#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gca s ASN 2 N 0.00 5.18 0.21 7.83 2.20 -1.26 -4.89 114.94 124.21 2gca s ASN 2 Ca 0.00 -0.78 -0.16 0.00 -0.94 0.00 0.00 52.86 50.98 2gca s ASN 2 Cb 0.00 -0.07 0.21 0.00 -2.00 0.00 0.00 41.25 39.39 2gca s ASN 2 CO 0.00 -1.05 1.60 0.22 -2.94 0.00 0.00 177.10 174.93 2gca h TYR 3 N 0.50 -0.59 -0.21 1.54 3.20 -1.98 -0.95 116.97 118.48 2gca h TYR 3 Ca -0.35 0.07 0.05 0.00 3.14 0.00 0.00 58.73 61.64 2gca h TYR 3 Cb 1.29 0.36 -0.05 0.00 1.54 0.00 0.00 36.73 39.86 2gca h TYR 3 CO 0.51 -0.33 -0.14 1.15 -1.64 0.00 0.00 178.16 177.71 2gca h THR 4 N -0.07 0.59 -0.62 1.81 2.02 -1.99 -0.29 112.91 114.37 2gca h THR 4 Ca 0.29 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.45 2gca h THR 4 Cb 0.52 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 2gca h THR 4 CO -0.69 0.00 0.32 -0.33 0.37 0.00 0.00 175.52 175.19 2gca h GLU 5 N -0.13 0.87 -0.30 6.66 5.08 -1.80 -1.29 114.58 123.66 2gca h GLU 5 Ca 0.12 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.41 2gca h GLU 5 Cb 0.31 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 2gca h GLU 5 CO -0.29 0.67 0.05 1.15 -1.00 0.00 0.00 179.01 179.60 2gca h THR 6 N 0.84 0.85 -0.35 1.13 2.02 -0.59 0.86 112.91 117.66 2gca h THR 6 Ca 0.21 -0.06 -0.15 0.00 0.77 0.00 0.00 66.41 67.19 2gca h THR 6 Cb 0.07 0.67 -0.00 0.00 -1.74 0.00 0.00 68.15 67.15 2gca h THR 6 CO -0.03 0.03 -0.37 0.58 0.37 0.00 0.00 175.52 176.10 2gca h VAL 7 N 0.16 1.28 -0.65 3.16 2.07 -0.98 -1.91 116.25 119.38 2gca h VAL 7 Ca 0.14 -1.54 -0.04 0.00 0.82 0.00 0.00 66.70 66.08 2gca h VAL 7 Cb 0.16 1.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 2gca h VAL 7 CO -0.19 0.51 0.24 0.00 0.02 0.00 0.00 177.57 178.15 2gca h ALA 8 N 0.74 1.21 -0.57 1.67 0.00 -0.83 -2.50 119.26 118.98 2gca h ALA 8 Ca 0.05 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 2gca h ALA 8 Cb 0.96 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2gca h ALA 8 CO 0.09 0.57 0.24 -0.92 0.00 0.00 0.00 179.25 179.23 2gca h TYR 9 N 0.94 0.85 -0.72 0.00 3.20 0.11 -2.75 116.97 118.60 2gca h TYR 9 Ca 0.22 -0.06 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 2gca h TYR 9 Cb 0.21 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 2gca h TYR 9 CO 0.02 0.68 0.36 0.82 -1.64 0.00 0.00 178.16 178.40 2gca h ILE 10 N 0.77 1.22 0.00 1.81 2.04 -0.93 -2.44 117.51 119.99 2gca h ILE 10 Ca 0.19 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2gca h ILE 10 Cb 0.18 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 2gca h ILE 10 CO -0.02 0.26 0.00 1.41 0.00 0.00 0.00 178.15 179.80 2gca n HIS 11 N -4.34 0.00 0.34 1.37 8.25 -1.03 -3.41 115.22 116.40 2gca n HIS 11 Ca 0.07 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.66 2gca n HIS 11 Cb 0.12 -0.38 0.31 0.00 1.12 0.00 0.00 29.99 31.16 2gca n HIS 11 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 2gca h SER 12 N 0.00 0.00 -2.91 0.41 0.02 -1.14 -3.47 113.55 106.46 2gca h SER 12 Ca 0.00 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.36 2gca h SER 12 Cb 0.37 0.00 0.14 0.00 0.14 0.00 0.00 62.40 63.05 2gca h SER 12 CO 0.00 0.00 -0.00 0.49 -1.14 0.00 0.00 176.83 176.18 2gca n PHE 13 N -2.84 0.66 -1.53 3.45 3.01 -1.22 -4.94 117.46 114.05 2gca n PHE 13 Ca 0.04 0.56 -0.34 0.00 1.01 0.00 0.00 57.45 58.72 2gca n PHE 13 Cb 0.46 -2.15 0.08 0.00 -0.01 0.00 0.00 39.48 37.86 2gca n PHE 13 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2gca s PRO 14 N -1.97 2.36 -0.71 -1.08 0.04 -1.26 -4.67 135.00 127.70 2gca s PRO 14 Ca 0.65 1.59 -0.22 0.00 0.04 0.00 0.00 61.00 63.06 2gca s PRO 14 Cb -0.55 -1.88 0.08 0.00 0.04 0.00 0.00 34.50 32.19 2gca s PRO 14 CO 0.56 -1.63 0.99 -0.98 0.04 0.00 0.00 177.00 175.98 2gca s ARG 15 N -4.04 3.21 0.33 4.56 3.03 -1.26 -4.38 118.95 120.40 2gca s ARG 15 Ca 0.71 -1.05 0.09 0.00 2.03 0.00 0.00 55.73 57.51 2gca s ARG 15 Cb -0.25 -4.39 -0.06 0.00 -1.03 0.00 0.00 34.95 29.23 2gca s ARG 15 CO 0.44 -1.80 -0.05 -0.51 -1.13 0.00 0.00 175.30 172.26 2gca s LEU 16 N 3.73 2.86 0.00 -1.89 1.43 -1.26 -5.13 118.68 118.42 2gca s LEU 16 Ca 0.24 -1.06 0.00 0.00 -1.03 0.00 0.00 54.13 52.28 2gca s LEU 16 Cb -0.15 -1.21 0.00 0.00 0.03 0.00 0.00 46.19 44.86 2gca s LEU 16 CO 0.06 -0.19 0.00 0.00 0.23 0.00 0.00 176.35 176.44 2gca n ALA 17 N -0.86 0.00 -2.83 4.21 0.00 -1.26 -4.99 120.51 114.78 2gca n ALA 17 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.28 2gca n ALA 17 Cb 0.62 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.09 2gca n ALA 17 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2gca n LYS 18 N 0.00 -0.68 -3.15 0.00 5.02 -1.26 -4.98 118.16 113.11 2gca n LYS 18 Ca 0.00 0.81 -0.08 0.00 -2.02 0.00 0.00 58.31 57.02 2gca n LYS 18 Cb 0.00 -1.08 -0.03 0.00 -0.02 0.00 0.00 35.03 33.90 2gca n LYS 18 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2gca s THR 19 N -0.95 -0.69 0.03 -0.18 -4.23 -1.26 -4.97 115.64 103.39 2gca s THR 19 Ca 0.11 -0.78 0.26 0.00 -1.18 0.00 0.00 61.69 60.10 2gca s THR 19 Cb -0.01 -0.30 0.26 0.00 1.34 0.00 0.00 72.50 73.79 2gca s THR 19 CO 0.25 -0.28 1.79 1.23 -0.54 0.00 0.00 174.62 177.07 2gca h GLY 20 N 6.37 0.00 -2.18 3.99 0.00 -1.93 -3.42 103.07 105.90 2gca h GLY 20 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 47.33 46.97 2gca h GLY 20 CO 0.13 0.00 -0.17 0.51 0.00 0.00 0.00 176.54 177.01 2gca s ASP 21 N -4.23 5.46 -0.14 0.19 -4.77 -1.26 -4.81 116.67 107.11 2gca s ASP 21 Ca -0.03 -0.34 0.15 0.00 -3.30 0.00 0.00 52.55 49.03 2gca s ASP 21 Cb 0.08 -0.61 0.31 0.00 -1.09 0.00 0.00 42.92 41.60 2gca s ASP 21 CO 0.24 -0.96 1.16 1.41 0.70 0.00 0.00 175.17 177.72 2gca n HIS 22 N -2.06 0.00 -0.35 2.11 8.25 -1.26 -4.82 115.22 117.10 2gca n HIS 22 Ca 0.09 -1.04 0.06 0.00 -0.26 0.00 0.00 57.72 56.56 2gca n HIS 22 Cb 0.59 -0.17 0.23 0.00 1.12 0.00 0.00 29.99 31.77 2gca n HIS 22 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 2gca h ARG 23 N 0.33 1.00 0.45 -0.41 9.65 -1.96 0.44 114.38 123.88 2gca h ARG 23 Ca -0.01 -0.06 -0.02 0.00 -1.10 0.00 0.00 59.98 58.79 2gca h ARG 23 Cb 1.07 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 29.42 2gca h ARG 23 CO 0.00 0.66 -0.35 -0.09 2.80 0.00 0.00 179.97 183.00 2gca h ARG 24 N 1.03 -0.74 -0.30 0.20 9.65 -1.93 0.16 114.38 122.45 2gca h ARG 24 Ca 0.45 0.05 -0.07 0.00 -1.10 0.00 0.00 59.98 59.32 2gca h ARG 24 Cb 0.36 0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 29.09 2gca h ARG 24 CO -0.21 -0.49 -0.09 0.97 2.80 0.00 0.00 179.97 182.94 2gca h ILE 25 N -0.77 1.22 -0.75 1.20 2.10 -1.90 -2.19 117.51 116.42 2gca h ILE 25 Ca -0.06 -0.95 -0.03 0.00 1.08 0.00 0.00 64.86 64.90 2gca h ILE 25 Cb 0.64 1.09 -0.04 0.00 -1.09 0.00 0.00 36.82 37.43 2gca h ILE 25 CO 0.01 0.31 0.36 -0.07 -1.08 0.00 0.00 178.15 177.69 2gca h LEU 26 N 0.47 0.97 -0.33 2.19 3.38 -0.76 1.04 115.31 122.28 2gca h LEU 26 Ca 0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2gca h LEU 26 Cb 0.45 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2gca h LEU 26 CO 0.02 0.82 0.16 0.74 0.09 0.00 0.00 178.44 180.28 2gca h THR 27 N 1.07 1.16 -0.05 0.22 2.02 -0.10 -0.32 112.91 116.91 2gca h THR 27 Ca 0.26 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.99 2gca h THR 27 Cb 0.11 0.85 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 2gca h THR 27 CO -0.03 0.16 0.01 0.25 0.37 0.00 0.00 175.52 176.28 2gca h LEU 28 N 0.39 0.08 -1.07 2.58 6.46 -0.69 -2.84 115.31 120.22 2gca h LEU 28 Ca 0.11 -0.27 0.11 0.00 -0.12 0.00 0.00 57.88 57.71 2gca h LEU 28 Cb 0.12 -0.02 -0.08 0.00 -0.73 0.00 0.00 40.66 39.95 2gca h LEU 28 CO -0.01 0.33 0.62 -0.07 -0.62 0.00 0.00 178.44 178.69 2gca h LEU 29 N -0.18 0.90 0.03 2.25 3.38 0.12 -1.75 115.31 120.05 2gca h LEU 29 Ca 0.01 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2gca h LEU 29 Cb 0.29 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2gca h LEU 29 CO 0.00 0.50 -0.16 -0.74 0.09 0.00 0.00 178.44 178.12 2gca h HIS 30 N 0.97 -0.43 0.00 1.13 2.76 -0.84 0.12 115.15 118.86 2gca h HIS 30 Ca 0.47 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.65 2gca h HIS 30 Cb 0.46 0.19 -0.00 0.00 1.55 0.00 0.00 27.41 29.60 2gca h HIS 30 CO -0.00 -0.24 -0.00 0.00 -1.30 0.00 0.00 177.93 176.39 2gca h ALA 31 N 0.62 1.11 -0.45 5.26 0.00 -1.12 0.32 119.26 125.00 2gca h ALA 31 Ca 0.04 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2gca h ALA 31 Cb 0.34 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2gca h ALA 31 CO -0.14 0.00 0.02 1.28 0.00 0.00 0.00 179.25 180.42 2gca n LEU 32 N -3.24 4.68 -1.64 0.00 4.77 0.19 -4.90 117.00 116.85 2gca n LEU 32 Ca -0.03 -2.38 -0.12 0.00 -0.03 0.00 0.00 56.01 53.45 2gca n LEU 32 Cb 0.08 -0.65 0.01 0.00 -2.33 0.00 0.00 43.42 40.53 2gca n LEU 32 CO 0.22 0.56 -0.04 0.61 -1.33 0.00 0.00 177.39 177.40 2gca n GLY 33 N 0.42 -0.01 4.00 -0.72 0.00 0.10 -4.01 105.19 104.96 2gca n GLY 33 Ca 0.22 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 2gca n GLY 33 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2gca n ASN 34 N -0.48 -1.91 0.27 1.61 3.02 0.11 -4.83 115.26 113.05 2gca n ASN 34 Ca -0.08 -1.04 0.12 0.00 -0.03 0.00 0.00 54.58 53.55 2gca n ASN 34 Cb 0.58 -1.26 0.75 0.00 -0.61 0.00 0.00 39.78 39.23 2gca n ASN 34 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2gca h PRO 35 N -1.42 0.00 0.00 3.52 0.13 -1.77 -2.47 132.00 129.98 2gca h PRO 35 Ca -0.56 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 2gca h PRO 35 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2gca h PRO 35 CO 0.47 0.09 0.00 -0.56 -0.23 0.00 0.00 178.00 177.77 2gca h GLN 36 N 0.00 0.00 -0.01 0.86 -0.00 -1.88 -1.41 115.11 112.67 2gca h GLN 36 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2gca h GLN 36 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.71 2gca h GLN 36 CO 0.01 0.00 -0.13 1.04 -0.00 0.00 0.00 178.83 179.75 2gca n GLN 37 N -2.52 1.36 -4.28 0.06 6.02 -0.93 -4.70 117.38 112.38 2gca n GLN 37 Ca -0.01 -0.85 -0.24 0.00 -0.01 0.00 0.00 57.00 55.90 2gca n GLN 37 Cb 0.12 -1.48 -0.07 0.00 1.02 0.00 0.00 30.24 29.82 2gca n GLN 37 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2gca s GLN 38 N -2.23 2.29 1.08 -1.09 -0.21 -0.53 -5.06 119.66 113.91 2gca s GLN 38 Ca 0.31 -1.36 0.00 0.00 0.02 0.00 0.00 55.36 54.33 2gca s GLN 38 Cb 0.20 -2.19 0.00 0.00 1.00 0.00 0.00 33.01 32.02 2gca s GLN 38 CO 0.42 0.38 0.00 0.41 -2.12 0.00 0.00 175.29 174.38 2gca n GLY 39 N -0.70 -1.90 3.56 3.09 0.00 -1.26 -4.94 105.19 103.04 2gca n GLY 39 Ca -0.07 -1.35 -0.30 0.00 0.00 0.00 0.00 46.02 44.30 2gca n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gca s ARG 40 N -0.15 2.10 0.04 1.61 0.52 -1.25 -5.07 118.95 116.75 2gca s ARG 40 Ca 0.00 -1.03 -0.02 0.00 -0.52 0.00 0.00 55.73 54.16 2gca s ARG 40 Cb 0.00 -2.28 -0.03 0.00 0.52 0.00 0.00 34.95 33.16 2gca s ARG 40 CO 0.00 0.51 0.00 0.71 0.02 0.00 0.00 175.30 176.54 2gca s TYR 41 N -1.18 0.34 -0.14 -0.53 1.51 -1.26 -1.97 117.35 114.12 2gca s TYR 41 Ca 0.20 -0.73 -0.00 0.00 -1.01 0.00 0.00 57.07 55.53 2gca s TYR 41 Cb -0.11 -0.25 0.03 0.00 -0.11 0.00 0.00 41.96 41.52 2gca s TYR 41 CO 0.12 -0.31 -0.07 0.42 -1.11 0.00 0.00 175.55 174.60 2gca s ILE 42 N -2.70 1.11 -0.28 2.71 1.01 -0.82 -0.10 121.20 122.14 2gca s ILE 42 Ca -0.04 -0.46 -0.13 0.00 0.00 0.00 0.00 60.65 60.02 2gca s ILE 42 Cb -0.01 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.24 2gca s ILE 42 CO -0.05 0.28 0.29 -2.28 0.00 0.00 0.00 174.94 173.18 2gca s HIS 43 N 1.66 3.23 -0.12 3.97 2.46 -0.71 -0.54 115.29 125.23 2gca s HIS 43 Ca 0.03 0.27 0.03 0.00 0.47 0.00 0.00 55.06 55.86 2gca s HIS 43 Cb -0.14 -2.49 0.00 0.00 -0.13 0.00 0.00 32.58 29.83 2gca s HIS 43 CO -0.08 -0.20 -0.21 0.08 -2.47 0.00 0.00 174.74 171.85 2gca s VAL 44 N 1.93 2.23 0.11 0.89 1.01 0.15 -0.03 120.40 126.69 2gca s VAL 44 Ca 0.11 -0.94 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 2gca s VAL 44 Cb -0.16 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 2gca s VAL 44 CO 0.10 0.55 0.06 0.28 0.00 0.00 0.00 175.10 176.09 2gca s THR 45 N 0.57 0.13 0.00 3.92 -1.32 -0.48 0.01 115.64 118.47 2gca s THR 45 Ca -0.12 -1.80 0.00 0.00 -1.21 0.00 0.00 61.69 58.55 2gca s THR 45 Cb -0.17 -1.86 0.00 0.00 -1.51 0.00 0.00 72.50 68.96 2gca s THR 45 CO 0.04 -0.59 0.00 0.61 -2.21 0.00 0.00 174.62 172.47 2gca n GLY 46 N -0.05 3.10 0.24 6.08 0.00 -1.26 -1.98 105.19 111.32 2gca n GLY 46 Ca -0.08 -0.67 -0.12 0.00 0.00 0.00 0.00 46.02 45.16 2gca n GLY 46 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2gca h THR 47 N 2.88 0.35 -3.44 2.61 2.02 -0.99 -3.41 112.91 112.94 2gca h THR 47 Ca 0.00 -0.63 -0.55 0.00 0.77 0.00 0.00 66.41 66.00 2gca h THR 47 Cb 0.00 0.55 -0.33 0.00 -1.74 0.00 0.00 68.15 66.63 2gca h THR 47 CO 0.00 0.07 -0.83 0.20 0.37 0.00 0.00 175.52 175.34 2gca s ASN 48 N -4.97 2.02 0.00 4.18 0.01 -1.26 -4.78 114.94 110.15 2gca s ASN 48 Ca -0.12 -0.35 0.00 0.00 -0.71 0.00 0.00 52.86 51.68 2gca s ASN 48 Cb 0.01 -0.91 0.00 0.00 0.41 0.00 0.00 41.25 40.76 2gca s ASN 48 CO 0.41 0.06 0.00 0.61 -1.51 0.00 0.00 177.10 176.67 2gca n GLY 49 N 3.72 1.66 0.20 0.66 0.00 -1.26 -4.38 105.19 105.79 2gca n GLY 49 Ca -0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 2gca n GLY 49 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2gca h LYS 50 N 1.55 0.64 -0.42 1.61 2.10 -1.86 -0.91 116.57 119.27 2gca h LYS 50 Ca 0.00 -0.07 -0.01 0.00 -2.00 0.00 0.00 60.65 58.57 2gca h LYS 50 Cb 0.00 -0.12 -0.02 0.00 -0.90 0.00 0.00 32.23 31.19 2gca h LYS 50 CO 0.00 0.50 0.23 0.78 -2.00 0.00 0.00 179.45 178.96 2gca h GLY 51 N 0.60 0.63 0.90 0.07 0.00 -1.92 -1.84 103.07 101.50 2gca h GLY 51 Ca 0.16 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2gca h GLY 51 CO -0.03 0.27 0.09 0.23 0.00 0.00 0.00 176.54 177.11 2gca h SER 52 N 0.54 0.30 0.39 0.19 0.87 -1.95 -1.94 113.55 111.96 2gca h SER 52 Ca 0.15 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.53 2gca h SER 52 Cb 0.06 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2gca h SER 52 CO -0.02 0.38 -0.19 0.00 -0.53 0.00 0.00 176.83 176.47 2gca h ALA 53 N 0.93 -0.52 -0.80 6.23 0.00 -1.10 -1.58 119.26 122.43 2gca h ALA 53 Ca 0.07 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.97 2gca h ALA 53 Cb 0.17 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.09 2gca h ALA 53 CO -0.01 -0.79 0.44 0.00 0.00 0.00 0.00 179.25 178.89 2gca h ALA 54 N 0.10 