#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2flm h PRO 11 N 0.00 0.00 -3.13 0.00 0.13 -1.89 -3.42 132.00 123.69 2flm h PRO 11 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.82 2flm h PRO 11 Cb 0.00 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 30.77 2flm h PRO 11 CO 0.00 0.00 -0.65 -1.17 -0.23 0.00 0.00 178.00 175.95 2flm s LEU 12 N -6.05 -0.03 0.05 1.56 2.96 -1.25 -0.85 118.68 115.08 2flm s LEU 12 Ca -0.01 0.29 0.03 0.00 -0.22 0.00 0.00 54.13 54.22 2flm s LEU 12 Cb 0.10 0.20 -0.03 0.00 0.50 0.00 0.00 46.19 46.97 2flm s LEU 12 CO 0.49 -0.24 -0.10 -0.32 -1.32 0.00 0.00 176.35 174.86 2flm s MET 13 N 2.26 0.63 -0.05 1.98 -2.45 -0.03 -4.43 119.30 117.21 2flm s MET 13 Ca 0.03 -0.85 0.04 0.00 -1.25 0.00 0.00 55.69 53.66 2flm s MET 13 Cb -0.12 -0.45 0.00 0.00 1.25 0.00 0.00 34.83 35.52 2flm s MET 13 CO -0.05 0.08 -0.16 0.08 1.05 0.00 0.00 175.02 176.02 2flm s VAL 14 N -1.49 1.36 -0.03 10.11 1.01 -0.88 -0.51 120.40 129.97 2flm s VAL 14 Ca -0.06 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.30 2flm s VAL 14 Cb -0.09 -1.19 -0.01 0.00 0.00 0.00 0.00 36.38 35.09 2flm s VAL 14 CO 0.01 0.40 -0.15 -1.59 0.00 0.00 0.00 175.10 173.76 2flm s LYS 15 N 0.24 1.45 -0.04 2.72 -2.85 -0.15 -0.19 119.74 120.91 2flm s LYS 15 Ca -0.08 -0.54 0.01 0.00 -1.00 0.00 0.00 55.97 54.37 2flm s LYS 15 Cb -0.13 -1.32 0.02 0.00 -2.06 0.00 0.00 37.83 34.34 2flm s LYS 15 CO 0.03 0.25 -0.05 0.08 0.10 0.00 0.00 175.35 175.76 2flm s VAL 16 N -0.08 0.58 0.13 1.79 1.01 0.03 -0.56 120.40 123.30 2flm s VAL 16 Ca -0.00 -0.17 0.09 0.00 0.00 0.00 0.00 61.98 61.89 2flm s VAL 16 Cb -0.09 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 2flm s VAL 16 CO 0.01 0.22 -0.14 -0.76 0.00 0.00 0.00 175.10 174.43 2flm s LEU 17 N 0.73 2.86 -0.32 3.92 1.43 -0.09 -1.00 118.68 126.21 2flm s LEU 17 Ca -0.10 -0.53 -0.09 0.00 -1.03 0.00 0.00 54.13 52.38 2flm s LEU 17 Cb -0.13 -1.64 0.01 0.00 0.03 0.00 0.00 46.19 44.45 2flm s LEU 17 CO 0.00 0.16 0.14 -0.62 0.23 0.00 0.00 176.35 176.26 2flm s ASP 18 N -2.36 5.43 0.04 2.29 -1.08 0.61 -1.55 116.67 120.04 2flm s ASP 18 Ca 0.21 -0.69 0.28 0.00 -0.52 0.00 0.00 52.55 51.83 2flm s ASP 18 Cb -0.10 -1.96 1.15 0.00 -1.46 0.00 0.00 42.92 40.55 2flm s ASP 18 CO 0.12 -0.23 1.90 0.00 0.52 0.00 0.00 175.17 177.48 2flm n ALA 19 N 4.94 2.33 -0.01 3.66 0.00 -0.47 -1.46 120.51 129.50 2flm n ALA 19 Ca -0.14 -0.09 -0.21 0.00 0.00 0.00 0.00 53.44 53.01 2flm n ALA 19 Cb 0.48 -1.47 -0.13 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 1.05 0.00 0.00 2.07 -1.94 -3.38 116.25 114.05 2flm h VAL 20 Ca 0.00 -2.36 0.00 0.00 0.82 0.00 0.00 66.70 65.16 2flm h VAL 20 Cb 0.55 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 33.00 2flm h VAL 20 CO 0.00 0.65 -0.93 0.54 0.02 0.00 0.00 177.57 177.85 2flm n ARG 21 N -4.03 0.23 -3.31 1.57 1.74 -1.24 -5.00 116.66 106.62 2flm n ARG 21 Ca -0.25 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.67 2flm n ARG 21 Cb 0.84 -1.58 0.07 0.00 -1.02 0.00 0.00 32.46 30.78 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 1.39 -0.99 3.48 -0.13 0.00 -0.54 -5.03 105.19 103.37 2flm n GLY 22 Ca 0.03 0.48 -0.09 0.00 0.00 0.00 0.00 46.02 46.44 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 -3.60 -0.10 0.68 1.61 1.04 -1.12 -5.01 113.70 107.20 2flm s SER 23 Ca 0.36 -0.75 -0.17 0.00 0.48 0.00 0.00 55.95 55.88 2flm s SER 23 Cb -0.05 0.53 0.01 0.00 0.10 0.00 0.00 66.02 66.61 2flm s SER 23 CO 0.74 -1.02 1.25 -2.16 0.98 0.00 0.00 173.24 173.03 2flm s PRO 24 N -3.95 2.38 -0.51 4.02 0.04 -1.26 -0.29 135.00 135.43 2flm s PRO 24 Ca 0.16 1.91 -0.20 0.00 0.04 0.00 0.00 61.00 62.92 2flm s PRO 24 Cb 0.01 -1.84 0.06 0.00 0.04 0.00 0.00 34.50 32.76 2flm s PRO 24 CO 0.02 -1.69 0.66 0.00 0.04 0.00 0.00 177.00 176.02 2flm s ALA 25 N -1.67 3.37 0.13 8.56 0.00 -0.17 -4.51 121.76 127.46 