#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fge s HIS 2 N 0.00 -0.73 -0.32 1.61 2.46 -1.26 -5.29 115.29 111.77 3fge s HIS 2 Ca 0.00 1.28 -0.07 0.00 0.47 0.00 0.00 55.06 56.73 3fge s HIS 2 Cb 0.00 0.44 0.02 0.00 -0.13 0.00 0.00 32.58 32.91 3fge s HIS 2 CO 0.00 -0.36 0.10 -0.06 -2.47 0.00 0.00 174.74 171.95 3fge s PHE 3 N 2.40 3.20 0.70 3.88 0.08 -1.26 -5.10 117.98 121.88 3fge s PHE 3 Ca -0.03 -1.12 -0.10 0.00 0.12 0.00 0.00 56.93 55.80 3fge s PHE 3 Cb -0.06 -2.28 0.03 0.00 -0.57 0.00 0.00 43.02 40.13 3fge s PHE 3 CO -0.17 -0.63 1.06 -1.54 -0.10 0.00 0.00 175.22 173.83 3fge s SER 4 N 1.47 5.23 0.21 1.36 1.04 -1.26 -4.83 113.70 116.93 3fge s SER 4 Ca 0.01 0.90 -0.09 0.00 0.48 0.00 0.00 55.95 57.24 3fge s SER 4 Cb -0.18 -1.66 0.31 0.00 0.10 0.00 0.00 66.02 64.59 3fge s SER 4 CO 0.03 -1.42 1.70 0.50 0.98 0.00 0.00 173.24 175.03 3fge h LYS 5 N -0.62 0.24 -0.73 4.02 3.64 -1.99 -0.86 116.57 120.27 3fge h LYS 5 Ca -0.45 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 58.87 3fge h LYS 5 Cb 1.28 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.01 3fge h LYS 5 CO 0.63 0.16 0.27 1.49 -2.27 0.00 0.00 179.45 179.73 3fge h GLU 6 N 0.24 1.10 -0.51 1.90 4.81 -1.99 -1.46 114.58 118.68 3fge h GLU 6 Ca 0.33 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 59.30 3fge h GLU 6 Cb 0.50 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 3fge h GLU 6 CO -0.43 0.92 0.14 1.25 -0.73 0.00 0.00 179.01 180.16 3fge h HIS 7 N 1.06 0.83 -0.41 0.92 2.76 -1.78 -1.70 115.15 116.82 3fge h HIS 7 Ca 0.24 -0.09 -0.02 0.00 -2.20 0.00 0.00 60.37 58.30 3fge h HIS 7 Cb 0.24 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 28.95 3fge h HIS 7 CO 0.02 0.73 0.18 0.82 -1.30 0.00 0.00 177.93 178.38 3fge h ILE 8 N 0.69 1.19 -0.14 6.26 2.04 -0.97 -2.34 117.51 124.24 3fge h ILE 8 Ca 0.16 -0.56 0.04 0.00 1.00 0.00 0.00 64.86 65.50 3fge h ILE 8 Cb 0.30 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3fge h ILE 8 CO -0.00 0.21 0.11 0.78 0.00 0.00 0.00 178.15 179.24 3fge h ASN 9 N 0.53 0.00 1.20 1.72 2.35 -1.03 -2.42 115.58 117.93 3fge h ASN 9 Ca 0.14 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.82 3fge h ASN 9 Cb 0.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3fge h ASN 9 CO -0.01 0.00 -0.32 0.00 -1.65 0.00 0.00 177.43 175.44 3fge h ALA 10 N 1.92 0.89 -2.86 -0.83 0.00 -0.75 -3.46 119.26 114.16 3fge h ALA 10 Ca 0.07 -0.29 -0.53 0.00 0.00 0.00 0.00 54.91 54.15 3fge h ALA 10 Cb 0.28 -0.05 0.11 0.00 0.00 0.00 0.00 17.79 18.13 3fge h ALA 10 CO -0.00 0.40 0.50 -0.51 0.00 0.00 0.00 179.25 179.64 3fge s LEU 11 N -6.65 3.74 0.63 0.00 1.43 -0.91 -4.96 118.68 111.96 3fge s LEU 11 Ca 0.02 2.46 -0.18 0.00 -1.03 0.00 0.00 54.13 55.40 3fge s LEU 11 Cb 0.09 -4.49 -0.02 0.00 0.03 0.00 0.00 46.19 41.80 3fge s LEU 11 CO 0.68 -1.51 1.23 -1.61 0.23 0.00 0.00 176.35 175.37 3fge s GLU 12 N -3.16 2.74 0.21 1.70 2.02 -1.26 -4.65 118.70 116.29 3fge s GLU 12 Ca 0.75 1.87 -0.17 0.00 0.02 0.00 0.00 54.97 57.44 3fge s GLU 12 Cb -0.32 -1.89 0.20 0.00 0.10 0.00 0.00 34.13 32.22 3fge s GLU 12 CO 0.36 -1.40 1.60 1.15 0.02 0.00 0.00 175.26 176.99 3fge h THR 13 N 0.61 0.22 -0.47 3.63 2.02 -1.96 0.97 112.91 117.93 3fge h THR 13 Ca -0.50 0.00 -0.10 0.00 0.77 0.00 0.00 66.41 66.58 3fge h THR 13 Cb 1.31 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 3fge h THR 13 CO 0.54 0.00 -0.10 0.03 0.37 0.00 0.00 175.52 176.35 3fge h ARG 14 N -0.08 0.90 -0.25 6.66 -0.00 -1.99 -0.83 114.38 118.79 3fge h ARG 14 Ca 0.29 -0.34 -0.00 0.00 -0.50 0.00 0.00 59.98 59.42 3fge h ARG 14 Cb 0.54 -0.05 -0.01 0.00 0.00 0.00 0.00 29.97 30.44 3fge h ARG 14 CO -0.71 0.99 0.14 1.15 0.00 0.00 0.00 179.97 181.54 3fge h THR 15 N 0.75 1.11 -0.77 2.04 2.02 -1.74 -1.05 112.91 115.27 3fge h THR 15 Ca 0.12 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.02 3fge h THR 15 Cb 0.65 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 3fge h THR 15 CO 0.04 0.11 0.48 -0.09 0.37 0.00 0.00 175.52 176.44 3fge h ARG 16 N 0.30 1.03 0.32 6.66 2.43 -0.72 -1.04 114.38 123.36 3fge h ARG 16 Ca 0.09 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 3fge h ARG 16 Cb 0.05 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.37 3fge h ARG 16 CO -0.02 0.70 -0.15 0.00 -1.51 0.00 0.00 179.97 178.99 3fge h ALA 17 N 1.48 -0.43 -0.86 2.80 0.00 -0.62 0.87 119.26 122.50 3fge h ALA 17 Ca 0.28 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.12 3fge h ALA 17 Cb -0.08 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.82 3fge h ALA 17 CO -0.06 -0.71 0.55 0.45 0.00 0.00 0.00 179.25 179.48 3fge h HIS 18 N -0.50 1.02 0.51 0.00 3.86 -0.98 -1.80 115.15 117.26 3fge h HIS 18 Ca -0.04 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 3fge h HIS 18 Cb 0.37 -0.34 0.01 0.00 1.06 0.00 0.00 27.41 28.51 3fge h HIS 18 CO -0.04 0.56 -0.25 0.35 0.86 0.00 0.00 177.93 179.42 3fge h PHE 19 N 1.04 -0.64 -0.70 2.45 3.57 -0.96 -2.13 116.94 119.57 3fge h PHE 19 Ca 0.36 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.78 3fge h PHE 19 Cb 0.08 0.21 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 3fge h PHE 19 CO -0.02 -0.31 0.20 0.82 -2.23 0.00 0.00 178.31 176.76 3fge h ILE 20 N -0.97 1.26 0.00 1.41 1.08 -0.86 -2.07 117.51 117.36 3fge h ILE 20 Ca -0.07 -0.91 -0.01 0.00 -0.39 0.00 0.00 64.86 63.48 3fge h ILE 20 Cb 0.61 0.51 -0.00 0.00 -3.07 0.00 0.00 36.82 34.87 3fge h ILE 20 CO 0.12 0.35 -0.04 0.78 -0.69 0.00 0.00 178.15 178.66 3fge h ASN 21 N 1.04 0.00 1.49 1.72 2.35 -1.36 -0.98 115.58 119.84 3fge h ASN 21 Ca 0.22 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.95 3fge h ASN 21 Cb 0.32 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 3fge h ASN 21 CO -0.00 0.04 -0.09 0.28 -1.65 0.00 0.00 177.43 176.01 3fge h SER 22 N 0.00 0.00 1.05 5.81 0.02 -0.66 -3.26 113.55 116.50 3fge h SER 22 Ca -0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 3fge h SER 22 Cb 0.33 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.87 3fge h SER 22 CO 0.01 0.09 -0.15 -0.07 -1.14 0.00 0.00 176.83 175.57 3fge h LEU 23 N 0.00 0.00 -1.53 5.07 3.38 -1.12 -3.06 115.31 118.05 3fge h LEU 23 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 3fge h LEU 23 Cb 0.86 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.61 3fge h LEU 23 CO 0.01 0.15 -0.12 0.77 0.09 0.00 0.00 178.44 179.34 3fge h SER 24 N 0.00 0.00 -1.94 -0.43 4.64 -1.73 -3.49 113.55 110.60 3fge h SER 24 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3fge h SER 24 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3fge h SER 24 CO 0.02 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 