1.14 -0.54 0.00 0.00 -1.32 0.28 119.26 118.91 2gca h ALA 54 Ca -0.05 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2gca h ALA 54 Cb 0.40 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2gca h ALA 54 CO 0.08 0.03 0.11 -0.97 0.00 0.00 0.00 179.25 178.51 2gca h ASN 55 N 0.72 0.78 0.40 0.00 -1.24 -1.17 -1.57 115.58 113.50 2gca h ASN 55 Ca 0.40 -0.15 -0.20 0.00 0.71 0.00 0.00 56.30 57.06 2gca h ASN 55 Cb 0.41 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 39.25 2gca h ASN 55 CO -0.27 0.78 -0.83 0.00 -1.29 0.00 0.00 177.43 175.82 2gca h ALA 56 N 1.32 0.53 -0.01 1.57 0.00 -0.07 -2.76 119.26 119.84 2gca h ALA 56 Ca 0.17 -0.67 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 2gca h ALA 56 Cb 0.32 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2gca h ALA 56 CO 0.00 0.83 0.01 0.82 0.00 0.00 0.00 179.25 180.90 2gca h ILE 57 N 0.19 1.07 -0.01 0.00 2.04 -0.18 -2.70 117.51 117.92 2gca h ILE 57 Ca -0.05 -0.20 0.02 0.00 1.00 0.00 0.00 64.86 65.63 2gca h ILE 57 Cb 1.43 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.68 2gca h ILE 57 CO 0.14 0.05 -0.09 0.00 0.00 0.00 0.00 178.15 178.25 2gca h ALA 58 N 0.92 -0.09 -0.36 1.87 0.00 -1.32 -2.19 119.26 118.09 2gca h ALA 58 Ca 0.00 0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2gca h ALA 58 Cb 0.08 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.97 2gca h ALA 58 CO -0.00 -0.58 -0.08 0.45 0.00 0.00 0.00 179.25 179.03 2gca h HIS 59 N -0.16 -0.18 -0.42 0.00 3.86 -1.45 0.11 115.15 116.91 2gca h HIS 59 Ca 0.04 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.32 2gca h HIS 59 Cb 0.20 0.13 -0.04 0.00 1.06 0.00 0.00 27.41 28.77 2gca h HIS 59 CO -0.16 -0.15 0.18 0.28 0.86 0.00 0.00 177.93 178.94 2gca h VAL 60 N 0.01 0.92 -0.27 2.45 2.07 -1.30 -0.55 116.25 119.58 2gca h VAL 60 Ca 0.17 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.49 2gca h VAL 60 Cb 0.26 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2gca h VAL 60 CO -0.36 0.07 -0.15 -0.07 0.02 0.00 0.00 177.57 177.08 2gca h LEU 61 N 0.37 0.44 -0.22 2.57 3.38 -0.76 -2.78 115.31 118.31 2gca h LEU 61 Ca 0.19 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 2gca h LEU 61 Cb 0.14 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2gca h LEU 61 CO -0.16 0.62 -0.05 -0.33 0.09 0.00 0.00 178.44 178.61 2gca h GLU 62 N 0.42 0.42 0.00 1.13 5.08 -0.18 -2.60 114.58 118.85 2gca h GLU 62 Ca 0.08 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2gca h GLU 62 Cb 0.51 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2gca h GLU 62 CO 0.03 0.66 0.00 0.00 -1.00 0.00 0.00 179.01 178.70 2gca h ALA 63 N 0.75 1.00 -0.01 3.43 0.00 -0.98 -0.43 119.26 123.02 2gca h ALA 63 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2gca h ALA 63 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2gca h ALA 63 CO 0.02 0.00 -0.26 -1.13 0.00 0.00 0.00 179.25 177.88 2gca n SER 64 N -2.56 1.17 0.00 0.00 3.41 -1.06 -4.84 113.62 109.74 2gca n SER 64 Ca -0.01 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.59 2gca n SER 64 Cb 0.10 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 2gca n SER 64 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2gca n GLY 65 N 1.34 1.06 3.91 5.00 0.00 -0.17 -5.02 105.19 111.31 2gca n GLY 65 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2gca n GLY 65 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2gca s LEU 66 N 0.00 4.29 -0.40 0.99 1.43 -1.00 -5.04 118.68 118.95 2gca s LEU 66 Ca 0.00 0.49 -0.19 0.00 -1.03 0.00 0.00 54.13 53.39 2gca s LEU 66 Cb 0.00 -3.21 0.01 0.00 0.03 0.00 0.00 46.19 43.03 2gca s LEU 66 CO 0.00 0.07 0.57 -0.89 0.23 0.00 0.00 176.35 176.34 2gca s THR 67 N -1.64 4.93 -0.14 5.49 2.01 -1.26 -4.21 115.64 120.82 2gca s THR 67 Ca 0.39 0.15 -0.02 0.00 0.31 0.00 0.00 61.69 62.53 2gca s THR 67 Cb -0.12 -4.10 -0.02 0.00 0.01 0.00 0.00 72.50 68.27 2gca s THR 67 CO 0.26 -0.43 -0.09 -0.69 -0.69 0.00 0.00 174.62 172.97 2gca s VAL 68 N 2.58 3.40 0.12 3.82 1.01 -1.26 -0.95 120.40 129.12 2gca s VAL 68 Ca 0.20 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.53 2gca s VAL 68 Cb -0.15 -2.46 -0.06 0.00 0.00 0.00 0.00 36.38 33.71 2gca s VAL 68 CO 0.16 0.51 0.47 -0.83 0.00 0.00 0.00 175.10 175.41 2gca s GLY 69 N 0.33 2.37 -0.05 4.51 0.00 -0.09 0.48 107.32 114.87 2gca s GLY 69 Ca -0.08 -0.29 -0.00 0.00 0.00 0.00 0.00 44.72 44.35 2gca s GLY 69 CO 0.05 -0.07 -0.01 -2.27 0.00 0.00 0.00 173.10 170.79 2gca s LEU 70 N -2.06 0.99 -0.29 0.66 2.96 0.28 -0.69 118.68 120.53 2gca s LEU 70 Ca 0.37 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 54.22 2gca s LEU 70 Cb -0.14 -0.38 0.07 0.00 0.50 0.00 0.00 46.19 46.24 2gca s LEU 70 CO 0.19 -0.12 -0.04 -0.47 -1.32 0.00 0.00 176.35 174.59 2gca s TYR 71 N 1.35 3.45 0.38 5.38 5.04 -0.85 -1.09 117.35 131.02 2gca s TYR 71 Ca -0.05 -2.56 0.06 0.00 -2.44 0.00 0.00 57.07 52.08 2gca s TYR 71 Cb -0.13 -2.32 -0.02 0.00 0.35 0.00 0.00 41.96 39.84 2gca s TYR 71 CO -0.02 -0.90 0.22 0.95 -1.34 0.00 0.00 175.55 174.45 2gca s THR 72 N 1.03 0.25 -0.07 4.34 -4.23 -0.96 -1.92 115.64 114.08 2gca s THR 72 Ca -0.01 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.19 2gca s THR 72 Cb -0.20 -2.39 0.08 0.00 1.34 0.00 0.00 72.50 71.33 2gca s THR 72 CO -0.06 0.00 0.71 -0.55 -0.54 0.00 0.00 174.62 174.19 2gca s SER 73 N -3.50 -0.64 0.55 3.99 0.15 -1.26 -4.57 113.70 108.42 2gca s SER 73 Ca 0.32 0.73 -0.00 0.00 0.70 0.00 0.00 55.95 57.70 2gca s SER 73 Cb 0.02 0.57 0.06 0.00 -1.71 0.00 0.00 66.02 64.97 2gca s SER 73 CO 0.22 -0.56 0.43 -0.81 1.20 0.00 0.00 173.24 173.72 2gca n PRO 74 N 1.00 0.28 -3.55 5.44 -0.04 -1.26 -4.96 135.00 131.91 2gca n PRO 74 Ca -0.18 -1.16 -0.35 0.00 -0.04 0.00 0.00 63.50 61.77 2gca n PRO 74 Cb 0.57 -0.30 -0.05 0.00 -0.04 0.00 0.00 33.50 33.68 2gca n PRO 74 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2gca s PHE 75 N -1.23 3.59 -0.12 0.54 -0.12 -1.26 -4.94 117.98 114.45 2gca s PHE 75 Ca 0.29 0.83 -0.10 0.00 -0.05 0.00 0.00 56.93 57.90 2gca s PHE 75 Cb -0.02 -2.19 -0.03 0.00 -0.63 0.00 0.00 43.02 40.15 2gca s PHE 75 CO 0.19 0.52 -0.19 -0.89 -0.05 0.00 0.00 175.22 174.79 2gca n ILE 76 N 0.95 1.15 -0.04 -4.49 2.08 -1.26 -4.85 119.36 112.90 2gca n ILE 76 Ca -0.08 0.25 -0.02 0.00 0.56 0.00 0.00 62.75 63.46 2gca n ILE 76 Cb 0.52 -2.20 -0.01 0.00 -0.75 0.00 0.00 39.64 37.21 2gca n ILE 76 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 2gca h MET 77 N -0.80 0.00 -5.54 0.38 2.86 -1.96 -3.45 114.93 106.43 2gca h MET 77 Ca 0.00 0.00 -0.50 0.00 -2.06 0.00 0.00 59.70 57.14 2gca h MET 77 Cb 0.55 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.07 2gca h MET 77 CO 0.00 0.00 -0.68 1.03 1.06 0.00 0.00 176.91 178.32 2gca s ARG 78 N -1.69 1.56 0.28 1.72 0.52 -1.26 -5.03 118.95 115.05 2gca s ARG 78 Ca -0.07 -1.79 0.01 0.00 -0.52 0.00 0.00 55.73 53.36 2gca s ARG 78 Cb 0.01 -1.18 0.41 0.00 0.52 0.00 0.00 34.95 34.71 2gca s ARG 78 CO 0.10 0.05 1.77 0.35 0.02 0.00 0.00 175.30 177.59 2gca h PHE 79 N 2.28 0.69 0.00 -0.53 3.57 -1.95 -2.70 116.94 118.30 2gca h PHE 79 Ca -0.40 -0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.00 2gca h PHE 79 Cb 1.23 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.79 2gca h PHE 79 CO 0.68 0.71 0.19 -0.91 -2.23 0.00 0.00 178.31 176.75 2gca h ASN 80 N 0.60 0.00 0.35 0.41 4.21 -1.94 -0.67 115.58 118.54 2gca h ASN 80 Ca 0.11 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.62 2gca h ASN 80 Cb 0.49 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.69 2gca h ASN 80 CO 0.03 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.55 2gca n GLU 81 N -2.53 0.34 0.16 0.81 1.02 -1.02 -2.68 120.64 116.74 2gca n GLU 81 Ca -0.02 0.08 0.03 0.00 -0.02 0.00 0.00 57.16 57.24 2gca n GLU 81 Cb 0.23 -1.50 0.18 0.00 -0.02 0.00 0.00 31.44 30.33 2gca n GLU 81 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2gca h ARG 82 N 0.00 0.00 -4.12 3.49 2.47 -1.34 -3.42 114.38 111.46 2gca h ARG 82 Ca 0.00 0.00 -0.59 0.00 -1.26 0.00 0.00 59.98 58.13 2gca h ARG 82 Cb 0.17 0.00 -0.39 0.00 -1.65 0.00 0.00 29.97 28.11 2gca h ARG 82 CO 0.00 0.48 -0.78 0.42 0.56 0.00 0.00 179.97 180.65 2gca s ILE 83 N -3.28 1.28 0.06 2.04 1.01 -1.10 -2.27 121.20 118.94 2gca s ILE 83 Ca 0.02 -1.12 0.07 0.00 0.00 0.00 0.00 60.65 59.62 2gca s ILE 83 Cb 0.10 -1.64 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 2gca s ILE 83 CO 0.72 -0.18 -0.20 -0.04 0.00 0.00 0.00 174.94 175.24 2gca s MET 84 N 1.50 1.23 -0.19 2.79 -1.94 -0.25 -1.33 119.30 121.11 2gca s MET 84 Ca -0.03 -0.98 0.01 0.00 -1.71 0.00 0.00 55.69 52.98 2gca s MET 84 Cb -0.18 -1.37 0.03 0.00 2.01 0.00 0.00 34.83 35.32 2gca s MET 84 CO -0.08 0.34 -0.16 0.42 -0.01 0.00 0.00 175.02 175.53 2gca s ILE 85 N -0.92 1.90 -1.39 2.53 1.01 -0.93 0.10 121.20 123.50 2gca s ILE 85 Ca 0.06 -0.99 -0.08 0.00 0.00 0.00 0.00 60.65 59.64 2gca s ILE 85 Cb -0.09 -1.82 0.03 0.00 0.01 0.00 0.00 42.46 40.60 2gca s ILE 85 CO 0.02 0.38 1.02 0.47 0.00 0.00 0.00 174.94 176.83 2gca n ASP 86 N 4.64 -4.50 -2.41 3.58 8.00 0.18 -2.05 116.55 123.98 2gca n ASP 86 Ca -0.18 -0.67 -0.20 0.00 0.71 0.00 0.00 54.79 54.44 2gca n ASP 86 Cb 0.48 -4.51 -0.01 0.00 -0.02 0.00 0.00 41.12 37.06 2gca n ASP 86 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2gca n HIS 87 N -4.68 -1.06 -4.02 1.24 8.25 -1.26 -4.99 115.22 108.71 2gca n HIS 87 Ca -0.07 0.01 -0.34 0.00 -0.26 0.00 0.00 57.72 57.06 2gca n HIS 87 Cb 0.58 -3.88 -0.15 0.00 1.12 0.00 0.00 29.99 27.66 2gca n HIS 87 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2gca s GLU 88 N -5.06 2.84 0.58 -0.41 0.41 -0.87 -5.06 118.70 111.13 2gca s GLU 88 Ca 0.00 -0.96 -0.20 0.00 -0.41 0.00 0.00 54.97 53.41 2gca s GLU 88 Cb -0.00 -2.85 -0.05 0.00 -1.78 0.00 0.00 34.13 29.45 2gca s GLU 88 CO 0.01 -0.35 1.15 -2.30 -0.49 0.00 0.00 175.26 173.28 2gca n PRO 89 N 4.63 1.22 -1.72 0.39 -0.02 -1.26 -2.19 135.00 136.05 2gca n PRO 89 Ca -0.18 0.46 -0.42 0.00 -2.02 0.00 0.00 63.50 61.34 2gca n PRO 89 Cb 0.47 -2.35 -0.03 0.00 -0.02 0.00 0.00 33.50 31.58 2gca n PRO 89 CO 0.00 0.00 0.00 1.51 1.98 0.00 0.00 175.50 178.99 2gca n ILE 90 N -1.45 0.14 -1.76 4.25 3.06 -0.44 -4.90 119.36 118.27 2gca n ILE 90 Ca 0.13 -0.03 -0.38 0.00 -2.50 0.00 0.00 62.75 59.97 2gca n ILE 90 Cb 0.46 -1.96 0.06 0.00 0.54 0.00 0.00 39.64 38.74 2gca n ILE 90 CO 0.00 0.00 0.00 -2.84 -2.50 0.00 0.00 176.55 171.21 2gca s PRO 91 N 0.93 2.84 0.17 9.51 0.02 -1.26 -4.79 135.00 142.41 2gca s PRO 91 Ca 0.74 2.16 -0.16 0.00 0.02 0.00 0.00 61.00 63.75 2gca s PRO 91 Cb -0.51 -2.05 0.10 0.00 0.02 0.00 0.00 34.50 32.06 2gca s PRO 91 CO 0.35 -1.40 1.69 -0.44 -0.33 0.00 0.00 177.00 176.86 2gca h ASP 92 N 0.99 -0.22 -0.79 2.53 5.19 -1.99 -0.18 116.42 121.95 2gca h ASP 92 Ca -0.51 0.10 -0.01 0.00 -0.62 0.00 0.00 57.03 55.99 2gca h ASP 92 Cb 1.32 0.19 -0.04 0.00 0.18 0.00 0.00 39.33 40.98 2gca h ASP 92 CO 0.55 -0.07 0.46 0.00 -3.12 0.00 0.00 179.24 177.06 2gca h ALA 93 N 1.36 1.31 -0.14 3.45 0.00 -2.00 -0.39 119.26 122.85 2gca h ALA 93 Ca 0.19 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2gca h ALA 93 Cb 0.28 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2gca h ALA 93 CO -0.35 0.58 -0.32 0.00 0.00 0.00 0.00 179.25 179.16 2gca h ALA 94 N 1.40 1.20 -0.16 0.00 0.00 -1.70 -2.44 119.26 117.56 2gca h ALA 94 Ca 0.28 -0.35 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 2gca h ALA 94 Cb -0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2gca h ALA 94 CO -0.05 0.53 -0.62 1.25 0.00 0.00 0.00 179.25 180.36 2gca h LEU 95 N 0.24 0.63 -0.73 0.00 5.85 -0.11 -2.15 115.31 119.03 2gca h LEU 95 Ca 0.03 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.35 2gca h LEU 95 Cb 0.69 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2gca h LEU 95 CO 0.05 1.09 0.31 0.58 -0.34 0.00 0.00 178.44 180.14 2gca h VAL 96 N 0.41 1.25 -0.12 1.05 2.07 -0.74 -1.55 116.25 118.61 2gca h VAL 96 Ca -0.01 -0.75 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 2gca h VAL 96 Cb 1.18 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 2gca h VAL 96 CO 0.12 0.31 -0.06 0.78 0.02 0.00 0.00 177.57 178.73 2gca h ASN 97 N 1.04 0.26 0.14 0.57 2.35 -1.38 -2.54 115.58 116.03 2gca h ASN 97 Ca 0.25 -0.42 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 2gca h ASN 97 Cb 0.18 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2gca h ASN 97 CO -0.02 0.63 -0.12 0.00 -1.65 0.00 0.00 177.43 176.27 2gca h ALA 98 N 0.64 -0.25 -0.61 -0.83 0.00 -1.31 0.13 119.26 117.03 2gca h ALA 98 Ca 0.03 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.00 2gca h ALA 98 Cb 0.53 0.16 -0.08 0.00 0.00 0.00 0.00 17.79 18.40 2gca h ALA 98 CO 0.02 -0.65 0.17 0.28 0.00 0.00 0.00 179.25 179.06 2gca h VAL 99 N -0.27 0.68 -0.68 0.00 2.07 -1.36 0.85 116.25 117.54 2gca h VAL 99 Ca -0.00 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.36 2gca h VAL 99 Cb 0.25 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 2gca h VAL 99 CO -0.01 0.06 0.24 0.00 0.02 0.00 0.00 177.57 177.87 2gca h ALA 100 N 1.46 1.13 -0.18 1.67 0.00 -1.03 -0.28 119.26 122.03 2gca h ALA 100 Ca 0.32 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 2gca h ALA 100 Cb 0.45 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2gca h ALA 100 CO -0.37 0.61 -0.07 0.35 0.00 0.00 0.00 179.25 179.77 2gca h PHE 101 N 1.00 0.41 0.00 0.00 3.57 0.42 -2.40 116.94 119.94 2gca h PHE 101 Ca 0.23 -0.10 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2gca h PHE 101 Cb 0.25 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.89 2gca h PHE 101 CO 0.02 0.65 -0.04 0.28 -2.23 0.00 0.00 178.31 176.99 2gca h VAL 102 N 0.06 0.13 0.01 1.41 2.07 -0.72 -2.81 116.25 116.41 2gca h VAL 102 Ca 0.04 -0.50 -0.21 0.00 0.82 0.00 0.00 66.70 66.85 2gca h VAL 102 Cb 0.53 1.43 0.02 0.00 -1.52 0.00 0.00 31.29 31.75 2gca h VAL 102 CO 0.02 0.04 -0.84 -0.09 0.02 0.00 0.00 177.57 176.72 2gca h ARG 103 N 0.00 0.54 -0.68 1.57 2.43 -0.79 -1.77 114.38 115.69 2gca h ARG 103 Ca -0.00 -0.60 -0.06 0.00 -0.81 0.00 0.00 59.98 58.51 2gca h ARG 103 Cb 0.43 0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 2gca h ARG 103 CO 0.01 1.22 0.20 0.00 -1.51 0.00 0.00 179.97 179.89 2gca h ALA 104 N 0.34 1.07 -0.17 2.80 0.00 -1.28 0.19 119.26 122.22 2gca h ALA 104 Ca -0.11 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2gca h ALA 104 Cb 1.53 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2gca