#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gak n LEU 3 N 0.00 3.62 -4.09 2.45 7.94 -1.25 -1.91 117.00 123.76 3gak n LEU 3 Ca 0.00 1.08 -0.18 0.00 -1.11 0.00 0.00 56.01 55.80 3gak n LEU 3 Cb 0.00 -1.51 -0.13 0.00 0.53 0.00 0.00 43.42 42.31 3gak n LEU 3 CO 0.00 -0.05 -0.44 0.00 -1.11 0.00 0.00 177.39 175.79 3gak s THR 5 N -0.75 3.89 0.23 0.00 -4.23 -1.25 -4.22 115.64 109.30 3gak s THR 5 Ca -0.00 1.46 -0.04 0.00 -1.18 0.00 0.00 61.69 61.92 3gak s THR 5 Cb -0.07 -3.76 0.06 0.00 1.34 0.00 0.00 72.50 70.08 3gak s THR 5 CO 0.01 0.02 1.67 0.25 -0.54 0.00 0.00 174.62 176.03 3gak h LEU 6 N 2.63 0.81 -0.63 4.79 5.85 -1.93 -2.55 115.31 124.27 3gak h LEU 6 Ca -0.48 -0.25 0.13 0.00 0.84 0.00 0.00 57.88 58.11 3gak h LEU 6 Cb 1.21 -0.22 -0.12 0.00 0.37 0.00 0.00 40.66 41.90 3gak h LEU 6 CO 0.63 0.95 -0.18 -0.09 -0.34 0.00 0.00 178.44 179.40 3gak h ARG 7 N 0.73 -0.03 0.22 1.25 2.43 -1.93 -1.99 114.38 115.07 3gak h ARG 7 Ca 0.12 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 3gak h ARG 7 Cb 0.62 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 3gak h ARG 7 CO 0.04 -0.02 -0.11 0.37 -1.51 0.00 0.00 179.97 178.75 3gak h GLN 8 N -0.03 -0.29 -0.72 0.20 4.15 -1.88 0.13 115.11 116.67 3gak h GLN 8 Ca 0.30 0.02 0.15 0.00 0.77 0.00 0.00 58.65 59.89 3gak h GLN 8 Cb 0.48 0.07 -0.11 0.00 0.21 0.00 0.00 27.48 28.13 3gak h GLN 8 CO -0.66 0.08 0.17 1.98 -1.93 0.00 0.00 178.83 178.46 3gak h MET 9 N -0.73 0.26 0.06 1.69 4.05 -1.35 0.82 114.93 119.74 3gak h MET 9 Ca -0.03 -0.02 -0.25 0.00 -0.28 0.00 0.00 59.70 59.13 3gak h MET 9 Cb 0.50 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.24 3gak h MET 9 CO 0.05 0.17 -1.08 -0.07 0.23 0.00 0.00 176.91 176.21 3gak h LEU 10 N 0.27 0.49 -0.65 3.39 3.38 -1.35 -1.92 115.31 118.91 3gak h LEU 10 Ca 0.41 -0.44 0.13 0.00 0.09 0.00 0.00 57.88 58.06 3gak h LEU 10 Cb 0.68 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 41.18 3gak h LEU 10 CO -0.50 1.28 0.11 1.23 0.09 0.00 0.00 178.44 180.65 3gak h GLY 11 N 1.37 0.82 1.26 0.83 0.00 0.13 0.80 103.07 108.29 3gak h GLY 11 Ca -0.11 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.07 3gak h GLY 11 CO 0.18 -0.17 -0.43 0.83 0.00 0.00 0.00 176.54 176.96 3gak h GLU 12 N 0.22 0.80 -0.18 4.80 4.39 -0.89 -1.60 114.58 122.13 3gak h GLU 12 Ca 0.35 -0.43 0.03 0.00 0.34 0.00 0.00 59.36 59.65 3gak h GLU 12 Cb 0.57 0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.21 3gak h GLU 12 CO -0.48 1.07 -0.04 0.00 -1.16 0.00 0.00 179.01 178.40 3gak h ALA 13 N 0.87 0.12 0.42 3.43 0.00 0.29 -1.51 119.26 122.88 3gak h ALA 13 Ca 0.05 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3gak h ALA 13 Cb 0.99 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3gak h ALA 13 CO 0.10 -0.47 -0.20 -0.09 0.00 0.00 0.00 179.25 178.58 3gak h ARG 14 N 0.01 -0.54 -0.59 0.00 2.43 0.42 0.46 114.38 116.57 3gak h ARG 14 Ca 0.08 0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.30 3gak h ARG 14 Cb 0.13 0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 3gak h ARG 14 CO -0.18 -0.32 0.38 -0.22 -1.51 0.00 0.00 179.97 178.13 3gak h LYS 15 N -0.65 0.76 -0.20 0.20 3.64 -1.24 -2.48 116.57 116.59 3gak h LYS 15 Ca -0.06 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 3gak h LYS 15 Cb 0.48 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3gak h LYS 15 CO 0.09 0.50 0.00 0.72 -2.27 0.00 0.00 179.45 178.50 3gak n HIS 16 N -4.69 0.26 -3.12 1.91 8.25 -0.57 -4.96 115.22 112.30 3gak n HIS 16 Ca 0.04 -0.13 -0.14 0.00 -0.26 0.00 0.00 57.72 57.23 3gak n HIS 16 Cb 0.03 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.21 3gak n HIS 16 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3gak n LYS 17 N 0.19 -2.89 -4.02 -0.41 4.01 -0.94 -5.05 118.16 109.05 3gak n LYS 17 Ca 0.13 0.78 -0.13 0.00 -0.51 0.00 0.00 58.31 58.58 3gak n LYS 17 Cb 0.25 -5.43 -0.03 0.00 -0.51 0.00 0.00 35.03 29.31 3gak n LYS 17 CO 0.00 0.00 0.00 1.52 -1.11 0.00 0.00 177.40 177.81 3gak s TYR 18 N -3.34 0.80 0.21 2.13 -0.85 0.16 -4.86 117.35 111.60 3gak s TYR 18 Ca 0.32 -1.13 0.10 0.00 -0.52 0.00 0.00 57.07 55.84 3gak s TYR 18 Cb -0.04 0.13 -0.05 0.00 0.38 0.00 0.00 41.96 42.38 3gak s TYR 18 CO 0.66 -1.21 -0.20 0.20 -1.52 0.00 0.00 175.55 173.48 3gak s GLY 19 N -3.18 1.65 -0.15 5.49 0.00 -0.60 -4.12 107.32 106.41 3gak s GLY 19 Ca 0.27 -1.68 -0.03 0.00 0.00 0.00 0.00 44.72 43.28 3gak s GLY 19 CO 0.17 -1.74 -0.06 0.14 0.00 0.00 0.00 173.10 171.62 3gak s VAL 20 N -2.18 3.68 0.12 1.40 1.01 -0.59 -3.85 120.40 120.00 3gak s VAL 20 Ca 0.22 -0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.47 3gak s VAL 20 Cb -0.06 -2.60 -0.06 0.00 0.00 0.00 0.00 36.38 33.66 3gak s VAL 20 CO 0.10 0.50 1.07 -0.83 0.00 0.00 0.00 175.10 175.93 3gak s GLY 21 N 0.40 2.83 -0.32 4.51 0.00 -1.26 -1.82 107.32 111.66 3gak s GLY 21 Ca -0.05 0.73 -0.11 0.00 0.00 0.00 0.00 44.72 45.28 3gak s GLY 21 CO 0.03 1.66 0.19 0.00 0.00 0.00 0.00 173.10 174.99 3gak s ALA 22 N 0.15 3.37 -0.15 3.20 0.00 -0.97 -3.21 121.76 124.15 3gak s ALA 22 Ca 0.50 -1.40 0.00 0.00 0.00 0.00 0.00 51.96 51.07 3gak s ALA 22 Cb -0.27 -2.50 -0.00 0.00 0.00 0.00 0.00 23.12 20.35 3gak s ALA 22 CO 0.32 -0.94 -0.15 -0.06 0.00 0.00 0.00 175.76 174.93 3gak s PHE 23 N 1.65 2.79 0.17 0.00 0.08 0.17 -1.66 117.98 121.18 3gak s PHE 23 Ca 0.05 -1.00 -0.31 0.00 0.12 0.00 0.00 56.93 55.80 3gak s PHE 23 Cb -0.17 -1.89 -0.09 0.00 -0.57 0.00 0.00 43.02 40.30 3gak s PHE 23 CO 0.08 -0.45 1.38 -0.80 -0.10 0.00 0.00 175.22 175.33 3gak s ASN 24 N 0.79 6.81 0.04 1.36 -0.87 -1.14 0.41 114.94 122.34 3gak s ASN 24 Ca -0.06 2.43 0.08 0.00 -1.57 0.00 0.00 52.86 53.74 3gak s ASN 24 Cb -0.15 -2.60 -0.03 0.00 -0.02 0.00 0.00 41.25 38.45 3gak s ASN 24 CO 0.00 -0.62 -0.23 0.68 -2.57 0.00 0.00 177.10 174.36 3gak s VAL 25 N 0.56 2.40 0.00 1.60 -7.23 0.28 -4.85 120.40 113.16 3gak s VAL 25 Ca 0.61 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 59.49 3gak s VAL 25 Cb -0.38 -1.96 0.00 0.00 0.56 0.00 0.00 36.38 34.60 3gak s VAL 25 CO 0.35 0.37 0.00 0.59 -0.31 0.00 0.00 175.10 176.10 3gak n ASN 26 N 1.73 1.82 -3.58 4.85 3.02 -1.26 -4.59 115.26 117.24 3gak n ASN 26 Ca -0.17 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.25 3gak n ASN 26 Cb 0.52 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.63 3gak n ASN 26 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3gak s ASN 27 N -3.80 0.65 0.02 6.41 2.20 -1.26 -4.74 114.94 114.43 3gak s ASN 27 Ca 0.00 -1.38 -0.08 0.00 -0.94 0.00 0.00 52.86 50.46 3gak s ASN 27 Cb 0.00 0.59 -0.04 0.00 -2.00 0.00 0.00 41.25 39.80 3gak s ASN 27 CO 0.00 -1.16 1.13 -0.03 -2.94 0.00 0.00 177.10 174.09 3gak h MET 28 N 2.23 -0.19 -0.81 3.55 1.85 -2.01 -2.66 114.93 116.88 3gak h MET 28 Ca -0.29 0.01 0.24 0.00 -0.61 0.00 0.00 59.70 59.05 3gak h MET 28 Cb 1.24 0.04 -0.03 0.00 0.43 0.00 0.00 31.60 33.28 3gak h MET 28 CO 0.40 -0.13 0.62 0.93 -0.40 0.00 0.00 176.91 178.34 3gak h GLU 29 N -0.20 0.00 -0.16 0.39 3.07 -1.99 0.24 114.58 115.94 3gak h GLU 29 Ca -0.01 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.80 3gak h GLU 29 Cb 0.19 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.09 3gak h GLU 29 CO -0.04 0.00 -0.10 1.96 -1.40 0.00 0.00 179.01 179.43 3gak h GLN 30 N 0.00 0.35 -0.17 2.33 4.20 -1.88 -2.39 115.11 117.54 3gak h GLN 30 Ca 0.39 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 3gak h GLN 30 Cb 1.63 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.40 3gak h GLN 30 CO -0.00 0.68 0.06 0.82 -0.67 0.00 0.00 178.83 179.72 3gak h ILE 31 N 0.01 1.17 -0.96 2.54 2.04 -0.33 -1.97 117.51 120.01 3gak h ILE 31 Ca 0.03 -0.52 0.21 0.00 1.00 0.00 0.00 64.86 65.59 3gak h ILE 31 Cb 0.59 1.19 -0.08 0.00 -0.74 0.00 0.00 36.82 37.78 3gak h ILE 31 CO 0.03 0.16 0.62 1.56 0.00 0.00 0.00 178.15 180.52 3gak h GLN 32 N 0.12 0.48 0.28 2.37 4.20 -1.41 -0.60 115.11 120.54 3gak h GLN 32 Ca 0.06 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 3gak h GLN 32 Cb 0.19 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.87 3gak h GLN 32 CO -0.00 0.32 -0.14 0.78 -0.67 0.00 0.00 178.83 179.12 3gak h GLY 33 N 0.49 -0.40 0.86 3.46 0.00 -0.82 -2.35 103.07 104.32 3gak h GLY 33 Ca 0.52 0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.98 3gak h GLY 33 CO -0.25 -0.14 -0.13 -2.22 0.00 0.00 0.00 176.54 173.80 3gak h ILE 34 N -0.43 0.77 -0.42 2.60 2.04 -0.99 -3.10 117.51 117.99 3gak h ILE 34 Ca -0.04 -0.28 0.08 0.00 1.00 0.00 0.00 64.86 65.63 3gak h ILE 34 Cb 0.33 0.93 -0.08 0.00 -0.74 0.00 0.00 36.82 37.26 3gak h ILE 34 CO 0.06 0.06 -0.08 0.24 0.00 0.00 0.00 178.15 178.43 3gak h MET 35 N -0.50 0.02 -0.71 2.37 2.86 -1.14 -1.89 114.93 115.94 3gak h MET 35 Ca -0.04 -0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.62 3gak h MET 35 Cb 0.37 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.99 3gak h MET 35 CO 0.06 0.01 0.47 -0.22 1.06 0.00 0.00 176.91 178.29 3gak h LYS 36 N 0.02 0.87 0.40 1.72 3.64 -1.35 0.23 116.57 122.10 3gak h LYS 36 Ca 0.21 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 3gak h LYS 36 Cb 0.31 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 3gak h LYS 36 CO -0.42 0.58 -0.19 0.00 -2.27 0.00 0.00 179.45 177.15 3gak h ALA 37 N 1.58 -0.53 -0.55 5.00 0.00 -1.34 -0.31 119.26 123.11 3gak h ALA 37 Ca 0.27 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3gak h ALA 37 Cb -0.01 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3gak h ALA 37 CO -0.07 -0.62 0.34 -0.39 0.00 0.00 0.00 179.25 178.50 3gak h VAL 38 N -0.88 1.08 -0.48 0.00 -1.51 -0.81 0.42 116.25 114.06 3gak h VAL 38 Ca -0.05 -0.23 0.01 0.00 -1.23 0.00 0.00 66.70 65.20 3gak h VAL 38 Cb 0.55 0.35 -0.03 0.00 -2.13 0.00 0.00 31.29 30.03 3gak h VAL 38 CO 0.09 0.12 0.30 0.58 -1.23 0.00 0.00 177.57 177.44 3gak h VAL 39 N 0.67 1.09 0.00 7.19 2.07 -1.03 0.85 116.25 127.09 3gak h VAL 39 Ca 0.22 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.53 3gak h VAL 39 Cb -0.00 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 3gak h VAL 39 CO -0.08 0.11 0.00 1.67 0.02 0.00 0.00 177.57 179.29 3gak n GLN 40 N -4.78 0.08 -0.12 1.57 7.27 -0.01 -1.77 117.38 119.62 3gak n GLN 40 Ca 0.02 0.19 0.02 0.00 0.07 0.00 0.00 57.00 57.30 3gak n GLN 40 Cb 0.04 -1.50 0.02 0.00 2.41 0.00 0.00 30.24 31.22 3gak n GLN 40 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 3gak n LEU 41 N -1.43 0.99 -4.20 1.69 4.77 -0.32 -5.02 117.00 113.49 3gak n LEU 41 Ca 0.05 -1.33 -0.30 0.00 -0.03 0.00 0.00 56.01 54.40 3gak n LEU 41 Cb 0.17 -0.08 -0.07 0.00 -2.33 0.00 0.00 43.42 41.11 3gak n LEU 41 CO 0.14 0.32 -0.39 0.29 -1.33 0.00 0.00 177.39 176.42 3gak n LYS 42 N -0.40 -1.53 -4.44 3.23 4.76 0.27 0.05 118.16 120.10 3gak n LYS 42 Ca 0.03 0.18 -0.35 0.00 -2.87 0.00 0.00 58.31 55.30 3gak n LYS 42 Cb 0.49 -3.78 -0.10 0.00 -1.84 0.00 0.00 35.03 29.80 3gak n LYS 42 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3gak s SER 43 N -4.32 5.06 0.80 4.39 0.15 0.14 -0.09 113.70 119.83 3gak s SER 43 Ca 0.03 0.08 -0.12 0.00 0.70 0.00 0.00 55.95 56.65 3gak s SER 43 Cb -0.02 -1.42 0.08 0.00 -1.71 0.00 0.00 66.02 62.95 3gak s SER 43 CO 0.97 0.36 1.14 -2.16 1.20 0.00 0.00 173.24 174.75 3gak s PRO 44 N -0.77 1.84 -0.00 5.44 0.04 -1.26 -4.70 135.00 135.59 3gak s PRO 44 Ca 0.12 1.47 0.00 0.00 0.04 0.00 0.00 61.00 62.63 3gak s PRO 44 Cb -0.11 -1.83 0.01 0.00 0.04 0.00 0.00 34.50 32.60 3gak s PRO 44 CO 0.02 -2.00 0.00 0.54 0.04 0.00 0.00 177.00 175.60 3gak s VAL 45 N -2.53 0.02 -0.33 -0.36 0.11 -0.73 -4.68 120.40 111.91 3gak s VAL 45 Ca 0.67 0.02 -0.13 0.00 -2.93 0.00 0.00 61.98 59.61 3gak s VAL 45 Cb -0.22 -0.05 -0.02 0.00 -1.53 0.00 0.00 36.38 34.55 3gak s VAL 45 CO 0.52 0.03 0.23 -0.63 -3.33 0.00 0.00 175.10 171.92 3gak s ILE 46 N 0.19 5.28 -0.20 7.04 1.01 -1.20 -1.96 121.20 131.36 3gak s ILE 46 Ca -0.02 -0.16 -0.22 0.00 0.00 0.00 0.00 60.65 60.25 3gak s ILE 46 Cb -0.03 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.74 3gak s ILE 46 CO -0.01 0.03 0.67 -0.76 0.00 0.00 0.00 174.94 174.87 3gak s LEU 47 N 1.73 4.14 -0.11 2.97 1.43 -0.11 0.45 118.68 129.17 3gak s LEU 47 Ca 0.06 0.88 -0.04 0.00 -1.03 0.00 0.00 54.13 54.00 3gak s LEU 47 Cb -0.17 -2.95 -0.04 0.00 0.03 0.00 0.00 46.19 43.06 3gak s LEU 47 CO 0.11 -0.31 0.05 -1.10 0.23 0.00 0.00 176.35 175.33 3gak s GLN 48 N 2.02 3.28 -0.31 1.70 -0.21 0.16 -1.40 119.66 124.90 3gak s GLN 48 Ca 0.30 -0.32 0.02 0.00 0.02 0.00 0.00 55.36 55.38 3gak s GLN 48 Cb -0.16 -2.98 0.09 0.00 1.00 0.00 0.00 33.01 30.97 3gak s GLN 48 CO 0.10 0.66 0.05 0.00 -2.12 0.00 0.00 175.29 173.99 3gak s SER 50 N 1.26 1.27 0.07 0.00 1.04 -1.26 -0.59 113.70 115.49 3gak s SER 50 Ca 0.08 1.31 -0.04 0.00 0.48 0.00 0.00 55.95 57.78 3gak s SER 50 Cb -0.18 -2.03 -0.28 0.00 0.10 0.00 0.00 66.02 63.62 3gak s SER 50 CO -0.15 -3.99 1.11 0.03 0.98 0.00 0.00 173.24 171.23 3gak h ARG 51 N -2.48 0.26 0.04 4.02 3.08 -1.86 -2.21 114.38 115.22 3gak h ARG 51 Ca -0.59 -0.44 0.01 0.00 0.07 0.00 0.00 59.98 59.03 3gak h ARG 51 Cb 1.34 0.17 -0.03 0.00 0.08 0.00 0.00 29.97 31.52 3gak h ARG 51 CO 0.52 1.20 -0.30 0.78 -1.07 0.00 0.00 179.97 181.09 3gak h GLY 52 N 1.65 -1.22 -0.50 0.04 0.00 -1.94 -2.60 103.07 98.51 3gak h GLY 52 Ca -0.14 0.61 0.04 0.00 0.00 0.00 0.00 47.33 47.85 3gak h GLY 52 CO 0.20 -0.36 -0.29 0.00 0.00 0.00 0.00 176.54 176.09 3gak n ALA 53 N -2.74 -0.32 0.23 3.60 0.00 -1.22 -0.41 120.51 119.65 3gak n ALA 53 Ca -0.05 0.42 0.15 0.00 0.00 0.00 0.00 53.44 53.97 3gak n ALA 53 Cb 0.23 0.04 0.81 0.00 0.00 0.00 0.00 19.45 20.53 3gak n ALA 53 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3gak h LEU 54 N 0.00 0.00 0.01 0.00 3.38 -1.32 -1.96 115.31 115.43 3gak h LEU 54 Ca 0.08 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.98 3gak h LEU 54 Cb 0.20 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.96 3gak h LEU 54 CO -0.47 0.00 -0.28 0.50 0.09 0.00 0.00 178.44 178.29 3gak h LYS 55 N 0.00 0.16 -0.98 1.13 3.64 -0.33 0.40 116.57 120.60 3gak h LYS 55 Ca 0.06 -0.19 0.16 0.00 -1.27 0.00 0.00 60.65 59.41 3gak h LYS 55 Cb 0.29 0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 32.08 3gak h LYS 55 CO -0.00 0.97 0.61 -0.92 -2.27 0.00 0.00 179.45 177.84 3gak h TYR 56 N -0.56 1.02 -0.66 1.91 3.20 -0.74 -2.76 116.97 118.38 3gak h TYR 56 Ca -0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.86 3gak h TYR 56 Cb 1.08 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 39.03 3gak h TYR 56 CO 0.20 0.31 0.00 -1.13 -1.64 0.00 0.00 178.16 175.90 3gak n SER 57 N -4.67 3.69 -1.57 -2.11 3.41 -0.79 -4.95 113.62 106.63 3gak n SER 57 Ca 0.21 -2.00 -0.14 0.00 -0.26 0.00 0.00 58.87 56.68 3gak n SER 57 Cb 0.50 -0.44 -0.05 0.00 -0.26 0.00 0.00 64.21 63.95 3gak n SER 57 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3gak n ASP 58 N 1.53 -3.89 0.00 4.04 8.00 -0.74 -2.65 116.55 122.85 3gak n ASP 58 Ca 0.23 0.33 0.00 0.00 0.71 0.00 0.00 54.79 56.05 3gak n ASP 58 Cb 0.59 -3.54 0.00 0.00 -0.02 0.00 0.00 41.12 38.15 3gak n ASP 58 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 3gak n MET 59 N -2.09 0.00 0.11 -1.24 2.81 0.13 -4.67 117.12 112.17 3gak n MET 59 Ca -0.15 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.72 3gak n MET 59 Cb 0.50 0.00 0.04 0.00 -0.71 0.00 0.00 33.22 33.04 3gak n MET 59 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3gak h ILE 60 N 0.00 1.40 -0.03 2.02 6.09 -1.84 -0.34 117.51 124.81 3gak h ILE 60 Ca 0.00 -2.65 -0.18 0.00 -1.37 0.00 0.00 64.86 60.66 3gak h ILE 60 Cb 0.00 2.48 -0.01 0.00 0.47 0.00 0.00 36.82 39.76 3gak h ILE 60 CO 0.00 0.72 -0.79 1.88 -3.07 0.00 0.00 178.15 176.90 3gak h TYR 61 N 0.00 0.35 0.07 2.19 0.05 -1.78 -2.80 116.97 115.06 3gak h TYR 61 Ca -0.01 -0.17 -0.00 0.00 0.05 0.00 0.00 58.73 58.60 3gak h TYR 61 Cb 1.42 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 39.11 3gak h TYR 61 CO 0.00 0.94 -0.03 -0.07 -1.05 0.00 0.00 178.16 177.94 3gak h LEU 62 N 0.16 -0.08 -0.97 3.88 4.07 -1.57 -0.35 115.31 120.45 3gak h LEU 62 Ca -0.03 -0.51 0.31 0.00 0.08 0.00 0.00 57.88 57.72 3gak h LEU 62 Cb 1.37 0.02 -0.17 0.00 1.08 0.00 0.00 40.66 42.96 3gak h LEU 62 CO 0.12 0.52 0.24 0.50 -1.08 0.00 0.00 178.44 178.74 3gak h LYS 63 N -0.73 0.06 0.03 1.13 3.64 -1.17 0.26 116.57 119.78 3gak h LYS 63 Ca -0.01 -0.00 -0.27 0.00 -1.27 0.00 0.00 60.65 59.10 3gak h LYS 63 Cb 0.59 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 3gak h LYS 63 CO 0.02 0.04 -1.44 0.87 -2.27 0.00 0.00 179.45 176.67 3gak h LYS 64 N 0.06 0.05 -0.30 1.90 1.57 -1.37 -0.84 116.57 117.64 3gak h LYS 64 Ca 0.67 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 59.30 3gak h LYS 64 Cb 1.52 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.85 3gak h LYS 64 CO -0.82 0.80 -0.03 -0.07 -0.57 0.00 0.00 179.45 178.76 3gak h LEU 65 N 0.01 0.54 -0.73 2.94 3.38 -0.31 -2.14 115.31 119.01 3gak h LEU 65 Ca -0.19 -0.34 0.11 0.00 0.09 0.00 0.00 57.88 57.56 3gak h LEU 65 Cb 1.93 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 42.46 3gak h LEU 65 CO 0.11 0.75 0.35 0.00 0.09 0.00 0.00 178.44 179.74 3gak h GLU 67 N 0.57 0.25 -0.15 0.00 5.08 -1.01 -2.89 114.58 116.43 3gak h GLU 67 Ca 0.37 -0.02 -0.21 0.00 -1.00 0.00 0.00 59.36 58.51 3gak h GLU 67 Cb 0.45 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.65 3gak h GLU 67 CO -0.30 0.18 -0.73 0.00 -1.00 0.00 0.00 179.01 177.16 3gak h ALA 68 N 1.86 0.41 -0.36 3.43 0.00 -0.16 -2.90 119.26 121.54 3gak h ALA 68 Ca 0.07 -0.59 0.07 0.00 0.00 0.00 0.00 54.91 54.46 3gak h ALA 68 Cb 0.01 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 3gak h ALA 68 CO -0.01 0.70 -0.34 0.00 0.00 0.00 0.00 179.25 179.60 3gak h ALA 69 N 0.67 -0.26 -0.92 0.00 0.00 -1.18 0.61 119.26 118.19 3gak h ALA 69 Ca -0.04 0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.13 3gak h ALA 69 Cb 1.34 0.73 -0.08 0.00 0.00 0.00 0.00 17.79 19.78 3gak h ALA 69 CO 0.15 -0.76 0.59 -0.07 0.00 0.00 0.00 179.25 179.15 3gak h LEU 70 N -0.29 0.59 0.00 0.00 3.38 -1.38 0.53 115.31 118.14 3gak h LEU 70 Ca 0.15 0.05 -0.20 0.00 0.09 0.00 0.00 57.88 57.97 3gak h LEU 70 Cb 0.55 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 3gak h LEU 70 CO -0.52 0.26 -1.57 -0.62 0.09 0.00 0.00 178.44 176.08 3gak n GLU 71 N -4.58 0.63 0.09 1.13 1.02 -1.04 -3.75 120.64 114.14 3gak n GLU 71 Ca 0.19 0.20 -0.06 0.00 -0.02 0.00 0.00 57.16 57.47 3gak n GLU 71 Cb 0.57 -1.77 0.02 0.00 -0.02 0.00 0.00 31.44 30.24 3gak n GLU 71 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3gak h LYS 72 N 0.00 0.10 -2.40 3.49 3.64 -0.55 -3.39 116.57 117.47 3gak h LYS 72 Ca -0.21 -0.11 -0.60 0.00 -1.27 0.00 0.00 60.65 58.46 3gak h LYS 72 Cb 1.69 0.03 -0.41 0.00 -0.41 0.00 0.00 32.23 33.14 3gak h LYS 72 CO 0.05 0.87 -0.74 0.72 -2.27 0.00 0.00 179.45 178.08 3gak n HIS 73 N -3.64 2.16 -0.28 1.91 8.25 0.15 -4.98 115.22 118.79 3gak n HIS 73 Ca -0.02 -3.97 -0.02 0.00 -0.26 0.00 0.00 57.72 53.45 3gak n HIS 73 Cb 0.78 -0.43 0.10 0.00 1.12 0.00 0.00 29.99 31.55 3gak n HIS 73 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3gak h PRO 74 N 4.62 0.91 -0.96 -0.41 0.11 -1.76 -3.01 132.00 131.50 3gak h PRO 74 Ca 0.17 -0.05 -0.18 0.00 0.11 0.00 0.00 66.00 66.05 3gak h PRO 74 Cb 0.76 -0.21 -0.11 0.00 0.11 0.00 0.00 31.00 31.56 3gak h PRO 74 CO 0.67 0.60 0.22 -0.25 -0.21 0.00 0.00 178.00 179.04 3gak n ASP 75 N -4.63 3.28 -4.10 -2.05 10.43 -1.26 -1.42 116.55 116.81 3gak n ASP 75 Ca 0.09 -2.64 -0.29 0.00 2.57 0.00 0.00 54.79 54.53 3gak n ASP 75 Cb 0.10 -0.63 -0.17 0.00 1.84 0.00 0.00 41.12 42.26 3gak n ASP 75 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 3gak s ILE 76 N -1.52 1.59 -0.47 0.53 -1.09 -1.14 -4.70 121.20 114.40 3gak s ILE 76 Ca 0.25 -0.72 -0.28 0.00 -2.23 0.00 0.00 60.65 57.67 3gak s ILE 76 Cb 0.20 -1.42 0.03 0.00 -1.58 0.00 0.00 42.46 39.69 3gak s ILE 76 CO 0.05 0.46 1.08 -2.16 -1.23 0.00 0.00 174.94 173.14 3gak s PRO 77 N 0.72 