3fge n GLY 25 N -0.17 -1.81 3.75 -0.77 0.00 -1.16 -4.99 105.19 100.05 3fge n GLY 25 Ca -0.00 -1.97 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 3fge n GLY 25 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fge s PHE 26 N 0.00 2.42 0.15 1.61 0.08 -1.26 -4.74 117.98 116.23 3fge s PHE 26 Ca 0.00 1.46 0.07 0.00 0.12 0.00 0.00 56.93 58.58 3fge s PHE 26 Cb 0.00 -3.60 -0.04 0.00 -0.57 0.00 0.00 43.02 38.81 3fge s PHE 26 CO 0.00 -2.40 -0.15 0.15 -0.10 0.00 0.00 175.22 172.71 3fge s LYS 27 N -3.05 1.16 0.42 0.44 1.02 -0.03 -4.98 119.74 114.72 3fge s LYS 27 Ca 0.73 -1.36 -0.22 0.00 0.02 0.00 0.00 55.97 55.14 3fge s LYS 27 Cb -0.34 -1.07 -0.10 0.00 -0.52 0.00 0.00 37.83 35.79 3fge s LYS 27 CO 0.39 0.20 0.96 -1.54 -0.92 0.00 0.00 175.35 174.45 3fge s SER 28 N -2.69 6.93 -0.34 2.83 1.04 -1.26 -0.51 113.70 119.71 3fge s SER 28 Ca 0.14 1.75 -0.03 0.00 0.48 0.00 0.00 55.95 58.29 3fge s SER 28 Cb -0.04 -2.55 0.07 0.00 0.10 0.00 0.00 66.02 63.59 3fge s SER 28 CO 0.05 -0.37 0.08 0.00 0.98 0.00 0.00 173.24 173.98 3fge s ALA 29 N -2.05 2.96 0.00 5.32 0.00 -1.21 -4.14 121.76 122.63 3fge s ALA 29 Ca 0.61 -2.00 0.04 0.00 0.00 0.00 0.00 51.96 50.61 3fge s ALA 29 Cb -0.12 -2.14 -0.01 0.00 0.00 0.00 0.00 23.12 20.85 3fge s ALA 29 CO 0.16 -1.45 -0.14 -0.80 0.00 0.00 0.00 175.76 173.53 3fge s ASN 30 N 1.45 1.64 -0.16 0.00 0.01 -1.08 -1.42 114.94 115.38 3fge s ASN 30 Ca -0.00 -0.30 -0.13 0.00 -0.71 0.00 0.00 52.86 51.72 3fge s ASN 30 Cb -0.21 -0.17 -0.05 0.00 0.41 0.00 0.00 41.25 41.24 3fge s ASN 30 CO -0.01 0.14 0.26 -0.76 -1.51 0.00 0.00 177.10 175.21 3fge s LEU 31 N -0.51 4.25 -0.33 0.60 1.43 0.55 -0.69 118.68 123.98 3fge s LEU 31 Ca 0.05 0.47 -0.10 0.00 -1.03 0.00 0.00 54.13 53.51 3fge s LEU 31 Cb -0.06 -2.31 0.01 0.00 0.03 0.00 0.00 46.19 43.86 3fge s LEU 31 CO -0.00 0.14 0.17 -0.63 0.23 0.00 0.00 176.35 176.26 3fge s ILE 32 N 0.29 4.57 -0.16 -0.59 -1.09 0.69 -0.93 121.20 124.00 3fge s ILE 32 Ca 0.15 -0.58 -0.14 0.00 -2.23 0.00 0.00 60.65 57.85 3fge s ILE 32 Cb -0.13 -3.41 -0.05 0.00 -1.58 0.00 0.00 42.46 37.30 3fge s ILE 32 CO 0.03 -0.04 0.29 -0.83 -1.23 0.00 0.00 174.94 173.16 3fge s GLY 33 N 1.59 2.21 0.25 6.18 0.00 -0.34 -2.12 107.32 115.09 3fge s GLY 33 Ca 0.04 -0.46 -0.01 0.00 0.00 0.00 0.00 44.72 44.28 3fge s GLY 33 CO 0.06 0.39 0.26 -0.51 0.00 0.00 0.00 173.10 173.30 3fge s THR 34 N 0.37 0.00 0.04 0.90 -4.23 -0.60 -1.11 115.64 111.02 3fge s THR 34 Ca 0.16 -1.85 -0.20 0.00 -1.18 0.00 0.00 61.69 58.62 3fge s THR 34 Cb -0.13 -2.47 0.04 0.00 1.34 0.00 0.00 72.50 71.28 3fge s THR 34 CO 0.04 0.00 0.46 0.00 -0.54 0.00 0.00 174.62 174.58 3fge s GLN 35 N -3.85 0.97 0.90 3.99 -2.07 -1.26 -0.82 119.66 117.52 3fge s GLN 35 Ca 0.36 -0.29 -0.13 0.00 -1.82 0.00 0.00 55.36 53.47 3fge s GLN 35 Cb 0.04 0.44 0.20 0.00 -1.09 0.00 0.00 33.01 32.60 3fge s GLN 35 CO 0.16 -0.34 1.23 -0.40 -1.32 0.00 0.00 175.29 174.62 3fge n ASP 36 N 0.47 0.35 0.21 12.60 5.68 -0.49 -4.81 116.55 130.57 3fge n ASP 36 Ca -0.18 -1.60 0.15 0.00 -0.50 0.00 0.00 54.79 52.66 3fge n ASP 36 Cb 0.60 -0.92 0.67 0.00 -1.14 0.00 0.00 41.12 40.33 3fge n ASP 36 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 3fge h ARG 37 N 0.00 0.00 -0.08 0.11 3.08 -1.93 -1.90 114.38 113.66 3fge h ARG 37 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.65 3fge h ARG 37 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 3fge h ARG 37 CO 0.31 0.00 0.00 1.04 -1.07 0.00 0.00 179.97 180.25 3fge n GLN 38 N -2.65 1.90 -0.51 0.04 3.00 -1.26 -4.95 117.38 112.95 3fge n GLN 38 Ca 0.00 -1.33 0.00 0.00 -0.01 0.00 0.00 57.00 55.67 3fge n GLN 38 Cb 0.21 -1.46 0.00 0.00 0.00 0.00 0.00 30.24 28.99 3fge n GLN 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3fge n GLY 39 N 1.24 0.75 3.67 1.08 0.00 -0.71 -5.03 105.19 106.18 3fge n GLY 39 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3fge n GLY 39 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3fge s ASN 40 N -2.39 6.85 0.40 1.61 0.01 -1.26 -4.79 114.94 115.37 3fge s ASN 40 Ca 0.00 1.99 -0.04 0.00 -0.71 0.00 0.00 52.86 54.10 3fge s ASN 40 Cb 0.00 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 3fge s ASN 40 CO 0.00 -0.77 0.67 0.42 -1.51 0.00 0.00 177.10 175.92 3fge s THR 41 N 3.10 4.97 0.07 1.60 -4.23 -1.26 -1.40 115.64 118.50 3fge s THR 41 Ca 0.63 0.04 -0.04 0.00 -1.18 0.00 0.00 61.69 61.14 3fge s THR 41 Cb -0.28 -3.82 -0.02 0.00 1.34 0.00 0.00 72.50 69.71 3fge s THR 41 CO 0.23 -0.63 0.07 0.20 -0.54 0.00 0.00 174.62 173.95 3fge s ASN 42 N -3.79 0.33 -0.18 3.99 -0.87 -0.00 -4.29 114.94 110.13 3fge s ASN 42 Ca 0.45 -0.88 -0.10 0.00 -1.57 0.00 0.00 52.86 50.76 3fge s ASN 42 Cb -0.10 0.26 0.06 0.00 -0.02 0.00 0.00 41.25 41.45 3fge s ASN 42 CO 0.38 -0.66 0.43 -0.22 -2.57 0.00 0.00 177.10 174.45 3fge s LEU 43 N -2.91 -0.09 0.00 0.60 2.96 -1.26 -1.55 118.68 116.43 3fge s LEU 43 Ca 0.08 0.92 0.01 0.00 -0.22 0.00 0.00 54.13 54.92 3fge s LEU 43 Cb 0.07 1.42 -0.00 0.00 0.50 0.00 0.00 46.19 48.17 3fge s LEU 43 CO -0.09 -0.19 -0.03 -0.44 -1.32 0.00 0.00 176.35 174.27 3fge s SER 44 N 1.29 0.38 0.10 3.68 0.01 -0.90 -4.66 113.70 113.59 3fge s SER 44 Ca -0.09 -0.10 -0.24 0.00 1.31 0.00 0.00 55.95 56.83 3fge s SER 44 Cb -0.08 -0.03 -0.07 0.00 0.21 0.00 0.00 66.02 66.06 3fge s SER 44 CO -0.12 0.01 0.75 -0.51 0.41 0.00 0.00 173.24 173.78 3fge s ILE 45 N -0.20 4.58 -0.03 1.44 2.07 -1.26 -0.22 121.20 127.57 3fge s ILE 45 Ca -0.00 1.61 -0.00 0.00 -1.41 0.00 0.00 60.65 60.85 3fge s ILE 45 Cb -0.02 -4.10 0.03 0.00 0.13 0.00 0.00 42.46 38.50 3fge s ILE 45 CO -0.00 0.45 0.02 -0.69 -1.91 0.00 0.00 174.94 172.81 3fge s VAL 46 N -0.62 0.07 -1.28 4.00 1.01 0.13 -4.95 120.40 118.77 3fge s VAL 46 Ca 0.36 0.19 0.18 0.00 0.00 0.00 0.00 61.98 62.71 3fge s VAL 46 Cb -0.21 -0.21 0.61 0.00 0.00 0.00 0.00 36.38 36.57 3fge s VAL 46 CO 0.24 0.14 1.52 -1.54 0.00 0.00 0.00 175.10 175.46 3fge n SER 47 N 4.41 4.13 -0.52 3.32 3.41 -1.26 -2.62 113.62 124.49 3fge n SER 47 Ca -0.22 -2.27 0.06 0.00 -0.26 0.00 0.00 58.87 56.18 3fge n SER 47 Cb 0.50 -0.49 0.16 0.00 -0.26 0.00 0.00 64.21 64.12 3fge n SER 47 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3fge n SER 48 N 1.06 2.99 -4.73 4.04 3.41 -1.26 -4.05 113.62 115.08 3fge n SER 48 Ca 0.23 -2.51 -0.42 0.00 -0.26 0.00 0.00 58.87 55.91 3fge n SER 48 Cb 0.73 -0.33 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 3fge n SER 48 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3fge s VAL 49 N -1.90 3.27 -0.01 -3.33 1.01 -1.26 -3.64 120.40 114.55 3fge s VAL 49 Ca 0.27 0.98 0.02 0.00 0.00 0.00 0.00 61.98 63.25 3fge s VAL 49 Cb 0.20 -3.63 -0.00 