h ALA 104 CO 0.16 0.63 0.08 0.00 0.00 0.00 0.00 179.25 180.12 2gca h ALA 105 N 1.21 0.22 0.07 0.00 0.00 -1.53 -0.18 119.26 119.05 2gca h ALA 105 Ca 0.22 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.06 2gca h ALA 105 Cb 0.30 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2gca h ALA 105 CO -0.01 -0.21 -0.21 1.25 0.00 0.00 0.00 179.25 180.08 2gca h LEU 106 N 0.14 -0.59 -1.06 0.00 6.46 -0.77 -2.55 115.31 116.95 2gca h LEU 106 Ca 0.06 0.07 0.04 0.00 -0.12 0.00 0.00 57.88 57.93 2gca h LEU 106 Cb 0.13 0.23 -0.06 0.00 -0.73 0.00 0.00 40.66 40.24 2gca h LEU 106 CO -0.01 -0.28 0.63 -0.33 -0.62 0.00 0.00 178.44 177.83 2gca h GLU 107 N -0.37 1.18 -0.46 1.25 5.08 -0.44 -1.72 114.58 119.10 2gca h GLU 107 Ca 0.04 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2gca h GLU 107 Cb 0.41 -0.27 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 2gca h GLU 107 CO -0.15 0.78 0.22 0.00 -1.00 0.00 0.00 179.01 178.86 2gca h ARG 108 N 1.21 0.42 -0.90 2.33 -0.00 -0.74 -2.51 114.38 114.19 2gca h ARG 108 Ca 0.39 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.98 59.83 2gca h ARG 108 Cb 0.02 -0.10 -0.04 0.00 0.00 0.00 0.00 29.97 29.85 2gca h ARG 108 CO -0.12 0.28 0.54 -0.07 0.00 0.00 0.00 179.97 180.59 2gca h LEU 109 N 0.43 1.08 -0.36 3.04 3.38 -0.93 -1.78 115.31 120.17 2gca h LEU 109 Ca 0.20 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2gca h LEU 109 Cb 0.13 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.61 2gca h LEU 109 CO -0.15 0.83 0.00 0.00 0.09 0.00 0.00 178.44 179.21 2gca n GLN 110 N -4.36 0.13 0.17 1.13 6.02 -0.78 -0.57 117.38 119.12 2gca n GLN 110 Ca 0.10 0.32 0.12 0.00 -0.01 0.00 0.00 57.00 57.53 2gca n GLN 110 Cb 0.06 -1.73 0.20 0.00 1.02 0.00 0.00 30.24 29.79 2gca n GLN 110 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 2gca h GLN 111 N 0.00 0.00 0.00 -1.09 4.15 -0.93 -3.09 115.11 114.15 2gca h GLN 111 Ca 0.00 0.00 -0.44 0.00 0.77 0.00 0.00 58.65 58.98 2gca h GLN 111 Cb 0.39 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 28.01 2gca h GLN 111 CO 0.00 0.00 -2.46 1.04 -1.93 0.00 0.00 178.83 175.48 2gca n GLN 112 N -2.82 0.58 -3.66 1.69 6.02 -0.78 -4.76 117.38 113.64 2gca n GLN 112 Ca 0.04 0.25 -0.38 0.00 -0.01 0.00 0.00 57.00 56.90 2gca n GLN 112 Cb 0.51 -1.48 -0.09 0.00 1.02 0.00 0.00 30.24 30.21 2gca n GLN 112 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2gca s GLN 113 N -2.53 2.69 0.30 -1.09 0.74 0.26 -4.99 119.66 115.05 2gca s GLN 113 Ca -0.38 -2.46 0.03 0.00 0.05 0.00 0.00 55.36 52.61 2gca s GLN 113 Cb 0.14 -3.83 0.78 0.00 1.10 0.00 0.00 33.01 31.20 2gca s GLN 113 CO 0.48 -1.19 1.61 0.00 -0.55 0.00 0.00 175.29 175.64 2gca h ALA 114 N 7.25 1.30 -0.52 1.58 0.00 -1.79 -0.62 119.26 126.46 2gca h ALA 114 Ca -0.01 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2gca h ALA 114 Cb 0.97 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2gca h ALA 114 CO 0.73 -0.56 0.00 -0.25 0.00 0.00 0.00 179.25 179.16 2gca n ASP 115 N -5.35 3.62 -4.77 0.00 8.00 -1.26 -4.92 116.55 111.88 2gca n ASP 115 Ca 0.24 -2.27 -0.39 0.00 0.71 0.00 0.00 54.79 53.07 2gca n ASP 115 Cb 0.77 -0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 41.36 2gca n ASP 115 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2gca s PHE 116 N -1.66 3.32 0.27 1.24 5.36 -0.24 -5.01 117.98 121.25 2gca s PHE 116 Ca 0.39 1.60 -0.20 0.00 -0.96 0.00 0.00 56.93 57.76 2gca s PHE 116 Cb 0.24 -3.38 0.05 0.00 -0.34 0.00 0.00 43.02 39.60 2gca s PHE 116 CO 0.21 -1.01 0.87 1.21 -1.46 0.00 0.00 175.22 175.04 2gca s ASN 117 N -0.93 -0.09 0.14 6.13 3.84 -1.26 -4.81 114.94 117.96 2gca s ASN 117 Ca 0.50 -0.76 -0.01 0.00 0.21 0.00 0.00 52.86 52.79 2gca s ASN 117 Cb -0.32 0.67 -0.04 0.00 -0.55 0.00 0.00 41.25 41.00 2gca s ASN 117 CO 0.41 -1.29 0.06 0.54 -2.79 0.00 0.00 177.10 174.04 2gca s VAL 118 N -2.83 0.10 0.69 -5.21 0.11 -1.26 -4.95 120.40 107.05 2gca s VAL 118 Ca 0.15 -1.92 -0.03 0.00 -2.93 0.00 0.00 61.98 57.25 2gca s VAL 118 Cb -0.04 -2.10 0.09 0.00 -1.53 0.00 0.00 36.38 32.80 2gca s VAL 118 CO 0.07 -0.41 0.97 0.42 -3.33 0.00 0.00 175.10 172.82 2gca s THR 119 N -4.05 2.30 0.06 5.04 -4.23 -1.26 -4.29 115.64 109.21 2gca s THR 119 Ca 0.26 -0.49 -0.31 0.00 -1.18 0.00 0.00 61.69 59.97 2gca s THR 119 Cb 0.07 -2.81 -0.18 0.00 1.34 0.00 0.00 72.50 70.92 2gca s THR 119 CO 0.03 0.00 1.58 -0.08 -0.54 0.00 0.00 174.62 175.61 2gca h GLU 120 N -0.47 -0.77 -0.52 3.99 4.81 -1.83 -1.33 114.58 118.45 2gca h GLU 120 Ca -0.40 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 2gca h GLU 120 Cb 1.28 0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.81 2gca h GLU 120 CO 0.48 -0.49 0.33 0.35 -0.73 0.00 0.00 179.01 178.94 2gca h PHE 121 N -0.84 0.67 -0.49 0.92 3.57 -1.95 -0.67 116.94 118.15 2gca h PHE 121 Ca -0.08 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.31 2gca h PHE 121 Cb 0.63 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 2gca h PHE 121 CO -0.03 0.44 -0.17 0.93 -2.23 0.00 0.00 178.31 177.26 2gca h GLU 122 N 0.72 0.96 -0.36 1.11 5.08 -1.92 0.90 114.58 121.08 2gca h GLU 122 Ca 0.19 -0.38 -0.06 0.00 -1.00 0.00 0.00 59.36 58.11 2gca h GLU 122 Cb -0.05 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 2gca h GLU 122 CO -0.04 1.05 -0.03 0.35 -1.00 0.00 0.00 179.01 179.34 2gca h PHE 123 N 0.84 0.71 -0.48 4.33 3.57 -0.46 -1.26 116.94 124.19 2gca h PHE 123 Ca 0.12 -0.13 -0.12 0.00 3.53 0.00 0.00 57.97 61.37 2gca h PHE 123 Cb 0.73 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 2gca h PHE 123 CO 0.05 0.77 -0.16 0.82 -2.23 0.00 0.00 178.31 177.55 2gca h ILE 124 N 0.45 1.27 -0.43 1.41 2.04 -1.03 -1.59 117.51 119.63 2gca h ILE 124 Ca 0.10 -1.31 -0.09 0.00 1.00 0.00 0.00 64.86 64.56 2gca h ILE 124 Cb 0.50 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 2gca h ILE 124 CO 0.02 0.45 -0.09 0.74 0.00 0.00 0.00 178.15 179.28 2gca h THR 125 N 0.80 1.25 -0.38 -0.27 2.02 -0.79 -1.55 112.91 113.99 2gca h THR 125 Ca 0.11 -1.13 -0.12 0.00 0.77 0.00 0.00 66.41 66.05 2gca h THR 125 Cb 0.73 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 2gca h THR 125 CO 0.06 0.39 -0.23 0.00 0.37 0.00 0.00 175.52 176.11 2gca h ALA 126 N 1.20 0.55 -0.64 6.16 0.00 -1.04 -2.78 119.26 122.72 2gca h ALA 126 Ca 0.12 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 2gca h ALA 126 Cb 0.55 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 2gca h ALA 126 CO 0.03 0.52 0.08 1.25 0.00 0.00 0.00 179.25 181.13 2gca h LEU 127 N 0.64 1.04 -0.35 0.00 6.46 -1.13 -2.11 115.31 119.85 2gca h LEU 127 Ca 0.08 -0.26 -0.00 0.00 -0.12 0.00 0.00 57.88 57.58 2gca h LEU 127 Cb 0.79 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.43 2gca h LEU 127 CO 0.06 1.04 0.21 1.23 -0.62 0.00 0.00 178.44 180.37 2gca h GLY 128 N 1.03 0.51 0.97 3.75 0.00 -1.23 0.23 103.07 108.34 2gca h GLY 128 Ca 0.19 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 2gca h GLY 128 CO 0.02 0.21 0.25 -0.97 0.00 0.00 0.00 176.54 176.05 2gca h TYR 129 N 0.45 0.65 0.38 5.60 0.05 -1.35 0.14 116.97 122.89 2gca h TYR 129 Ca 0.13 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.87 2gca h TYR 129 Cb 0.02 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 37.55 2gca h TYR 129 CO -0.04 0.50 -0.18 2.35 -1.05 0.00 0.00 178.16 179.74 2gca h TRP 130 N 0.62 -0.47 -0.47 4.88 7.01 -1.15 -2.05 115.95 124.32 2gca h TRP 130 Ca 0.16 -0.01 0.09 0.00 2.11 0.00 0.00 58.89 61.24 2gca h TRP 130 Cb 0.07 0.15 -0.08 0.00 -2.10 0.00 0.00 29.16 27.20 2gca h TRP 130 CO -0.02 -0.24 -0.02 -0.92 -2.79 0.00 0.00 178.44 174.45 2gca h TYR 131 N -0.59 -0.07 -0.45 2.65 3.20 -0.32 0.29 116.97 121.68 2gca h TYR 131 Ca -0.05 0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.87 2gca h TYR 131 Cb 0.44 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.79 2gca h TYR 131 CO -0.03 -0.12 0.30 0.74 -1.64 0.00 0.00 178.16 177.41 2gca h PHE 132 N 0.09 0.53 -0.02 -3.82 0.05 -0.61 -0.31 116.94 112.85 2gca h PHE 132 Ca 0.23 0.01 -0.24 0.00 3.82 0.00 0.00 57.97 61.80 2gca h PHE 132 Cb 0.35 -0.18 0.01 0.00 2.00 0.00 0.00 35.95 38.13 2gca h PHE 132 CO -0.32 0.32 -0.95 0.00 -0.18 0.00 0.00 178.31 177.19 2gca h ARG 133 N 0.56 0.54 -0.18 1.51 2.47 -0.30 -1.97 114.38 117.02 2gca h ARG 133 Ca 0.17 -0.56 -0.00 0.00 -1.26 0.00 0.00 59.98 58.33 2gca h ARG 133 Cb 0.02 0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.48 2gca h ARG 133 CO -0.04 1.19 0.10 0.37 0.56 0.00 0.00 179.97 182.14 2gca h GLN 134 N 0.32 0.24 0.00 0.04 4.15 0.46 -1.64 115.11 118.68 2gca h GLN 134 Ca -0.09 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.30 2gca h GLN 134 Cb 1.58 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 29.22 2gca h GLN 134 CO 0.17 0.23 0.00 0.54 -1.93 0.00 0.00 178.83 177.85 2gca n ARG 135 N -4.92 0.56 -3.70 1.69 5.12 -0.22 -4.93 116.66 110.27 2gca n ARG 135 Ca -0.04 0.03 -0.25 0.00 -1.93 0.00 0.00 57.85 55.66 2gca n ARG 135 Cb 0.07 -1.50 0.03 0.00 -1.16 0.00 0.00 32.46 29.90 2gca n ARG 135 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2gca n GLN 136 N -1.16 -3.14 -1.42 5.56 6.02 -0.62 -4.96 117.38 117.65 2gca n GLN 136 Ca 0.15 0.55 -0.32 0.00 -0.01 0.00 0.00 57.00 57.38 2gca n GLN 136 Cb 0.15 -4.77 0.08 0.00 1.02 0.00 0.00 30.24 26.72 2gca n GLN 136 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 2gca s VAL 137 N -3.63 3.21 0.03 5.09 -7.23 -0.88 -4.96 120.40 112.02 2gca s VAL 137 Ca 0.20 0.46 -0.18 0.00 -1.81 0.00 0.00 61.98 60.65 2gca s VAL 137 Cb -0.06 -2.94 -0.21 0.00 0.56 0.00 0.00 36.38 33.73 2gca s VAL 137 CO 0.84 -0.45 1.17 0.44 -0.31 0.00 0.00 175.10 176.79 2gca h ASP 138 N -0.72 0.60 -4.75 4.85 3.32 -1.41 -3.45 116.42 114.86 2gca h ASP 138 Ca -0.45 -0.70 -0.11 0.00 0.02 0.00 0.00 57.03 55.79 2gca h ASP 138 Cb 1.24 -0.18 -0.21 0.00 0.22 0.00 0.00 39.33 40.40 2gca h ASP 138 CO 0.52 1.21 -0.21 0.54 -1.72 0.00 0.00 179.24 179.58 2gca s VAL 139 N -3.46 0.04 -0.13 -1.35 0.11 -1.21 -3.84 120.40 110.56 2gca s VAL 139 Ca -0.13 -0.31 0.01 0.00 -2.93 0.00 0.00 61.98 58.62 2gca s VAL 139 Cb 0.05 -0.65 0.02 0.00 -1.53 0.00 0.00 36.38 34.26 2gca s VAL 139 CO 0.83 -0.17 -0.16 0.00 -3.33 0.00 0.00 175.10 172.26 2gca s ALA 140 N -0.98 1.88 -0.42 1.54 0.00 -0.83 -0.91 121.76 122.03 2gca s ALA 140 Ca -0.10 -0.88 -0.23 0.00 0.00 0.00 0.00 51.96 50.75 2gca s ALA 140 Cb -0.04 -0.95 0.02 0.00 0.00 0.00 0.00 23.12 22.15 2gca s ALA 140 CO 0.04 -0.17 0.78 0.08 0.00 0.00 0.00 175.76 176.50 2gca s VAL 141 N 1.11 4.68 -0.23 0.00 1.01 0.13 -1.94 120.40 125.17 2gca s VAL 141 Ca -0.03 0.60 -0.10 0.00 0.00 0.00 0.00 61.98 62.45 2gca s VAL 141 Cb -0.14 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 31.91 2gca s VAL 141 CO -0.05 -0.61 0.14 -0.63 0.00 0.00 0.00 175.10 173.95 2gca s ILE 142 N 3.22 5.16 -0.23 2.22 -1.09 0.30 -2.00 121.20 128.78 2gca s ILE 142 Ca 0.30 0.11 -0.12 0.00 -2.23 0.00 0.00 60.65 58.71 2gca s ILE 142 Cb -0.12 -3.40 -0.05 0.00 -1.58 0.00 0.00 42.46 37.31 2gca s ILE 142 CO 0.21 0.36 0.25 -0.70 -1.23 0.00 0.00 174.94 173.83 2gca s GLU 143 N 1.02 4.09 0.38 2.79 2.12 -0.81 0.30 118.70 128.60 2gca s GLU 143 Ca 0.07 -0.10 -0.27 0.00 0.36 0.00 0.00 54.97 55.02 2gca s GLU 143 Cb -0.14 -3.55 -0.09 0.00 0.26 0.00 0.00 34.13 30.61 2gca s GLU 143 CO 0.04 -0.01 1.35 0.08 -0.54 0.00 0.00 175.26 176.18 2gca s VAL 144 N 1.25 2.50 0.02 3.70 1.01 0.10 -4.85 120.40 124.13 2gca s VAL 144 Ca 0.12 0.47 -0.19 0.00 0.00 0.00 0.00 61.98 62.37 2gca s VAL 144 Cb -0.14 -3.29 -0.11 0.00 0.00 0.00 0.00 36.38 32.84 2gca s VAL 144 CO 0.06 0.09 1.08 1.23 0.00 0.00 0.00 175.10 177.56 2gca h GLY 145 N 2.90 -0.73 -5.31 4.51 0.00 -1.96 -3.47 103.07 99.00 2gca h GLY 145 Ca -0.50 0.27 -0.12 0.00 0.00 0.00 0.00 47.33 46.99 2gca h GLY 145 CO 0.63 -0.27 -0.23 -0.42 0.00 0.00 0.00 176.54 176.26 2gca s ILE 146 N -4.17 -0.01 0.00 2.60 -1.09 -1.26 -5.06 121.20 112.21 2gca s ILE 146 Ca -0.10 0.02 0.00 0.00 -2.23 0.00 0.00 60.65 58.34 2gca s ILE 146 Cb 0.01 -0.60 0.00 0.00 -1.58 0.00 0.00 42.46 40.29 2gca s ILE 146 CO 0.31 0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.63 2gca n GLY 147 N 3.16 1.35 0.00 6.18 0.00 -1.26 -4.52 105.19 110.10 2gca n GLY 147 Ca -0.15 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2gca n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2gca n GLY 148 N 0.00 -0.69 0.35 -0.02 0.00 -1.26 -3.93 105.19 99.65 2gca n GLY 148 Ca 0.00 0.36 -0.09 0.00 0.00 0.00 0.00 46.02 46.29 2gca n GLY 148 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2gca n ASP 149 N 0.00 -0.88 -1.73 1.61 2.03 -0.20 -0.97 116.55 116.42 2gca n ASP 149 Ca 0.00 1.49 0.08 0.00 0.52 0.00 0.00 54.79 56.88 2gca n ASP 149 Cb 0.00 -0.20 0.38 0.00 -0.72 0.00 0.00 41.12 40.58 2gca n ASP 149 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2gca n THR 150 N -5.06 2.40 -2.37 5.18 -2.24 -1.26 -4.86 114.28 106.08 2gca n THR 150 Ca 0.02 -1.36 -0.38 0.00 -2.27 0.00 0.00 64.05 60.06 2gca n THR 150 Cb 0.22 -0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 2gca n THR 150 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2gca s ASP 151 N -0.89 6.65 0.54 3.42 2.15 -0.14 -4.93 116.67 123.48 2gca s ASP 151 Ca 0.53 2.27 0.26 0.00 0.43 0.00 0.00 52.55 56.04 2gca s ASP 151 Cb 0.38 -2.61 1.44 0.00 -0.30 0.00 0.00 42.92 41.83 2gca s ASP 151 CO 0.19 -0.58 2.00 0.28 -0.17 0.00 0.00 175.17 176.89 2gca h SER 152 N 2.73 0.00 1.78 -0.34 0.02 -1.93 -0.69 113.55 115.13 2gca h SER 152 Ca -0.48 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.44 2gca h SER 152 Cb 1.23 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.76 2gca h SER 152 CO 0.63 0.00 -0.22 0.71 -1.14 0.00 0.00 176.83 176.81 2gca h THR 153 N 0.00 0.16 -0.00 -2.27 1.35 -1.91 -3.40 112.91 106.83 2gca h THR 153 Ca 0.22 -1.23 -0.66 0.00 -0.55 0.00 0.00 66.41 64.19 2gca h THR 153 Cb 0.94 2.02 0.03 0.00 -1.73 0.00 0.00 68.15 69.41 2gca h THR 153 CO -0.00 0.09 2.49 -3.20 -0.25 0.00 0.00 175.52 174.65 2gca n ASN 154 N -3.07 2.83 -0.97 5.36 5.15 -0.27 -3.83 115.26 120.47 2gca n ASN 154 Ca 0.03 -2.72 0.00 0.00 -0.60 0.00 0.00 54.58 51.30 2gca n ASN 154 Cb 0.57 -1.24 -0.00 0.00 -0.53 0.00 0.00 39.78 38.58 2gca n ASN 154 CO 0.00 0.00 0.00 0.55 1.40 0.00 0.00 177.26 179.21 2gca n VAL 155 N 5.80 0.00 -4.37 3.44 3.14 -1.26 -4.89 118.33 120.19 2gca n VAL 155 Ca 0.50 -0.39 -0.19 0.00 -2.96 0.00 0.00 64.34 61.30 