00 0.00 0.00 53.44 53.63 3did n ALA 81 Cb 0.38 -1.36 0.13 0.00 0.00 0.00 0.00 19.45 18.61 3did n ALA 81 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3did n LEU 82 N -2.08 0.62 0.00 0.00 7.94 -0.90 -4.98 117.00 117.60 3did n LEU 82 Ca 0.02 0.06 0.00 0.00 -1.11 0.00 0.00 56.01 54.98 3did n LEU 82 Cb 0.22 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 44.00 3did n LEU 82 CO 0.19 0.04 0.00 0.61 -1.11 0.00 0.00 177.39 177.11 3did n GLY 83 N 1.40 0.55 3.15 -3.96 0.00 -0.58 -5.06 105.19 100.68 3did n GLY 83 Ca 0.03 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 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 1.60 -0.06 -0.61 1.01 -1.21 -5.08 121.20 114.85 3did s ILE 84 Ca 0.00 -0.78 -0.25 0.00 0.00 0.00 0.00 60.65 59.61 3did s ILE 84 Cb 0.00 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 3did s ILE 84 CO 0.00 0.46 0.79 -0.55 0.00 0.00 0.00 174.94 175.64 3did s SER 85 N 0.24 7.09 0.91 3.58 0.15 -1.26 -4.41 113.70 119.99 3did s SER 85 Ca -0.10 1.32 -0.13 0.00 0.70 0.00 0.00 55.95 57.74 3did s SER 85 Cb -0.14 -2.46 0.19 0.00 -1.71 0.00 0.00 66.02 61.89 3did s SER 85 CO 0.04 -0.18 1.25 -2.16 1.20 0.00 0.00 173.24 173.39 3did s PRO 86 N 0.99 0.86 0.57 5.44 0.04 -1.26 -4.98 135.00 136.66 3did s PRO 86 Ca 0.42 -0.58 0.35 0.00 0.04 0.00 0.00 61.00 61.22 3did s PRO 86 Cb -0.19 -1.96 1.61 0.00 0.04 0.00 0.00 34.50 34.01 3did s PRO 86 CO 0.20 -2.21 2.08 0.00 0.04 0.00 0.00 177.00 177.12 3did h MET 87 N -1.40 0.00 -2.48 4.56 -0.00 -1.38 -3.45 114.93 110.78 3did h MET 87 Ca -0.42 0.00 0.02 0.00 -0.00 0.00 0.00 59.70 59.30 3did h MET 87 Cb 1.24 0.00 -0.15 0.00 -0.00 0.00 0.00 31.60 32.69 3did h MET 87 CO 0.38 0.04 0.32 -1.58 -0.00 0.00 0.00 176.91 176.07 3did s HIS 88 N -3.88 -0.49 -0.35 -0.10 5.65 -1.26 -5.06 115.29 109.81 3did s HIS 88 Ca -0.01 0.47 0.24 0.00 0.25 0.00 0.00 55.06 56.00 3did s HIS 88 Cb 0.11 0.52 1.08 0.00 -1.18 0.00 0.00 32.58 33.11 3did s HIS 88 CO 0.53 -0.67 1.72 1.05 -0.65 0.00 0.00 174.74 176.71 3did h GLU 89 N 2.23 0.00 -4.77 2.88 4.11 -1.94 -3.42 114.58 113.67 3did h GLU 89 Ca -0.28 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 58.85 3did h GLU 89 Cb 1.25 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.30 3did h GLU 89 CO 0.35 0.00 -0.74 -1.01 0.07 0.00 0.00 179.01 177.69 3did s HIS 90 N -3.42 0.86 -0.20 2.06 3.76 -1.26 -1.92 115.29 115.17 3did s HIS 90 Ca 0.02 -0.58 -0.10 0.00 -0.15 0.00 0.00 55.06 54.26 3did s HIS 90 Cb 0.08 -0.49 -0.05 0.00 1.11 0.00 0.00 32.58 33.23 3did s HIS 90 CO 0.34 -0.05 0.12 0.00 -0.85 0.00 0.00 174.74 174.30 3did s ALA 91 N -1.85 3.65 0.07 -1.40 0.00 -0.35 -4.89 121.76 117.00 3did s ALA 91 Ca -0.03 -0.71 0.07 0.00 0.00 0.00 0.00 51.96 51.29 3did s ALA 91 Cb -0.07 -2.14 -0.03 0.00 0.00 0.00 0.00 23.12 20.88 3did s ALA 91 CO -0.00 0.14 -0.19 -1.21 0.00 0.00 0.00 175.76 174.51 3did s GLU 92 N 0.40 1.11 -0.11 0.00 8.01 -1.26 -0.59 118.70 126.26 3did s GLU 92 Ca 0.07 -1.00 -0.05 0.00 0.01 0.00 0.00 54.97 54.00 3did s GLU 92 Cb -0.11 -1.25 0.05 0.00 -4.31 0.00 0.00 34.13 28.51 3did s GLU 92 CO -0.01 0.30 0.24 0.14 0.01 0.00 0.00 175.26 175.94 3did s VAL 93 N -1.04 -0.20 -0.14 2.63 -7.23 -0.43 -5.00 120.40 108.98 3did s VAL 93 Ca 0.04 0.22 -0.09 0.00 -1.81 0.00 0.00 61.98 60.34 3did s VAL 93 Cb -0.09 -0.39 -0.04 0.00 0.56 0.00 0.00 36.38 36.41 3did s VAL 93 CO 0.03 0.09 0.16 -0.69 -0.31 0.00 0.00 175.10 174.38 3did s VAL 94 N 1.78 5.43 0.03 1.32 1.01 -1.26 -1.35 120.40 127.36 3did s VAL 94 Ca -0.04 0.27 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 3did s VAL 94 Cb -0.11 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.78 3did s VAL 94 CO -0.08 0.55 -0.02 0.72 0.00 0.00 0.00 175.10 176.26 3did s PHE 95 N -0.50 0.35 -0.22 5.22 -0.12 -0.59 -5.02 117.98 117.10 3did s PHE 95 Ca 0.13 -0.73 -0.09 0.00 -0.05 0.00 0.00 56.93 56.20 3did s PHE 95 Cb -0.12 -0.26 -0.04 0.00 -0.63 0.00 0.00 43.02 41.97 3did s PHE 95 CO 0.03 -0.27 0.11 0.99 -0.05 0.00 0.00 175.22 176.02 3did s THR 96 N -2.47 4.92 0.18 -4.49 2.01 -1.26 -1.07 115.64 113.46 3did s THR 96 Ca -0.07 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.00 3did s THR 96 Cb -0.03 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.18 3did s THR 96 CO -0.05 0.38 0.20 0.00 -0.69 0.00 0.00 174.62 174.46 3did s ALA 97 N 0.97 3.70 -1.25 7.40 0.00 -0.06 -4.90 121.76 127.64 3did s ALA 97 Ca 0.05 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3did s ALA 97 Cb -0.14 -1.49 0.00 0.00 0.00 0.00 0.00 23.12 21.49 3did s ALA 97 CO 0.03 0.46 0.00 0.09 0.00 0.00 0.00 175.76 176.34 3did n ASN 98 N -0.60 -3.98 0.32 0.00 4.13 -1.26 -3.95 115.26 109.92 3did n ASN 98 Ca -0.08 0.22 0.12 0.00 1.68 0.00 0.00 54.58 56.52 3did n ASN 98 Cb 0.55 -3.47 0.65 0.00 -1.54 0.00 0.00 39.78 35.97 3did n ASN 98 CO 0.00 0.00 0.00 0.44 0.28 0.00 0.00 