3.69 -0.11 2.79 0.04 -1.26 -0.74 135.00 140.13 3gak s PRO 77 Ca -0.12 0.48 0.03 0.00 0.04 0.00 0.00 61.00 61.43 3gak s PRO 77 Cb -0.16 -3.90 -0.01 0.00 0.04 0.00 0.00 34.50 30.47 3gak s PRO 77 CO 0.03 -1.32 -0.19 0.42 0.04 0.00 0.00 177.00 175.97 3gak s ILE 78 N 4.23 2.48 -0.10 0.56 1.01 -0.80 -1.77 121.20 126.81 3gak s ILE 78 Ca 0.45 -0.87 0.03 0.00 0.00 0.00 0.00 60.65 60.25 3gak s ILE 78 Cb -0.08 -1.99 0.01 0.00 0.01 0.00 0.00 42.46 40.41 3gak s ILE 78 CO 0.30 0.55 -0.19 0.00 0.00 0.00 0.00 174.94 175.59 3gak s ILE 80 N 0.57 4.67 -0.09 0.00 -1.09 -1.26 -0.93 121.20 123.07 3gak s ILE 80 Ca -0.15 -0.14 0.03 0.00 -2.23 0.00 0.00 60.65 58.17 3gak s ILE 80 Cb -0.17 -3.25 0.00 0.00 -1.58 0.00 0.00 42.46 37.47 3gak s ILE 80 CO 0.05 0.24 -0.20 -2.28 -1.23 0.00 0.00 174.94 171.52 3gak s HIS 81 N 1.66 2.19 0.14 3.97 5.65 -0.50 -0.66 115.29 127.74 3gak s HIS 81 Ca 0.06 -0.88 -0.30 0.00 0.25 0.00 0.00 55.06 54.19 3gak s HIS 81 Cb -0.16 -1.50 -0.07 0.00 -1.18 0.00 0.00 32.58 29.68 3gak s HIS 81 CO 0.06 -0.37 1.10 -1.17 -0.65 0.00 0.00 174.74 173.71 3gak s LEU 82 N 0.44 4.46 0.03 8.88 2.96 0.11 -0.24 118.68 135.32 3gak s LEU 82 Ca -0.17 2.02 -0.01 0.00 -0.22 0.00 0.00 54.13 55.74 3gak s LEU 82 Cb -0.17 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.88 3gak s LEU 82 CO 0.07 -0.26 0.20 -0.62 -1.32 0.00 0.00 176.35 174.42 3gak s ASP 83 N 0.20 6.37 -1.76 3.68 3.68 0.24 -1.41 116.67 127.67 3gak s ASP 83 Ca 0.51 0.31 -0.20 0.00 2.13 0.00 0.00 52.55 55.30 3gak s ASP 83 Cb -0.28 -1.98 0.18 0.00 -1.45 0.00 0.00 42.92 39.39 3gak s ASP 83 CO 0.33 0.21 0.68 1.41 0.13 0.00 0.00 175.17 177.93 3gak n HIS 84 N 0.57 -1.51 -0.69 -5.34 8.25 -1.26 -4.02 115.22 111.23 3gak n HIS 84 Ca -0.08 0.75 -0.29 0.00 -0.26 0.00 0.00 57.72 57.84 3gak n HIS 84 Cb 0.52 -2.56 0.21 0.00 1.12 0.00 0.00 29.99 29.28 3gak n HIS 84 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3gak s GLY 85 N -3.34 1.59 0.05 -1.41 0.00 -0.75 -4.74 107.32 98.73 3gak s GLY 85 Ca 0.74 0.08 0.00 0.00 0.00 0.00 0.00 44.72 45.53 3gak s GLY 85 CO 0.97 0.68 0.00 2.09 0.00 0.00 0.00 173.10 176.84 3gak n ASP 86 N -4.58 -0.17 -4.95 1.64 5.75 -1.26 -0.02 116.55 112.95 3gak n ASP 86 Ca 0.06 0.09 -0.24 0.00 -0.01 0.00 0.00 54.79 54.70 3gak n ASP 86 Cb 0.54 0.28 -0.02 0.00 -1.03 0.00 0.00 41.12 40.89 3gak n ASP 86 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 3gak s THR 87 N -2.00 5.26 0.53 2.12 -4.23 -1.26 -4.83 115.64 111.23 3gak s THR 87 Ca 0.00 -0.78 0.20 0.00 -1.18 0.00 0.00 61.69 59.94 3gak s THR 87 Cb 0.00 -3.81 0.33 0.00 1.34 0.00 0.00 72.50 70.36 3gak s THR 87 CO 0.00 -0.26 2.09 0.25 -0.54 0.00 0.00 174.62 176.16 3gak h LEU 88 N 1.53 0.00 0.00 4.79 7.12 -2.00 -2.92 115.31 123.83 3gak h LEU 88 Ca -0.50 0.00 -0.13 0.00 0.13 0.00 0.00 57.88 57.38 3gak h LEU 88 Cb 1.21 0.00 -0.02 0.00 -0.53 0.00 0.00 40.66 41.32 3gak h LEU 88 CO 0.64 0.00 -0.62 -0.33 -0.13 0.00 0.00 178.44 178.00 3gak h GLU 89 N 0.00 0.00 0.02 1.25 4.39 -1.98 -1.20 114.58 117.06 3gak h GLU 89 Ca 0.10 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 3gak h GLU 89 Cb 0.42 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.07 3gak h GLU 89 CO -0.00 0.61 -0.01 0.66 -1.16 0.00 0.00 179.01 179.11 3gak h SER 90 N 0.00 -0.02 -0.06 1.42 4.64 -1.92 -2.24 113.55 115.37 3gak h SER 90 Ca -0.01 -0.37 0.04 0.00 -0.47 0.00 0.00 61.79 60.98 3gak h SER 90 Cb 1.47 0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 63.52 3gak h SER 90 CO 0.08 0.36 -0.23 -0.37 -0.87 0.00 0.00 176.83 175.80 3gak h VAL 91 N -0.41 0.45 -0.98 0.95 -1.51 -1.55 -1.99 116.25 111.22 3gak h VAL 91 Ca -0.00 0.00 0.27 0.00 -1.23 0.00 0.00 66.70 65.74 3gak h VAL 91 Cb 0.39 0.45 -0.05 0.00 -2.13 0.00 0.00 31.29 29.95 3gak h VAL 91 CO 0.00 0.00 0.69 0.50 -1.23 0.00 0.00 177.57 177.53 3gak h LYS 92 N -0.33 0.12 0.03 5.19 3.64 -1.09 0.31 116.57 124.43 3gak h LYS 92 Ca 0.08 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3gak h LYS 92 Cb 0.44 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 3gak h LYS 92 CO -0.25 0.08 -0.01 1.98 -2.27 0.00 0.00 179.45 178.98 3gak h MET 93 N 0.12 -0.04 -0.59 1.90 4.05 -1.12 -3.28 114.93 115.97 3gak h MET 93 Ca 0.49 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.91 3gak h MET 93 Cb 1.71 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 32.49 3gak h MET 93 CO -0.08 0.20 0.38 0.00 0.23 0.00 0.00 176.91 177.63 3gak h ALA 94 N -0.77 1.55 -1.00 0.39 0.00 -0.54 0.58 119.26 119.46 3gak h ALA 94 Ca -0.00 -0.05 0.21 0.00 0.00 0.00 0.00 54.91 55.06 3gak h ALA 94 Cb 0.25 -0.24 -0.11 0.00 0.00 0.00 0.00 17.79 17.69 3gak h ALA 94 CO 0.01 0.41 0.61 0.82 0.00 0.00 0.00 179.25 181.09 3gak h ILE 95 N 0.81 0.64 -0.29 0.00 2.04 -0.55 -1.66 117.51 118.49 3gak h ILE 95 Ca 0.22 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.84 3gak h ILE 95 Cb -0.06 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 35.90 3gak h ILE 95 CO -0.04 0.13 0.00 0.47 0.00 0.00 0.00 178.15 178.70 3gak n ASP 96 N -4.81 2.09 -1.34 1.72 8.00 0.20 -1.85 116.55 120.56 3gak n ASP 96 Ca 0.25 -1.86 0.05 0.00 0.71 0.00 0.00 54.79 53.94 3gak n ASP 96 Cb 0.65 -0.19 0.26 0.00 -0.02 0.00 0.00 41.12 41.82 3gak n ASP 96 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3gak n LEU 97 N 0.61 3.90 -1.46 0.64 4.77 -0.68 -4.90 117.00 119.88 3gak n LEU 97 Ca 0.16 -1.97 -0.16 0.00 -0.03 0.00 0.00 56.01 54.01 3gak n LEU 97 Cb 0.37 -0.57 -0.04 0.00 -2.33 0.00 0.00 43.42 40.85 3gak n LEU 97 CO 0.12 0.54 -0.17 0.61 -1.33 0.00 0.00 177.39 177.15 3gak n GLY 98 N 0.60 0.80 3.61 -0.72 0.00 -0.77 -4.86 105.19 103.85 3gak n GLY 98 Ca 0.18 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.63 3gak n GLY 98 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3gak n PHE 99 N -3.17 0.37 0.27 1.61 0.99 -0.84 -4.98 117.46 111.72 3gak n PHE 99 Ca -0.17 0.36 0.03 0.00 -0.00 0.00 0.00 57.45 57.68 3gak n PHE 99 Cb 0.57 -1.97 -0.04 0.00 -1.00 0.00 0.00 39.48 37.04 3gak n PHE 99 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 3gak n SER 100 N -3.40 0.86 -3.64 4.37 3.41 0.17 -4.81 113.62 110.57 3gak n SER 100 Ca 0.11 -0.55 -0.15 0.00 -0.26 0.00 0.00 58.87 58.02 3gak n SER 100 Cb 0.52 1.06 -0.08 0.00 -0.26 0.00 0.00 64.21 65.45 3gak n SER 100 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3gak s SER 101 N -1.86 -0.51 -0.07 4.04 0.15 -0.22 -2.53 113.70 112.71 3gak s SER 101 Ca 0.02 0.68 -0.05 0.00 0.70 0.00 0.00 55.95 57.30 3gak s SER 101 Cb 0.05 0.68 0.02 0.00 -1.71 0.00 0.00 66.02 65.07 3gak s SER 101 CO 0.29 -0.43 0.17 0.68 1.20 0.00 0.00 173.24 175.14 3gak s VAL 102 N -0.74 -0.02 -0.14 4.45 -7.23 -0.34 -0.71 120.40 115.68 3gak s VAL 102 Ca -0.08 0.06 -0.12 0.00 -1.81 0.00 0.00 61.98 60.02 3gak s VAL 102 Cb -0.03 -0.25 -0.05 0.00 0.56 0.00 0.00 36.38 36.62 3gak s VAL 102 CO 0.05 0.02 0.27 -0.32 -0.31 0.00 0.00 175.10 174.81 3gak s MET 103 N 0.47 4.09 -0.59 4.82 -2.45 -0.50 -0.98 119.30 124.16 3gak s MET 103 Ca -0.03 0.07 -0.05 0.00 -1.25 0.00 0.00 55.69 54.42 3gak s MET 103 Cb -0.05 -3.36 0.15 0.00 1.25 0.00 0.00 34.83 32.82 3gak s MET 103 CO -0.02 0.38 0.43 -1.50 1.05 0.00 0.00 175.02 175.36 3gak s ILE 104 N 0.04 3.96 -0.72 10.11 1.10 -0.43 -1.81 121.20 133.46 3gak s ILE 104 Ca 0.16 -2.56 -0.22 0.00 -0.51 0.00 0.00 60.65 57.52 3gak s ILE 104 Cb -0.13 -3.58 0.08 0.00 0.15 0.00 0.00 42.46 38.98 3gak s ILE 104 CO 0.04 -0.85 1.00 -0.62 -2.11 0.00 0.00 174.94 172.40 3gak s ASP 105 N 1.38 6.27 -0.30 4.50 2.15 0.98 -4.41 116.67 127.23 3gak s ASP 105 Ca 0.14 -1.23 0.08 0.00 0.43 0.00 0.00 52.55 51.97 3gak s ASP 105 Cb -0.20 -2.41 0.46 0.00 -0.30 0.00 0.00 42.92 40.46 3gak s ASP 105 CO -0.04 -1.36 1.17 0.00 -0.17 0.00 0.00 175.17 174.78 3gak n ALA 106 N 7.44 4.77 -0.69 3.66 0.00 -1.26 -4.58 120.51 129.85 3gak n ALA 106 Ca 0.02 -3.74 0.03 0.00 0.00 0.00 0.00 53.44 49.75 3gak n ALA 106 Cb 0.46 -0.41 0.33 0.00 0.00 0.00 0.00 19.45 19.83 3gak n ALA 106 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3gak n SER 107 N -0.66 4.96 -0.06 0.00 3.41 -1.26 -3.13 113.62 116.88 3gak n SER 107 Ca 0.39 -2.89 -0.02 0.00 -0.26 0.00 0.00 58.87 56.09 3gak n SER 107 Cb 0.92 -0.68 -0.14 0.00 -0.26 0.00 0.00 64.21 64.04 3gak n SER 107 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3gak n HIS 108 N 0.36 0.00 -2.62 7.33 8.25 -1.26 -4.49 115.22 122.79 3gak n HIS 108 Ca 0.28 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.41 3gak n HIS 108 Cb 1.14 -0.71 -0.05 0.00 1.12 0.00 0.00 29.99 31.48 3gak n HIS 108 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3gak s HIS 109 N -2.72 3.40 0.57 4.41 3.76 -1.18 -5.01 115.29 118.52 3gak s HIS 109 Ca -0.08 1.47 -0.21 0.00 -0.15 0.00 0.00 55.06 56.09 3gak s HIS 109 Cb 0.07 -2.77 -0.04 0.00 1.11 0.00 0.00 32.58 30.95 3gak s HIS 109 CO 0.74 -0.23 1.36 -0.35 -0.85 0.00 0.00 174.74 175.40 3gak n PRO 110 N -1.17 1.59 -0.29 8.40 -0.04 -1.26 -4.46 135.00 137.78 3gak n PRO 110 Ca 0.06 0.59 0.29 0.00 -0.04 0.00 0.00 63.50 64.40 3gak n PRO 110 Cb 0.54 -2.58 0.53 0.00 -0.04 0.00 0.00 33.50 31.94 3gak n PRO 110 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3gak n PHE 111 N -1.22 1.04 -0.10 0.54 -0.00 -1.26 0.16 117.46 116.61 3gak n PHE 111 Ca 0.12 1.05 -0.12 0.00 -0.00 0.00 0.00 57.45 58.49 3gak n PHE 111 Cb 0.45 -1.46 -0.00 0.00 -0.00 0.00 0.00 39.48 38.47 3gak n PHE 111 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 3gak h ASP 112 N 0.00 0.94 0.18 -2.13 5.19 -2.00 -2.64 116.42 115.97 3gak h ASP 112 Ca 0.76 -0.43 -0.22 0.00 -0.62 0.00 0.00 57.03 56.52 3gak h ASP 112 Cb 2.02 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 41.27 3gak h ASP 112 CO -0.68 1.21 -0.86 -0.08 -3.12 0.00 0.00 179.24 175.70 3gak h GLU 113 N 0.72 0.52 -0.73 3.56 4.57 -0.61 -2.38 114.58 120.22 3gak h GLU 113 Ca 0.06 -0.49 0.13 0.00 -1.18 0.00 0.00 59.36 57.88 3gak h GLU 113 Cb 0.97 0.12 -0.09 0.00 -0.16 0.00 0.00 28.75 29.60 3gak h