2gca n VAL 155 Cb 0.40 0.63 -0.10 0.00 -1.06 0.00 0.00 33.84 33.71 2gca n VAL 155 CO 0.00 0.00 0.00 0.27 -6.46 0.00 0.00 176.83 170.64 2gca s ILE 156 N 0.00 1.33 -0.37 1.55 -4.36 -1.25 -4.83 121.20 113.27 2gca s ILE 156 Ca 0.13 -2.08 -0.01 0.00 -0.26 0.00 0.00 60.65 58.43 2gca s ILE 156 Cb 0.15 -2.36 0.10 0.00 1.25 0.00 0.00 42.46 41.60 2gca s ILE 156 CO -0.07 -0.34 0.13 -0.89 0.24 0.00 0.00 174.94 174.01 2gca s THR 157 N -3.22 3.00 0.88 8.37 2.01 -1.26 -5.07 115.64 120.35 2gca s THR 157 Ca 0.28 -1.99 -0.13 0.00 0.31 0.00 0.00 61.69 60.16 2gca s THR 157 Cb 0.04 -3.02 0.12 0.00 0.01 0.00 0.00 72.50 69.65 2gca s THR 157 CO 0.10 -0.56 1.18 -2.16 -0.69 0.00 0.00 174.62 172.49 2gca s PRO 158 N 1.11 1.41 -0.03 4.92 0.04 -1.26 -4.66 135.00 136.52 2gca s PRO 158 Ca 0.06 0.09 -0.03 0.00 0.04 0.00 0.00 61.00 61.16 2gca s PRO 158 Cb -0.21 -1.89 -0.27 0.00 0.04 0.00 0.00 34.50 32.16 2gca s PRO 158 CO -0.04 -1.98 0.72 0.28 0.04 0.00 0.00 177.00 176.02 2gca h VAL 159 N -1.33 1.00 -3.53 -0.36 2.07 -0.91 -3.48 116.25 109.71 2gca h VAL 159 Ca -0.47 -2.66 -0.13 0.00 0.82 0.00 0.00 66.70 64.26 2gca h VAL 159 Cb 1.32 2.68 -0.19 0.00 -1.52 0.00 0.00 31.29 33.58 2gca h VAL 159 CO 0.60 0.80 -0.43 -0.69 0.02 0.00 0.00 177.57 177.86 2gca s VAL 160 N -2.60 0.10 -0.08 2.57 1.01 -1.25 -4.31 120.40 115.84 2gca s VAL 160 Ca -0.12 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.09 2gca s VAL 160 Cb 0.07 -0.71 -0.00 0.00 0.00 0.00 0.00 36.38 35.73 2gca s VAL 160 CO 0.84 -0.45 -0.21 -0.44 0.00 0.00 0.00 175.10 174.84 2gca s SER 161 N -1.78 2.70 -0.07 3.32 0.01 -0.76 -1.75 113.70 115.37 2gca s SER 161 Ca -0.09 -0.47 0.04 0.00 1.31 0.00 0.00 55.95 56.73 2gca s SER 161 Cb -0.04 -1.05 -0.02 0.00 0.21 0.00 0.00 66.02 65.13 2gca s SER 161 CO -0.01 0.16 -0.18 -0.69 0.41 0.00 0.00 173.24 172.92 2gca s VAL 162 N 0.24 2.67 -0.35 3.43 1.01 0.96 -0.52 120.40 127.84 2gca s VAL 162 Ca -0.12 -0.84 -0.00 0.00 0.00 0.00 0.00 61.98 61.01 2gca s VAL 162 Cb -0.16 -2.04 0.13 0.00 0.00 0.00 0.00 36.38 34.31 2gca s VAL 162 CO 0.06 0.57 0.19 -0.22 0.00 0.00 0.00 175.10 175.69 2gca s LEU 163 N -0.24 1.37 0.09 3.92 0.20 -0.35 -1.38 118.68 122.29 2gca s LEU 163 Ca -0.00 -2.02 -0.30 0.00 0.69 0.00 0.00 54.13 52.50 2gca s LEU 163 Cb -0.13 -0.57 -0.15 0.00 -0.43 0.00 0.00 46.19 44.91 2gca s LEU 163 CO 0.03 -0.34 1.64 0.71 -0.29 0.00 0.00 176.35 178.10 2gca h THR 164 N 5.52 0.44 -2.13 3.68 1.35 -1.65 -2.80 112.91 117.33 2gca h THR 164 Ca -0.03 0.00 0.15 0.00 -0.55 0.00 0.00 66.41 65.98 2gca h THR 164 Cb 0.98 0.44 -0.15 0.00 -1.73 0.00 0.00 68.15 67.69 2gca h THR 164 CO 0.37 0.00 0.56 -1.83 -0.25 0.00 0.00 175.52 174.36 2gca s GLU 165 N -6.07 0.76 -0.11 4.72 -1.05 -1.26 -2.88 118.70 112.81 2gca s GLU 165 Ca -0.16 -0.31 0.04 0.00 -0.15 0.00 0.00 54.97 54.38 2gca s GLU 165 Cb 0.05 0.33 -0.00 0.00 -0.44 0.00 0.00 34.13 34.07 2gca s GLU 165 CO 0.63 -0.34 -0.23 0.08 0.95 0.00 0.00 175.26 176.36 2gca s VAL 166 N -3.00 2.14 0.20 1.83 1.01 -1.26 -0.25 120.40 121.07 2gca s VAL 166 Ca 0.07 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.01 2gca s VAL 166 Cb -0.01 -1.82 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2gca s VAL 166 CO -0.07 0.56 0.24 0.00 0.00 0.00 0.00 175.10 175.82 2gca s ALA 167 N 0.39 0.62 -0.80 5.51 0.00 -1.26 -4.87 121.76 121.35 2gca s ALA 167 Ca -0.17 -1.36 0.05 0.00 0.00 0.00 0.00 51.96 50.48 2gca s ALA 167 Cb -0.18 1.19 0.27 0.00 0.00 0.00 0.00 23.12 24.40 2gca s ALA 167 CO 0.08 -0.66 0.92 1.28 0.00 0.00 0.00 175.76 177.38 2gca n LEU 168 N -0.28 2.51 -0.09 0.00 4.32 -1.26 -4.40 117.00 117.81 2gca n LEU 168 Ca -0.01 -1.27 -0.10 0.00 -0.02 0.00 0.00 56.01 54.61 2gca n LEU 168 Cb 0.64 -0.55 -0.03 0.00 -1.62 0.00 0.00 43.42 41.87 2gca n LEU 168 CO 0.29 0.37 0.90 0.44 -1.22 0.00 0.00 177.39 178.17 2gca h ASP 169 N 1.32 0.38 -0.81 -1.43 5.19 -1.97 -2.95 116.42 116.15 2gca h ASP 169 Ca 0.00 -0.14 -0.35 0.00 -0.62 0.00 0.00 57.03 55.92 2gca h ASP 169 Cb 0.96 -0.10 -0.21 0.00 0.18 0.00 0.00 39.33 40.17 2gca h ASP 169 CO 0.16 0.41 0.45 1.41 -3.12 0.00 0.00 179.24 178.55 2gca n HIS 170 N -4.78 2.58 0.12 4.55 8.25 -1.26 -4.65 115.22 120.03 2gca n HIS 170 Ca -0.02 -1.46 0.05 0.00 -0.26 0.00 0.00 57.72 56.03 2gca n HIS 170 Cb 0.11 -0.78 0.27 0.00 1.12 0.00 0.00 29.99 30.71 2gca n HIS 170 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 2gca n GLN 171 N -0.60 0.07 0.17 -0.41 7.27 -1.12 -1.25 117.38 121.50 2gca n GLN 171 Ca 0.47 0.50 0.12 0.00 0.07 0.00 0.00 57.00 58.16 2gca n GLN 171 Cb 1.46 -2.00 0.09 0.00 2.41 0.00 0.00 30.24 32.21 2gca n GLN 171 CO 0.00 0.00 0.00 0.87 0.07 0.00 0.00 177.06 178.00 2gca h LYS 172 N 0.00 0.00 0.00 3.69 1.57 -1.83 -3.30 116.57 116.71 2gca h LYS 172 Ca 0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2gca h LYS 172 Cb 0.56 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.85 2gca h LYS 172 CO 0.00 0.00 -1.52 1.28 -0.57 0.00 0.00 179.45 178.64 2gca n LEU 173 N -2.90 2.83 0.06 2.94 4.77 -0.38 -4.85 117.00 119.47 2gca n LEU 173 Ca 0.02 -0.04 -0.03 0.00 -0.03 0.00 0.00 56.01 55.93 2gca n LEU 173 Cb 0.54 -0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 2gca n LEU 173 CO 0.37 0.62 0.15 -0.07 -1.33 0.00 0.00 177.39 177.13 2gca h LEU 174 N -0.02 -0.17 0.00 2.23 3.38 -1.66 -3.51 115.31 115.56 2gca h LEU 174 Ca -0.20 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2gca h LEU 174 Cb 1.31 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.10 2gca h LEU 174 CO -0.04 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.15 2gca n GLY 175 N 0.94 -1.10 0.11 0.83 0.00 -1.24 -4.67 105.19 100.05 2gca n GLY 175 Ca -0.02 -1.01 0.12 0.00 0.00 0.00 0.00 46.02 45.10 2gca n GLY 175 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2gca h HIS 176 N 0.00 0.00 -2.20 1.61 3.86 -1.96 -3.40 115.15 113.06 2gca h HIS 176 Ca 0.00 0.00 -0.56 0.00 -1.16 0.00 0.00 60.37 58.65 2gca h HIS 176 Cb 0.00 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.33 2gca h HIS 176 CO 0.00 0.00 -0.64 0.95 0.86 0.00 0.00 177.93 179.10 2gca s THR 177 N -3.33 1.83 0.15 2.45 -4.23 -1.26 -5.03 115.64 106.21 2gca s THR 177 Ca 0.01 -2.09 -0.17 0.00 -1.18 0.00 0.00 61.69 58.26 2gca s THR 177 Cb 0.10 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 71.22 2gca s THR 177 CO 0.78 -0.13 1.79 0.40 -0.54 0.00 0.00 174.62 176.92 2gca h ILE 178 N 2.03 1.03 -0.17 2.99 1.08 -1.95 -2.26 117.51 120.26 2gca h ILE 178 Ca -0.42 -0.14 0.05 0.00 -0.39 0.00 0.00 64.86 63.96 2gca h ILE 178 Cb 1.24 0.57 -0.07 0.00 -3.07 0.00 0.00 36.82 35.50 2gca h ILE 178 CO 0.73 0.08 -0.32 0.74 -0.69 0.00 0.00 178.15 178.68 2gca h THR 179 N 0.42 0.28 -0.43 -0.27 2.02 -1.96 0.31 112.91 113.28 2gca h THR 179 Ca 0.14 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.37 2gca h THR 179 Cb 0.02 0.28 -0.04 0.00 -1.74 0.00 0.00 68.15 66.67 2gca h THR 179 CO -0.07 0.00 0.18 0.00 0.37 0.00 0.00 175.52 176.00 2gca h ALA 180 N 0.48 0.53 -0.29 6.16 0.00 -1.91 -1.64 119.26 122.59 2gca h ALA 180 Ca 0.11 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2gca h ALA 180 Cb 0.54 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 2gca h ALA 180 CO -0.38 -0.19 -0.16 0.82 0.00 0.00 0.00 179.25 179.34 2gca h ILE 181 N 0.37 1.24 -0.25 0.00 2.04 -0.81 -2.75 117.51 117.36 2gca h ILE 181 Ca 0.19 -1.09 -0.11 0.00 1.00 0.00 0.00 64.86 64.86 2gca h ILE 181 Cb 0.15 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 2gca h ILE 181 CO -0.17 0.35 -0.29 0.00 0.00 0.00 0.00 178.15 178.04 2gca h ALA 182 N 1.38 1.03 -0.81 1.87 0.00 0.14 -2.88 119.26 119.99 2gca h ALA 182 Ca 0.08 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.66 2gca h ALA 182 Cb 0.54 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2gca h ALA 182 CO 0.03 0.59 0.53 0.87 0.00 0.00 0.00 179.25 181.27 2gca h LYS 183 N 0.43 0.95 0.79 0.00 1.57 -1.00 -1.43 116.57 117.89 2gca h LYS 183 Ca 0.06 -0.06 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2gca h LYS 183 Cb 0.74 -0.22 0.01 0.00 0.08 0.00 0.00 32.23 32.84 2gca h LYS 183 CO 0.06 0.63 -0.38 0.45 -0.57 0.00 0.00 179.45 179.64 2gca h HIS 184 N 0.98 -0.98 -0.72 -1.35 3.86 -1.52 -3.15 115.15 112.26 2gca h HIS 184 Ca 0.33 -0.02 0.14 0.00 -1.16 0.00 0.00 60.37 59.65 2gca h HIS 184 Cb 0.07 0.33 -0.05 0.00 1.06 0.00 0.00 27.41 28.82 2gca h HIS 184 CO -0.00 -0.61 0.48 0.87 0.86 0.00 0.00 177.93 179.53 2gca h LYS 185 N -1.24 0.39 0.00 2.45 1.57 -1.46 0.26 116.57 118.54 2gca h LYS 185 Ca -0.11 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2gca h LYS 185 Cb 0.81 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.04 2gca h LYS 185 CO 0.18 0.26 0.00 0.00 -0.57 0.00 0.00 179.45 179.31 2gca h ALA 186 N 1.66 1.00 0.00 3.86 0.00 -1.26 -2.91 119.26 121.60 2gca h ALA 186 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 2gca h ALA 186 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2gca h ALA 186 CO -0.11 0.00 0.00 0.78 0.00 0.00 0.00 179.25 179.92 2gca h GLY 187 N 1.72 0.00 -1.05 0.00 0.00 -0.53 -1.06 103.07 102.16 2gca h GLY 187 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2gca h GLY 187 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.54 176.83 2gca n ILE 188 N -2.72 0.32 -3.15 2.60 -5.35 -1.10 -4.61 119.36 105.35 2gca n ILE 188 Ca -0.02 -0.41 -0.39 0.00 -0.27 0.00 0.00 62.75 61.66 2gca n ILE 188 Cb 0.07 0.35 -0.05 0.00 -1.74 0.00 0.00 39.64 38.27 2gca n ILE 188 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2gca s ILE 189 N -1.68 5.07 0.21 7.28 1.01 -0.40 -4.88 121.20 127.81 2gca s ILE 189 Ca 0.30 1.21 0.11 0.00 0.00 0.00 0.00 60.65 62.26 2gca s ILE 189 Cb 0.16 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 2gca s ILE 189 CO 0.23 0.21 -0.18 -0.54 0.00 0.00 0.00 174.94 174.67 2gca s LYS 190 N 1.22 1.75 -0.18 2.79 -0.14 -1.26 -5.05 119.74 118.87 2gca s LYS 190 Ca 0.31 -1.49 -0.37 0.00 -1.36 0.00 0.00 55.97 53.06 2gca s LYS 190 Cb -0.16 -1.94 -0.13 0.00 -1.68 0.00 0.00 37.83 33.91 2gca s LYS 190 CO 0.13 0.39 1.83 0.54 -0.76 0.00 0.00 175.35 177.48 2gca n ARG 191 N -0.03 1.71 0.00 1.68 1.74 -1.26 -1.55 116.66 118.94 2gca n ARG 191 Ca -0.10 0.63 0.00 0.00 -0.77 0.00 0.00 57.85 57.60 2gca n ARG 191 Cb 0.57 -2.40 0.00 0.00 -1.02 0.00 0.00 32.46 29.61 2gca n ARG 191 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2gca n GLY 192 N 4.34 2.90 3.70 -0.13 0.00 -0.04 -5.00 105.19 110.95 2gca n GLY 192 Ca 0.25 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 2gca n GLY 192 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gca s ILE 193 N -2.87 5.07 0.66 -0.61 -1.09 -0.60 -4.76 121.20 117.00 2gca s ILE 193 Ca 0.00 1.24 -0.16 0.00 -2.23 0.00 0.00 60.65 59.50 2gca s ILE 193 Cb 0.00 -3.96 0.00 0.00 -1.58 0.00 0.00 42.46 36.93 2gca s ILE 193 CO 0.00 0.21 1.17 -2.16 -1.23 0.00 0.00 174.94 172.93 2gca s PRO 194 N 1.20 2.66 -0.04 2.79 0.04 -1.26 -4.44 135.00 135.95 2gca s PRO 194 Ca 0.32 1.64 0.03 0.00 0.04 0.00 0.00 61.00 63.03 2gca s PRO 194 Cb -0.16 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2gca s PRO 194 CO 0.13 -1.41 -0.13 0.54 0.04 0.00 0.00 177.00 176.17 2gca s VAL 195 N -2.00 1.15 -0.18 -0.36 0.11 -0.39 -1.83 120.40 116.90 2gca s VAL 195 Ca 0.72 -0.55 -0.01 0.00 -2.93 0.00 0.00 61.98 59.21 2gca s VAL 195 Cb -0.26 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.59 2gca s VAL 195 CO 0.39 0.34 -0.13 -0.69 -3.33 0.00 0.00 175.10 171.69 2gca s VAL 196 N 0.16 2.73 0.22 2.04 1.01 0.33 -1.63 120.40 125.25 2gca s VAL 196 Ca -0.04 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.28 2gca s VAL 196 Cb -0.11 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 34.04 2gca s VAL 196 CO 0.02 0.49 -0.11 0.42 0.00 0.00 0.00 175.10 175.92 2gca s THR 197 N 1.16 1.62 0.00 3.92 -4.23 -0.70 -1.21 115.64 116.20 2gca s THR 197 Ca 0.01 -2.16 0.00 0.00 -1.18 0.00 0.00 61.69 58.36 2gca s THR 197 Cb -0.14 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.53 2gca s THR 197 CO -0.05 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 2gca n GLY 198 N -0.43 -0.99 3.45 3.99 0.00 -1.05 -1.02 105.19 109.13 2gca n GLY 198 Ca -0.07 -1.64 -0.44 0.00 0.00 0.00 0.00 46.02 43.87 2gca n GLY 198 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2gca s ASN 199 N -1.02 6.80 0.52 1.61 2.47 -1.26 -3.75 114.94 120.31 2gca s ASN 199 Ca 0.00 -2.42 -0.22 0.00 0.42 0.00 0.00 52.86 50.64 2gca s ASN 199 Cb 0.00 -2.39 -0.06 0.00 -1.45 0.00 0.00 41.25 37.36 2gca s ASN 199 CO 0.00 -0.92 1.27 -0.76 -3.72 0.00 0.00 177.10 172.97 2gca s LEU 200 N 2.12 3.88 0.66 3.21 1.43 -1.26 -4.99 118.68 123.73 2gca s LEU 200 Ca 0.35 2.55 -0.16 0.00 -1.03 0.00 0.00 54.13 55.84 2gca s LEU 200 Cb -0.04 -4.30 0.00 0.00 0.03 0.00 0.00 46.19 41.87 2gca s LEU 200 CO -0.06 -1.34 1.17 0.68 0.23 0.00 0.00 176.35 177.03 2gca s VAL 201 N -1.42 2.73 0.30 -1.59 -7.23 -1.26 -4.57 120.40 107.36 2gca s VAL 201 Ca 0.69 0.38 0.03 0.00 -1.81 0.00 0.00 61.98 61.28 2gca s VAL 201 Cb -0.35 -2.99 0.40 0.00 0.56 0.00 0.00 36.38 34.00 2gca s VAL 201 CO 0.41 -0.17 1.49 -0.81 -0.31 0.00 0.00 175.10 175.72 2gca n PRO 202 N -2.23 -0.07 -0.13 4.82 -0.04 -1.26 -1.42 135.00 134.66 2gca n PRO 202 Ca 0.12 1.41 -0.04 0.00 -0.04 0.00 0.00 63.50 64.95 2gca n PRO 202 Cb 0.51 -2.27 0.15 0.00 -0.04 0.00 0.00 33.50 31.85 2gca n PRO 202 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2gca h ASP 203 N 0.00 0.81 0.56 3.54 3.32 -1.98 -2.26 116.42 120.42 2gca h ASP 203 Ca 0.60 -0.18 -0.23 0.00 0.02 0.00 0.00 57.03 57.24 2gca h ASP 203 Cb 1.28 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.61 2gca h ASP 203 CO -0.88 0.84 -1.04 0.00 -1.72 0.00 0.00 179.24 176.43 2gca h ALA 204 N 1.26 0.30 0.00 3.45 0.00 -1.58 -3.16 119.26 119.54 2gca h ALA 204 Ca 0.16 -0.79 -0.06 0.00 0.00 0.00 0.00 54.91 54.22 2gca h ALA 204 Cb 0.40 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2gca h ALA 204 CO 0.01 0.93 -0.27 0.00 0.00 0.00 0.00 179.25 179.92 2gca h ALA 205 N 0.76 1.51 -0.00 0.00 0.00 -1.01 -2.32 119.26 118.20 2gca h ALA 205 Ca -0.09 -0.25 -0.22 0.00 0.00 0.00 0.00 54.91 54.36 2gca h ALA 205 Cb 1.72 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.47 2gca h ALA 205 CO 0.17 0.34 -0.92 0.00 0.00 0.00 0.00 179.25 178.84 2gca h ALA 206 N 1.73 0.41 -0.48 0.00 0.00 -1.44 -1.62 119.26 117.86 2gca h ALA 206 Ca -0.00 -0.71 -0.05 0.00 0.00 0.00 0.00 54.91 54.15 2gca h