#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fzu s VAL 2 N 0.00 2.76 -0.12 3.84 1.01 -1.26 -4.53 120.40 122.10 3fzu s VAL 2 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.65 3fzu s VAL 2 Cb 0.00 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 3fzu s VAL 2 CO 0.00 0.12 -0.12 -1.10 0.00 0.00 0.00 175.10 174.01 3fzu s GLN 3 N -0.81 3.26 -0.15 2.72 -0.21 0.37 -4.83 119.66 120.01 3fzu s GLN 3 Ca 0.55 -0.66 0.00 0.00 0.02 0.00 0.00 55.36 55.28 3fzu s GLN 3 Cb -0.40 -2.63 0.02 0.00 1.00 0.00 0.00 33.01 31.01 3fzu s GLN 3 CO 0.46 0.30 -0.13 -0.51 -2.12 0.00 0.00 175.29 173.29 3fzu s LEU 4 N 0.13 1.66 -0.27 2.90 1.43 -1.26 -2.25 118.68 121.02 3fzu s LEU 4 Ca -0.06 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 52.55 3fzu s LEU 4 Cb -0.15 -1.13 0.05 0.00 0.03 0.00 0.00 46.19 44.99 3fzu s LEU 4 CO 0.04 -0.08 -0.06 -0.69 0.23 0.00 0.00 176.35 175.79 3fzu s VAL 5 N 1.52 2.63 0.42 -1.59 1.01 -0.79 -4.07 120.40 119.52 3fzu s VAL 5 Ca 0.04 -1.36 -0.16 0.00 0.00 0.00 0.00 61.98 60.50 3fzu s VAL 5 Cb -0.13 -2.46 -0.09 0.00 0.00 0.00 0.00 36.38 33.70 3fzu s VAL 5 CO -0.10 0.03 0.87 -1.61 0.00 0.00 0.00 175.10 174.29 3fzu s GLU 6 N 1.22 4.01 0.18 2.72 8.01 -1.26 -1.91 118.70 131.66 3fzu s GLU 6 Ca -0.05 0.83 -0.04 0.00 0.01 0.00 0.00 54.97 55.73 3fzu s GLU 6 Cb -0.19 -2.28 -0.03 0.00 -4.31 0.00 0.00 34.13 27.33 3fzu s GLU 6 CO -0.04 -0.04 0.17 0.45 0.01 0.00 0.00 175.26 175.81 3fzu s SER 7 N -2.63 0.16 0.00 -0.19 0.15 -0.18 -4.92 113.70 106.08 3fzu s SER 7 Ca 0.57 -1.19 0.00 0.00 0.70 0.00 0.00 55.95 56.03 3fzu s SER 7 Cb -0.10 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 3fzu s SER 7 CO 0.23 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.43 3fzu n GLY 8 N -0.21 -2.94 1.59 9.45 0.00 -1.26 0.23 105.19 112.05 3fzu n GLY 8 Ca -0.02 -1.82 0.00 0.00 0.00 0.00 0.00 46.02 44.18 3fzu n GLY 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fzu n GLY 9 N -0.33 -0.19 0.00 -0.02 0.00 -1.26 -4.92 105.19 98.47 3fzu n GLY 9 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3fzu n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fzu n GLY 10 N 2.36 0.96 3.71 -0.02 0.00 -1.15 -4.92 105.19 106.13 3fzu n GLY 10 Ca 0.00 -1.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.04 3fzu n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3fzu s LEU 11 N 0.00 3.67 -0.22 0.99 2.96 -1.26 -1.08 118.68 123.73 3fzu s LEU 11 Ca 0.00 0.13 -0.16 0.00 -0.22 0.00 0.00 54.13 53.88 3fzu s LEU 11 Cb 0.00 -1.97 0.06 0.00 0.50 0.00 0.00 46.19 44.78 3fzu s LEU 11 CO 0.00 0.34 0.56 0.00 -1.32 0.00 0.00 176.35 175.93 3fzu s ALA 12 N -1.00 -1.46 0.43 5.97 0.00 -0.18 -4.96 121.76 120.56 3fzu s ALA 12 Ca 0.17 1.85 -0.22 0.00 0.00 0.00 0.00 51.96 53.75 3fzu s ALA 12 Cb -0.12 -1.09 -0.09 0.00 0.00 0.00 0.00 23.12 21.82 3fzu s ALA 12 CO 0.07 -0.30 1.02 0.15 0.00 0.00 0.00 175.76 176.69 3fzu s LYS 13 N 1.04 4.09 0.26 0.00 1.02 -1.24 -0.83 119.74 124.07 3fzu s LYS 13 Ca -0.06 1.39 -0.30 0.00 0.02 0.00 0.00 55.97 57.01 3fzu s LYS 13 Cb -0.06 -2.35 -0.13 0.00 -0.52 0.00 0.00 37.83 34.77 3fzu s LYS 13 CO -0.10 -0.19 1.34 -2.30 -0.92 0.00 0.00 175.35 173.19 3fzu n PRO 14 N -0.41 1.95 0.00 -1.68 -0.02 -1.26 -0.25 135.00 133.33 3fzu n PRO 14 Ca 0.07 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 3fzu n PRO 14 Cb 0.51 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3fzu n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fzu n GLY 15 N 1.82 3.29 1.29 -1.23 0.00 0.19 -4.90 105.19 105.66 3fzu n GLY 15 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.03 3fzu n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fzu n GLY 16 N -1.91 -1.19 3.16 -0.02 0.00 0.66 -3.92 105.19 101.96 3fzu n GLY 16 Ca 0.00 -1.69 -0.17 0.00 0.00 0.00 0.00 46.02 44.15 3fzu n GLY 16 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3fzu s SER 17 N -2.62 1.57 0.28 1.61 0.01 -1.26 -0.70 113.70 112.59 3fzu s SER 17 Ca 0.25 -0.62 0.03 0.00 1.31 0.00 0.00 55.95 56.91 3fzu s SER 17 Cb -0.01 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.15 3fzu s SER 17 CO 0.18 -0.10 0.17 -0.76 0.41 0.00 0.00 173.24 173.13 3fzu s LEU 18 N -1.77 1.53 -0.03 2.44 1.43 -0.52 -4.99 118.68 116.77 3fzu s LEU 18 Ca -0.02 -1.53 0.02 0.00 -1.03 0.00 0.00 54.13 51.56 3fzu s LEU 18 Cb -0.10 0.30 0.01 0.00 0.03 0.00 0.00 46.19 46.44 3fzu s LEU 18 CO 0.02 -0.89 -0.06 -0.60 0.23 0.00 0.00 176.35 175.05 3fzu s ARG 19 N -3.87 0.83 0.09 1.70 3.52 -1.26 0.25 118.95 120.22 3fzu s ARG 19 Ca 0.38 -0.18 0.03 0.00 -0.13 0.00 0.00 55.73 55.82 3fzu s ARG 19 Cb 0.05 -0.80 -0.04 0.00 -1.56 0.00 0.00 34.95 32.60 3fzu s ARG 19 CO 0.17 0.01 0.14 -0.51 -0.81 0.00 0.00 175.30 174.30 3fzu s LEU 20 N 0.54 4.00 0.35 -0.88 1.43 0.03 -4.36 118.68 119.78 3fzu s LEU 20 Ca -0.07 0.06 0.04 0.00 -1.03 0.00 0.00 54.13 53.12 3fzu s LEU 20 Cb -0.11 -2.63 -0.06 0.00 0.03 0.00 0.00 46.19 43.42 3fzu s LEU 20 CO 0.00 0.14 0.06 -0.44 0.23 0.00 0.00 176.35 176.35 3fzu s SER 21 N -2.62 2.59 -0.28 2.29 0.01 0.14 -2.04 113.70 113.79 3fzu s SER 21 Ca 0.31 -1.43 -0.16 0.00 1.31 0.00 0.00 55.95 55.98 3fzu s SER 21 Cb -0.12 0.01 0.11 0.00 0.21 0.00 0.00 66.02 66.22 3fzu s SER 21 CO 0.24 -0.66 0.81 0.00 0.41 0.00 0.00 173.24 174.04 3fzu s ALA 23 N 1.46 3.35 0.16 0.00 0.00 -0.80 -1.50 121.76 124.43 3fzu s ALA 23 Ca -0.09 -0.77 0.11 0.00 0.00 0.00 0.00 51.96 51.21 3fzu s ALA 23 Cb -0.04 -1.65 -0.04 0.00 0.00 0.00 0.00 23.12 21.39 3fzu s ALA 23 CO -0.17 0.45 -0.25 0.00 0.00 0.00 0.00 175.76 175.79 3fzu s ALA 24 N -0.46 2.41 -0.21 0.00 0.00 -0.84 -1.89 121.76 120.77 3fzu s ALA 24 Ca 0.09 -1.55 -0.27 0.00 0.00 0.00 0.00 51.96 50.23 3fzu s ALA 24 Cb -0.12 -0.34 0.09 0.00 0.00 0.00 0.00 23.12 22.76 3fzu s ALA 24 CO 0.02 0.46 0.85 0.45 0.00 0.00 0.00 175.76 177.54 3fzu s SER 25 N -2.39 -0.58 0.00 0.00 0.15 -0.95 -4.89 113.70 105.03 3fzu s SER 25 Ca 0.17 0.95 0.00 0.00 0.70 0.00 0.00 55.95 57.78 3fzu s SER 25 Cb -0.09 0.91 0.00 0.00 -1.71 0.00 0.00 66.02 65.13 3fzu s SER 25 CO 0.08 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.82 3fzu n GLY 26 N 1.85 0.92 3.80 9.45 0.00 -1.26 -0.48 105.19 119.47 3fzu n GLY 26 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 3fzu n GLY 26 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fzu s PHE 27 N -2.00 3.30 0.08 1.61 0.40 -1.26 -4.15 117.98 115.96 3fzu s PHE 27 Ca 0.00 1.64 -0.27 0.00 -0.60 0.00 0.00 56.93 57.70 3fzu s PHE 27 Cb 0.00 -2.98 -0.16 0.00 0.51 0.00 0.00 43.02 40.38 3fzu s PHE 27 CO 0.00 -0.35 1.69 -0.09 0.70 0.00 0.00 175.22 177.17 3fzu h ARG 28 N 2.22 -0.38 0.00 0.44 2.43 -1.97 -3.44 114.38 113.67 3fzu h ARG 28 Ca -0.48 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.71 3fzu h ARG 28 Cb 1.20 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 3fzu h ARG 28 CO 0.62 -0.26 0.00 1.19 -1.51 0.00 0.00 179.97 180.01 3fzu n PHE 29 N -5.27 -3.18 -3.17 2.20 3.72 -1.26 -5.06 117.46 105.45 3fzu n PHE 29 Ca -0.10 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.00 3fzu n PHE 29 Cb 0.18 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.68 3fzu n PHE 29 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 3fzu s THR 30 N 0.49 4.87 0.41 4.37 -1.32 -1.26 -4.90 115.64 118.30 3fzu