2flm s ALA 25 Ca 0.79 -1.70 -0.09 0.00 0.00 0.00 0.00 51.96 50.95 2flm s ALA 25 Cb -0.33 -3.39 -0.06 0.00 0.00 0.00 0.00 23.12 19.34 2flm s ALA 25 CO 0.42 -2.05 0.44 0.96 0.00 0.00 0.00 175.76 175.53 2flm s ILE 26 N 2.75 5.05 -1.41 0.00 -4.36 -1.26 -4.34 121.20 117.63 2flm s ILE 26 Ca 0.16 0.39 -0.03 0.00 -0.26 0.00 0.00 60.65 60.92 2flm s ILE 26 Cb -0.19 -3.64 0.00 0.00 1.25 0.00 0.00 42.46 39.88 2flm s ILE 26 CO 0.12 0.15 0.42 0.59 0.24 0.00 0.00 174.94 176.46 2flm n ASN 27 N 0.48 -5.53 -4.65 4.36 3.02 -0.17 -4.95 115.26 107.82 2flm n ASN 27 Ca -0.05 -0.20 -0.42 0.00 -0.03 0.00 0.00 54.58 53.89 2flm n ASN 27 Cb 0.52 -4.42 -0.04 0.00 -0.61 0.00 0.00 39.78 35.24 2flm n ASN 27 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2flm s VAL 28 N -3.06 4.81 0.31 2.41 1.01 -1.26 -4.76 120.40 119.85 2flm s VAL 28 Ca 0.21 1.67 -0.28 0.00 0.00 0.00 0.00 61.98 63.57 2flm s VAL 28 Cb -0.09 -4.16 -0.09 0.00 0.00 0.00 0.00 36.38 32.04 2flm s VAL 28 CO 0.26 -0.09 1.12 0.00 0.00 0.00 0.00 175.10 176.38 2flm s ALA 29 N 2.86 3.35 -0.03 5.51 0.00 -1.26 -1.20 121.76 130.98 2flm s ALA 29 Ca 0.37 0.91 0.00 0.00 0.00 0.00 0.00 51.96 53.24 2flm s ALA 29 Cb -0.15 -3.34 0.03 0.00 0.00 0.00 0.00 23.12 19.66 2flm s ALA 29 CO 0.07 -0.24 -0.01 0.08 0.00 0.00 0.00 175.76 175.67 2flm s VAL 30 N -1.25 0.25 -0.10 0.00 1.01 -0.06 -0.59 120.40 119.65 2flm s VAL 30 Ca 0.48 0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.55 2flm s VAL 30 Cb -0.31 -0.34 0.00 0.00 0.00 0.00 0.00 36.38 35.73 2flm s VAL 30 CO 0.40 0.17 -0.23 -1.00 0.00 0.00 0.00 175.10 174.44 2flm s HIS 31 N 1.08 2.49 -0.08 5.22 3.76 -0.26 -1.46 115.29 126.04 2flm s HIS 31 Ca -0.09 -1.03 0.00 0.00 -0.15 0.00 0.00 55.06 53.80 2flm s HIS 31 Cb -0.14 -1.67 -0.03 0.00 1.11 0.00 0.00 32.58 31.85 2flm s HIS 31 CO -0.02 -0.42 -0.06 0.08 -0.85 0.00 0.00 174.74 173.48 2flm s VAL 32 N 0.38 3.77 0.15 -0.90 1.01 0.26 -0.23 120.40 124.84 2flm s VAL 32 Ca -0.18 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 61.42 2flm s VAL 32 Cb -0.18 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.61 2flm s VAL 32 CO 0.08 0.59 -0.16 -0.36 0.00 0.00 0.00 175.10 175.25 2flm s PHE 33 N -0.71 1.65 -0.05 5.22 0.40 0.29 -0.22 117.98 124.56 2flm s PHE 33 Ca 0.11 -0.52 0.03 0.00 -0.60 0.00 0.00 56.93 55.95 2flm s PHE 33 Cb -0.11 -0.83 0.01 0.00 0.51 0.00 0.00 43.02 42.59 2flm s PHE 33 CO 0.02 0.26 -0.14 0.50 0.70 0.00 0.00 175.22 176.56 2flm s ARG 34 N -2.88 1.72 0.12 0.44 3.52 -0.17 -0.80 118.95 120.90 2flm s ARG 34 Ca 0.14 -0.50 -0.31 0.00 -0.13 0.00 0.00 55.73 54.93 2flm s ARG 34 Cb -0.05 -1.45 -0.08 0.00 -1.56 0.00 0.00 34.95 31.81 2flm s ARG 34 CO 0.05 0.12 1.44 0.21 -0.81 0.00 0.00 175.30 176.32 2flm s LYS 35 N 0.37 4.29 0.48 5.12 2.20 0.55 -1.00 119.74 131.75 2flm s LYS 35 Ca -0.10 2.15 0.05 0.00 -0.36 0.00 0.00 55.97 57.72 2flm s LYS 35 Cb -0.14 -3.24 0.02 0.00 -1.51 0.00 0.00 37.83 32.96 2flm s LYS 35 CO 0.03 -0.49 0.66 0.00 -0.36 0.00 0.00 175.35 175.19 2flm s ALA 36 N 1.20 4.29 0.34 3.13 0.00 -0.35 -4.69 121.76 125.68 2flm s ALA 36 Ca 0.66 -1.56 0.25 0.00 0.00 0.00 0.00 51.96 51.31 2flm s ALA 36 Cb -0.38 -1.79 1.14 0.00 0.00 0.00 0.00 23.12 22.08 2flm s ALA 36 CO 0.30 -0.49 1.18 0.00 0.00 0.00 0.00 175.76 176.76 2flm n ALA 37 N -2.06 1.06 0.93 0.00 0.00 -1.26 -0.11 120.51 119.07 2flm n ALA 37 Ca 0.08 0.65 0.10 0.00 0.00 0.00 0.00 53.44 54.27 2flm n ALA 37 Cb 0.59 -0.81 -0.02 0.00 0.00 0.00 0.00 19.45 19.22 2flm n ALA 37 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2flm n ASP 38 N -4.16 1.79 -0.06 0.00 5.68 -1.26 -4.95 116.55 113.59 2flm n ASP 38 Ca 0.31 -1.39 -0.01 0.00 -0.50 0.00 0.00 54.79 53.20 2flm n ASP 38 Cb 1.21 0.55 -0.00 0.00 -1.14 0.00 0.00 41.12 41.74 2flm n ASP 38 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2flm n ASP 39 N -0.25 -1.47 -4.88 -1.12 -0.08 0.85 -5.07 116.55 104.53 2flm n ASP 39 Ca 0.08 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 53.15 2flm n ASP 39 Cb 0.42 -0.62 -0.03 0.00 2.34 0.00 0.00 41.12 43.23 2flm n ASP 39 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 2flm s THR 40 N -2.03 3.05 -0.50 5.18 -1.32 -1.26 -4.80 115.64 113.98 2flm s THR 40 Ca 0.00 -1.33 -0.26 0.00 -1.21 0.00 0.00 61.69 58.89 2flm s THR 40 Cb 0.00 -3.08 0.03 0.00 -1.51 0.00 0.00 72.50 67.94 2flm s THR 40 CO 0.00 -0.07 0.99 0.26 -2.21 0.00 0.00 174.62 173.59 2flm s TRP 41 N -2.39 2.84 -0.09 9.09 0.52 -1.26 -1.21 118.94 126.44 2flm s TRP 41 Ca 0.46 0.35 -0.16 0.00 0.02 0.00 0.00 56.10 56.77 2flm s TRP 41 Cb -0.05 -4.12 -0.05 0.00 -1.15 0.00 0.00 33.47 28.10 2flm s TRP 41 CO 0.28 -1.24 0.40 -2.00 0.02 0.00 0.00 176.95 174.41 2flm s GLU 42 N 4.04 4.15 0.38 4.98 2.12 -0.17 -4.85 118.70 129.35 2flm s GLU 42 Ca 0.38 0.33 -0.28 0.00 0.36 0.00 0.00 54.97 55.76 2flm s GLU 42 Cb -0.10 -3.35 -0.10 0.00 0.26 0.00 0.00 34.13 30.83 2flm s GLU 42 CO 0.26 0.38 1.44 -2.14 -0.54 0.00 0.00 175.26 174.65 2flm s PRO 43 N -0.04 4.08 -0.01 4.30 0.02 -1.26 -1.00 135.00 141.09 2flm s PRO 43 Ca 0.22 2.48 -0.00 0.00 0.02 0.00 0.00 61.00 63.72 2flm s PRO 43 Cb -0.15 -2.93 -0.01 0.00 0.02 0.00 0.00 34.50 31.44 2flm s PRO 43 CO 0.09 -0.52 -0.01 0.34 -0.33 0.00 0.00 177.00 176.57 2flm n PHE 44 N 0.40 0.00 -3.63 6.54 7.35 0.70 -4.78 117.46 124.04 2flm n PHE 44 Ca 0.02 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.68 2flm n PHE 44 Cb 0.40 -0.04 -0.01 0.00 0.35 0.00 0.00 39.48 40.18 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 -2.02 -2.02 0.16 3.13 0.00 -0.96 -5.00 121.76 115.05 2flm s ALA 45 Ca -0.01 0.81 -0.21 0.00 0.00 0.00 0.00 51.96 52.54 2flm s ALA 45 Cb 0.00 0.32 0.06 0.00 0.00 0.00 0.00 23.12 23.50 2flm s ALA 45 CO 0.02 -0.91 0.57 -1.54 0.00 0.00 0.00 175.76 173.90 2flm s SER 46 N -2.74 -0.47 -0.00 0.00 1.04 -1.26 0.91 113.70 111.18 2flm s SER 46 Ca 0.12 -0.13 -0.12 0.00 0.48 0.00 0.00 55.95 56.29 2flm s SER 46 Cb 0.02 0.59 0.04 0.00 0.10 0.00 0.00 66.02 66.76 2flm s SER 46 CO -0.03 -0.98 0.55 0.61 0.98 0.00 0.00 173.24 174.36 2flm n GLY 47 N -0.36 0.48 3.03 7.32 0.00 -0.54 -4.94 105.19 110.19 2flm n GLY 47 Ca -0.15 -0.93 -0.11 0.00 0.00 0.00 0.00 46.02 44.82 2flm n GLY 47 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2flm s LYS 48 N -2.01 0.45 0.49 1.61 -2.85 -1.26 -0.88 119.74 115.29 2flm s LYS 48 Ca 0.13 -0.73 -0.22 0.00 -1.00 0.00 0.00 55.97 54.15 2flm s LYS 48 Cb -0.00 -0.11 -0.07 0.00 -2.06 0.00 0.00 37.83 35.59 2flm s LYS 48 CO -0.00 0.00 1.17 0.95 0.10 0.00 0.00 175.35 177.58 2flm s THR 49 N -1.55 3.02 0.59 3.79 -4.23 -0.34 -4.73 115.64 112.19 2flm s THR 49 Ca -0.11 0.73 -0.07 0.00 -1.18 0.00 0.00 61.69 61.06 2flm s THR 49 Cb -0.09 -3.36 0.13 0.00 1.34 0.00 0.00 72.50 70.52 2flm s THR 49 CO -0.01 -0.04 0.80 -1.54 -0.54 0.00 0.00 174.62 173.30 2flm n SER 50 N -0.73 0.39 0.25 3.99 3.41 0.12 -1.00 113.62 120.06 2flm n SER 50 Ca 0.09 -1.49 0.17 0.00 -0.26 0.00 0.00 58.87 57.38 2flm n SER 50 Cb 0.48 -0.58 0.90 0.00 -0.26 0.00 0.00 64.21 64.75 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 -0.02 4.33 4.39 -1.94 0.82 114.58 122.16 2flm h GLU 51 Ca -0.26 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.44 2flm h GLU 51 Cb 0.80 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 2flm h GLU 51 CO 0.22 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 176.94 2flm n SER 52 N -3.64 0.91 0.00 1.42 3.41 -1.26 -4.76 113.62 109.70 2flm n SER 52 Ca -0.00 -1.32 0.00 0.00 -0.26 0.00 0.00 58.87 57.29 2flm n SER 52 Cb 0.25 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 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 1.10 0.59 3.83 5.00 0.00 0.28 -4.78 105.19 111.22 2flm n GLY 53 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.11 