#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gaf n PRO 6 N 0.00 3.07 -0.40 -1.46 -0.04 -1.26 -4.37 135.00 130.54 3gaf n PRO 6 Ca 0.00 -2.28 0.04 0.00 -0.04 0.00 0.00 63.50 61.22 3gaf n PRO 6 Cb 0.00 -1.72 0.20 0.00 -0.04 0.00 0.00 33.50 31.94 3gaf n PRO 6 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3gaf n PHE 7 N 0.93 0.94 -4.86 0.54 3.72 -1.26 -2.20 117.46 115.27 3gaf n PHE 7 Ca 0.21 -0.35 -0.33 0.00 -0.05 0.00 0.00 57.45 56.93 3gaf n PHE 7 Cb 0.70 -0.24 -0.14 0.00 -0.94 0.00 0.00 39.48 38.87 3gaf n PHE 7 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 3gaf s HIS 8 N -1.81 2.73 -0.42 1.38 3.76 -1.26 -4.93 115.29 114.73 3gaf s HIS 8 Ca 0.27 -0.33 -0.02 0.00 -0.15 0.00 0.00 55.06 54.83 3gaf s HIS 8 Cb 0.20 -1.70 0.23 0.00 1.11 0.00 0.00 32.58 32.41 3gaf s HIS 8 CO 0.10 0.04 2.19 1.28 -0.85 0.00 0.00 174.74 177.50 3gaf n LEU 9 N 2.73 6.72 -4.70 0.89 4.77 -0.40 -4.67 117.00 122.33 3gaf n LEU 9 Ca -0.17 -3.68 -0.42 0.00 -0.03 0.00 0.00 56.01 51.70 3gaf n LEU 9 Cb 0.52 -1.08 -0.03 0.00 -2.33 0.00 0.00 43.42 40.50 3gaf n LEU 9 CO 0.27 1.39 1.06 0.54 -1.33 0.00 0.00 177.39 179.32 3gaf s ASN 10 N -0.16 6.89 0.00 -1.43 6.03 -1.24 -2.74 114.94 122.30 3gaf s ASN 10 Ca 0.43 2.14 0.00 0.00 -1.03 0.00 0.00 52.86 54.40 3gaf s ASN 10 Cb 0.32 -2.57 0.00 0.00 -3.03 0.00 0.00 41.25 35.97 3gaf s ASN 10 CO -0.07 -0.65 0.00 -0.67 -2.03 0.00 0.00 177.10 173.68 3gaf n ASP 11 N 4.76 -0.83 -4.47 3.54 4.64 -1.21 -5.02 116.55 117.96 3gaf n ASP 11 Ca 0.12 0.00 -0.30 0.00 -1.38 0.00 0.00 54.79 53.23 3gaf n ASP 11 Cb 0.44 -0.41 -0.12 0.00 -1.04 0.00 0.00 41.12 39.99 3gaf n ASP 11 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3gaf s ALA 12 N -2.01 2.62 -0.15 -1.67 0.00 -1.11 -5.05 121.76 114.40 3gaf s ALA 12 Ca 0.00 -1.34 0.01 0.00 0.00 0.00 0.00 51.96 50.62 3gaf s ALA 12 Cb 0.00 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.52 3gaf s ALA 12 CO 0.00 0.58 -0.15 0.08 0.00 0.00 0.00 175.76 176.27 3gaf s VAL 13 N -1.09 1.63 -0.12 0.00 1.01 -1.26 -0.50 120.40 120.06 3gaf s VAL 13 Ca 0.17 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.50 3gaf s VAL 13 Cb -0.10 -1.52 0.01 0.00 0.00 0.00 0.00 36.38 34.77 3gaf s VAL 13 CO 0.09 0.47 -0.18 0.00 0.00 0.00 0.00 175.10 175.47 3gaf s ALA 14 N 1.43 1.94 -0.05 5.51 0.00 -0.21 -0.33 121.76 130.05 3gaf s ALA 14 Ca 0.04 -0.89 -0.18 0.00 0.00 0.00 0.00 51.96 50.93 3gaf s ALA 14 Cb -0.13 -0.90 -0.05 0.00 0.00 0.00 0.00 23.12 22.04 3gaf s ALA 14 CO -0.10 -0.05 0.51 0.42 0.00 0.00 0.00 175.76 176.53 3gaf s ILE 15 N 0.91 5.04 -0.16 0.00 1.01 0.28 -1.05 121.20 127.23 3gaf s ILE 15 Ca -0.07 1.04 -0.01 0.00 0.00 0.00 0.00 60.65 61.61 3gaf s ILE 15 Cb -0.15 -3.84 0.05 0.00 0.01 0.00 0.00 42.46 38.53 3gaf s ILE 15 CO -0.02 0.42 -0.01 -0.69 0.00 0.00 0.00 174.94 174.64 3gaf s VAL 16 N -0.06 0.79 0.45 2.92 1.01 -1.08 -0.41 120.40 124.02 3gaf s VAL 16 Ca 0.27 -0.48 0.03 0.00 0.00 0.00 0.00 61.98 61.80 3gaf s VAL 16 Cb -0.17 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.15 3gaf s VAL 16 CO 0.14 0.03 0.65 0.42 0.00 0.00 0.00 175.10 176.34 3gaf s THR 17 N 1.76 3.41 -1.68 3.92 -4.23 -0.94 -1.47 115.64 116.41 3gaf s THR 17 Ca 0.01 -0.74 -0.16 0.00 -1.18 0.00 0.00 61.69 59.62 3gaf s THR 17 Cb -0.15 -3.23 0.16 0.00 1.34 0.00 0.00 72.50 70.62 3gaf s THR 17 CO -0.07 -0.13 0.39 0.61 -0.54 0.00 0.00 174.62 174.87 3gaf n GLY 18 N -2.04 -0.29 1.78 3.99 0.00 -0.95 -3.67 105.19 104.01 3gaf n GLY 18 Ca 0.04 0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.24 3gaf n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gaf n ALA 19 N -4.03 3.75 -0.01 4.61 0.00 0.24 -4.51 120.51 120.55 3gaf n ALA 19 Ca -0.02 -1.94 -0.11 0.00 0.00 0.00 0.00 53.44 51.37 3gaf n ALA 19 Cb 0.50 -1.08 -0.05 0.00 0.00 0.00 0.00 19.45 18.82 3gaf n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gaf h ALA 20 N 3.81 0.15 -4.56 0.00 0.00 -1.82 -3.10 119.26 113.74 3gaf h ALA 20 Ca 0.00 -0.04 -0.40 0.00 0.00 0.00 0.00 54.91 54.47 3gaf h ALA 20 Cb 1.90 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 19.54 3gaf h ALA 20 CO 0.45 -0.33 -0.38 0.00 0.00 0.00 0.00 179.25 178.99 3gaf n ALA 21 N -2.15 0.58 -0.93 0.00 0.00 -1.26 -4.70 120.51 112.05 3gaf n ALA 21 Ca -0.05 -1.61 0.00 0.00 0.00 0.00 0.00 53.44 51.78 3gaf n ALA 21 Cb 0.06 1.29 0.00 0.00 0.00 0.00 0.00 19.45 20.79 3gaf n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gaf n GLY 22 N -0.50 2.91 0.17 0.00 0.00 -1.26 -2.91 105.19 103.60 3gaf n GLY 22 Ca 0.05 -0.36 -0.14 0.00 0.00 0.00 0.00 46.02 45.57 3gaf n GLY 22 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3gaf h ILE 23 N 0.00 0.73 -0.94 -0.61 2.04 -1.93 -2.89 117.51 113.91 3gaf h ILE 23 Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.98 3gaf h ILE 23 Cb 0.00 0.73 -0.08 0.00 -0.74 0.00 0.00 36.82 36.73 3gaf h ILE 23 CO 0.00 0.00 0.57 1.23 0.00 0.00 0.00 178.15 179.95 3gaf h GLY 24 N -0.36 1.53 0.76 5.37 0.00 -1.80 -1.43 103.07 107.13 3gaf h GLY 24 