177.26 177.98 3did h ASP 99 N 0.00 0.00 -1.42 6.41 3.32 -1.98 -3.36 116.42 119.39 3did h ASP 99 Ca -0.31 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.73 3did h ASP 99 Cb 1.12 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.42 3did h ASP 99 CO 0.39 0.00 -0.36 -0.44 -1.72 0.00 0.00 179.24 177.11 3did s SER 100 N -4.11 -0.68 0.17 6.45 0.01 -1.26 -5.13 113.70 109.15 3did s SER 100 Ca -0.03 0.62 0.00 0.00 1.31 0.00 0.00 55.95 57.86 3did s SER 100 Cb 0.07 1.72 0.00 0.00 0.21 0.00 0.00 66.02 68.02 3did s SER 100 CO 0.22 -0.28 0.00 0.61 0.41 0.00 0.00 173.24 174.20 3did n GLY 101 N 5.40 -1.82 3.78 3.44 0.00 -1.26 -4.84 105.19 109.89 3did n GLY 101 Ca -0.02 -1.35 -0.36 0.00 0.00 0.00 0.00 46.02 44.29 3did n GLY 101 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3did s PRO 102 N -1.94 3.84 -0.05 1.61 0.02 -1.26 -4.89 135.00 132.33 3did s PRO 102 Ca 0.00 1.57 -0.05 0.00 0.02 0.00 0.00 61.00 62.54 3did s PRO 102 Cb 0.00 -2.32 0.01 0.00 0.02 0.00 0.00 34.50 32.22 3did s PRO 102 CO 0.00 -0.43 0.14 1.03 -0.33 0.00 0.00 177.00 177.41 3did s ARG 103 N -2.84 0.17 -0.04 5.54 1.81 -1.26 -4.58 118.95 117.75 3did s ARG 103 Ca 0.64 0.20 -0.03 0.00 -1.72 0.00 0.00 55.73 54.82 3did s ARG 103 Cb -0.23 0.08 -0.04 0.00 -0.45 0.00 0.00 34.95 34.32 3did s ARG 103 CO 0.28 -0.02 0.13 1.03 -0.68 0.00 0.00 175.30 176.04 3did s ARG 104 N 0.07 3.30 -0.04 3.54 0.52 -0.43 -4.95 118.95 120.96 3did s ARG 104 Ca -0.00 -0.33 0.07 0.00 -0.52 0.00 0.00 55.73 54.94 3did s ARG 104 Cb -0.01 -3.03 -0.01 0.00 0.52 0.00 0.00 34.95 32.42 3did s ARG 104 CO 0.00 0.69 -0.24 0.71 0.02 0.00 0.00 175.30 176.49 3did s TYR 105 N -1.19 2.24 -0.17 -0.53 2.02 -0.39 -1.70 117.35 117.63 3did s TYR 105 Ca 0.22 -0.55 0.01 0.00 -0.37 0.00 0.00 57.07 56.38 3did s TYR 105 Cb -0.12 -1.46 0.02 0.00 -0.40 0.00 0.00 41.96 40.00 3did s TYR 105 CO 0.13 -0.13 -0.19 0.99 -1.57 0.00 0.00 175.55 174.78 3did s THR 106 N -0.33 1.94 -0.34 -0.71 2.01 -0.88 -1.94 115.64 115.39 3did s THR 106 Ca 0.02 -0.87 -0.12 0.00 0.31 0.00 0.00 61.69 61.03 3did s THR 106 Cb -0.11 -1.76 -0.01 0.00 0.01 0.00 0.00 72.50 70.63 3did s THR 106 CO 0.01 0.52 0.22 -0.63 -0.69 0.00 0.00 174.62 174.06 3did s ILE 107 N 1.25 5.04 -0.15 1.82 -1.09 -0.62 -1.22 121.20 126.23 3did s ILE 107 Ca 0.03 -0.37 -0.05 0.00 -2.23 0.00 0.00 60.65 58.03 3did s ILE 107 Cb -0.13 -3.63 -0.03 0.00 -1.58 0.00 0.00 42.46 37.09 3did s ILE 