#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fjm s VAL 22 N 0.00 4.10 -0.23 2.53 1.01 0.37 -4.98 120.40 123.20 3fjm s VAL 22 Ca 0.00 -0.56 -0.06 0.00 0.00 0.00 0.00 61.98 61.36 3fjm s VAL 22 Cb 0.00 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 3fjm s VAL 22 CO 0.00 0.13 0.03 0.20 0.00 0.00 0.00 175.10 175.47 3fjm s ASN 23 N 1.54 4.93 -0.02 3.32 0.01 -1.26 -0.48 114.94 122.98 3fjm s ASN 23 Ca 0.04 -0.23 0.00 0.00 -0.71 0.00 0.00 52.86 51.96 3fjm s ASN 23 Cb -0.17 -1.87 -0.04 0.00 0.41 0.00 0.00 41.25 39.59 3fjm s ASN 23 CO 0.03 -0.00 0.02 -0.76 -1.51 0.00 0.00 177.10 174.88 3fjm s LEU 24 N 1.41 3.63 0.00 0.60 1.02 0.32 -0.79 118.68 124.88 3fjm s LEU 24 Ca 0.05 0.07 0.03 0.00 0.02 0.00 0.00 54.13 54.30 3fjm s LEU 24 Cb -0.15 -2.03 -0.01 0.00 0.02 0.00 0.00 46.19 44.02 3fjm s LEU 24 CO 0.02 0.30 -0.10 -0.31 0.02 0.00 0.00 176.35 176.28 3fjm s TYR 25 N -1.06 0.90 -0.49 0.29 2.02 -0.57 -0.52 117.35 117.91 3fjm s TYR 25 Ca 0.19 -0.22 0.00 0.00 -0.37 0.00 0.00 57.07 56.67 3fjm s TYR 25 Cb -0.12 -0.57 0.00 0.00 -0.40 0.00 0.00 41.96 40.88 3fjm s TYR 25 CO 0.09 -0.01 0.00 0.41 -1.57 0.00 0.00 175.55 174.47 3fjm n GLY 26 N 2.58 -1.26 3.86 0.71 0.00 -0.84 -1.17 105.19 109.07 3fjm n GLY 26 Ca -0.15 -0.92 -0.31 0.00 0.00 0.00 0.00 46.02 44.65 3fjm n GLY 26 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3fjm s PRO 27 N -0.87 3.24 0.51 1.61 0.04 -1.26 -2.34 135.00 135.94 3fjm s PRO 27 Ca 0.00 0.70 -0.22 0.00 0.04 0.00 0.00 61.00 61.52 3fjm s PRO 27 Cb 0.00 -2.04 -0.06 0.00 0.04 0.00 0.00 34.50 32.44 3fjm s PRO 27 CO 0.00 -0.82 1.28 0.20 0.04 0.00 0.00 177.00 177.71 3fjm s GLY 28 N -4.15 2.85 0.00 0.56 0.00 -1.26 -4.29 107.32 101.02 3fjm s GLY 28 Ca 0.57 1.18 0.00 0.00 0.00 0.00 0.00 44.72 46.47 3fjm s GLY 28 CO 0.54 1.68 0.00 0.61 0.00 0.00 0.00 173.10 175.93 3fjm n GLY 29 N 0.61 1.93 0.09 0.20 0.00 -1.26 -4.82 105.19 101.94 3fjm n GLY 29 Ca 0.09 -0.52 0.09 0.00 0.00 0.00 0.00 46.02 45.68 3fjm n GLY 29 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3fjm n PRO 30 N 0.00 0.11 0.24 1.61 -0.02 -1.26 -3.21 135.00 132.47 3fjm n PRO 30 Ca 0.00 0.45 0.07 0.00 -2.02 0.00 0.00 63.50 62.01 3fjm n PRO 30 Cb 0.00 -1.75 0.59 0.00 -0.02 0.00 0.00 33.50 32.32 3fjm n PRO 30 CO 0.00 0.00 0.00 1.12 1.98 0.00 0.00 175.50 178.60 3fjm h HIS 31 N 0.00 0.00 -0.27 6.00 2.07 -1.88 -1.66 115.15 119.42 3fjm h HIS 31 Ca 0.00 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.42 3fjm h HIS 31 Cb 0.19 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.16 3fjm h HIS 31 CO 0.00 0.11 -0.21 1.79 -3.07 0.00 0.00 177.93 176.55 3fjm h THR 32 N 0.00 1.31 -0.39 6.12 1.35 -1.95 0.87 112.91 120.22 3fjm h THR 32 Ca -0.00 -1.36 -0.04 0.00 -0.55 0.00 0.00 66.41 64.46 3fjm h THR 32 Cb 0.20 1.59 -0.02 0.00 -1.73 0.00 0.00 68.15 68.20 3fjm h THR 32 CO 0.01 0.43 0.08 0.00 -0.25 0.00 0.00 175.52 175.79 3fjm h ALA 33 N 0.71 0.52 -0.76 6.62 0.00 -1.71 -3.00 119.26 121.63 3fjm h ALA 33 Ca 0.05 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 3fjm h ALA 33 Cb 0.76 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3fjm h ALA 33 CO 0.06 0.22 0.30 -0.07 0.00 0.00 0.00 179.25 179.75 3fjm h LEU 34 N 0.49 1.06 -0.48 0.00 3.38 -1.16 -1.05 115.31 117.55 3fjm h LEU 34 Ca 0.12 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.94 3fjm h LEU 34 Cb 0.35 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3fjm h LEU 34 CO 0.01 0.94 0.30 0.11 0.09 0.00 0.00 178.44 179.89 3fjm h LYS 35 N 1.12 0.59 -0.27 1.13 1.79 -0.80 0.39 116.57 120.51 3fjm h LYS 35 Ca 0.25 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.68 3fjm h LYS 35 Cb 0.22 -0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 30.73 3fjm h LYS 35 CO -0.02 0.39 0.12 -0.44 -1.08 0.00 0.00 179.45 178.42 3fjm h ASP 36 N 0.61 0.36 -0.62 0.86 3.32 -1.32 -0.46 116.42 119.17 3fjm h ASP 36 Ca 0.19 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 3fjm h ASP 36 Cb -0.02 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 3fjm h ASP 36 CO -0.07 0.40 0.27 0.40 -1.72 0.00 0.00 179.24 178.52 3fjm h ILE 37 N 0.30 1.23 -0.47 0.35 2.04 -0.86 -1.93 117.51 118.17 3fjm h ILE 37 Ca 0.09 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 65.23 3fjm h ILE 37 Cb 0.14 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 3fjm h ILE 37 CO -0.01 0.27 0.12 0.00 0.00 0.00 0.00 178.15 178.53 3fjm h ALA 38 N 1.11 0.62 0.10 1.87 0.00 -0.07 -0.34 119.26 122.54 3fjm h ALA 38 Ca 0.21 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3fjm h ALA 38 Cb 0.17 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3fjm h ALA 38 CO -0.02 0.30 -0.27 -0.97 0.00 0.00 0.00 179.25 178.30 3fjm h ASN 39 N 0.63 -0.77 -0.82 0.00 -1.24 -0.87 0.12 115.58 112.63 3fjm h ASN 39 Ca 0.15 0.09 0.01 0.00 0.71 0.00 0.00 56.30 57.26 3fjm h ASN 39 Cb 0.32 0.30 -0.04 0.00 0.73 0.00 0.00 38.32 39.62 3fjm h ASN 39 CO 0.00 -0.35 0.54 0.50 -1.29 0.00 0.00 177.43 176.83 3fjm h LYS 40 N -0.46 1.07 -0.26 6.67 3.64 -1.22 -2.18 116.57 123.82 3fjm h LYS 40 Ca 0.04 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 3fjm h LYS 40 Cb 0.50 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3fjm h LYS 40 CO -0.17 0.70 0.03 -0.92 -2.27 0.00 0.00 179.45 176.83 3fjm h TYR 41 N 1.10 0.47 -0.79 1.91 3.20 -0.71 -2.38 116.97 119.78 3fjm h TYR 41 Ca 0.30 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 62.06 3fjm h TYR 41 Cb -0.11 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 37.99 3fjm h TYR 41 CO -0.02 0.57 0.33 0.77 -1.64 0.00 0.00 178.16 178.17 3fjm h SER 42 N 0.24 1.07 -0.40 -2.11 0.02 -0.59 -0.08 113.55 111.70 3fjm h SER 42 Ca 0.08 -0.16 -0.07 0.00 -0.84 0.00 0.00 61.79 60.79 3fjm h SER 42 Cb 0.36 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 3fjm h SER 42 CO 0.01 0.94 0.00 -0.33 -1.14 0.00 0.00 176.83 176.31 3fjm h GLU 43 N 1.14 0.80 0.14 3.45 5.08 -1.36 0.08 114.58 123.90 3fjm h GLU 43 Ca 0.27 -0.21 -0.28 0.00 -1.00 0.00 0.00 59.36 58.13 3fjm h GLU 43 Cb 0.19 -0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.36 3fjm h GLU 43 CO -0.03 0.80 -1.26 -0.22 -1.00 0.00 0.00 179.01 177.30 3fjm h LYS 44 N 0.74 0.36 0.00 2.33 3.64 -0.89 -3.38 116.57 119.38 3fjm h LYS 44 Ca 0.15 -0.58 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 3fjm h LYS 44 Cb 0.45 0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 3fjm h LYS 44 CO 0.02 1.26 -1.54 0.25 -2.27 0.00 0.00 179.45 177.18 3fjm n THR 45 N -3.61 0.00 -0.03 1.00 -2.24 -0.09 -4.98 114.28 104.33 3fjm n THR 45 Ca -0.10 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 3fjm n THR 45 Cb 1.02 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 3fjm n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fjm n GLY 46 N 1.78 1.95 3.70 3.38 0.00 0.01 -5.02 105.19 111.00 3fjm n GLY 46 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3fjm n GLY 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fjm s VAL 47 N -2.70 4.75 -0.26 1.61 1.01 -1.25 -5.00 120.40 118.56 3fjm s VAL 47 Ca 0.00 1.99 -0.25 0.00 0.00 0.00 0.00 61.98 63.72 3fjm s VAL 47 Cb 0.00 -4.28 -0.00 0.00 0.00 0.00 0.00 36.38 32.10 3fjm s VAL 47 CO 0.00 0.09 0.85 -0.75 0.00 0.00 0.00 175.10 175.29 3fjm s LYS 48 N 1.47 4.12 -0.18 2.72 2.36 -1.26 -3.93 119.74 125.04 3fjm s LYS 48 Ca 0.51 0.88 -0.00 0.00 -2.55 0.00 0.00 55.97 54.81 3fjm s LYS 48 Cb -0.21 -3.67 0.01 0.00 -1.05 0.00 0.00 37.83 32.91 3fjm s LYS 48 CO 0.24 -0.59 -0.15 0.08 1.55 0.00 0.00 175.35 176.47 3fjm s VAL 49 N 2.95 2.53 -0.15 4.02 1.01 -1.26 -0.48 120.40 129.02 3fjm s VAL 49 Ca 0.35 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.50 3fjm s VAL 49 Cb -0.15 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 3fjm s VAL 49 CO 0.09 0.51 0.01 0.20 0.00 0.00 0.00 175.10 175.90 3fjm s ASN 50 N 1.17 5.18 -0.43 3.32 0.01 0.37 -4.83 114.94 119.73 3fjm s ASN 50 Ca 0.02 0.00 -0.07 0.00 -0.71 0.00 0.00 52.86 52.10 3fjm s ASN 50 Cb -0.14 -1.79 0.10 0.00 0.41 0.00 0.00 41.25 39.84 3fjm s ASN 50 CO -0.06 0.21 0.26 -0.69 -1.51 0.00 0.00 177.10 