GLU 113 CO 0.09 1.12 0.31 -0.97 -1.18 0.00 0.00 179.01 178.38 3gak h ASN 114 N 0.32 0.31 -0.45 1.04 -0.73 -1.38 -0.56 115.58 114.14 3gak h ASN 114 Ca -0.07 0.10 -0.01 0.00 1.87 0.00 0.00 56.30 58.19 3gak h ASN 114 Cb 1.48 0.06 -0.02 0.00 0.27 0.00 0.00 38.32 40.12 3gak h ASN 114 CO 0.16 0.14 0.24 0.58 -0.37 0.00 0.00 177.43 178.17 3gak h VAL 115 N 0.47 1.17 -0.41 2.57 2.07 -1.06 -0.70 116.25 120.36 3gak h VAL 115 Ca 0.39 -0.45 -0.06 0.00 0.82 0.00 0.00 66.70 67.41 3gak h VAL 115 Cb 0.56 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 3gak h VAL 115 CO -0.37 0.18 0.04 -0.09 0.02 0.00 0.00 177.57 177.35 3gak h ARG 116 N 0.59 0.70 -0.50 1.57 2.43 -1.00 -0.47 114.38 117.70 3gak h ARG 116 Ca 0.16 -0.20 -0.12 0.00 -0.81 0.00 0.00 59.98 59.01 3gak h ARG 116 Cb 0.07 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 3gak h ARG 116 CO -0.02 0.76 -0.14 0.82 -1.51 0.00 0.00 179.97 179.88 3gak h ILE 117 N 0.54 1.27 0.14 1.20 2.04 -0.82 -1.89 117.51 119.99 3gak h ILE 117 Ca 0.12 -1.29 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 3gak h ILE 117 Cb 0.42 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 3gak h ILE 117 CO 0.01 0.45 -0.07 0.74 0.00 0.00 0.00 178.15 179.28 3gak h THR 118 N 0.83 1.02 -1.16 -0.27 2.02 -1.10 -2.43 112.91 111.82 3gak h THR 118 Ca 0.12 -0.85 0.34 0.00 0.77 0.00 0.00 66.41 66.78 3gak h THR 118 Cb 0.71 1.53 -0.05 0.00 -1.74 0.00 0.00 68.15 68.60 3gak h THR 118 CO 0.05 0.20 0.83 0.11 0.37 0.00 0.00 175.52 177.08 3gak h LYS 119 N -0.61 0.01 -0.17 6.66 1.57 -1.00 0.40 116.57 123.42 3gak h LYS 119 Ca -0.02 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3gak h LYS 119 Cb 0.47 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.77 3gak h LYS 119 CO 0.03 0.00 0.04 1.49 -0.57 0.00 0.00 179.45 180.45 3gak h GLU 120 N 0.01 0.28 -0.34 3.15 4.81 -0.85 -2.89 114.58 118.74 3gak h GLU 120 Ca 0.55 -0.07 -0.16 0.00 -0.13 0.00 0.00 59.36 59.55 3gak h GLU 120 Cb 2.20 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 31.54 3gak h GLU 120 CO -0.01 0.42 -0.41 0.28 -0.73 0.00 0.00 179.01 178.56 3gak h VAL 121 N 0.09 1.28 -0.70 0.32 2.07 -0.07 -3.13 116.25 116.10 3gak h VAL 121 Ca 0.05 -1.59 -0.06 0.00 0.82 0.00 0.00 66.70 65.93 3gak h VAL 121 Cb 0.27 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 3gak h VAL 121 CO 0.00 0.52 0.19 0.58 0.02 0.00 0.00 177.57 178.89 3gak h VAL 122 N 0.68 1.26 -0.69 2.57 2.07 -1.09 0.64 116.25 121.69 3gak h VAL 122 Ca 0.05 -0.93 0.00 0.00 0.82 0.00 0.00 66.70 66.64 3gak h VAL 122 Cb 1.01 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 3gak h VAL 122 CO 0.10 0.36 0.45 0.00 0.02 0.00 0.00 177.57 178.50 3gak h ALA 123 N 1.09 1.48 0.13 1.67 0.00 -1.57 -2.21 119.26 119.86 3gak h ALA 123 Ca 0.22 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3gak h ALA 123 Cb 0.34 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3gak h ALA 123 CO -0.00 0.47 -0.06 -0.92 0.00 0.00 0.00 179.25 178.73 3gak h TYR 124 N 0.95 -0.17 -0.91 0.00 3.20 -1.18 -3.21 116.97 115.65 3gak h TYR 124 Ca 0.25 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.22 3gak h TYR 124 Cb -0.09 0.06 -0.12 0.00 1.54 0.00 0.00 36.73 38.11 3gak h TYR 124 CO 0.00 -0.10 -0.53 0.00 -1.64 0.00 0.00 178.16 175.89 3gak h ALA 125 N -1.70 -0.40 0.00 1.82 0.00 0.16 -1.89 119.26 117.24 3gak h ALA 125 Ca -0.02 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3gak h ALA 125 Cb 0.14 1.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 3gak h ALA 125 CO 0.03 -0.89 -0.13 0.45 0.00 0.00 0.00 179.25 178.71 3gak h HIS 126 N -0.05 0.00 0.00 0.00 3.86 -1.34 0.11 115.15 117.72 3gak h HIS 126 Ca 0.19 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.34 3gak h HIS 126 Cb 0.48 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.94 3gak h HIS 126 CO -0.94 0.13 -0.30 0.00 0.86 0.00 0.00 177.93 177.67 3gak h ALA 127 N 1.87 1.40 -0.03 2.45 0.00 -1.34 -2.50 119.26 121.11 3gak h ALA 127 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3gak h ALA 127 Cb 0.44 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3gak h ALA 127 CO 0.02 0.38 -0.04 0.54 0.00 0.00 0.00 179.25 180.15 3gak n ARG 128 N -4.03 2.12 0.00 0.00 1.74 0.28 -4.89 116.66 111.89 3gak n ARG 128 Ca -0.02 -1.80 0.00 0.00 -0.77 0.00 0.00 57.85 55.26 3gak n ARG 128 Cb 0.36 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 3gak n ARG 128 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gak n GLY 129 N 1.31 3.18 3.64 -0.13 0.00 -0.90 -4.57 105.19 107.71 3gak n GLY 129 Ca 0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 3gak n GLY 129 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gak n VAL 130 N -1.24 1.37 -2.30 1.61 0.31 -0.68 -4.78 118.33 112.62 3gak n VAL 130 Ca 0.00 -0.34 -0.28 0.00 -0.01 0.00 0.00 64.34 63.71 3gak n VAL 130 Cb 0.00 -1.26 0.02 0.00 -0.91 0.00 0.00 33.84 31.70 3gak n VAL 130 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3gak s SER 131 N -0.08 5.78 -0.07 4.52 0.01 -1.05 -3.15 113.70 119.66 3gak s SER 131 Ca 0.65 0.91 -0.03 0.00 1.31 0.00 0.00 55.95 58.79 3gak s SER 131 Cb -0.69 -1.95 0.04 0.00 0.21 0.00 0.00 66.02 63.64 3gak s SER 131 CO 0.55 -0.99 0.14 -0.69 0.41 0.00 0.00 173.24 172.67 3gak s VAL 132 N -3.02 -0.17 -0.07 3.43 1.01 -1.26 -1.19 120.40 119.12 3gak s VAL 132 Ca 0.53 0.29 0.02 0.00 0.00 0.00 0.00 61.98 62.82 3gak s VAL 132 Cb -0.11 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 3gak s VAL 132 CO 0.47 0.12 -0.11 -0.70 0.00 0.00 0.00 175.10 174.88 3gak s GLU 133 N 1.83 2.78 0.21 2.72 2.12 -0.15 -1.40 118.70 126.81 3gak s GLU 133 Ca -0.02 -0.64 0.01 0.00 0.36 0.00 0.00 54.97 54.68 3gak s GLU 133 Cb -0.12 -2.51 -0.00 0.00 0.26 0.00 0.00 34.13 31.75 3gak s GLU 133 CO -0.06 0.56 0.03 0.00 -0.54 0.00 0.00 175.26 175.25 3gak n ALA 134 N 2.52 0.22 -3.15 6.30 0.00 -0.94 -1.31 120.51 124.16 3gak n ALA 134 Ca -0.18 -0.98 -0.13 0.00 0.00 0.00 0.00 53.44 52.16 3gak n ALA 134 Cb 0.53 0.59 -0.11 0.00 0.00 0.00 0.00 19.45 20.45 3gak n ALA 134 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3gak s GLU 135 N -2.77 0.36 -0.24 0.00 2.12 -1.26 -1.87 118.70 115.05 3gak s GLU 135 Ca 0.04 0.20 0.00 0.00 0.36 0.00 0.00 54.97 55.57 3gak s GLU 135 Cb 0.00 0.17 0.06 0.00 0.26 0.00 0.00 34.13 34.62 3gak s GLU 135 CO 0.03 -0.06 -0.03 -1.17 -0.54 0.00 0.00 175.26 173.48 3gak s LEU 136 N -0.22 2.48 0.00 2.70 2.96 -1.19 -4.35 118.68 121.06 3gak s LEU 136 Ca -0.03 -1.20 0.00 0.00 -0.22 0.00 0.00 54.13 52.68 3gak s LEU 136 Cb -0.03 -1.12 0.00 0.00 0.50 0.00 0.00 46.19 45.54 3gak s LEU 136 CO 0.01 -0.26 0.00 0.61 -1.32 0.00 0.00 176.35 175.39 3gak n GLY 137 N 4.70 0.24 0.00 7.98 0.00 -1.26 -3.35 105.19 113.50 3gak n GLY 137 Ca -0.11 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 43.99 3gak n GLY 137 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3gak n THR 153 N 0.77 0.00 -3.97 2.61 -2.24 0.11 -4.63 114.28 106.93 3gak n THR 153 Ca 0.00 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 3gak n THR 153 Cb 0.00 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.08 3gak n THR 153 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3gak s GLU 154 N -1.02 3.15 0.21 -0.78 2.56 -1.26 -4.98 118.70 116.57 3gak s GLU 154 Ca 0.00 -0.76 -0.04 0.00 0.00 0.00 0.00 54.97 54.17 3gak s GLU 154 Cb 0.00 -2.90 0.40 0.00 2.00 0.00 0.00 34.13 33.63 3gak s GLU 154 CO 0.00 -0.25 1.13 -2.30 -0.56 0.00 0.00 175.26 173.28 3gak n PRO 155 N 4.72 -0.06 0.06 4.30 -0.02 -1.26 -2.63 135.00 140.12 3gak n PRO 155 Ca -0.18 1.12 -0.13 0.00 -2.02 0.00 0.00 63.50 62.29 3gak n PRO 155 Cb 0.50 -1.70 -0.06 0.00 -0.02 0.00 0.00 33.50 32.22 3gak n PRO 155 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3gak h GLN 156 N 0.00 -0.50 -1.01 -0.52 1.08 -1.98 -1.89 115.11 110.29 3gak h GLN 156 Ca 0.38 0.03 0.24 0.00 -1.45 0.00 0.00 58.65 57.85 3gak h GLN 156 Cb 0.65 0.11 -0.11 0.00 -0.05 0.00 0.00 27.48 28.08 3gak h GLN 156 CO -0.73 -0.34 0.62 -0.44 -0.95 0.00 0.00 178.83 176.99 3gak h ASP 157 N -0.52 0.64 -0.47 1.46 3.32 -1.95 -0.83 116.42 118.07 3gak h ASP 157 Ca 0.05 0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.18 3gak h ASP 157 Cb 0.60 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 3gak h ASP 157 CO -0.28 0.13 0.16 0.00 -1.72 0.00 0.00 179.24 177.53 3gak h ALA 158 N 1.69 1.31 0.76 3.45 0.00 -1.37 -1.49 119.26 123.60 3gak h ALA 158 Ca 0.62 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.32 3gak h ALA 158 Cb 1.23 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.81 3gak h ALA 158 CO -0.42 0.50 -0.37 -0.22 0.00 0.00 0.00 179.25 178.75 3gak h LYS 159 N 0.76 -0.99 -0.38 0.00 3.64 -0.59 -3.11 116.57 115.90 3gak h LYS 159 Ca 0.18 0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.58 3gak h LYS 159 Cb 0.22 0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 3gak h LYS 159 CO -0.01 -0.66 0.07 0.87 -2.27 0.00 0.00 179.45 177.45 3gak h LYS 160 N -1.20 0.58 -0.24 1.90 6.56 -1.33 -0.99 116.57 121.86 3gak h LYS 160 Ca -0.10 -0.11 -0.01 0.00 -1.06 0.00 0.00 60.65 59.37 3gak h LYS 160 Cb 0.78 -0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 32.34 3gak h LYS 160 CO 0.17 0.55 0.10 0.35 -2.06 0.00 0.00 179.45 178.56 3gak h PHE 161 N 0.56 0.35 -0.44 -1.35 3.57 -1.36 0.84 116.94 119.12 3gak h PHE 161 Ca 0.13 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.57 3gak h PHE 161 Cb 0.26 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 3gak h PHE 161 CO 0.01 0.37 0.15 0.28 -2.23 0.00 0.00 178.31 176.89 3gak h VAL 162 N 0.23 1.22 -0.62 1.41 2.07 -1.35 0.37 116.25 119.58 3gak h VAL 162 Ca 0.08 -0.70 0.11 0.00 0.82 0.00 0.00 66.70 67.00 3gak h VAL 162 Cb 0.16 0.85 -0.08 0.00 -1.52 0.00 0.00 31.29 30.70 3gak h VAL 162 CO -0.01 0.25 0.20 -0.33 0.02 0.00 0.00 177.57 177.70 3gak h GLU 163 N 0.57 0.34 0.00 1.57 4.39 -0.54 0.26 114.58 121.17 3gak h GLU 163 Ca 0.14 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.82 3gak h GLU 163 Cb 0.25 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 3gak h GLU 163 CO -0.01 0.23 -0.61 -0.07 -1.16 0.00 0.00 179.01 177.39 3gak h LEU 164 N 0.35 0.00 0.00 1.33 3.38 0.14 -3.39 115.31 117.11 3gak h LEU 164 Ca 0.32 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 58.02 3gak h LEU 164 Cb 0.45 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 3gak h LEU 164 CO -0.36 0.00 -1.95 0.35 0.09 0.00 0.00 178.44 176.57 3gak n THR 165 N -2.85 0.94 -2.55 0.22 -2.24 0.12 -4.90 114.28 103.03 3gak n THR 165 Ca 0.02 -0.29 -0.01 0.00 -2.27 0.00 0.00 64.05 61.49 3gak n THR 165 Cb 0.54 -1.