ALA 206 Cb 0.49 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2gca h ALA 206 CO 0.04 0.84 0.10 0.28 0.00 0.00 0.00 179.25 180.50 2gca h VAL 207 N 0.20 1.24 -0.19 0.00 2.07 -1.41 -2.21 116.25 115.95 2gca h VAL 207 Ca -0.07 -0.87 -0.12 0.00 0.82 0.00 0.00 66.70 66.45 2gca h VAL 207 Cb 1.55 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2gca h VAL 207 CO 0.15 0.31 -0.36 0.58 0.02 0.00 0.00 177.57 178.27 2gca h VAL 208 N 0.65 1.33 -0.41 2.57 2.07 -1.44 -1.45 116.25 119.57 2gca h VAL 208 Ca 0.15 -1.60 0.08 0.00 0.82 0.00 0.00 66.70 66.15 2gca h VAL 208 Cb 0.36 1.88 -0.08 0.00 -1.52 0.00 0.00 31.29 31.93 2gca h VAL 208 CO 0.01 0.49 -0.07 0.00 0.02 0.00 0.00 177.57 178.01 2gca h ALA 209 N 0.59 0.30 -0.17 1.67 0.00 -1.26 0.12 119.26 120.52 2gca h ALA 209 Ca 0.01 0.15 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 2gca h ALA 209 Cb 0.96 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2gca h ALA 209 CO 0.08 -0.44 -0.40 0.00 0.00 0.00 0.00 179.25 178.49 2gca h ALA 210 N 1.40 1.00 -0.05 0.00 0.00 -1.40 -2.61 119.26 117.60 2gca h ALA 210 Ca 0.20 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2gca h ALA 210 Cb 0.30 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2gca h ALA 210 CO -0.40 0.61 0.00 -0.22 0.00 0.00 0.00 179.25 179.25 2gca h LYS 211 N 0.32 0.08 -0.59 0.00 1.63 -0.12 -3.10 116.57 114.78 2gca h LYS 211 Ca 0.03 -0.02 -0.04 0.00 -0.85 0.00 0.00 60.65 59.76 2gca h LYS 211 Cb 0.85 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.45 2gca h LYS 211 CO 0.07 0.35 0.21 -0.39 -3.45 0.00 0.00 179.45 176.23 2gca h VAL 212 N -0.20 1.22 -0.00 2.00 -1.51 -0.81 -1.11 116.25 115.84 2gca h VAL 212 Ca 0.01 -0.73 0.00 0.00 -1.23 0.00 0.00 66.70 64.76 2gca h VAL 212 Cb 0.31 0.55 -0.00 0.00 -2.13 0.00 0.00 31.29 30.02 2gca h VAL 212 CO 0.00 0.28 0.01 0.00 -1.23 0.00 0.00 177.57 176.63 2gca h ALA 213 N 1.37 1.27 0.10 5.19 0.00 -1.41 1.30 119.26 127.07 2gca h ALA 213 Ca 0.20 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.79 2gca h ALA 213 Cb 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2gca h ALA 213 CO -0.01 -0.01 -1.71 1.15 0.00 0.00 0.00 179.25 178.67 2gca h THR 214 N 0.00 0.93 -0.01 0.00 2.02 -1.15 -3.35 112.91 111.35 2gca h THR 214 Ca 0.00 -2.63 0.00 0.00 0.77 0.00 0.00 66.41 64.55 2gca h THR 214 Cb 0.02 2.62 0.00 0.00 -1.74 0.00 0.00 68.15 69.05 2gca h THR 214 CO -0.00 0.78 -0.49 0.35 0.37 0.00 0.00 175.52 176.53 2gca n THR 215 N -3.38 0.00 -2.49 3.16 -2.24 -0.65 -4.94 114.28 103.74 2gca n THR 215 Ca -0.21 -0.17 -0.21 0.00 -2.27 0.00 0.00 64.05 61.18 2gca n THR 215 Cb 1.05 0.93 -0.00 0.00 -2.10 0.00 0.00 70.33 70.21 2gca n THR 215 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2gca n GLY 216 N 1.41 -0.50 3.80 3.38 0.00 0.44 -0.86 105.19 112.85 2gca n GLY 216 Ca 0.09 0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2gca n GLY 216 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2gca s SER 217 N -2.14 7.21 0.19 1.61 0.01 -1.07 -4.50 113.70 115.01 2gca s SER 217 Ca 0.04 1.71 -0.30 0.00 1.31 0.00 0.00 55.95 58.72 2gca s SER 217 Cb -0.02 -2.53 -0.08 0.00 0.21 0.00 0.00 66.02 63.60 2gca s SER 217 CO 0.05 -0.09 1.10 -1.58 0.41 0.00 0.00 173.24 173.13 2gca s GLN 218 N -2.23 4.60 -0.18 12.44 0.74 -1.26 -4.85 119.66 128.92 2gca s GLN 218 Ca 0.51 1.73 0.01 0.00 0.05 0.00 0.00 55.36 57.65 2gca s GLN 218 Cb -0.17 -3.27 0.03 0.00 1.10 0.00 0.00 33.01 30.71 2gca s GLN 218 CO 0.21 0.09 -0.11 -0.46 -0.55 0.00 0.00 175.29 174.47 2gca s TRP 219 N -0.35 2.24 -0.32 1.67 -0.00 -1.26 -1.27 118.94 119.65 2gca s TRP 219 Ca 0.49 -1.39 -0.07 0.00 -0.00 0.00 0.00 56.10 55.13 2gca s TRP 219 Cb -0.30 -1.58 0.03 0.00 -0.00 0.00 0.00 33.47 31.61 2gca s TRP 219 CO 0.36 -0.70 0.10 -0.51 -0.00 0.00 0.00 176.95 176.20 2gca s LEU 220 N 1.46 4.17 0.06 5.86 1.43 -0.65 -5.00 118.68 126.01 2gca s LEU 220 Ca 0.01 -0.95 0.02 0.00 -1.03 0.00 0.00 54.13 52.18 2gca s LEU 220 Cb -0.15 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 2gca s LEU 220 CO -0.09 -0.28 0.11 0.00 0.23 0.00 0.00 176.35 176.32 2gca s ARG 221 N 1.46 3.04 0.31 1.70 1.70 -1.26 -1.73 118.95 124.17 2gca s ARG 221 Ca 0.00 -0.60 -0.29 0.00 -0.47 0.00 0.00 55.73 54.38 2gca s ARG 221 Cb -0.19 -2.82 -0.10 0.00 -0.57 0.00 0.00 34.95 31.27 2gca s ARG 221 CO 0.03 0.59 1.37 0.12 -1.08 0.00 0.00 175.30 176.33 2gca s PHE 222 N -1.38 2.98 -0.77 5.89 5.36 -0.19 -1.99 117.98 127.88 2gca s PHE 222 Ca 0.29 1.27 0.00 0.00 -0.96 0.00 0.00 56.93 57.53 2gca s PHE 222 Cb -0.12 -3.77 0.00 0.00 -0.34 0.00 0.00 43.02 38.79 2gca s PHE 222 CO 0.22 -2.25 0.00 -0.25 -1.46 0.00 0.00 175.22 171.48 2gca n ASP 223 N 1.22 -3.63 0.13 6.13 8.00 0.11 -4.23 116.55 124.28 2gca n ASP 223 Ca 0.02 0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.66 2gca n ASP 223 Cb 0.41 -2.10 0.00 0.00 -0.02 0.00 0.00 41.12 39.41 2gca n ASP 223 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2gca n ARG 224 N -2.51 0.00 0.02 -1.24 0.63 -1.03 -4.91 116.66 107.63 2gca n ARG 224 Ca -0.08 0.00 0.11 0.00 -0.92 0.00 0.00 57.85 56.96 2gca n ARG 224 Cb 0.33 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.15 2gca n ARG 224 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2gca n ASP 225 N -3.34 0.38 -3.52 6.15 8.00 -0.84 -4.97 116.55 118.40 2gca n ASP 225 Ca 0.00 -0.05 -0.14 0.00 0.71 0.00 0.00 54.79 55.31 2gca n ASP 225 Cb 0.00 1.37 -0.04 0.00 -0.02 0.00 0.00 41.12 42.43 2gca n ASP 225 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2gca s PHE 226 N -3.39 -0.49 0.29 1.24 -0.12 -1.25 -2.92 117.98 111.34 2gca s PHE 226 Ca -0.03 0.52 -0.19 0.00 -0.05 0.00 0.00 56.93 57.18 2gca s PHE 226 Cb 0.13 0.42 0.07 0.00 -0.63 0.00 0.00 43.02 43.01 2gca s PHE 226 CO 0.86 -0.71 0.91 -1.54 -0.05 0.00 0.00 175.22 174.70 2gca s SER 227 N -2.13 0.02 -0.56 1.98 1.04 0.33 0.09 113.70 114.48 2gca s SER 227 Ca -0.04 -0.94 0.04 0.00 0.48 0.00 0.00 55.95 55.49 2gca s SER 227 Cb -0.00 0.69 0.14 0.00 0.10 0.00 0.00 66.02 66.94 2gca s SER 227 CO -0.04 -1.37 0.32 -0.69 0.98 0.00 0.00 173.24 172.44 2gca s VAL 228 N -2.17 2.56 0.25 5.02 1.01 -1.26 -0.71 120.40 125.10 2gca s VAL 228 Ca 0.19 -3.50 -0.05 0.00 0.00 0.00 0.00 61.98 58.62 2gca s VAL 228 Cb -0.04 -2.75 0.23 0.00 0.00 0.00 0.00 36.38 33.81 2gca s VAL 228 CO 0.09 -0.86 1.86 -0.65 0.00 0.00 0.00 175.10 175.53 2gca h PRO 229 N 6.24 0.99 -5.25 2.72 0.11 -1.93 -3.44 132.00 131.44 2gca h PRO 229 Ca -0.02 -0.06 -0.43 0.00 0.11 0.00 0.00 66.00 65.60 2gca h PRO 229 Cb 0.86 -0.22 -0.25 0.00 0.11 0.00 0.00 31.00 31.50 2gca h PRO 229 CO 0.68 0.65 -0.79 0.15 -0.21 0.00 0.00 178.00 178.48 2gca s LYS 230 N -6.06 0.91 -0.23 1.05 1.02 -1.26 -5.02 119.74 110.15 2gca s LYS 230 Ca -0.13 -0.73 -0.27 0.00 0.02 0.00 0.00 55.97 54.87 2gca s LYS 230 Cb 0.19 -0.90 0.10 0.00 -0.52 0.00 0.00 37.83 36.69 2gca s LYS 230 CO 0.80 0.22 0.88 0.00 -0.92 0.00 0.00 175.35 176.33 2gca s ALA 231 N -0.83 -1.88 0.06 5.17 0.00 -1.26 -1.23 121.76 121.79 2gca s ALA 231 Ca 0.01 1.81 -0.27 0.00 0.00 0.00 0.00 51.96 53.51 2gca s ALA 231 Cb -0.08 -1.07 0.09 0.00 0.00 0.00 0.00 23.12 22.06 2gca s ALA 231 CO 0.01 -0.30 0.97 -1.59 0.00 0.00 0.00 175.76 174.86 2gca s LYS 232 N -0.10 0.93 0.26 0.00 -2.85 -0.56 -4.99 119.74 112.43 2gca s LYS 232 Ca -0.00 -0.45 -0.30 0.00 -1.00 0.00 0.00 55.97 54.22 2gca s LYS 232 Cb -0.04 0.36 -0.09 0.00 -2.06 0.00 0.00 37.83 36.00 2gca s LYS 232 CO -0.01 -0.42 1.26 -0.51 0.10 0.00 0.00 175.35 175.77 2gca s LEU 233 N -2.72 4.45 -0.33 2.77 1.43 -1.26 0.54 118.68 123.55 2gca s LEU 233 Ca 0.09 2.46 -0.01 0.00 -1.03 0.00 0.00 54.13 55.65 2gca s LEU 233 Cb -0.01 -3.63 0.13 0.00 0.03 0.00 0.00 46.19 42.72 2gca s LEU 233 CO -0.03 -0.44 0.22 -2.28 0.23 0.00 0.00 176.35 174.05 2gca s HIS 234 N -0.58 0.31 0.00 0.29 2.46 -0.17 -4.73 115.29 112.87 2gca s HIS 234 Ca 0.51 -1.12 0.00 0.00 0.47 0.00 0.00 55.06 54.92 2gca s HIS 234 Cb -0.36 -0.78 0.00 0.00 -0.13 0.00 0.00 32.58 31.31 2gca s HIS 234 CO 0.44 -0.86 0.00 0.41 -2.47 0.00 0.00 174.74 172.25 2gca n GLY 235 N 4.57 2.19 2.60 1.59 0.00 -1.26 -2.57 105.19 112.31 2gca n GLY 235 Ca 0.05 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.24 2gca n GLY 235 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2gca n TRP 236 N 13.32 2.22 -3.04 1.61 -0.00 -1.26 -4.84 117.44 125.44 2gca n TRP 236 Ca 0.00 -2.25 0.00 0.00 -0.00 0.00 0.00 57.50 55.25 2gca n TRP 236 Cb 0.00 -1.40 0.00 0.00 -0.00 0.00 0.00 31.31 29.91 2gca n TRP 236 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2gca n GLY 237 N 0.62 1.36 3.17 5.87 0.00 -1.06 -4.21 105.19 110.94 2gca n GLY 237 Ca 0.52 -0.76 -0.16 0.00 0.00 0.00 0.00 46.02 45.63 2gca n GLY 237 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2gca s GLN 238 N -0.32 0.83 -0.18 1.61 -0.21 -0.92 -1.00 119.66 119.46 2gca s GLN 238 Ca 0.00 -1.08 0.00 0.00 0.02 0.00 0.00 55.36 54.30 2gca s GLN 238 Cb 0.00 -0.64 0.01 0.00 1.00 0.00 0.00 33.01 33.38 2gca s GLN 238 CO 0.00 0.12 -0.17 0.50 -2.12 0.00 0.00 175.29 173.62 2gca s ARG 239 N -2.38 3.09 0.17 2.91 3.52 0.19 -2.67 118.95 123.78 2gca s ARG 239 Ca 0.02 -0.78 -0.06 0.00 -0.13 0.00 0.00 55.73 54.79 2gca s ARG 239 Cb -0.06 -2.66 -0.02 0.00 -1.56 0.00 0.00 34.95 30.65 2gca s ARG 239 CO 0.01 -0.18 0.21 -0.59 -0.81 0.00 0.00 175.30 173.94 2gca s PHE 240 N 1.27 0.67 -0.12 5.12 -0.12 -0.36 -1.49 117.98 122.94 2gca s PHE 240 Ca 0.04 -1.01 0.00 0.00 -0.05 0.00 0.00 56.93 55.91 2gca s PHE 240 Cb -0.14 -0.25 -0.02 0.00 -0.63 0.00 0.00 43.02 41.99 2gca s PHE 240 CO -0.09 -0.67 -0.13 0.99 -0.05 0.00 0.00 175.22 175.26 2gca s THR 241 N -4.03 3.08 -0.15 -4.49 2.01 -0.36 -0.04 115.64 111.66 2gca s THR 241 Ca 0.24 -0.66 -0.08 0.00 0.31 0.00 0.00 61.69 61.50 2gca s THR 241 Cb 0.05 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 70.23 2gca s THR 241 CO 0.04 0.53 0.13 -0.47 -0.69 0.00 0.00 174.62 174.16 2gca s TYR 242 N 0.21 3.50 -0.02 4.92 5.04 -0.48 -3.25 117.35 127.28 2gca s TYR 242 Ca -0.08 0.43 0.00 0.00 -2.44 0.00 0.00 57.07 54.98 2gca s TYR 242 Cb -0.15 -2.03 0.02 0.00 0.35 0.00 0.00 41.96 40.14 2gca s TYR 242 CO 0.05 0.53 -0.00 -2.00 -1.34 0.00 0.00 175.55 172.79 2gca s GLU 243 N -0.42 0.17 0.00 4.97 2.12 0.12 -0.93 118.70 124.73 2gca s GLU 243 Ca 0.12 0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.48 2gca s GLU 243 Cb -0.12 -0.29 0.00 0.00 0.26 0.00 0.00 34.13 33.98 2gca s GLU 243 CO 0.01 -0.07 0.00 -0.40 -0.54 0.00 0.00 175.26 174.27 2gca n ASP 244 N 3.67 0.00 -0.24 -1.70 5.68 -0.69 0.12 116.55 123.40 2gca n ASP 244 Ca -0.21 -0.92 0.02 0.00 -0.50 0.00 0.00 54.79 53.18 2gca n ASP 244 Cb 0.54 0.00 0.11 0.00 -1.14 0.00 0.00 41.12 40.63 2gca n ASP 244 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 2gca h GLN 245 N 0.00 0.04 0.00 0.11 4.20 -1.93 -0.37 115.11 117.16 2gca h GLN 245 Ca 0.00 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 2gca h GLN 245 Cb 0.00 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.77 2gca h GLN 245 CO 0.00 0.03 -0.04 -0.44 -0.67 0.00 0.00 178.83 177.71 2gca h ASP 246 N 0.04 0.00 0.00 1.46 3.32 -1.96 -3.49 116.42 115.79 2gca h ASP 246 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 2gca h ASP 246 Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 2gca h ASP 246 CO -0.67 0.04 0.00 0.61 -1.72 0.00 0.00 179.24 177.50 2gca n GLY 247 N -0.27 0.65 3.64 2.75 0.00 -0.15 -5.09 105.19 106.72 2gca n GLY 247 Ca -0.00 -1.84 -0.33 0.00 0.00 0.00 0.00 46.02 43.84 2gca n GLY 247 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2gca s ARG 248 N -1.29 2.72 -0.44 1.61 0.52 -1.26 -1.70 118.95 119.12 2gca s ARG 248 Ca 0.00 -0.63 0.02 0.00 -0.52 0.00 0.00 55.73 54.61 2gca s ARG 248 Cb 0.00 -2.62 0.13 0.00 0.52 0.00 0.00 34.95 32.98 2gca s ARG 248 CO 0.00 0.63 0.22 0.42 0.02 0.00 0.00 175.30 176.58 2gca s ILE 249 N -1.02 1.68 0.49 1.52 1.01 -0.11 -5.00 121.20 119.78 2gca s ILE 249 Ca 0.18 -2.60 -0.10 0.00 0.00 0.00 0.00 60.65 58.13 2gca s ILE 249 Cb -0.11 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.12 2gca s ILE 249 CO 0.08 -0.83 0.87 -0.94 0.00 0.00 0.00 174.94 174.12 2gca s SER 250 N 0.37 6.39 -1.33 3.58 1.04 -1.26 -1.38 113.70 121.12 2gca s SER 250 Ca 0.16 1.21 -0.03 0.00 0.48 0.00 0.00 55.95 57.77 2gca s SER 250 Cb -0.24 -2.36 -0.00 0.00 0.10 0.00 0.00 66.02 63.52 2gca s SER 250 CO -0.03 -0.59 0.57 0.47 0.98 0.00 0.00 173.24 174.64 2gca n ASP 251 N -1.96 -1.42 -4.86 7.02 9.92 -1.16 -4.94 116.55 119.15 2gca n ASP 251 Ca 0.03 -0.95 -0.31 0.00 -0.53 0.00 0.00 54.79 53.03 2gca n ASP 251 Cb 0.54 -3.44 -0.05 0.00 -0.64 0.00 0.00 41.12 37.53 2gca n ASP 251 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2gca s LEU 252 N -6.78 3.95 -0.05 0.64 1.43 0.95 -4.83 118.68 113.99 2gca s LEU 252 Ca 0.08 1.23 0.02 0.00 -1.03 0.00 0.00 54.13 54.43 2gca s LEU 252 Cb -0.03 -4.07 0.01 0.00 0.03 0.00 0.00 46.19 42.13 2gca s LEU 252 CO 0.86 -0.30 -0.10 -1.61 0.23 0.00 0.00 176.35 175.42 2gca s GLU 253 N -3.39 1.36 -0.01 1.70 2.02 -1.26 -1.23 118.70 117.89 2gca s GLU 253 Ca 0.53 -0.34 0.05 0.00 0.02 0.00 0.00 54.97 55.24 2gca s GLU 253 Cb -0.10 -1.18 -0.01 0.00 0.10 0.00 0.00 34.13 32.93 2gca s GLU 253 CO 0.24 0.04 -0.17 0.54 0.02 0.00 0.00 175.26 175.93 2gca s VAL 254 N 0.58 1.30 -0.04 2.63 0.11 -1.09 -3.35 120.40 120.55 2gca s VAL 254 Ca -0.11 -0.72 -0.01 0.00 -2.93 0.00 0.00 61.98 58.21 2gca s VAL 254 Cb -0.14 -1.09 -0.01 0.00 -1.53 0.00 0.00 36.38 33.61 2gca s VAL 254 CO 0.02 0.36 2.23 -0.81 -3.33 0.00 0.00 175.10 173.57 2gca n PRO 255 N 2.64 1.23 -5.25 1.54 -0.04 -1.26 -2.17 135.00 131.68 2gca n PRO 255 Ca -0.15 -0.32 -0.31 0.00 -0.04 0.00 0.00 63.50 62.68 2gca n PRO 255 Cb 0.54 -1.21 -0.16 0.00 -0.04 0.00 0.00 33.50 32.63 2gca n PRO 255 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2gca s LEU 256 N -0.21 2.11 0.02 1.53 0.20 -1.26 -4.78 118.68 116.30 2gca s LEU 256 Ca 0.13 -0.48 0.04 0.00 0.69 0.00 0.00 54.13 54.51 2gca s LEU 256 Cb 0.07 -1.38 -0.03 0.00 -0.43 0.00 0.00 46.19 44.42 2gca s LEU 256 CO -0.00 0.27 -0.07 -0.69 -0.29 0.00 0.00 176.35 175.56 2gca s VAL 257 N -0.32 3.57 0.00 1.68 1.01 -1.26 -3.09 120.40 122.00 2gca s VAL 257 Ca 0.01 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.11 2gca s VAL 257 Cb -0.12 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.68 2gca s VAL 257 CO 0.02 0.34 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2gca