0.00 0.00 0.00 0.00 36.38 32.95 3fge s VAL 49 CO 0.09 0.11 -0.07 -0.51 0.00 0.00 0.00 175.10 174.72 3fge s ILE 50 N 0.56 0.59 0.20 2.22 2.07 0.19 -4.78 121.20 122.26 3fge s ILE 50 Ca 0.60 -0.29 -0.30 0.00 -1.41 0.00 0.00 60.65 59.24 3fge s ILE 50 Cb -0.36 -0.52 -0.09 0.00 0.13 0.00 0.00 42.46 41.62 3fge s ILE 50 CO 0.35 0.18 1.36 -2.28 -1.91 0.00 0.00 174.94 172.64 3fge s HIS 51 N 0.01 3.19 -0.06 3.50 5.65 -1.26 -0.08 115.29 126.22 3fge s HIS 51 Ca 0.00 1.11 0.05 0.00 0.25 0.00 0.00 55.06 56.47 3fge s HIS 51 Cb -0.05 -3.68 -0.08 0.00 -1.18 0.00 0.00 32.58 27.59 3fge s HIS 51 CO -0.00 -2.21 0.01 1.28 -0.65 0.00 0.00 174.74 173.17 3fge n LEU 52 N 2.79 0.37 0.00 8.88 4.77 -0.16 -4.82 117.00 128.83 3fge n LEU 52 Ca 0.07 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3fge n LEU 52 Cb 0.42 0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 3fge n LEU 52 CO 0.59 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 3fge n GLY 53 N 2.67 0.65 0.01 -0.72 0.00 -0.98 -4.91 105.19 101.92 3fge n GLY 53 Ca -0.11 -0.67 0.09 0.00 0.00 0.00 0.00 46.02 45.33 3fge n GLY 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fge n ALA 54 N -0.03 2.67 -3.42 4.61 0.00 -1.26 -0.94 120.51 122.15 3fge n ALA 54 Ca 0.00 -0.47 -0.21 0.00 0.00 0.00 0.00 53.44 52.77 3fge n ALA 54 Cb 0.00 -0.64 -0.10 0.00 0.00 0.00 0.00 19.45 18.71 3fge n ALA 54 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3fge s ASN 55 N -4.20 1.98 0.64 0.00 6.03 -1.26 -2.91 114.94 115.22 3fge s ASN 55 Ca -0.07 -1.39 -0.11 0.00 -1.03 0.00 0.00 52.86 50.26 3fge s ASN 55 Cb 0.12 0.25 -0.02 0.00 -3.03 0.00 0.00 41.25 38.56 3fge s ASN 55 CO 0.78 -0.33 1.04 -2.16 -2.03 0.00 0.00 177.10 174.40 3fge s PRO 56 N 1.76 3.37 -0.52 3.55 0.04 -1.26 -5.06 135.00 136.87 3fge s PRO 56 Ca 0.14 0.83 -0.28 0.00 0.04 0.00 0.00 61.00 61.73 3fge s PRO 56 Cb -0.16 -2.05 -0.00 0.00 0.04 0.00 0.00 34.50 32.32 3fge s PRO 56 CO -0.17 -0.75 1.64 -1.25 0.04 0.00 0.00 177.00 176.51 3fge s PRO 57 N -5.09 3.10 0.45 0.56 0.04 -1.14 -4.52 135.00 128.39 3fge s PRO 57 Ca 0.56 0.73 0.01 0.00 0.04 0.00 0.00 61.00 62.34 3fge s PRO 57 Cb -0.12 -4.22 -0.00 0.00 0.04 0.00 0.00 34.50 30.19 3fge s PRO 57 CO 0.54 -2.17 0.03 1.28 0.04 0.00 0.00 177.00 176.72 3fge n LEU 58 N 10.73 0.00 0.00 -3.56 4.77 -0.12 -1.08 117.00 127.75 3fge n LEU 58 Ca 0.17 -2.94 0.00 0.00 -0.03 0.00 0.00 56.01 53.21 3fge n LEU 58 Cb 0.50 0.47 0.00 0.00 -2.33 0.00 0.00 43.42 42.05 3fge n LEU 58 CO 0.70 -0.42 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 3fge n GLY 60 N -0.61 1.91 2.82 -0.72 0.00 0.88 -0.99 105.19 108.48 3fge n GLY 60 Ca -0.16 -0.97 -0.19 0.00 0.00 0.00 0.00 46.02 44.69 3fge n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fge s ILE 62 N -2.90 0.31 -0.19 -0.61 -1.09 -1.24 -0.63 121.20 114.84 3fge s ILE 62 Ca 0.00 0.05 -0.10 0.00 -2.23 0.00 0.00 60.65 58.38 3fge s ILE 62 Cb 0.00 -0.41 -0.05 0.00 -1.58 0.00 0.00 42.46 40.43 3fge s ILE 62 CO 0.00 0.20 0.14 -0.63 -1.23 0.00 0.00 174.94 173.41 3fge s ILE 63 N 1.27 5.41 0.45 2.92 -1.09 -0.16 -4.75 121.20 125.25 3fge s ILE 63 Ca -0.06 0.21 -0.25 0.00 -2.23 0.00 0.00 60.65 58.32 3fge s ILE 63 Cb -0.13 -3.47 -0.09 0.00 -1.58 0.00 0.00 42.46 37.19 3fge s ILE 63 CO -0.02 0.46 1.29 -2.11 -1.23 0.00 0.00 174.94 173.33 3fge n ARG 64 N 3.37 1.92 0.00 2.79 1.85 -1.26 -2.64 116.66 122.68 3fge n ARG 64 Ca -0.16 0.69 0.00 0.00 -1.00 0.00 0.00 57.85 57.37 3fge n ARG 64 Cb 0.52 -2.43 0.00 0.00 -1.05 0.00 0.00 32.46 29.50 3fge n ARG 64 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 3fge n PRO 65 N -0.14 0.00 -1.14 2.89 -0.02 -1.26 -4.86 135.00 130.48 3fge n PRO 65 Ca 0.07 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.24 3fge n PRO 65 Cb 0.41 -1.16 0.11 0.00 -0.02 0.00 0.00 33.50 32.83 3fge n PRO 65 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3fge s PRO 69 N 0.12 1.93 0.37 0.52 0.04 -1.26 -4.96 135.00 131.76 3fge s PRO 69 Ca 0.00 1.23 0.06 0.00 0.04 0.00 0.00 61.00 62.33 3fge s PRO 69 Cb 0.00 -1.85 0.73 0.00 0.04 0.00 0.00 34.50 33.42 3fge s PRO 69 CO 0.00 -1.89 1.96 0.07 0.04 0.00 0.00 177.00 177.18 3fge h ARG 70 N -1.32 0.51 -0.41 4.56 -0.00 -2.02 -3.25 114.38 112.46 3fge h ARG 70 Ca -0.44 -0.07 -0.07 0.00 -0.00 0.00 0.00 59.98 59.40 3fge h ARG 70 Cb 1.24 -0.09 -0.02 0.00 -0.00 0.00 0.00 29.97 31.10 3fge h ARG 70 CO 0.49 0.45 -0.04 1.12 -0.00 0.00 0.00 179.97 181.99 3fge h HIS 71 N 0.51 0.72 -0.07 4.08 -0.00 -1.99 -1.20 115.15 117.20 3fge h HIS 71 Ca 0.12 -0.10 0.01 0.00 -0.00 0.00 0.00 60.37 60.41 3fge h HIS 71 Cb 0.15 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.35 3fge h HIS 71 CO 0.01 0.70 -0.02 1.15 -0.00 0.00 0.00 177.93 179.77 3fge h THR 72 N 0.63 0.92 -0.48 6.12 2.02 -1.97 0.12 112.91 120.27 3fge h THR 72 Ca 0.12 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.25 3fge h THR 72 Cb 0.46 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 3fge h THR 72 CO 0.02 0.00 0.08 0.15 0.37 0.00 0.00 175.52 176.14 3fge h PHE 73 N -0.01 0.84 -0.46 3.16 3.57 -1.67 -2.01 116.94 120.36 3fge h PHE 73 Ca 0.03 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.41 3fge h PHE 73 Cb 0.06 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.55 3fge h PHE 73 CO -0.13 0.78 0.28 0.93 -2.23 0.00 0.00 178.31 177.93 3fge h GLU 74 N 0.66 0.62 -0.73 1.11 5.08 -0.96 -2.45 114.58 117.91 3fge h GLU 74 Ca 0.15 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 3fge h GLU 74 Cb 0.39 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.47 3fge h GLU 74 CO 0.01 0.46 0.38 -0.91 -1.00 0.00 0.00 179.01 177.95 3fge h ASN 75 N 0.61 0.93 0.00 1.42 2.35 -0.65 0.10 115.58 120.34 3fge h ASN 75 Ca 0.16 -0.11 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 3fge h ASN 75 Cb -0.00 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.13 3fge h ASN 75 CO -0.03 0.78 0.00 -0.38 -1.65 0.00 0.00 177.43 176.15 3fge n ILE 76 N -4.44 0.07 0.00 2.81 5.41 -0.77 -0.80 119.36 121.63 3fge n ILE 76 Ca 0.06 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.81 3fge n ILE 76 Cb 0.11 -0.29 0.00 0.00 -0.71 0.00 0.00 39.64 38.75 3fge n ILE 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3fge n GLN 78 N 0.64 0.00 -0.01 0.38 0.00 0.02 0.05 117.38 118.46 3fge n GLN 78 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 57.00 57.06 3fge n GLN 78 Cb 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 30.24 30.20 3fge n GLN 78 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 3fge n THR 79 N 0.00 0.00 -1.11 -0.39 -2.24 0.02 -4.96 114.28 105.59 3fge n THR 79 Ca 0.00 -0.28 -0.04 0.00 -2.27 0.00 0.00 64.05 