107 CO -0.11 -0.04 0.00 0.00 -1.23 0.00 0.00 174.94 173.56 3did s ALA 108 N 1.67 3.18 -0.11 9.38 0.00 -0.64 -1.38 121.76 133.87 3did s ALA 108 Ca 0.05 -0.79 -0.00 0.00 0.00 0.00 0.00 51.96 51.22 3did s ALA 108 Cb -0.18 -1.66 0.02 0.00 0.00 0.00 0.00 23.12 21.31 3did s ALA 108 CO 0.09 0.27 -0.08 0.00 0.00 0.00 0.00 175.76 176.04 3did s ALA 109 N 0.14 1.33 -0.40 0.00 0.00 -0.28 -1.47 121.76 121.08 3did s ALA 109 Ca 0.01 -0.54 -0.13 0.00 0.00 0.00 0.00 51.96 51.30 3did s ALA 109 Cb -0.13 -0.89 0.02 0.00 0.00 0.00 0.00 23.12 22.12 3did s ALA 109 CO 0.02 -0.38 0.26 -1.64 0.00 0.00 0.00 175.76 174.02 3did s MET 110 N 1.64 2.90 -0.14 0.00 -1.94 -0.28 -1.01 119.30 120.47 3did s MET 110 Ca 0.04 -1.05 -0.04 0.00 -1.71 0.00 0.00 55.69 52.92 3did s MET 110 Cb -0.13 -3.87 -0.03 0.00 2.01 0.00 0.00 34.83 32.81 3did s MET 110 CO -0.08 -0.73 -0.00 -0.51 -0.01 0.00 0.00 175.02 173.69 3did s LEU 111 N 1.62 3.48 0.25 -0.03 1.43 -0.61 -2.15 118.68 122.68 3did s LEU 111 Ca 0.04 0.00 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 3did s LEU 111 Cb -0.19 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 3did s LEU 111 CO 0.09 0.23 -0.00 -0.44 0.23 0.00 0.00 176.35 176.46 3did s SER 112 N -0.02 2.06 0.31 2.29 0.01 -0.43 -1.49 113.70 116.43 3did s SER 112 Ca 0.03 -1.24 0.06 0.00 1.31 0.00 0.00 55.95 56.11 3did s SER 112 Cb -0.13 -0.03 0.73 0.00 0.21 0.00 0.00 66.02 66.79 3did s SER 112 CO 0.02 -0.50 1.79 -0.65 0.41 0.00 0.00 173.24 174.32 3did h PRO 113 N 2.39 0.77 -0.05 12.44 0.11 -1.99 -3.15 132.00 142.52 3did h PRO 113 Ca -0.39 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3did h PRO 113 Cb 1.23 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3did h PRO 113 CO 0.66 0.51 0.00 0.66 -0.21 0.00 0.00 178.00 179.61 3did n TYR 114 N -4.72 0.14 -3.61 0.65 4.01 -1.26 -0.89 117.16 111.49 3did n TYR 114 Ca 0.22 -0.86 -0.16 0.00 -0.16 0.00 0.00 57.90 56.94 3did n TYR 114 Cb 0.54 -0.15 -0.07 0.00 -0.31 0.00 0.00 39.34 39.35 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 -2.30 -0.62 0.12 7.72 0.15 -1.19 -5.02 113.70 112.56 3did s SER 115 Ca 0.27 0.92 -0.15 0.00 0.70 0.00 0.00 55.95 57.69 3did s SER 115 Cb 0.23 0.88 0.03 0.00 -1.71 0.00 0.00 66.02 65.45 3did s SER 115 CO 0.04 -0.41 0.38 -0.72 1.20 0.00 0.00 173.24 173.73 3did s TYR 116 N -0.49 -0.17 -0.16 3.44 -0.85 -1.26 -1.32 117.35 116.54 3did s TYR 116 Ca -0.06 -0.16 0.01 0.00 -0.52 