3.09 -0.20 1.61 2.02 -1.26 -0.79 118.70 123.06 2flm s GLU 54 Ca 0.00 -0.60 -0.00 0.00 0.02 0.00 0.00 54.97 54.39 2flm s GLU 54 Cb 0.00 -2.84 0.05 0.00 0.10 0.00 0.00 34.13 31.44 2flm s GLU 54 CO 0.00 0.58 -0.04 -1.17 0.02 0.00 0.00 175.26 174.66 2flm s LEU 55 N -2.43 1.89 0.33 1.80 2.96 0.74 -0.70 118.68 123.26 2flm s LEU 55 Ca 0.31 -0.89 0.09 0.00 -0.22 0.00 0.00 54.13 53.42 2flm s LEU 55 Cb -0.12 -0.95 -0.04 0.00 0.50 0.00 0.00 46.19 45.57 2flm s LEU 55 CO 0.24 -0.23 0.10 -1.00 -1.32 0.00 0.00 176.35 174.14 2flm s HIS 56 N 1.59 2.67 -0.74 5.38 3.76 -1.26 -2.08 115.29 124.61 2flm s HIS 56 Ca -0.02 -0.38 0.00 0.00 -0.15 0.00 0.00 55.06 54.51 2flm s HIS 56 Cb -0.17 -1.56 0.00 0.00 1.11 0.00 0.00 32.58 31.96 2flm s HIS 56 CO -0.07 0.40 0.00 0.41 -0.85 0.00 0.00 174.74 174.63 2flm n GLY 57 N -1.08 0.48 0.26 -2.22 0.00 -1.26 -4.93 105.19 96.43 2flm n GLY 57 Ca -0.04 -0.62 -0.07 0.00 0.00 0.00 0.00 46.02 45.29 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 0.73 -8.13 0.99 3.38 -1.87 -3.48 115.31 106.92 2flm h LEU 58 Ca -0.17 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.44 2flm h LEU 58 Cb 0.84 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2flm h LEU 58 CO 0.22 0.94 0.17 0.28 0.09 0.00 0.00 178.44 180.14 2flm s THR 59 N -4.57 0.00 0.24 0.22 -1.32 -1.26 -4.76 115.64 104.18 2flm s THR 59 Ca -0.09 -1.14 0.10 0.00 -1.21 0.00 0.00 61.69 59.35 2flm s THR 59 Cb 0.13 -2.92 -0.05 0.00 -1.51 0.00 0.00 72.50 68.15 2flm s THR 59 CO 0.83 0.00 -0.18 0.42 -2.21 0.00 0.00 174.62 173.47 2flm s THR 60 N -2.29 2.17 0.22 5.08 -4.23 -1.26 -4.65 115.64 110.68 2flm s THR 60 Ca 0.20 -2.27 -0.07 0.00 -1.18 0.00 0.00 61.69 58.36 2flm s THR 60 Cb -0.04 -2.16 0.17 0.00 1.34 0.00 0.00 72.50 71.81 2flm s THR 60 CO 0.14 -0.43 1.76 1.05 -0.54 0.00 0.00 174.62 176.60 2flm h GLU 61 N 2.53 0.51 -0.64 3.99 -0.00 -2.00 -0.25 114.58 118.71 2flm h GLU 61 Ca -0.40 -0.03 -0.07 0.00 -0.00 0.00 0.00 59.36 58.86 2flm h GLU 61 Cb 1.24 -0.11 -0.03 0.00 -0.00 0.00 0.00 28.75 29.85 2flm h GLU 61 CO 0.59 0.34 0.12 0.93 -0.00 0.00 0.00 179.01 180.99 2flm h GLU 62 N 0.52 1.04 0.00 1.06 5.08 -2.04 -3.12 114.58 117.12 2flm h GLU 62 Ca 0.35 -0.26 -0.13 0.00 -1.00 0.00 0.00 59.36 58.32 2flm h GLU 62 Cb 0.41 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2flm h GLU 62 CO -0.30 0.94 -0.64 1.49 -1.00 0.00 0.00 179.01 179.50 2flm h GLU 63 N 0.98 0.00 -4.24 2.33 4.81 -1.83 -3.39 114.58 113.25 2flm h GLU 63 Ca 0.20 0.00 -0.74 0.00 -0.13 0.00 0.00 59.36 58.69 2flm h GLU 63 Cb 0.39 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 29.63 2flm h GLU 63 CO 0.01 0.64 1.91 0.34 -0.73 0.00 0.00 179.01 181.17 2flm n PHE 64 N -3.32 3.91 -2.19 0.92 7.35 -0.15 -4.95 117.46 119.02 2flm n PHE 64 Ca 0.01 -3.02 -0.27 0.00 -0.76 0.00 0.00 57.45 53.40 2flm n PHE 64 Cb 0.76 -2.16 0.15 0.00 0.35 0.00 0.00 39.48 38.58 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 1.46 2.06 0.45 -2.13 -7.23 -1.26 -4.93 120.40 108.81 2flm s VAL 65 Ca 0.43 -0.24 -0.25 0.00 -1.81 0.00 0.00 61.98 60.11 2flm s VAL 65 Cb 0.05 -2.82 -0.09 0.00 0.56 0.00 0.00 36.38 34.08 2flm s VAL 65 CO 0.00 0.00 1.33 1.21 -0.31 0.00 0.00 175.10 177.33 2flm n GLU 66 N -3.38 1.98 -3.57 4.82 0.00 -1.26 -4.81 120.64 114.43 2flm n GLU 66 Ca 0.15 0.71 0.00 0.00 0.00 0.00 0.00 57.16 58.02 2flm n GLU 66 Cb 0.60 -2.48 0.00 0.00 0.00 0.00 0.00 31.44 29.56 2flm n GLU 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2flm n GLY 67 N 0.74 -2.03 3.61 8.31 0.00 -1.11 -5.00 105.19 109.71 2flm n GLY 67 Ca 0.07 -1.17 -0.38 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.14 5.31 0.03 -0.61 1.01 -1.26 -0.46 121.20 123.07 2flm s ILE 68 Ca 0.00 0.23 0.04 0.00 0.00 0.00 0.00 60.65 60.92 2flm s ILE 68 Cb 0.00 -3.55 -0.03 0.00 0.01 0.00 0.00 42.46 38.89 2flm s ILE 68 CO 0.00 0.27 -0.08 -0.31 0.00 0.00 0.00 174.94 174.82 2flm s TYR 69 N 1.60 2.84 -0.20 3.97 1.51 0.17 -0.33 117.35 126.90 2flm s TYR 69 Ca 0.08 -0.08 -0.00 0.00 -1.01 0.00 0.00 57.07 56.06 2flm s TYR 69 Cb -0.15 -1.56 0.01 0.00 -0.11 0.00 0.00 41.96 40.15 2flm s TYR 69 CO 0.09 0.37 -0.14 0.21 -1.11 0.00 0.00 175.55 174.97 2flm s LYS 70 N -1.59 3.06 -0.36 -0.62 2.20 0.02 -1.15 119.74 121.29 2flm s LYS 70 Ca 0.18 -0.80 -0.13 0.00 -0.36 0.00 0.00 55.97 54.86 2flm s LYS 70 Cb -0.11 -2.73 0.01 0.00 -1.51 0.00 0.00 37.83 33.49 2flm s LYS 70 CO 0.09 -0.23 0.24 0.08 -0.36 0.00 0.00 175.35 175.16 2flm s VAL 71 N 1.34 5.01 -0.25 4.02 1.01 0.40 -0.55 120.40 131.39 2flm s VAL 71 Ca 0.04 -0.53 -0.09 0.00 0.00 0.00 0.00 61.98 61.40 2flm s VAL 71 Cb -0.14 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 2flm s VAL 71 CO -0.10 -0.14 0.13 -0.70 0.00 0.00 0.00 175.10 174.30 2flm s GLU 72 N 1.66 3.92 -0.26 2.72 2.12 0.68 -0.75 118.70 128.79 2flm s GLU 72 Ca 0.05 -0.34 -0.06 0.00 0.36 0.00 0.00 54.97 54.97 2flm s GLU 72 Cb -0.18 -3.48 -0.01 0.00 0.26 0.00 0.00 34.13 30.72 2flm s GLU 72 CO 0.09 -0.04 0.05 0.42 -0.54 0.00 0.00 175.26 175.24 2flm s ILE 73 N 1.30 3.94 -1.36 -3.70 1.01 0.24 -1.10 121.20 121.53 2flm s ILE 73 Ca 0.06 -0.49 -0.14 0.00 0.00 0.00 0.00 60.65 60.09 2flm s ILE 73 Cb -0.14 -2.92 0.09 0.00 0.01 0.00 0.00 42.46 39.49 2flm s ILE 73 CO 0.06 0.23 1.96 0.47 0.00 0.00 0.00 174.94 177.66 2flm n ASP 74 N 4.87 4.53 0.04 3.58 10.43 0.24 -1.25 116.55 138.98 2flm n ASP 74 Ca -0.16 -2.94 -0.07 0.00 2.57 0.00 0.00 54.79 54.19 2flm n ASP 74 Cb 0.50 -1.63 0.09 0.00 1.84 0.00 0.00 41.12 41.92 2flm n ASP 74 CO 0.00 0.00 0.00 0.71 -1.07 0.00 0.00 177.20 176.84 2flm h THR 75 N 4.34 1.34 -0.46 -3.53 1.35 -1.86 -2.47 112.91 111.63 2flm h THR 75 Ca 0.48 -1.83 -0.01 0.00 -0.55 0.00 0.00 66.41 64.50 2flm h THR 75 Cb 0.71 1.84 -0.02 0.00 -1.73 0.00 0.00 68.15 68.95 2flm h THR 75 CO 1.67 0.56 0.26 0.50 -0.25 0.00 0.00 175.52 178.25 2flm h LYS 76 N 0.32 0.63 -0.27 4.72 3.64 -1.72 -1.08 116.57 122.80 2flm h LYS 76 Ca 0.00 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 59.20 2flm h LYS 76 Cb 1.07 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 2flm h LYS 76 CO 0.10 0.48 -0.31 0.77 -2.27 0.00 0.00 179.45 178.22 2flm h SER 77 N 0.60 0.58 0.12 4.20 0.02 -1.79 -0.34 113.55 116.94 2flm h SER 77 Ca 0.16 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 2flm h SER 77 Cb 0.03 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 2flm h SER 77 CO -0.03 0.86 -0.10 0.22 -1.14 0.00 0.00 176.83 176.64 2flm h TYR 78 N 0.49 -0.26 -0.37 3.45 3.20 -1.03 0.16 116.97 122.61 2flm h TYR 78 Ca 0.06 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.80 2flm h TYR 78 Cb 0.77 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.13 2flm h TYR 78 CO 0.03 -0.16 -0.30 -1.49 -1.64 0.00 0.00 178.16 174.60 2flm h TRP 79 N -0.23 0.93 -0.00 -3.82 4.06 -0.98 -2.97 115.95 112.94 2flm h TRP 79 Ca -0.00 -0.24 -0.12 0.00 2.06 0.00 0.00 58.89 60.58 2flm h TRP 79 Cb 0.21 -0.21 -0.02 0.00 -1.00 0.00 0.00 29.16 28.15 2flm h TRP 79 CO -0.10 1.00 -0.59 0.87 -3.56 0.00 0.00 178.44 176.06 2flm h LYS 80 N 0.68 0.00 0.00 0.49 1.57 -0.86 0.95 116.57 119.40 2flm h LYS 80 Ca 0.08 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 2flm h LYS 80 Cb 0.84 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.15 2flm h LYS 80 CO 0.07 0.59 -0.17 0.00 -0.57 0.00 0.00 179.45 179.38 2flm h ALA 81 N 1.41 1.12 -0.26 3.86 0.00 -0.54 -0.02 119.26 124.82 2flm h ALA 81 Ca -0.01 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2flm h ALA 81 Cb 1.