s THR 30 Ca 0.00 0.48 0.27 0.00 -1.21 0.00 0.00 61.69 61.23 3fzu s THR 30 Cb 0.00 -3.68 0.43 0.00 -1.51 0.00 0.00 72.50 67.74 3fzu s THR 30 CO 0.00 -0.30 1.59 0.15 -2.21 0.00 0.00 174.62 173.84 3fzu h PHE 31 N 1.85 0.66 0.00 9.09 3.57 -1.92 0.15 116.94 130.34 3fzu h PHE 31 Ca -0.47 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.06 3fzu h PHE 31 Cb 1.18 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.77 3fzu h PHE 31 CO 0.60 -0.35 0.00 0.27 -2.23 0.00 0.00 178.31 176.60 3fzu n ASN 32 N -4.97 0.00 -0.46 0.41 2.04 -1.26 -2.35 115.26 108.68 3fzu n ASN 32 Ca 0.39 -1.27 0.08 0.00 -0.44 0.00 0.00 54.58 53.33 3fzu n ASN 32 Cb 1.41 0.00 0.03 0.00 -2.53 0.00 0.00 39.78 38.69 3fzu n ASN 32 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 3fzu n ASN 33 N -0.54 1.87 -4.30 0.53 4.13 0.04 -4.61 115.26 112.38 3fzu n ASN 33 Ca 0.01 -1.43 -0.34 0.00 1.68 0.00 0.00 54.58 54.50 3fzu n ASN 33 Cb 0.01 0.27 -0.15 0.00 -1.54 0.00 0.00 39.78 38.37 3fzu n ASN 33 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 3fzu s TYR 34 N -1.58 2.85 0.69 3.10 1.51 -0.99 -4.91 117.35 118.03 3fzu s TYR 34 Ca 0.15 -0.95 -0.15 0.00 -1.01 0.00 0.00 57.07 55.11 3fzu s TYR 34 Cb 0.12 -1.96 0.02 0.00 -0.11 0.00 0.00 41.96 40.03 3fzu s TYR 34 CO 0.30 -0.46 1.14 0.71 -1.11 0.00 0.00 175.55 176.13 3fzu s TYR 35 N 0.96 2.41 0.07 2.71 4.12 -1.26 -4.30 117.35 122.06 3fzu s TYR 35 Ca -0.02 1.57 -0.04 0.00 0.02 0.00 0.00 57.07 58.61 3fzu s TYR 35 Cb -0.15 -3.27 -0.03 0.00 -1.52 0.00 0.00 41.96 36.99 3fzu s TYR 35 CO -0.01 -2.01 0.06 -1.64 0.02 0.00 0.00 175.55 171.97 3fzu s MET 36 N -4.04 0.74 0.05 -0.62 -1.94 -0.65 -4.62 119.30 108.21 3fzu s MET 36 Ca 0.69 -1.15 -0.04 0.00 -1.71 0.00 0.00 55.69 53.48 3fzu s MET 36 Cb -0.23 0.26 -0.02 0.00 2.01 0.00 0.00 34.83 36.85 3fzu s MET 36 CO 0.43 -0.19 0.07 -0.51 -0.01 0.00 0.00 175.02 174.81 3fzu s ASP 37 N -2.91 0.27 -0.03 3.03 1.11 -0.57 -0.96 116.67 116.61 3fzu s ASP 37 Ca 0.08 -0.72 0.07 0.00 0.18 0.00 0.00 52.55 52.16 3fzu s ASP 37 Cb 0.07 0.24 -0.02 0.00 1.07 0.00 0.00 42.92 44.28 3fzu s ASP 37 CO -0.09 -0.58 -0.25 0.26 1.18 0.00 0.00 175.17 175.68 3fzu s TRP 38 N -3.31 2.29 0.13 4.23 0.52 -0.27 -1.54 118.94 120.99 3fzu s TRP 38 Ca 0.01 -0.49 0.09 0.00 0.02 0.00 0.00 56.10 55.73 3fzu s TRP 38 Cb 0.03 -1.48 -0.04 0.00 -1.15 0.00 0.00 33.47 30.83 3fzu s TRP 38 CO -0.08 -0.08 -0.22 0.08 0.02 0.00 0.00 176.95 176.68 3fzu s VAL 39 N -0.50 1.90 0.18 4.03 1.01 0.18 -0.95 120.40 126.26 3fzu s VAL 39 Ca 0.07 -1.71 0.03 0.00 0.00 0.00 0.00 61.98 60.37 3fzu s VAL 39 Cb -0.11 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.48 3fzu s VAL 39 CO 0.00 -0.09 -0.03 0.00 0.00 0.00 0.00 175.10 174.98 3fzu s ARG 40 N -2.19 1.16 -0.20 2.72 1.70 0.70 -0.47 118.95 122.36 3fzu s ARG 40 Ca 0.11 -1.55 -0.04 0.00 -0.47 0.00 0.00 55.73 53.78 3fzu s ARG 40 Cb -0.09 -0.48 0.08 0.00 -0.57 0.00 0.00 34.95 33.89 3fzu s ARG 40 CO 0.06 -0.05 0.18 -1.14 -1.08 0.00 0.00 175.30 173.27 3fzu s GLN 41 N -3.84 0.16 0.65 3.89 0.74 -0.11 -0.63 119.66 120.50 3fzu s GLN 41 Ca 0.23 0.10 -0.14 0.00 0.05 0.00 0.00 55.36 55.60 3fzu s GLN 41 Cb 0.05 -1.38 -0.01 0.00 1.10 0.00 0.00 33.01 32.76 3fzu s GLN 41 CO 0.04 -0.67 1.07 0.00 -0.55 0.00 0.00 175.29 175.17 3fzu s ALA 42 N 2.27 2.66 0.06 1.58 0.00 -1.26 -1.54 121.76 125.53 3fzu s ALA 42 Ca 0.06 0.30 -0.31 0.00 0.00 0.00 0.00 51.96 52.01 3fzu s ALA 42 Cb -0.16 -3.23 -0.08 0.00 0.00 0.00 0.00 23.12 19.66 3fzu s ALA 42 CO -0.12 -1.06 1.67 -1.25 0.00 0.00 0.00 175.76 175.00 3fzu s PRO 43 N -4.44 4.19 0.00 0.00 0.04 -1.26 -1.39 135.00 132.14 3fzu s PRO 43 Ca 0.62 2.34 0.00 0.00 0.04 0.00 0.00 61.00 64.00 3fzu s PRO 43 Cb -0.16 -3.65 0.00 0.00 0.04 0.00 0.00 34.50 30.73 3fzu s PRO 43 CO 0.44 -0.75 0.00 0.41 0.04 0.00 0.00 177.00 177.14 3fzu n GLY 44 N 4.03 3.48 0.95 0.56 0.00 -1.26 -5.03 105.19 107.91 3fzu n GLY 44 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 3fzu n GLY 44 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3fzu n GLN 45 N -1.94 1.56 -0.40 1.61 1.13 -0.49 -5.15 117.38 113.71 3fzu n GLN 45 Ca 0.00 -0.97 0.00 0.00 -1.94 0.00 0.00 57.00 54.09 3fzu n GLN 45 Cb 0.00 0.29 0.00 0.00 0.11 0.00 0.00 30.24 30.64 3fzu n GLN 45 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3fzu n GLY 46 N 3.14 1.63 3.77 1.08 0.00 -1.26 -4.64 105.19 108.90 3fzu n GLY 46 Ca -0.05 -2.04 -0.39 0.00 0.00 0.00 0.00 46.02 43.55 3fzu n GLY 46 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fzu s LEU 47 N 0.00 4.49 -0.07 0.99 1.43 -1.26 -4.27 118.68 119.98 3fzu s LEU 47 Ca 0.00 1.92 -0.01 0.00 -1.03 0.00 0.00 54.13 55.01 3fzu s LEU 47 Cb 0.00 -3.81 0.03 0.00 0.03 0.00 0.00 46.19 42.43 3fzu s LEU 47 CO 0.00 0.02 -0.01 -0.70 0.23 0.00 0.00 176.35 175.89 3fzu s GLU 48 N -1.63 0.71 0.34 1.70 2.12 0.20 -4.98 118.70 117.16 3fzu s GLU 48 Ca 0.46 0.06 -0.27 0.00 0.36 0.00 0.00 54.97 55.58 3fzu s GLU 48 Cb -0.23 -1.01 -0.09 0.00 0.26 0.00 0.00 34.13 33.06 3fzu s GLU 48 CO 0.29 -0.28 1.12 -0.46 -0.54 0.00 0.00 175.26 175.39 3fzu s TRP 49 N 1.85 3.34 -0.07 5.30 -0.00 -1.26 -0.22 118.94 127.88 3fzu s TRP 49 Ca 0.03 1.63 -0.06 0.00 -0.00 0.00 0.00 56.10 57.70 3fzu s TRP 49 Cb -0.12 -3.30 -0.04 0.00 -0.00 0.00 0.00 33.47 30.01 3fzu s TRP 49 CO -0.05 -0.86 -0.14 0.28 -0.00 0.00 0.00 176.95 176.18 3fzu n VAL 50 N 0.57 0.96 -3.46 5.86 0.31 -0.12 -4.69 118.33 117.77 3fzu n VAL 50 Ca 0.02 0.06 -0.12 0.00 -0.01 0.00 0.00 64.34 64.29 3fzu n VAL 50 Cb 0.46 -1.77 -0.02 0.00 -0.91 0.00 0.00 33.84 31.60 3fzu n VAL 50 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3fzu s SER 51 N -5.99 -0.52 0.06 4.52 0.15 -1.01 -1.58 113.70 109.33 3fzu s SER 51 Ca -0.14 0.08 0.02 0.00 0.70 0.00 0.00 55.95 56.62 3fzu s SER 51 Cb 0.04 0.53 -0.03 0.00 -1.71 0.00 0.00 66.02 64.85 3fzu s SER 51 CO 0.19 -0.82 -0.08 -0.60 1.20 0.00 0.00 173.24 173.12 3fzu s ARG 52 N -3.26 0.66 0.03 5.44 3.52 -0.02 -1.11 118.95 124.21 3fzu s ARG 52 Ca 0.01 -0.96 0.02 0.00 -0.13 0.00 0.00 55.73 54.67 3fzu s ARG 52 Cb -0.01 -0.34 -0.02 0.00 -1.56 0.00 0.00 34.95 33.02 3fzu s ARG 52 CO -0.09 0.05 -0.08 -1.50 -0.81 0.00 0.00 175.30 172.87 3fzu s ILE 53 N -2.04 0.55 0.84 4.11 2.07 -0.14 -0.88 121.20 125.72 3fzu s ILE 53 Ca -0.02 -0.82 -0.11 0.00 -1.41 0.00 0.00 60.65 58.28 3fzu s ILE 53 Cb -0.05 -0.56 0.13 0.00 0.13 0.00 0.00 42.46 42.11 3fzu s ILE 53 CO -0.01 -0.21 1.19 -0.55 -1.91 0.00 0.00 174.94 173.45 3fzu s SER 54 N -1.12 3.94 0.24 4.50 0.15 -0.89 -1.64 113.70 118.88 3fzu s SER 54 Ca -0.06 0.35 -0.04 0.00 0.70 0.00 0.00 55.95 56.91 3fzu s SER 54 Cb -0.07 -0.67 0.44 0.00 -1.71 0.00 0.00 66.02 64.01 3fzu s SER 54 CO 0.00 -2.20 1.76 0.28 1.20 0.00 0.00 173.24 174.28 3fzu h SER 55 N -1.16 0.44 0.73 5.45 0.02 -1.85 -2.95 113.55 114.23 3fzu h SER 55 Ca -0.44 0.08 -0.25 0.00 -0.84 0.00 0.00 61.79 60.34 3fzu h SER 55 Cb 1.28 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.80 3fzu h SER 55 CO 0.50 0.21 -1.33 0.77 -1.14 0.00 0.00 176.83 175.83 3fzu h SER 56 N 0.57 0.07 0.00 3.07 4.64 -1.93 -3.44 113.55 116.54 3fzu h SER 56 Ca 0.41 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3fzu h SER 56 Cb 0.54 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3fzu h SER 56 CO -0.34 1.