175.31 3fjm s VAL 51 N 0.11 3.86 -0.10 1.60 1.01 -1.26 -0.52 120.40 125.10 3fjm s VAL 51 Ca 0.02 -1.74 -0.15 0.00 0.00 0.00 0.00 61.98 60.10 3fjm s VAL 51 Cb -0.13 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.70 3fjm s VAL 51 CO 0.02 -0.64 0.37 0.20 0.00 0.00 0.00 175.10 175.05 3fjm s ASN 52 N 2.19 6.62 0.22 3.32 0.01 0.33 -5.00 114.94 122.62 3fjm s ASN 52 Ca 0.05 0.73 -0.07 0.00 -0.71 0.00 0.00 52.86 52.87 3fjm s ASN 52 Cb -0.24 -2.23 -0.02 0.00 0.41 0.00 0.00 41.25 39.17 3fjm s ASN 52 CO -0.01 0.16 0.30 0.72 -1.51 0.00 0.00 177.10 176.76 3fjm s PHE 53 N -0.04 0.75 -1.24 2.20 -0.71 -1.26 -1.99 117.98 115.69 3fjm s PHE 53 Ca 0.21 -1.04 0.00 0.00 -1.04 0.00 0.00 56.93 55.06 3fjm s PHE 53 Cb -0.15 -0.18 0.00 0.00 -1.21 0.00 0.00 43.02 41.49 3fjm s PHE 53 CO 0.09 -0.82 0.00 0.41 -1.34 0.00 0.00 175.22 173.56 3fjm n GLY 54 N -0.32 0.64 3.66 1.99 0.00 -0.99 -4.88 105.19 105.29 3fjm n GLY 54 Ca -0.00 -2.22 -0.45 0.00 0.00 0.00 0.00 46.02 43.35 3fjm n GLY 54 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3fjm n PRO 55 N -0.57 1.88 -0.34 1.61 -0.02 -1.26 -4.10 135.00 132.20 3fjm n PRO 55 Ca 0.00 0.67 0.22 0.00 -2.02 0.00 0.00 63.50 62.37 3fjm n PRO 55 Cb 0.00 -2.28 0.47 0.00 -0.02 0.00 0.00 33.50 31.67 3fjm n PRO 55 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3fjm h GLN 56 N 3.80 0.43 0.00 -0.52 4.15 -1.91 0.44 115.11 121.50 3fjm h GLN 56 Ca -0.45 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 58.93 3fjm h GLN 56 Cb 1.29 -0.10 -0.00 0.00 0.21 0.00 0.00 27.48 28.88 3fjm h GLN 56 CO 0.73 0.28 -0.10 0.00 -1.93 0.00 0.00 178.83 177.81 3fjm h ALA 57 N 1.68 1.23 0.00 3.38 0.00 -2.00 0.47 119.26 124.02 3fjm h ALA 57 Ca 0.64 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.46 3fjm h ALA 57 Cb 1.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.26 3fjm h ALA 57 CO -0.39 0.13 0.00 1.79 0.00 0.00 0.00 179.25 180.77 3fjm h THR 58 N 0.00 0.00 0.00 0.00 1.35 -1.25 -3.36 112.91 109.65 3fjm h THR 58 Ca -0.00 -0.66 0.00 0.00 -0.55 0.00 0.00 66.41 65.20 3fjm h THR 58 Cb 0.33 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 3fjm h THR 58 CO 0.01 0.00 0.00 -2.67 -0.25 0.00 0.00 175.52 172.61 3fjm n TRP 59 N -2.73 0.00 0.02 4.73 4.27 -0.96 -4.92 117.44 117.85 3fjm n TRP 59 Ca 0.04 0.00 -0.10 0.00 -3.89 0.00 0.00 57.50 53.55 3fjm n TRP 59 Cb 0.42 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.34 3fjm n TRP 59 CO 0.00 0.00 0.00 0.35 -2.29 0.00 0.00 177.69 175.75 3fjm h PHE 60 N 0.00 -0.45 -0.62 -2.67 3.57 -1.06 0.10 116.94 115.81 3fjm h PHE 60 Ca 0.00 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.54 3fjm h PHE 60 Cb 0.22 0.22 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 3fjm h PHE 60 CO 0.00 -0.25 0.39 0.93 -2.23 0.00 0.00 178.31 177.15 3fjm h GLU 61 N -0.24 0.75 -0.38 1.11 4.39 -1.85 -1.89 114.58 116.47 3fjm h GLU 61 Ca 0.08 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 3fjm h GLU 61 Cb 0.36 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 3fjm h GLU 61 CO -0.23 0.50 0.04 0.87 -1.16 0.00 0.00 179.01 179.03 3fjm h LYS 62 N 0.78 0.65 -0.80 2.33 1.57 -1.85 -3.01 116.57 116.24 3fjm h LYS 62 Ca 0.24 -0.19 0.08 0.00 -1.87 0.00 0.00 60.65 58.92 3fjm h LYS 62 Cb -0.02 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.17 3fjm h LYS 62 CO -0.08 0.72 0.52 0.00 -0.57 0.00 0.00 179.45 180.04 3fjm h ALA 63 N 0.90 1.70 -0.01 3.86 0.00 -0.54 -0.43 119.26 124.74 3fjm h ALA 63 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3fjm h ALA 63 Cb 0.40 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3fjm h ALA 63 CO 0.01 0.16 0.03 0.87 0.00 0.00 0.00 179.25 180.32 3fjm h LYS 64 N 0.79 0.00 0.03 0.00 1.57 -1.21 0.43 116.57 118.19 3fjm h LYS 64 Ca 0.36 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.79 3fjm h LYS 64 Cb 0.35 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.61 3fjm h LYS 64 CO -0.13 0.00 -2.08 1.63 -0.57 0.00 0.00 179.45 178.30 3fjm n LYS 65 N -3.55 0.68 -0.22 3.15 4.76 -0.20 -4.77 118.16 118.01 3fjm n LYS 65 Ca -0.03 0.19 0.00 0.00 -2.87 0.00 0.00 58.31 55.60 3fjm n LYS 65 Cb 0.10 -1.66 0.00 0.00 -1.84 0.00 0.00 35.03 31.63 3fjm n LYS 65 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3fjm n ASP 66 N -3.12 0.00 -4.68 4.39 5.75 -1.05 -5.07 116.55 112.77 3fjm n ASP 66 Ca -0.29 -1.36 -0.42 0.00 -0.01 0.00 0.00 54.79 52.70 3fjm n ASP 66 Cb 1.07 -0.07 -0.03 0.00 -1.03 0.00 0.00 41.12 41.06 3fjm n ASP 66 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3fjm s ALA 67 N 0.00 3.67 -0.16 2.12 0.00 0.12 -4.61 121.76 122.90 3fjm s ALA 67 Ca 0.00 1.18 0.02 0.00 0.00 0.00 0.00 51.96 53.16 3fjm s ALA 67 Cb 0.00 -3.72 -0.23 0.00 0.00 0.00 0.00 23.12 19.17 3fjm s ALA 67 CO 0.00 -1.20 0.21 -0.25 0.00 0.00 0.00 175.76 174.52 3fjm n ASP 68 N 6.02 1.65 -3.87 0.00 8.00 0.03 -4.75 116.55 123.63 3fjm n ASP 68 Ca 0.16 0.12 -0.16 0.00 0.71 0.00 0.00 54.79 55.62 3fjm n ASP 68 Cb 0.41 -0.40 -0.15 0.00 -0.02 0.00 0.00 41.12 40.96 3fjm n ASP 68 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3fjm s ILE 69 N -2.55 0.21 -0.22 0.53 1.01 -1.01 -1.41 121.20 117.77 3fjm s ILE 69 Ca -0.22 -0.02 -0.08 0.00 0.00 0.00 0.00 60.65 60.33 3fjm s ILE 69 Cb 0.07 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.26 3fjm s ILE 69 CO 0.74 0.11 0.09 -0.76 0.00 0.00 0.00 174.94 175.12 3fjm s LEU 70 N 0.52 3.77 0.15 2.97 1.43 -0.55 -1.52 118.68 125.46 3fjm s LEU 70 Ca -0.05 0.00 0.05 0.00 -1.03 0.00 0.00 54.13 53.10 3fjm s LEU 70 Cb -0.08 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 3fjm s LEU 70 CO -0.01 0.09 0.10 0.72 0.23 0.00 0.00 176.35 177.47 3fjm s PHE 71 N 0.91 3.09 0.14 0.29 -0.71 -0.32 -1.21 117.98 120.18 3fjm s PHE 71 Ca 0.05 -0.03 0.05 0.00 -1.04 0.00 0.00 56.93 55.96 3fjm s PHE 71 Cb -0.14 -1.50 -0.04 0.00 -1.21 0.00 0.00 43.02 40.13 3fjm s PHE 71 CO 0.03 0.52 -0.12 0.20 -1.34 0.00 0.00 175.22 174.51 3fjm s GLY 72 N -2.94 1.10 0.00 1.99 0.00 0.03 -4.17 107.32 103.33 3fjm s GLY 72 Ca 0.30 -1.42 0.13 0.00 0.00 0.00 0.00 44.72 43.73 3fjm s GLY 72 CO 0.22 -1.50 0.95 0.00 0.00 0.00 0.00 173.10 172.77 3fjm n ALA 73 N 0.10 2.45 -3.73 3.20 0.00 -1.26 -2.61 120.51 118.65 3fjm n ALA 73 Ca -0.12 -0.67 -0.04 0.00 0.00 0.00 0.00 53.44 52.61 3fjm n ALA 73 Cb 0.59 -0.44 -0.01 0.00 0.00 0.00 0.00 19.45 19.59 3fjm n ALA 73 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3fjm s SER 74 N -1.06 -0.19 -0.08 0.00 1.04 -1.00 -4.42 113.70 107.98 3fjm s SER 74 Ca 0.16 -0.37 -0.27 0.00 0.48 0.00 0.00 55.95 55.95 3fjm s SER 74 Cb 0.11 0.48 -0.23 0.00 0.10 0.00 0.00 66.02 66.47 3fjm s SER 74 CO 0.16 -0.87 1.00 -0.78 0.98 0.00 0.00 173.24 173.73 3fjm h ASP 75 N 2.00 -0.00 -1.00 7.02 1.82 -1.95 -2.31 116.42 122.00 3fjm h ASP 75 Ca -0.24 -0.75 0.06 0.00 -0.39 0.00 0.00 57.03 55.71 3fjm h ASP 75 Cb 1.23 0.00 -0.07 0.00 0.68 0.00 0.00 39.33 41.18 3fjm h ASP 75 CO 0.26 0.75 0.65 0.06 -1.61 0.00 0.00 179.24 179.35 3fjm h GLN 76 N -0.76 1.14 -0.08 0.28 -0.00 -1.97 0.12 115.11 113.84 3fjm h GLN 76 Ca -0.00 -0.07 -0.20 0.00 -0.00 0.00 0.00 58.65 58.38 3fjm h GLN 76 Cb 0.75 -0.26 -0.00 0.00 -0.00 0.00 0.00 27.48 27.98 3fjm h GLN 76 CO 0.00 0.75 -0.77 0.66 -0.00 0.00 0.00 178.83 179.48 3fjm h SER 77 N 1.18 0.60 -0.49 0.06 4.64 -1.82 -2.07 113.55 115.65 3fjm h SER 77 Ca 0.43 -0.40 -0.11 0.00 -0.47 0.00 0.00 61.79 61.23 3fjm h SER 77 Cb 0.16 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 3fjm h SER 77 CO -0.17 1.16 -0.14 0.00 -0.87 0.00 0.00 176.83 176.82 3fjm h ALA 78 N 0.82 0.67 -0.67 5.18 0.00 -0.81 -0.90 119.26 123.56 3fjm h ALA 78 Ca -0.04 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.52 3fjm h ALA 78 Cb 1.37 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 3fjm h ALA 78 CO 0.14 0.60 0.44 1.25 0.00 0.00 0.00 179.25 181.67 3fjm h LEU 79 N 0.80 0.75 0.24 0.00 5.85 -0.75 -0.79 115.31 121.41 3fjm h LEU 79 Ca 0.12 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 3fjm h LEU 79 Cb 0.70 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.55 3fjm h LEU 79 CO 0.05 0.53 -0.12 0.00 -0.34 0.00 0.00 178.44 178.57 3fjm h ALA 80 N 1.25 -0.32 -0.21 1.25 0.00 -1.10 -1.86 119.26 118.27 3fjm h ALA 80 Ca 0.25 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3fjm h ALA 80 Cb -0.07 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3fjm h ALA 80 CO -0.07 -0.65 0.09 0.82 0.00 0.00 0.00 179.25 179.44 3fjm h ILE 81 N -0.39 1.16 -0.16 0.00 2.04 -1.04 -2.60 117.51 116.52 3fjm h ILE 81 Ca -0.03 -0.48 -0.02 0.00 1.00 0.00 0.00 64.86 65.33 3fjm h ILE 81 Cb 0.30 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 3fjm h ILE 81 CO 0.05 0.16 0.02 0.00 0.00 0.00 0.00 178.15 178.38 3fjm h ALA 82 N 0.93 1.74 0.00 1.87 0.00 -1.16 -1.51 119.26 121.14 3fjm h ALA 82 Ca 0.07 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3fjm h ALA 82 Cb 0.17 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3fjm h ALA 82 CO -0.01 0.20 -0.13 0.77 0.00 0.00 0.00 179.25 180.08 3fjm h SER 83 N 0.22 0.00 0.78 0.00 0.02 -0.95 -2.44 113.55 111.19 3fjm h SER 83 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3fjm h SER 83 Cb 0.