Ca -0.03 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 3gaf h GLY 24 CO 0.05 0.13 -0.04 -0.09 0.00 0.00 0.00 176.54 176.60 3gaf h ARG 25 N 0.90 -0.10 -0.21 4.80 2.43 -1.45 -0.71 114.38 120.04 3gaf h ARG 25 Ca 0.47 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.67 3gaf h ARG 25 Cb 0.48 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 3gaf h ARG 25 CO -0.27 0.16 0.14 0.00 -1.51 0.00 0.00 179.97 178.49 3gaf h ALA 26 N 0.56 2.00 -0.10 2.80 0.00 -1.24 0.12 119.26 123.39 3gaf h ALA 26 Ca -0.01 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.69 3gaf h ALA 26 Cb 0.30 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.06 3gaf h ALA 26 CO 0.02 -0.04 -0.72 0.82 0.00 0.00 0.00 179.25 179.33 3gaf h ILE 27 N 0.16 1.31 0.20 0.00 2.04 -1.18 -1.76 117.51 118.28 3gaf h ILE 27 Ca 0.09 -1.98 -0.01 0.00 1.00 0.00 0.00 64.86 63.96 3gaf h ILE 27 Cb 0.16 2.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.40 3gaf h ILE 27 CO -0.01 0.61 -0.10 0.00 0.00 0.00 0.00 178.15 178.65 3gaf h ALA 28 N 0.48 -0.27 -0.43 1.87 0.00 -0.33 -1.28 119.26 119.30 3gaf h ALA 28 Ca -0.06 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 54.85 3gaf h ALA 28 Cb 1.37 0.10 -0.08 0.00 0.00 0.00 0.00 17.79 19.18 3gaf h ALA 28 CO 0.15 -0.62 -0.07 0.78 0.00 0.00 0.00 179.25 179.49 3gaf h GLY 29 N -0.33 0.35 0.99 0.00 0.00 -0.87 -2.59 103.07 100.62 3gaf h GLY 29 Ca -0.03 0.11 -0.10 0.00 0.00 0.00 0.00 47.33 47.32 3gaf h GLY 29 CO 0.05 -0.15 -0.15 -0.84 0.00 0.00 0.00 176.54 175.45 3gaf h THR 30 N 0.03 1.28 -0.54 4.70 2.02 -1.19 -2.45 112.91 116.76 3gaf h THR 30 Ca 0.21 -1.26 -0.08 0.00 0.77 0.00 0.00 66.41 66.05 3gaf h THR 30 Cb 0.32 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 3gaf h THR 30 CO -0.42 0.42 0.03 -0.26 0.37 0.00 0.00 175.52 175.66 3gaf h PHE 31 N 0.58 1.02 0.00 3.16 -1.00 -1.22 -0.03 116.94 119.45 3gaf h PHE 31 Ca 0.09 -0.16 0.03 0.00 2.81 0.00 0.00 57.97 60.74 3gaf h PHE 31 Cb 0.69 -0.27 -0.05 0.00 3.61 0.00 0.00 35.95 39.93 3gaf h PHE 31 CO 0.05 0.92 -0.37 0.00 -1.61 0.00 0.00 178.31 177.30 3gaf h ALA 32 N 0.97 -0.58 0.00 2.45 0.00 -1.43 -0.78 119.26 119.89 3gaf h ALA 32 Ca 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3gaf h ALA 32 Cb 0.49 0.66 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3gaf h ALA 32 CO 0.02 -0.90 0.00 1.57 0.00 0.00 0.00 179.25 179.94 3gaf h LYS 33 N -0.53 0.00 0.00 0.00 2.10 -1.33 -2.24 116.57 114.57 3gaf h LYS 33 Ca 0.05 