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.32 3fzu n GLY 57 N 1.48 1.04 3.15 -0.77 0.00 -1.11 -4.98 105.19 103.99 3fzu n GLY 57 Ca -0.09 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 3fzu n GLY 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3fzu s ASP 58 N -1.12 -0.28 0.67 1.61 2.15 -1.26 -4.61 116.67 113.84 3fzu s ASP 58 Ca 0.00 0.71 -0.01 0.00 0.43 0.00 0.00 52.55 53.67 3fzu s ASP 58 Cb 0.00 0.66 0.11 0.00 -0.30 0.00 0.00 42.92 43.38 3fzu s ASP 58 CO 0.00 -0.19 0.73 -2.65 -0.17 0.00 0.00 175.17 172.89 3fzu n PRO 59 N 4.48 -0.00 -4.33 4.34 -0.02 -1.26 -4.75 135.00 133.46 3fzu n PRO 59 Ca -0.21 -1.87 -0.20 0.00 -2.02 0.00 0.00 63.50 59.20 3fzu n PRO 59 Cb 0.53 -0.52 -0.13 0.00 -0.02 0.00 0.00 33.50 33.36 3fzu n PRO 59 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3fzu s THR 60 N -2.20 1.16 0.07 3.45 -4.23 -1.26 -2.10 115.64 110.53 3fzu s THR 60 Ca 0.47 -1.10 0.09 0.00 -1.18 0.00 0.00 61.69 59.97 3fzu s THR 60 Cb -0.03 -1.07 -0.03 0.00 1.34 0.00 0.00 72.50 72.72 3fzu s THR 60 CO 0.32 -0.04 -0.23 0.26 -0.54 0.00 0.00 174.62 174.39 3fzu s TRP 61 N -0.95 2.42 0.08 3.99 0.51 -0.06 -4.97 118.94 119.96 3fzu s TRP 61 Ca 0.01 -0.34 0.02 0.00 -2.12 0.00 0.00 56.10 53.67 3fzu s TRP 61 Cb -0.08 -1.39 -0.04 0.00 -0.81 0.00 0.00 33.47 31.15 3fzu s TRP 61 CO 0.02 0.23 -0.07 0.71 -0.51 0.00 0.00 176.95 177.33 3fzu s TYR 62 N -0.92 0.82 0.26 -1.98 2.02 -1.26 -0.85 117.35 115.44 3fzu s TYR 62 Ca 0.14 -0.76 -0.20 0.00 -0.37 0.00 0.00 57.07 55.88 3fzu s TYR 62 Cb -0.10 -0.48 -0.09 0.00 -0.40 0.00 0.00 41.96 40.89 3fzu s TYR 62 CO 0.05 -0.12 0.76 0.00 -1.57 0.00 0.00 175.55 174.67 3fzu s ALA 63 N -2.78 3.36 0.52 3.71 0.00 -0.61 -4.89 121.76 121.06 3fzu s ALA 63 Ca 0.04 0.20 0.20 0.00 0.00 0.00 0.00 51.96 52.39 3fzu s ALA 63 Cb -0.00 -2.87 1.30 0.00 0.00 0.00 0.00 23.12 21.55 3fzu s ALA 63 CO -0.03 0.30 2.07 -0.44 0.00 0.00 0.00 175.76 177.66 3fzu h ASP 64 N 3.13 0.04 -0.92 0.00 3.32 -1.94 0.75 116.42 120.80 3fzu h ASP 64 Ca -0.48 0.00 0.22 0.00 0.02 0.00 0.00 57.03 56.79 3fzu h ASP 64 Cb 1.19 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 40.66 3fzu h ASP 64 CO 0.65 0.02 0.61 -1.28 -1.72 0.00 0.00 179.24 177.53 3fzu h SER 65 N 0.04 0.37 0.00 6.45 0.87 -1.95 -3.16 113.55 116.17 3fzu h SER 65 Ca 0.14 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 3fzu h SER 65 Cb 0.50 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.43 3fzu h SER 65 CO -0.01 0.14 0.00 1.33 -0.53 0.00 0.00 176.83 177.76 3fzu n VAL 66 N -4.50 0.00 -1.83 2.23 0.24 0.17 -5.04 118.33 109.59 3fzu n VAL 66 Ca 0.20 -0.35 -0.41 0.00 -2.04 0.00 0.00 64.34 61.73 3fzu n VAL 66 Cb 0.75 1.29 -0.02 0.00 -1.47 0.00 0.00 33.84 34.39 3fzu n VAL 66 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3fzu s LYS 67 N -0.01 4.16 0.00 7.34 2.20 -0.65 -2.62 119.74 130.16 3fzu s LYS 67 Ca 0.00 2.51 0.00 0.00 -0.36 0.00 0.00 55.97 58.12 3fzu s LYS 67 Cb 0.00 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.28 3fzu s LYS 67 CO 0.00 -0.58 0.00 0.41 -0.36 0.00 0.00 175.35 174.82 3fzu n GLY 68 N 2.09 2.86 0.05 5.54 0.00 -1.26 -4.81 105.19 109.65 3fzu n GLY 68 Ca 0.07 -0.60 -0.04 0.00 0.00 0.00 0.00 46.02 45.46 3fzu n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fzu n ARG 69 N 0.00 2.20 -4.18 1.61 1.74 -1.08 -4.99 116.66 111.96 3fzu n ARG 69 Ca 0.00 -0.01 -0.31 0.00 -0.77 0.00 0.00 57.85 56.76 3fzu n ARG 69 Cb 0.00 -1.26 -0.08 0.00 -1.02 0.00 0.00 32.46 30.10 3fzu n ARG 69 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3fzu s PHE 70 N -2.28 3.01 -0.03 -1.55 0.40 -1.11 -0.72 117.98 115.70 3fzu s PHE 70 Ca -0.05 0.00 0.00 0.00 -0.60 0.00 0.00 56.93 56.29 3fzu s PHE 70 Cb 0.03 -1.58 0.03 0.00 0.51 0.00 0.00 43.02 42.01 3fzu s PHE 70 CO 0.42 0.47 -0.00 0.99 0.70 0.00 0.00 175.22 177.79 3fzu s THR 71 N -1.24 0.19 -0.04 0.64 2.01 0.18 -4.87 115.64 112.51 3fzu s THR 71 Ca 0.24 0.07 -0.07 0.00 0.31 0.00 0.00 61.69 62.23 3fzu s THR 71 Cb -0.12 -0.28 -0.05 0.00 0.01 0.00 0.00 72.50 72.06 3fzu s THR 71 CO 0.16 0.15 0.23 -0.51 -0.69 0.00 0.00 174.62 173.96 3fzu s ILE 72 N 0.99 5.35 0.20 1.82 2.07 -1.26 -1.00 121.20 129.37 3fzu s ILE 72 Ca -0.10 0.24 -0.01 0.00 -1.41 0.00 0.00 60.65 59.37 3fzu s ILE 72 Cb -0.14 -3.52 0.01 0.00 0.13 0.00 0.00 42.46 38.94 3fzu s ILE 72 CO -0.02 0.48 0.29 -1.54 -1.91 0.00 0.00 174.94 172.24 3fzu n SER 73 N 1.51 -0.80 -3.63 4.50 3.41 -0.98 -5.01 113.62 112.63 3fzu n SER 73 Ca -0.15 -2.07 -0.12 0.00 -0.26 0.00 0.00 58.87 56.27 3fzu n SER 73 Cb 0.54 1.48 -0.07 0.00 -0.26 0.00 0.00 64.21 65.90 3fzu n SER 73 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 3fzu s ARG 74 N -2.43 0.71 -0.33 4.33 3.52 -1.26 -1.79 118.95 121.70 3fzu s ARG 74 Ca 0.16 0.80 0.00 0.00 -0.13 0.00 0.00 55.73 56.57 3fzu s ARG 74 Cb -0.01 0.35 0.10 0.00 -1.56 0.00 0.00 34.95 33.83 3fzu s ARG 74 CO 0.12 -0.09 0.11 -2.00 -0.81 0.00 0.00 175.30 172.62 3fzu s GLU 75 N 0.24 0.88 0.21 5.12 2.12 0.08 -4.98 118.70 122.36 3fzu s GLU 75 Ca 0.01 -1.28 -0.08 0.00 0.36 0.00 0.00 54.97 53.97 3fzu s GLU 75 Cb -0.05 -2.19 0.14 0.00 0.26 0.00 0.00 34.13 32.30 3fzu s GLU 75 CO -0.01 -1.00 1.76 -0.91 -0.54 0.00 0.00 175.26 174.56 3fzu h ASN 76 N 7.88 1.08 -0.39 -1.70 2.35 -1.94 0.32 115.58 123.18 3fzu h ASN 76 Ca -0.11 -0.19 0.11 0.00 -0.55 0.00 0.00 56.30 55.57 3fzu h ASN 76 Cb 1.01 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 39.08 3fzu h ASN 76 CO 0.48 0.98 0.59 0.00 -1.65 0.00 0.00 177.43 177.83 3fzu h ALA 77 N 1.15 2.06 0.00 -0.83 0.00 -1.96 -1.95 119.26 117.73 3fzu h ALA 77 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3fzu h ALA 77 Cb 0.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3fzu h ALA 77 CO -0.02 -0.79 0.00 1.63 0.00 0.00 0.00 179.25 180.08 3fzu n LYS 78 N -3.34 2.14 -3.75 0.00 5.02 -0.06 -5.00 118.16 113.17 3fzu n LYS 78 Ca 0.07 -1.22 -0.26 0.00 -2.02 0.00 0.00 58.31 54.88 3fzu n LYS 78 Cb 0.74 -0.88 0.05 0.00 -0.02 0.00 0.00 35.03 34.93 3fzu n LYS 78 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3fzu n ASN 79 N -0.36 -5.13 -4.16 4.39 5.03 -0.26 -4.84 115.26 109.93 3fzu n ASN 79 Ca 0.00 -0.67 -0.20 0.00 0.87 0.00 0.00 54.58 54.57 3fzu n ASN 79 Cb 0.30 -4.44 -0.13 0.00 -1.02 0.00 0.00 39.78 34.49 3fzu n ASN 79 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3fzu s THR 80 N -3.33 1.16 -0.00 3.41 2.01 -1.06 -1.98 115.64 115.84 3fzu s THR 80 Ca 0.56 -1.06 0.07 0.00 0.31 0.00 0.00 61.69 61.58 3fzu s THR 80 Cb -0.27 -1.06 -0.02 0.00 0.01 0.00 0.00 72.50 71.17 3fzu s THR 80 CO 0.78 -0.00 -0.22 -0.22 -0.69 0.00 0.00 174.62 174.27 3fzu s LEU 81 N -1.22 2.07 0.15 4.42 2.96 -0.56 -0.74 118.68 125.77 3fzu s LEU 81 Ca 0.02 -0.43 0.06 0.00 -0.22 0.00 0.00 54.13 53.56 3fzu s LEU 81 Cb -0.08 -1.10 -0.04 0.00 0.50 0.00 0.00 46.19 45.47 3fzu s LEU 81 CO 0.01 0.25 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.80 3fzu s PHE 82 N -0.58 1.48 -0.22 5.38 0.08 -0.74 -1.48 117.98 121.90 3fzu s PHE 82 Ca 0.08 -0.61 -0.04 0.00 0.12 0.00 0.00 56.93 56.49 3fzu s PHE 82 Cb -0.09 -0.74 0.07 0.00 -0.57 0.00 0.00 43.02 41.70 3fzu s PHE 82 CO -0.00 0.20 0.09 -1.17 -0.10 0.00 0.00 175.22 174.24 3fzu s LEU 83 N -2.88 0.74 -0.15 -0.37 2.96 -0.86 -2.32 118.68 