#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2flm n PRO 11 N 0.00 0.22 -3.69 0.00 -0.04 -1.26 -4.75 135.00 125.48 2flm n PRO 11 Ca 0.00 0.08 -0.18 0.00 -0.04 0.00 0.00 63.50 63.36 2flm n PRO 11 Cb 0.00 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 31.79 2flm n PRO 11 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2flm s LEU 12 N -2.71 0.29 0.01 1.53 2.96 -1.26 -0.24 118.68 119.26 2flm s LEU 12 Ca 0.18 0.15 0.02 0.00 -0.22 0.00 0.00 54.13 54.26 2flm s LEU 12 Cb 0.15 0.00 -0.01 0.00 0.50 0.00 0.00 46.19 46.84 2flm s LEU 12 CO 0.37 -0.22 -0.07 -0.32 -1.32 0.00 0.00 176.35 174.79 2flm s MET 13 N 1.94 0.54 -0.04 1.98 -2.45 -0.48 -4.45 119.30 116.35 2flm s MET 13 Ca 0.01 -0.37 0.06 0.00 -1.25 0.00 0.00 55.69 54.15 2flm s MET 13 Cb -0.12 -0.48 -0.01 0.00 1.25 0.00 0.00 34.83 35.46 2flm s MET 13 CO -0.04 0.12 -0.23 0.08 1.05 0.00 0.00 175.02 176.00 2flm s VAL 14 N -0.44 1.88 -0.02 10.11 1.01 -1.08 -0.86 120.40 131.00 2flm s VAL 14 Ca -0.00 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.01 2flm s VAL 14 Cb -0.04 -1.58 -0.00 0.00 0.00 0.00 0.00 36.38 34.75 2flm s VAL 14 CO -0.00 0.53 -0.10 -0.75 0.00 0.00 0.00 175.10 174.78 2flm s LYS 15 N -0.33 0.96 -0.07 2.72 2.20 0.03 -0.03 119.74 125.23 2flm s LYS 15 Ca 0.03 -0.36 0.02 0.00 -0.36 0.00 0.00 55.97 55.29 2flm s LYS 15 Cb -0.11 -0.91 0.02 0.00 -1.51 0.00 0.00 37.83 35.31 2flm s LYS 15 CO 0.01 0.18 -0.10 0.08 -0.36 0.00 0.00 175.35 175.16 2flm s VAL 16 N -0.04 1.03 0.03 4.02 1.01 0.17 -0.52 120.40 126.10 2flm s VAL 16 Ca 0.01 -0.40 0.08 0.00 0.00 0.00 0.00 61.98 61.66 2flm s VAL 16 Cb -0.06 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 2flm s VAL 16 CO 0.00 0.34 -0.21 -0.76 0.00 0.00 0.00 175.10 174.47 2flm s LEU 17 N 0.83 2.44 -0.34 3.92 1.43 0.38 -0.74 118.68 126.61 2flm s LEU 17 Ca -0.12 -0.46 -0.10 0.00 -1.03 0.00 0.00 54.13 52.42 2flm s LEU 17 Cb -0.15 -1.43 0.01 0.00 0.03 0.00 0.00 46.19 44.64 2flm s LEU 17 CO 0.02 0.27 0.18 -0.62 0.23 0.00 0.00 176.35 176.42 2flm s ASP 18 N -1.26 5.63 0.12 2.29 -1.08 0.10 -0.54 116.67 121.93 2flm s ASP 18 Ca 0.13 -0.70 0.27 0.00 -0.52 0.00 0.00 52.55 51.73 2flm s ASP 18 Cb -0.10 -2.01 0.98 0.00 -1.46 0.00 0.00 42.92 40.33 2flm s ASP 18 CO 0.03 -0.27 1.82 0.00 0.52 0.00 0.00 175.17 177.28 2flm n ALA 19 N 4.99 2.25 0.03 3.66 0.00 -0.24 -1.13 120.51 130.07 2flm n ALA 19 Ca -0.13 -0.05 -0.21 0.00 0.00 0.00 0.00 53.44 53.05 2flm n ALA 19 Cb 0.48 -1.46 -0.14 0.00 0.00 0.00 0.00 19.45 18.33 2flm n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2flm h VAL 20 N 0.00 1.22 0.00 0.00 2.07 -1.94 -3.39 116.25 114.21 2flm h VAL 20 Ca 0.00 -2.47 0.00 0.00 0.82 0.00 0.00 66.70 65.05 2flm h VAL 20 Cb 0.61 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.29 2flm h VAL 20 CO 0.00 0.71 -1.29 0.54 0.02 0.00 0.00 177.57 177.56 2flm n ARG 21 N -3.99 0.55 -2.85 1.57 1.74 -1.24 -5.01 116.66 107.43 2flm n ARG 21 Ca -0.20 -0.07 -0.10 0.00 -0.77 0.00 0.00 57.85 56.71 2flm n ARG 21 Cb 0.88 -1.45 0.05 0.00 -1.02 0.00 0.00 32.46 30.93 2flm n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2flm n GLY 22 N 1.42 -0.09 3.41 -0.13 0.00 -0.28 -5.04 105.19 104.47 2flm n GLY 22 Ca 0.01 -0.08 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 2flm n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2flm s SER 23 N -3.77 -0.00 0.62 1.61 1.04 -1.04 -5.01 113.70 107.15 2flm s SER 23 Ca 0.03 -0.93 -0.19 0.00 0.48 0.00 0.00 55.95 55.35 2flm s SER 23 Cb -0.00 0.48 -0.02 0.00 0.10 0.00 0.00 66.02 66.58 2flm s SER 23 CO 0.45 -0.97 1.28 -2.84 0.98 0.00 0.00 173.24 172.14 2flm s PRO 24 N -4.00 2.72 -0.48 4.02 0.02 -1.26 0.02 135.00 136.03 2flm s PRO 24 Ca 0.21 2.03 -0.19 0.00 0.02 0.00 0.00 61.00 63.06 2flm s PRO 24 Cb 0.02 -1.91 0.05 0.00 0.02 0.00 0.00 34.50 32.68 2flm s PRO 24 CO 0.04 -1.46 0.59 0.00 -0.33 0.00 0.00 177.00 