n GLY 258 N 1.39 2.36 0.34 4.51 0.00 -1.26 -4.83 105.19 107.70 2gca n GLY 258 Ca -0.15 -0.89 0.17 0.00 0.00 0.00 0.00 46.02 45.16 2gca n GLY 258 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2gca h ASP 259 N 0.00 0.00 1.22 1.61 2.03 -1.94 0.23 116.42 119.57 2gca h ASP 259 Ca 0.00 0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 56.23 2gca h ASP 259 Cb 0.00 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.49 2gca h ASP 259 CO 0.00 0.00 -0.32 0.10 -1.03 0.00 0.00 179.24 177.99 2gca h TYR 260 N 0.00 0.00 0.00 4.15 -0.00 -1.99 -2.88 116.97 116.26 2gca h TYR 260 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.77 2gca h TYR 260 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.36 2gca h TYR 260 CO 0.00 0.32 0.00 1.96 -0.00 0.00 0.00 178.16 180.44 2gca h GLN 261 N 0.00 0.00 -0.59 0.10 1.08 -0.85 -2.27 115.11 112.58 2gca h GLN 261 Ca -0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 2gca h GLN 261 Cb 1.02 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.42 2gca h GLN 261 CO 0.04 0.00 0.28 1.96 -0.95 0.00 0.00 178.83 180.17 2gca h GLN 262 N 0.00 0.85 -0.09 1.46 4.20 -1.62 -1.01 115.11 118.90 2gca h GLN 262 Ca 0.00 -0.13 -0.11 0.00 0.06 0.00 0.00 58.65 58.47 2gca h GLN 262 Cb 0.25 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 2gca h GLN 262 CO 0.00 0.69 -0.45 0.07 -0.67 0.00 0.00 178.83 178.46 2gca h ARG 263 N 0.80 0.20 -0.37 1.46 0.11 -1.59 -1.38 114.38 113.62 2gca h ARG 263 Ca 0.20 -0.10 -0.14 0.00 0.10 0.00 0.00 59.98 60.03 2gca h ARG 263 Cb 0.12 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.19 2gca h ARG 263 CO -0.03 0.62 -0.35 -0.91 0.10 0.00 0.00 179.97 179.41 2gca h ASN 264 N 0.17 0.89 -0.24 0.08 -0.26 -1.44 -1.42 115.58 113.35 2gca h ASN 264 Ca 0.01 -0.38 -0.12 0.00 -0.56 0.00 0.00 56.30 55.24 2gca h ASN 264 Cb 0.87 -0.25 -0.00 0.00 -1.06 0.00 0.00 38.32 37.88 2gca h ASN 264 CO 0.07 1.14 -0.34 0.24 -1.06 0.00 0.00 177.43 177.49 2gca h MET 265 N 0.70 0.66 -0.87 0.81 2.86 -1.05 -0.25 114.93 117.80 2gca h MET 265 Ca 0.07 -0.38 0.02 0.00 -2.06 0.00 0.00 59.70 57.34 2gca h MET 265 Cb 0.91 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.55 2gca h MET 265 CO 0.08 1.00 0.57 0.00 1.06 0.00 0.00 176.91 179.62 2gca h ALA 266 N 0.66 1.12 -0.50 6.32 0.00 -1.21 0.19 119.26 125.84 2gca h ALA 266 Ca 0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 2gca h ALA 266 Cb 0.92 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2gca h ALA 266 CO 0.08 0.47 0.17 0.82 0.00 0.00 0.00 179.25 180.79 2gca h ILE 267 N 1.15 1.22 -0.03 0.00 2.04 -1.07 -0.68 117.51 120.14 2gca h ILE 267 Ca 0.33 -0.73 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 2gca h ILE 267 Cb -0.09 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 2gca h ILE 267 CO -0.09 0.27 0.02 0.00 0.00 0.00 0.00 178.15 178.35 2gca h ALA 268 N 1.02 0.04 0.51 1.87 0.00 0.02 0.10 119.26 122.83 2gca h ALA 268 Ca 0.16 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2gca h ALA 268 Cb 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2gca h ALA 268 CO -0.01 -0.43 -0.36 0.82 0.00 0.00 0.00 179.25 179.27 2gca h ILE 269 N -0.01 0.27 -0.43 0.00 2.04 -0.59 0.12 117.51 118.92 2gca h ILE 269 Ca 0.01 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.94 2gca h ILE 269 Cb 0.05 0.27 -0.06 0.00 -0.74 0.00 0.00 36.82 36.35 2gca h ILE 269 CO -0.00 0.00 0.11 -0.61 0.00 0.00 0.00 178.15 177.65 2gca h GLN 270 N -0.84 0.25 -0.60 2.37 5.75 -1.09 -0.37 115.11 120.57 2gca h GLN 270 Ca -0.06 -0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.45 2gca h GLN 270 Cb 0.70 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.16 2gca h GLN 270 CO 0.03 0.16 0.37 1.15 -2.65 0.00 0.00 178.83 177.89 2gca h THR 271 N 0.25 1.07 -0.54 2.39 2.02 -0.58 -1.33 112.91 116.19 2gca h THR 271 Ca 0.21 -0.25 -0.06 0.00 0.77 0.00 0.00 66.41 67.08 2gca h THR 271 Cb 0.24 0.28 -0.02 0.00 -1.74 0.00 0.00 68.15 66.91 2gca h THR 271 CO -0.25 0.13 0.11 0.00 0.37 0.00 0.00 175.52 175.88 2gca h ALA 272 N 1.26 1.18 -0.12 6.16 0.00 -0.10 -1.66 119.26 125.98 2gca h ALA 272 Ca 0.24 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2gca h ALA 272 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2gca h ALA 272 CO -0.10 0.56 -0.31 0.87 0.00 0.00 0.00 179.25 180.27 2gca h LYS 273 N 0.81 0.23 -0.19 0.00 1.57 -0.42 -1.65 116.57 116.91 2gca h LYS 273 Ca 0.17 -0.09 -0.17 0.00 -1.87 0.00 0.00 60.65 58.70 2gca h LYS 273 Cb 0.32 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 2gca h LYS 273 CO 0.00 0.52 -0.57 0.28 -0.57 0.00 0.00 179.45 179.11 2gca h VAL 274 N 0.20 1.32 -0.20 0.50 2.07 -0.64 -2.66 116.25 116.84 2gca h VAL 274 Ca 0.03 -1.82 -0.03 0.00 0.82 0.00 0.00 66.70 65.69 2gca h VAL 274 Cb 0.65 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 2gca h VAL 274 CO 0.05 0.57 -0.01 0.22 0.02 0.00 0.00 177.57 178.42 2gca h TYR 275 N 0.45 0.40 -0.18 1.57 3.20 -1.01 -1.35 116.97 120.06 2gca h TYR 275 Ca 0.00 -0.07 0.04 0.00 3.14 0.00 0.00 58.73 61.84 2gca h TYR 275 Cb 1.12 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.26 2gca h TYR 275 CO 0.05 0.57 -0.06 0.00 -1.64 0.00 0.00 178.16 177.07 2gca h ALA 276 N 0.78 0.09 0.04 1.82 0.00 -1.30 -1.45 119.26 119.24 2gca h ALA 276 Ca 0.06 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2gca h ALA 276 Cb 0.42 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2gca h ALA 276 CO 0.01 -0.50 -0.02 -0.22 0.00 0.00 0.00 179.25 178.52 2gca h LYS 277 N -0.03 -0.06 -0.13 0.00 3.64 -1.48 0.78 116.57 119.28 2gca h LYS 277 Ca 0.09 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2gca h LYS 277 Cb 0.17 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 2gca h LYS 277 CO -0.20 0.14 0.14 1.96 -2.27 0.00 0.00 179.45 179.21 2gca h GLN 278 N -0.24 0.00 -0.17 1.90 1.08 -1.09 -0.73 115.11 115.85 2gca h GLN 278 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2gca h GLN 278 Cb 0.22 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.65 2gca h GLN 278 CO 0.01 0.00 0.00 0.25 -0.95 0.00 0.00 178.83 178.14 2gca n THR 279 N -3.93 2.13 -4.21 -0.54 -2.24 -0.56 -4.97 114.28 99.96 2gca n THR 279 Ca 0.00 -2.01 -0.32 0.00 -2.27 0.00 0.00 64.05 59.46 2gca n THR 279 Cb 0.25 -0.24 -0.08 0.00 -2.10 0.00 0.00 70.33 68.16 2gca n THR 279 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2gca n GLU 280 N -0.84 -0.84 -4.75 -0.78 -0.58 -0.14 -4.93 120.64 107.79 2gca n GLU 280 Ca 0.19 0.08 -0.33 0.00 -0.42 0.00 0.00 57.16 56.68 2gca n GLU 280 Cb 0.79 -3.23 -0.13 0.00 -0.57 0.00 0.00 31.44 28.30 2gca n GLU 280 CO 0.00 0.00 0.00 -0.46 -0.48 0.00 0.00 177.13 176.19 2gca s TRP 281 N -4.22 2.82 -0.03 -0.32 -0.11 0.25 -5.00 118.94 112.34 2gca s TRP 281 Ca 0.07 -0.21 -0.28 0.00 1.22 0.00 0.00 56.10 56.90 2gca s TRP 281 Cb -0.04 -1.72 -0.03 0.00 -1.50 0.00 0.00 33.47 30.18 2gca s TRP 281 CO 0.95 0.14 0.92 -1.25 -4.62 0.00 0.00 176.95 173.09 2gca s PRO 282 N -0.46 4.52 -0.10 5.86 0.04 -1.26 -4.30 135.00 139.30 2gca s PRO 282 Ca 0.06 1.30 -0.01 0.00 0.04 0.00 0.00 61.00 62.38 2gca s PRO 282 Cb -0.12 -3.47 0.03 0.00 0.04 0.00 0.00 34.50 30.99 2gca s PRO 282 CO 0.02 -0.05 -0.01 -1.17 0.04 0.00 0.00 177.00 175.83 2gca s LEU 283 N 1.07 0.83 0.38 -3.56 2.96 -1.26 -5.00 118.68 114.10 2gca s LEU 283 Ca 0.48 -0.26 0.07 0.00 -0.22 0.00 0.00 54.13 54.21 2gca s LEU 283 Cb -0.20 -0.56 -0.00 0.00 0.50 0.00 0.00 46.19 45.92 2gca s LEU 283 CO 0.25 -0.20 0.49 0.42 -1.32 0.00 0.00 176.35 175.99 2gca s THR 284 N 1.89 3.42 0.37 3.68 -4.23 -1.26 -4.99 115.64 114.52 2gca s THR 284 Ca 0.04 -1.07 0.29 0.00 -1.18 0.00 0.00 61.69 59.77 2gca s THR 284 Cb -0.13 -3.17 0.31 0.00 1.34 0.00 0.00 72.50 70.84 2gca s THR 284 CO -0.06 -0.08 2.06 -0.65 -0.54 0.00 0.00 174.62 175.35 2gca h PRO 285 N 0.83 0.00 -0.25 3.99 0.11 -2.01 -1.80 132.00 132.87 2gca h PRO 285 Ca -0.43 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.48 2gca h PRO 285 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2gca h PRO 285 CO 0.50 0.11 -0.63 1.96 -0.21 0.00 0.00 178.00 179.74 2gca h GLN 286 N 0.00 0.86 0.05 1.05 1.08 -1.98 0.34 115.11 116.51 2gca h GLN 286 Ca -0.00 -0.60 -0.00 0.00 -1.45 0.00 0.00 58.65 56.60 2gca h GLN 286 Cb 0.37 0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.90 2gca h GLN 286 CO 0.01 1.22 -0.02 -0.91 -0.95 0.00 0.00 178.83 178.18 2gca h ASN 287 N 0.63 -0.06 -0.27 1.46 -0.26 -1.68 -0.46 115.58 114.95 2gca h ASN 287 Ca -0.01 -0.03 0.02 0.00 -0.56 0.00 0.00 56.30 55.72 2gca h ASN 287 Cb 1.25 0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 38.50 2gca h ASN 287 CO 0.14 -0.01 0.14 0.40 -1.06 0.00 0.00 177.43 177.04 2gca h ILE 288 N -0.10 1.00 -0.31 2.81 2.04 -1.35 0.91 117.51 122.51 2gca h ILE 288 Ca -0.01 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.77 2gca h ILE 288 Cb 0.08 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 2gca h ILE 288 CO 0.01 0.05 0.17 -0.09 0.00 0.00 0.00 178.15 178.30 2gca h ARG 289 N 0.29 0.35 -0.02 2.37 2.43 -0.75 -1.31 114.38 117.74 2gca h ARG 289 Ca 0.11 -0.02 -0.17 0.00 -0.81 0.00 0.00 59.98 59.09 2gca h ARG 289 Cb 0.02 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.48 2gca h ARG 289 CO -0.07 0.23 -0.76 0.37 -1.51 0.00 0.00 179.97 178.24 2gca h GLN 290 N 0.36 0.14 -0.33 0.20 4.15 -0.92 -2.63 115.11 116.08 2gca h GLN 290 Ca 0.12 -0.13 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 2gca h GLN 290 Cb 0.01 0.03 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 2gca h GLN 290 CO -0.07 0.83 -0.09 0.78 -1.93 0.00 0.00 178.83 178.35 2gca h GLY 291 N 1.87 0.59 1.67 2.39 0.00 -0.47 -3.01 103.07 106.11 2gca h GLY 291 Ca -0.02 -0.40 -0.26 0.00 0.00 0.00 0.00 47.33 46.65 2gca h GLY 291 CO 0.11 0.37 -1.16 1.41 0.00 0.00 0.00 176.54 177.27 2gca h LEU 292 N 0.51 0.38 0.00 3.11 3.38 -1.21 -3.14 115.31 118.33 2gca h LEU 292 Ca 0.10 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2gca h LEU 292 Cb 0.47 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2gca h LEU 292 CO 0.03 1.28 0.00 0.00 0.09 0.00 0.00 178.44 179.84 2gca n ALA 293 N -2.51 1.33 -0.08 1.53 0.00 -1.00 -1.24 120.51 118.55 2gca n ALA 293 Ca -0.07 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2gca n ALA 293 Cb 0.98 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 19.38 2gca n ALA 293 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gca n ALA 294 N -1.29 2.24 -0.62 0.00 0.00 -1.19 -4.73 120.51 114.92 2gca n ALA 294 Ca 0.01 -0.55 -0.11 0.00 0.00 0.00 0.00 53.44 52.79 2gca n ALA 294 Cb 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.40 2gca n ALA 294 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2gca n SER 295 N -0.08 3.55 -4.68 0.00 7.64 -0.37 -4.90 113.62 114.77 2gca n SER 295 Ca 0.00 -2.13 -0.42 0.00 1.01 0.00 0.00 58.87 57.33 2gca n SER 295 Cb 0.06 -0.89 -0.03 0.00 -1.01 0.00 0.00 64.21 62.35 2gca n SER 295 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 2gca s HIS 296 N 2.33 2.21 -0.84 1.43 3.76 -1.26 -4.81 115.29 118.10 2gca s HIS 296 Ca 0.38 0.21 -0.07 0.00 -0.15 0.00 0.00 55.06 55.43 2gca s HIS 296 Cb 0.16 -3.98 0.21 0.00 1.11 0.00 0.00 32.58 30.08 2gca s HIS 296 CO -0.01 -4.05 0.75 -0.46 -0.85 0.00 0.00 174.74 170.12 2gca s TRP 297 N 3.12 3.79 0.44 1.40 -0.00 -1.26 -5.07 118.94 121.37 2gca s TRP 297 Ca 0.75 -2.57 -0.23 0.00 -0.00 0.00 0.00 56.10 54.05 2gca s TRP 297 Cb -0.39 -3.52 -0.10 0.00 -0.00 0.00 0.00 33.47 29.46 2gca s TRP 297 CO 0.33 -0.88 0.97 -0.35 -0.00 0.00 0.00 176.95 177.02 2gca n PRO 298 N 3.21 1.25 -0.86 5.86 -0.04 -1.26 -2.27 135.00 140.89 2gca n PRO 298 Ca 0.16 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 64.07 2gca n PRO 298 Cb 0.41 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 31.84 2gca n PRO 298 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2gca n ALA 299 N -0.66 0.00 -3.83 0.55 0.00 -1.26 -4.95 120.51 110.37 2gca n ALA 299 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.20 2gca n ALA 299 Cb 0.40 -0.63 -0.12 0.00 0.00 0.00 0.00 19.45 19.10 2gca n ALA 299 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2gca s ARG 300 N -0.75 2.11 -1.38 0.00 3.00 -0.96 -1.36 118.95 119.60 2gca s ARG 300 Ca 0.00 -2.23 -0.00 0.00 0.00 0.00 0.00 55.73 53.49 2gca s ARG 300 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 34.95 31.42 2gca s ARG 300 CO 0.00 -1.10 0.49 -0.11 0.00 0.00 0.00 175.30 174.59 2gca n LEU 301 N 3.87 -2.45 -4.60 2.53 0.00 -0.91 -4.86 117.00 110.58 2gca n LEU 301 Ca 0.04 -0.96 -0.37 0.00 0.00 0.00 0.00 56.01 54.72 2gca n LEU 301 Cb 0.38 -2.34 -0.11 0.00 0.00 0.00 0.00 43.42 41.36 2gca n LEU 301 CO 0.32 0.43 -0.18 -0.70 0.00 0.00 0.00 177.39 177.25 2gca s GLU 302 N -6.41 3.96 -0.79 1.96 2.12 -0.17 -4.84 118.70 114.53 2gca s GLU 302 Ca 0.01 -0.32 -0.26 0.00 0.36 0.00 0.00 54.97 54.76 2gca s GLU 302 Cb -0.01 -3.58 0.02 0.00 0.26 0.00 0.00 34.13 30.82 2gca s GLU 302 CO 0.87 -0.10 1.50 0.21 -0.54 0.00 0.00 175.26 177.20 2gca s LYS 303 N 1.50 3.09 0.00 4.30 2.20 -1.26 -1.50 119.74 128.07 2gca s LYS 303 Ca 0.07 -0.25 0.24 0.00 -0.36 0.00 0.00 55.97 55.67 2gca s LYS 303 Cb -0.15 -4.56 0.95 0.00 -1.51 0.00 0.00 37.83 32.56 2gca s LYS 303 CO 0.08 -2.40 1.67 0.44 -0.36 0.00 0.00 175.35 174.78 2gca n ILE 304 N 6.80 0.10 -3.56 5.43 -6.64 -0.87 -4.89 119.36 115.74 2gca n ILE 304 Ca 0.16 -0.27 -0.17 0.00 -1.77 0.00 0.00 62.75 60.70 2gca n ILE 304 Cb 0.50 0.35 -0.06 0.00 -1.44 0.00 0.00 39.64 38.99 2gca n ILE 304 CO 0.00 0.00 0.00 -0.55 -1.77 0.00 0.00 176.55 174.23 2gca s SER 305 N -1.77 -0.62 -0.21 7.28 0.15 -1.18 -4.95 113.70 112.40 2gca s SER 305 Ca 0.35 0.73 -0.04 0.00 0.70 0.00 0.00 55.95 57.69 2gca s SER 305 Cb 0.19 0.61 -0.12 0.00 -1.71 0.00 0.00 66.02 64.99 2gca s SER 305 CO 0.30 -0.55 -0.23 -0.67 1.20 0.00 0.00 173.24 173.28 2gca n ASP 306 N 1.14 2.03 -3.52 5.45 2.03 -1.26 -2.77 116.55 119.64 2gca n ASP 306 Ca -0.19 0.06 -0.23 0.00 0.52 0.00 0.00 54.79 54.95 2gca n ASP 306 Cb 0.57 -0.47 -0.14 0.00 -0.72 0.00 0.00 41.12 40.36 2gca n ASP 306 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2gca s THR 307 N -2.41 -0.22 0.71 5.18 2.01 -1.26 -2.29 115.64 117.36 2gca s THR 307 Ca -0.29 -0.35 -0.12 0.00 0.31 0.00 0.00 61.69 61.24 2gca s THR 307 Cb 0.09 -0.78 0.02 0.00 0.01 0.00 0.00 72.50 71.84 2gca s THR 307 CO 0.44 -0.40 1.08 -2.16 -0.69 0.00 0.00 174.62 172.89 2gca s PRO 308 