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.66 3fjm h SER 83 CO -0.00 0.13 0.00 0.47 -1.14 0.00 0.00 176.83 176.29 3fjm n ASP 84 N -3.38 0.11 -0.13 3.07 8.00 -0.57 -3.47 116.55 120.19 3fjm n ASP 84 Ca -0.01 0.52 0.11 0.00 0.71 0.00 0.00 54.79 56.13 3fjm n ASP 84 Cb 0.33 -0.55 0.07 0.00 -0.02 0.00 0.00 41.12 40.95 3fjm n ASP 84 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3fjm n PHE 85 N -1.62 0.00 -4.62 1.24 3.72 -0.92 -5.05 117.46 110.21 3fjm n PHE 85 Ca 0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.45 3fjm n PHE 85 Cb 0.26 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 3fjm n PHE 85 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fjm n GLY 86 N 1.46 2.28 0.41 1.37 0.00 -1.23 -3.40 105.19 106.08 3fjm n GLY 86 Ca 0.07 -0.43 0.23 0.00 0.00 0.00 0.00 46.02 45.88 3fjm n GLY 86 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3fjm h LYS 87 N 0.00 0.00 -0.46 1.61 5.09 -1.95 -2.46 116.57 118.41 3fjm h LYS 87 Ca 0.00 0.00 0.07 0.00 0.09 0.00 0.00 60.65 60.81 3fjm h LYS 87 Cb 0.00 0.00 -0.03 0.00 0.10 0.00 0.00 32.23 32.30 3fjm h LYS 87 CO 0.00 0.00 0.31 -0.44 -2.09 0.00 0.00 179.45 177.23 3fjm h ASP 88 N 0.00 0.27 -4.11 7.07 3.32 -1.96 -3.41 116.42 117.60 3fjm h ASP 88 Ca 0.29 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.82 3fjm h ASP 88 Cb 1.21 -0.06 -0.30 0.00 0.22 0.00 0.00 39.33 40.41 3fjm h ASP 88 CO -0.00 0.17 -0.82 -0.36 -1.72 0.00 0.00 179.24 176.51 3fjm s PHE 89 N -5.30 1.47 -0.48 4.55 0.08 -0.93 -1.56 117.98 115.82 3fjm s PHE 89 Ca -0.07 -0.34 -0.16 0.00 0.12 0.00 0.00 56.93 56.49 3fjm s PHE 89 Cb 0.19 -0.97 0.08 0.00 -0.57 0.00 0.00 43.02 41.74 3fjm s PHE 89 CO 0.73 -0.08 0.41 1.21 -0.10 0.00 0.00 175.22 177.40 3fjm s ASN 90 N -0.19 6.15 0.65 1.36 3.04 -1.26 -4.71 114.94 119.99 3fjm s ASN 90 Ca 0.02 -1.34 0.35 0.00 0.04 0.00 0.00 52.86 51.93 3fjm s ASN 90 Cb -0.08 -2.19 1.92 0.00 -1.54 0.00 0.00 41.25 39.35 3fjm s ASN 90 CO 0.00 -0.67 2.12 -0.37 -3.04 0.00 0.00 177.10 175.14 3fjm h VAL 91 N 5.77 0.11 0.00 -5.21 -1.51 -1.92 0.59 116.25 114.07 3fjm h VAL 91 Ca -0.29 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 3fjm h VAL 91 Cb 1.11 0.82 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 3fjm h VAL 91 CO 0.89 0.00 0.00 -1.54 -1.23 0.00 0.00 177.57 175.69 3fjm n SER 92 N -3.17 0.00 -1.69 4.19 3.41 -1.26 -2.88 113.62 112.22 3fjm n SER 92 Ca -0.01 0.41 0.08 0.00 -0.26 0.00 0.00 58.87 59.08 3fjm n SER 92 Cb 0.27 -0.45 0.38 0.00 -0.26 0.00 0.00 64.21 64.14 3fjm n SER 92 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3fjm n LYS 93 N -1.45 4.30 -2.11 4.33 5.02 0.20 -4.95 118.16 123.48 3fjm n LYS 93 Ca 0.04 -3.03 -0.42 0.00 -2.02 0.00 0.00 58.31 52.88 3fjm n LYS 93 Cb 0.17 -2.08 -0.03 0.00 -0.02 0.00 0.00 35.03 33.06 3fjm n LYS 93 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3fjm s ILE 94 N -2.40 3.20 -0.34 -0.18 1.01 -1.14 -4.62 121.20 116.72 3fjm s ILE 94 Ca 0.52 0.83 -0.01 0.00 0.00 0.00 0.00 60.65 61.98 3fjm s ILE 94 Cb 0.38 -3.53 0.08 0.00 0.01 0.00 0.00 42.46 39.39 3fjm s ILE 94 CO 0.19 0.05 0.08 -0.54 0.00 0.00 0.00 174.94 174.72 3fjm s LYS 95 N 1.35 2.15 0.15 2.79 -0.14 0.00 -4.96 119.74 121.09 3fjm s LYS 95 Ca 0.66 -1.55 -0.31 0.00 -1.36 0.00 0.00 55.97 53.42 3fjm s LYS 95 Cb -0.38 -3.33 -0.08 0.00 -1.68 0.00 0.00 37.83 32.36 3fjm s LYS 95 CO 0.30 -0.83 1.32 -2.14 -0.76 0.00 0.00 175.35 173.25 3fjm s PRO 96 N 1.16 4.37 0.00 -1.68 0.02 -1.26 -2.04 135.00 135.57 3fjm s PRO 96 Ca 0.02 2.02 0.00 0.00 0.02 0.00 0.00 61.00 63.06 3fjm s PRO 96 Cb -0.21 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.08 3fjm s PRO 96 CO -0.03 -0.31 0.00 1.28 -0.33 0.00 0.00 177.00 177.60 3fjm n LEU 97 N 3.27 0.99 -4.09 -5.54 4.77 -0.18 -4.99 117.00 111.24 3fjm n LEU 97 Ca 0.08 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.96 3fjm n LEU 97 Cb 0.43 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.43 3fjm n LEU 97 CO 0.58 0.17 -0.17 -0.31 -1.33 0.00 0.00 177.39 176.32 3fjm s TYR 98 N -1.80 0.74 0.13 -1.77 2.02 -1.20 -4.82 117.35 110.64 3fjm s TYR 98 Ca 0.00 -1.08 0.00 0.00 -0.37 0.00 0.00 57.07 55.62 3fjm s TYR 98 Cb 0.00 -0.32 -0.04 0.00 -0.40 0.00 0.00 41.96 41.19 3fjm s TYR 98 CO 0.00 -0.63 0.00 -0.59 -1.57 0.00 0.00 175.55 172.76 3fjm s PHE 99 N -4.04 0.93 0.13 2.71 -0.71 -0.29 -0.40 117.98 116.30 3fjm s PHE 99 Ca 0.24 -1.08 -0.14 0.00 -1.04 0.00 0.00 56.93 54.91 3fjm s PHE 99 Cb 0.06 -0.54 0.02 0.00 -1.21 0.00 0.00 43.02 41.35 3fjm s PHE 99 CO 0.03 -0.33 0.36 -0.98 -1.34 0.00 0.00 175.22 172.96 3fjm s ARG 100 N -3.95 1.06 0.25 1.99 3.03 -0.59 -0.25 118.95 120.50 3fjm s ARG 100 Ca 0.19 -0.81 -0.12 0.00 2.03 0.00 0.00 55.73 57.03 3fjm s ARG 100 Cb 0.07 0.44 -0.08 0.00 -1.03 0.00 0.00 34.95 34.35 3fjm s ARG 100 CO -0.01 -0.40 0.61 -1.83 -1.13 0.00 0.00 175.30 172.54 3fjm s GLU 101 N -3.83 3.87 0.55 3.89 1.03 -1.26 -2.02 118.70 120.93 3fjm s GLU 101 Ca 0.05 0.41 -0.19 0.00 0.03 0.00 0.00 54.97 55.27 3fjm s GLU 101 Cb 0.02 -2.60 -0.05 0.00 -0.80 0.00 0.00 34.13 30.70 3fjm s GLU 101 CO -0.10 0.28 1.13 0.00 -1.33 0.00 0.00 175.26 175.24 3fjm s ALA 102 N -1.84 2.68 0.24 -0.84 0.00 -0.65 -2.01 121.76 119.32 3fjm s ALA 102 Ca 0.49 0.81 0.01 0.00 0.00 0.00 0.00 51.96 53.27 3fjm s ALA 102 Cb -0.11 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.60 3fjm s ALA 102 CO 0.20 -0.81 0.10 0.96 0.00 0.00 0.00 175.76 176.21 3fjm s ILE 103 N -1.80 0.38 -0.23 0.00 -4.36 0.44 -4.46 121.20 111.16 3fjm s ILE 103 Ca 0.73 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 59.04 3fjm s ILE 103 Cb -0.24 -2.58 -0.04 0.00 1.25 0.00 0.00 42.46 40.86 3fjm s ILE 103 CO 0.28 -0.02 0.09 -0.63 0.24 0.00 0.00 174.94 174.90 3fjm s ILE 104 N -3.89 4.66 -0.28 8.37 1.01 -0.72 -1.58 121.20 128.77 3fjm s ILE 104 Ca 0.38 -0.06 -0.12 0.00 0.00 0.00 0.00 60.65 60.85 3fjm s ILE 104 Cb 0.08 -3.16 -0.05 0.00 0.01 0.00 0.00 42.46 39.34 3fjm s ILE 104 CO 0.13 0.36 0.21 -0.22 0.00 0.00 0.00 174.94 175.42 3fjm s LEU 105 N 1.23 4.06 0.35 2.97 2.96 0.05 -0.12 118.68 130.17 3fjm s LEU 105 Ca 0.05 -0.01 0.07 0.00 -0.22 0.00 0.00 54.13 54.03 3fjm s LEU 105 Cb -0.14 -2.15 -0.02 0.00 0.50 0.00 0.00 46.19 44.37 3fjm s LEU 105 CO 0.04 -0.08 0.35 0.42 -1.32 0.00 0.00 176.35 175.76 3fjm s THR 106 N 1.79 3.52 0.73 3.68 -4.23 0.07 -0.89 115.64 120.31 3fjm s THR 106 Ca 0.08 -1.28 -0.14 0.00 -1.18 0.00 0.00 61.69 59.17 3fjm s THR 106 Cb -0.16 -3.20 0.04 0.00 1.34 0.00 0.00 72.50 70.52 3fjm s THR 106 CO 0.11 -0.14 1.17 -1.10 -0.54 0.00 0.00 174.62 174.11 3fjm s GLN 107 N -4.06 2.24 0.09 3.99 -1.52 -1.21 -0.09 119.66 119.09 3fjm s GLN 107 Ca 0.43 1.61 -0.37 0.00 -1.95 0.00 0.00 55.36 55.08 3fjm s GLN 107 Cb -0.06 -1.86 -0.17 0.00 -0.22 0.00 0.00 33.01 30.70 3fjm s GLN 107 CO 0.28 -1.72 1.34 1.63 -0.25 0.00 0.00 175.29 176.56 3fjm n LYS 108 N -2.80 1.15 0.00 2.91 4.76 -1.26 -0.83 118.16 122.09 3fjm n LYS 108 Ca 0.12 0.41 0.00 0.00 -2.87 