175.84 2flm s ALA 25 N -1.43 3.39 0.04 -1.55 0.00 0.08 -4.58 121.76 117.71 2flm s ALA 25 Ca 0.80 -1.64 -0.10 0.00 0.00 0.00 0.00 51.96 51.03 2flm s ALA 25 Cb -0.36 -3.28 -0.05 0.00 0.00 0.00 0.00 23.12 19.42 2flm s ALA 25 CO 0.39 -1.89 0.36 0.42 0.00 0.00 0.00 175.76 175.04 2flm s ILE 26 N 2.53 5.14 -1.28 0.00 1.01 -1.26 -4.36 121.20 122.98 2flm s ILE 26 Ca 0.15 0.47 -0.02 0.00 0.00 0.00 0.00 60.65 61.25 2flm s ILE 26 Cb -0.18 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.66 2flm s ILE 26 CO 0.13 0.38 0.20 -3.20 0.00 0.00 0.00 174.94 172.46 2flm n ASN 27 N 1.20 -4.88 -4.67 3.58 4.05 -0.57 -4.94 115.26 109.02 2flm n ASN 27 Ca -0.11 -0.10 -0.40 0.00 0.45 0.00 0.00 54.58 54.42 2flm n ASN 27 Cb 0.53 -3.88 -0.06 0.00 1.23 0.00 0.00 39.78 37.59 2flm n ASN 27 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2flm s VAL 28 N -2.90 5.06 0.23 3.44 1.01 -1.26 -4.76 120.40 121.23 2flm s VAL 28 Ca 0.10 1.15 -0.30 0.00 0.00 0.00 0.00 61.98 62.93 2flm s VAL 28 Cb -0.04 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.32 2flm s VAL 28 CO 0.13 0.17 1.19 0.00 0.00 0.00 0.00 175.10 176.58 2flm s ALA 29 N 1.57 3.44 -0.04 5.51 0.00 -1.26 -1.20 121.76 129.77 2flm s ALA 29 Ca 0.29 0.98 0.01 0.00 0.00 0.00 0.00 51.96 53.24 2flm s ALA 29 Cb -0.16 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.58 2flm s ALA 29 CO 0.11 -0.35 -0.06 0.08 0.00 0.00 0.00 175.76 175.54 2flm s VAL 30 N -0.51 0.65 -0.09 0.00 1.01 0.12 -1.13 120.40 120.46 2flm s VAL 30 Ca 0.50 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.32 2flm s VAL 30 Cb -0.33 -0.64 -0.00 0.00 0.00 0.00 0.00 36.38 35.40 2flm s VAL 30 CO 0.40 0.24 -0.23 -1.00 0.00 0.00 0.00 175.10 174.52 2flm s HIS 31 N 0.75 2.39 -0.14 5.22 3.76 -0.01 -1.67 115.29 125.59 2flm s HIS 31 Ca -0.11 -0.92 -0.04 0.00 -0.15 0.00 0.00 55.06 53.84 2flm s HIS 31 Cb -0.14 -1.60 -0.03 0.00 1.11 0.00 0.00 32.58 31.92 2flm s HIS 31 CO 0.01 -0.36 0.00 0.08 -0.85 0.00 0.00 174.74 173.61 2flm s VAL 32 N 0.29 4.26 0.14 -0.90 1.01 0.20 -0.10 120.40 125.30 2flm s VAL 32 Ca -0.16 -0.24 0.08 0.00 0.00 0.00 0.00 61.98 61.67 2flm s VAL 32 Cb -0.17 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 2flm s VAL 32 CO 0.07 0.52 -0.19 -0.36 0.00 0.00 0.00 175.10 175.15 2flm s PHE 33 N -0.07 1.81 0.04 5.22 0.40 0.93 -0.46 117.98 125.84 2flm s PHE 33 Ca 0.04 -0.45 0.06 0.00 -0.60 0.00 0.00 56.93 55.97 2flm s PHE 33 Cb -0.13 -0.93 -0.03 0.00 0.51 0.00 0.00 43.02 42.44 2flm s PHE 33 CO 0.02 0.29 -0.11 0.50 0.70 0.00 0.00 175.22 176.61 2flm s ARG 34 N -2.51 2.28 -0.06 0.44 3.52 -0.26 -0.81 118.95 121.55 2flm s ARG 34 Ca 0.13 -0.89 -0.28 0.00 -0.13 0.00 0.00 55.73 54.56 2flm s ARG 34 Cb -0.07 -2.34 -0.02 0.00 -1.56 0.00 0.00 34.95 30.95 2flm s ARG 34 CO 0.06 0.56 0.91 0.21 -0.81 0.00 0.00 175.30 176.23 2flm s LYS 35 N -1.63 4.47 0.45 5.12 2.20 0.26 -0.90 119.74 129.70 2flm s LYS 35 Ca 0.17 1.26 -0.02 0.00 -0.36 0.00 0.00 55.97 57.02 2flm s LYS 35 Cb -0.11 -3.49 -0.02 0.00 -1.51 0.00 0.00 37.83 32.70 2flm s LYS 35 CO 0.08 -0.13 0.69 0.00 -0.36 0.00 0.00 175.35 175.64 2flm s ALA 36 N 1.37 3.60 0.60 3.13 0.00 0.04 -4.76 121.76 125.73 2flm s ALA 36 Ca 0.46 -0.85 0.30 0.00 0.00 0.00 0.00 51.96 51.88 2flm s ALA 36 Cb -0.19 -2.29 1.75 0.00 0.00 0.00 0.00 23.12 22.39 2flm s ALA 36 CO 0.22 -0.33 2.15 0.00 0.00 0.00 0.00 175.76 177.79 2flm h ALA 37 N 0.38 1.66 -0.28 0.00 0.00 -1.96 0.53 119.26 119.59 2flm h ALA 37 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2flm h ALA 37 Cb 1.