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2flm h ALA 81 CO 0.08 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.81 2flm n LEU 82 N -3.46 2.18 -0.84 0.00 4.77 -0.95 -4.93 117.00 113.77 2flm n LEU 82 Ca -0.01 -0.95 -0.08 0.00 -0.03 0.00 0.00 56.01 54.94 2flm n LEU 82 Cb 0.34 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 2flm n LEU 82 CO 0.31 0.48 -0.10 0.61 -1.33 0.00 0.00 177.39 177.36 2flm n GLY 83 N 1.22 0.39 3.45 -0.72 0.00 -0.02 -5.04 105.19 104.48 2flm n GLY 83 Ca 0.16 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.38 2.87 -0.60 -0.61 1.01 0.29 -4.98 121.20 116.80 2flm s ILE 84 Ca 0.00 -0.94 -0.20 0.00 0.00 0.00 0.00 60.65 59.51 2flm s ILE 84 Cb 0.00 -2.15 0.10 0.00 0.01 0.00 0.00 42.46 40.42 2flm s ILE 84 CO 0.00 0.49 0.75 -0.44 0.00 0.00 0.00 174.94 175.74 2flm s SER 85 N -1.01 6.18 0.58 3.58 0.01 -1.26 -3.14 113.70 118.64 2flm s SER 85 Ca 0.13 -1.33 0.05 0.00 1.31 0.00 0.00 55.95 56.11 2flm s SER 85 Cb -0.11 -2.32 0.07 0.00 0.21 0.00 0.00 66.02 63.87 2flm s SER 85 CO 0.02 -1.17 0.80 -2.16 0.41 0.00 0.00 173.24 171.14 2flm s PRO 86 N 2.95 2.29 -0.11 12.44 0.04 -1.26 -5.01 135.00 146.33 2flm s PRO 86 Ca 0.14 -1.29 -0.23 0.00 0.04 0.00 0.00 61.00 59.66 2flm s PRO 86 Cb -0.23 -2.56 -0.20 0.00 0.04 0.00 0.00 34.50 31.55 2flm s PRO 86 CO 0.07 -0.87 0.71 0.35 0.04 0.00 0.00 177.00 177.30 2flm h PHE 87 N 0.07 -0.03 -3.58 0.56 3.04 -1.36 -3.48 116.94 112.17 2flm h PHE 87 Ca -0.35 -0.00 -0.50 0.00 3.98 0.00 0.00 57.97 61.09 2flm h PHE 87 Cb 1.28 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.80 2flm h PHE 87 CO 0.25 0.68 0.04 -1.01 -2.02 0.00 0.00 178.31 176.25 2flm s HIS 88 N -2.50 3.45 0.09 0.41 0.09 -1.26 -4.99 115.29 110.58 2flm s HIS 88 Ca -0.15 0.98 -0.10 0.00 -0.00 0.00 0.00 55.06 55.79 2flm s HIS 88 Cb -0.02 -2.38 -0.19 0.00 -0.00 0.00 0.00 32.58 30.00 2flm s HIS 88 CO 0.55 0.01 1.22 0.93 -0.00 0.00 0.00 174.74 177.45 2flm h GLU 89 N 1.61 0.57 0.00 1.40 4.39 -1.98 -3.37 114.58 117.20 2flm h GLU 89 Ca -0.47 -0.64 0.21 0.00 0.34 0.00 0.00 59.36 58.79 2flm h GLU 89 Cb 1.18 0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 29.99 2flm h GLU 89 CO 0.65 1.25 0.66 -2.39 -1.16 0.00 0.00 179.01 178.02 2flm n HIS 90 N -3.79 -1.05 -4.94 4.33 1.44 -1.26 -3.22 115.22 106.72 2flm n HIS 90 Ca -0.10 -1.07 -0.31 0.00 -2.01 0.00 0.00 57.72 54.23 2flm n HIS 90 Cb 0.89 0.51 -0.14 0.00 0.12 0.00 0.00 29.99 31.37 2flm n HIS 90 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2flm s ALA 91 N -1.99 2.46 -0.01 1.59 0.00 -0.38 -4.89 121.76 118.54 2flm s ALA 91 Ca 0.24 -1.11 0.03 0.00 0.00 0.00 0.00 51.96 51.12 2flm s ALA 91 Cb -0.02 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 2flm s ALA 91 CO 0.04 0.55 -0.09 -2.00 0.00 0.00 0.00 175.76 174.25 2flm s GLU 92 N -0.97 0.76 -0.13 0.00 2.56 -1.26 -0.59 118.70 119.07 2flm s GLU 92 Ca 0.12 -0.33 -0.03 0.00 0.00 0.00 0.00 54.97 54.73 2flm s GLU 92 Cb -0.10 -0.74 0.05 0.00 2.00 0.00 0.00 34.13 35.34 2flm s GLU 92 CO 0.02 0.20 0.03 0.08 -0.56 0.00 0.00 175.26 175.03 2flm s VAL 93 N -0.20 0.32 -0.12 3.70 1.01 0.07 -4.96 120.40 120.22 2flm s VAL 93 Ca 0.03 -0.16 0.03 0.00 0.00 0.00 0.00 61.98 61.88 2flm s VAL 93 Cb -0.04 -0.70 0.01 0.00 0.00 0.00 0.00 36.38 35.65 2flm s VAL 93 CO -0.00 -0.01 -0.22 -0.69 0.00 0.00 0.00 175.10 174.17 2flm s VAL 94 N 1.97 2.00 0.00 2.92 1.01 -1.26 -0.45 120.40 126.60 2flm s VAL 94 Ca 0.02 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 60.83 2flm s VAL 94 Cb -0.15 -1.76 0.04 0.00 0.00 0.00 0.00 36.38 34.52 2flm s VAL 94 CO -0.07 0.54 0.47 0.72 0.00 0.00 0.00 175.10 176.76 2flm s PHE 95 N 0.66 -0.36 0.07 5.22 -0.71 -0.30 -4.99 117.98 117.56 2flm s PHE 95 Ca -0.11 0.51 -0.29 0.00 -1.04 0.00 0.00 56.93 56.00 2flm s PHE 95 Cb -0.16 0.25 -0.05 0.00 -1.21 0.00 0.00 43.02 41.84 2flm s PHE 95 CO 0.02 -0.53 0.91 0.99 -1.34 0.00 0.00 175.22 175.27 2flm s THR 96 N -1.75 4.63 0.07 -4.49 2.01 -1.26 -0.66 115.64 114.19 2flm s THR 96 Ca -0.10 1.96 0.08 0.00 0.31 0.00 0.00 61.69 63.94 2flm s THR 96 Cb -0.02 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.19 