0.00 0.00 58.31 55.98 3fjm n LYS 108 Cb 0.51 -2.06 0.00 0.00 -1.84 0.00 0.00 35.03 31.64 3fjm n LYS 108 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3fjm n GLY 109 N 2.52 1.68 3.77 0.72 0.00 -1.26 -4.46 105.19 108.16 3fjm n GLY 109 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.86 3fjm n GLY 109 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3fjm n ASN 110 N 0.00 -4.93 0.19 1.61 5.15 -0.01 -4.82 115.26 112.45 3fjm n ASN 110 Ca 0.00 -1.08 0.13 0.00 -0.60 0.00 0.00 54.58 53.03 3fjm n ASN 110 Cb 0.00 -3.01 0.70 0.00 -0.53 0.00 0.00 39.78 36.93 3fjm n ASN 110 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3fjm h PRO 111 N -2.05 0.00 -0.02 1.20 0.13 -1.78 0.02 132.00 129.50 3fjm h PRO 111 Ca -0.68 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 3fjm h PRO 111 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 3fjm h PRO 111 CO 0.49 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.54 3fjm n LEU 112 N -4.37 1.07 -3.63 1.56 4.77 -1.26 -4.93 117.00 110.21 3fjm n LEU 112 Ca 0.01 -0.37 -0.23 0.00 -0.03 0.00 0.00 56.01 55.39 3fjm n LEU 112 Cb 0.24 -0.01 0.07 0.00 -2.33 0.00 0.00 43.42 41.39 3fjm n LEU 112 CO 0.34 0.18 0.15 0.29 -1.33 0.00 0.00 177.39 177.02 3fjm n LYS 113 N -0.15 -6.86 -2.11 3.23 5.02 -0.01 -4.91 118.16 112.37 3fjm n LYS 113 Ca 0.20 0.77 -0.42 0.00 -2.02 0.00 0.00 58.31 56.83 3fjm n LYS 113 Cb 0.28 -5.73 -0.03 0.00 -0.02 0.00 0.00 35.03 29.53 3fjm n LYS 113 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3fjm s ILE 114 N -3.37 3.28 -0.60 -0.18 1.01 -1.26 -4.91 121.20 115.17 3fjm s ILE 114 Ca 0.40 0.84 0.14 0.00 0.00 0.00 0.00 60.65 62.03 3fjm s ILE 114 Cb -0.18 -3.54 -0.16 0.00 0.01 0.00 0.00 42.46 38.59 3fjm s ILE 114 CO 0.76 0.04 0.57 0.29 0.00 0.00 0.00 174.94 176.60 3fjm n LYS 115 N 4.60 2.16 -3.80 2.79 4.76 -1.26 -4.99 118.16 122.42 3fjm n LYS 115 Ca 0.13 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 3fjm n LYS 115 Cb 0.42 -1.18 0.00 0.00 -1.84 0.00 0.00 35.03 32.43 3fjm n LYS 115 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3fjm n GLY 116 N 1.37 -1.11 0.22 0.72 0.00 -1.26 -4.87 105.19 100.26 3fjm n GLY 116 Ca 0.02 -1.11 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 3fjm n GLY 116 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3fjm h LEU 117 N 0.00 0.74 -1.28 0.99 3.38 -1.96 -2.58 115.31 114.60 3fjm h LEU 117 Ca 0.00 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 57.55 3fjm h LEU 117 Cb 0.00 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 3fjm h LEU 117 CO 0.00 1.01 0.49 0.11 0.09 0.00 0.00 178.44 180.14 3fjm h LYS 118 N 0.48 0.97 -0.79 1.13 1.57 -2.00 -1.00 116.57 116.92 3fjm h LYS 118 Ca 0.07 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 3fjm h LYS 118 Cb 0.76 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.81 3fjm h LYS 118 CO 0.06 0.64 0.45 0.22 -0.57 0.00 0.00 179.45 180.25 3fjm h ASP 119 N 1.00 0.97 0.79 0.86 3.58 -1.88 -1.41 116.42 120.32 3fjm h ASP 119 Ca 0.27 -0.07 -0.00 0.00 0.42 0.00 0.00 57.03 57.65 3fjm h ASP 119 Cb -0.12 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 40.69 3fjm h ASP 119 CO -0.06 0.76 -0.01 -0.07 -2.88 0.00 0.00 179.24 176.99 3fjm h LEU 120 N 1.10 0.00 0.08 2.28 3.38 -0.81 -1.44 115.31 119.90 3fjm h LEU 120 Ca 0.28 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.95 3fjm h LEU 120 Cb -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3fjm h LEU 120 CO -0.05 0.01 -1.55 0.00 0.09 0.00 0.00 178.44 176.94 3fjm h ALA 121 N 1.99 0.40 0.00 1.53 0.00 -0.83 -3.38 119.26 118.97 3fjm h ALA 121 Ca -0.00 -1.18 0.00 0.00 0.00 0.00 0.00 54.91 53.73 3fjm h ALA 121 Cb 0.40 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3fjm h ALA 121 CO 0.00 1.26 -1.06 0.09 0.00 0.00 0.00 179.25 179.54 3fjm n ASN 122 N -3.36 0.74 -4.99 0.00 3.02 -0.78 -4.31 115.26 105.58 3fjm n ASN 122 Ca -0.16 0.23 -0.19 0.00 -0.03 0.00 0.00 54.58 54.43 3fjm n ASN 122 Cb 1.03 0.59 -0.00 0.00 -0.61 0.00 0.00 39.78 40.79 3fjm n ASN 122 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3fjm s LYS 123 N -3.35 3.13 -0.65 3.52 1.02 -0.57 -5.05 119.74 117.79 3fjm s LYS 123 Ca -0.00 -0.98 -0.22 0.00 0.02 0.00 0.00 55.97 54.79 3fjm s LYS 123 Cb 0.11 -2.81 0.07 0.00 -0.52 0.00 0.00 37.83 34.68 3fjm s LYS 123 CO 0.80 0.06 0.93 0.15 -0.92 0.00 0.00 175.35 176.37 3fjm s LYS 124 N -4.18 3.11 0.02 1.68 3.01 -1.26 -4.90 119.74 117.22 3fjm s LYS 124 Ca 0.45 -0.87 0.00 0.00 -1.01 0.00 0.00 55.97 54.54 3fjm s LYS 124 Cb -0.10 -4.22 -0.02 0.00 -1.01 0.00 0.00 37.83 32.48 3fjm s LYS 124 CO 0.31 -1.77 -0.04 0.14 0.51 0.00 0.00 175.35 174.51 3fjm s VAL 125 N 3.89 0.17 -0.34 3.17 -7.23 -1.26 -5.12 120.40 113.68 3fjm s VAL 125 Ca 0.21 -0.84 -0.17 0.00 -1.81 0.00 0.00 61.98 59.37 3fjm s VAL 125 Cb -0.18 -0.29 -0.01 0.00 0.56 0.00 0.00 36.38 36.46 3fjm s VAL 125 CO 0.10 -0.42 0.48 -0.13 -0.31 0.00 0.00 175.10 174.82 3fjm s ARG 126 N -1.32 3.67 -0.09 4.82 0.52 -1.26 -4.65 118.95 120.64 3fjm s ARG 126 Ca -0.13 -0.15 -0.00 0.00 -0.52 0.00 0.00 55.73 54.92 3fjm s ARG 126 Cb -0.09 -3.79 -0.03 0.00 0.52 0.00 0.00 34.95 31.57 3fjm s ARG 126 CO -0.01 -0.58 -0.06 0.42 0.02 0.00 0.00 175.30 175.09 3fjm s ILE 127 N 2.31 3.73 -0.04 1.52 1.01 -0.25 0.04 121.20 129.51 3fjm s ILE 127 Ca 0.17 -0.45 0.05 0.00 0.00 0.00 0.00 60.65 60.42 3fjm s ILE 127 Cb -0.16 -2.56 -0.02 0.00 0.01 0.00 0.00 42.46 39.73 3fjm s ILE 127 CO 0.12 0.57 -0.17 0.54 0.00 0.00 0.00 174.94 176.01 3fjm s VAL 128 N -0.48 2.82 -0.04 2.92 0.11 0.08 -0.87 120.40 124.94 3fjm s VAL 128 Ca 0.07 -0.82 -0.03 0.00 -2.93 0.00 0.00 61.98 58.27 3fjm s VAL 128 Cb -0.12 -2.08 0.02 0.00 -1.53 0.00 0.00 36.38 32.67 3fjm s VAL 128 CO 0.02 0.59 0.11 0.68 -3.33 0.00 0.00 175.10 173.17 3fjm s VAL 129 N -0.70 -0.01 -0.07 2.04 -7.23 -0.92 -2.01 120.40 111.50 3fjm s VAL 129 Ca 0.11 0.03 -0.30 0.00 -1.81 0.00 0.00 61.98 60.02 3fjm s VAL 129 Cb -0.10 -0.17 -0.02 0.00 0.56 0.00 0.00 36.38 36.65 3fjm s VAL 129 CO 0.00 0.01 1.08 -2.84 -0.31 0.00 0.00 175.10 173.04 3fjm s PRO 130 N 0.25 4.42 -0.02 4.82 0.02 -1.26 -1.65 135.00 141.58 3fjm s PRO 130 Ca -0.02 1.51 0.00 0.00 0.02 0.00 0.00 61.00 62.51 3fjm s PRO 130 Cb -0.03 -3.53 0.03 0.00 0.02 0.00 0.00 34.50 31.00 3fjm s PRO 130 CO -0.01 -0.32 0.02 -1.21 -0.33 0.00 0.00 177.00 175.15 3fjm s GLU 131 N 1.91 0.05 0.35 5.54 0.41 0.24 -3.52 118.70 123.67 3fjm s GLU 131 Ca 0.52 0.15 0.12 0.00 -0.41 0.00 0.00 54.97 55.35 3fjm s GLU 131 Cb -0.21 -0.30 0.65 0.00 -1.78 0.00 0.00 34.13 32.49 3fjm s GLU 131 CO 0.21 -0.15 1.78 0.78 -0.49 0.00 0.00 175.26 177.39 3fjm h GLY 132 N 7.24 0.00 -2.61 -1.39 0.00 -1.80 -3.37 103.07 101.13 3fjm h GLY 132 Ca -0.44 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.57 3fjm h GLY 132 CO 0.48 0.00 -0.36 0.00 0.00 0.00 0.00 176.54 176.66 3fjm n ALA 133 N -2.45 -0.53 -0.97 3.60 0.00 -1.26 -1.78 120.51 117.12 3fjm n ALA 133 Ca -0.02 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.60 3fjm n ALA 133 Cb 0.45 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.19 3fjm n ALA 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3fjm n GLY 134 N -0.65 0.57 0.00 0.00 0.00 -1.26 -4.78 105.19 99.06 3fjm n GLY 134 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3fjm n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3fjm n LYS 135 N -2.18 0.32 -3.98 1.61 4.76 -0.73 -5.04 118.16 112.92 3fjm n LYS 135 Ca 0.00 -0.16 -0.13 0.00 -2.87 0.00 0.00 58.31 55.15 3fjm n LYS 135 Cb 0.05 -0.60 -0.13 0.00 -1.84 0.00 0.00 35.03 32.51 3fjm n LYS 135 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3fjm s SER 136 N -0.09 0.29 -0.51 4.39 0.15 -0.78 -5.11 113.70 112.03 3fjm s SER 136 Ca 0.00 -0.17 -0.13 0.00 0.70 0.00 0.00 55.95 56.34 3fjm s SER 136 Cb 0.00 0.01 0.12 0.00 -1.71 0.00 0.00 66.02 64.44 3fjm s SER 136 CO 0.00 -0.06 0.43 0.20 1.20 0.00 0.00 173.24 175.01 3fjm s ASN 137 N -0.47 6.00 0.05 5.45 0.01 -1.26 -4.22 114.94 120.50 3fjm s ASN 137 Ca -0.04 -1.80 0.05 0.00 -0.71 0.00 0.00 52.86 50.36 3fjm s ASN 137 Cb -0.03 -2.13 -0.02 0.00 0.41 0.00 0.00 41.25 39.47 3fjm s ASN 137 CO -0.00 -0.78 -0.13 0.28 -1.51 0.00 0.00 177.10 174.96 3fjm s THR 138 N 1.51 1.04 -0.10 1.60 -1.32 -1.26 -4.89 115.64 112.23 3fjm s THR 138 Ca 0.04 -1.05 0.27 0.00 -1.21 0.00 0.00 61.69 59.74 3fjm s THR 138 Cb -0.28 -0.97 0.27 0.00 -1.51 0.00 0.00 72.50 70.01 3fjm s THR 138 CO 0.02 -0.07 1.81 0.77 -2.21 0.00 0.00 174.62 174.93 3fjm h SER 139 N 4.79 0.00 1.85 8.08 4.64 -1.93 -2.99 113.55 127.99 3fjm h SER 139 Ca -0.38 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3fjm h SER 139 Cb 1.