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2flm h ALA 37 CO 0.60 -0.21 0.00 -0.40 0.00 0.00 0.00 179.25 179.24 2flm n ASP 38 N -3.71 2.29 -0.10 0.00 3.85 -1.26 -4.92 116.55 112.70 2flm n ASP 38 Ca 0.00 -2.19 -0.01 0.00 -0.71 0.00 0.00 54.79 51.88 2flm n ASP 38 Cb 0.25 -0.38 -0.01 0.00 -1.35 0.00 0.00 41.12 39.63 2flm n ASP 38 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 2flm n ASP 39 N 0.33 -5.03 -4.92 -1.12 10.43 0.18 -5.02 116.55 111.42 2flm n ASP 39 Ca 0.11 0.03 -0.26 0.00 2.57 0.00 0.00 54.79 57.24 2flm n ASP 39 Cb 0.45 -2.64 0.02 0.00 1.84 0.00 0.00 41.12 40.79 2flm n ASP 39 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2flm s THR 40 N -1.42 3.95 -0.35 -3.53 -4.23 -1.25 -4.80 115.64 104.01 2flm s THR 40 Ca 0.00 0.01 -0.17 0.00 -1.18 0.00 0.00 61.69 60.36 2flm s THR 40 Cb 0.00 -3.54 -0.01 0.00 1.34 0.00 0.00 72.50 70.29 2flm s THR 40 CO 0.00 -0.54 0.43 0.26 -0.54 0.00 0.00 174.62 174.23 2flm s TRP 41 N -2.91 3.19 -0.18 3.99 0.52 -1.26 -0.78 118.94 121.51 2flm s TRP 41 Ca 0.52 0.05 -0.10 0.00 0.02 0.00 0.00 56.10 56.60 2flm s TRP 41 Cb -0.10 -2.80 -0.05 0.00 -1.15 0.00 0.00 33.47 29.37 2flm s TRP 41 CO 0.45 -0.49 0.14 -1.83 0.02 0.00 0.00 176.95 175.23 2flm s GLU 42 N 2.19 4.05 0.30 4.98 -1.05 -0.08 -4.89 118.70 124.21 2flm s GLU 42 Ca 0.15 -0.19 -0.27 0.00 -0.15 0.00 0.00 54.97 54.50 2flm s GLU 42 Cb -0.16 -3.38 -0.14 0.00 -0.44 0.00 0.00 34.13 30.02 2flm s GLU 42 CO 0.12 0.39 0.96 -2.30 0.95 0.00 0.00 175.26 175.39 2flm n PRO 43 N 3.23 1.25 0.00 -4.83 -0.02 -1.26 -1.10 135.00 132.27 2flm n PRO 43 Ca -0.17 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2flm n PRO 43 Cb 0.53 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 2flm n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2flm n PHE 44 N 0.09 0.00 -3.54 6.00 7.35 0.39 -4.73 117.46 123.02 2flm n PHE 44 Ca 0.10 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.66 2flm n PHE 44 Cb 0.33 0.12 -0.05 0.00 0.35 0.00 0.00 39.48 40.23 2flm n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2flm s ALA 45 N -1.88 -1.83 0.25 3.13 0.00 -0.95 -5.00 121.76 115.48 2flm s ALA 45 Ca 0.00 1.34 -0.18 0.00 0.00 0.00 0.00 51.96 53.12 2flm s ALA 45 Cb 0.00 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 22.95 2flm s ALA 45 CO 0.00 -0.41 0.61 -1.54 0.00 0.00 0.00 175.76 174.42 2flm s SER 46 N -1.43 -0.22 0.00 0.00 1.04 -1.26 0.59 113.70 112.41 2flm s SER 46 Ca -0.04 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.73 2flm s SER 46 Cb -0.00 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.77 2flm s SER 46 CO 0.02 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 173.63 2flm n GLY 47 N -0.41 -1.35 3.31 7.32 0.00 -0.67 -4.97 105.19 108.41 2flm n GLY 47 Ca -0.05 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.70 2flm n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2flm s LYS 48 N -1.06 2.05 0.57 1.61 1.02 -1.26 -0.70 119.74 121.97 2flm s LYS 48 Ca 0.00 -0.95 -0.19 0.00 0.02 0.00 0.00 55.97 54.84 2flm s LYS 48 Cb 0.00 -2.02 -0.04 0.00 -0.52 0.00 0.00 37.83 35.25 2flm s LYS 48 CO 0.00 0.55 1.20 0.95 -0.92 0.00 0.00 175.35 177.13 2flm s THR 49 N -0.64 2.72 0.57 2.17 -4.23 -0.34 -4.79 115.64 111.10 2flm s THR 49 Ca 0.10 0.46 -0.08 0.00 -1.18 0.00 0.00 61.69 61.00 2flm s THR 49 Cb -0.10 -3.19 0.13 0.00 1.34 0.00 0.00 72.50 70.68 2flm s THR 49 CO -0.01 -0.09 0.78 -1.54 -0.54 0.00 0.00 174.62 173.23 2flm n SER 50 N -1.43 0.29 0.31 3.99 3.41 0.15 -1.52 113.62 118.83 2flm n SER 50 Ca 0.13 -1.42 0.18 0.00 -0.26 0.00 0.00 58.87 57.50 2flm n SER 50 Cb 0.49 -0.58 1.03 0.00 -0.26 0.00 0.00 64.21 64.90 2flm n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2flm h GLU 51 N 0.00 0.00 -0.20 4.33 4.39 -1.95 0.34 114.58 121.50 2flm h GLU 51 Ca -0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.45 2flm h GLU 51 Cb 0.76 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 2flm h GLU 51 CO 0.20 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 176.92 2flm n SER 52 N -3.51 1.53 -0.41 1.42 3.41 -1.26 -4.81 113.62 110.00 2flm n SER 52 Ca -0.03 -1.78 -0.05 0.00 -0.26 0.00 0.00 58.87 56.76 2flm n SER 52 Cb 0.11 -0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 