61.46 3fge n THR 79 Cb 0.00 0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 3fge n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fge n GLY 80 N 1.81 0.65 3.09 3.38 0.00 0.11 -5.00 105.19 109.23 3fge n GLY 80 Ca -0.02 -0.34 -0.21 0.00 0.00 0.00 0.00 46.02 45.44 3fge n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fge s LEU 81 N -0.90 2.02 0.18 0.99 1.43 -1.26 -0.50 118.68 120.64 3fge s LEU 81 Ca 0.00 -0.23 -0.22 0.00 -1.03 0.00 0.00 54.13 52.65 3fge s LEU 81 Cb 0.00 -0.66 0.06 0.00 0.03 0.00 0.00 46.19 45.61 3fge s LEU 81 CO 0.00 0.16 0.60 -0.72 0.23 0.00 0.00 176.35 176.62 3fge s TYR 82 N -0.29 -0.44 0.08 0.29 1.13 -0.57 -4.59 117.35 112.95 3fge s TYR 82 Ca 0.05 0.17 0.07 0.00 -1.41 0.00 0.00 57.07 55.95 3fge s TYR 82 Cb -0.05 0.56 -0.04 0.00 -1.10 0.00 0.00 41.96 41.33 3fge s TYR 82 CO -0.00 -0.91 -0.13 0.95 -2.51 0.00 0.00 175.55 172.94 3fge s THR 83 N -3.79 3.18 -0.13 -3.49 -4.23 -0.27 -0.41 115.64 106.50 3fge s THR 83 Ca 0.03 -1.22 0.03 0.00 -1.18 0.00 0.00 61.69 59.35 3fge s THR 83 Cb -0.02 -2.43 0.01 0.00 1.34 0.00 0.00 72.50 71.40 3fge s THR 83 CO -0.09 0.20 -0.22 -0.63 -0.54 0.00 0.00 174.62 173.35 3fge s ILE 84 N -1.10 1.99 -0.13 2.99 1.01 -0.17 -1.20 121.20 124.60 3fge s ILE 84 Ca 0.19 -0.95 -0.01 0.00 0.00 0.00 0.00 60.65 59.88 3fge s ILE 84 Cb -0.11 -1.75 0.03 0.00 0.01 0.00 0.00 42.46 40.64 3fge s ILE 84 CO 0.10 0.54 -0.05 0.20 0.00 0.00 0.00 174.94 175.73 3fge s ASN 85 N 0.72 2.31 0.26 3.58 0.01 -0.10 -1.12 114.94 120.59 3fge s ASN 85 Ca -0.10 -0.40 -0.31 0.00 -0.71 0.00 0.00 52.86 51.35 3fge s ASN 85 Cb -0.16 -0.79 -0.11 0.00 0.41 0.00 0.00 41.25 40.60 3fge s ASN 85 CO 0.01 -0.16 1.63 -1.00 -1.51 0.00 0.00 177.10 176.07 3fge s HIS 86 N 1.74 2.82 0.36 2.20 3.76 -0.12 -0.33 115.29 125.71 3fge s HIS 86 Ca 0.03 0.65 -0.25 0.00 -0.15 0.00 0.00 55.06 55.34 3fge s HIS 86 Cb -0.13 -4.08 -0.09 0.00 1.11 0.00 0.00 32.58 29.38 3fge s HIS 86 CO -0.08 -3.78 1.01 0.08 -0.85 0.00 0.00 174.74 171.12 3fge s VAL 87 N 0.42 3.92 0.35 -0.90 1.01 -0.51 -4.45 120.40 120.24 3fge s VAL 87 Ca 0.67 1.55 0.04 0.00 0.00 0.00 0.00 61.98 64.24 3fge s VAL 87 Cb -0.48 -3.84 -0.05 0.00 0.00 0.00 0.00 36.38 32.01 3fge s VAL 87 CO 0.42 0.09 0.08 0.54 0.00 0.00 0.00 175.10 176.23 3fge s ASN 88 N -1.53 2.50 0.52 3.32 2.20 -1.26 -1.59 114.94 119.09 3fge s ASN 88 Ca 0.53 -1.46 0.17 0.00 -0.94 0.00 0.00 52.86 51.16 3fge s ASN 88 Cb -0.21 0.09 1.28 0.00 -2.00 0.00 0.00 41.25 40.42 3fge s ASN 88 CO 0.27 -0.70 2.14 -0.61 -2.94 0.00 0.00 177.10 175.26 3fge h GLN 89 N 2.01 0.00 0.00 3.55 4.15 -1.71 -1.28 115.11 121.84 3fge h GLN 89 Ca -0.39 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 58.99 3fge h GLN 89 Cb 1.25 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.94 3fge h GLN 89 CO 0.66 0.00 -0.18 0.77 -1.93 0.00 0.00 178.83 178.15 3fge h SER 90 N 0.00 0.00 0.00 -0.69 0.02 -1.96 -3.35 113.55 107.57 3fge h SER 90 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3fge h SER 90 Cb 0.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.62 3fge h SER 90 CO -0.00 0.18 -0.01 2.30 -1.14 0.00 0.00 176.83 178.16 3fge n ILE 91 N -3.26 0.92 0.10 3.27 -5.35 -0.56 -4.81 119.36 109.67 3fge n ILE 91 Ca 0.01 -0.96 -0.02 0.00 -0.27 0.00 0.00 62.75 61.51 3fge n ILE 91 Cb 0.46 0.50 0.23 0.00 -1.74 0.00 0.00 39.64 39.09 3fge n ILE 91 CO 0.00 0.00 0.00 0.10 -1.76 0.00 0.00 176.55 174.89 3fge h TYR 92 N 0.00 0.25 -0.21 4.28 -0.00 -1.48 -0.20 116.97 119.62 3fge h TYR 92 Ca 0.00 -0.07 -0.01 0.00 -0.00 0.00 0.00 58.73 58.65 3fge h TYR 92 Cb 0.63 -0.05 -0.01 0.00 -0.00 0.00 0.00 36.73 37.29 3fge h TYR 92 CO 0.00 0.61 0.10 0.93 -0.00 0.00 0.00 178.16 179.80 3fge h GLU 93 N 0.18 0.29 -0.42 0.10 4.39 -1.87 -0.22 114.58 117.02 3fge h GLU 93 Ca 0.01 -0.04 -0.09 0.00 0.34 0.00 0.00 59.36 59.58 3fge h GLU 93 Cb 0.83 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.41 3fge h GLU 93 CO 0.06 0.31 -0.10 1.96 -1.16 0.00 0.00 179.01 180.08 3fge h GLN 94 N 0.21 0.75 -0.22 2.33 1.08 -1.83 -1.82 115.11 115.62 3fge h GLN 94 Ca 0.07 -0.24 0.02 0.00 -1.45 0.00 0.00 58.65 57.04 3fge h GLN 94 Cb 0.11 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.46 3fge h GLN 94 CO -0.01 0.83 0.10 0.00 -0.95 0.00 0.00 178.83 178.80 3fge h ALA 95 N 1.20 0.26 -0.97 3.87 0.00 -0.85 -2.15 119.26 120.61 3fge h ALA 95 Ca 0.12 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.11 3fge h ALA 95 Cb 0.57 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 3fge h ALA 95 CO 0.04 -0.31 0.62 1.25 0.00 0.00 0.00 179.25 180.84 3fge h HIS 96 N 0.22 1.15 0.00 0.00 -0.00 -0.78 -2.08 115.15 113.66 3fge h HIS 96 Ca 0.09 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.48 3fge h HIS 96 Cb 0.03 -0.38 -0.00 0.00 -0.00 0.00 0.00 27.41 27.07 3fge h HIS 96 CO -0.10 0.58 -0.06 0.37 -0.00 0.00 0.00 177.93 178.72 3fge h GLN 97 N 1.12 0.00 -0.12 5.26 5.75 -0.69 -2.24 115.11 124.18 3fge h GLN 97 Ca 0.43 0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.96 3fge h GLN 97 Cb 0.19 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.74 3fge h GLN 97 CO -0.18 0.06 0.17 1.79 -2.65 0.00 0.00 178.83 178.02 3fge h THR 98 N 0.00 0.35 0.00 2.39 1.35 -1.00 -1.90 112.91 114.10 3fge h THR 98 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3fge h THR 98 Cb 0.11 0.85 0.00 0.00 -1.73 0.00 0.00 68.15 67.39 3fge h THR 98 CO 0.01 0.00 0.00 -1.54 -0.25 0.00 0.00 175.52 173.74 3fge n SER 99 N -3.59 0.00 -4.70 5.36 3.41 -0.84 -4.81 113.62 108.45 3fge n SER 99 Ca 0.00 0.29 -0.32 0.00 -0.26 0.00 0.00 58.87 58.58 3fge n SER 99 Cb 0.28 -0.42 0.14 0.00 -0.26 0.00 0.00 64.21 63.94 3fge n SER 99 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3fge s ALA 100 N -2.85 1.75 -0.22 7.33 0.00 -0.72 -4.95 121.76 122.10 3fge s ALA 100 Ca 0.17 0.65 -0.27 0.00 0.00 0.00 0.00 51.96 52.52 3fge s ALA 100 Cb 0.17 -3.44 -0.00 0.00 0.00 0.00 0.00 23.12 19.85 3fge s ALA 100 CO 0.45 -2.39 0.92 1.03 0.00 0.00 0.00 175.76 175.77 3fge s ARG 101 N -4.45 4.24 0.38 0.00 3.00 -1.26 -5.03 118.95 115.84 3fge s ARG 101 Ca 0.69 1.14 0.08 0.00 0.00 0.00 0.00 55.73 57.63 3fge s ARG 101 Cb -0.24 -3.63 -0.05 0.00 0.00 0.00 0.00 34.95 31.03 3fge s ARG 101 CO 0.54 -0.53 0.16 0.71 0.00 0.00 0.00 175.30 176.18 3fge s TYR 102 N 2.86 2.63 0.71 -0.53 2.02 -1.26 -5.11 117.35 118.67 3fge s TYR 102 Ca 0.40 -0.51 -0.16 0.00 -0.37 0.00 0.00 57.07 56.42 3fge s TYR 102 Cb -0.15 -1.83 -0.04 0.00 -0.40 0.00 0.00 41.96 39.54 3fge s TYR 102 CO 0.08 0.25 0.57 -0.40 -1.57 0.00 0.00 175.55 174.47 3fge n ASP 103 N -1.19 -1.04 -0.21 2.29 5.68 -1.26 -4.86 116.55 115.96 3fge n ASP 103 Ca -0.02 0.61 0.01 0.00 -0.50 0.00 0.00 54.79 54.89 3fge n ASP 103 Cb 0.63 -1.23 0.10 0.00 -1.14 0.00 0.00 41.12 39.48 3fge n ASP 103 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 3fge h LYS 104 N -0.32 0.09 -0.72 0.11 6.56 -2.05 -2.06 116.57 118.17 3fge h LYS 104 Ca -0.46 -0.01 -0.14 0.00 -1.06 0.00 0.00 60.65 58.99 3fge h LYS 104 Cb 1.35 -0.02 -0.08 0.00 -0.57 0.00 0.00 32.23 32.91 3fge h LYS 104 CO 0.43 0.06 0.18 -0.25 -2.06 0.00 0.00 179.45 177.81 3fge n ASP 105 N -5.32 4.93 -4.50 0.86 8.00 -1.26 -4.90 116.55 114.35 3fge n ASP 105 Ca 0.09 -3.05 -0.41 0.00 0.71 0.00 0.00 54.79 52.13 3fge n ASP 105 Cb 0.37 -0.72 -0.10 0.00 -0.02 0.00 0.00 41.12 40.64 3fge n ASP 105 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3fge s GLU 106 N -2.77 3.34 0.21 -1.24 2.12 -0.78 -5.06 118.70 114.53 3fge s GLU 106 Ca 0.51 -0.75 -0.30 0.00 0.36 0.00 0.00 54.97 54.80 3fge s GLU 106 Cb 0.40 -3.83 -0.09 0.00 0.26 0.00 0.00 34.13 30.88 3fge s GLU 106 CO 0.13 -0.52 1.26 0.45 -0.54 0.00 0.00 175.26 176.05 3fge s SER 107 N 1.70 6.96 0.56 -1.70 0.15 -1.26 -4.74 113.70 115.37 3fge s SER 107 Ca 0.06 2.36 0.34 0.00 0.70 0.00 0.00 55.95 59.41 3fge s SER 107 Cb -0.18 -2.61 1.44 0.00 -1.71 0.00 0.00 66.02 62.96 3fge s SER 107 CO 0.10 -0.46 2.01 -0.33 1.20 0.00 0.00 173.24 175.76 3fge h GLU 108 N 5.14 0.00 -0.05 5.44 3.07 -1.83 -0.09 114.58 126.26 3fge h GLU 108 Ca -0.45 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.40 3fge h GLU 108 Cb 1.21 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.12 3fge h GLU 108 CO 0.75 0.02 0.01 0.74 -1.40 0.00 0.00 179.01 179.13 3fge h PHE 109 N 0.00 0.09 -0.64 4.33 0.04 -1.88 -2.72 116.94 116.16 3fge h PHE 109 Ca -0.00 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.72 3fge h PHE 109 Cb 0.48 -0.03 -0.03 0.00 2.20 0.00 0.00 35.95 38.57 3fge h PHE 109 CO 0.00 0.30 0.23 1.49 -0.60 0.00 0.00 178.31 179.73 3fge h GLU 110 N -0.14 0.97 0.00 1.51 4.57 -1.53 -2.98 114.58 116.97 3fge h GLU 110 Ca 0.02 -0.19 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 3fge h GLU 110 Cb 0.25 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 3fge h GLU 110 CO 0.00 0.83 0.00 0.00 -1.18 0.00 0.00 179.01 178.66 3fge h ALA 111 N 1.09 1.00 -1.35 2.92 0.00 -1.08 -3.46 119.26 118.39 3fge h ALA 111 Ca 0.21 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.53 3fge h ALA 111 Cb 0.24 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.90 3fge h ALA 111 CO -0.01 0.00 -0.55 0.95 0.00 0.00 0.00 179.25 179.64 3fge s THR 112 N -3.53 1.10 -2.00 0.00 -4.23 -1.03 -5.03 115.64 100.92 3fge s THR 112 Ca 0.02 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.79 3fge s THR 112 Cb 0.09 -2.49 0.73 0.00 1.34 0.00 0.00 72.50 72.18 3fge s THR 112 CO 0.48 0.00 1.93 0.61 -0.54 0.00 0.00 174.62 177.10 3fge n GLY 113 N -0.98 -0.88 3.84 3.99 0.00 -1.26 -4.82 105.19 105.08 3fge n GLY 113 Ca -0.09 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.45 3fge n GLY 113 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fge s LEU 114 N -1.91 3.65 -0.10 0.99 1.43 -1.26 -5.06 118.68 116.42 3fge s LEU 114 Ca 0.39 1.56 0.03 0.00 -1.03 0.00 0.00 54.13 55.07 3fge s LEU 114 Cb 0.18 -4.49 0.01 0.00 0.03 0.00 0.00 46.19 41.92 3fge s LEU 114 CO 0.30 -0.56 -0.18 -0.89 0.23 0.00 0.00 176.35 175.24 3fge s THR 115 N -2.58 1.64 0.68 5.49 2.01 -1.26 -4.69 115.64 116.93 3fge s THR 115 Ca 0.59 -0.76 -0.12 0.00 0.31 0.00 0.00 61.69 61.71 3fge s THR 115 Cb -0.10 -1.46 0.00 0.00 0.01 0.00 0.00 72.50 70.96 3fge s THR 115 CO 0.30 0.47 1.06 -2.16 -0.69 0.00 0.00 174.62 173.60 3fge s PRO 116 N 0.65 2.98 -0.21 4.92 0.04 -1.26 -0.23 135.00 141.89 3fge s PRO 116 Ca -0.13 1.01 -0.10 0.00 0.04 0.00 0.00 61.00 61.81 3fge s PRO 116 Cb -0.16 -1.99 0.08 0.00 0.04 0.00 0.00 34.50 32.46 3fge s PRO 116 CO 0.04 -1.07 0.50 -2.00 0.04 0.00 0.00 177.00 174.51 3fge s GLU 117 N -4.85 0.47 -0.14 4.56 2.12 -0.45 -4.61 118.70 115.80 3fge s GLU 117 Ca 0.59 1.00 -0.07 0.00 0.36 0.00 0.00 54.97 56.85 3fge s GLU 117 Cb -0.14 0.15 -0.04 0.00 0.26 0.00 0.00 34.13 34.36 3fge s GLU 117 CO 0.52 -0.18 0.10 0.71 -0.54 0.00 0.00 175.26 175.86 3fge s TYR 118 N 1.81 3.41 0.01 5.30 2.02 -1.26 0.00 117.35 128.64 3fge s TYR 118 Ca -0.08 0.34 0.01 0.00 -0.37 0.00 0.00 57.07 56.98 3fge s TYR 118 Cb -0.09 -1.97 -0.01 0.00 -0.40 0.00 0.00 41.96 39.50 3fge s TYR 118 CO -0.15 0.50 -0.05 -0.51 -1.57 0.00 0.00 175.55 173.77 3fge s LEU 119 N -0.51 2.07 -1.61 -1.29 1.43 -1.26 -4.92 118.68 112.59 3fge s LEU 119 Ca 0.11 -0.19 -0.14 0.00 -1.03 0.00 0.00 54.13 52.88 3fge s LEU 119 Cb -0.12 -0.20 0.11 0.00 0.03 0.00 0.00 46.19 46.02 3fge s LEU 119 CO 0.02 -0.01 0.77 -1.20 0.23 0.00 0.00 176.35 176.15 3fge n SER 120 N 2.62 -3.08 -1.29 2.29 7.64 -1.26 -1.50 113.62 119.04 3fge n SER 120 Ca -0.15 -0.96 -0.17 0.00 1.01 0.00 0.00 58.87 58.60 3fge n SER 120 Cb 0.58 -3.08 -0.07 0.00 -1.01 0.00 0.00 64.21 60.62 3fge n SER 120 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3fge n ASP 121 N -2.76 -5.36 -4.68 6.43 8.00 -1.26 -4.97 116.55 111.95 3fge n ASP 121 Ca -0.01 0.42 -0.41 0.00 0.71 0.00 0.00 54.79 55.50 3fge n ASP 121 Cb 0.54 -4.35 -0.04 0.00 -0.02 0.00 0.00 41.12 37.25 3fge n ASP 121 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3fge s PHE 122 N -2.51 3.45 -0.70 1.24 5.36 -0.56 -4.96 117.98 119.30 3fge s PHE 122 Ca 0.00 1.24 -0.05 0.00 -0.96 0.00 0.00 56.93 57.15 3fge s PHE 122 Cb 0.00 -2.96 -0.00 0.00 -0.34 0.00 0.00 43.02 39.72 3fge s PHE 122 CO 0.00 -0.17 2.86 0.00 -1.46 0.00 0.00 175.22 176.45 3fge s ALA 124 N -0.66 -1.20 0.34 0.00 0.00 -1.26 -4.70 121.76 114.28 3fge s ALA 124 Ca 0.60 1.36 -0.23 0.00 0.00 0.00 0.00 51.96 53.69 3fge s ALA 124 Cb 0.30 -0.78 -0.10 0.00 0.00 0.00 0.00 23.12 22.54 3fge s ALA 124 CO -0.13 -0.23 0.90 -1.25 0.00 0.00 0.00 175.76 175.04 3fge s PRO 125 N 0.23 4.39 0.47 0.00 0.04 -1.26 -4.78 135.00 134.08 3fge s PRO 125 Ca -0.00 1.15 0.02 0.00 0.04 0.00 0.00 61.00 62.20 3fge s PRO 125 Cb -0.03 -2.61 0.01 0.00 0.04 0.00 0.00 34.50 31.91 3fge s PRO 125 CO 0.01 0.20 0.68 -0.06 0.04 0.00 0.00 177.00 177.87 3fge s PHE 126 N -1.79 3.08 -0.32 0.56 0.08 0.10 -4.38 117.98 115.32 3fge s PHE 126 Ca 0.53 0.09 -0.15 0.00 0.12 0.00 0.00 56.93 57.51 3fge s PHE 126 Cb -0.15 -2.43 -0.02 0.00 -0.57 0.00 0.00 43.02 39.85 3fge s PHE 126 CO 0.20 -0.49 0.36 0.08 -0.10 0.00 0.00 175.22 175.26 3fge s VAL 127 N -2.58 5.17 0.26 -0.44 1.01 -1.26 -1.34 120.40 121.23 3fge s VAL 127 Ca 0.51 0.22 -0.02 0.00 0.00 0.00 0.00 61.98 62.69 3fge s VAL 127 Cb -0.10 -3.77 0.27 0.00 0.00 0.00 0.00 36.38 32.78 3fge s VAL 127 CO 0.37 0.00 1.87 