115.79 3fzu s LEU 83 Ca 0.15 -0.93 -0.23 0.00 -0.22 0.00 0.00 54.13 52.90 3fzu s LEU 83 Cb -0.02 -0.40 -0.02 0.00 0.50 0.00 0.00 46.19 46.25 3fzu s LEU 83 CO 0.04 -0.37 0.72 -1.58 -1.32 0.00 0.00 176.35 173.84 3fzu s GLN 84 N 2.02 4.30 -0.32 1.98 2.00 -0.17 -0.79 119.66 128.69 3fzu s GLN 84 Ca 0.04 0.84 0.02 0.00 -2.00 0.00 0.00 55.36 54.26 3fzu s GLN 84 Cb -0.16 -3.54 0.08 0.00 0.80 0.00 0.00 33.01 30.19 3fzu s GLN 84 CO -0.18 -0.19 0.01 -1.64 -0.50 0.00 0.00 175.29 172.80 3fzu s MET 85 N 1.69 1.86 0.30 1.67 -1.94 0.14 -0.65 119.30 122.37 3fzu s MET 85 Ca 0.35 -1.66 0.06 0.00 -1.71 0.00 0.00 55.69 52.73 3fzu s MET 85 Cb -0.17 -3.15 -0.02 0.00 2.01 0.00 0.00 34.83 33.50 3fzu s MET 85 CO 0.13 -0.81 0.37 -0.80 -0.01 0.00 0.00 175.02 173.90 3fzu s ASN 86 N 1.10 5.86 -1.32 3.03 0.01 0.11 -1.44 114.94 122.28 3fzu s ASN 86 Ca 0.03 -0.20 -0.05 0.00 -0.71 0.00 0.00 52.86 51.94 3fzu s ASN 86 Cb -0.20 -1.35 0.02 0.00 0.41 0.00 0.00 41.25 40.13 3fzu s ASN 86 CO -0.06 -0.28 0.97 -1.20 -1.51 0.00 0.00 177.10 175.01 3fzu n SER 87 N -1.48 -3.38 -4.61 -1.22 7.64 -1.08 -4.50 113.62 105.00 3fzu n SER 87 Ca -0.03 -0.68 -0.35 0.00 1.01 0.00 0.00 58.87 58.82 3fzu n SER 87 Cb 0.58 -4.62 0.10 0.00 -1.01 0.00 0.00 64.21 59.26 3fzu n SER 87 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3fzu n LEU 88 N -4.48 3.26 -3.79 -3.43 4.77 0.13 -4.52 117.00 108.93 3fzu n LEU 88 Ca -0.16 0.60 -0.13 0.00 -0.03 0.00 0.00 56.01 56.30 3fzu n LEU 88 Cb 0.62 -1.41 -0.11 0.00 -2.33 0.00 0.00 43.42 40.20 3fzu n LEU 88 CO 0.66 -2.15 -0.07 -0.60 -1.33 0.00 0.00 177.39 173.90 3fzu s ARG 89 N -3.58 0.42 0.22 3.23 3.52 -1.26 -0.63 118.95 120.87 3fzu s ARG 89 Ca 0.71 0.09 -0.08 0.00 -0.13 0.00 0.00 55.73 56.33 3fzu s ARG 89 Cb -0.32 0.19 0.34 0.00 -1.56 0.00 0.00 34.95 33.61 3fzu s ARG 89 CO 0.53 -0.08 1.25 0.00 -0.81 0.00 0.00 175.30 176.18 3fzu n ALA 90 N 2.28 0.14 0.02 6.12 0.00 -1.26 0.64 120.51 128.46 3fzu n ALA 90 Ca -0.17 0.87 0.22 0.00 0.00 0.00 0.00 53.44 54.37 3fzu n ALA 90 Cb 0.57 -0.50 0.70 0.00 0.00 0.00 0.00 19.45 20.22 3fzu n ALA 90 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3fzu h GLU 91 N 0.00 0.00 0.00 0.00 3.07 -1.97 -0.60 114.58 115.09 3fzu h GLU 91 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 3fzu h GLU 91 Cb 0.57 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.48 3fzu h GLU 91 CO -0.82 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 176.54 3fzu n ASP 92 N -3.66 0.00 -4.59 1.42 8.00 0.21 -4.79 116.55 113.13 3fzu n ASP 92 Ca 0.11 0.17 -0.43 0.00 0.71 0.00 0.00 54.79 55.34 3fzu n ASP 92 Cb 0.80 -0.38 -0.03 0.00 -0.02 0.00 0.00 41.12 41.49 3fzu n ASP 92 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3fzu n THR 93 N -1.38 0.34 -3.76 -3.53 -1.04 -0.23 -4.89 114.28 99.79 3fzu n THR 93 Ca 0.10 -0.45 -0.06 0.00 -2.04 0.00 0.00 64.05 61.61 3fzu n THR 93 Cb 0.26 -2.52 -0.02 0.00 -1.82 0.00 0.00 70.33 66.23 3fzu n THR 93 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3fzu s ALA 94 N 8.21 -1.49 -0.12 2.41 0.00 -0.73 -4.40 121.76 125.65 3fzu s ALA 94 Ca 1.01 0.02 -0.19 0.00 0.00 0.00 0.00 51.96 52.80 3fzu s ALA 94 Cb -0.36 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.44 3fzu s ALA 94 CO 0.36 -1.01 0.53 0.08 0.00 0.00 0.00 175.76 175.72 3fzu s VAL 95 N -3.55 5.15 -0.27 0.00 1.01 -0.59 -0.63 120.40 121.51 3fzu s VAL 95 Ca 0.11 1.05 -0.07 0.00 0.00 0.00 0.00 61.98 63.07 3fzu s VAL 95 Cb -0.03 -3.87 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 3fzu s VAL 95 CO 0.03 0.29 0.06 -0.31 0.00 0.00 0.00 175.10 175.17 3fzu s TYR 96 N 0.81 3.11 -0.29 5.22 1.51 -0.48 -0.93 117.35 126.29 3fzu s TYR 96 Ca 0.28 -0.82 -0.15 0.00 -1.01 0.00 0.00 57.07 55.37 3fzu s TYR 96 Cb -0.16 -2.24 -0.03 0.00 -0.11 0.00 0.00 41.96 39.43 3fzu s TYR 96 CO 0.12 -0.51 0.39 0.71 -1.11 0.00 0.00 175.55 175.14 3fzu s TYR 97 N 1.53 3.23 0.05 2.71 1.51 0.37 -2.50 117.35 124.26 3fzu s TYR 97 Ca 0.04 0.31 -0.32 0.00 -1.01 0.00 0.00 57.07 56.09 3fzu s TYR 97 Cb -0.16 -2.63 -0.11 0.00 -0.11 0.00 0.00 41.96 38.95 3fzu s TYR 97 CO 0.02 -0.30 1.85 0.00 -1.11 0.00 0.00 175.55 176.01 3fzu s ALA 99 N 3.29 0.61 -0.37 0.00 0.00 -0.59 0.30 121.76 125.00 3fzu s ALA 99 Ca 0.86 -0.08 -0.12 0.00 0.00 0.00 0.00 51.96 52.63 3fzu s ALA 99 Cb -0.55 -0.35 0.02 0.00 0.00 0.00 0.00 23.12 22.25 3fzu s ALA 99 CO 0.42 0.02 0.22 0.45 0.00 0.00 0.00 175.76 176.88 3fzu s SER 100 N 0.68 5.82 0.00 0.00 0.15 0.33 -1.52 113.70 119.16 3fzu s SER 100 Ca -0.09 -0.89 0.14 0.00 0.70 0.00 0.00 55.95 55.82 3fzu s SER 100 Cb -0.12 -2.06 0.23 0.00 -1.71 0.00 0.00 66.02 62.37 3fzu s SER 100 CO 0.00 -0.37 1.12 0.18 1.20 0.00 0.00 173.24 175.37 3fzu n LEU 101 N 5.04 2.63 -4.73 3.45 4.77 -1.26 -1.24 117.00 125.65 3fzu n LEU 101 Ca -0.12 -1.42 -0.42 0.00 -0.03 0.00 0.00 56.01 54.02 3fzu n LEU 101 Cb 0.47 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 41.40 3fzu n LEU 101 CO 0.37 0.57 1.22 -0.89 -1.33 0.00 0.00 177.39 177.33 3fzu s THR 102 N -1.12 2.46 0.28 -5.08 2.01 -1.26 -4.88 115.64 108.05 3fzu s THR 102 Ca 0.22 0.35 -0.29 0.00 0.31 0.00 0.00 61.69 62.28 3fzu s THR 102 Cb 0.14 -3.23 -0.10 0.00 0.01 0.00 0.00 72.50 69.32 3fzu s THR 102 CO 0.19 0.04 1.18 0.42 -0.69 0.00 0.00 174.62 175.76 3fzu s THR 103 N 0.70 3.28 0.00 -0.82 -4.23 -1.26 0.30 115.64 113.61 3fzu s THR 103 Ca 0.67 1.24 0.00 0.00 -1.18 0.00 0.00 61.69 62.43 3fzu s THR 103 Cb -0.45 -3.79 0.00 0.00 1.34 0.00 0.00 72.50 69.60 3fzu s THR 103 CO 0.37 0.28 0.00 0.61 -0.54 0.00 0.00 174.62 175.34 3fzu n GLY 104 N 1.26 1.65 2.61 3.99 0.00 -1.26 -4.91 105.19 108.54 3fzu n GLY 104 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 3fzu n GLY 104 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3fzu n SER 105 N 0.00 1.59 -4.72 1.61 7.64 0.15 -5.07 113.62 114.82 3fzu n SER 105 Ca 0.00 -2.80 -0.41 0.00 1.01 0.00 0.00 58.87 56.67 3fzu n SER 105 Cb 0.00 -0.53 -0.04 0.00 -1.01 0.00 0.00 64.21 62.63 3fzu n SER 105 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3fzu s ASP 106 N -3.09 7.28 -0.08 6.43 -1.08 -1.24 -4.50 116.67 120.40 3fzu s ASP 106 Ca 0.29 1.54 -0.28 0.00 -0.52 0.00 0.00 52.55 53.59 3fzu s ASP 106 Cb 0.45 -2.53 0.06 0.00 -1.46 0.00 0.00 42.92 39.44 3fzu s ASP 106 CO 0.02 -0.18 0.63 -0.55 0.52 0.00 0.00 175.17 175.60 3fzu s SER 107 N 0.78 -0.61 -0.04 -0.34 0.15 -0.37 -4.76 113.70 108.51 3fzu s SER 107 Ca 0.47 0.74 0.04 0.00 0.70 0.00 0.00 55.95 57.90 3fzu s SER 107 Cb -0.20 0.64 -0.00 0.00 -1.71 0.00 0.00 66.02 64.74 3fzu s SER 107 CO 0.25 -0.53 -0.15 0.26 1.20 0.00 0.00 173.24 174.28 3fzu s TRP 108 N -0.97 1.46 1.35 3.44 0.52 -1.26 -0.51 118.94 122.97 3fzu s TRP 108 Ca -0.10 -0.39 -0.21 0.00 0.02 0.00 0.00 56.10 55.42 3fzu s TRP 108 Cb -0.01 -0.99 0.34 0.00 -1.15 0.00 0.00 33.47 31.66 3fzu s TRP 108 CO 0.08 -0.13 0.97 0.20 0.02 0.00 0.00 176.95 178.09 3fzu s GLY 109 N 0.05 1.46 0.13 0.98 0.00 0.15 -4.76 107.32 105.33 3fzu s GLY 109 Ca -0.03 -0.75 0.02 0.00 0.00 0.00 0.00 44.72 43.97 3fzu s GLY 109 CO 0.01 0.20 1.30 1.46 0.00 0.00 0.00 173.10 176.08 3fzu h GLN 110 N -3.18 0.16 0.00 2.90 4.20 -1.90 -3.46 115.11 113.83 3fzu h GLN 110 Ca -0.46 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.04 3fzu h GLN 110 Cb 1.33 