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 3gaf h LYS 33 Cb 0.61 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.94 3gaf h LYS 33 CO -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.16 3gaf n ALA 34 N -1.90 2.23 0.00 0.07 0.00 -0.04 -4.88 120.51 116.00 3gaf n ALA 34 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.43 3gaf n ALA 34 Cb 0.18 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.17 3gaf n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gaf n GLY 35 N 1.20 1.43 3.53 0.00 0.00 -0.85 -1.28 105.19 109.22 3gaf n GLY 35 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 3gaf n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gaf s ALA 36 N -1.77 2.80 -0.04 4.61 0.00 -0.73 -3.31 121.76 123.31 3gaf s ALA 36 Ca 0.00 -1.26 -0.18 0.00 0.00 0.00 0.00 51.96 50.51 3gaf s ALA 36 Cb 0.00 -0.79 -0.05 0.00 0.00 0.00 0.00 23.12 22.28 3gaf s ALA 36 CO 0.00 0.61 0.51 -1.54 0.00 0.00 0.00 175.76 175.35 3gaf s SER 37 N -2.01 6.84 -0.15 0.00 1.04 0.34 -3.81 113.70 115.95 3gaf s SER 37 Ca 0.19 1.00 0.01 0.00 0.48 0.00 0.00 55.95 57.62 3gaf s SER 37 Cb -0.11 -2.31 0.02 0.00 0.10 0.00 0.00 66.02 63.72 3gaf s SER 37 CO 0.11 0.11 -0.16 -0.69 0.98 0.00 0.00 173.24 173.59 3gaf s VAL 38 N -0.10 1.70 -1.00 5.02 1.01 -0.64 -1.04 120.40 125.35 3gaf s VAL 38 Ca 0.28 -0.72 -0.16 0.00 0.00 0.00 0.00 61.98 61.38 3gaf s VAL 38 Cb -0.17 -1.57 0.17 0.00 0.00 0.00 0.00 36.38 34.81 3gaf s VAL 38 CO 0.14 0.48 1.13 -0.69 0.00 0.00 0.00 175.10 176.16 3gaf s VAL 39 N 1.40 5.10 0.11 2.92 1.01 -0.22 -1.08 120.40 129.64 3gaf s VAL 39 Ca 0.04 -2.19 -0.31 0.00 0.00 0.00 0.00 61.98 59.52 3gaf s VAL 39 Cb -0.13 -4.74 -0.08 0.00 0.00 0.00 0.00 36.38 31.43 3gaf s VAL 39 CO -0.11 -1.41 1.49 -0.69 0.00 0.00 0.00 175.10 174.38 3gaf s VAL 40 N 1.55 3.09 0.19 2.92 1.01 0.29 -2.65 120.40 126.81 3gaf s VAL 40 Ca 0.32 0.73 0.09 0.00 0.00 0.00 0.00 61.98 63.12 3gaf s VAL 40 Cb -0.06 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.81 3gaf s VAL 40 CO -0.07 0.04 -0.18 0.42 0.00 0.00 0.00 175.10 175.31 3gaf s THR 41 N 1.52 1.94 0.09 3.92 -4.23 -0.54 -0.22 115.64 118.12 3gaf s THR 41 Ca 0.68 -2.05 -0.26 0.00 -1.18 0.00 0.00 61.69 58.87 3gaf s THR 41 Cb -0.39 -1.97 0.08 0.00 1.34 0.00 0.00 72.50 71.56 3gaf s THR 41 CO 0.30 -0.36 0.81 -0.62 -0.54 0.00 0.00 174.62 174.21 3gaf s ASP 42 N -2.91 -0.38 0.12 3.99 -1.08 -0.70 -0.59 116.67 115.12 3gaf s ASP 42 Ca 0.19 -0.12 -0.24 0.00 -0.52 0.00 0.00 52.55 51.87 3gaf s ASP 42 Cb -0.05 