0.50 0.00 0.00 0.00 175.10 177.84 3fge h LYS 128 N 8.37 1.09 0.00 2.72 3.64 -0.86 -2.39 116.57 129.15 3fge h LYS 128 Ca -0.31 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 3fge h LYS 128 Cb 1.15 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 3fge h LYS 128 CO 0.67 0.72 0.00 0.39 -2.27 0.00 0.00 179.45 178.96 3fge n GLU 129 N -4.53 0.03 -2.69 1.90 4.71 -1.26 -4.79 120.64 114.01 3fge n GLU 129 Ca 0.16 0.16 -0.40 0.00 -0.01 0.00 0.00 57.16 57.06 3fge n GLU 129 Cb 0.21 -1.54 -0.05 0.00 -1.01 0.00 0.00 31.44 29.04 3fge n GLU 129 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 3fge s SER 130 N -3.18 7.55 0.01 1.62 0.15 -0.90 -4.94 113.70 114.00 3fge s SER 130 Ca 0.10 1.99 0.24 0.00 0.70 0.00 0.00 55.95 58.98 3fge s SER 130 Cb 0.13 -2.61 0.36 0.00 -1.71 0.00 0.00 66.02 62.19 3fge s SER 130 CO 0.40 0.06 1.31 0.54 1.20 0.00 0.00 173.24 176.75 3fge n ARG 131 N 1.65 0.03 -3.57 5.44 1.74 -1.26 -4.79 116.66 115.90 3fge n ARG 131 Ca -0.01 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.99 3fge n ARG 131 Cb 0.47 -1.51 -0.09 0.00 -1.02 0.00 0.00 32.46 30.31 3fge n ARG 131 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3fge s LEU 132 N -3.10 -0.66 0.15 0.55 2.96 -1.26 -1.24 118.68 116.08 3fge s LEU 132 Ca 0.10 0.81 -0.20 0.00 -0.22 0.00 0.00 54.13 54.62 3fge s LEU 132 Cb 0.17 1.31 0.06 0.00 0.50 0.00 0.00 46.19 48.23 3fge s LEU 132 CO 0.73 -0.25 0.52 -1.59 -1.32 0.00 0.00 176.35 174.44 3fge s LYS 133 N 2.60 1.19 -0.07 1.98 -2.85 -0.48 -0.94 119.74 121.17 3fge s LYS 133 Ca 0.02 -0.57 -0.27 0.00 -1.00 0.00 0.00 55.97 54.15 3fge s LYS 133 Cb -0.13 0.54 0.06 0.00 -2.06 0.00 0.00 37.83 36.24 3fge s LYS 133 CO -0.14 -0.50 0.61 1.52 0.10 0.00 0.00 175.35 176.94 3fge s TYR 134 N -3.77 -0.58 0.37 1.78 1.13 -0.28 -0.33 117.35 115.66 3fge s TYR 134 Ca 0.02 1.07 -0.24 0.00 -1.41 0.00 0.00 57.07 56.51 3fge s TYR 134 Cb 0.00 0.33 -0.10 0.00 -1.10 0.00 0.00 41.96 41.09 3fge s TYR 134 CO -0.13 -0.53 0.95 -1.54 -2.51 0.00 0.00 175.55 171.79 3fge s SER 135 N -0.97 7.17 -0.01 -0.18 1.04 -0.14 -1.00 113.70 119.62 3fge s SER 135 Ca -0.10 1.77 -0.01 0.00 0.48 0.00 0.00 55.95 58.10 3fge s SER 135 Cb -0.02 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.54 3fge s SER 135 CO 0.07 -0.19 0.02 -0.69 0.98 0.00 0.00 173.24 173.43 3fge s VAL 136 N -1.85 -0.00 -0.15 5.02 1.01 0.45 -0.35 120.40 124.53 3fge s VAL 136 Ca 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.51 3fge s VAL 136 Cb -0.15 -0.03 -0.02 0.00 0.00 0.00 0.00 36.38 36.18 3fge s VAL 136 CO 0.19 0.00 -0.08 -1.59 0.00 0.00 0.00 175.10 173.63 3fge s LYS 137 N 0.02 3.52 0.23 2.72 -2.85 -0.48 -1.52 119.74 121.39 3fge s LYS 137 Ca -0.00 -0.60 -0.32 0.00 -1.00 0.00 0.00 55.97 54.05 3fge s LYS 137 Cb -0.00 -2.81 -0.12 0.00 -2.06 0.00 0.00 37.83 32.84 3fge s LYS 137 CO -0.00 0.18 1.66 -0.11 0.10 0.00 0.00 175.35 177.18 3fge n LEU 138 N 3.67 3.99 0.00 2.77 7.94 0.34 -0.32 117.00 135.40 3fge n LEU 138 Ca -0.18 1.09 0.00 0.00 -1.11 0.00 0.00 56.01 55.82 3fge n LEU 138 Cb 0.52 -1.56 0.00 0.00 0.53 0.00 0.00 43.42 42.91 3fge n LEU 138 CO 0.32 0.10 -0.26 1.33 -1.11 0.00 0.00 177.39 177.76 3fge n VAL 139 N 3.25 0.00 -3.62 1.96 0.24 -0.24 -4.84 118.33 115.08 3fge n VAL 139 Ca 0.14 -0.10 -0.10 0.00 -2.04 0.00 0.00 64.34 62.24 3fge n VAL 139 Cb 0.35 0.53 -0.07 0.00 -1.47 0.00 0.00 33.84 33.19 3fge n VAL 139 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3fge s GLU 140 N -1.25 0.56 -0.05 7.34 2.12 -0.97 -5.02 118.70 121.42 3fge s GLU 140 Ca 0.00 0.50 0.03 0.00 0.36 0.00 0.00 54.97 55.86 3fge s GLU 140 Cb 0.00 0.27 0.00 0.00 0.26 0.00 0.00 34.13 34.66 3fge s GLU 140 CO 0.00 -0.10 -0.15 -3.38 -0.54 0.00 0.00 175.26 171.10 3fge s HIS 141 N -0.12 1.53 -0.16 5.30 -3.43 -1.26 -1.14 115.29 116.00 3fge s HIS 141 Ca 0.01 -0.47 -0.01 0.00 -0.80 0.00 0.00 55.06 53.80 3fge s HIS 141 Cb -0.04 -1.06 -0.00 0.00 -1.43 0.00 0.00 32.58 30.05 3fge s HIS 141 CO -0.04 -0.19 -0.13 -0.65 -2.00 0.00 0.00 174.74 171.74 3fge s GLN 142 N 0.24 3.27 0.00 -0.38 -0.21 0.62 -4.96 119.66 118.25 3fge s GLN 142 Ca -0.07 -0.71 -0.29 0.00 0.02 0.00 0.00 55.36 54.30 3fge s GLN 142 Cb -0.12 -2.70 -0.03 0.00 1.00 0.00 0.00 33.01 31.16 3fge s GLN 142 CO 0.02 0.01 0.95 -1.58 -2.12 0.00 0.00 175.29 172.58 3fge s HIS 143 N 0.86 3.67 -0.54 0.91 2.46 -1.26 -0.18 115.29 121.20 3fge s HIS 143 Ca -0.04 1.67 -0.14 0.00 0.47 0.00 0.00 55.06 57.02 3fge s HIS 143 Cb -0.15 -3.08 0.13 0.00 -0.13 0.00 0.00 32.58 29.35 3fge s HIS 143 CO -0.00 0.02 0.48 -0.51 -2.47 0.00 0.00 174.74 172.25 3fge s LEU 144 N 0.90 6.09 0.52 8.88 1.43 -0.08 -4.94 118.68 131.49 3fge s LEU 144 Ca 0.50 -1.90 0.27 0.00 -1.03 0.00 0.00 54.13 51.97 3fge s LEU 144 Cb -0.21 -2.15 1.45 0.00 0.03 0.00 0.00 46.19 45.30 3fge s LEU 144 CO 0.27 -0.79 2.07 0.00 0.23 0.00 0.00 176.35 178.14 3fge h ALA 145 N 8.67 1.30 -0.89 4.21 0.00 -1.95 0.14 119.26 130.74 3fge h ALA 145 Ca -0.24 -0.11 0.20 0.00 0.00 0.00 0.00 54.91 54.76 3fge h ALA 145 Cb 1.09 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 3fge h ALA 145 CO 0.97 0.14 0.59 -0.84 0.00 0.00 0.00 179.25 180.11 3fge h ILE 146 N 0.00 0.68 0.00 0.00 3.07 -1.95 -3.28 117.51 116.03 3fge h ILE 146 Ca -0.00 -0.14 0.00 0.00 1.55 0.00 0.00 64.86 66.27 3fge h ILE 146 Cb 0.33 0.25 0.00 0.00 -0.27 0.00 0.00 36.82 37.12 3fge h ILE 146 CO 0.02 0.07 -0.29 -0.46 -1.05 0.00 0.00 178.15 176.43 3fge n ASN 147 N -4.50 0.00 -0.59 2.16 6.94 -1.13 -5.03 115.26 113.10 3fge n ASN 147 Ca 0.19 -1.59 -0.08 0.00 -0.02 0.00 0.00 54.58 53.08 3fge n ASN 147 Cb 0.69 -0.12 -0.03 0.00 -2.36 0.00 0.00 39.78 37.96 3fge n ASN 147 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3fge n GLY 148 N 0.00 0.96 3.95 4.83 0.00 0.45 -4.61 105.19 110.76 3fge n GLY 148 Ca 0.00 -0.54 -0.24 0.00 0.00 0.00 0.00 46.02 45.24 3fge n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fge s THR 149 N -2.22 3.33 -0.07 2.61 -4.23 -1.05 -4.08 115.64 109.92 3fge s THR 149 Ca 0.00 -0.37 0.05 0.00 -1.18 0.00 0.00 61.69 60.19 3fge s THR 149 Cb 0.00 -3.28 -0.01 0.00 1.34 0.00 0.00 72.50 70.55 3fge s THR 149 CO 0.00 -0.24 -0.24 -1.61 -0.54 0.00 0.00 174.62 171.99 3fge s GLU 150 N -4.82 2.67 -0.42 3.99 0.41 -1.08 -0.90 118.70 118.55 3fge s GLU 150 Ca 0.54 -0.87 -0.09 0.00 -0.41 0.00 0.00 54.97 54.14 3fge s GLU 150 Cb -0.10 -2.16 0.08 0.00 -1.78 0.00 0.00 34.13 30.16 3fge s GLU 150 CO 0.41 0.29 0.26 0.12 -0.49 0.00 0.00 175.26 175.85 3fge s PHE 151 N 0.05 3.33 -0.23 1.61 5.36 0.75 -0.99 117.98 127.86 3fge s PHE 151 Ca -0.09 -1.50 -0.14 0.00 -0.96 0.00 0.00 56.93 54.23 3fge s PHE 151 Cb -0.15 -2.93 -0.04 