2flm s THR 96 CO 0.03 0.30 -0.21 0.00 -0.69 0.00 0.00 174.62 174.05 2flm s ALA 97 N 0.18 1.78 -1.87 7.40 0.00 0.39 -4.82 121.76 124.82 2flm s ALA 97 Ca 0.46 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 51.27 2flm s ALA 97 Cb -0.22 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.60 2flm s ALA 97 CO 0.28 0.38 0.00 0.09 0.00 0.00 0.00 175.76 176.50 2flm n ASN 98 N 1.49 -5.18 0.05 0.00 3.02 -1.26 -2.73 115.26 110.65 2flm n ASN 98 Ca -0.18 0.39 0.12 0.00 -0.03 0.00 0.00 54.58 54.87 2flm n ASN 98 Cb 0.53 -4.27 0.48 0.00 -0.61 0.00 0.00 39.78 35.92 2flm n ASN 98 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2flm n ASP 99 N -0.98 0.33 -1.71 6.41 4.64 -1.26 -2.94 116.55 121.04 2flm n ASP 99 Ca -0.18 0.55 -0.17 0.00 -1.38 0.00 0.00 54.79 53.60 2flm n ASP 99 Cb 0.60 -0.63 0.06 0.00 -1.04 0.00 0.00 41.12 40.11 2flm n ASP 99 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 2flm n SER 100 N -1.83 4.23 0.00 1.67 7.64 -1.26 -5.10 113.62 118.97 2flm n SER 100 Ca 0.05 -3.78 0.00 0.00 1.01 0.00 0.00 58.87 56.15 2flm n SER 100 Cb 0.31 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.13 2flm n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2flm n GLY 101 N -0.80 -0.33 3.75 0.23 0.00 -1.15 -4.97 105.19 101.93 2flm n GLY 101 Ca 0.39 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 2flm n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2flm s PRO 102 N -1.99 4.14 0.24 1.61 0.04 -1.26 -4.29 135.00 133.48 2flm s PRO 102 Ca 0.00 2.55 0.02 0.00 0.04 0.00 0.00 61.00 63.61 2flm s PRO 102 Cb 0.00 -3.02 -0.05 0.00 0.04 0.00 0.00 34.50 31.47 2flm s PRO 102 CO 0.00 -0.59 0.04 1.03 0.04 0.00 0.00 177.00 177.52 2flm s ARG 103 N -0.76 1.35 -0.15 4.56 1.81 -1.26 -4.88 118.95 119.62 2flm s ARG 103 Ca 0.61 -1.71 -0.04 0.00 -1.72 0.00 0.00 55.73 52.87 2flm s ARG 103 Cb -0.47 -0.43 -0.03 0.00 -0.45 0.00 0.00 34.95 33.57 2flm s ARG 103 CO 0.50 -0.19 -0.02 1.03 -0.68 0.00 0.00 175.30 175.93 2flm s ARG 104 N -3.95 3.65 -0.12 3.54 0.52 -0.02 -4.85 118.95 117.73 2flm s ARG 104 Ca 0.32 -0.49 0.03 0.00 -0.52 0.00 0.00 55.73 55.07 2flm s ARG 104 Cb 0.07 -2.93 0.00 0.00 0.52 0.00 0.00 34.95 32.61 2flm s ARG 104 CO 0.10 0.29 -0.22 0.71 0.02 0.00 0.00 175.30 176.20 2flm s TYR 105 N 0.25 2.62 -0.12 -0.53 1.51 -0.03 -1.09 117.35 119.96 2flm s TYR 105 Ca -0.02 -1.12 0.02 0.00 -1.01 0.00 0.00 57.07 54.94 2flm s TYR 105 Cb -0.14 -1.76 -0.00 0.00 -0.11 0.00 0.00 41.96 39.95 2flm s TYR 105 CO 0.03 -0.47 -0.20 0.99 -1.11 0.00 0.00 175.55 174.79 2flm s THR 106 N 0.51 2.41 -0.31 -0.71 2.01 0.18 -0.85 115.64 118.89 2flm s THR 106 Ca -0.14 -0.88 -0.09 0.00 0.31 0.00 0.00 61.69 60.88 2flm s THR 106 Cb -0.17 -1.97 -0.01 0.00 0.01 0.00 0.00 72.50 70.36 2flm s THR 106 CO 0.05 0.54 0.15 -0.63 -0.69 0.00 0.00 174.62 174.04 2flm s ILE 107 N 0.46 4.59 -0.12 1.82 -1.09 0.33 -1.15 121.20 126.04 2flm s ILE 107 Ca -0.14 -0.41 -0.03 0.00 -2.23 0.00 0.00 60.65 57.84 2flm s ILE 107 Cb -0.17 -3.33 -0.03 0.00 -1.58 0.00 0.00 42.46 37.35 2flm s ILE 107 CO 0.06 0.08 0.01 0.00 -1.23 0.00 0.00 174.94 173.85 2flm s ALA 108 N 1.61 3.26 0.04 9.38 0.00 -0.09 -0.98 121.76 134.97 2flm s ALA 108 Ca 0.05 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.24 2flm s ALA 108 Cb -0.17 -1.58 -0.02 0.00 0.00 0.00 0.00 23.12 21.35 2flm s ALA 108 CO 0.06 0.44 -0.09 0.00 0.00 0.00 0.00 175.76 176.17 2flm s ALA 109 N -0.41 0.69 -0.11 0.00 0.00 0.28 -0.76 121.76 121.45 2flm s ALA 109 Ca 0.08 -0.75 0.02 0.00 0.00 0.00 0.00 51.96 51.31 2flm s ALA 109 Cb -0.12 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2flm s ALA 109 CO 0.02 0.04 -0.16 -1.17 0.00 0.00 0.00 175.76 174.49 2flm s LEU 110 N -1.41 1.75 -0.09 0.00 2.96 -0.30 -0.92 118.68 120.66 2flm s LEU 110 Ca -0.07 -0.44 0.02 0.00 -0.22 0.00 0.00 54.13 53.43 2flm s LEU 110 