63.91 2flm n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2flm n GLY 53 N 1.06 0.72 3.75 5.00 0.00 0.11 -4.75 105.19 111.07 2flm n GLY 53 Ca 0.14 -0.25 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 2flm n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2flm s GLU 54 N -1.97 2.73 -0.24 1.61 2.02 -1.26 -0.65 118.70 120.95 2flm s GLU 54 Ca 0.00 -0.87 0.01 0.00 0.02 0.00 0.00 54.97 54.12 2flm s GLU 54 Cb 0.00 -2.59 0.06 0.00 0.10 0.00 0.00 34.13 31.71 2flm s GLU 54 CO 0.00 0.51 -0.03 -1.17 0.02 0.00 0.00 175.26 174.58 2flm s LEU 55 N -2.78 2.55 0.31 1.80 2.96 0.95 -0.67 118.68 123.80 2flm s LEU 55 Ca 0.29 -1.22 0.06 0.00 -0.22 0.00 0.00 54.13 53.04 2flm s LEU 55 Cb -0.11 -1.14 -0.02 0.00 0.50 0.00 0.00 46.19 45.43 2flm s LEU 55 CO 0.21 -0.26 0.39 -1.00 -1.32 0.00 0.00 176.35 174.38 2flm s HIS 56 N 1.42 3.16 -1.05 5.38 3.76 -1.26 -2.64 115.29 124.06 2flm s HIS 56 Ca -0.04 -0.18 0.00 0.00 -0.15 0.00 0.00 55.06 54.69 2flm s HIS 56 Cb -0.19 -1.82 0.00 0.00 1.11 0.00 0.00 32.58 31.68 2flm s HIS 56 CO -0.07 0.17 0.00 0.41 -0.85 0.00 0.00 174.74 174.39 2flm n GLY 57 N -1.51 1.11 0.32 -2.22 0.00 -1.26 -4.92 105.19 96.71 2flm n GLY 57 Ca -0.03 -0.38 0.03 0.00 0.00 0.00 0.00 46.02 45.64 2flm n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2flm h LEU 58 N 0.00 0.75 -8.24 0.99 3.38 -1.84 -3.47 115.31 106.88 2flm h LEU 58 Ca -0.20 0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 2flm h LEU 58 Cb 0.75 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 2flm h LEU 58 CO 0.30 0.43 0.06 0.28 0.09 0.00 0.00 178.44 179.60 2flm s THR 59 N -6.02 0.00 0.24 0.22 -1.32 -1.26 -4.77 115.64 102.73 2flm s THR 59 Ca -0.12 -1.27 0.07 0.00 -1.21 0.00 0.00 61.69 59.15 2flm s THR 59 Cb 0.20 -2.77 -0.05 0.00 -1.51 0.00 0.00 72.50 68.36 2flm s THR 59 CO 0.79 0.00 -0.09 0.42 -2.21 0.00 0.00 174.62 173.53 2flm s THR 60 N -2.64 1.61 0.30 5.08 -4.23 -1.26 -4.48 115.64 110.02 2flm s THR 60 Ca 0.22 -2.15 0.01 0.00 -1.18 0.00 0.00 61.69 58.59 2flm s THR 60 Cb -0.03 -2.27 0.28 0.00 1.34 0.00 0.00 72.50 71.82 2flm s THR 60 CO 0.16 -0.43 1.91 -0.33 -0.54 0.00 0.00 174.62 175.39 2flm h GLU 61 N 2.42 0.99 -0.67 3.99 4.39 -1.97 -0.73 114.58 123.00 2flm h GLU 61 Ca -0.39 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.18 2flm h GLU 61 Cb 1.23 -0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 29.63 2flm h GLU 61 CO 0.65 0.65 0.15 1.49 -1.16 0.00 0.00 179.01 180.79 2flm h GLU 62 N 1.02 1.08 0.00 2.33 4.57 -2.04 -2.97 114.58 118.56 2flm h GLU 62 Ca 0.40 -0.27 -0.15 0.00 -1.18 0.00 0.00 59.36 58.15 2flm h GLU 62 Cb 0.22 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 2flm h GLU 62 CO -0.15 0.97 -0.73 0.93 -1.18 0.00 0.00 179.01 178.85 2flm h GLU 63 N 1.00 0.00 -3.69 1.92 5.08 -1.83 -3.40 114.58 113.66 2flm h GLU 63 Ca 0.21 0.00 -0.73 0.00 -1.00 0.00 0.00 59.36 57.84 2flm h GLU 63 Cb 0.39 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.55 2flm h GLU 63 CO 0.01 0.73 2.64 0.34 -1.00 0.00 0.00 179.01 181.73 2flm n PHE 64 N -3.32 3.18 -1.88 4.33 7.35 -0.33 -4.97 117.46 121.83 2flm n PHE 64 Ca 0.01 -2.89 -0.30 0.00 -0.76 0.00 0.00 57.45 53.51 2flm n PHE 64 Cb 0.81 -2.26 0.04 0.00 0.35 0.00 0.00 39.48 38.43 2flm n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 2flm s VAL 65 N 1.74 3.56 0.37 -2.13 -7.23 -1.26 -4.94 120.40 110.52 2flm s VAL 65 Ca 0.45 0.51 -0.26 0.00 -1.81 0.00 0.00 61.98 60.86 2flm s VAL 65 Cb 0.12 -3.50 -0.11 0.00 0.56 0.00 0.00 36.38 33.45 2flm s VAL 65 CO -0.05 -0.66 1.18 -0.62 -0.31 0.00 0.00 175.10 174.64 2flm n GLU 66 N -3.00 1.77 -3.99 4.82 1.02 -1.26 -4.87 120.64 115.13 2flm n GLU 66 Ca 0.07 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 57.83 2flm n GLU 66 Cb 0.57 -2.20 0.00 0.00 -0.02 0.00 0.00 31.44 29.79 2flm n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2flm