0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.18 3fzu h GLN 110 CO 0.32 1.02 0.00 0.41 -0.67 0.00 0.00 178.83 179.91 3fzu n GLY 111 N 1.14 3.36 2.82 3.46 0.00 -1.26 -5.01 105.19 109.70 3fzu n GLY 111 Ca -0.04 -1.86 -0.15 0.00 0.00 0.00 0.00 46.02 43.98 3fzu n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fzu s VAL 112 N -2.53 0.05 0.18 1.61 0.11 -1.04 -4.89 120.40 113.88 3fzu s VAL 112 Ca 0.00 0.11 -0.30 0.00 -2.93 0.00 0.00 61.98 58.86 3fzu s VAL 112 Cb 0.00 -0.13 -0.08 0.00 -1.53 0.00 0.00 36.38 34.64 3fzu s VAL 112 CO 0.00 0.09 1.02 -0.22 -3.33 0.00 0.00 175.10 172.65 3fzu s LEU 113 N 0.76 4.54 -0.10 2.54 0.20 -1.26 -1.38 118.68 123.98 3fzu s LEU 113 Ca -0.07 1.98 0.02 0.00 0.69 0.00 0.00 54.13 56.75 3fzu s LEU 113 Cb -0.10 -3.60 0.01 0.00 -0.43 0.00 0.00 46.19 42.07 3fzu s LEU 113 CO -0.02 -0.07 -0.15 -0.69 -0.29 0.00 0.00 176.35 175.13 3fzu s VAL 114 N -0.47 1.45 -0.24 1.68 1.01 0.20 -2.94 120.40 121.09 3fzu s VAL 114 Ca 0.46 -0.63 -0.00 0.00 0.00 0.00 0.00 61.98 61.81 3fzu s VAL 114 Cb -0.27 -1.32 0.03 0.00 0.00 0.00 0.00 36.38 34.82 3fzu s VAL 114 CO 0.33 0.43 -0.10 -0.89 0.00 0.00 0.00 175.10 174.87 3fzu s THR 115 N 0.86 2.56 -0.44 3.92 2.01 -0.25 -1.77 115.64 122.54 3fzu s THR 115 Ca -0.10 -1.16 -0.20 0.00 0.31 0.00 0.00 61.69 60.54 3fzu s THR 115 Cb -0.15 -2.31 0.03 0.00 0.01 0.00 0.00 72.50 70.07 3fzu s THR 115 CO 0.01 0.20 0.59 -0.69 -0.69 0.00 0.00 174.62 174.04 3fzu s VAL 116 N 1.26 4.89 -0.06 3.82 1.01 -1.26 -1.01 120.40 129.07 3fzu s VAL 116 Ca -0.01 -0.05 -0.31 0.00 0.00 0.00 0.00 61.98 61.61 3fzu s VAL 116 Cb -0.17 -4.18 0.07 0.00 0.00 0.00 0.00 36.38 32.11 3fzu s VAL 116 CO -0.06 -0.58 0.69 -0.55 0.00 0.00 0.00 175.10 174.61 3fzu s SER 117 N 2.01 -0.65 0.41 3.32 0.15 -0.01 -4.49 113.70 114.45 3fzu s SER 117 Ca 0.19 0.72 0.26 0.00 0.70 0.00 0.00 55.95 57.82 3fzu s SER 117 Cb -0.15 0.54 0.70 0.00 -1.71 0.00 0.00 66.02 65.40 3fzu s SER 117 CO 0.17 -0.59 1.73 0.77 1.20 0.00 0.00 173.24 176.52 3fzu h SER 118 N 3.01 0.00 -3.92 5.45 4.64 -1.95 -3.30 113.55 117.48 3fzu h SER 118 Ca -0.27 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.50 3fzu h SER 118 Cb 1.14 0.00 0.14 0.00 -0.31 0.00 0.00 62.40 63.37 3fzu h SER 118 CO 0.38 0.00 0.57 0.00 -0.87 0.00 0.00 176.83 176.91 3fzu n ALA 119 N -2.02 1.52 -2.57 5.18 0.00 -1.26 -5.03 120.51 116.32 3fzu n ALA 119 Ca 0.03 0.15 -0.20 0.00 0.00 0.00 0.00 53.44 53.43 3fzu n ALA 119 Cb 0.44 -2.33 -0.02 0.00 0.00 0.00 0.00 19.45 17.54 3fzu n ALA 119 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3fzu s SER 120 N -0.82 5.87 0.42 0.00 1.04 -1.26 -4.99 113.70 113.95 3fzu s SER 120 Ca 0.69 -0.21 -0.25 0.00 0.48 0.00 0.00 55.95 56.66 3fzu s SER 120 Cb -0.43 -1.29 -0.10 0.00 0.10 0.00 0.00 66.02 64.30 3fzu s SER 120 CO 0.51 -0.34 1.10 0.41 0.98 0.00 0.00 173.24 175.90 3fzu n THR 121 N -1.53 2.53 -3.66 2.02 -1.04 -1.26 -4.76 114.28 106.58 3fzu n THR 121 Ca -0.02 -0.50 -0.08 0.00 -2.04 0.00 0.00 64.05 61.41 3fzu n THR 121 Cb 0.58 -1.29 -0.09 0.00 -1.82 0.00 0.00 70.33 67.72 3fzu n THR 121 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3fzu s LYS 122 N -2.10 0.52 0.41 -2.82 2.20 0.74 -4.89 119.74 113.81 3fzu s LYS 122 Ca 0.63 1.06 -0.23 0.00 -0.36 0.00 0.00 55.97 57.06 3fzu s LYS 122 Cb -0.54 0.18 -0.09 0.00 -1.51 0.00 0.00 37.83 35.87 3fzu s LYS 122 CO 0.57 -0.17 1.04 0.20 -0.36 0.00 0.00 175.35 176.63 3fzu s GLY 123 N 1.80 2.69 0.79 5.54 0.00 -1.26 -0.34 107.32 116.54 3fzu s GLY 123 Ca -0.08 0.67 -0.11 0.00 0.00 0.00 0.00 44.72 45.19 3fzu s GLY 123 CO -0.16 1.07 1.09 2.56 0.00 0.00 0.00 173.10 177.66 3fzu s PRO 124 N -2.63 2.17 0.00 2.90 0.04 -1.26 -4.64 135.00 131.59 3fzu s PRO 124 Ca 0.59 0.72 -0.00 0.00 0.04 0.00 0.00 61.00 62.35 3fzu s PRO 124 Cb -0.20 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 3fzu s PRO 124 CO 0.26 -1.58 0.09 -1.12 0.04 0.00 0.00 177.00 174.69 3fzu s SER 125 N -3.84 5.70 -0.28 6.66 0.01 -0.10 -4.91 113.70 116.95 3fzu s SER 125 Ca 0.60 0.14 0.01 0.00 1.31 0.00 0.00 55.95 58.02 3fzu s SER 125 Cb -0.15 -1.64 0.08 0.00 0.21 0.00 0.00 66.02 64.53 3fzu s SER 125 CO 0.55 0.26 0.01 -0.69 0.41 0.00 0.00 173.24 173.77 3fzu s VAL 126 N -1.22 1.55 -0.01 3.43 1.01 -1.26 0.08 120.40 123.98 3fzu s VAL 126 Ca 0.24 -1.52 -0.00 0.00 0.00 0.00 0.00 61.98 60.69 3fzu s VAL 126 Cb -0.12 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 3fzu s VAL 126 CO 0.15 -0.35 0.05 -0.36 0.00 0.00 0.00 175.10 174.59 3fzu s PHE 127 N 1.33 3.21 0.27 5.22 0.40 -0.73 -4.91 117.98 122.77 3fzu s PHE 127 Ca 0.02 0.17 -0.21 0.00 -0.60 0.00 0.00 56.93 56.30 3fzu s PHE 127 Cb -0.19 -1.72 -0.09 0.00 0.51 0.00 0.00 43.02 41.53 3fzu s PHE 127 CO -0.11 0.52 0.81 -1.25 0.70 0.00 0.00 175.22 175.89 3fzu s PRO 128 N -1.58 4.34 -0.46 0.24 0.04 -1.26 0.86 135.00 137.18 3fzu s PRO 128 Ca 0.21 1.02 -0.17 0.00 0.04 0.00 0.00 61.00 62.09 3fzu s PRO 128 Cb -0.12 -2.79 0.05 0.00 0.04 0.00 0.00 34.50 31.68 3fzu s PRO 128 CO 0.11 0.32 0.47 -0.51 0.04 0.00 0.00 177.00 177.44 3fzu s LEU 129 N -2.13 5.10 0.00 -3.56 1.43 0.24 -4.79 118.68 114.98 3fzu s LEU 129 Ca 0.47 -0.92 -0.30 0.00 -1.03 0.00 0.00 54.13 52.35 3fzu s LEU 129 Cb -0.16 -2.34 -0.03 0.00 0.03 0.00 0.00 46.19 43.68 3fzu s LEU 129 CO 0.21 -0.68 0.99 0.00 0.23 0.00 0.00 176.35 177.11 3fzu s ALA 130 N 2.12 3.18 0.36 4.21 0.00 -1.26 -1.69 121.76 128.68 3fzu s ALA 130 Ca 0.10 0.55 -0.28 0.00 0.00 0.00 0.00 51.96 52.34 3fzu s ALA 130 Cb -0.20 -3.35 -0.10 0.00 0.00 0.00 0.00 23.12 19.48 3fzu s ALA 130 CO 0.11 -0.25 1.30 -1.25 0.00 0.00 0.00 175.76 175.67 3fzu s PRO 131 N 1.04 4.20 0.00 0.00 0.04 -1.26 -4.69 135.00 134.34 3fzu s PRO 131 Ca 0.52 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.75 3fzu s PRO 131 Cb -0.21 -2.94 0.00 0.00 0.04 0.00 0.00 34.50 31.38 3fzu s PRO 131 CO 0.28 -0.30 0.00 0.45 0.04 0.00 0.00 177.00 177.47 3fzu n SER 132 N 0.53 0.00 -1.25 6.66 2.88 -1.26 -1.02 113.62 120.15 3fzu n SER 132 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 3fzu n SER 132 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 3fzu n SER 132 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 3fzu n SER 133 N 0.00 3.70 -2.09 -3.46 3.41 -1.26 -4.13 113.62 109.79 3fzu n SER 133 Ca 0.00 -2.03 -0.19 0.00 -0.26 0.00 0.00 58.87 56.39 3fzu n SER 133 Cb 0.00 -0.72 -0.01 0.00 -0.26 0.00 0.00 64.21 63.23 3fzu n SER 133 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3fzu n LYS 134 N 1.00 1.99 -4.52 4.33 5.02 -1.26 -5.07 118.16 119.65 3fzu n LYS 134 Ca 0.00 -1.73 -0.25 0.00 -2.02 0.00 0.00 58.31 54.31 3fzu n LYS 134 Cb 0.45 -1.80 -0.11 0.00 -0.02 0.00 0.00 35.03 33.56 3fzu n LYS 134 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3fzu s SER 135 N 0.42 3.36 -0.31 4.39 0.01 -1.26 0.10 113.70 120.42 3fzu s SER 135 Ca 0.42 -1.26 0.01 0.00 1.31 0.00 0.00 55.95 56.42 3fzu s SER 135 Cb 0.29 -0.28 0.14 0.00 0.21 0.00 0.00 66.02 66.37 3fzu s SER 135 CO -0.08 -0.34 0.32 -0.83 0.41 0.00 0.00 173.24 172.72 3fzu s GLY 138 N -3.58 -0.14 0.00 3.44 0.00 -1.26 -4.40 107.32 101.38 3fzu s GLY 138 Ca 0.33 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.62 3fzu s GLY 138 CO 0.16 2.70 0.00 0.61 0.00 0.00 0.00 173.10 176.56 3fzu n GLY 139 N 5.08 3.32 3.40 0.20 0.00 -1.26 -5.08 105.19 110.84 3fzu n GLY 139 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 3fzu n GLY 139 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fzu s THR 140 N -2.99 2.31 0.01 2.61 2.01 -1.26 -3.03 115.64 115.30 3fzu s THR 140 Ca 0.00 -1.75 0.08 0.00 0.31 0.00 0.00 61.69 60.33 3fzu s THR 140 Cb 0.00 -2.