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 3gak n THR 165 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gak n GLY 166 N 2.25 0.85 3.87 3.38 0.00 0.88 -4.77 105.19 111.65 3gak n GLY 166 Ca -0.32 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 44.76 3gak n GLY 166 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gak s VAL 167 N -2.99 4.28 -0.70 1.61 -7.23 -1.26 -5.00 120.40 109.12 3gak s VAL 167 Ca 0.03 0.74 0.24 0.00 -1.81 0.00 0.00 61.98 61.19 3gak s VAL 167 Cb -0.01 -3.73 0.05 0.00 0.56 0.00 0.00 36.38 33.25 3gak s VAL 167 CO 0.04 -0.97 1.35 0.47 -0.31 0.00 0.00 175.10 175.68 3gak n ASP 168 N -2.85 0.65 -3.57 4.85 9.92 -0.49 -4.92 116.55 120.14 3gak n ASP 168 Ca 0.06 0.08 -0.17 0.00 -0.53 0.00 0.00 54.79 54.23 3gak n ASP 168 Cb 0.55 0.16 -0.07 0.00 -0.64 0.00 0.00 41.12 41.12 3gak n ASP 168 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3gak s ALA 169 N -3.14 -1.54 -0.11 2.24 0.00 -1.05 -4.39 121.76 113.77 3gak s ALA 169 Ca 0.07 1.08 -0.02 0.00 0.00 0.00 0.00 51.96 53.09 3gak s ALA 169 Cb 0.14 0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.33 3gak s ALA 169 CO 0.71 -0.35 0.03 -1.17 0.00 0.00 0.00 175.76 174.98 3gak s LEU 170 N -1.25 0.61 0.67 0.00 2.96 -0.64 -2.21 118.68 118.82 3gak s LEU 170 Ca -0.11 -0.30 -0.14 0.00 -0.22 0.00 0.00 54.13 53.35 3gak s LEU 170 Cb -0.01 -0.40 0.00 0.00 0.50 0.00 0.00 46.19 46.29 3gak s LEU 170 CO 0.08 -0.25 1.10 0.00 -1.32 0.00 0.00 176.35 175.96 3gak s ALA 171 N 2.00 2.48 0.06 5.97 0.00 -0.78 -2.22 121.76 129.28 3gak s ALA 171 Ca 0.03 0.48 -0.03 0.00 0.00 0.00 0.00 51.96 52.44 3gak s ALA 171 Cb -0.14 -3.30 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 3gak s ALA 171 CO -0.06 -1.28 0.04 0.14 0.00 0.00 0.00 175.76 174.60 3gak s VAL 172 N -2.44 0.19 -0.18 0.00 -7.23 -0.94 -3.18 120.40 106.63 3gak s VAL 172 Ca 0.66 -1.58 -0.24 0.00 -1.81 0.00 0.00 61.98 59.00 3gak s VAL 172 Cb -0.19 -1.42 -0.02 0.00 0.56 0.00 0.00 36.38 35.31 3gak s VAL 172 CO 0.43 -0.87 0.78 0.00 -0.31 0.00 0.00 175.10 175.12 3gak s ALA 173 N -3.80 3.52 0.00 1.32 0.00 -1.21 -4.71 121.76 116.88 3gak s ALA 173 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 51.97 3gak s ALA 173 Cb 0.06 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 20.03 3gak s ALA 173 CO -0.10 -0.62 0.00 0.44 0.00 0.00 0.00 175.76 175.48 3gak n ILE 174 N 4.72 0.00 -3.31 0.00 -5.35 -1.26 0.08 119.36 114.24 3gak n ILE 174 Ca 0.03 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.18 3gak n ILE 174 Cb 0.49 0.00 -0.06 0.00 -1.74 0.00 0.00 39.64 38.33 3gak n ILE 174 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 3gak s LEU 191 N 0.00 4.20 -0.19 7.28 2.96 -1.26 -4.96 118.68 126.72 3gak s LEU 191 Ca 0.00 1.08 -0.05 0.00 -0.22 0.00 0.00 54.13 54.95 3gak s LEU 191 Cb 0.00 -3.66 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 3gak s LEU 191 CO 0.00 -0.05 -0.01 0.00 -1.32 0.00 0.00 176.35 174.97 3gak s ALA 192 N -1.74 3.04 -0.03 5.97 0.00 -1.26 -5.04 121.76 122.70 3gak s ALA 192 Ca 0.46 -0.93 0.13 0.00 0.00 0.00 0.00 51.96 51.62 3gak s ALA 192 Cb -0.12 -1.71 0.23 0.00 0.00 0.00 0.00 23.12 21.51 3gak s ALA 192 CO 0.20 -0.03 1.10 -0.89 0.00 0.00 0.00 175.76 176.14 3gak n ILE 193 N 4.00 0.41 -0.03 0.00 -0.00 -1.26 -4.77 119.36 117.71 3gak n ILE 193 Ca -0.17 -0.91 -0.03 0.00 -0.00 0.00 0.00 62.75 61.64 3gak n ILE 193 Cb 0.52 0.53 -0.05 0.00 -0.00 0.00 0.00 39.64 40.65 3gak n ILE 193 CO 0.00 0.00 0.00 -0.90 -0.00 0.00 0.00 176.55 175.65 3gak n ASP 194 N -0.08 3.59 -0.31 4.38 3.85 -1.26 -4.52 116.55 122.20 3gak n ASP 194 Ca 0.06 0.00 -0.01 0.00 -0.71 0.00 0.00 54.79 54.13 3gak n ASP 194 Cb 0.86 0.67 0.12 0.00 -1.35 0.00 0.00 41.12 41.42 3gak n ASP 194 CO 0.00 0.00 0.00 0.03 -1.01 0.00 0.00 177.20 176.22 3gak h ARG 195 N 0.00 0.97 -0.97 0.11 3.08 -1.96 -3.12 114.38 112.49 3gak h ARG 195 Ca -0.15 -0.06 0.16 0.00 0.07 0.00 0.00 59.98 60.00 3gak h ARG 195 Cb 1.31 -0.22 -0.10 0.00 0.08 0.00 0.00 29.97 31.04 3gak h ARG 195 CO 0.01 0.64 0.58 0.28 -1.07 0.00 0.00 179.97 180.41 3gak h VAL 196 N 1.00 0.77 0.12 2.04 2.07 -1.86 0.47 116.25 120.87 3gak h VAL 196 Ca 0.35 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.59 3gak h VAL 196 Cb 0.09 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.77 3gak h VAL 196 CO -0.14 0.15 -0.06 0.50 0.02 0.00 0.00 177.57 178.03 3gak h LYS 197 N 0.80 -0.15 -0.10 1.57 1.63 -1.64 -0.77 116.57 117.92 3gak h LYS 197 Ca 0.53 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.35 3gak h LYS 197 Cb 0.73 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.37 3gak h LYS 197 CO -0.34 0.31 -0.18 1.79 -3.45 0.00 0.00 179.45 177.58 3gak h THR 198 N -0.71 0.00 -0.82 1.00 1.35 -1.35 0.13 112.91 112.51 3gak h THR 198 Ca -0.02 0.00 0.19 0.00 -0.55 0.00 0.00 66.41 66.03 3gak h THR 198 Cb 0.53 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 66.83 3gak h THR 198 CO 0.03 0.00 0.28 0.40 -0.25 0.00 0.00 175.52 175.98 3gak h ILE 199 N -0.15 0.49 -0.40 6.82 2.04 -0.20 0.15 117.51 126.26 3gak h ILE 199 Ca 0.02 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.82 3gak h ILE 199 Cb 0.20 0.12 -0.05 0.00 -0.74 0.00 0.00 36.82 36.35 3gak h ILE 199 CO -0.17 0.06 0.12 -1.28 0.00 0.00 0.00 178.15 176.88 3gak h SER 200 N 0.34 0.10 0.29 1.72 0.87 -0.66 -2.61 113.55 113.60 3gak h SER 200 Ca 0.49 0.05 -0.30 0.00 -1.23 0.00 0.00 61.79 60.81 3gak h SER 200 Cb 0.89 0.05 0.02 0.00 -0.44 0.00 0.00 62.40 62.92 3gak h SER 200 CO -0.53 0.09 -1.27 0.44 -0.53 0.00 0.00 176.83 175.03 3gak h ASP 201 N 0.27 0.74 -0.50 6.23 3.32 0.19 0.76 116.42 127.42 3gak h ASP 201 Ca 0.19 -0.72 -0.13 0.00 0.02 0.00 0.00 57.03 56.39 3gak h ASP 201 Cb 0.19 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 3gak h ASP 201 CO -0.21 1.54 -0.18 -0.07 -1.72 0.00 0.00 179.24 178.60 3gak h LEU 202 N 0.20 1.03 0.00 1.55 -0.00 -1.08 -3.23 115.31 113.79 3gak h LEU 202 Ca -0.18 -0.38 -0.21 0.00 -0.00 0.00 0.00 57.88 57.11 3gak h LEU 202 Cb 1.96 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 42.30 3gak h LEU 202 CO 0.23 1.18 -1.18 0.71 -0.00 0.00 0.00 178.44 179.38 3gak h THR 203 N 0.88 1.16 -2.72 0.22 1.35 -1.50 -3.46 112.91 108.85 3gak h THR 203 Ca 0.12 -2.83 -0.39 0.00 -0.55 0.00 0.00 66.41 62.77 3gak h THR 203 Cb 0.76 2.55 -0.02 0.00 -1.73 0.00 0.00 68.15 69.70 3gak h THR 203 CO 0.06 0.66 -0.49 0.61 -0.25 0.00 0.00 175.52 176.11 3gak n GLY 204 N 1.39 -0.37 3.34 5.82 0.00 0.26 -4.99 105.19 110.65 3gak n GLY 204 Ca -0.06 -0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 3gak n GLY 204 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3gak s ILE 205 N -2.96 0.47 -0.03 -0.61 -4.36 -1.22 -5.05 121.20 107.45 3gak s ILE 205 Ca 0.00 -2.00 -0.30 0.00 -0.26 0.00 0.00 60.65 58.09 3gak s ILE 205 Cb 0.00 -2.56 -0.07 0.00 1.25 0.00 0.00 42.46 41.08 3gak s ILE 205 CO 0.00 0.00 1.81 -2.84 0.24 0.00 0.00 174.94 174.15 3gak s PRO 206 N -3.91 4.10 0.72 0.37 0.02 -1.26 -4.84 135.00 130.20 3gak s PRO 206 Ca 0.36 2.34 -0.06 0.00 0.02 0.00 0.00 61.00 63.65 3gak s PRO 206 Cb 0.06 -4.08 0.08 0.00 0.02 0.00 0.00 34.50 30.58 3gak s PRO 206 CO 0.16 -0.96 1.03 -0.51 -0.33 0.00 0.00 177.00 176.38 3gak s LEU 207 N 4.44 2.85 -0.10 -5.54 1.43 -1.01 -1.62 118.68 119.13 3gak s LEU 207 Ca 0.81 0.34 -0.05 0.00 -1.03 0.00 0.00 54.13 54.20 3gak s LEU 207 Cb -0.37 -2.92 0.05 0.00 0.03 0.00 0.00 46.19 42.97 3gak s LEU 207 CO 0.35 -1.69 0.23 -0.69 0.23 0.00 0.00 176.35 174.78 3gak s VAL 208 N -3.27 -0.08 -0.33 -1.59 1.01 -0.94 -2.47 120.40 112.73 3gak s VAL 208 Ca 0.62 0.17 -0.15 0.00 0.00 0.00 0.00 61.98 62.61 3gak s VAL 208 Cb -0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 36.38 35.91 3gak s VAL 208 CO 0.45 0.07 0.38 -0.04 0.00 0.00 0.00 175.10 175.96 3gak s MET 209 N 1.37 3.62 0.37 2.72 -1.94 -0.87 -2.20 119.30 122.37 3gak s MET 209 Ca -0.08 -0.33 0.04 0.00 -1.71 0.00 0.00 55.69 53.60 3gak s MET 209 Cb -0.11 -3.79 -0.01 0.00 2.01 0.00 0.00 34.83 32.93 3gak s MET 209 CO -0.08 -0.51 0.54 -1.01 -0.01 0.00 0.00 175.02 173.94 3gak s HIS 210 N 2.07 3.21 -1.26 -0.03 3.76 -1.26 -1.56 115.29 120.23 3gak s HIS 210 Ca 0.13 0.00 -0.14 0.00 -0.15 0.00 0.00 55.06 54.90 3gak s HIS 210 Cb -0.16 -2.06 0.00 0.00 1.11 0.00 0.00 32.58 31.47 3gak s HIS 210 CO 0.12 -0.08 0.62 0.41 -0.85 0.00 0.00 174.74 174.96 3gak n GLY 211 N -1.79 -0.66 2.00 -2.22 0.00 -1.25 -4.88 105.19 96.39 3gak n GLY 211 Ca -0.01 0.32 -0.23 0.00 0.00 0.00 0.00 46.02 46.10 3gak n GLY 211 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3gak n SER 212 N -2.73 4.68 -4.81 1.61 2.88 -1.12 -5.00 113.62 109.11 3gak n SER 212 Ca -0.18 -3.72 -0.38 0.00 -1.33 0.00 0.00 58.87 53.26 3gak n SER 212 Cb 0.63 -0.79 -0.06 0.00 -0.75 0.00 0.00 64.21 63.23 3gak n SER 212 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3gak s SER 213 N -1.93 7.05 -0.09 -3.46 0.01 -1.26 -4.88 113.70 109.14 3gak s SER 213 Ca 0.56 1.25 0.11 0.00 1.31 0.00 0.00 55.95 59.18 3gak s SER 213 Cb 0.47 -2.35 -0.24 0.00 0.21 0.00 0.00 66.02 64.11 3gak s SER 213 CO 0.04 0.27 0.47 -1.20 0.41 0.00 0.00 173.24 173.24 3gak n SER 214 N 1.70 0.90 -3.47 2.44 7.64 -1.25 -1.17 113.62 120.40 3gak n SER 214 Ca -0.10 0.28 -0.23 0.00 1.01 0.00 0.00 58.87 59.83 3gak n SER 214 Cb 0.51 0.04 0.05 0.00 -1.01 