n GLY 67 N 0.95 -1.57 3.69 0.62 0.00 -1.14 -4.97 105.19 102.77 2flm n GLY 67 Ca 0.07 -1.24 -0.36 0.00 0.00 0.00 0.00 46.02 44.50 2flm n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2flm s ILE 68 N -2.88 5.33 0.14 -0.61 1.01 -1.26 -0.25 121.20 122.68 2flm s ILE 68 Ca 0.00 0.17 0.10 0.00 0.00 0.00 0.00 60.65 60.91 2flm s ILE 68 Cb 0.00 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 2flm s ILE 68 CO 0.00 0.40 -0.23 -0.31 0.00 0.00 0.00 174.94 174.80 2flm s TYR 69 N 0.65 2.09 -0.09 3.97 1.51 0.64 -0.58 117.35 125.54 2flm s TYR 69 Ca 0.07 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.76 2flm s TYR 69 Cb -0.12 -1.10 0.01 0.00 -0.11 0.00 0.00 41.96 40.63 2flm s TYR 69 CO 0.01 0.33 -0.18 0.21 -1.11 0.00 0.00 175.55 174.81 2flm s LYS 70 N -2.23 2.39 -0.22 -0.62 2.20 0.01 -1.21 119.74 120.06 2flm s LYS 70 Ca 0.13 -0.65 -0.05 0.00 -0.36 0.00 0.00 55.97 55.05 2flm s LYS 70 Cb -0.09 -1.89 -0.02 0.00 -1.51 0.00 0.00 37.83 34.32 2flm s LYS 70 CO 0.06 0.08 -0.01 0.08 -0.36 0.00 0.00 175.35 175.20 2flm s VAL 71 N 0.58 3.69 -0.15 4.02 1.01 0.10 -0.05 120.40 129.60 2flm s VAL 71 Ca -0.15 -0.39 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 2flm s VAL 71 Cb -0.17 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 2flm s VAL 71 CO 0.05 0.41 -0.08 -0.70 0.00 0.00 0.00 175.10 174.78 2flm s GLU 72 N 1.35 3.52 -0.18 2.72 2.12 0.86 -0.52 118.70 128.56 2flm s GLU 72 Ca 0.04 -0.60 -0.02 0.00 0.36 0.00 0.00 54.97 54.76 2flm s GLU 72 Cb -0.14 -2.80 -0.00 0.00 0.26 0.00 0.00 34.13 31.44 2flm s GLU 72 CO -0.00 0.18 -0.11 0.42 -0.54 0.00 0.00 175.26 175.21 2flm s ILE 73 N 0.48 2.98 -1.38 -3.70 1.01 0.14 -0.83 121.20 119.89 2flm s ILE 73 Ca -0.06 -0.65 -0.14 0.00 0.00 0.00 0.00 60.65 59.80 2flm s ILE 73 Cb -0.15 -2.30 0.08 0.00 0.01 0.00 0.00 42.46 40.10 2flm s ILE 73 CO 0.04 0.48 2.02 -0.67 0.00 0.00 0.00 174.94 176.81 2flm n ASP 74 N 4.33 4.39 0.13 3.58 2.03 -0.28 -1.62 116.55 129.12 2flm n ASP 74 Ca -0.19 -2.92 -0.01 0.00 0.52 0.00 0.00 54.79 52.19 2flm n ASP 74 Cb 0.51 -1.64 0.21 0.00 -0.72 0.00 0.00 41.12 39.49 2flm n ASP 74 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2flm h THR 75 N 4.29 1.37 -0.21 5.18 1.35 -1.86 -3.17 112.91 119.86 2flm h THR 75 Ca 0.50 -1.81 -0.01 0.00 -0.55 0.00 0.00 66.41 64.54 2flm h THR 75 Cb 0.70 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 69.05 2flm h THR 75 CO 1.72 0.52 0.11 0.50 -0.25 0.00 0.00 175.52 178.12 2flm h LYS 76 N 0.06 0.30 -0.76 4.72 3.64 -1.78 -1.75 116.57 121.00 2flm h LYS 76 Ca -0.00 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2flm h LYS 76 Cb 0.96 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.68 2flm h LYS 76 CO 0.07 0.30 0.46 0.77 -2.27 0.00 0.00 179.45 178.79 2flm h SER 77 N 0.21 0.91 0.22 4.20 0.02 -1.90 -1.37 113.55 115.85 2flm h SER 77 Ca 0.07 -0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2flm h SER 77 Cb 0.10 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 2flm h SER 77 CO -0.01 0.70 -0.16 0.22 -1.14 0.00 0.00 176.83 176.44 2flm h TYR 78 N 1.05 -0.42 -0.25 3.45 3.20 -1.43 -0.73 116.97 121.84 2flm h TYR 78 Ca 0.28 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.10 2flm h TYR 78 Cb -0.05 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 2flm h TYR 78 CO 0.00 -0.25 -0.03 -1.49 -1.64 0.00 0.00 178.16 174.75 2flm h TRP 79 N -0.39 0.51 -0.51 -3.82 4.06 -1.19 -2.96 115.95 111.66 2flm h TRP 79 Ca -0.01 -0.10 -0.02 0.00 2.06 0.00 0.00 58.89 60.81 2flm h TRP 79 Cb 0.34 -0.13 -0.02 0.00 -1.00 0.00 0.00 29.16 28.34 2flm h TRP 79 CO -0.11 0.66 0.22 0.87 -3.56 0.00 0.00 178.44 176.52 2flm h LYS 80 N 0.22 0.73 0.00 0.49 1.57 -1.16 -0.72 116.57 117.69 2flm h LYS 80 Ca 0.07 -0.10 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2flm h LYS 80 Cb 0.47 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 2flm h LYS 