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.46 3fzu s THR 140 CO 0.00 0.08 -0.25 0.00 -0.69 0.00 0.00 174.62 173.77 3fzu s ALA 141 N -1.09 2.27 -0.07 7.40 0.00 -0.84 -4.34 121.76 125.09 3fzu s ALA 141 Ca 0.15 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 50.98 3fzu s ALA 141 Cb -0.10 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.43 3fzu s ALA 141 CO 0.06 0.54 -0.20 0.00 0.00 0.00 0.00 175.76 176.17 3fzu s ALA 142 N -0.72 2.40 0.14 0.00 0.00 0.28 -1.46 121.76 122.42 3fzu s ALA 142 Ca 0.11 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 3fzu s ALA 142 Cb -0.10 -0.86 -0.03 0.00 0.00 0.00 0.00 23.12 22.13 3fzu s ALA 142 CO 0.01 0.44 0.12 -0.48 0.00 0.00 0.00 175.76 175.84 3fzu s LEU 143 N -0.27 1.54 0.00 0.00 0.05 -0.83 -4.21 118.68 114.96 3fzu s LEU 143 Ca 0.01 -1.14 0.00 0.00 0.05 0.00 0.00 54.13 53.04 3fzu s LEU 143 Cb -0.13 0.51 0.00 0.00 -2.05 0.00 0.00 46.19 44.52 3fzu s LEU 143 CO 0.03 -0.78 0.00 0.61 -0.55 0.00 0.00 176.35 175.66 3fzu n GLY 144 N -0.13 1.36 2.96 -3.48 0.00 -0.68 -0.36 105.19 104.86 3fzu n GLY 144 Ca -0.05 -0.88 -0.21 0.00 0.00 0.00 0.00 46.02 44.88 3fzu n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fzu s LEU 146 N 0.63 5.86 -0.56 0.00 2.96 0.25 -1.05 118.68 126.76 3fzu s LEU 146 Ca -0.10 -1.53 -0.21 0.00 -0.22 0.00 0.00 54.13 52.07 3fzu s LEU 146 Cb -0.13 -2.20 0.07 0.00 0.50 0.00 0.00 46.19 44.42 3fzu s LEU 146 CO 0.01 -0.75 0.76 -0.69 -1.32 0.00 0.00 176.35 174.36 3fzu s VAL 147 N 1.66 4.67 -0.04 1.68 1.01 0.36 -1.78 120.40 127.96 3fzu s VAL 147 Ca 0.04 -0.47 0.05 0.00 0.00 0.00 0.00 61.98 61.60 3fzu s VAL 147 Cb -0.27 -4.46 -0.01 0.00 0.00 0.00 0.00 36.38 31.64 3fzu s VAL 147 CO 0.05 -1.06 -0.18 -0.75 0.00 0.00 0.00 175.10 173.15 3fzu s LYS 148 N 3.14 1.81 -0.49 2.72 2.20 0.11 -1.90 119.74 127.34 3fzu s LYS 148 Ca 0.18 -0.65 -0.00 0.00 -0.36 0.00 0.00 55.97 55.13 3fzu s LYS 148 Cb -0.19 -1.60 0.00 0.00 -1.51 0.00 0.00 37.83 34.53 3fzu s LYS 148 CO 0.11 0.29 0.46 -0.25 -0.36 0.00 0.00 175.35 175.61 3fzu n ASP 149 N 3.02 -5.88 -4.15 1.43 8.00 0.56 -0.92 116.55 118.62 3fzu n ASP 149 Ca -0.17 -0.03 -0.09 0.00 0.71 0.00 0.00 54.79 55.20 3fzu n ASP 149 Cb 0.53 -3.88 -0.10 0.00 -0.02 0.00 0.00 41.12 37.65 3fzu n ASP 149 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 3fzu s TYR 150 N -2.96 0.78 -0.26 1.24 -0.85 -0.89 -4.21 117.35 110.19 3fzu s TYR 150 Ca 0.01 -0.96 -0.21 0.00 -0.52 0.00 0.00 57.07 55.38 3fzu s TYR 150 Cb -0.00 -0.48 0.07 0.00 0.38 0.00 0.00 41.96 41.93 3fzu s TYR 150 CO 0.50 -0.22 0.68 0.12 -1.52 0.00 0.00 175.55 175.11 3fzu s PHE 151 N -3.72 -0.82 0.00 -3.49 2.19 0.54 -1.41 117.98 111.28 3fzu s PHE 151 Ca 0.10 1.89 0.00 0.00 0.33 0.00 0.00 56.93 59.25 3fzu s PHE 151 Cb 0.06 0.35 0.00 0.00 -1.31 0.00 0.00 43.02 42.12 3fzu s PHE 151 CO -0.06 -0.40 0.00 -0.35 1.83 0.00 0.00 175.22 176.24 3fzu n PRO 152 N 3.14 1.05 -1.33 10.12 -0.04 -1.26 -0.18 135.00 146.49 3fzu n PRO 152 Ca -0.16 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.01 3fzu n PRO 152 Cb 0.56 0.00 0.14 0.00 -0.04 0.00 0.00 33.50 34.17 3fzu n PRO 152 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3fzu s GLU 153 N -0.57 1.04 0.47 0.54 0.41 -1.26 -4.79 118.70 114.54 3fzu s GLU 153 Ca 0.00 0.54 0.08 0.00 -0.41 0.00 0.00 54.97 55.18 3fzu s GLU 153 Cb 0.00 -1.81 0.03 0.00 -1.78 0.00 0.00 34.13 30.57 3fzu s GLU 153 CO 0.00 -2.32 0.56 -1.25 -0.49 0.00 0.00 175.26 171.76 3fzu s PRO 154 N -5.07 2.56 0.22 0.39 0.04 -1.26 -4.92 135.00 126.96 3fzu s PRO 154 Ca 0.64 -1.50 0.11 0.00 0.04 0.00 0.00 61.00 60.28 3fzu s PRO 154 Cb -0.17 -2.57 -0.05 0.00 0.04 0.00 0.00 34.50 31.76 3fzu s PRO 154 CO 0.56 -0.44 -0.20 0.14 0.04 0.00 0.00 177.00 177.10 3fzu s VAL 155 N -2.51 2.22 0.13 -0.36 -7.23 -1.26 -4.48 120.40 106.91 3fzu s VAL 155 Ca 0.53 -2.18 0.09 0.00 -1.81 0.00 0.00 61.98 58.61 3fzu s VAL 155 Cb -0.06 -2.13 -0.04 0.00 0.56 0.00 0.00 36.38 34.71 3fzu s VAL 155 CO 0.32 -0.33 -0.17 0.42 -0.31 0.00 0.00 175.10 175.03 3fzu s THR 156 N -2.23 2.86 -0.05 5.32 -4.23 -0.07 -4.94 115.64 112.29 3fzu s THR 156 Ca 0.24 -1.55 0.03 0.00 -1.18 0.00 0.00 61.69 59.23 3fzu s THR 156 Cb -0.05 -2.33 0.00 0.00 1.34 0.00 0.00 72.50 71.46 3fzu s THR 156 CO 0.11 0.07 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.41 3fzu s VAL 157 N -1.23 1.35 0.22 2.29 1.01 -1.26 -1.49 120.40 121.30 3fzu s VAL 157 Ca 0.19 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 61.56 3fzu s VAL 157 Cb -0.10 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.04 3fzu s VAL 157 CO 0.11 0.40 -0.01 -0.94 0.00 0.00 0.00 175.10 174.65 3fzu s SER 158 N 0.28 1.81 -0.16 3.32 1.04 -0.85 -4.97 113.70 114.18 3fzu s SER 158 Ca -0.09 -1.20 -0.01 0.00 0.48 0.00 0.00 55.95 55.14 3fzu s SER 158 Cb -0.13 0.01 0.04 0.00 0.10 0.00 0.00 66.02 66.04 3fzu s SER 158 CO 0.03 -0.50 -0.05 0.26 0.98 0.00 0.00 173.24 173.96 3fzu s TRP 159 N -3.42 1.67 -1.46 5.02 0.52 -1.26 -1.04 118.94 118.98 3fzu s TRP 159 Ca 0.27 -1.04 -0.06 0.00 0.02 0.00 0.00 56.10 55.29 3fzu s TRP 159 Cb 0.05 -1.30 0.03 0.00 -1.15 0.00 0.00 33.47 31.10 3fzu s TRP 159 CO 0.08 -0.60 0.57 0.09 0.02 0.00 0.00 176.95 177.11 3fzu n ASN 160 N 4.88 -5.28 -2.30 2.95 3.02 0.10 -2.61 115.26 116.02 3fzu n ASN 160 Ca -0.12 -0.32 -0.12 0.00 -0.03 0.00 0.00 54.58 53.99 3fzu n ASN 160 Cb 0.48 -4.29 0.05 0.00 -0.61 0.00 0.00 39.78 35.40 3fzu n ASN 160 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3fzu n SER 161 N -2.45 -3.39 0.00 6.41 7.64 -1.26 -3.11 113.62 117.47 3fzu n SER 161 Ca -0.08 -0.32 0.00 0.00 1.01 0.00 0.00 58.87 59.48 3fzu n SER 161 Cb 0.59 -3.08 0.00 0.00 -1.01 0.00 0.00 64.21 60.71 3fzu n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fzu n GLY 162 N -1.23 1.44 0.28 0.23 0.00 -1.20 -4.89 105.19 99.82 3fzu n GLY 162 Ca -0.07 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.89 3fzu n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fzu h ALA 163 N 0.00 1.01 -3.06 4.61 0.00 -1.57 -3.39 119.26 116.85 3fzu h ALA 163 Ca 0.00 -0.30 -0.70 0.00 0.00 0.00 0.00 54.91 53.91 3fzu h ALA 163 Cb 0.00 -0.19 -0.34 0.00 0.00 0.00 0.00 17.79 17.27 3fzu h ALA 163 CO 0.00 0.60 -0.47 -1.17 0.00 0.00 0.00 179.25 178.21 3fzu s LEU 164 N -9.11 5.34 -0.15 0.00 2.96 -1.07 -4.85 118.68 111.80 3fzu s LEU 164 Ca -0.10 -2.23 0.09 0.00 -0.22 0.00 0.00 54.13 51.68 3fzu s LEU 164 Cb 0.14 -1.87 -0.16 0.00 0.50 0.00 0.00 46.19 44.81 3fzu s LEU 164 CO 0.82 -0.53 -0.01 0.35 -1.32 0.00 0.00 176.35 175.67 3fzu n THR 165 N 4.36 0.97 -1.52 3.68 -2.24 -1.26 -4.43 114.28 113.84 3fzu n THR 165 Ca -0.00 -0.53 -0.52 0.00 -2.27 0.00 0.00 64.05 60.73 3fzu n THR 165 Cb 0.40 -0.77 -0.07 0.00 -2.10 0.00 0.00 70.33 67.80 3fzu n THR 165 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3fzu n SER 166 N -2.65 2.32 0.00 3.42 7.64 -1.26 -2.43 113.62 120.66 3fzu n SER 166 Ca -0.25 0.60 