0.00 0.00 64.21 63.80 3gak n SER 214 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3gak n VAL 215 N -3.05 -7.41 -1.72 0.44 0.31 -1.26 -3.73 118.33 101.91 3gak n VAL 215 Ca -0.23 -1.04 -0.41 0.00 -0.01 0.00 0.00 64.34 62.65 3gak n VAL 215 Cb 1.07 -5.35 0.01 0.00 -0.91 0.00 0.00 33.84 28.66 3gak n VAL 215 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3gak n PRO 216 N -3.59 2.11 -0.51 5.55 -0.02 -1.26 -4.78 135.00 132.49 3gak n PRO 216 Ca -0.08 0.75 0.42 0.00 -2.02 0.00 0.00 63.50 62.57 3gak n PRO 216 Cb 0.60 -2.45 0.70 0.00 -0.02 0.00 0.00 33.50 32.32 3gak n PRO 216 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3gak n LYS 217 N 0.13 -0.03 0.06 -0.52 4.81 -1.26 -2.12 118.16 119.22 3gak n LYS 217 Ca 0.05 1.21 -0.20 0.00 -0.87 0.00 0.00 58.31 58.51 3gak n LYS 217 Cb 0.39 -2.46 -0.14 0.00 0.02 0.00 0.00 35.03 32.84 3gak n LYS 217 CO 0.00 0.00 0.00 0.38 1.17 0.00 0.00 177.40 178.95 3gak h ASP 218 N 0.00 0.48 0.18 3.14 -0.00 -1.98 -1.98 116.42 116.26 3gak h ASP 218 Ca 0.88 -0.75 -0.16 0.00 -0.00 0.00 0.00 57.03 57.00 3gak h ASP 218 Cb 2.99 -0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 42.16 3gak h ASP 218 CO -0.38 1.64 -0.62 0.58 -0.00 0.00 0.00 179.24 180.46 3gak h VAL 219 N 0.08 1.35 -0.03 4.15 2.07 -1.78 0.21 116.25 122.31 3gak h VAL 219 Ca -0.32 -1.94 -0.00 0.00 0.82 0.00 0.00 66.70 65.26 3gak h VAL 219 Cb 2.06 1.93 -0.00 0.00 -1.52 0.00 0.00 31.29 33.76 3gak h VAL 219 CO 0.16 0.59 0.00 0.50 0.02 0.00 0.00 177.57 178.84 3gak h LYS 220 N 0.32 0.05 -0.30 1.57 3.64 -1.61 -2.68 116.57 117.55 3gak h LYS 220 Ca -0.01 -0.01 -0.11 0.00 -1.27 0.00 0.00 60.65 59.25 3gak h LYS 220 Cb 1.16 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 3gak h LYS 220 CO 0.11 0.29 -0.26 -0.44 -2.27 0.00 0.00 179.45 176.88 3gak h ASP 221 N -0.20 0.61 -0.96 4.20 3.32 -1.34 0.19 116.42 122.25 3gak h ASP 221 Ca 0.01 -0.22 0.06 0.00 0.02 0.00 0.00 57.03 56.90 3gak h ASP 221 Cb 0.27 -0.17 -0.06 0.00 0.22 0.00 0.00 39.33 39.58 3gak h ASP 221 CO 0.00 0.86 0.61 -0.03 -1.72 0.00 0.00 179.24 178.96 3gak h MET 222 N 0.53 1.09 0.00 3.56 4.05 -1.00 -1.60 114.93 121.55 3gak h MET 222 Ca 0.07 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 3gak h MET 222 Cb 0.73 -0.25 0.00 0.00 -0.80 0.00 0.00 31.60 31.28 3gak h MET 222 CO 0.06 0.72 0.00 -0.89 0.23 0.00 0.00 176.91 177.03 3gak n ILE 223 N -4.53 0.00 -0.30 1.77 5.41 -0.72 -3.11 119.36 117.88 3gak n ILE 223 Ca 0.14 0.75 0.19 0.00 1.00 0.00 0.00 62.75 64.83 3gak n ILE 223 Cb 0.17 -1.52 0.36 0.00 -0.71 0.00 0.00 39.64 37.94 3gak n ILE 223 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 3gak n ASN 224 N -1.36 0.05 0.33 4.38 3.02 0.58 -0.78 115.26 121.48 3gak n ASN 224 Ca 0.00 1.51 -0.19 0.00 -0.03 0.00 0.00 54.58 55.87 3gak n ASN 224 Cb 0.00 -0.62 -0.10 0.00 -0.61 0.00 0.00 39.78 38.45 3gak n ASN 224 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3gak h LYS 225 N 0.00 -1.02 -0.71 3.52 3.64 -1.43 -3.09 116.57 117.48 3gak h LYS 225 Ca 0.62 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 60.07 3gak h LYS 225 Cb 1.45 0.23 0.00 0.00 -0.41 0.00 0.00 32.23 33.50 3gak h LYS 225 CO -0.79 -0.68 0.00 0.66 -2.27 0.00 0.00 179.45 176.37 3gak n TYR 226 N -5.55 0.00 0.00 1.91 4.01 0.04 -4.74 117.16 112.83 3gak n TYR 226 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 3gak n TYR 226 Cb 0.47 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 3gak n TYR 226 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3gak n GLY 227 N 0.12 1.91 3.42 2.72 0.00 -1.17 -4.82 105.19 107.38 3gak n GLY 227 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3gak n GLY 227 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gak s GLY 228 N -2.02 1.48 -0.44 -0.02 0.00 -1.13 -4.98 107.32 100.22 3gak s GLY 228 Ca 0.00 -0.64 0.04 0.00 0.00 0.00 0.00 44.72 44.13 3gak s GLY 228 CO 0.00 0.25 1.05 1.17 0.00 0.00 0.00 173.10 175.58 3gak n LYS 229 N -5.22 0.67 -3.84 2.90 4.81 -1.26 -4.41 118.16 111.80 3gak n LYS 229 Ca 0.09 -1.51 -0.30 0.00 -0.87 0.00 0.00 58.31 55.73 3gak n LYS 229 Cb 0.58 -1.03 -0.16 0.00 0.02 0.00 0.00 35.03 34.45 3gak n LYS 229 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3gak s MET 230 N 0.43 1.12 -0.03 1.64 0.23 -1.26 -5.08 119.30 116.36 3gak s MET 230 Ca 0.27 -1.00 0.04 0.00 -1.03 0.00 0.00 55.69 53.98 3gak s MET 230 Cb 0.25 -2.37 -0.25 0.00 -1.53 0.00 0.00 34.83 30.93 3gak s MET 230 CO -0.17 -0.77 0.73 -1.00 -2.03 0.00 0.00 175.02 171.78 3gak h PRO 231 N 8.02 0.12 0.00 3.16 0.14 -1.96 -3.45 132.00 138.03 3gak h PRO 231 Ca -0.15 -0.20 0.00 0.00 0.14 0.00 0.00 66.00 65.79 3gak h PRO 231 Cb 1.06 0.08 0.00 0.00 0.14 0.00 0.00 31.00 32.27 3gak h PRO 231 CO 0.43 0.85 0.00 -0.25 0.14 0.00 0.00 178.00 179.17 3gak n ASP 232 N -3.27 0.00 -1.38 1.44 9.92 -1.26 -4.99 116.55 117.00 3gak n ASP 232 Ca -0.18 0.00 -0.12 0.00 -0.53 0.00 0.00 54.79 53.97 3gak n ASP 232 Cb 1.04 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 41.52 3gak n ASP 232 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3gak n ALA 233 N -3.00 -0.37 -3.23 2.24 0.00 -1.26 -4.77 120.51 110.13 3gak n ALA 233 Ca 0.00 0.10 -0.16 0.00 0.00 0.00 0.00 53.44 53.38 3gak n ALA 233 Cb 0.00 -1.58 0.01 0.00 0.00 0.00 0.00 19.45 17.88 3gak n ALA 233 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3gak n VAL 234 N -4.00 -7.85 -2.02 0.00 0.24 -1.26 -4.88 118.33 98.56 3gak n VAL 234 Ca -0.13 0.24 -0.28 0.00 -2.04 0.00 0.00 64.34 62.13 3gak n VAL 234 Cb 0.60 -5.57 0.07 0.00 -1.47 0.00 0.00 33.84 27.46 3gak n VAL 234 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3gak s GLY 235 N -2.53 1.62 -0.21 7.63 0.00 -1.26 -4.99 107.32 107.58 3gak s GLY 235 Ca 0.17 -0.64 0.00 0.00 0.00 0.00 0.00 44.72 44.25 3gak s GLY 235 CO 0.81 -0.22 -0.06 0.14 0.00 0.00 0.00 173.10 173.77 3gak s VAL 236 N -3.38 1.45 0.22 1.40 1.01 -0.32 -4.97 120.40 115.81 3gak s VAL 236 Ca 0.60 -1.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.25 3gak s VAL 236 Cb -0.11 -1.65 -0.09 0.00 0.00 0.00 0.00 36.38 34.53 3gak s VAL 236 CO 0.48 0.01 1.35 -2.84 0.00 0.00 0.00 175.10 174.11 3gak s PRO 237 N 1.46 4.35 0.46 2.72 0.02 -1.26 -3.88 135.00 138.87 3gak s PRO 237 Ca -0.03 2.15 0.15 0.00 0.02 0.00 0.00 61.00 63.28 3gak s PRO 237 Cb -0.17 -3.16 1.10 0.00 0.02 0.00 0.00 34.50 32.29 3gak s PRO 237 CO -0.07 -0.30 2.03 0.97 -0.33 0.00 0.00 177.00 179.30 3gak h ILE 238 N 3.64 0.93 -0.71 2.83 6.09 -1.96 -1.75 117.51 126.59 3gak h ILE 238 Ca -0.45 -0.10 0.08 0.00 -1.37 0.00 0.00 64.86 63.02 3gak h ILE 238 Cb 1.22 0.62 -0.06 0.00 0.47 0.00 0.00 36.82 39.06 3gak h ILE 238 CO 0.77 0.05 0.37 -0.33 -3.07 0.00 0.00 178.15 175.95 3gak h GLU 239 N 0.29 0.64 -0.37 2.19 4.39 -2.00 0.10 114.58 119.83 3gak h GLU 239 Ca 0.19 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.82 3gak h GLU 239 Cb 0.39 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.87 3gak h GLU 239 CO -0.04 0.42 0.07 0.77 -1.16 0.00 0.00 179.01 179.07 3gak h SER 240 N 0.66 0.50 -0.00 1.42 0.02 -1.69 -2.32 113.55 112.13 3gak h SER 240 Ca 0.33 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.21 3gak h SER 240 Cb 0.29 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.70 3gak h SER 240 CO -0.23 0.52 -0.02 0.40 -1.14 0.00 0.00 176.83 176.36 3gak h ILE 241 N 0.53 1.63 -0.73 3.27 2.04 -1.24 -1.27 117.51 121.74 3gak h ILE 241 Ca 0.12 -1.87 0.16 0.00 1.00 0.00 0.00 64.86 64.28 3gak h ILE 241 Cb 0.24 2.89 -0.13 0.00 -0.74 0.00 0.00 36.82 39.08 3gak h ILE 241 CO -0.00 0.49 -0.00 0.58 0.00 0.00 0.00 178.15 179.21 3gak h VAL 242 N -0.77 0.37 -0.46 1.67 2.07 -0.95 0.64 116.25 118.82 3gak h VAL 242 Ca -0.00 -0.04 -0.08 0.00 0.82 0.00 0.00 66.70 67.40 3gak h VAL 242 Cb 0.81 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 3gak h VAL 242 CO 0.00 0.02 -0.03 -0.74 0.02 0.00 0.00 177.57 176.84 3gak h HIS 243 N 0.10 0.84 -0.76 1.57 -0.00 -1.37 -1.95 115.15 113.59 3gak h HIS 243 Ca 0.39 -0.13 -0.04 0.00 -0.00 0.00 0.00 60.37 60.59 3gak h HIS 243 Cb 0.68 -0.23 -0.03 0.00 -0.00 0.00 0.00 27.41 27.82 3gak h HIS 243 CO -0.42 0.79 0.31 0.00 -0.00 0.00 0.00 177.93 178.61 3gak h ALA 244 N 1.24 1.11 -0.55 5.26 0.00 0.15 -3.22 119.26 123.24 3gak h ALA 244 Ca 0.14 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3gak h ALA 244 Cb 0.49 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3gak h ALA 244 CO 0.02 0.64 0.29 0.82 0.00 0.00 0.00 179.25 181.03 3gak h ILE 245 N 1.10 1.19 -0.12 0.00 2.04 -0.15 0.86 117.51 122.44 3gak h ILE 245 Ca 0.25 -0.50 0.03 0.00 1.00 0.00 0.00 64.86 65.65 3gak h ILE 245 Cb 0.20 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 36.78 3gak h ILE 245 CO -0.02 0.21 0.13 1.23 0.00 0.00 0.00 178.15 179.70 3gak h GLY 246 N 0.75 0.00 1.00 5.37 0.00 -1.55 -0.08 103.07 108.56 3gak h GLY 246 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 3gak h GLY 246 CO -0.03 0.00 -0.26 1.18 0.00 0.00 0.00 176.54 177.43 3gak n GLU 247 N -3.82 0.34 0.00 4.80 -0.58 0.25 -4.93 120.64 116.71 3gak n GLU 247 Ca -0.00 -0.16 0.00 0.00 -0.42 0.00 0.00 57.16 56.58 3gak n GLU 247 Cb 0.24 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.61 3gak n GLU 247 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3gak n GLY 248 N 1.41 1.64 3.62 0.62 0.00 -0.05 -3.79 105.19 108.65 3gak n GLY 248 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 3gak n GLY 248 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gak s VAL 249 N -2.00 3.93 -1.71 1.61 1.01 -1.16 -2.41 120.40 119.66 3gak s VAL 249 Ca 0.00 1.01 0.17 0.00 0.00 0.00 0.00 61.98 63.16 3gak s VAL 249 Cb 0.00 -4.06 0.02 0.00 0.00 0.00 0.00 36.38 32.35 3gak s VAL 249 CO 0.00 -0.54 0.93 0.00 0.00 0.00 0.00 175.10 175.49 3gak s LYS 251 N -1.91 0.24 -0.57 0.00 2.20 -1.22 -1.54 119.74 116.94 3gak s LYS 251 Ca 0.16 0.17 0.03 0.00 -0.36 0.00 0.00 55.97 55.97 3gak s LYS 251 Cb 0.14 -0.57 0.14 0.00 -1.51 0.00 0.00 37.83 36.03 3gak