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3fjm h SER 139 CO 0.43 0.00 -0.01 1.23 -0.87 0.00 0.00 176.83 177.61 3fjm h GLY 140 N 0.61 0.00 -5.72 -0.77 0.00 -1.94 -3.46 103.07 91.79 3fjm h GLY 140 Ca 0.00 0.00 -0.59 0.00 0.00 0.00 0.00 47.33 46.74 3fjm h GLY 140 CO 0.00 0.00 1.18 2.41 0.00 0.00 0.00 176.54 180.13 3fjm n THR 141 N -3.10 0.63 -0.04 4.70 -1.04 -1.13 -1.45 114.28 112.85 3fjm n THR 141 Ca 0.03 -0.14 0.00 0.00 -2.04 0.00 0.00 64.05 61.90 3fjm n THR 141 Cb 0.51 -2.07 0.00 0.00 -1.82 0.00 0.00 70.33 66.95 3fjm n THR 141 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3fjm n GLY 142 N 4.60 1.28 0.23 3.41 0.00 -1.26 -4.96 105.19 108.48 3fjm n GLY 142 Ca 0.23 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 3fjm n GLY 142 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3fjm h VAL 143 N 0.00 0.59 -0.82 1.61 2.07 -1.57 -2.53 116.25 115.61 3fjm h VAL 143 Ca 0.00 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 3fjm h VAL 143 Cb 0.00 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 3fjm h VAL 143 CO 0.00 0.09 0.49 4.11 0.02 0.00 0.00 177.57 182.28 3fjm h TRP 144 N -0.81 1.08 -0.09 1.57 5.08 -1.93 -2.07 115.95 118.79 3fjm h TRP 144 Ca -0.05 -0.00 -0.14 0.00 1.08 0.00 0.00 58.89 59.78 3fjm h TRP 144 Cb 0.53 -0.35 -0.01 0.00 -3.00 0.00 0.00 29.16 26.32 3fjm h TRP 144 CO 0.02 0.72 -0.56 1.05 -1.28 0.00 0.00 178.44 178.39 3fjm h GLU 145 N 1.13 0.27 -0.10 0.12 4.11 -1.95 -1.79 114.58 116.36 3fjm h GLU 145 Ca 0.29 -0.17 -0.11 0.00 0.07 0.00 0.00 59.36 59.44 3fjm h GLU 145 Cb -0.04 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3fjm h GLU 145 CO -0.05 0.76 -0.43 -0.44 0.07 0.00 0.00 179.01 178.91 3fjm h ASP 146 N 0.20 0.23 0.08 3.06 3.32 -0.99 -0.68 116.42 121.66 3fjm h ASP 146 Ca -0.00 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 3fjm h ASP 146 Cb 1.05 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.54 3fjm h ASP 146 CO 0.09 0.64 -0.04 0.24 -1.72 0.00 0.00 179.24 178.45 3fjm h MET 147 N 0.18 -0.11 0.00 3.56 2.86 -1.19 -3.31 114.93 116.92 3fjm h MET 147 Ca 0.01 0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 3fjm h MET 147 Cb 0.84 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.51 3fjm h MET 147 CO 0.07 0.25 -0.27 0.97 1.06 0.00 0.00 176.91 178.98 3fjm h ILE 148 N -0.98 0.87 0.00 -1.22 6.09 -1.41 -2.26 117.51 118.60 3fjm h ILE 148 Ca -0.01 -1.07 -0.01 0.00 -1.37 0.00 0.00 64.86 62.40 3fjm h ILE 148 Cb 0.41 1.64 -0.00 0.00 0.47 0.00 0.00 36.82 39.34 3fjm h ILE 148 CO 0.02 0.27 -0.05 1.23 -3.07 0.00 0.00 178.15 176.55 3fjm h GLY 149 N 1.35 0.00 1.29 8.18 0.00 -1.25 -1.93 103.07 110.72 3fjm h GLY 149 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3fjm h GLY 149 CO 0.04 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.12 3fjm n ARG 150 N -3.68 0.50 0.17 4.80 1.74 -0.85 -1.28 116.66 118.05 3fjm n ARG 150 Ca -0.02 0.04 0.13 0.00 -0.77 0.00 0.00 57.85 57.23 3fjm n ARG 150 Cb 0.15 -1.50 0.41 0.00 -1.02 0.00 0.00 32.46 30.50 3fjm n ARG 150 CO 0.00 0.00 0.00 1.79 -1.52 0.00 0.00 177.63 177.90 3fjm h THR 151 N 0.00 0.00 -6.29 0.55 1.35 -1.52 -3.48 112.91 103.53 3fjm h THR 151 Ca 0.00 -0.57 -0.47 0.00 -0.55 0.00 0.00 66.41 64.82 3fjm h THR 151 Cb 0.10 1.51 -0.03 0.00 -1.73 0.00 0.00 68.15 68.01 3fjm h THR 151 CO 0.00 0.00 -0.76 0.00 -0.25 0.00 0.00 175.52 174.51 3fjm n GLN 152 N -2.62 -5.62 -3.61 4.72 6.02 -0.41 -4.96 117.38 110.90 3fjm n GLN 152 Ca 0.04 0.61 -0.26 0.00 -0.01 0.00 0.00 57.00 57.37 3fjm n GLN 152 Cb 0.39 -5.50 -0.17 0.00 1.02 0.00 0.00 30.24 25.98 3fjm n GLN 152 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3fjm s ASP 153 N -3.32 2.30 0.39 1.08 2.15 -1.26 -5.03 116.67 112.97 3fjm s ASP 153 Ca 0.65 -0.59 0.06 0.00 0.43 0.00 0.00 52.55 53.10 3fjm s ASP 153 Cb -0.33 -0.23 0.77 0.00 -0.30 0.00 0.00 42.92 42.83 3fjm s ASP 153 CO 0.83 -0.35 2.01 -0.29 -0.17 0.00 0.00 175.17 177.20 3fjm h ILE 154 N 6.42 1.13 -0.73 4.11 6.09 -1.97 -1.49 117.51 131.07 3fjm h ILE 154 Ca -0.15 -0.33 -0.04 0.00 -1.37 0.00 0.00 64.86 62.97 3fjm h ILE 154 Cb 1.15 0.55 -0.03 0.00 0.47 0.00 0.00 36.82 38.96 3fjm h ILE 154 CO 0.29 0.15 0.30 0.50 -3.07 0.00 0.00 178.15 176.31 3fjm h LYS 155 N 0.59 1.08 -0.50 2.19 3.64 -1.98 0.13 116.57 121.72 3fjm h LYS 155 Ca 0.15 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.26 3fjm h LYS 155 Cb 0.01 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 3fjm h LYS 155 CO -0.03 0.88 0.01 1.15 -2.27 0.00 0.00 179.45 179.19 3fjm h THR 156 N 1.04 1.26 -0.33 1.00 2.02 -1.73 0.12 112.91 116.29 3fjm h THR 156 Ca 0.24 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 3fjm h THR 156 Cb 0.20 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 3fjm h THR 156 CO -0.02 0.38 0.18 0.40 0.37 0.00 0.00 175.52 176.83 3fjm h ILE 157 N 0.74 1.13 -0.48 3.11 2.04 -0.92 -0.84 117.51 122.29 3fjm h ILE 157 Ca 0.14 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.66 3fjm h ILE 157 Cb 0.51 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 3fjm h ILE 157 CO 0.02 0.13 0.31 1.56 0.00 0.00 0.00 178.15 180.18 3fjm h GLN 158 N 0.41 0.63 -0.59 2.37 4.20 -0.60 -1.59 115.11 119.94 3fjm h GLN 158 Ca 0.12 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.76 3fjm h GLN 158 Cb 0.05 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 3fjm h GLN 158 CO -0.02 0.42 0.26 -0.91 -0.67 0.00 0.00 178.83 177.92 3fjm h ASN 159 N 0.65 0.78 -0.09 1.46 2.35 -0.73 -0.37 115.58 119.62 3fjm h ASN 159 Ca 0.17 -0.15 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 3fjm h ASN 159 Cb -0.07 -0.20 -0.00 0.00 0.05 0.00 0.00 38.32 38.09 3fjm h ASN 159 CO -0.04 0.71 0.05 0.15 -1.65 0.00 0.00 177.43 176.65 3fjm h PHE 160 N 0.80 0.13 -0.80 1.19 3.57 -1.02 -2.95 116.94 117.86 3fjm h PHE 160 Ca 0.20 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.70 3fjm h PHE 160 Cb 0.15 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 3fjm h PHE 160 CO 0.00 0.17 0.50 -0.09 -2.23 0.00 0.00 178.31 176.66 3fjm h ARG 161 N 0.05 1.07 0.00 1.11 2.43 -1.04 -1.17 114.38 116.83 3fjm h ARG 161 Ca 0.03 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.12 3fjm h ARG 161 Cb 0.08 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 3fjm h ARG 161 CO -0.00 0.73 -0.01 -0.91 -1.51 0.00 0.00 179.97 178.26 3fjm h ASN 162 N 1.09 0.00 0.54 -3.80 -0.26 -0.90 -1.58 115.58 110.68 3fjm h ASN 162 Ca 0.29 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.03 3fjm h ASN 162 Cb -0.08 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.18 3fjm h ASN 162 CO -0.06 0.01 -0.40 0.59 -1.06 0.00 0.00 177.43 176.51 3fjm n ASN 163 N -3.40 0.47 -4.61 5.81 3.02 -0.45 -4.81 115.26 111.29 3fjm n ASN 163 Ca -0.03 -0.21 -0.43 0.00 -0.03 0.00 0.00 54.58 53.88 3fjm n ASN 163 Cb 0.10 0.13 -0.02 0.00 -0.61 0.00 0.00 39.78 39.38 3fjm n ASN 163 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3fjm s ILE 164 N -2.95 3.92 -0.19 2.41 1.01 -0.59 -1.10 121.20 123.71 3fjm s ILE 164 Ca 0.13 0.99 0.21 0.00 0.00 0.00 0.00 60.65 61.97 3fjm s ILE 164 Cb 0.18 -4.10 -0.06 0.00 0.01 0.00 0.00 42.46 38.50 3fjm s ILE 164 CO 0.66 -0.60 0.95 1.33 0.00 0.00 0.00 174.94 177.28 3fjm n VAL 165 N 6.76 0.80 -3.68 2.92 0.24 -0.05 -4.88 118.33 120.44 3fjm n VAL 165 Ca 0.17 -0.60 -0.09 0.00 -2.04 0.00 0.00 64.34 61.78 3fjm n VAL 165 Cb 0.47 -0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 32.28 3fjm n VAL 165 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3fjm