0.00 0.00 1.01 0.00 0.00 58.87 60.23 3fzu n SER 166 Cb 0.92 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 3fzu n SER 166 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3fzu n GLY 167 N 5.89 0.84 3.78 0.23 0.00 -1.26 -4.72 105.19 109.94 3fzu n GLY 167 Ca 0.37 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 46.00 3fzu n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fzu s VAL 168 N -2.03 4.76 -0.16 1.61 1.01 -1.02 -2.82 120.40 121.75 3fzu s VAL 168 Ca 0.00 1.35 -0.04 0.00 0.00 0.00 0.00 61.98 63.29 3fzu s VAL 168 Cb 0.00 -3.98 0.06 0.00 0.00 0.00 0.00 36.38 32.46 3fzu s VAL 168 CO 0.00 0.47 0.08 -1.00 0.00 0.00 0.00 175.10 174.64 3fzu s HIS 169 N -0.58 0.35 -0.27 5.22 3.76 -0.61 -5.02 115.29 118.14 3fzu s HIS 169 Ca 0.32 -0.37 -0.11 0.00 -0.15 0.00 0.00 55.06 54.75 3fzu s HIS 169 Cb -0.20 -0.74 -0.05 0.00 1.11 0.00 0.00 32.58 32.70 3fzu s HIS 169 CO 0.20 -0.50 0.20 0.99 -0.85 0.00 0.00 174.74 174.77 3fzu s THR 170 N 2.08 5.31 0.35 1.30 2.01 -1.26 -1.29 115.64 124.15 3fzu s THR 170 Ca 0.02 0.20 -0.26 0.00 0.31 0.00 0.00 61.69 61.95 3fzu s THR 170 Cb -0.16 -3.53 -0.09 0.00 0.01 0.00 0.00 72.50 68.73 3fzu s THR 170 CO -0.08 0.27 1.06 -0.36 -0.69 0.00 0.00 174.62 174.82 3fzu s PHE 171 N 1.62 3.41 0.40 4.92 0.40 -0.63 -4.99 117.98 123.11 3fzu s PHE 171 Ca 0.08 1.68 -0.24 0.00 -0.60 0.00 0.00 56.93 57.84 3fzu s PHE 171 Cb -0.15 -3.18 -0.11 0.00 0.51 0.00 0.00 43.02 40.09 3fzu s PHE 171 CO 0.10 -0.55 0.94 -2.30 0.70 0.00 0.00 175.22 174.10 3fzu n PRO 172 N 0.44 1.22 -1.89 0.24 -0.02 -1.26 -4.62 135.00 129.10 3fzu n PRO 172 Ca 0.03 0.44 -0.40 0.00 -2.02 0.00 0.00 63.50 61.54 3fzu n PRO 172 Cb 0.48 -1.93 0.01 0.00 -0.02 0.00 0.00 33.50 32.04 3fzu n PRO 172 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3fzu s ALA 173 N -1.27 3.30 0.08 3.55 0.00 -1.26 -4.80 121.76 121.36 3fzu s ALA 173 Ca 0.63 1.40 0.08 0.00 0.00 0.00 0.00 51.96 54.06 3fzu s ALA 173 Cb -0.59 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 18.94 3fzu s ALA 173 CO 0.57 -1.04 -0.18 0.14 0.00 0.00 0.00 175.76 175.26 3fzu s VAL 174 N -1.21 2.84 -0.15 0.00 -7.23 0.17 -4.93 120.40 109.90 3fzu s VAL 174 Ca 0.58 -1.34 -0.22 0.00 -1.81 0.00 0.00 61.98 59.19 3fzu s VAL 174 Cb -0.42 -2.25 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 3fzu s VAL 174 CO 0.55 0.22 0.69 -0.22 -0.31 0.00 0.00 175.10 176.02 3fzu s LEU 175 N -1.80 4.20 0.54 1.32 2.96 -1.26 -0.86 118.68 123.78 3fzu s LEU 175 Ca 0.16 1.01 -0.04 0.00 -0.22 0.00 0.00 54.13 55.04 3fzu s LEU 175 Cb -0.11 -3.02 -0.00 0.00 0.50 0.00 0.00 46.19 43.57 3fzu s LEU 175 CO 0.08 -0.25 0.83 -1.10 -1.32 0.00 0.00 176.35 174.58 3fzu s GLN 176 N 1.63 3.04 0.57 1.98 -0.21 0.83 -4.96 119.66 122.54 3fzu s GLN 176 Ca 0.33 -0.10 0.35 0.00 0.02 0.00 0.00 55.36 55.96 3fzu s GLN 176 Cb -0.16 -2.36 1.69 0.00 1.00 0.00 0.00 33.01 33.18 3fzu s GLN 176 CO 0.13 -0.53 2.12 0.66 -2.12 0.00 0.00 175.29 175.55 3fzu h SER 177 N 0.02 0.00 0.15 5.90 4.64 -1.97 0.98 113.55 123.28 3fzu h SER 177 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3fzu h SER 177 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3fzu h SER 177 CO 0.60 0.05 0.00 -1.54 -0.87 0.00 0.00 176.83 175.07 3fzu n SER 178 N -3.28 0.00 0.00 4.97 3.41 -1.26 -4.88 113.62 112.59 3fzu n SER 178 Ca -0.01 0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 3fzu n SER 178 Cb 0.22 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.92 3fzu n SER 178 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3fzu n GLY 179 N -0.48 2.32 3.95 5.00 0.00 0.34 -5.04 105.19 111.28 3fzu n GLY 179 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.82 3fzu n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fzu s LEU 180 N 0.00 4.29 0.43 0.99 1.43 -1.26 -4.82 118.68 119.75 3fzu s LEU 180 Ca 0.00 0.21 -0.03 0.00 -1.03 0.00 0.00 54.13 53.28 3fzu s LEU 180 Cb 0.00 -2.97 -0.03 0.00 0.03 0.00 0.00 46.19 43.21 3fzu s LEU 180 CO 0.00 -0.01 0.70 -0.31 0.23 0.00 0.00 176.35 176.95 3fzu s TYR 181 N -1.85 3.50 0.01 0.29 2.02 -0.50 -0.12 117.35 120.70 3fzu s TYR 181 Ca 0.36 0.60 -0.18 0.00 -0.37 0.00 0.00 57.07 57.47 3fzu s TYR 181 Cb -0.10 -2.17 0.03 0.00 -0.40 0.00 0.00 41.96 39.32 3fzu s TYR 181 CO 0.29 -0.16 0.38 0.45 -1.57 0.00 0.00 175.55 174.95 3fzu s SER 182 N -4.10 -0.26 0.19 2.29 0.15 -0.04 -0.32 113.70 111.61 3fzu s SER 182 Ca 0.45 0.09 -0.14 0.00 0.70 0.00 0.00 55.95 57.05 3fzu s SER 182 Cb -0.10 0.38 0.01 0.00 -1.71 0.00 0.00 66.02 64.60 3fzu s SER 182 CO 0.41 -0.56 0.44 -1.48 1.20 0.00 0.00 173.24 173.25 3fzu s LEU 183 N -1.63 0.41 0.19 3.45 0.05 -0.80 0.45 118.68 120.81 3fzu s LEU 183 Ca -0.09 -0.69 0.10 0.00 0.05 0.00 0.00 54.13 53.50 3fzu s LEU 183 Cb -0.03 1.77 -0.04 0.00 -2.05 0.00 0.00 46.19 45.84 3fzu s LEU 183 CO 0.02 -1.02 -0.22 -0.44 -0.55 0.00 0.00 176.35 174.14 3fzu s SER 184 N -2.93 3.16 -0.02 1.48 0.01 -1.26 -0.49 113.70 113.66 3fzu s SER 184 Ca 0.14 -0.87 0.05 0.00 1.31 0.00 0.00 55.95 56.58 3fzu s SER 184 Cb 0.00 -0.22 -0.01 0.00 0.21 0.00 0.00 66.02 66.00 3fzu s SER 184 CO 0.00 0.06 -0.16 -0.55 0.41 0.00 0.00 173.24 173.00 3fzu s SER 185 N -2.71 1.97 0.03 2.44 0.15 -0.22 -1.60 113.70 113.77 3fzu s SER 185 Ca 0.19 -0.31 -0.00 0.00 0.70 0.00 0.00 55.95 56.54 3fzu s SER 185 Cb -0.07 -0.29 -0.03 0.00 -1.71 0.00 0.00 66.02 63.92 3fzu s SER 185 CO 0.09 0.19 -0.04 0.68 1.20 0.00 0.00 173.24 175.36 3fzu s VAL 186 N -0.30 0.21 -0.03 4.45 -7.23 -0.41 -0.46 120.40 116.63 3fzu s VAL 186 Ca 0.04 -1.25 -0.02 0.00 -1.81 0.00 0.00 61.98 58.95 3fzu s VAL 186 Cb -0.07 -0.74 0.02 0.00 0.56 0.00 0.00 36.38 36.14 3fzu s VAL 186 CO -0.00 -0.66 0.07 0.54 -0.31 0.00 0.00 175.10 174.74 3fzu s VAL 187 N -2.31 -0.02 -0.21 1.32 0.11 0.52 -1.58 120.40 118.23 3fzu s VAL 187 Ca -0.07 0.07 -0.12 0.00 -2.93 0.00 0.00 61.98 58.93 3fzu s VAL 187 Cb -0.04 -0.11 -0.05 0.00 -1.53 0.00 0.00 36.38 34.65 3fzu s VAL 187 CO -0.04 0.03 0.24 0.42 -3.33 0.00 0.00 175.10 172.42 3fzu s THR 188 N 0.42 5.31 0.13 5.04 -4.23 -1.13 -1.96 115.64 119.23 3fzu s THR 188 Ca -0.03 0.38 0.03 0.00 -1.18 0.00 0.00 61.69 60.89 3fzu s THR 188 Cb -0.05 -3.58 -0.04 0.00 1.34 0.00 0.00 72.50 70.17 3fzu s THR 188 CO -0.02 0.34 -0.08 0.68 -0.54 0.00 0.00 174.62 175.00 3fzu s VAL 189 N 0.96 0.94 0.15 2.29 -7.23 -0.53 -4.66 120.40 112.31 3fzu s VAL 189 Ca 0.12 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 57.97 3fzu s VAL 189 Cb -0.13 -1.80 -0.10 0.00 0.56 0.00 0.00 36.38 34.91 3fzu s VAL 189 CO 0.04 -0.78 1.64 -2.84 -0.31 0.00 0.00 175.10 172.85 3fzu s PRO 190 N -3.79 4.19 0.00 4.82 0.02 -1.26 -1.98 135.00 136.99 3fzu s PRO 190 Ca 0.15 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.59 3fzu s PRO 190 Cb 0.04 -3.28 0.00 0.00 0.02 0.00 0.00 34.50 31.28 3fzu s PRO 190 CO -0.01 -0.68 0.94 0.43 -0.33 0.00 0.00 177.00 177.35 3fzu n SER 191 N 4.48 0.00 -0.17 2.53 7.64 -1.17 -1.62 113.62 125.31 3fzu n SER 191 Ca 0.15 0.94 0.29 0.00 1.01 0.00 0.00 58.87 61.26 3fzu n SER 191 Cb 0.38 -0.44 0.62 0.00 -1.01 0.00 0.00 64.21 63.76 3fzu n SER 191 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3fzu h SER 192 N 0.00 0.00 0.50 6.43 4.64 -1.91 -1.02 113.55 122.18 3fzu h SER 192 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fzu