s LYS 251 CO 0.40 -0.22 0.33 0.42 -0.36 0.00 0.00 175.35 175.92 3gak s ILE 252 N 1.50 2.79 -0.53 5.43 1.01 -0.76 -2.05 121.20 128.59 3gak s ILE 252 Ca -0.03 -3.50 -0.27 0.00 0.00 0.00 0.00 60.65 56.85 3gak s ILE 252 Cb -0.13 -2.90 -0.08 0.00 0.01 0.00 0.00 42.46 39.36 3gak s ILE 252 CO -0.03 -0.85 2.44 0.59 0.00 0.00 0.00 174.94 177.09 3gak n ASN 253 N 2.89 2.14 -4.49 3.58 4.13 -0.60 -2.30 115.26 120.60 3gak n ASN 253 Ca 0.09 -0.44 -0.35 0.00 1.68 0.00 0.00 54.58 55.56 3gak n ASN 253 Cb 0.33 -1.52 -0.12 0.00 -1.54 0.00 0.00 39.78 36.93 3gak n ASN 253 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 3gak s VAL 254 N 11.90 4.26 0.00 2.41 1.01 -0.67 -2.81 120.40 136.50 3gak s VAL 254 Ca 1.02 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.79 3gak s VAL 254 Cb -0.28 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.16 3gak s VAL 254 CO 0.28 0.41 0.00 -0.67 0.00 0.00 0.00 175.10 175.13 3gak n ASP 255 N 4.24 0.00 -0.04 3.32 4.64 -1.26 -2.86 116.55 124.59 3gak n ASP 255 Ca -0.17 0.00 0.10 0.00 -1.38 0.00 0.00 54.79 53.34 3gak n ASP 255 Cb 0.52 0.00 0.50 0.00 -1.04 0.00 0.00 41.12 41.10 3gak n ASP 255 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 3gak h SER 256 N 0.00 0.36 -0.68 1.67 0.02 -1.99 0.38 113.55 113.30 3gak h SER 256 Ca 0.00 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.01 3gak h SER 256 Cb 0.00 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.41 3gak h SER 256 CO 0.00 0.23 0.38 0.44 -1.14 0.00 0.00 176.83 176.74 3gak h ASP 257 N 0.40 0.57 -0.02 3.07 3.32 -1.97 0.25 116.42 122.04 3gak h ASP 257 Ca 0.23 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.31 3gak h ASP 257 Cb 0.37 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 3gak h ASP 257 CO -0.06 0.37 0.01 0.28 -1.72 0.00 0.00 179.24 178.12 3gak h SER 258 N 0.70 0.02 -0.25 6.45 0.02 -1.26 -2.94 113.55 116.30 3gak h SER 258 Ca 0.31 -0.15 0.05 0.00 -0.84 0.00 0.00 61.79 61.16 3gak h SER 258 Cb 0.19 -0.01 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 3gak h SER 258 CO -0.19 0.16 -0.09 0.03 -1.14 0.00 0.00 176.83 175.60 3gak h ARG 259 N -0.12 -0.05 0.00 3.45 3.08 -1.11 -3.02 114.38 116.62 3gak h ARG 259 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 3gak h ARG 259 Cb 0.15 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.21 3gak h ARG 259 CO -0.00 -0.03 0.00 -1.33 -1.07 0.00 0.00 179.97 177.54 3gak n MET 260 N -5.26 0.00 -0.05 0.04 2.81 0.83 -2.62 117.12 112.87 3gak n MET 260 Ca -0.01 0.56 -0.00 0.00 -1.81 0.00 0.00 57.70 56.44 3gak n MET 260 Cb 0.18 -1.42 0.01 0.00 -0.71 0.00 0.00 33.22 31.27 3gak n MET 260 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3gak n ALA 261 N -2.03 -0.01 0.22 3.04 0.00 -1.12 -0.21 120.51 120.41 3gak n ALA 261 Ca 0.00 0.14 -0.13 0.00 0.00 0.00 0.00 53.44 53.45 3gak n ALA 261 Cb 0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 19.45 19.32 3gak n ALA 261 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.50 179.48 3gak h MET 262 N 0.00 -0.69 0.00 0.00 -1.53 -1.44 -1.80 114.93 109.46 3gak h MET 262 Ca 0.05 0.05 0.00 0.00 -3.44 0.00 0.00 59.70 56.36 3gak h MET 262 Cb 0.09 0.16 0.00 0.00 -0.55 0.00 0.00 31.60 31.29 3gak h MET 262 CO -0.14 -0.46 0.03 2.41 0.14 0.00 0.00 176.91 178.89 3gak n THR 263 N -4.49 0.50 0.03 -0.77 -1.04 0.71 -0.95 114.28 108.28 3gak n THR 263 Ca -0.09 0.15 -0.02 0.00 -2.04 0.00 0.00 64.05 62.05 3gak n THR 263 Cb 0.32 -1.15 -0.01 0.00 -1.82 0.00 0.00 70.33 67.67 3gak n THR 263 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 3gak h GLY 264 N 0.00 -0.16 1.03 3.41 0.00 -0.18 -3.33 103.07 103.84 3gak h GLY 264 Ca 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.36 3gak h GLY 264 CO 0.00 -0.06 0.38 0.00 0.00 0.00 0.00 176.54 176.86 3gak h ALA 265 N -1.26 1.01 -0.54 3.60 0.00 -0.84 -2.80 119.26 118.43 3gak h ALA 265 Ca -0.02 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3gak h ALA 265 Cb 0.12 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3gak h ALA 265 CO 0.03 0.58 0.27 0.82 0.00 0.00 0.00 179.25 180.94 3gak h ILE 266 N 1.11 1.17 -0.26 0.00 2.04 -1.67 -1.11 117.51 118.79 3gak h ILE 266 Ca 0.27 -0.47 -0.11 0.00 1.00 0.00 0.00 64.86 65.55 3gak h ILE 266 Cb 0.12 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 3gak h ILE 266 CO -0.03 0.20 -0.25 0.03 0.00 0.00 0.00 178.15 178.09 3gak h ARG 267 N 0.75 0.62 -0.36 2.37 3.08 -1.61 -2.06 114.38 117.18 3gak h ARG 267 Ca 0.19 -0.33 0.08 0.00 0.07 0.00 0.00 59.98 59.99 3gak h ARG 267 Cb 0.06 0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.03 3gak h ARG 267 CO -0.03 0.93 -0.25 -0.22 -1.07 0.00 0.00 179.97 179.33 3gak h LYS 268 N 0.34 -0.19 -0.53 0.04 3.64 -1.11 -1.05 116.57 117.71 3gak h LYS 268 Ca 0.04 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 3gak h LYS 268 Cb 0.81 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.66 3gak h LYS 268 CO 0.06 -0.13 -0.03 0.28 -2.27 0.00 0.00 179.45 177.36 3gak h VAL 269 N -0.20 1.27 -0.87 2.00 2.07 -1.20 -0.74 116.25 118.57 3gak h VAL 269 Ca 0.17 -1.15 0.12 0.00 0.82 0.00 0.00 66.70 66.66 3gak h VAL 269 Cb 0.48 0.94 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 3gak h VAL 269 CO -0.47 0.41 0.56 -0.26 0.02 0.00 0.00 177.57 177.82 3gak h PHE 270 N 0.83 0.84 0.00 1.57 -1.00 -0.89 0.45 116.94 118.74 3gak h PHE 270 Ca 0.15 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.93 3gak h PHE 270 Cb 0.57 -0.27 -0.00 0.00 3.61 0.00 0.00 35.95 39.86 3gak h PHE 270 CO 0.04 0.35 -0.14 0.28 -1.61 0.00 0.00 178.31 177.23 3gak h VAL 271 N 0.75 0.64 0.00 -0.55 2.07 -0.63 -3.15 116.25 115.38 3gak h VAL 271 Ca 0.42 -1.52 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 3gak h VAL 271 Cb 0.58 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 3gak h VAL 271 CO -0.18 0.22 -0.05 -0.33 0.02 0.00 0.00 177.57 177.24 3gak h GLU 272 N -1.00 0.00 -2.07 1.57 5.08 -1.13 -3.33 114.58 113.69 3gak h GLU 272 Ca -0.02 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.77 3gak h GLU 272 Cb 0.47 0.00 -0.38 0.00 0.50 0.00 0.00 28.75 29.33 3gak h GLU 272 CO -0.01 0.05 -1.06 0.72 -1.00 0.00 0.00 179.01 177.70 3gak n HIS 273 N -4.07 -0.58 -0.17 4.33 8.25 0.16 -4.94 115.22 118.20 3gak n HIS 273 Ca -0.03 -3.46 0.28 0.00 -0.26 0.00 0.00 57.72 54.25 3gak n HIS 273 Cb 0.14 -0.15 0.71 0.00 1.12 0.00 0.00 29.99 31.82 3gak n HIS 273 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3gak h PRO 274 N 4.46 0.02 0.03 -0.41 0.11 -1.66 -2.03 132.00 132.51 3gak h PRO 274 Ca 0.12 -0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.96 3gak h PRO 274 Cb 0.89 -0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.02 3gak h PRO 274 CO 0.43 0.01 -1.09 1.05 -0.21 0.00 0.00 178.00 178.19 3gak h GLU 275 N 0.02 0.68 -6.86 1.05 9.09 -1.91 -3.46 114.58 113.19 3gak h GLU 275 Ca 0.42 -0.77 -0.55 0.00 0.05 0.00 0.00 59.36 58.51 3gak h GLU 275 Cb 1.64 0.23 0.11 0.00 -1.65 0.00 0.00 28.75 29.08 3gak h GLU 275 CO -0.01 1.34 0.69 1.63 0.05 0.00 0.00 179.01 182.71 3gak n LYS 276 N -3.84 2.49 0.00 1.06 5.02 -0.76 -4.89 118.16 117.24 3gak n LYS 276 Ca -0.11 0.88 0.00 0.00 -2.02 0.00 0.00 58.31 57.05 3gak n LYS 276 Cb 0.91 -2.56 0.00 0.00 -0.02 0.00 0.00 35.03 33.35 3gak n LYS 276 CO 0.00 0.00 0.00 1.97 -0.52 0.00 0.00 177.40 178.85 3gak n PHE 277 N 0.55 0.00 -2.64 2.13 1.16 -1.26 -5.00 117.46 112.40 3gak n PHE 277 Ca 0.03 0.00 -0.43 0.00 -1.87 0.00 0.00 57.45 55.18 3gak n PHE 277 Cb 0.38 0.01 -0.02 0.00 -1.61 0.00 0.00 39.48 38.23 3gak n PHE 277 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 3gak s ASP 278 N 0.00 7.18 0.23 5.98 -1.08 -1.26 -4.98 116.67 122.74 3gak s ASP 278 Ca 0.00 1.56 -0.16 0.00 -0.52 0.00 0.00 52.55 53.43 3gak s ASP 278 Cb 0.00 -2.55 0.25 0.00 -1.46 0.00 0.00 42.92 39.16 3gak s ASP 278 CO 0.00 -0.52 1.57 -0.65 0.52 0.00 0.00 175.17 176.10 3gak h PRO 279 N 7.25 -0.05 -1.35 4.34 0.11 -2.00 1.06 132.00 141.36 3gak h PRO 279 Ca -0.29 0.00 0.39 0.00 0.11 0.00 0.00 66.00 66.21 3gak h PRO 279 Cb 1.13 0.01 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 3gak h PRO 279 CO 0.88 -0.03 1.06 0.00 -0.21 0.00 0.00 178.00 179.70 3gak h ARG 280 N -0.05 0.00 0.00 1.05 3.08 -1.94 0.90 114.38 117.42 3gak h ARG 280 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 3gak h ARG 280 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 3gak h ARG 280 CO -0.86 0.00 -0.08 -0.44 -1.07 0.00 0.00 179.97 177.52 3gak h ASP 281 N 0.00 0.00 0.00 7.04 3.45 0.80 -2.57 116.42 125.14 3gak h ASP 281 Ca 0.64 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 58.10 3gak h ASP 281 Cb 2.76 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 41.53 3gak h ASP 281 CO -0.01 0.00 -0.97 0.00 -1.57 0.00 0.00 179.24 176.69 3gak n TYR 282 N -2.95 0.00 0.18 4.55 0.18 -0.67 -4.64 117.16 113.81 3gak n TYR 282 Ca 0.04 0.00 0.17 0.00 1.88 0.00 0.00 57.90 59.99 3gak n TYR 282 Cb 0.52 0.00 0.80 0.00 -0.38 0.00 0.00 39.34 40.27 3gak n TYR 282 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 3gak h LEU 283 N 0.00 0.00 0.51 -3.48 4.07 0.64 -2.54 115.31 114.51 3gak h LEU 283 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 3gak h LEU 283 Cb 0.97 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.72 3gak h LEU 283 CO 0.00 0.00 -0.24 1.23 -1.08 0.00 0.00 178.44 178.35 3gak h GLY 284 N 0.00 -0.71 0.78 0.83 0.00 -1.58 -2.99 103.07 99.40 3gak h GLY 284 Ca 0.10 0.26 0.15 0.00 0.00 0.00 0.00 47.33 47.85 3gak h GLY 284 CO -0.00 -0.26 0.47 -2.55 0.00 0.00 0.00 176.54 174.19 3gak h PRO 285 N -0.86 0.00 -0.26 4.80 0.11 -1.78 -2.29 132.00 131.72 3gak h PRO 285 Ca -0.07 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.02 3gak h PRO 285 Cb 0.52 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 3gak h PRO 285 CO 0.11 0.00 0.08 0.78 -0.21 0.00 0.00 178.00 178.76 3gak h GLY 286 N 0.00 0.43 0.25 -0.55 0.00 -1.45 -1.35 103.07 100.40 3gak h GLY 286 Ca 0.24 -0.26 0.09 0.00 