N 2.23 2.68 -0.46 4.92 0.04 -1.26 -5.08 135.00 138.07 2gca s PRO 308 Ca 0.07 1.14 -0.28 0.00 0.04 0.00 0.00 61.00 61.96 2gca s PRO 308 Cb -0.16 -1.95 0.03 0.00 0.04 0.00 0.00 34.50 32.46 2gca s PRO 308 CO -0.21 -1.31 1.08 -1.17 0.04 0.00 0.00 177.00 175.42 2gca s LEU 309 N -5.47 3.75 0.01 -3.56 0.20 -0.97 -4.65 118.68 107.98 2gca s LEU 309 Ca 0.61 0.41 0.07 0.00 0.69 0.00 0.00 54.13 55.91 2gca s LEU 309 Cb -0.16 -3.46 -0.02 0.00 -0.43 0.00 0.00 46.19 42.12 2gca s LEU 309 CO 0.51 -1.18 -0.22 -0.63 -0.29 0.00 0.00 176.35 174.54 2gca s ILE 310 N 4.23 1.76 -0.02 6.68 1.01 -1.12 -1.28 121.20 132.46 2gca s ILE 310 Ca 0.45 -1.07 0.03 0.00 0.00 0.00 0.00 60.65 60.06 2gca s ILE 310 Cb -0.08 -1.48 0.00 0.00 0.01 0.00 0.00 42.46 40.90 2gca s ILE 310 CO 0.29 0.39 -0.10 -0.69 0.00 0.00 0.00 174.94 174.84 2gca s VAL 311 N -0.63 0.83 -0.05 2.92 1.01 0.23 -2.04 120.40 122.67 2gca s VAL 311 Ca 0.09 -0.40 0.05 0.00 0.00 0.00 0.00 61.98 61.71 2gca s VAL 311 Cb -0.09 -0.73 -0.02 0.00 0.00 0.00 0.00 36.38 35.54 2gca s VAL 311 CO 0.00 0.25 -0.20 0.27 0.00 0.00 0.00 175.10 175.42 2gca s ILE 312 N 0.08 2.51 0.02 2.22 -4.36 -0.56 0.56 121.20 121.67 2gca s ILE 312 Ca -0.01 -0.92 -0.01 0.00 -0.26 0.00 0.00 60.65 59.45 2gca s ILE 312 Cb -0.08 -1.94 -0.02 0.00 1.25 0.00 0.00 42.46 41.67 2gca s ILE 312 CO 0.00 0.58 -0.02 -0.62 0.24 0.00 0.00 174.94 175.12 2gca s ASP 313 N -0.43 0.27 0.00 4.36 2.15 0.54 -1.00 116.67 122.56 2gca s ASP 313 Ca 0.05 -0.56 0.23 0.00 0.43 0.00 0.00 52.55 52.70 2gca s ASP 313 Cb -0.12 0.12 0.45 0.00 -0.30 0.00 0.00 42.92 43.08 2gca s ASP 313 CO 0.02 -0.35 1.42 0.61 -0.17 0.00 0.00 175.17 176.70 2gca n GLY 314 N 1.37 1.82 3.38 2.66 0.00 -0.46 -4.14 105.19 109.81 2gca n GLY 314 Ca -0.22 -0.75 -0.44 0.00 0.00 0.00 0.00 46.02 44.60 2gca n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gca n ALA 315 N 1.53 -2.60 -0.45 4.61 0.00 -1.26 -3.85 120.51 118.50 2gca n ALA 315 Ca 0.20 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2gca n ALA 315 Cb 0.61 -1.60 0.00 0.00 0.00 0.00 0.00 19.45 18.46 2gca n ALA 315 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2gca n HIS 316 N -0.52 0.00 -1.12 0.00 1.44 -1.26 -2.85 115.22 110.91 2gca n HIS 316 Ca 0.14 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.55 2gca n HIS 316 Cb 0.33 0.09 0.25 0.00 0.12 0.00 0.00 29.99 30.78 2gca n HIS 316 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 2gca n ASN 317 N -1.83 -1.94 0.15 4.39 5.03 -1.26 -4.70 115.26 115.11 2gca n ASN 317 Ca 0.00 -1.19 -0.14 0.00 0.87 0.00 0.00 54.58 54.12 2gca n ASN 317 Cb 0.00 -1.01 -0.08 0.00 -1.02 0.00 0.00 39.78 37.67 2gca n ASN 317 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 2gca h PRO 318 N 0.00 -0.33 -0.52 3.52 0.13 -2.00 0.95 132.00 133.74 2gca h PRO 318 Ca -0.41 0.02 -0.06 0.00 -0.87 0.00 0.00 66.00 64.68 2gca h PRO 318 Cb 1.25 0.08 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2gca h PRO 318 CO 0.27 -0.12 0.09 0.22 -0.23 0.00 0.00 178.00 178.23 2gca h ASP 319 N -0.48 0.77 -0.30 1.44 1.82 -1.97 0.23 116.42 117.93 2gca h ASP 319 Ca -0.04 -0.15 0.05 0.00 -0.39 0.00 0.00 57.03 56.50 2gca h ASP 319 Cb 0.36 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 2gca h ASP 319 CO 0.06 0.78 0.20 1.23 -1.61 0.00 0.00 179.24 179.90 2gca h GLY 320 N 0.97 0.23 0.20 -0.78 0.00 -1.78 -1.52 103.07 100.40 2gca h GLY 320 Ca 0.17 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.42 2gca h GLY 320 CO 0.00 0.06 -1.38 4.51 0.00 0.00 0.00 176.54 179.74 2gca n ILE 321 N -4.48 0.07 0.27 2.60 3.06 0.29 -4.16 119.36 117.01 2gca n ILE 321 Ca 0.03 -0.27 0.16 0.00 -2.50 0.00 0.00 62.75 60.17 2gca n ILE 321 Cb 0.23 0.35 0.66 0.00 0.54 0.00 0.00 39.64 41.42 2gca n ILE 321 CO 0.00 0.00 0.00 0.78 -2.50 0.00 0.00 176.55 174.83 2gca h ASN 322 N 0.00 0.00 0.30 9.51 2.35 0.49 -0.13 115.58 128.10 2gca h ASN 322 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2gca h ASN 322 Cb 0.77 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.14 2gca h ASN 322 CO 0.00 0.03 -0.19 0.61 -1.65 0.00 0.00 177.43 176.23 2gca n GLY 323 N 0.04 -0.77 0.10 2.83 0.00 -1.10 -3.87 105.19 102.42 2gca n GLY 323 Ca 0.01 -0.34 -0.18 0.00 0.00 0.00 0.00 46.02 45.50 2gca n GLY 323 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2gca n LEU 324 N -0.79 1.86 -0.16 0.99 7.94 -0.10 -2.48 117.00 124.25 2gca n LEU 324 Ca 0.13 0.46 0.22 0.00 -1.11 0.00 0.00 56.01 55.72 2gca n LEU 324 Cb 0.32 -0.93 0.62 0.00 0.53 0.00 0.00 43.42 43.96 2gca n LEU 324 CO 0.25 0.12 1.23 0.40 -1.11 0.00 0.00 177.39 178.27 2gca h ILE 325 N -1.00 0.66 0.00 1.96 5.03 -1.58 1.13 117.51 123.71 2gca h ILE 325 Ca -0.29 -0.06 -0.12 0.00 -0.12 0.00 0.00 64.86 64.27 2gca h ILE 325 Cb 1.14 0.47 -0.02 0.00 -3.03 0.00 0.00 36.82 35.38 2gca h ILE 325 CO -0.18 0.03 -0.92 0.71 -0.68 0.00 0.00 178.15 177.12 2gca h THR 326 N 0.18 0.60 0.16 -0.27 1.35 -1.72 -2.51 112.91 110.69 2gca h THR 326 Ca 0.39 -1.97 -0.31 0.00 -0.55 0.00 0.00 66.41 63.97 2gca h THR 326 Cb 1.27 2.16 0.03 0.00 -1.73 0.00 0.00 68.15 69.89 2gca h THR 326 CO -0.07 0.34 -1.32 0.00 -0.25 0.00 0.00 175.52 174.22 2gca h ALA 327 N 1.53 -0.05 0.00 6.62 0.00 0.74 -2.97 119.26 125.13 2gca h ALA 327 Ca -0.07 -0.80 -0.13 0.00 0.00 0.00 0.00 54.91 53.91 2gca h ALA 327 Cb 1.42 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.33 2gca h ALA 327 CO 0.05 0.70 -0.60 -0.07 0.00 0.00 0.00 179.25 179.33 2gca h LEU 328 N 0.24 0.00 -0.52 0.00 3.38 0.80 -2.91 115.31 116.30 2gca h LEU 328 Ca -0.21 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 2gca h LEU 328 Cb 2.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.72 2gca h LEU 328 CO 0.25 0.60 0.21 0.50 0.09 0.00 0.00 178.44 180.08 2gca h LYS 329 N 0.00 0.78 -0.32 1.13 3.64 -1.47 -1.01 116.57 119.33 2gca h LYS 329 Ca -0.01 -0.14 -0.17 0.00 -1.27 0.00 0.00 60.65 59.06 2gca h LYS 329 Cb 1.19 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 2gca h LYS 329 CO 0.08 0.69 -0.47 1.96 -2.27 0.00 0.00 179.45 179.44 2gca h GLN 330 N 0.71 0.88 0.00 1.90 4.20 -1.46 -3.28 115.11 118.05 2gca h GLN 330 Ca 0.17 -0.52 0.00 0.00 0.06 0.00 0.00 58.65 58.36 2gca h GLN 330 Cb 0.20 0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2gca h GLN 330 CO -0.01 1.16 -0.07 -0.07 -0.67 0.00 0.00 178.83 179.17 2gca h LEU 331 N 0.67 0.00 -7.94 1.46 3.38 -1.45 -3.45 115.31 107.97 2gca h LEU 331 Ca 0.03 -0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.59 2gca h LEU 331 Cb 1.07 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.52 2gca h LEU 331 CO 0.11 0.00 -0.78 -0.36 0.09 0.00 0.00 178.44 177.50 2gca s PHE 332 N -3.21 0.84 -0.08 1.13 2.99 -0.39 -4.99 117.98 114.27 2gca s PHE 332 Ca 0.07 -0.20 0.09 0.00 0.00 0.00 0.00 56.93 56.90 2gca s PHE 332 Cb 0.06 -0.60 -0.13 0.00 0.00 0.00 0.00 43.02 42.35 2gca s PHE 332 CO 0.67 -0.09 0.09 -1.13 -0.00 0.00 0.00 175.22 174.76 2gca n SER 333 N 3.28 2.55 -4.90 1.36 3.41 -1.26 -4.59 113.62 113.47 2gca n SER 333 Ca -0.18 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.15 2gca n SER 333 Cb 0.55 0.93 0.08 0.00 -0.26 0.00 0.00 64.21 65.51 2gca n SER 333 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2gca s GLN 334 N -2.37 2.20 0.18 4.33 -2.07 -1.26 -5.03 119.66 115.64 2gca s GLN 334 Ca -0.05 0.11 -0.30 0.00 -1.82 0.00 0.00 55.36 53.30 2gca s GLN 334 Cb 0.04 -2.01 -0.08 0.00 -1.09 0.00 0.00 33.01 29.86 2gca s GLN 334 CO 0.42 -1.40 1.32 -2.14 -1.32 0.00 0.00 175.29 172.16 2gca s PRO 335 N -5.46 4.38 0.27 9.60 0.02 -1.26 -5.04 135.00 137.51 2gca s PRO 335 Ca 0.61 2.04 0.07 0.00 0.02 0.00 0.00 61.00 63.74 2gca s PRO 335 Cb -0.11 -3.21 -0.06 0.00 0.02 0.00 0.00 34.50 31.14 2gca s PRO 335 CO 0.49 -0.29 -0.07 0.96 -0.33 0.00 0.00 177.00 177.76 2gca s ILE 336 N 0.34 1.67 -0.22 2.83 -4.36 -1.26 -4.40 121.20 115.80 2gca s ILE 336 Ca 0.58 -2.14 -0.04 0.00 -0.26 0.00 0.00 60.65 58.80 2gca s ILE 336 Cb -0.36 -2.41 -0.01 0.00 1.25 0.00 0.00 42.46 40.93 2gca s ILE 336 CO 0.36 -0.33 -0.05 -0.89 0.24 0.00 0.00 174.94 174.28 2gca s THR 337 N -3.00 3.32 -0.19 8.37 2.01 -0.15 -3.96 115.64 122.04 2gca s THR 337 Ca 0.29 -0.52 -0.06 0.00 0.31 0.00 0.00 61.69 61.71 2gca s THR 337 Cb 0.03 -2.52 -0.03 0.00 0.01 0.00 0.00 72.50 69.99 2gca s THR 337 CO 0.12 0.42 0.03 -0.69 -0.69 0.00 0.00 174.62 173.80 2gca s VAL 338 N 1.47 4.33 -0.34 3.82 1.01 -1.03 -0.22 120.40 129.44 2gca s VAL 338 Ca 0.06 -0.19 -0.04 0.00 0.00 0.00 0.00 61.98 61.80 2gca s VAL 338 Cb -0.14 -2.95 0.06 0.00 0.00 0.00 0.00 36.38 33.34 2gca s VAL 338 CO -0.04 0.44 0.09 -0.63 0.00 0.00 0.00 175.10 174.96 2gca s ILE 339 N 0.67 3.43 -0.03 2.22 1.01 0.21 -0.03 121.20 128.67 2gca s ILE 339 Ca 0.01 -1.37 0.03 0.00 0.00 0.00 0.00 60.65 59.32 2gca s ILE 339 Cb -0.14 -3.02 -0.03 0.00 0.01 0.00 0.00 42.46 39.29 2gca s ILE 339 CO 0.02 -0.24 -0.09 0.00 0.00 0.00 0.00 174.94 174.63 2gca s ALA 340 N 1.31 2.91 -0.56 9.38 0.00 0.42 -1.38 121.76 133.84 2gca s ALA 340 Ca -0.01 -0.98 0.06 0.00 0.00 0.00 0.00 51.96 51.02 2gca s ALA 340 Cb -0.20 -1.10 0.34 0.00 0.00 0.00 0.00 23.12 22.15 2gca s ALA 340 CO 0.00 0.59 0.92 0.41 0.00 0.00 0.00 175.76 177.68 2gca n GLY 341 N 1.91 5.36 3.88 0.00 0.00 -0.79 -1.32 105.19 114.22 2gca n GLY 341 Ca -0.17 -2.67 -0.30 0.00 0.00 0.00 0.00 46.02 42.89 2gca n GLY 341 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2gca s ILE 342 N -4.16 4.75 -0.21 -0.61 -1.09 -1.26 -4.36 121.20 114.26 2gca s ILE 342 Ca 0.48 0.73 0.17 0.00 -2.23 0.00 0.00 60.65 59.80 2gca s ILE 342 Cb 0.28 -3.86 0.47 0.00 -1.58 0.00 0.00 42.46 37.77 2gca s ILE 342 CO -0.13 -1.06 1.16 0.00 -1.23 0.00 0.00 174.94 173.69 2gca n LEU 343 N -2.57 2.63 0.00 2.97 -0.00 -1.26 -4.93 117.00 113.83 2gca n LEU 343 Ca 0.05 -3.48 0.00 0.00 -0.00 0.00 0.00 56.01 52.58 2gca n LEU 343 Cb 0.54 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.96 2gca n LEU 343 CO 0.56 1.31 0.00 -1.22 -0.00 0.00 0.00 177.39 178.04 2gca n TYR 348 N -0.51 0.00 0.04 1.47 0.53 -1.26 -5.11 117.16 112.32 2gca n TYR 348 Ca 0.20 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.08 2gca n TYR 348 Cb 0.90 0.00 0.02 0.00 -1.03 0.00 0.00 39.34 39.23 2gca n TYR 348 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2gca n ALA 349 N -3.00 1.27 -0.08 -0.72 0.00 -1.26 -1.05 120.51 115.67 2gca n ALA 349 Ca 0.00 -0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.30 2gca n ALA 349 Cb 0.00 -1.01 -0.05 0.00 0.00 0.00 0.00 19.45 18.39 2gca n ALA 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gca h ALA 350 N 2.04 0.38 -0.06 0.00 0.00 -2.02 -3.19 119.26 116.41 2gca h ALA 350 Ca 0.00 -0.39 -0.23 0.00 0.00 0.00 0.00 54.91 54.29 2gca h ALA 350 Cb 0.01 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.73 2gca h ALA 350 CO 0.00 0.38 -0.89 0.52 0.00 0.00 0.00 179.25 179.26 2gca h MET 351 N 0.36 0.63 -1.36 0.00 2.07 -1.52 -3.26 114.93 111.84 2gca h MET 351 Ca 0.04 -0.60 0.40 0.00 -2.07 0.00 0.00 59.70 57.47 2gca h MET 351 Cb 0.84 0.15 -0.07 0.00 -1.87 0.00 0.00 31.60 30.65 2gca h MET 351 CO 0.07 1.21 0.96 0.00 1.07 0.00 0.00 176.91 180.22 2gca h ALA 352 N 0.60 3.16 -0.01 6.32 0.00 -1.53 0.46 119.26 128.25 2gca h ALA 352 Ca -0.08 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 2gca h ALA 352 Cb 1.52 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 2gca h ALA 352 CO 0.17 -1.58 -0.69 0.22 0.00 0.00 0.00 179.25 177.37 2gca h ASP 353 N 0.05 0.08 0.42 0.00 3.58 -1.60 -1.43 116.42 117.52 2gca h ASP 353 Ca 0.68 -0.05 -0.18 0.00 0.42 0.00 0.00 57.03 57.90 2gca h ASP 353 Cb 2.56 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 43.57 2gca h ASP 353 CO -0.08 0.74 -0.75 0.03 -2.88 0.00 0.00 179.24 176.30 2gca h ARG 354 N 0.04 0.26 0.20 0.28 -0.00 -0.25 -1.45 114.38 113.47 2gca h ARG 354 Ca -0.01 -0.23 -0.29 0.00 -0.50 0.00 0.00 59.98 58.94 2gca h ARG 354 Cb 1.22 0.05 0.03 0.00 0.00 0.00 0.00 29.97 31.26 2gca h ARG 354 CO 0.09 0.90 -1.34 -0.07 0.00 0.00 0.00 179.97 179.55 2gca h LEU 355 N 0.17 0.67 -0.89 3.04 3.38 -1.46 -3.29 115.31 116.93 2gca h LEU 355 Ca -0.03 -0.93 -0.11 0.00 0.09 0.00 0.00 57.88 56.91 2gca h LEU 355 Cb 1.32 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 2gca h LEU 355 CO 0.12 1.63 -0.38 0.71 0.09 0.00 0.00 178.44 180.61 2gca h THR 356 N -0.04 1.30 -1.03 0.22 1.35 -1.33 -2.35 112.91 111.03 2gca h THR 356 Ca -0.25 -1.48 -0.57 0.00 -0.55 0.00 0.00 66.41 63.56 2gca h THR 356 Cb 1.98 1.60 -0.23 0.00 -1.73 0.00 0.00 68.15 69.78 2gca h THR 356 CO 0.21 0.45 0.71 0.00 -0.25 0.00 0.00 175.52 176.64 2gca n ALA 357 N -2.48 6.04 0.00 6.62 0.00 -0.55 -4.06 120.51 126.08 2gca n ALA 357 Ca -0.01 -3.00 0.00 0.00 0.00 0.00 0.00 53.44 50.42 2gca n ALA 357 Cb 0.47 -1.75 0.00 0.00 0.00 0.00 0.00 19.45 18.17 2gca n ALA 357 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2gca n ALA 358 N -0.23 0.64 -2.42 0.00 0.00 -1.04 -4.91 120.51 112.54 2gca n ALA 358 Ca 0.50 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.78 2gca n ALA 358 Cb 0.55 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.89 2gca n ALA 358 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2gca s PHE 359 N -1.00 1.33 0.00 0.00 0.40 -0.91 -5.10 117.98 112.70 2gca s PHE 359 Ca 0.00 -0.62 0.00 0.00 -0.60 0.00 0.00 56.93 55.71 2gca s PHE 359 Cb 0.00 -0.69 0.00 0.00 0.51 0.00 0.00 43.02 42.84 2gca s PHE 359 CO 0.00 0.12 0.56 0.43 0.70 0.00 0.00 175.22 177.03 2gca n SER 360 N 0.30 0.00 -4.76 1.36 7.64 -1.26 -4.70 113.62 112.20 2gca n SER 360 Ca -0.14 0.56 -0.38 0.00 1.01 0.00 0.00 58.87 59.92 2gca n SER 360 Cb 0.58 -0.06 -0.06 0.00 -1.01 0.00 0.00 64.21 63.66 2gca n SER 360 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2gca s THR 361 N -1.23 5.12 -0.14 0.44 -4.23 -1.25 -5.05 115.64 109.29 2gca s THR 361 Ca 0.00 0.90 -0.05 0.00 -1.18 0.00 0.00 61.69 61.36 2gca s THR 361 Cb 0.00 -3.78 0.07 0.00 1.34 0.00 0.00 72.50 70.13 2gca s THR 361 CO 0.00 0.42 0.29 -0.69 -0.54 0.00 0.00 174.62 174.10 2gca s VAL 362 N 0.02 -0.43 -0.10 2.29 1.01 -1.26 -2.47 120.40 119.46 2gca s VAL 362 Ca 0.25 0.26 -0.02 0.00 0.00 0.00 0.00 61.98 62.46 2gca s VAL 362 Cb -0.16 -0.48 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 2gca s VAL 362 CO 0.11 0.11 -0.01 -0.31 0.00 0.00 0.00 175.10 175.00 2gca s TYR 363 N 2.39 3.12 -0.28 5.22 4.12 0.96 -4.66 117.35 128.22 2gca s TYR 363 Ca 0.00 0.10 -0.07 0.00 0.02 0.00 0.00 57.07 57.12 