h SER 192 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3fzu h SER 192 CO 0.00 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.42 3fzu n SER 193 N -3.59 0.56 0.00 4.97 3.41 -0.64 -2.90 113.62 115.43 3fzu n SER 193 Ca 0.20 0.67 0.06 0.00 -0.26 0.00 0.00 58.87 59.54 3fzu n SER 193 Cb 1.22 -0.78 0.36 0.00 -0.26 0.00 0.00 64.21 64.76 3fzu n SER 193 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3fzu n LEU 194 N -2.15 0.00 0.00 1.04 4.77 -0.39 -1.63 117.00 118.64 3fzu n LEU 194 Ca 0.01 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 3fzu n LEU 194 Cb 0.17 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3fzu n LEU 194 CO 0.16 -0.08 0.00 0.61 -1.33 0.00 0.00 177.39 176.75 3fzu n GLY 195 N -0.18 0.00 0.00 -0.72 0.00 -1.14 -4.22 105.19 98.93 3fzu n GLY 195 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3fzu n GLY 195 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3fzu n THR 196 N 0.00 0.00 -4.00 2.61 5.66 -1.26 -5.06 114.28 112.23 3fzu n THR 196 Ca 0.00 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.65 3fzu n THR 196 Cb 0.00 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 68.69 3fzu n THR 196 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 3fzu s GLN 197 N 0.00 3.85 -0.00 1.09 2.00 -0.65 -5.07 119.66 120.88 3fzu s GLN 197 Ca 0.00 -0.31 -0.19 0.00 -2.00 0.00 0.00 55.36 52.86 3fzu s GLN 197 Cb 0.00 -3.19 -0.06 0.00 0.80 0.00 0.00 33.01 30.56 3fzu s GLN 197 CO 0.00 0.37 0.53 0.99 -0.50 0.00 0.00 175.29 176.68 3fzu s THR 198 N 0.10 4.94 -0.28 -0.34 2.01 -1.26 -4.76 115.64 116.04 3fzu s THR 198 Ca 0.06 1.11 0.01 0.00 0.31 0.00 0.00 61.69 63.18 3fzu s THR 198 Cb -0.12 -3.86 0.08 0.00 0.01 0.00 0.00 72.50 68.61 3fzu s THR 198 CO 0.00 0.47 0.01 -0.31 -0.69 0.00 0.00 174.62 174.10 3fzu s TYR 199 N -0.44 2.68 -0.15 4.92 1.51 -1.26 -4.99 117.35 119.61 3fzu s TYR 199 Ca 0.28 -2.14 -0.02 0.00 -1.01 0.00 0.00 57.07 54.18 3fzu s TYR 199 Cb -0.18 -2.01 -0.02 0.00 -0.11 0.00 0.00 41.96 39.64 3fzu s TYR 199 CO 0.16 -0.85 -0.07 0.96 -1.11 0.00 0.00 175.55 174.63 3fzu s ILE 200 N 1.29 3.56 0.11 2.71 -4.36 -1.26 -0.35 121.20 122.90 3fzu s ILE 200 Ca 0.02 -0.47 0.03 0.00 -0.26 0.00 0.00 60.65 59.97 3fzu s ILE 200 Cb -0.19 -2.54 -0.04 0.00 1.25 0.00 0.00 42.46 40.94 3fzu s ILE 200 CO -0.11 0.50 0.15 0.00 0.24 0.00 0.00 174.94 175.72 3fzu s ASN 202 N -2.74 4.48 -0.04 0.00 0.01 -0.20 0.06 114.94 116.51 3fzu s ASN 202 Ca 0.32 -1.62 -0.08 0.00 -0.71 0.00 0.00 52.86 50.76 3fzu s ASN 202 Cb -0.12 -1.52 -0.05 0.00 0.41 0.00 0.00 41.25 39.98 3fzu s ASN 202 CO 0.25 -0.26 0.25 -0.69 -1.51 0.00 0.00 177.10 175.14 3fzu s VAL 203 N 1.08 5.32 -0.05 1.60 1.01 0.15 -2.00 120.40 127.52 3fzu s VAL 203 Ca -0.02 0.32 -0.02 0.00 0.00 0.00 0.00 61.98 62.27 3fzu s VAL 203 Cb -0.19 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.68 3fzu s VAL 203 CO -0.07 0.50 0.09 0.21 0.00 0.00 0.00 175.10 175.83 3fzu s ASN 204 N -1.34 0.44 -0.44 3.32 2.47 -0.55 -1.46 114.94 117.38 3fzu s ASN 204 Ca 0.22 0.16 0.02 0.00 0.42 0.00 0.00 52.86 53.68 3fzu s ASN 204 Cb -0.13 0.03 0.14 0.00 -1.45 0.00 0.00 41.25 39.83 3fzu s ASN 204 CO 0.11 -0.19 0.24 -2.28 -3.72 0.00 0.00 177.10 171.27 3fzu s HIS 205 N 1.61 1.99 0.27 0.43 5.65 0.12 -0.90 115.29 124.45 3fzu s HIS 205 Ca -0.03 -2.43 -0.02 0.00 0.25 0.00 0.00 55.06 52.83 3fzu s HIS 205 Cb -0.12 -1.88 0.44 0.00 -1.18 0.00 0.00 32.58 29.84 3fzu s HIS 205 CO -0.04 -0.78 1.86 -0.22 -0.65 0.00 0.00 174.74 174.91 3fzu h LYS 206 N 6.69 1.03 0.00 2.88 3.64 -1.78 -0.28 116.57 128.74 3fzu h LYS 206 Ca -0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3fzu h LYS 206 Cb 0.92 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 3fzu h LYS 206 CO 0.48 0.68 0.00 -1.35 -2.27 0.00 0.00 179.45 176.99 3fzu h PRO 207 N 1.06 0.00 -0.53 1.90 0.11 -1.91 -0.61 132.00 132.01 3fzu h PRO 207 Ca 0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.55 3fzu h PRO 207 Cb 0.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.40 3fzu h PRO 207 CO -0.21 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.45 3fzu n SER 208 N -2.75 3.41 -4.07 -2.05 3.41 -0.22 -4.84 113.62 106.51 3fzu n SER 208 Ca -0.01 -1.99 -0.34 0.00 -0.26 0.00 0.00 58.87 56.27 3fzu n SER 208 Cb 0.15 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 63.72 3fzu n SER 208 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3fzu n ASN 209 N 1.07 -3.22 -4.84 4.04 5.15 -0.24 -4.95 115.26 112.27 3fzu n ASN 209 Ca 0.18 -0.89 -0.32 0.00 -0.60 0.00 0.00 54.58 52.95 3fzu n ASN 209 Cb 0.52 -2.65 -0.06 0.00 -0.53 0.00 0.00 39.78 37.06 3fzu n ASN 209 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3fzu s THR 210 N -3.18 4.98 -0.08 -0.44 2.01 -0.58 -4.99 115.64 113.35 3fzu s THR 210 Ca 0.69 -0.46 -0.03 0.00 0.31 0.00 0.00 61.69 62.19 3fzu s THR 210 Cb -0.38 -3.36 0.05 0.00 0.01 0.00 0.00 72.50 68.82 3fzu s THR 210 CO 0.84 0.22 0.17 -0.54 -0.69 0.00 0.00 174.62 174.63 3fzu s LYS 211 N -2.17 0.07 0.02 4.92 1.02 -1.26 -0.71 119.74 121.63 3fzu s LYS 211 Ca 0.29 0.53 0.09 0.00 0.02 0.00 0.00 55.97 56.89 3fzu s LYS 211 Cb -0.12 -0.22 -0.03 0.00 -0.52 0.00 0.00 37.83 36.94 3fzu s LYS 211 CO 0.21 -0.26 -0.25 0.08 -0.92 0.00 0.00 175.35 174.20 3fzu s VAL 212 N 1.96 2.19 -0.06 3.17 1.01 -0.53 -5.00 120.40 123.13 3fzu s VAL 212 Ca -0.01 -1.27 0.05 0.00 0.00 0.00 0.00 61.98 60.75 3fzu s VAL 212 Cb -0.12 -1.83 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 3fzu s VAL 212 CO -0.06 0.44 -0.21 -1.81 0.00 0.00 0.00 175.10 173.46 3fzu s ASP 213 N -1.05 3.43 -0.07 3.32 1.01 -1.26 0.34 116.67 122.39 3fzu s ASP 213 Ca 0.11 -0.41 -0.03 0.00 0.71 0.00 0.00 52.55 52.94 3fzu s ASP 213 Cb -0.10 -0.92 0.04 0.00 1.01 0.00 0.00 42.92 42.95 3fzu s ASP 213 CO 0.01 0.26 0.15 -0.75 0.21 0.00 0.00 175.17 175.05 3fzu s LYS 214 N -0.25 0.09 -0.20 8.23 2.20 0.11 -4.95 119.74 124.97 3fzu s LYS 214 Ca -0.00 0.40 -0.29 0.00 -0.36 0.00 0.00 55.97 55.72 3fzu s LYS 214 Cb -0.13 -0.19 0.00 0.00 -1.51 0.00 0.00 37.83 36.00 3fzu s LYS 214 CO 0.03 -0.19 1.04 0.21 -0.36 0.00 0.00 175.35 176.08 3fzu s LYS 215 N 1.33 4.30 0.53 4.03 2.20 -1.26 0.21 119.74 131.08 3fzu s LYS 215 Ca -0.08 1.38 -0.10 0.00 -0.36 0.00 0.00 55.97 56.82 3fzu s LYS 215 Cb -0.12 -3.62 -0.05 0.00 -1.51 0.00 0.00 37.83 32.54 3fzu s LYS 215 CO -0.06 -0.56 0.91 0.08 -0.36 0.00 0.00 175.35 175.36 3fzu s VAL 216 N 2.92 4.77 -0.09 4.02 1.01 0.53 -4.97 120.40 128.58 3fzu s VAL 216 Ca 0.45 0.66 -0.30 0.00 0.00 0.00 0.00 61.98 62.79 3fzu s VAL 216 Cb -0.16 -3.83 0.08 0.00 0.00 0.00 0.00 36.38 32.47 3fzu s VAL 216 CO 0.09 -0.91 0.74 -1.83 0.00 0.00 0.00 175.10 173.18 3fzu s GLU 217 N -4.73 0.96 1.04 2.72 -1.05 -1.26 -4.54 118.70 111.84 3fzu s GLU 217 Ca 0.52 0.30 -0.19 0.00 -0.15 0.00 0.00 54.97 55.45 3fzu s GLU 217 Cb -0.11 0.46 -0.01 0.00 -0.44 0.00 0.00 34.13 34.03 3fzu s GLU 217 CO 0.45 -0.29 -0.30 -2.30 0.95 0.00 0.00 175.26 173.77 3fzu n PRO 218 N 1.02 -0.73 0.00 -4.83 -0.02 -1.26 -4.36 135.00 124.82 3fzu n PRO 218 Ca -0.17 -0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.11 3fzu n PRO 218 Cb 0.57 -1.51 0.00 0.00 -0.02 0.00 0.00 33.50 32.54 3fzu n PRO 218 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11