s ALA 166 N -3.22 -1.17 -0.22 2.33 0.00 -1.19 -5.05 121.76 113.24 3fjm s ALA 166 Ca -0.02 1.60 -0.13 0.00 0.00 0.00 0.00 51.96 53.42 3fjm s ALA 166 Cb 0.09 -1.14 -0.05 0.00 0.00 0.00 0.00 23.12 22.03 3fjm s ALA 166 CO 0.80 -0.48 0.25 -0.06 0.00 0.00 0.00 175.76 176.27 3fjm s PHE 167 N 1.93 3.34 0.18 0.00 0.08 -1.26 -2.15 117.98 120.09 3fjm s PHE 167 Ca -0.06 0.38 0.11 0.00 0.12 0.00 0.00 56.93 57.47 3fjm s PHE 167 Cb -0.10 -2.36 -0.04 0.00 -0.57 0.00 0.00 43.02 39.95 3fjm s PHE 167 CO -0.13 0.04 -0.24 0.14 -0.10 0.00 0.00 175.22 174.93 3fjm s VAL 168 N 1.13 2.40 -0.13 -0.44 -7.23 -0.66 -4.87 120.40 110.60 3fjm s VAL 168 Ca 0.12 -1.93 0.30 0.00 -1.81 0.00 0.00 61.98 58.65 3fjm s VAL 168 Cb -0.14 -2.13 0.33 0.00 0.56 0.00 0.00 36.38 35.00 3fjm s VAL 168 CO 0.06 -0.06 1.88 1.55 -0.31 0.00 0.00 175.10 178.21 3fjm h PRO 169 N 3.35 0.00 -2.69 4.82 0.13 -1.90 0.70 132.00 136.41 3fjm h PRO 169 Ca -0.48 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.74 3fjm h PRO 169 Cb 1.20 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.24 3fjm h PRO 169 CO 0.46 0.00 0.34 0.54 -0.23 0.00 0.00 178.00 179.11 3fjm s ASN 170 N -5.06 -0.33 0.33 1.44 2.20 -1.26 -4.47 114.94 107.80 3fjm s ASN 170 Ca 0.02 -0.31 0.04 0.00 -0.94 0.00 0.00 52.86 51.67 3fjm s ASN 170 Cb 0.09 0.57 0.59 0.00 -2.00 0.00 0.00 41.25 40.50 3fjm s ASN 170 CO 0.47 -1.01 1.89 0.28 -2.94 0.00 0.00 177.10 175.79 3fjm h SER 171 N 2.00 0.54 -0.84 3.54 0.02 -1.92 -2.14 113.55 114.75 3fjm h SER 171 Ca -0.24 -0.09 0.04 0.00 -0.84 0.00 0.00 61.79 60.66 3fjm h SER 171 Cb 1.26 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 63.61 3fjm h SER 171 CO 0.29 0.57 0.55 1.23 -1.14 0.00 0.00 176.83 178.33 3fjm h GLY 172 N 0.83 1.19 1.29 -3.77 0.00 -1.97 0.42 103.07 101.07 3fjm h GLY 172 Ca 0.13 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 46.93 3fjm h GLY 172 CO 0.00 0.33 -0.26 1.76 0.00 0.00 0.00 176.54 178.37 3fjm h SER 173 N 1.01 0.83 -0.53 0.19 0.02 -1.81 -2.23 113.55 111.03 3fjm h SER 173 Ca 0.34 -0.32 -0.06 0.00 -0.84 0.00 0.00 61.79 60.91 3fjm h SER 173 Cb 0.08 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 3fjm h SER 173 CO -0.11 1.05 0.09 0.00 -1.14 0.00 0.00 176.83 176.72 3fjm h ALA 174 N 1.01 0.70 -0.62 3.77 0.00 -1.05 -1.76 119.26 121.31 3fjm h ALA 174 Ca 0.09 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3fjm h ALA 174 Cb 0.79 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3fjm h ALA 174 CO 0.07 0.44 0.40 -0.09 0.00 0.00 0.00 179.25 180.06 3fjm h ARG 175 N 0.76 0.83 -0.20 0.00 2.43 -0.77 0.15 114.38 117.59 3fjm h ARG 175 Ca 0.16 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 3fjm h ARG 175 Cb 0.39 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 3fjm h ARG 175 CO 0.01 0.57 0.05 -0.22 -1.51 0.00 0.00 179.97 178.86 3fjm h LYS 176 N 0.84 0.31 -0.39 0.20 3.64 -1.28 0.51 116.57 120.41 3fjm h LYS 176 Ca 0.23 -0.07 0.04 0.00 -1.27 0.00 0.00 60.65 59.57 3fjm h LYS 176 Cb -0.07 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.67 3fjm h LYS 176 CO -0.05 0.44 0.17 1.25 -2.27 0.00 0.00 179.45 178.99 3fjm h LEU 177 N 0.13 0.24 -0.71 5.20 7.12 -1.08 -1.93 115.31 124.28 3fjm h LEU 177 Ca 0.06 0.03 -0.01 0.00 0.13 0.00 0.00 57.88 58.09 3fjm h LEU 177 Cb 0.26 -0.01 -0.03 0.00 -0.53 0.00 0.00 40.66 40.35 3fjm h LEU 177 CO 0.00 0.18 0.41 0.15 -0.13 0.00 0.00 178.44 179.04 3fjm h PHE 178 N 0.36 0.96 0.00 1.25 3.04 -0.48 -2.24 116.94 119.83 3fjm h PHE 178 Ca 0.17 -0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.05 3fjm h PHE 178 Cb 0.10 -0.31 -0.01 0.00 2.56 0.00 0.00 35.95 38.29 3fjm h PHE 178 CO -0.12 0.67 -0.24 0.00 -2.02 0.00 0.00 178.31 176.60 3fjm h ALA 179 N 1.21 1.38 -0.26 2.41 0.00 -0.47 -1.39 119.26 122.13 3fjm h ALA 179 Ca 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3fjm h ALA 179 Cb 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3fjm h ALA 179 CO -0.04 0.30 0.00 1.04 0.00 0.00 0.00 179.25 180.54 3fjm n GLN 180 N -3.92 1.66 -2.56 0.00 6.02 -0.76 -4.89 117.38 112.93 3fjm n GLN 180 Ca -0.02 -0.97 -0.19 0.00 -0.01 0.00 0.00 57.00 55.81 3fjm n GLN 180 Cb 0.32 -1.24 0.01 0.00 1.02 0.00 0.00 30.24 30.35 3fjm n GLN 180 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 3fjm n ASP 181 N 0.28 -5.45 -0.12 1.08 8.00 -0.52 -4.88 116.55 114.93 3fjm n ASP 181 Ca 0.09 -0.10 0.13 0.00 0.71 0.00 0.00 54.79 55.61 3fjm n ASP 181 Cb 0.25 -4.43 0.33 0.00 -0.02 0.00 0.00 41.12 37.24 3fjm n ASP 181 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fjm n GLN 182 N -3.09 0.43 -3.88 -1.24 1.13 -0.88 -4.88 117.38 104.97 3fjm n GLN 182 Ca -0.18 -0.24 -0.11 0.00 -1.94 0.00 0.00 57.00 54.53 3fjm n GLN 182 Cb 0.65 -1.49 -0.11 0.00 0.11 0.00 0.00 30.24 29.39 3fjm n GLN 182 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3fjm s ALA 183 N -2.74 -0.25 -0.02 -1.58 0.00 -1.26 -4.95 121.76 110.96 3fjm s ALA 183 Ca 0.18 -0.08 0.12 0.00 0.00 0.00 0.00 51.96 52.18 3fjm s ALA 183 Cb 0.18 0.03 -0.18 0.00 0.00 0.00 0.00 23.12 23.16 3fjm s ALA 183 CO 0.60 -0.16 0.94 -0.44 0.00 0.00 0.00 175.76 176.70 3fjm h ASP 184 N 4.78 0.00 -3.67 0.00 3.32 -0.73 -3.46 116.42 116.65 3fjm h ASP 184 Ca -0.29 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.55 3fjm h ASP 184 Cb 1.20 0.00 -0.28 0.00 0.22 0.00 0.00 39.33 40.47 3fjm h ASP 184 CO 0.41 0.88 -0.58 0.00 -1.72 0.00 0.00 179.24 178.23 3fjm s ALA 185 N -2.72 -0.30 -0.19 3.45 0.00 -0.39 -3.36 121.76 118.26 3fjm s ALA 185 Ca -0.02 0.45 0.01 0.00 0.00 0.00 0.00 51.96 52.40 3fjm s ALA 185 Cb 0.09 -0.28 0.03 0.00 0.00 0.00 0.00 23.12 22.95 3fjm s ALA 185 CO 0.81 -0.09 -0.17 -0.46 0.00 0.00 0.00 175.76 175.86 3fjm s TRP 186 N 0.39 2.68 -0.43 0.00 -0.00 -0.07 -0.74 118.94 120.78 3fjm s TRP 186 Ca -0.03 -1.64 -0.29 0.00 -0.00 0.00 0.00 56.10 54.14 3fjm s TRP 186 Cb -0.04 -1.83 0.02 0.00 -0.00 0.00 0.00 33.47 31.62 3fjm s TRP 186 CO -0.02 -0.78 1.22 0.42 -0.00 0.00 0.00 176.95 177.79 3fjm s ILE 187 N 1.32 4.15 0.00 5.86 -1.09 -0.85 -0.77 121.20 129.81 3fjm s ILE 187 Ca 0.03 1.21 0.00 0.00 -2.23 0.00 0.00 60.65 59.65 3fjm s ILE 187 Cb -0.14 -4.43 0.00 0.00 -1.58 0.00 0.00 42.46 36.31 3fjm s ILE 187 CO -0.11 -0.83 0.00 1.07 -1.23 0.00 0.00 174.94 173.84 3fjm n THR 188 N 6.74 0.00 -4.27 2.92 5.66 -0.61 -4.56 114.28 120.16 3fjm n THR 188 Ca 0.13 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.85 3fjm n THR 188 Cb 0.48 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.16 3fjm n THR 188 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 175.07 172.28 3fjm s TRP 189 N -1.40 2.66 0.39 1.09 0.52 -1.26 -0.42 118.94 120.52 3fjm s TRP 189 Ca 0.00 -0.20 0.13 0.00 0.02 0.00 0.00 56.10 56.05 3fjm s TRP 189 Cb 0.00 -1.36 0.95 0.00 -1.15 0.00 0.00 33.47 31.92 3fjm s TRP 189 CO 0.00 0.45 1.88 0.97 0.02 0.00 0.00 176.95 180.28 3fjm h ILE 190 N 3.09 0.79 -0.01 2.03 6.09 -1.71 -1.51 117.51 126.28 3fjm h ILE 190 Ca -0.48 -0.18 -0.04 0.00 -1.37 0.00 0.00 64.86 62.78 3fjm h ILE 190 Cb 1.18 0.20 -0.01 0.00 0.47 0.00 0.00 36.82 38.67 3fjm h ILE 190 CO 0.52 0.10 -0.19 -2.24 -3.07 0.00 0.00 178.15 173.26 3fjm h ASP 191 N 0.54 0.01 -0.35 2.19 2.03 -1.86 -0.96 116.42 118.02 3fjm h ASP 191 Ca 0.43 -0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 56.65 3fjm h ASP 191 Cb 0.86 -0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.34 3fjm h ASP 191 CO -0.17 0.20 -0.03 -0.50 -1.03 0.00 0.00 179.24 177.71 3fjm h TRP 192 N 0.01 0.78 -0.13 4.15 4.06 -1.58 0.67 115.95 123.92 3fjm h TRP 192 Ca 0.00 -0.11 -0.08 0.00 2.06 0.00 0.00 58.89 60.76 3fjm h TRP 192 Cb 0.35 -0.21 -0.00 0.00 -1.00 0.00 0.00 29.16 28.29 3fjm h TRP 192 CO 0.00 0.75 -0.22 1.03 -3.56 0.00 0.00 178.44 176.45 3fjm h SER 193 N 0.68 0.41 -0.95 -3.49 0.87 -1.31 -2.82 113.55 106.95 3fjm h SER 193 Ca 0.13 -0.54 -0.01 0.00 -1.23 0.00 0.00 61.79 60.15 3fjm h SER 193 Cb 0.47 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.27 3fjm h SER 193 CO 0.02 0.87 0.57 0.11 -0.53 0.00 0.00 176.83 177.88 3fjm h LYS 194 N -0.03 1.29 