0.00 0.00 0.00 47.33 47.41 3gak h GLY 286 CO -0.00 0.24 0.03 -0.09 0.00 0.00 0.00 176.54 176.71 3gak h ARG 287 N 0.25 0.14 0.32 4.80 2.43 -1.27 0.74 114.38 121.80 3gak h ARG 287 Ca 0.08 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 3gak h ARG 287 Cb 0.24 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3gak h ARG 287 CO -0.00 0.09 -0.16 -0.44 -1.51 0.00 0.00 179.97 177.95 3gak h ASP 288 N 0.14 -0.37 -0.88 -3.80 3.45 -1.45 -0.76 116.42 112.76 3gak h ASP 288 Ca 0.24 -0.07 0.17 0.00 0.43 0.00 0.00 57.03 57.80 3gak h ASP 288 Cb 0.35 0.10 -0.16 0.00 -0.56 0.00 0.00 39.33 39.06 3gak h ASP 288 CO -0.38 -0.15 -0.25 0.00 -1.57 0.00 0.00 179.24 176.89 3gak n ALA 289 N -2.35 0.14 0.21 3.45 0.00 -0.52 0.24 120.51 121.67 3gak n ALA 289 Ca -0.10 0.94 -0.09 0.00 0.00 0.00 0.00 53.44 54.19 3gak n ALA 289 Cb 0.23 -0.54 -0.05 0.00 0.00 0.00 0.00 19.45 19.10 3gak n ALA 289 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3gak h ILE 290 N 0.00 0.00 -0.89 0.00 2.04 -0.31 -1.35 117.51 116.99 3gak h ILE 290 Ca 0.39 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.43 3gak h ILE 290 Cb 0.61 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.53 3gak h ILE 290 CO -0.90 0.00 -0.24 0.41 0.00 0.00 0.00 178.15 177.43 3gak n THR 291 N -3.75 -0.38 1.55 -0.27 -1.04 0.23 -0.82 114.28 109.80 3gak n THR 291 Ca -0.07 2.04 0.15 0.00 -2.04 0.00 0.00 64.05 64.13 3gak n THR 291 Cb 0.24 -2.81 0.74 0.00 -1.82 0.00 0.00 70.33 66.67 3gak n THR 291 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3gak n GLU 292 N -5.44 0.71 -0.01 -2.82 -0.58 0.14 -2.49 120.64 110.15 3gak n GLU 292 Ca 0.14 -0.13 0.10 0.00 -0.42 0.00 0.00 57.16 56.85 3gak n GLU 292 Cb 0.44 -1.50 -0.16 0.00 -0.57 0.00 0.00 31.44 29.65 3gak n GLU 292 CO 0.00 0.00 0.00 -0.12 -0.48 0.00 0.00 177.13 176.53 3gak n MET 293 N -1.03 0.62 -0.02 3.49 1.56 0.00 -4.55 117.12 117.18 3gak n MET 293 Ca 0.17 -0.19 -0.15 0.00 -0.27 0.00 0.00 57.70 57.26 3gak n MET 293 Cb 0.23 -1.49 -0.12 0.00 2.15 0.00 0.00 33.22 33.99 3gak n MET 293 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 3gak h LEU 294 N 0.00 0.23 -0.89 -0.89 4.07 -0.94 -3.37 115.31 113.51 3gak h LEU 294 Ca -0.00 -0.81 0.22 0.00 0.08 0.00 0.00 57.88 57.36 3gak h LEU 294 Cb 0.95 -0.07 -0.17 0.00 1.08 0.00 0.00 40.66 42.45 3gak h LEU 294 CO 0.00 1.01 -0.08 -0.38 -1.08 0.00 0.00 178.44 177.91 3gak n ILE 295 N -4.48 -0.38 -0.08 1.22 5.41 -1.04 -0.07 119.36 119.94 3gak n ILE 295 Ca -0.10 2.00 -0.11 0.00 1.00 0.00 0.00 62.75 65.53 3gak n ILE 295 Cb 0.53 -2.85 -0.04 0.00 -0.71 0.00 0.00 39.64 36.56 3gak n ILE 295 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 3gak h PRO 296 N 0.00 0.46 -0.03 0.38 0.11 -1.84 -2.79 132.00 128.28 3gak h PRO 296 Ca 0.50 -0.16 0.00 0.00 0.11 0.00 0.00 66.00 66.45 3gak h PRO 296 Cb 0.93 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 3gak h PRO 296 CO -0.87 0.66 -0.06 -0.22 -0.21 0.00 0.00 178.00 177.29 3gak h LYS 297 N 0.21 -0.05 -0.42 1.05 3.64 -0.65 0.13 116.57 120.49 3gak h LYS 297 Ca 0.07 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.49 3gak h LYS 297 Cb 0.47 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.25 3gak h LYS 297 CO 0.02 -0.04 -0.26 0.82 -2.27 0.00 0.00 179.45 177.72 3gak h ILE 298 N -0.06 0.00 -0.37 2.00 5.03 -1.21 0.11 117.51 123.02 3gak h ILE 298 Ca 0.01 0.00 0.03 0.00 -0.12 0.00 0.00 64.86 64.78 3gak h ILE 298 Cb 0.07 0.00 -0.04 0.00 -3.03 0.00 0.00 36.82 33.82 3gak h ILE 298 CO -0.06 0.00 -0.22 0.29 -0.68 0.00 0.00 178.15 177.48 3gak n LYS 299 N -4.00 -0.16 -0.15 2.37 5.02 -1.05 0.11 118.16 120.29 3gak n LYS 299 Ca 0.01 0.65 0.08 0.00 -2.02 0.00 0.00 58.31 57.03 3gak n LYS 299 Cb 0.12 -0.97 0.40 0.00 -0.02 0.00 0.00 35.03 34.56 3gak n LYS 299 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gak h ALA 300 N 0.09 1.79 0.00 7.82 0.00 0.18 -0.02 119.26 129.12 3gak h ALA 300 Ca 0.06 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 3gak h ALA 300 Cb 0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3gak h ALA 300 CO -0.35 0.09 -0.55 0.74 0.00 0.00 0.00 179.25 179.18 3gak h PHE 301 N 0.65 0.00 0.00 0.00 0.04 0.21 -3.45 116.94 114.39 3gak h PHE 301 Ca 0.30 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.07 3gak h PHE 301 Cb 0.34 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.49 3gak h PHE 301 CO -0.00 0.55 0.00 0.41 -0.60 0.00 0.00 178.31 178.66 3gak n GLY 302 N 0.09 0.58 0.02 -1.45 0.00 0.63 -1.55 105.19 103.50 3gak n GLY 302 Ca -0.01 -0.51 0.13 0.00 0.00 0.00 0.00 46.02 45.63 3gak n GLY 302 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gak n SER 303 N 0.92 0.39 -4.32 1.61 3.41 -1.25 -4.84 113.62 109.55 3gak n SER 303 Ca 0.00 0.09 -0.61 0.00 -0.26 0.00 0.00 58.87 58.09 3gak n SER 303 Cb 0.00 -0.07 -0.11 0.00 -0.26 0.00 0.00 64.21 63.77 3gak n SER 303 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gak n ALA 304 N -1.56 -0.13 -0.48 7.33 0.00 -1.26 -1.25 120.51 123.17 3gak n ALA 304 Ca 0.06 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.75 3gak n ALA 304 Cb 0.36 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.78 3gak n ALA 304 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gak n GLY 305 N 6.66 0.84 0.64 0.00 0.00 0.11 -4.88 105.19 108.56 3gak n GLY 305 Ca 0.49 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.62 3gak n GLY 305 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3gak n HIS 306 N -2.00 0.25 -0.13 1.61 -0.00 -0.38 -4.46 115.22 110.12 3gak n HIS 306 Ca 0.00 -0.13 -0.01 0.00 -0.00 0.00 0.00 57.72 57.58 3gak n HIS 306 Cb 0.00 0.00 0.23 0.00 -0.00 0.00 0.00 29.99 30.22 3gak n HIS 306 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3gak h ALA 307 N 4.11 1.33 -0.01 -1.41 0.00 -1.24 -1.25 119.26 120.80 3gak h ALA 307 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3gak h ALA 307 Cb 0.56 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3gak h ALA 307 CO 0.00 0.50 -0.04 0.41 0.00 0.00 0.00 179.25 180.12 3gak n GLY 308 N -1.05 -0.71 0.39 0.00 0.00 -1.26 -4.52 105.19 98.04 3gak n GLY 308 Ca 0.05 -0.29 0.14 0.00 0.00 0.00 0.00 46.02 45.91 3gak n GLY 308 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3gak h ASP 309 N 0.85 0.00 -4.96 1.61 3.32 -1.52 -3.45 116.42 112.27 3gak h ASP 309 Ca 0.00 0.00 0.04 0.00 0.02 0.00 0.00 57.03 57.09 3gak h ASP 309 Cb 0.26 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.71 3gak h ASP 309 CO 0.00 0.00 0.29 -0.72 -1.72 0.00 0.00 179.24 177.09 3gak s TYR 310 N -4.22 -0.40 -0.16 4.55 -0.85 -1.26 -5.14 117.35 109.87 3gak s TYR 310 Ca -0.02 0.14 -0.18 0.00 -0.52 0.00 0.00 57.07 56.48 3gak s TYR 310 Cb 0.08 0.59 -0.04 0.00 0.38 0.00 0.00 41.96 42.98 3gak s TYR 310 CO 0.27 -0.88 0.49 0.21 -1.52 0.00 0.00 175.55 174.13 3gak s LYS 311 N -3.63 4.26 -0.08 -3.49 2.20 -1.26 -5.02 119.74 112.73 3gak s LYS 311 Ca 0.05 0.43 -0.30 0.00 -0.36 0.00 0.00 55.97 55.79 3gak s LYS 311 Cb -0.02 -3.50 -0.02 0.00 -1.51 0.00 0.00 37.83 32.78 3gak s LYS 311 CO -0.07 0.00 1.09 0.08 -0.36 0.00 0.00 175.35 176.09 3gak s VAL 312 N 1.13 4.56 0.22 4.02 1.01 -1.26 -5.00 120.40 125.08 3gak s VAL 312 Ca 0.25 1.85 -0.17 0.00 0.00 0.00 0.00 61.98 63.91 3gak s VAL 312 Cb -0.15 -4.19 -0.08 0.00 0.00 0.00 0.00 36.38 31.96 3gak s VAL 312 CO 0.10 0.01 0.68 -0.69 0.00 0.00 0.00 175.10 175.19 3gak s VAL 313 N 2.03 4.67 0.16 2.92 1.01 -1.26 -5.07 120.40 124.87 3gak s VAL 313 Ca 0.52 1.08 0.08 0.00 0.00 0.00 0.00 61.98 63.65 3gak s VAL 313 Cb -0.21 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 3gak s VAL 313 CO 0.20 0.13 -0.05 -0.94 0.00 0.00 0.00 175.10 174.45 3gak s SER 314 N -1.81 4.56 0.26 3.32 1.04 -1.26 -3.94 113.70 115.86 3gak s SER 314 Ca 0.44 -0.43 0.12 0.00 0.48 0.00 0.00 55.95 56.55 3gak s SER 314 Cb -0.15 -0.91 0.87 0.00 0.10 0.00 0.00 66.02 65.93 3gak s SER 314 CO 0.20 0.12 1.14 0.18 0.98 0.00 0.00 173.24 175.85 3gak n LEU 315 N 0.14 0.17 0.06 2.42 4.77 -1.26 -0.96 117.00 122.34 3gak n LEU 315 Ca -0.11 1.20 -0.02 0.00 -0.03 0.00 0.00 56.01 57.05 3gak n LEU 315 Cb 0.54 -0.55 -0.01 0.00 -2.33 0.00 0.00 43.42 41.07 3gak n LEU 315 CO 0.36 -1.32 0.34 -0.08 -1.33 0.00 0.00 177.39 175.37 3gak h GLU 316 N 0.00 -0.16 -1.44 3.23 4.57 -1.96 -3.23 114.58 115.60 3gak h GLU 316 Ca 0.57 0.01 0.42 0.00 -1.18 0.00 0.00 59.36 59.18 3gak h GLU 316 Cb 1.44 0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 30.01 3gak h GLU 316 CO -0.59 -0.10 1.13 0.93 -1.18 0.00 0.00 179.01 179.20 3gak h GLU 317 N -0.22 0.00 0.00 1.92 5.08 -1.72 -1.95 114.58 117.68 3gak h GLU 317 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3gak h GLU 317 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3gak h GLU 317 CO 0.03 0.00 -0.52 0.00 -1.00 0.00 0.00 179.01 177.52 3gak n ALA 318 N -2.72 2.82 -0.25 3.43 0.00 -0.13 -2.76 120.51 120.91 3gak n ALA 318 Ca 0.32 -0.21 0.05 0.00 0.00 0.00 0.00 53.44 53.60 3gak n ALA 318 Cb 1.58 -1.22 0.18 0.00 0.00 0.00 0.00 19.45 19.99 3gak n ALA 318 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3gak h LYS 319 N 0.00 0.30 -0.99 0.00 1.57 -1.37 -1.15 116.57 114.93 3gak h LYS 319 Ca 0.00 -0.02 0.36 0.00 -1.87 0.00 0.00 60.65 59.12 3gak h LYS 319 Cb 0.74 -0.07 -0.18 0.00 0.08 0.00 0.00 32.23 32.80 3gak h LYS 319 CO 0.00 0.20 0.37 0.00 -0.57 0.00 0.00 179.45 179.45 3gak h ALA 320 N 1.59 1.79 -0.53 3.86 0.00 -1.70 0.28 119.26 124.55 3gak h ALA 320 Ca 0.41 0.28 0.15 0.00 0.00 0.00 0.00 54.91 55.76 3gak h ALA 320 Cb 0.68 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 3gak h ALA 320 CO -0.48 -0.78 0.46 -1.49 0.00 0.00 0.00 179.25 176.97 3gak h TRP 321 N 0.04 0.00 -0.00 0.00 6.55 -1.41 -3.54 115.95 117.59 3gak h TRP 321 Ca 0.75 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.59 3gak h TRP 321 Cb 1.82 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 30.12 3gak h TRP 321 CO -0.18 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 177.87