80 CO 0.02 0.59 -0.01 0.00 -0.57 0.00 0.00 179.45 179.48 2flm h ALA 81 N 1.52 1.01 -0.01 3.86 0.00 -0.96 -0.09 119.26 124.58 2flm h ALA 81 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2flm h ALA 81 Cb 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2flm h ALA 81 CO -0.02 0.01 -0.01 1.28 0.00 0.00 0.00 179.25 180.51 2flm n LEU 82 N -3.11 1.33 -0.07 0.00 4.77 -0.37 -4.93 117.00 114.61 2flm n LEU 82 Ca -0.00 -0.44 -0.01 0.00 -0.03 0.00 0.00 56.01 55.53 2flm n LEU 82 Cb 0.25 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.33 2flm n LEU 82 CO 0.26 0.22 -0.01 0.61 -1.33 0.00 0.00 177.39 177.14 2flm n GLY 83 N 1.16 0.37 3.29 -0.72 0.00 -0.05 -5.05 105.19 104.19 2flm n GLY 83 Ca 0.19 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.97 2flm n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2flm s ILE 84 N -2.03 2.39 -0.35 -0.61 1.01 -0.63 -5.01 121.20 115.97 2flm s ILE 84 Ca 0.00 -0.92 -0.28 0.00 0.00 0.00 0.00 60.65 59.45 2flm s ILE 84 Cb 0.00 -1.93 0.02 0.00 0.01 0.00 0.00 42.46 40.56 2flm s ILE 84 CO 0.00 0.55 1.03 -0.55 0.00 0.00 0.00 174.94 175.98 2flm s SER 85 N 0.16 6.83 0.32 3.58 0.15 -1.26 -3.03 113.70 120.44 2flm s SER 85 Ca -0.11 0.86 -0.06 0.00 0.70 0.00 0.00 55.95 57.34 2flm s SER 85 Cb -0.16 -2.52 -0.05 0.00 -1.71 0.00 0.00 66.02 61.58 2flm s SER 85 CO 0.06 -0.90 0.60 -2.16 1.20 0.00 0.00 173.24 172.05 2flm s PRO 86 N 3.65 3.65 -0.04 5.44 0.04 -1.26 -4.95 135.00 141.53 2flm s PRO 86 Ca 0.43 0.09 -0.23 0.00 0.04 0.00 0.00 61.00 61.33 2flm s PRO 86 Cb -0.12 -2.59 -0.26 0.00 0.04 0.00 0.00 34.50 31.57 2flm s PRO 86 CO 0.18 0.15 0.98 0.35 0.04 0.00 0.00 177.00 178.69 2flm h PHE 87 N 1.52 0.42 -3.37 0.56 3.57 -1.59 -3.48 116.94 114.57 2flm h PHE 87 Ca -0.48 -0.26 -0.52 0.00 3.53 0.00 0.00 57.97 60.25 2flm h PHE 87 Cb 1.19 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.88 2flm h PHE 87 CO 0.58 1.12 -0.09 -1.01 -2.23 0.00 0.00 178.31 176.68 2flm s HIS 88 N -2.82 3.46 0.18 0.41 3.76 -1.26 -4.98 115.29 114.04 2flm s HIS 88 Ca -0.15 0.79 0.09 0.00 -0.15 0.00 0.00 55.06 55.64 2flm s HIS 88 Cb 0.01 -2.21 0.07 0.00 1.11 0.00 0.00 32.58 31.56 2flm s HIS 88 CO 0.79 0.16 1.44 0.93 -0.85 0.00 0.00 174.74 177.21 2flm h GLU 89 N 1.91 0.00 -2.21 1.40 4.39 -1.98 -3.40 114.58 114.70 2flm h GLU 89 Ca -0.47 0.00 0.22 0.00 0.34 0.00 0.00 59.36 59.45 2flm h GLU 89 Cb 1.18 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.76 2flm h GLU 89 CO 0.67 0.80 0.65 -3.38 -1.16 0.00 0.00 179.01 176.59 2flm s HIS 90 N -3.14 -0.01 -0.01 4.33 -3.43 -1.26 -4.21 115.29 107.55 2flm s HIS 90 Ca 0.00 -0.27 0.03 0.00 -0.80 0.00 0.00 55.06 54.03 2flm s HIS 90 Cb 0.11 0.63 -0.03 0.00 -1.43 0.00 0.00 32.58 31.87 2flm s HIS 90 CO 0.79 -0.68 -0.09 0.00 -2.00 0.00 0.00 174.74 172.76 2flm s ALA 91 N -2.51 2.91 0.02 -1.38 0.00 -0.64 -4.92 121.76 115.24 2flm s ALA 91 Ca 0.19 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 51.16 2flm s ALA 91 Cb -0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.03 2flm s ALA 91 CO 0.02 0.59 -0.08 -2.00 0.00 0.00 0.00 175.76 174.29 2flm s GLU 92 N -1.22 0.58 -0.06 0.00 2.12 -1.26 0.29 118.70 119.15 2flm s GLU 92 Ca 0.15 -0.46 -0.01 0.00 0.36 0.00 0.00 54.97 55.01 2flm s GLU 92 Cb -0.11 -0.50 0.03 0.00 0.26 0.00 0.00 34.13 33.81 2flm s GLU 92 CO 0.05 0.12 0.02 0.08 -0.54 0.00 0.00 175.26 174.99 2flm s VAL 93 N -0.62 0.20 -0.11 3.70 1.01 0.32 -4.98 120.40 119.92 2flm s VAL 93 Ca -0.01 0.21 0.03 0.00 0.00 0.00 0.00 61.98 62.20 2flm s VAL 93 Cb -0.05 -0.38 0.00 0.00 0.00 0.00 0.00 36.38 35.95 2flm s VAL 93 CO 0.00 0.22 -0.22 -0.69 0.00 0.00 0.00 175.10 174.41 2flm s VAL 94 N 1.88 2.17 0.05 2.92 1.01 -1.26 0.02 120.40 127.18 2flm s VAL 94 Ca 0.03 -0.97 -0.20 0.00 0.00 0.00 0.00 61.98 60.84 2flm s VAL 94 Cb -0.12 -1.84 0.04 0.00 0.00 0.00 0.00 36.38 34.45 2flm s VAL 94 CO -0.04 0.55 0.46 