0.00 0.00 57.07 56.34 3did s TYR 116 Cb -0.03 0.23 0.02 0.00 0.38 0.00 0.00 41.96 42.56 3did s TYR 116 CO 0.05 -0.69 -0.18 -1.12 -1.52 0.00 0.00 175.55 172.09 3did s SER 117 N -2.81 2.98 0.20 -0.18 0.01 -0.91 -5.00 113.70 107.98 3did s SER 117 Ca 0.03 -0.59 0.11 0.00 1.31 0.00 0.00 55.95 56.81 3did s SER 117 Cb 0.02 -1.38 -0.04 0.00 0.21 0.00 0.00 66.02 64.83 3did s SER 117 CO -0.12 -0.01 -0.23 0.28 0.41 0.00 0.00 173.24 173.58 3did s THR 118 N 1.28 2.31 -0.07 1.44 -1.32 -1.26 -1.13 115.64 116.89 3did s THR 118 Ca 0.03 -2.08 -0.05 0.00 -1.21 0.00 0.00 61.69 58.38 3did s THR 118 Cb -0.13 -2.12 0.03 0.00 -1.51 0.00 0.00 72.50 68.76 3did s THR 118 CO -0.11 -0.18 0.18 -0.89 -2.21 0.00 0.00 174.62 171.41 3did s THR 119 N -1.84 -0.02 -0.30 5.08 2.01 -0.54 -5.03 115.64 114.99 3did s THR 119 Ca 0.22 0.08 -0.12 0.00 0.31 0.00 0.00 61.69 62.18 3did s THR 119 Cb -0.07 -0.27 -0.04 0.00 0.01 0.00 0.00 72.50 72.13 3did s THR 119 CO 0.10 0.03 0.21 0.00 -0.69 0.00 0.00 174.62 174.28 3did s ALA 120 N 0.64 3.52 -0.27 7.40 0.00 -1.26 -1.62 121.76 130.17 3did s ALA 120 Ca -0.05 -1.19 -0.10 0.00 0.00 0.00 0.00 51.96 50.63 3did s ALA 120 Cb -0.06 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 3did s ALA 120 CO -0.03 -0.71 0.15 0.08 0.00 0.00 0.00 175.76 175.24 3did s VAL 121 N 1.76 4.88 -0.21 0.00 1.01 -0.36 -4.98 120.40 122.50 3did s VAL 121 Ca 0.07 -0.03 -0.00 0.00 0.00 0.00 0.00 61.98 62.02 3did s VAL 121 Cb -0.16 -3.34 0.02 0.00 0.00 0.00 0.00 36.38 32.90 3did s VAL 121 CO 0.11 0.25 -0.13 -0.69 0.00 0.00 0.00 175.10 174.64 3did s VAL 122 N 1.69 2.47 0.00 2.92 1.01 -1.26 -2.06 120.40 125.16 3did s VAL 122 Ca 0.07 -0.95 0.08 0.00 0.00 0.00 0.00 61.98 61.17 3did s VAL 122 Cb -0.16 -2.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 3did s VAL 122 CO 0.08 0.39 -0.24 0.42 0.00 0.00 0.00 175.10 175.75 3did s THR 123 N 1.31 1.89 -0.55 3.92 -4.23 -0.69 -4.98 115.64 112.31 3did s THR 123 Ca 0.03 -1.10 -0.19 0.00 -1.18 0.00 0.00 61.69 59.24 3did s THR 123 Cb -0.15 -1.59 0.08 0.00 1.34 0.00 0.00 72.50 72.18 3did s THR 123 CO -0.09 0.46 0.68 0.21 -0.54 0.00 0.00 174.62 175.34 3did s ASN 124 N -0.76 6.20 0.00 3.99 3.04 -1.26 -1.32 114.94 124.84 3did s ASN 124 Ca 0.09 -1.15 0.00 0.00 0.04 0.00 0.00 52.86 51.85 3did s ASN 124 Cb -0.09 -2.30 0.00 0.00 -1.54 0.00 0.00 41.25 37.32 3did s ASN 124 CO -0.00 -1.02 0.30 -0.81 -3.04 0.00 0.00 177.10 172.53