0.00 2.24 1.79 -1.05 -1.84 116.57 118.97 3fjm h LYS 194 Ca 0.01 -0.12 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 3fjm h LYS 194 Cb 0.79 -0.27 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 3fjm h LYS 194 CO 0.05 0.90 0.00 0.77 -1.08 0.00 0.00 179.45 180.09 3fjm h SER 195 N 1.31 0.00 -2.00 0.86 0.02 -0.89 -3.36 113.55 109.48 3fjm h SER 195 Ca 0.34 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.73 3fjm h SER 195 Cb -0.05 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 62.09 3fjm h SER 195 CO -0.06 0.00 -1.10 0.59 -1.14 0.00 0.00 176.83 175.12 3fjm n ASN 196 N -2.89 0.27 0.18 3.07 3.02 -0.71 -4.96 115.26 113.25 3fjm n ASN 196 Ca 0.01 -2.71 0.18 0.00 -0.03 0.00 0.00 54.58 52.02 3fjm n ASN 196 Cb 0.30 -0.64 0.81 0.00 -0.61 0.00 0.00 39.78 39.63 3fjm n ASN 196 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3fjm h PRO 197 N 3.99 0.00 0.00 3.52 0.13 -1.68 -2.34 132.00 135.62 3fjm h PRO 197 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3fjm h PRO 197 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.01 3fjm h PRO 197 CO 0.47 0.00 -0.27 -0.40 -0.23 0.00 0.00 178.00 177.57 3fjm n ASP 198 N -3.82 0.28 -0.04 1.44 5.75 -1.26 -4.53 116.55 114.37 3fjm n ASP 198 Ca 0.03 0.10 -0.00 0.00 -0.01 0.00 0.00 54.79 54.90 3fjm n ASP 198 Cb 0.38 -0.10 -0.00 0.00 -1.03 0.00 0.00 41.12 40.37 3fjm n ASP 198 CO 0.00 0.00 0.00 0.40 -0.11 0.00 0.00 177.20 177.49 3fjm h ILE 199 N 0.00 0.00 -1.54 2.12 1.08 -1.78 -3.50 117.51 113.89 3fjm h ILE 199 Ca 0.00 -0.86 0.00 0.00 -0.39 0.00 0.00 64.86 63.61 3fjm h ILE 199 Cb 0.51 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.26 3fjm h ILE 199 CO 0.00 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.07 3fjm n GLY 200 N 1.80 4.33 3.12 5.37 0.00 -1.26 -4.53 105.19 114.02 3fjm n GLY 200 Ca -0.00 -1.48 -0.33 0.00 0.00 0.00 0.00 46.02 44.21 3fjm n GLY 200 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fjm s THR 201 N -1.70 2.11 0.14 2.61 2.01 0.87 -4.80 115.64 116.88 3fjm s THR 201 Ca 0.00 -0.99 -0.30 0.00 0.31 0.00 0.00 61.69 60.71 3fjm s THR 201 Cb 0.00 -1.92 -0.07 0.00 0.01 0.00 0.00 72.50 70.53 3fjm s THR 201 CO 0.00 0.49 1.12 0.00 -0.69 0.00 0.00 174.62 175.54 3fjm s ALA 202 N 1.28 3.37 -0.14 7.40 0.00 -1.26 -0.75 121.76 131.66 3fjm s ALA 202 Ca 0.04 0.81 0.02 0.00 0.00 0.00 0.00 51.96 52.83 3fjm s ALA 202 Cb -0.14 -3.38 0.01 0.00 0.00 0.00 0.00 23.12 19.62 3fjm s ALA 202 CO -0.12 -0.28 -0.21 0.08 0.00 0.00 0.00 175.76 175.23 3fjm s VAL 203 N 0.19 1.96 0.40 0.00 1.01 0.83 -4.96 120.40 119.84 3fjm s VAL 203 Ca 0.52 -0.92 -0.26 0.00 0.00 0.00 0.00 61.98 61.33 3fjm s VAL 203 Cb -0.29 -1.74 -0.09 0.00 0.00 0.00 0.00 36.38 34.26 3fjm s VAL 203 CO 0.33 0.53 1.25 0.00 0.00 0.00 0.00 175.10 177.21 3fjm s ALA 204 N 0.87 3.22 0.15 5.51 0.00 -1.26 -1.75 121.76 128.49 3fjm s ALA 204 Ca -0.06 1.12 -0.16 0.00 0.00 0.00 0.00 51.96 52.86 3fjm s ALA 204 Cb -0.15 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.45 3fjm s ALA 204 CO -0.03 -0.70 0.58 0.42 0.00 0.00 0.00 175.76 176.03 3fjm s ILE 205 N -1.31 4.80 0.03 0.00 1.01 -1.26 -4.59 121.20 119.88 3fjm s ILE 205 Ca 0.57 0.96 -0.39 0.00 0.00 0.00 0.00 60.65 61.79 3fjm s ILE 205 Cb -0.35 -3.78 -0.19 0.00 0.01 0.00 0.00 42.46 38.15 3fjm s ILE 205 CO 0.45 0.29 1.18 -0.62 0.00 0.00 0.00 174.94 176.23 3fjm n GLU 206 N 0.94 0.46 -0.13 2.79 4.71 -1.26 -4.68 120.64 123.47 3fjm n GLU 206 Ca -0.06 0.17 0.15 0.00 -0.01 0.00 0.00 57.16 57.41 3fjm n GLU 206 Cb 0.52 -1.72 0.53 0.00 -1.01 0.00 0.00 31.44 29.75 3fjm n GLU 206 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 3fjm h LYS 207 N 3.63 0.34 -0.02 3.49 1.79 -1.96 -0.37 116.57 123.48 3fjm h LYS 207 Ca -0.50 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 57.95 3fjm h LYS 207 Cb 1.39 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.96 3fjm h LYS 207 CO 0.70 0.23 0.00 -0.40 -1.08 0.00 0.00 179.45 178.90 3fjm n ASP 208 N -4.46 0.62 0.00 0.86 5.68 -1.26 -3.89 116.55 114.11 3fjm n ASP 208 Ca 0.13 -1.28 0.00 0.00 -0.50 0.00 0.00 54.79 53.14 3fjm n ASP 208 Cb 0.51 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 3fjm n ASP 208 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3fjm n LEU 209 N -0.48 0.00 -4.76 -2.12 4.77 -0.29 -4.93 117.00 109.19 3fjm n LEU 209 Ca 0.20 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.81 3fjm n LEU 209 Cb 0.20 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.32 3fjm n LEU 209 CO 0.16 0.00 0.93 0.54 -1.33 0.00 0.00 177.39 177.69 3fjm s VAL 210 N -1.94 2.42 0.20 4.08 0.11 -0.35 -4.28 120.40 120.64 3fjm s VAL 210 Ca 0.00 0.31 0.08 0.00 -2.93 0.00 0.00 61.98 59.44 3fjm s VAL 210 Cb 0.00 -3.15 -0.04 0.00 -1.53 0.00 0.00 36.38 31.66 3fjm s VAL 210 CO 0.00 -0.01 0.00 0.68 -3.33 0.00 0.00 175.10 172.45 3fjm s VAL 211 N -1.40 3.65 -0.11 2.04 -7.23 -1.26 -5.01 120.40 111.09 3fjm s VAL 211 Ca 0.70 -1.57 0.02 0.00 -1.81 0.00 0.00 61.98 59.32 3fjm s VAL 211 Cb -0.36 -2.88 0.01 0.00 0.56 0.00 0.00 36.38 33.71 3fjm s VAL 211 CO 0.43 -0.20 -0.17 -0.31 -0.31 0.00 0.00 175.10 174.53 3fjm s TYR 212 N -1.92 2.13 0.33 2.82 1.51 -1.26 -1.64 117.35 119.33 3fjm s TYR 212 Ca 0.29 -0.98 0.10 0.00 -1.01 0.00 0.00 57.07 55.47 3fjm s TYR 212 Cb -0.08 -1.50 -0.06 0.00 -0.11 0.00 0.00 41.96 40.21 3fjm s TYR 212 CO 0.19 -0.47 -0.11 1.03 -1.11 0.00 0.00 175.55 175.09 3fjm s ARG 213 N 0.82 1.82 0.19 -0.62 0.52 -0.86 -4.88 118.95 115.94 3fjm s ARG 213 Ca -0.09 -1.89 0.05 0.00 -0.52 0.00 0.00 55.73 53.28 3fjm s ARG 213 Cb -0.16 -1.74 -0.04 0.00 0.52 0.00 0.00 34.95 33.54 3fjm s ARG 213 CO 0.01 0.18 0.19 0.95 0.02 0.00 0.00 175.30 176.65 3fjm s THR 214 N -2.58 4.67 -0.02 0.02 -4.23 -1.26 -1.54 115.64 110.70 3fjm s THR 214 Ca 0.32 -1.10 -0.13 0.00 -1.18 0.00 0.00 61.69 59.60 3fjm s THR 214 Cb 0.01 -3.44 -0.05 0.00 1.34 0.00 0.00 72.50 70.36 3fjm s THR 214 CO 0.16 -0.19 0.35 0.12 -0.54 0.00 0.00 174.62 174.53 3fjm s PHE 215 N -1.87 3.70 0.14 3.99 5.36 0.46 -2.39 117.98 127.38 3fjm s PHE 215 Ca 0.32 0.90 -0.07 0.00 -0.96 0.00 0.00 56.93 57.12 3fjm s PHE 215 Cb -0.10 -2.22 -0.02 0.00 -0.34 0.00 0.00 43.02 40.35 3fjm s PHE 215 CO 0.25 0.66 0.21 0.54 -1.46 0.00 0.00 175.22 175.42 3fjm s ASN 216 N -1.09 0.12 0.04 6.13 2.20 -1.07 -1.01 114.94 120.25 3fjm s ASN 216 Ca 0.22 -0.92 0.00 0.00 -0.94 0.00 0.00 52.86 51.22 3fjm s ASN 216 Cb -0.16 0.39 -0.03 0.00 -2.00 0.00 0.00 41.25 39.45 3fjm s ASN 216 CO 0.12 -0.83 -0.04 0.68 -2.94 0.00 0.00 177.10 174.09 3fjm s VAL 217 N -3.97 0.24 -0.05 3.54 -7.23 -0.87 -0.79 120.40 111.27 3fjm s VAL 217 Ca 0.17 -1.32 -0.02 0.00 -1.81 0.00 0.00 61.98 59.00 3fjm s VAL 217 Cb 0.05 -0.84 0.04 0.00 0.56 0.00 0.00 36.38 36.18 3fjm s VAL 217 CO -0.01 -0.69 0.11 -0.51 -0.31 0.00 0.00 175.10 173.69 3fjm s ILE 218 N -2.48 -0.06 0.13 -0.62 2.07 -0.35 -0.82 121.20 119.08 3fjm s ILE 218 Ca -0.05 0.20 -0.18 0.00 -1.41 0.00 0.00 60.65 59.21 3fjm s ILE 218 Cb -0.03 -0.19 -0.07 0.00 0.13 0.00 0.00 42.46 42.30 3fjm s ILE 218 CO -0.04 0.08 0.60 0.00 -1.91 0.00 0.00 174.94 173.67 3fjm s ALA 219 N 1.20 3.55 0.79 1.50 0.00 -1.26 -1.48 121.76 126.06 3fjm s ALA 219 Ca -0.08 0.01 -0.13 0.00 0.00 0.00 0.00 51.96 51.75 3fjm s ALA 219 Cb -0.12 -2.64 0.07 0.00 0.00 0.00 0.00 23.12 20.43 3fjm s ALA 219 CO -0.05 0.40 1.19 -1.59 0.00 0.00 0.00 175.76 175.72 3fjm s LYS 220 N -1.56 1.77 0.26 0.00 -2.85 -0.50 -4.76 119.74 112.11 3fjm s LYS 220 Ca 0.35 1.70 -0.30 0.00 -1.00 0.00 0.00 55.97 56.72 3fjm s LYS 220 Cb -0.18 -1.80 -0.11 0.00 -2.06 0.00 0.00 37.83 33.69 3fjm s LYS 220 CO 0.20 -2.10 1.57 -1.21 0.10 0.00 0.00 175.35 173.90 3fjm s GLU 221 N -4.15 4.16 -0.85 1.78 0.41 -0.60 -2.07 118.70 117.38 3fjm s GLU 221 Ca 0.72 2.50 -0.01 0.00 -0.41 0.00 0.00 54.97 57.77 3fjm s GLU 221 Cb -0.28 -3.06 0.00 0.00 -1.78 0.00 0.00 34.13 29.02 3fjm s GLU 221 CO 0.50 -0.59 0.18 0.41 -0.49 0.00 0.00 175.26 175.27 3fjm n GLY 222 N 2.47 0.01 3.75 -1.39 0.00 -1.26 -4.97 105.19 103.80 3fjm n GLY 222 Ca 0.09 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.34 