0.72 0.00 0.00 0.00 175.10 176.79 2flm s PHE 95 N 0.46 -0.33 -0.14 5.22 -0.71 -0.35 -4.99 117.98 117.15 2flm s PHE 95 Ca -0.15 0.29 -0.15 0.00 -1.04 0.00 0.00 56.93 55.88 2flm s PHE 95 Cb -0.17 0.28 -0.05 0.00 -1.21 0.00 0.00 43.02 41.87 2flm s PHE 95 CO 0.06 -0.61 0.37 0.99 -1.34 0.00 0.00 175.22 174.68 2flm s THR 96 N -2.60 5.25 0.01 -4.49 2.01 -1.26 -0.26 115.64 114.30 2flm s THR 96 Ca -0.04 0.71 -0.23 0.00 0.31 0.00 0.00 61.69 62.44 2flm s THR 96 Cb -0.01 -3.70 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 2flm s THR 96 CO -0.03 0.38 0.67 0.00 -0.69 0.00 0.00 174.62 174.95 2flm s ALA 97 N 0.44 3.43 0.08 7.40 0.00 0.66 -4.96 121.76 128.80 2flm s ALA 97 Ca 0.20 0.14 0.06 0.00 0.00 0.00 0.00 51.96 52.36 2flm s ALA 97 Cb -0.14 -2.86 -0.03 0.00 0.00 0.00 0.00 23.12 20.09 2flm s ALA 97 CO 0.07 0.11 -0.16 -0.80 0.00 0.00 0.00 175.76 174.97 2flm s ASN 98 N -0.08 1.94 -1.11 0.00 0.01 -1.26 -2.89 114.94 111.56 2flm s ASN 98 Ca 0.34 -0.62 -0.09 0.00 -0.71 0.00 0.00 52.86 51.78 2flm s ASN 98 Cb -0.19 -0.08 0.28 0.00 0.41 0.00 0.00 41.25 41.66 2flm s ASN 98 CO 0.20 -0.02 1.11 -1.81 -1.51 0.00 0.00 177.10 175.06 2flm s ASP 99 N -1.73 7.31 0.84 -1.22 -0.00 -1.26 -4.86 116.67 115.74 2flm s ASP 99 Ca 0.01 -3.57 -0.14 0.00 -0.00 0.00 0.00 52.55 48.84 2flm s ASP 99 Cb -0.10 -2.21 -0.00 0.00 -0.00 0.00 0.00 42.92 40.61 2flm s ASP 99 CO 0.03 -0.30 0.49 -0.81 -0.00 0.00 0.00 175.17 174.58 2flm n PRO 102 N 2.75 0.02 -0.00 8.23 -0.04 -1.26 -5.20 135.00 139.49 2flm n PRO 102 Ca 0.24 0.06 0.09 0.00 -0.04 0.00 0.00 63.50 63.84 2flm n PRO 102 Cb 0.39 -1.86 -0.11 0.00 -0.04 0.00 0.00 33.50 31.88 2flm n PRO 102 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2flm n ARG 103 N -1.24 0.96 -4.58 0.54 1.85 -1.07 -4.72 116.66 108.40 2flm n ARG 103 Ca 0.08 -0.03 -0.33 0.00 -1.00 0.00 0.00 57.85 56.57 2flm n ARG 103 Cb 0.52 -1.37 -0.15 0.00 -1.05 0.00 0.00 32.46 30.41 2flm n ARG 103 CO 0.00 0.00 0.00 1.03 -0.01 0.00 0.00 177.63 178.65 2flm s ARG 104 N -2.81 3.25 -0.21 2.89 0.52 -0.00 -4.74 118.95 117.85 2flm s ARG 104 Ca 0.04 -0.74 -0.06 0.00 -0.52 0.00 0.00 55.73 54.46 2flm s ARG 104 Cb 0.13 -2.62 -0.03 0.00 0.52 0.00 0.00 34.95 32.95 2flm s ARG 104 CO 0.75 0.05 0.02 0.71 0.02 0.00 0.00 175.30 176.85 2flm s TYR 105 N 0.73 3.07 -0.19 -0.53 1.51 0.67 -1.33 117.35 121.27 2flm s TYR 105 Ca -0.07 -0.40 -0.04 0.00 -1.01 0.00 0.00 57.07 55.55 2flm s TYR 105 Cb -0.15 -2.12 -0.02 0.00 -0.11 0.00 0.00 41.96 39.56 2flm s TYR 105 CO 0.01 -0.23 -0.04 0.99 -1.11 0.00 0.00 175.55 175.18 2flm s THR 106 N 1.08 3.66 -0.32 -0.71 2.01 0.36 -1.38 115.64 120.34 2flm s THR 106 Ca 0.03 -0.42 -0.11 0.00 0.31 0.00 0.00 61.69 61.51 2flm s THR 106 Cb -0.14 -2.64 -0.01 0.00 0.01 0.00 0.00 72.50 69.72 2flm s THR 106 CO 0.02 0.45 0.18 -0.63 -0.69 0.00 0.00 174.62 173.95 2flm s ILE 107 N 0.93 4.81 -0.10 1.82 -1.09 -0.04 -1.15 121.20 126.38 2flm s ILE 107 Ca -0.00 -0.36 -0.00 0.00 -2.23 0.00 0.00 60.65 58.06 2flm s ILE 107 Cb -0.15 -3.46 -0.03 0.00 -1.58 0.00 0.00 42.46 37.25 2flm s ILE 107 CO 0.01 0.04 -0.08 0.00 -1.23 0.00 0.00 174.94 173.69 2flm s ALA 108 N 1.65 2.88 -0.04 9.38 0.00 -0.43 -0.79 121.76 134.41 2flm s ALA 108 Ca 0.05 -0.88 0.05 0.00 0.00 0.00 0.00 51.96 51.18 2flm s ALA 108 Cb -0.17 -1.28 -0.01 0.00 0.00 0.00 0.00 23.12 21.66 2flm s ALA 108 CO 0.08 0.42 -0.19 0.00 0.00 0.00 0.00 175.76 176.06 2flm s ALA 109 N -0.27 1.68 -0.17 0.00 0.00 0.32 -1.03 121.76 122.30 2flm s ALA 109 Ca 0.03 -0.80 -0.01 0.00 0.00 0.00 0.00 51.96 51.19 2flm s ALA 109 Cb -0.13 -0.52 -0.00 0.00 0.00 0.00 0.00 23.12 22.47 2flm s ALA 109 CO 0.03 0.34 -0.13 -1.17 0.00 0.00 0.00 175.76 174.82 2flm s LEU 110 N -0.12 2.59 -0.10 0.00 2.96 -0.31 -0.47 118.68 123.23 2flm s LEU 110 Ca -0.01 -0.44 -0.01 0.00 -0.22 0.00 0.00 54.13 53.46 2flm s LEU 110 Cb -0.11 