2gca s TYR 363 Cb -0.12 -1.82 -0.00 0.00 -1.52 0.00 0.00 41.96 38.50 2gca s TYR 363 CO -0.09 0.37 0.08 -0.51 0.02 0.00 0.00 175.55 175.41 2gca s LEU 364 N -0.63 3.70 0.36 -1.29 1.43 0.27 -0.44 118.68 122.09 2gca s LEU 364 Ca 0.10 -0.53 0.06 0.00 -1.03 0.00 0.00 54.13 52.73 2gca s LEU 364 Cb -0.12 -1.90 -0.07 0.00 0.03 0.00 0.00 46.19 44.13 2gca s LEU 364 CO 0.02 -0.14 0.01 0.68 0.23 0.00 0.00 176.35 177.15 2gca s VAL 365 N 1.54 1.71 0.50 -1.59 -7.23 -0.44 -2.28 120.40 112.62 2gca s VAL 365 Ca 0.04 -2.03 -0.14 0.00 -1.81 0.00 0.00 61.98 58.04 2gca s VAL 365 Cb -0.16 -2.85 -0.07 0.00 0.56 0.00 0.00 36.38 33.86 2gca s VAL 365 CO 0.03 -0.05 0.94 -2.84 -0.31 0.00 0.00 175.10 172.87 2gca s PRO 366 N -3.76 3.87 -0.24 4.82 0.02 -1.26 -4.19 135.00 134.25 2gca s PRO 366 Ca 0.35 0.81 -0.19 0.00 0.02 0.00 0.00 61.00 61.99 2gca s PRO 366 Cb 0.08 -2.19 -0.03 0.00 0.02 0.00 0.00 34.50 32.39 2gca s PRO 366 CO 0.16 -0.25 0.55 0.08 -0.33 0.00 0.00 177.00 177.22 2gca s VAL 367 N -2.63 5.05 0.84 3.83 1.01 -1.26 -4.63 120.40 122.61 2gca s VAL 367 Ca 0.57 0.98 -0.14 0.00 0.00 0.00 0.00 61.98 63.38 2gca s VAL 367 Cb -0.10 -3.86 0.03 0.00 0.00 0.00 0.00 36.38 32.44 2gca s VAL 367 CO 0.34 0.09 0.68 -2.65 0.00 0.00 0.00 175.10 173.56 2gca n PRO 368 N 5.42 0.02 -2.33 2.72 -0.02 -1.26 -2.90 135.00 136.64 2gca n PRO 368 Ca -0.03 0.06 -0.18 0.00 -2.02 0.00 0.00 63.50 61.33 2gca n PRO 368 Cb 0.50 -2.02 -0.01 0.00 -0.02 0.00 0.00 33.50 31.95 2gca n PRO 368 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2gca n GLY 369 N 1.25 -0.35 3.08 -1.23 0.00 -1.26 -4.87 105.19 101.81 2gca n GLY 369 Ca 0.10 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 2gca n GLY 369 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gca s THR 370 N -2.89 -0.01 1.12 2.61 2.01 -1.14 -5.16 115.64 112.17 2gca s THR 370 Ca 0.00 0.04 -0.13 0.00 0.31 0.00 0.00 61.69 61.91 2gca s THR 370 Cb 0.00 -0.31 0.26 0.00 0.01 0.00 0.00 72.50 72.45 2gca s THR 370 CO 0.00 0.02 1.05 -2.16 -0.69 0.00 0.00 174.62 172.83 2gca s PRO 371 N 0.38 -0.54 -0.42 4.92 0.04 -1.26 -4.86 135.00 133.26 2gca s PRO 371 Ca -0.02 0.66 -0.16 0.00 0.04 0.00 0.00 61.00 61.52 2gca s PRO 371 Cb -0.04 -1.61 0.03 0.00 0.04 0.00 0.00 34.50 32.92 2gca s PRO 371 CO -0.02 -3.42 0.35 0.50 0.04 0.00 0.00 177.00 174.46 2gca s ARG 372 N -4.66 3.00 0.48 4.56 3.00 -1.26 -4.96 118.95 119.11 2gca s ARG 372 Ca 0.67 -1.00 0.00 0.00 -1.00 0.00 0.00 55.73 54.40 2gca s ARG 372 Cb -0.22 -4.00 0.01 0.00 0.00 0.00 0.00 34.95 30.73 2gca s ARG 372 CO 0.62 -0.83 0.71 0.00 0.00 0.00 0.00 175.30 175.80 2gca s ALA 373 N 1.81 3.75 -0.44 6.12 0.00 -1.26 -5.27 121.76 126.48 2gca s ALA 373 Ca 0.07 -1.09 -0.22 0.00 0.00 0.00 0.00 51.96 50.72 2gca s ALA 373 Cb -0.19 -2.16 0.02 0.00 0.00 0.00 0.00 23.12 20.79 2gca s ALA 373 CO 0.10 -0.48 0.73 -0.51 0.00 0.00 0.00 175.76 175.60 2gca s LEU 374 N -4.63 4.32 0.00 0.00 1.43 -1.26 -5.23 118.68 113.31 2gca s LEU 374 Ca 0.51 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 2gca s LEU 374 Cb -0.10 -2.89 0.00 0.00 0.03 0.00 0.00 46.19 43.23 2gca s LEU 374 CO 0.38 -0.85 0.00 0.54 0.23 0.00 0.00 176.35 176.66 2gca n ARG 386 N 6.53 0.00 -3.01 1.70 5.12 -1.26 -5.21 116.66 120.53 2gca n ARG 386 Ca 0.01 0.00 -0.36 0.00 -1.93 0.00 0.00 57.85 55.57 2gca n ARG 386 Cb 0.48 -3.14 -0.06 0.00 -1.16 0.00 0.00 32.46 28.58 2gca n ARG 386 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2gca s LEU 387 N 0.00 4.28 0.06 0.55 1.43 -1.26 0.97 118.68 124.71 2gca s LEU 387 Ca 0.00 1.52 -0.08 0.00 -1.03 0.00 0.00 54.13 54.54 2gca s LEU 387 Cb 0.00 -3.81 -0.00 0.00 0.03 0.00 0.00 46.19 42.41 2gca s LEU 387 CO 0.00 -0.04 0.16 -0.54 0.23 0.00 0.00 176.35 176.16 2gca s LYS 388 N -2.19 0.73 0.30 1.70 -0.14 -0.97 -4.89 119.74 114.28 2gca s LYS 388 Ca 0.47 -0.82 0.25 0.00 -1.36 0.00 0.00 55.97 54.52 2gca s LYS 388 Cb -0.16 0.30 0.68 0.00 -1.68 0.00 0.00 37.83 36.97 2gca s LYS 388 CO 0.21 -0.21 1.73 -0.44 -0.76 0.00 0.00 175.35 175.87 2gca h ASP 389 N 3.18 0.00 -4.61 2.83 3.32 -1.97 -3.40 116.42 115.77 2gca h ASP 389 Ca -0.33 0.00 0.08 0.00 0.02 0.00 0.00 57.03 56.80 2gca h ASP 389 Cb 1.19 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.57 2gca h ASP 389 CO 0.53 0.00 0.45 -0.94 -1.72 0.00 0.00 179.24 177.56 2gca s SER 390 N -5.10 -0.41 0.52 6.45 1.04 -1.26 -4.53 113.70 110.41 2gca s SER 390 Ca 0.09 0.13 0.18 0.00 0.48 0.00 0.00 55.95 56.83 2gca s SER 390 Cb 0.10 0.40 1.28 0.00 0.10 0.00 0.00 66.02 67.90 2gca s SER 390 CO 0.61 -0.61 2.09 4.11 0.98 0.00 0.00 173.24 180.42 2gca h TRP 391 N 2.18 0.04 -0.24 5.02 5.08 -1.91 -1.80 115.95 124.32 2gca h TRP 391 Ca -0.23 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.74 2gca h TRP 391 Cb 1.23 -0.01 -0.01 0.00 -3.00 0.00 0.00 29.16 27.36 2gca h TRP 391 CO 0.27 0.02 0.15 1.96 -1.28 0.00 0.00 178.44 179.56 2gca h GLN 392 N 0.04 0.32 -0.74 0.12 7.50 -1.98 0.66 115.11 121.02 2gca h GLN 392 Ca 0.10 -0.02 -0.03 0.00 0.50 0.00 0.00 58.65 59.19 2gca h GLN 392 Cb 0.34 -0.07 -0.03 0.00 0.05 0.00 0.00 27.48 27.76 2gca h GLN 392 CO -0.01 0.23 0.34 1.49 -1.50 0.00 0.00 178.83 179.38 2gca h GLU 393 N 0.31 1.09 -0.35 1.46 4.81 -1.75 0.19 114.58 120.34 2gca h GLU 393 Ca 0.09 -0.17 -0.11 0.00 -0.13 0.00 0.00 59.36 59.03 2gca h GLU 393 Cb -0.02 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.16 2gca h GLU 393 CO -0.02 0.86 -0.24 0.00 -0.73 0.00 0.00 179.01 178.89 2gca h ALA 394 N 1.17 0.94 -0.22 2.92 0.00 -0.90 -1.42 119.26 121.75 2gca h ALA 394 Ca 0.25 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 2gca h ALA 394 Cb 0.15 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2gca h ALA 394 CO -0.03 0.61 -0.37 1.25 0.00 0.00 0.00 179.25 180.71 2gca h LEU 395 N 0.60 0.70 -0.63 0.00 5.85 0.85 -2.72 115.31 119.95 2gca h LEU 395 Ca 0.08 -0.53 -0.09 0.00 0.84 0.00 0.00 57.88 58.18 2gca h LEU 395 Cb 0.72 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2gca h LEU 395 CO 0.06 1.10 0.03 0.00 -0.34 0.00 0.00 178.44 179.28 2gca h ALA 396 N 0.62 0.85 -0.26 1.25 0.00 -0.55 -2.15 119.26 119.02 2gca h ALA 396 Ca 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 2gca h ALA 396 Cb 0.96 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2gca h ALA 396 CO 0.08 0.68 0.09 0.00 0.00 0.00 0.00 179.25 180.10 2gca h ALA 397 N 1.01 0.34 0.33 0.00 0.00 -1.29 -1.41 119.26 118.25 2gca h ALA 397 Ca 0.18 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2gca h ALA 397 Cb 0.53 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2gca h ALA 397 CO 0.03 -0.04 -0.21 1.03 0.00 0.00 0.00 179.25 180.06 2gca h SER 398 N 0.26 -0.53 0.24 0.00 0.87 -1.42 0.14 113.55 113.12 2gca h SER 398 Ca 0.09 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2gca h SER 398 Cb 0.22 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 2gca h SER 398 CO -0.00 -0.34 0.00 -0.07 -0.53 0.00 0.00 176.83 175.89 2gca h LEU 399 N -0.53 0.00 0.11 2.23 3.38 -1.36 -0.59 115.31 118.56 2gca h LEU 399 Ca -0.03 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.63 2gca h LEU 399 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2gca h LEU 399 CO 0.03 0.00 -1.62 -1.13 0.09 0.00 0.00 178.44 175.81 2gca h ASN 400 N 0.00 0.38 0.00 -0.43 -1.24 -0.15 -3.32 115.58 110.81 2gca h ASN 400 Ca 0.00 -0.85 -0.00 0.00 0.71 0.00 0.00 56.30 56.16 2gca h ASN 400 Cb 0.12 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 39.05 2gca h ASN 400 CO 0.00 1.70 -0.00 0.44 -1.29 0.00 0.00 177.43 178.28 2gca h ASP 401 N -0.22 -0.00 -2.54 1.15 3.32 -0.30 -3.42 116.42 114.41 2gca h ASP 401 Ca -0.35 -0.92 -0.60 0.00 0.02 0.00 0.00 57.03 55.18 2gca h ASP 401 Cb 1.83 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 40.99 2gca h ASP 401 CO 0.05 0.92 -0.89 0.68 -1.72 0.00 0.00 179.24 178.28 2gca s VAL 402 N -2.52 0.86 0.31 -1.35 -7.23 -0.27 -5.02 120.40 105.18 2gca s VAL 402 Ca -0.18 -2.94 0.08 0.00 -1.81 0.00 0.00 61.98 57.13 2gca s VAL 402 Cb -0.02 -1.59 0.31 0.00 0.56 0.00 0.00 36.38 35.64 2gca s VAL 402 CO 0.68 -1.18 1.69 -0.65 -0.31 0.00 0.00 175.10 175.33 2gca h PRO 403 N 5.66 0.38 -0.21 4.82 0.11 -1.68 -1.41 132.00 139.68 2gca h PRO 403 Ca 0.23 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.32 2gca h PRO 403 Cb 0.88 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.91 2gca h PRO 403 CO 0.44 0.25 0.00 -0.25 -0.21 0.00 0.00 178.00 178.23 2gca n ASP 404 N -5.04 1.28 -4.62 -2.05 8.00 -1.26 -4.84 116.55 108.03 2gca n ASP 404 Ca 0.26 -1.89 -0.41 0.00 0.71 0.00 0.00 54.79 53.47 2gca n ASP 404 Cb 0.78 -0.14 -0.06 0.00 -0.02 0.00 0.00 41.12 41.68 2gca n ASP 404 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 2gca s GLN 405 N -1.72 4.09 0.36 -1.24 0.74 -0.53 -4.96 119.66 116.39 2gca s GLN 405 Ca 0.21 0.51 -0.28 0.00 0.05 0.00 0.00 55.36 55.84 2gca s GLN 405 Cb 0.11 -3.66 -0.12 0.00 1.10 0.00 0.00 33.01 30.45 2gca s GLN 405 CO 0.15 -0.42 1.44 -0.35 -0.55 0.00 0.00 175.29 175.57 2gca n PRO 406 N 5.71 2.51 -4.67 1.67 -0.04 -1.26 -4.75 135.00 134.17 2gca n PRO 406 Ca -0.01 0.88 -0.33 0.00 -0.04 0.00 0.00 63.50 64.00 2gca n PRO 406 Cb 0.49 -2.58 -0.14 0.00 -0.04 0.00 0.00 33.50 31.24 2gca n PRO 406 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2gca s ILE 407 N -0.99 3.31 -0.15 0.52 1.09 -0.40 -0.98 121.20 123.60 2gca s ILE 407 Ca 0.55 -0.57 0.01 0.00 -1.10 0.00 0.00 60.65 59.53 2gca s ILE 407 Cb -0.51 -2.40 -0.00 0.00 -1.06 0.00 0.00 42.46 38.49 2gca s ILE 407 CO 0.62 0.52 -0.16 -0.69 -0.10 0.00 0.00 174.94 175.13 2gca s VAL 408 N 0.26 2.65 -0.18 2.92 1.01 0.69 -0.60 120.40 127.14 2gca s VAL 408 Ca -0.07 -0.78 -0.05 0.00 0.00 0.00 0.00 61.98 61.07 2gca s VAL 408 Cb -0.15 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 2gca s VAL 408 CO 0.05 0.52 0.01 -0.63 0.00 0.00 0.00 175.10 175.05 2gca s ILE 409 N 0.70 4.18 0.36 2.22 -1.09 0.19 -0.62 121.20 127.14 2gca s ILE 409 Ca -0.07 -0.25 -0.11 0.00 -2.23 0.00 0.00 60.65 57.99 2gca s ILE 409 Cb -0.16 -2.87 0.03 0.00 -1.58 0.00 0.00 42.46 37.88 2gca s ILE 409 CO 0.02 0.45 0.66 0.28 -1.23 0.00 0.00 174.94 175.11 2gca s THR 410 N 0.66 0.00 0.00 2.92 -1.32 -0.48 -0.34 115.64 117.08 2gca s THR 410 Ca 0.00 -1.24 0.00 0.00 -1.21 0.00 0.00 61.69 59.24 2gca s THR 410 Cb -0.14 -2.72 0.00 0.00 -1.51 0.00 0.00 72.50 68.13 2gca s THR 410 CO 0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 2gca n GLY 411 N -0.53 1.35 3.54 6.08 0.00 -1.19 -1.88 105.19 112.56 2gca n GLY 411 Ca -0.04 -0.28 -0.16 0.00 0.00 0.00 0.00 46.02 45.54 2gca n GLY 411 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2gca s SER 412 N -0.59 -0.59 0.49 1.61 1.04 -1.13 -4.47 113.70 110.06 2gca s SER 412 Ca 0.00 0.66 0.28 0.00 0.48 0.00 0.00 55.95 57.37 2gca s SER 412 Cb 0.00 0.50 1.08 0.00 0.10 0.00 0.00 66.02 67.70 2gca s SER 412 CO 0.00 -0.53 1.88 0.25 0.98 0.00 0.00 173.24 175.82 2gca h LEU 413 N 2.94 0.00 0.01 2.42 7.12 -1.82 -2.33 115.31 123.65 2gca h LEU 413 Ca -0.25 0.00 -0.24 0.00 0.13 0.00 0.00 57.88 57.52 2gca h LEU 413 Cb 1.15 0.00 -0.04 0.00 -0.53 0.00 0.00 40.66 41.24 2gca h LEU 413 CO 0.36 0.12 -1.28 1.88 -0.13 0.00 0.00 178.44 179.39 2gca h TYR 414 N 0.00 0.02 -0.04 1.25 0.05 -1.95 -1.95 116.97 114.35 2gca h TYR 414 Ca -0.00 -0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.70 2gca h TYR 414 Cb 0.66 -0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.40 2gca h TYR 414 CO 0.00 1.02 -0.20 1.25 -1.05 0.00 0.00 178.16 179.18 2gca h LEU 415 N 0.00 0.25 -0.44 3.88 5.85 -1.86 -1.23 115.31 121.77 2gca h LEU 415 Ca -0.12 -0.66 0.05 0.00 0.84 0.00 0.00 57.88 57.99 2gca h LEU 415 Cb 1.87 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.78 2gca h LEU 415 CO 0.11 0.87 0.18 0.00 -0.34 0.00 0.00 178.44 179.26 2gca h ALA 416 N 0.39 0.53 -0.86 1.25 0.00 -1.51 -1.00 119.26 118.06 2gca h ALA 416 Ca -0.01 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.97 2gca h ALA 416 Cb 0.86 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.60 2gca h ALA 416 CO 0.04 -0.20 0.56 1.03 0.00 0.00 0.00 179.25 180.69 2gca h SER 417 N 0.36 0.92 -0.07 0.00 0.87 -1.32 -1.15 113.55 113.16 2gca h SER 417 Ca 0.20 -0.01 -0.17 0.00 -1.23 0.00 0.00 61.79 60.57 2gca h SER 417 Cb 0.16 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 61.90 2gca h SER 417 CO -0.18 0.64 -0.57 0.00 -0.53 0.00 0.00 176.83 176.18 2gca h ALA 418 N 1.50 0.60 -0.26 6.23 0.00 -0.10 -2.53 119.26 124.69 2gca h ALA 418 Ca 0.34 -0.52 -0.15 0.00 0.00 0.00 0.00 54.91 54.58 2gca h ALA 418 Cb 0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2gca h ALA 418 CO -0.10 0.69 -0.40 0.28 0.00 0.00 0.00 179.25 179.72 2gca h VAL 419 N 0.50 1.30 -0.57 0.00 2.07 -0.90 -2.74 116.25 115.92 2gca h VAL 419 Ca 0.00 -1.60 0.01 0.00 0.82 0.00 0.00 66.70 65.94 2gca h VAL 419 Cb 1.15 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 32.56 2gca h VAL 419 CO 0.11 0.51 0.36 -0.09 0.02 0.00 0.00 177.57 178.49 2gca h ARG 420 N 0.48 0.71 0.00 1.57 2.43 -1.22 0.43 114.38 118.78 2gca h ARG 420 Ca 0.02 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 2gca h ARG 420 Cb 1.00 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 2gca h ARG 420 CO 0.09 0.47 -0.17 1.96 -1.51 0.00 0.00 179.97 180.81 2gca h GLN 421 N 0.73 0.00 0.00 0.20 4.20 -1.45 0.34 115.11 119.13 2gca h GLN 421 Ca 0.22 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.76 2gca h GLN 421 Cb -0.04 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 2gca h GLN 421 CO -0.07 0.17 -0.89 1.15 -0.67 0.00 0.00 178.83 178.52 2gca h THR 422 N 0.00 1.19 0.00 -0.54 2.02 -0.99 -2.72 112.91 111.86 2gca h THR 422 Ca -0.00 -2.24 -0.13 0.00 0.77 0.00 0.00 66.41 64.80 2gca h THR 422 Cb 0.35 2.60 -0.02 0.00 -1.74 0.00 0.00 68.15 69.34 2gca h THR 422 CO 0.02 0.42 -0.64 -0.07 0.37 0.00 0.00 175.52 175.62 2gca h LEU 423 N -0.97 0.00 0.00 2.58 3.38 -0.15 -3.36 115.31 116.78 2gca h LEU 423 Ca -0.24 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.45 2gca h LEU 423 Cb 1.23 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.93 2gca h LEU 423 CO -0.14 0.64 -2.04 0.18 0.09 0.00 0.00 178.44 177.18 2gca n LEU 424 N -3.47 2.63 0.00 1.67 4.77 0.09 -5.07 117.00 117.62 2gca n LEU 424 Ca 0.00 -0.02 0.10 0.00 -0.03 0.00 0.00 56.01 56.06 2gca n LEU 424 Cb 0.71 -0.62 0.59 0.00 -2.33 0.00 0.00 43.42 41.77 2gca n LEU 424 CO 0.42 0.72 0.79 0.61 -1.33 0.00 0.00 177.39 178.59