3fjm n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fjm n ALA 223 N -2.20 1.87 -1.12 4.61 0.00 -0.88 -4.97 120.51 117.82 3fjm n ALA 223 Ca -0.09 0.26 -0.30 0.00 0.00 0.00 0.00 53.44 53.32 3fjm n ALA 223 Cb 0.58 -2.36 0.14 0.00 0.00 0.00 0.00 19.45 17.81 3fjm n ALA 223 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3fjm s SER 224 N -0.45 3.43 0.24 0.00 1.04 -1.26 -4.81 113.70 111.89 3fjm s SER 224 Ca 0.60 1.62 -0.07 0.00 0.48 0.00 0.00 55.95 58.58 3fjm s SER 224 Cb -0.47 -2.29 0.22 0.00 0.10 0.00 0.00 66.02 63.59 3fjm s SER 224 CO 0.58 -2.68 1.90 0.50 0.98 0.00 0.00 173.24 174.52 3fjm h LYS 225 N -1.58 1.24 -0.63 4.02 3.11 -1.99 -1.65 116.57 119.08 3fjm h LYS 225 Ca -0.49 -0.09 -0.01 0.00 -2.81 0.00 0.00 60.65 57.25 3fjm h LYS 225 Cb 1.28 -0.27 -0.03 0.00 -1.00 0.00 0.00 32.23 32.20 3fjm h LYS 225 CO 0.52 0.84 0.34 0.93 -2.81 0.00 0.00 179.45 179.28 3fjm h GLU 226 N 1.27 0.87 -0.18 1.90 3.07 -1.99 -0.19 114.58 119.32 3fjm h GLU 226 Ca 0.34 -0.09 -0.04 0.00 -0.50 0.00 0.00 59.36 59.06 3fjm h GLU 226 Cb -0.11 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.62 3fjm h GLU 226 CO -0.07 0.64 -0.05 1.15 -1.40 0.00 0.00 179.01 179.28 3fjm h THR 227 N 0.88 1.29 -0.90 1.13 2.02 -1.73 -2.45 112.91 113.16 3fjm h THR 227 Ca 0.22 -1.04 -0.01 0.00 0.77 0.00 0.00 66.41 66.36 3fjm h THR 227 Cb 0.02 1.61 -0.04 0.00 -1.74 0.00 0.00 68.15 68.00 3fjm h THR 227 CO -0.04 0.31 0.54 1.56 0.37 0.00 0.00 175.52 178.27 3fjm h GLN 228 N 0.06 1.22 -0.76 6.66 4.20 -0.98 -1.81 115.11 123.70 3fjm h GLN 228 Ca 0.04 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 3fjm h GLN 228 Cb 0.50 -0.26 -0.04 0.00 0.30 0.00 0.00 27.48 27.99 3fjm h GLN 228 CO 0.02 0.86 0.42 -0.44 -0.67 0.00 0.00 178.83 179.02 3fjm h ASP 229 N 1.24 0.95 -0.35 1.46 3.32 -0.94 -2.17 116.42 119.93 3fjm h ASP 229 Ca 0.32 -0.09 -0.16 0.00 0.02 0.00 0.00 57.03 57.12 3fjm h ASP 229 Cb -0.05 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.26 3fjm h ASP 229 CO -0.06 0.77 -0.39 0.15 -1.72 0.00 0.00 179.24 177.98 3fjm h PHE 230 N 1.05 1.07 -0.59 4.55 3.57 -1.08 -2.21 116.94 123.29 3fjm h PHE 230 Ca 0.27 -0.33 0.10 0.00 3.53 0.00 0.00 57.97 61.54 3fjm h PHE 230 Cb 0.02 -0.22 -0.08 0.00 2.79 0.00 0.00 35.95 38.46 3fjm h PHE 230 CO -0.00 1.15 0.16 0.82 -2.23 0.00 0.00 178.31 178.20 3fjm h ILE 231 N 0.68 0.69 -0.83 1.41 1.08 -1.13 -0.72 117.51 118.68 3fjm h ILE 231 Ca 0.05 -0.10 0.01 0.00 -0.39 0.00 0.00 64.86 64.43 3fjm h ILE 231 Cb 0.99 0.36 -0.04 0.00 -3.07 0.00 0.00 36.82 35.05 3fjm h ILE 231 CO 0.10 0.06 0.55 0.00 -0.69 0.00 0.00 178.15 178.16 3fjm h ALA 232 N 1.45 1.06 -0.02 1.87 0.00 -1.23 -2.37 119.26 120.01 3fjm h ALA 232 Ca 0.31 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.17 3fjm h ALA 232 Cb 0.43 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3fjm h ALA 232 CO -0.36 0.46 0.02 -0.92 0.00 0.00 0.00 179.25 178.44 3fjm h TYR 233 N 1.12 0.00 0.00 0.00 3.20 -0.52 -0.75 116.97 120.02 3fjm h TYR 233 Ca 0.31 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.18 3fjm h TYR 233 Cb -0.12 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.15 3fjm h TYR 233 CO -0.01 0.00 0.00 1.28 -1.64 0.00 0.00 178.16 177.79 3fjm n LEU 234 N -4.12 0.50 -0.65 2.82 4.77 -0.84 -1.11 117.00 118.38 3fjm n LEU 234 Ca -0.03 0.66 0.06 0.00 -0.03 0.00 0.00 56.01 56.67 3fjm n LEU 234 Cb 0.11 -0.64 0.15 0.00 -2.33 0.00 0.00 43.42 40.72 3fjm n LEU 234 CO 0.30 -0.63 0.63 -1.20 -1.33 0.00 0.00 177.39 175.15 3fjm n SER 235 N -2.10 2.92 -4.84 -1.43 7.64 -0.29 -4.52 113.62 111.01 3fjm n SER 235 Ca 0.01 -1.98 -0.31 0.00 1.01 0.00 0.00 58.87 57.61 3fjm n SER 235 Cb 0.15 -0.23 0.05 0.00 -1.01 0.00 0.00 64.21 63.17 3fjm n SER 235 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3fjm s SER 236 N -1.00 5.29 0.26 6.43 1.04 -0.26 -4.83 113.70 120.62 3fjm s SER 236 Ca 0.24 1.39 -0.03 0.00 0.48 0.00 0.00 55.95 58.03 3fjm s SER 236 Cb 0.12 -2.24 0.38 0.00 0.10 0.00 0.00 66.02 64.38 3fjm s SER 236 CO 0.16 -1.47 1.86 0.50 0.98 0.00 0.00 173.24 175.27 3fjm h LYS 237 N -0.74 1.04 -0.62 4.02 1.63 -1.95 -0.50 116.57 119.45 3fjm h LYS 237 Ca -0.45 -0.06 -0.06 0.00 -0.85 0.00 0.00 60.65 59.23 3fjm h LYS 237 Cb 1.23 -0.24 -0.03 0.00 -0.60 0.00 0.00 32.23 32.60 3fjm h LYS 237 CO 0.60 0.69 0.16 1.05 -3.45 0.00 0.00 179.45 178.50 3fjm h GLU 238 N 1.07 0.98 -0.24 1.90 9.09 -1.93 -2.55 114.58 122.91 3fjm h GLU 238 Ca 0.41 -0.23 -0.03 0.00 0.05 0.00 0.00 59.36 59.56 3fjm h GLU 238 Cb 0.19 -0.13 -0.01 0.00 -1.65 0.00 0.00 28.75 27.15 3fjm h GLU 238 CO -0.18 0.89 0.02 0.00 0.05 0.00 0.00 179.01 179.78 3fjm h ALA 239 N 1.05 0.33 -0.73 1.06 0.00 -1.59 -2.79 119.26 116.59 3fjm h ALA 239 Ca 0.20 -0.20 0.12 0.00 0.00 0.00 0.00 54.91 55.02 3fjm h ALA 239 Cb 0.34 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 3fjm h ALA 239 CO -0.00 0.04 0.32 0.87 0.00 0.00 0.00 179.25 180.48 3fjm h LYS 240 N 0.20 0.49 -0.53 0.00 1.57 -1.00 0.28 116.57 117.58 3fjm h LYS 240 Ca 0.07 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 3fjm h LYS 240 Cb 0.38 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 3fjm h LYS 240 CO 0.01 0.33 -0.06 1.49 -0.57 0.00 0.00 179.45 180.65 3fjm h GLU 241 N 0.51 0.95 -0.12 3.15 4.57 -1.36 0.34 114.58 122.62 3fjm h GLU 241 Ca 0.38 -0.32 -0.03 0.00 -1.18 0.00 0.00 59.36 58.22 3fjm h GLU 241 Cb 0.51 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 29.02 3fjm h GLU 241 CO -0.34 0.98 -0.03 0.82 -1.18 0.00 0.00 179.01 179.26 3fjm h ILE 242 N 0.86 1.29 -0.63 2.32 2.04 -1.10 -1.85 117.51 120.44 3fjm h ILE 242 Ca 0.15 -0.95 0.10 0.00 1.00 0.00 0.00 64.86 65.16 3fjm h ILE 242 Cb 0.59 1.68 -0.08 0.00 -0.74 0.00 0.00 36.82 38.28 3fjm h ILE 242 CO 0.04 0.27 0.23 -0.26 0.00 0.00 0.00 178.15 178.43 3fjm h PHE 243 N -0.09 0.40 -0.95 1.37 0.04 -0.84 -1.81 116.94 115.06 3fjm h PHE 243 Ca 0.03 0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.88 3fjm h PHE 243 Cb 0.44 -0.08 -0.06 0.00 2.20 0.00 0.00 35.95 38.45 3fjm h PHE 243 CO 0.05 0.09 0.62 -0.22 -0.60 0.00 0.00 178.31 178.24 3fjm h LYS 244 N 0.41 1.12 -0.41 1.51 3.64 -0.71 -1.06 116.57 121.06 3fjm h LYS 244 Ca 0.33 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.70 3fjm h LYS 244 Cb 0.42 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 3fjm h LYS 244 CO -0.33 0.74 0.28 0.87 -2.27 0.00 0.00 179.45 178.73 3fjm h LYS 245 N 1.15 0.28 -0.32 1.90 1.57 -0.47 -1.02 116.57 119.66 3fjm h LYS 245 Ca 0.39 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 3fjm h LYS 245 Cb 0.08 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.33 3fjm h LYS 245 CO -0.13 0.18 0.00 0.66 -0.57 0.00 0.00 179.45 179.59 3fjm n TYR 246 N -4.47 0.41 -0.01 -1.35 4.01 -0.50 -4.93 117.16 110.32 3fjm n TYR 246 Ca 0.05 -0.21 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 3fjm n TYR 246 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 3fjm n TYR 246 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fjm n GLY 247 N 1.35 0.68 3.70 2.72 0.00 -0.39 -3.55 105.19 109.71 3fjm n GLY 247 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3fjm n GLY 247 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3fjm s TRP 248 N -2.01 3.59 0.34 1.61 0.52 -0.62 -4.61 118.94 117.76 3fjm s TRP 248 Ca 0.00 1.47 0.08 0.00 0.02 0.00 0.00 56.10 57.67 3fjm s TRP 248 Cb 0.00 -3.00 -0.07 0.00 -1.15 0.00 0.00 33.47 29.25 3fjm s TRP 248 CO 0.00 -0.03 -0.06 1.03 0.02 0.00 0.00 176.95 177.91 3fjm s ARG 249 N 1.18 1.78 -0.05 4.98 0.52 0.65 -3.43 118.95 124.58 3fjm s ARG 249 Ca 0.45 -1.94 0.05 0.00 -0.52 0.00 0.00 55.73 53.78 3fjm s ARG 249 Cb -0.19 -1.55 -0.08 0.00 0.52 0.00 0.00 34.95 33.66 3fjm s ARG 249 CO 0.21 0.07 0.04 0.39 0.02 0.00 0.00 175.30 176.04 3fjm n GLU 250 N -0.78 2.60 0.00 3.54 1.02 -1.26 -1.13 120.64 124.63 3fjm n GLU 250 Ca -0.05 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 3fjm n GLU 250 Cb 0.64 -1.15 0.00 0.00 -0.02 0.00 0.00 31.44 30.91 3fjm n GLU 250 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92