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.95 2flm s LEU 110 CO 0.02 0.07 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.29 2flm s LEU 111 N 0.89 3.09 0.17 -0.68 1.43 0.29 -1.50 118.68 122.38 2flm s LEU 111 Ca -0.03 -0.11 0.04 0.00 -1.03 0.00 0.00 54.13 52.99 2flm s LEU 111 Cb -0.15 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.33 2flm s LEU 111 CO -0.01 0.27 -0.06 -0.44 0.23 0.00 0.00 176.35 176.35 2flm s SER 112 N -0.27 1.65 0.35 2.29 0.01 -0.26 -1.07 113.70 116.40 2flm s SER 112 Ca 0.03 -1.09 0.12 0.00 1.31 0.00 0.00 55.95 56.32 2flm s SER 112 Cb -0.13 0.02 0.93 0.00 0.21 0.00 0.00 66.02 67.05 2flm s SER 112 CO 0.03 -0.43 1.77 -0.65 0.41 0.00 0.00 173.24 174.37 2flm h PRO 113 N 2.70 0.55 -0.20 12.44 0.11 -2.00 -2.60 132.00 143.01 2flm h PRO 113 Ca -0.37 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.71 2flm h PRO 113 Cb 1.20 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2flm h PRO 113 CO 0.64 0.36 0.00 0.66 -0.21 0.00 0.00 178.00 179.45 2flm n TYR 114 N -4.72 0.54 -3.66 0.65 4.01 -1.26 -1.40 117.16 111.32 2flm n TYR 114 Ca 0.24 -0.77 -0.15 0.00 -0.16 0.00 0.00 57.90 57.07 2flm n TYR 114 Cb 0.72 -0.18 -0.08 0.00 -0.31 0.00 0.00 39.34 39.49 2flm n TYR 114 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2flm s SER 115 N -1.78 -0.49 0.02 7.72 0.15 -0.98 -4.99 113.70 113.35 2flm s SER 115 Ca 0.31 0.73 -0.04 0.00 0.70 0.00 0.00 55.95 57.65 2flm s SER 115 Cb 0.24 0.75 -0.01 0.00 -1.71 0.00 0.00 66.02 65.28 2flm s SER 115 CO 0.08 -0.36 0.06 -0.72 1.20 0.00 0.00 173.24 173.50 2flm s TYR 116 N -0.52 0.20 0.07 3.44 -0.85 -1.26 -1.10 117.35 117.32 2flm s TYR 116 Ca -0.06 -0.45 0.06 0.00 -0.52 0.00 0.00 57.07 56.09 2flm s TYR 116 Cb -0.03 -0.15 -0.03 0.00 0.38 0.00 0.00 41.96 42.13 2flm s TYR 116 CO 0.04 -0.29 -0.15 -1.54 -1.52 0.00 0.00 175.55 172.09 2flm s SER 117 N -1.76 1.81 -0.01 -0.18 1.04 -0.56 -4.98 113.70 109.07 2flm s SER 117 Ca -0.11 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.74 2flm s SER 117 Cb -0.05 -0.08 0.01 0.00 0.10 0.00 0.00 66.02 66.00 2flm s SER 117 CO -0.02 -0.03 -0.00 0.28 0.98 0.00 0.00 173.24 174.45 2flm s THR 118 N -1.16 0.07 0.07 2.02 -1.32 -1.26 -1.16 115.64 112.90 2flm s THR 118 Ca 0.00 0.02 0.05 0.00 -1.21 0.00 0.00 61.69 60.55 2flm s THR 118 Cb -0.10 -0.10 -0.03 0.00 -1.51 0.00 0.00 72.50 70.77 2flm s THR 118 CO 0.02 0.05 -0.14 0.28 -2.21 0.00 0.00 174.62 172.62 2flm s THR 119 N 0.30 1.12 -0.08 5.08 -1.32 -0.20 -4.97 115.64 115.58 2flm s THR 119 Ca -0.03 -1.27 0.00 0.00 -1.21 0.00 0.00 61.69 59.18 2flm s THR 119 Cb -0.04 -1.07 -0.03 0.00 -1.51 0.00 0.00 72.50 69.85 2flm s THR 119 CO -0.01 -0.19 -0.07 0.00 -2.21 0.00 0.00 174.62 172.14 2flm s ALA 120 N -1.22 2.96 -0.13 11.08 0.00 -1.26 -1.32 121.76 131.87 2flm s ALA 120 Ca -0.01 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.08 2flm s ALA 120 Cb -0.10 -1.26 0.02 0.00 0.00 0.00 0.00 23.12 21.77 2flm s ALA 120 CO 0.02 0.51 -0.17 0.08 0.00 0.00 0.00 175.76 176.20 2flm s VAL 121 N -0.59 1.71 -0.22 0.00 1.01 -0.30 -4.98 120.40 117.04 2flm s VAL 121 Ca 0.09 -0.75 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 2flm s VAL 121 Cb -0.12 -1.55 0.06 0.00 0.00 0.00 0.00 36.38 34.77 2flm s VAL 121 CO 0.02 0.48 -0.00 -0.69 0.00 0.00 0.00 175.10 174.91 2flm s VAL 122 N 1.10 0.99 0.20 2.92 1.01 -1.26 -0.49 120.40 124.87 2flm s VAL 122 Ca -0.03 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.08 2flm s VAL 122 Cb -0.14 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.79 2flm s VAL 122 CO -0.05 -0.18 0.01 0.42 0.00 0.00 0.00 175.10 175.30 2flm s THR 123 N 1.64 0.72 -1.99 3.92 -4.23 -0.44 -4.82 115.64 110.43 2flm s THR 123 Ca -0.03 -1.99 0.16 0.00 -1.18 0.00 0.00 61.69 58.65 2flm s THR 123 Cb -0.18 -2.24 0.13 0.00 1.34 0.00 0.00 72.50 71.55 2flm s THR 123 CO -0.08 -0.38 1.00 0.59 -0.54 0.00 0.00 174.62 175.22