Cb -0.09 -1.11 -0.02 0.00 0.50 0.00 0.00 46.19 45.47 2flm s LEU 110 CO 0.01 0.02 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.14 2flm s LEU 111 N 0.97 2.60 0.16 -0.68 1.43 -0.60 -1.39 118.68 121.17 2flm s LEU 111 Ca -0.07 -0.32 0.05 0.00 -1.03 0.00 0.00 54.13 52.76 2flm s LEU 111 Cb -0.15 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 2flm s LEU 111 CO -0.02 0.23 -0.10 -0.44 0.23 0.00 0.00 176.35 176.25 2flm s SER 112 N -0.06 1.87 0.47 2.29 0.01 0.00 -1.36 113.70 116.92 2flm s SER 112 Ca -0.03 -1.02 0.25 0.00 1.31 0.00 0.00 55.95 56.45 2flm s SER 112 Cb -0.14 -0.02 1.28 0.00 0.21 0.00 0.00 66.02 67.34 2flm s SER 112 CO 0.04 -0.32 1.84 -0.65 0.41 0.00 0.00 173.24 174.56 2flm h PRO 113 N 2.75 0.22 -0.09 12.44 0.11 -1.99 -2.61 132.00 142.82 2flm h PRO 113 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2flm h PRO 113 Cb 1.19 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2flm h PRO 113 CO 0.63 0.14 0.00 0.66 -0.21 0.00 0.00 178.00 179.23 2flm n TYR 114 N -4.42 0.19 -3.66 0.65 4.02 -1.26 -0.85 117.16 111.83 2flm n TYR 114 Ca 0.21 -0.69 -0.12 0.00 -0.01 0.00 0.00 57.90 57.29 2flm n TYR 114 Cb 0.90 -0.11 -0.08 0.00 -0.02 0.00 0.00 39.34 40.03 2flm n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2flm s SER 115 N -1.67 -0.70 0.12 7.72 0.15 -0.99 -5.00 113.70 113.34 2flm s SER 115 Ca 0.18 1.30 -0.05 0.00 0.70 0.00 0.00 55.95 58.09 2flm s SER 115 Cb 0.14 1.29 -0.02 0.00 -1.71 0.00 0.00 66.02 65.71 2flm s SER 115 CO 0.05 -0.22 0.13 -0.72 1.20 0.00 0.00 173.24 173.67 2flm s TYR 116 N 0.62 0.55 0.01 3.44 -0.85 -1.26 -0.82 117.35 119.04 2flm s TYR 116 Ca -0.02 -0.96 0.00 0.00 -0.52 0.00 0.00 57.07 55.57 2flm s TYR 116 Cb -0.05 -0.27 -0.01 0.00 0.38 0.00 0.00 41.96 42.01 2flm s TYR 116 CO -0.03 -0.56 -0.02 0.45 -1.52 0.00 0.00 175.55 173.87 2flm s SER 117 N -2.97 0.13 0.00 -0.18 0.15 -0.48 -4.98 113.70 105.37 2flm s SER 117 Ca 0.16 -0.23 0.03 0.00 0.70 0.00 0.00 55.95 56.61 2flm s SER 117 Cb 0.06 0.04 -0.01 0.00 -1.71 0.00 0.00 66.02 64.40 2flm s SER 117 CO -0.03 -0.13 -0.08 0.28 1.20 0.00 0.00 173.24 174.47 2flm s THR 118 N -0.66 0.66 0.07 6.45 -1.32 -1.26 -1.15 115.64 118.42 2flm s THR 118 Ca -0.07 -0.47 0.03 0.00 -1.21 0.00 0.00 61.69 59.97 2flm s THR 118 Cb -0.05 -0.58 -0.03 0.00 -1.51 0.00 0.00 72.50 70.34 2flm s THR 118 CO -0.00 0.11 -0.08 0.28 -2.21 0.00 0.00 174.62 172.71 2flm s THR 119 N -0.36 0.70 -0.09 5.08 -1.32 0.06 -4.99 115.64 114.73 2flm s THR 119 Ca 0.02 -1.42 0.01 0.00 -1.21 0.00 0.00 61.69 59.09 2flm s THR 119 Cb -0.04 -1.05 -0.02 0.00 -1.51 0.00 0.00 72.50 69.87 2flm s THR 119 CO -0.00 -0.52 -0.12 0.00 -2.21 0.00 0.00 174.62 171.76 2flm s ALA 120 N -2.13 2.72 -0.23 11.08 0.00 -1.26 -0.92 121.76 131.03 2flm s ALA 120 Ca -0.01 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 51.00 2flm s ALA 120 Cb -0.05 -1.14 0.01 0.00 0.00 0.00 0.00 23.12 21.94 2flm s ALA 120 CO -0.01 0.42 -0.06 0.08 0.00 0.00 0.00 175.76 176.19 2flm s VAL 121 N -0.25 3.08 -0.15 0.00 1.01 -0.30 -4.98 120.40 118.80 2flm s VAL 121 Ca 0.02 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.29 2flm s VAL 121 Cb -0.13 -2.45 0.01 0.00 0.00 0.00 0.00 36.38 33.81 2flm s VAL 121 CO 0.03 0.36 -0.19 -0.69 0.00 0.00 0.00 175.10 174.61 2flm s VAL 122 N 1.41 2.32 0.17 2.92 1.01 -1.26 -0.65 120.40 126.32 2flm s VAL 122 Ca 0.04 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.22 2flm s VAL 122 Cb -0.15 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 2flm s VAL 122 CO -0.05 0.53 -0.17 0.42 0.00 0.00 0.00 175.10 175.84 2flm s THR 123 N 0.91 1.73 -1.12 3.92 -4.23 -0.25 -4.98 115.64 111.63 2flm s THR 123 Ca -0.04 -1.95 0.09 0.00 -1.18 0.00 0.00 61.69 58.61 2flm s THR 123 Cb -0.15 -1.84 0.07 0.00 1.34 0.00 0.00 72.50 71.92 2flm s THR 123 CO -0.03 -0.39 0.78 -3.20 -0.54 0.00 0.00 174.62 171.25