0.00 -0.34 0.00 0.00 43.02 39.55 3fge s PHE 151 CO 0.06 -0.84 0.33 0.08 -1.46 0.00 0.00 175.22 173.39 3fge s VAL 152 N 1.43 5.24 -0.15 3.12 1.01 -1.26 -0.28 120.40 129.51 3fge s VAL 152 Ca 0.03 0.54 0.01 0.00 0.00 0.00 0.00 61.98 62.56 3fge s VAL 152 Cb -0.23 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.49 3fge s VAL 152 CO 0.02 0.26 -0.18 -0.63 0.00 0.00 0.00 175.10 174.57 3fge s ILE 153 N 1.40 2.42 0.07 2.22 1.01 -0.29 -4.25 121.20 123.78 3fge s ILE 153 Ca 0.15 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.95 3fge s ILE 153 Cb -0.15 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.29 3fge s ILE 153 CO 0.07 0.53 -0.05 -0.83 0.00 0.00 0.00 174.94 174.66 3fge s GLY 154 N 0.78 0.62 -0.19 6.18 0.00 -1.26 -1.08 107.32 112.37 3fge s GLY 154 Ca -0.07 -1.22 -0.09 0.00 0.00 0.00 0.00 44.72 43.34 3fge s GLY 154 CO -0.00 -1.32 0.11 1.85 0.00 0.00 0.00 173.10 173.74 3fge s GLU 155 N -3.58 4.07 0.18 2.90 2.12 0.57 -4.38 118.70 120.59 3fge s GLU 155 Ca 0.07 -0.25 -0.30 0.00 0.36 0.00 0.00 54.97 54.85 3fge s GLU 155 Cb 0.04 -3.35 -0.08 0.00 0.26 0.00 0.00 34.13 31.00 3fge s GLU 155 CO -0.06 0.34 1.29 0.42 -0.54 0.00 0.00 175.26 176.70 3fge s ILE 156 N 0.24 3.32 0.00 -3.70 1.01 -0.24 -1.38 121.20 120.46 3fge s ILE 156 Ca 0.07 1.08 0.00 0.00 0.00 0.00 0.00 60.65 61.80 3fge s ILE 156 Cb -0.11 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.67 3fge s ILE 156 CO -0.01 0.15 0.00 0.52 0.00 0.00 0.00 174.94 175.60 3fge n VAL 157 N 2.76 0.00 -4.60 2.92 0.31 0.53 -4.86 118.33 115.38 3fge n VAL 157 Ca 0.06 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.09 3fge n VAL 157 Cb 0.43 -0.79 -0.13 0.00 -0.91 0.00 0.00 33.84 32.45 3fge n VAL 157 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 3fge s ASP 158 N -0.81 3.50 -0.02 4.52 1.11 -1.26 -4.95 116.67 118.76 3fge s ASP 158 Ca 0.00 -0.58 0.06 0.00 0.18 0.00 0.00 52.55 52.20 3fge s ASP 158 Cb 0.00 -0.40 -0.02 0.00 1.07 0.00 0.00 42.92 43.57 3fge s ASP 158 CO 0.00 0.22 -0.19 -0.69 1.18 0.00 0.00 175.17 175.69 3fge s VAL 159 N -0.96 2.67 -0.07 -1.27 1.01 -1.26 -0.97 120.40 119.55 3fge s VAL 159 Ca 0.14 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.21 3fge s VAL 159 Cb -0.10 -2.02 0.01 0.00 0.00 0.00 0.00 36.38 34.27 3fge s VAL 159 CO 0.05 0.54 -0.13 -0.31 0.00 0.00 0.00 175.10 175.26 3fge s TYR 160 N -0.72 1.54 -0.06 5.22 2.02 0.55 -5.00 117.35 120.89 3fge s TYR 160 Ca 0.11 -0.60 -0.12 0.00 -0.37 0.00 0.00 57.07 56.09 3fge s TYR 160 Cb -0.10 -1.13 0.02 0.00 -0.40 0.00 0.00 41.96 40.35 3fge s TYR 160 CO 0.01 -0.31 0.30 0.54 -1.57 0.00 0.00 175.55 174.51 3fge s VAL 161 N 0.75 0.03 0.47 0.71 0.11 -1.26 -1.38 120.40 119.84 3fge s VAL 161 Ca -0.13 -0.29 -0.22 0.00 -2.93 0.00 0.00 61.98 58.42 3fge s VAL 161 Cb -0.16 -0.52 -0.09 0.00 -1.53 0.00 0.00 36.38 34.08 3fge s VAL 161 CO 0.03 -0.16 0.88 0.47 -3.33 0.00 0.00 175.10 172.99 3fge n ASP 162 N 2.01 0.58 -4.75 3.54 9.92 -0.37 -4.88 116.55 122.60 3fge n ASP 162 Ca -0.18 0.94 -0.38 0.00 -0.53 0.00 0.00 54.79 54.63 3fge n ASP 162 Cb 0.57 -1.30 0.04 0.00 -0.64 0.00 0.00 41.12 39.79 3fge n ASP 162 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 3fge s ASP 163 N -0.92 5.21 0.00 -2.24 1.01 -1.26 -2.98 116.67 115.49 3fge s ASP 163 Ca 0.66 2.79 0.00 0.00 0.71 0.00 0.00 52.55 56.72 3fge s ASP 163 Cb -0.52 -2.64 0.00 0.00 1.01 0.00 0.00 42.92 40.77 3fge s ASP 163 CO 0.55 -1.61 0.00 0.59 0.21 0.00 0.00 175.17 174.91 3fge n ASN 164 N -1.06 0.00 0.09 0.27 3.02 -1.26 -4.87 115.26 111.44 3fge n ASN 164 Ca 0.11 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.51 3fge n ASN 164 Cb 0.45 -0.70 -0.08 0.00 -0.61 0.00 0.00 39.78 38.84 3fge n ASN 164 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fge h ALA 165 N 0.00 0.25 -2.26 5.41 0.00 -1.90 -3.43 119.26 117.33 3fge h ALA 165 Ca 0.00 -0.78 -0.61 0.00 0.00 0.00 0.00 54.91 53.51 3fge h ALA 165 Cb 0.00 -0.01 -0.12 0.00 0.00 0.00 0.00 17.79 17.67 3fge h ALA 165 CO 0.00 0.88 0.30 0.08 0.00 0.00 0.00 179.25 180.51 3fge s VAL 166 N -3.00 4.81 0.80 0.00 1.01 -1.26 -3.91 120.40 118.85 3fge s VAL 166 Ca -0.05 0.90 -0.12 0.00 0.00 0.00 0.00 61.98 62.71 3fge s VAL 166 Cb 0.08 -4.13 0.07 0.00 0.00 0.00 0.00 36.38 32.40 3fge s VAL 166 CO 0.87 -0.31 1.13 -1.10 0.00 0.00 0.00 175.10 175.69 3fge s GLN 167 N 2.90 2.09 0.53 2.72 -0.21 0.15 -4.92 119.66 122.93 3fge s GLN 167 Ca 0.29 0.35 0.30 0.00 0.02 0.00 0.00 55.36 56.32 3fge s GLN 167 Cb -0.14 -1.94 1.48 0.00 1.00 0.00 0.00 33.01 33.40 3fge s GLN 167 CO 0.14 -1.55 2.06 1.79 -2.12 0.00 0.00 175.29 175.61 3fge h THR 168 N -1.03 0.41 -0.14 -0.19 1.35 -1.97 -0.91 112.91 110.44 3fge h THR 168 Ca -0.47 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 3fge h THR 168 Cb 1.30 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 3fge h THR 168 CO 0.63 0.10 0.00 -0.90 -0.25 0.00 0.00 175.52 175.10 3fge n ASP 169 N -3.46 1.40 0.00 5.36 5.75 -1.26 -4.91 116.55 119.43 3fge n ASP 169 Ca -0.01 -1.66 0.00 0.00 -0.01 0.00 0.00 54.79 53.10 3fge n ASP 169 Cb 0.26 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 3fge n ASP 169 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3fge n GLY 170 N 1.07 1.90 3.77 6.12 0.00 -0.35 -5.05 105.19 112.66 3fge n GLY 170 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.78 3fge n GLY 170 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3fge s PHE 171 N -2.39 2.87 -0.17 1.61 5.36 -1.26 -4.65 117.98 119.35 3fge s PHE 171 Ca 0.00 1.40 0.01 0.00 -0.96 0.00 0.00 56.93 57.38 3fge s PHE 171 Cb 0.00 -3.69 0.02 0.00 -0.34 0.00 0.00 43.02 39.00 3fge s PHE 171 CO 0.00 -2.08 -0.20 0.42 -1.46 0.00 0.00 175.22 171.90 3fge s ILE 172 N -1.22 2.08 -0.46 3.12 1.01 -1.26 -0.68 121.20 123.80 3fge s ILE 172 Ca 0.54 -0.94 -0.29 0.00 0.00 0.00 0.00 60.65 59.96 3fge s ILE 172 Cb -0.39 -1.87 0.03 0.00 0.01 0.00 0.00 42.46 40.24 3fge s ILE 172 CO 0.51 0.54 1.14 -0.62 0.00 0.00 0.00 174.94 176.51 3fge s ASP 173 N 1.20 6.66 0.36 3.58 -1.08 -1.25 -4.88 116.67 121.26 3fge s ASP 173 Ca 0.03 0.54 0.14 0.00 -0.52 0.00 0.00 52.55 52.74 3fge s ASP 173 Cb -0.13 -2.55 0.66 0.00 -1.46 0.00 0.00 42.92 39.44 3fge s ASP 173 CO -0.11 -1.22 1.76 -0.07 0.52 0.00 0.00 175.17 176.06 3fge h LEU 174 N 11.13 0.00 -0.53 -1.34 3.38 -1.97 -2.86 115.31 123.12 3fge h LEU 174 Ca -0.23 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.59 3fge h LEU 174 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 3fge h LEU 174 CO 1.12 0.42 -0.43 -0.61 0.09 0.00 0.00 178.44 179.04 3fge h GLN 175 N 0.00 0.72 -0.13 1.13 4.15 -1.86 -1.52 115.11 117.59 3fge h GLN 175 Ca -0.00 -0.39 -0.07 0.00 0.77 0.00 0.00 58.65 58.96 3fge h GLN 175 Cb 0.81 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.51 3fge h GLN 175 CO 0.06 1.01 -0.22 0.00 -1.93 0.00 0.00 178.83 177.75 3fge h ALA 176 N 0.94 1.39 -0.55 3.38 0.00 -1.89 -1.85 119.26 120.68 3fge h ALA 176 Ca 0.04 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3fge h ALA 176 Cb 0.97 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3fge h ALA 176 CO 0.09 0.42 0.00 0.44 0.00 0.00 0.00 179.25 180.20 3fge n ILE 177 N -4.20 1.37 -2.55 0.00 -5.35 -1.14 -4.95 119.36 102.55 3fge n ILE 177 Ca -0.01 -0.94 -0.19 0.00 -0.27 0.00 0.00 62.75 61.34 3fge n ILE 177 Cb 0.33 0.12 -0.00 0.00 -1.74 0.00 0.00 39.64 38.35 3fge n ILE 177 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 3fge n ASP 178 N 0.97 -5.47 -4.76 7.28 8.00 -0.70 -4.89 116.55 116.99 3fge n ASP 178 Ca 0.21 -0.03 -0.39 0.00 0.71 0.00 0.00 54.79 55.29 3fge n ASP 178 Cb 0.71 -4.54 0.02 0.00 -0.02 0.00 0.00 41.12 37.29 3fge n ASP 178 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3fge s THR 179 N -2.98 2.23 0.11 -3.53 2.01 -0.60 -1.94 115.64 110.94 3fge s THR 179 Ca 0.07 0.19 0.05 0.00 0.31 0.00 0.00 61.69 62.30 3fge s THR 179 Cb -0.03 -3.11 -0.04 0.00 0.01 0.00 0.00 72.50 69.33 3fge s THR 179 CO 0.08 0.02 0.03 0.68 -0.69 0.00 0.00 174.62 174.74 3fge s VAL 180 N -1.27 4.15 0.28 3.82 -7.23 -0.62 -4.33 120.40 115.20 3fge s VAL 180 Ca 0.64 -1.01 0.08 0.00 -1.81 0.00 0.00 61.98 59.89 3fge s VAL 180 Cb -0.41 -3.01 -0.04 0.00 0.56 0.00 0.00 36.38 33.48 3fge s VAL 180 CO 0.51 0.06 0.12 0.00 -0.31 0.00 0.00 175.10 175.48 3fge s ALA 181 N -1.43 3.43 0.09 1.32 0.00 0.23 -3.35 121.76 122.04 3fge s ALA 181 Ca 0.27 -1.61 0.09 0.00 0.00 0.00 0.00 51.96 50.71 3fge s ALA 181 Cb -0.11 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 22.00 3fge s ALA 181 CO 0.20 0.19 -0.24 0.42 0.00 0.00 0.00 175.76 176.33 3fge s ILE 182 N -2.28 2.40 0.12 0.00 1.01 0.34 -0.96 121.20 121.82 3fge s ILE 182 Ca 0.34 -1.51 0.04 0.00 0.00 0.00 0.00 60.65 59.52 3fge s ILE 182 Cb -0.06 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 3fge s ILE 182 CO 0.23 0.22 -0.11 -0.94 0.00 0.00 0.00 174.94 174.34 3fge s SER 183 N -1.72 1.66 0.91 3.58 1.04 0.19 -0.86 113.70 118.51 3fge s SER 183 Ca 0.14 -0.87 0.00 0.00 0.48 0.00 0.00 55.95 55.70 3fge s SER 183 Cb -0.10 -0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.01 3fge s SER 183 CO 0.05 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.62 3fge n GLY 184 N 0.33 2.01 0.03 7.32 0.00 -1.23 -2.04 105.19 111.60 3fge n GLY 184 Ca -0.14 -0.51 0.11 0.00 0.00 0.00 0.00 46.02 45.48 3fge n GLY 184 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3fge n LEU 185 N 0.00 0.52 -0.25 0.99 4.77 -1.26 -4.73 117.00 117.03 3fge n LEU 185 Ca 0.00 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3fge n LEU 185 Cb 0.00 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.04 3fge n LEU 185 CO 0.00 0.04 0.17 -0.90 -1.33 0.00 0.00 177.39 175.37 3fge n ASP 186 N -2.04 0.00 -4.50 -1.43 5.68 -1.21 -5.10 116.55 107.95 3fge n ASP 186 Ca 0.00 -1.17 -0.34 0.00 -0.50 0.00 0.00 54.79 52.79 3fge n ASP 186 Cb 0.47 -0.03 -0.12 0.00 -1.14 0.00 0.00 41.12 40.29 3fge n ASP 186 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3fge s TYR 188 N 0.27 2.79 0.03 0.00 1.51 -1.26 -0.64 117.35 120.05 3fge s TYR 188 Ca -0.04 -0.10 -0.03 0.00 -1.01 0.00 0.00 57.07 55.89 3fge s TYR 188 Cb -0.14 -1.59 -0.02 0.00 -0.11 0.00 0.00 41.96 40.10 3fge s TYR 188 CO 0.03 0.31 0.03 0.71 -1.11 0.00 0.00 175.55 175.52 3fge s TYR 189 N -0.91 0.28 0.40 2.71 1.51 -0.14 -4.98 117.35 116.23 3fge s TYR 189 Ca 0.15 -0.62 0.04 0.00 -1.01 0.00 0.00 57.07 55.63 3fge s TYR 189 Cb -0.11 -0.21 -0.00 0.00 -0.11 0.00 0.00 41.96 41.53 3fge s TYR 189 CO 0.05 -0.31 0.58 0.95 -1.11 0.00 0.00 175.55 175.71 3fge s THR 190 N -2.48 3.80 -0.05 -0.71 -4.23 -1.26 -0.60 115.64 110.11 3fge s THR 190 Ca -0.06 -0.80 -0.03 0.00 -1.18 0.00 0.00 61.69 59.62 3fge s THR 190 Cb -0.02 -3.35 -0.04 0.00 1.34 0.00 0.00 72.50 70.43 3fge s THR 190 CO -0.04 -0.18 0.14 -0.83 -0.54 0.00 0.00 174.62 173.16 3fge s GLY 191 N -4.23 2.12 -0.26 3.99 0.00 -1.26 -4.87 107.32 102.81 3fge s GLY 191 Ca 0.48 -0.75 0.03 0.00 0.00 0.00 0.00 44.72 44.48 3fge s GLY 191 CO 0.34 -0.58 -0.09 -0.35 0.00 0.00 0.00 173.10 172.42 3fge s ASP 192 N -1.55 4.37 0.27 1.64 2.15 -1.26 -4.73 116.67 117.56 3fge s ASP 192 Ca 0.22 -1.42 -0.30 0.00 0.43 0.00 0.00 52.55 51.48 3fge s ASP 192 Cb -0.12 -1.49 -0.10 0.00 -0.30 0.00 0.00 42.92 40.91 3fge s ASP 192 CO 0.12 -0.21 1.36 -0.75 -0.17 0.00 0.00 175.17 175.52 3fge s LYS 193 N 1.14 4.32 -0.11 4.34 2.20 -1.26 -4.94 119.74 125.43 3fge s LYS 193 Ca -0.07 2.22 -0.11 0.00 -0.36 0.00 0.00 55.97 57.66 3fge s LYS 193 Cb -0.20 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 32.98 3fge s LYS 193 CO -0.06 -0.30 -0.20 1.28 -0.36 0.00 0.00 175.35 175.71 3fge n LEU 194 N 1.81 1.29 -3.57 5.43 4.77 -1.26 -5.10 117.00 120.37 3fge n LEU 194 Ca 0.04 0.31 -0.06 0.00 -0.03 0.00 0.00 56.01 56.27 3fge n LEU 194 Cb 0.41 -0.69 -0.02 0.00 -2.33 0.00 0.00 43.42 40.79 3fge n LEU 194 CO 0.60 -0.38 0.91 0.00 -1.33 0.00 0.00 177.39 177.18 3fge s ALA 195 N -2.90 -1.99 -0.12 -1.18 0.00 -1.26 -5.13 121.76 109.17 3fge s ALA 195 Ca -0.17 1.43 -0.12 0.00 0.00 0.00 0.00 51.96 53.09 3fge s ALA 195 Cb 0.02 0.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.11 3fge s ALA 195 CO 0.25 -0.61 0.28 1.03 0.00 0.00 0.00 175.76 176.71 3fge s ARG 196 N -2.59 3.99 0.01 0.00 0.52 -1.26 -5.10 118.95 114.52 3fge s ARG 196 Ca 0.08 0.10 0.04 0.00 -0.52 0.00 0.00 55.73 55.43 3fge s ARG 196 Cb -0.01 -3.32 -0.03 0.00 0.52 0.00 0.00 34.95 32.10 3fge s ARG 196 CO -0.06 0.47 -0.08 -0.51 0.02 0.00 0.00 175.30 175.14 3fge s LEU 197 N -0.24 3.11 0.82 2.53 1.43 -1.26 -5.11 118.68 119.96 3fge s LEU 197 Ca 0.17 -0.18 -0.12 0.00 -1.03 0.00 0.00 54.13 52.98 3fge s LEU 197 Cb -0.14 -1.79 0.08 0.00 0.03 0.00 0.00 46.19 44.37 3fge s LEU 197 CO 0.06 0.28 1.10 -2.16 0.23 0.00 0.00 176.35 175.86 3fge s PRO 198 N -1.44 1.92 -0.32 1.29 0.04 -1.26 -4.90 135.00 130.33 3fge s PRO 198 Ca 0.17 0.61 -0.35 0.00 0.04 0.00 0.00 61.00 61.47 3fge s PRO 198 Cb -0.11 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 32.41 3fge s PRO 198 CO 0.08 -1.73 2.13 0.98 0.04 0.00 0.00 177.00 178.50 3fge n TYR 199 N -3.50 1.71 0.00 0.56 4.19 -1.26 -5.34 117.16 113.53 3fge n TYR 199 Ca 0.07 0.26 0.00 0.00 3.31 0.00 0.00 57.90 61.54 3fge n TYR 199 Cb 0.57 -2.54 0.00 0.00 0.49 0.00 0.00 39.34 37.85 3fge n TYR 199 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77