0.48 -0.07 0.00 -1.46 0.00 0.00 42.92 41.83 3gaf s ASP 42 CO 0.08 -0.81 1.68 0.25 0.52 0.00 0.00 175.17 176.88 3gaf h LEU 43 N 2.00 -0.43 -8.21 -1.34 6.46 -1.88 0.28 115.31 112.19 3gaf h LEU 43 Ca -0.25 0.06 -0.71 0.00 -0.12 0.00 0.00 57.88 56.86 3gaf h LEU 43 Cb 1.26 0.18 -0.27 0.00 -0.73 0.00 0.00 40.66 41.10 3gaf h LEU 43 CO 0.31 -0.20 -0.49 -0.54 -0.62 0.00 0.00 178.44 176.90 3gaf s LYS 44 N -6.14 2.68 0.00 1.25 1.02 -1.26 -4.52 119.74 112.78 3gaf s LYS 44 Ca -0.14 -1.32 0.08 0.00 0.02 0.00 0.00 55.97 54.61 3gaf s LYS 44 Cb 0.09 -3.75 0.36 0.00 -0.52 0.00 0.00 37.83 34.00 3gaf s LYS 44 CO 0.67 -0.85 1.23 -1.13 -0.92 0.00 0.00 175.35 174.34 3gaf n SER 45 N 4.94 0.00 0.07 2.83 3.41 -1.26 -0.89 113.62 122.72 3gaf n SER 45 Ca -0.11 0.43 -0.09 0.00 -0.26 0.00 0.00 58.87 58.84 3gaf n SER 45 Cb 0.44 -0.46 0.02 0.00 -0.26 0.00 0.00 64.21 63.95 3gaf n SER 45 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3gaf h GLU 46 N 0.00 0.31 -0.27 4.33 3.07 -1.95 0.41 114.58 120.49 3gaf h GLU 46 Ca 0.00 -0.28 -0.02 0.00 -0.50 0.00 0.00 59.36 58.55 3gaf h GLU 46 Cb 0.13 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.09 3gaf h GLU 46 CO 0.00 0.95 0.09 0.78 -1.40 0.00 0.00 179.01 179.43 3gaf h GLY 47 N 1.48 0.45 0.74 -3.84 0.00 -1.42 -2.11 103.07 98.37 3gaf h GLY 47 Ca -0.04 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 3gaf h GLY 47 CO 0.13 0.25 -0.02 0.00 0.00 0.00 0.00 176.54 176.90 3gaf h ALA 48 N 0.92 -0.05 -0.41 3.60 0.00 -1.39 -3.03 119.26 118.90 3gaf h ALA 48 Ca 0.09 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3gaf h ALA 48 Cb 0.23 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3gaf h ALA 48 CO -0.00 -0.40 0.22 1.05 0.00 0.00 0.00 179.25 180.12 3gaf h GLU 49 N -0.31 0.43 -0.76 0.00 9.09 -0.24 -2.20 114.58 120.58 3gaf h GLU 49 Ca -0.01 -0.03 0.16 0.00 0.05 0.00 0.00 59.36 59.54 3gaf h GLU 49 Cb 0.29 -0.10 -0.11 0.00 -1.65 0.00 0.00 28.75 27.18 3gaf h GLU 49 CO 0.01 0.28 0.24 0.00 0.05 0.00 0.00 179.01 179.59 3gaf h ALA 50 N 1.21 1.05 -0.24 1.06 0.00 -1.39 0.14 119.26 121.09 3gaf h ALA 50 Ca 0.17 0.15 -0.09 0.00 0.00 0.00 0.00 54.91 55.15 3gaf h ALA 50 Cb 0.06 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3gaf h ALA 50 CO -0.11 -0.31 -0.19 0.28 0.00 0.00 0.00 179.25 178.93 3gaf h VAL 51 N 0.33 1.31 -0.64 0.00 2.07 -1.37 -1.68 116.25 116.27 3gaf h VAL 51 Ca 0.44 -1.33 0.06 0.00 0.82 0.00 0.00 66.70 66.69 3gaf h VAL 51 Cb 0.74 1.66 -0.06 0.00 -1.52 0.00 0.00 31.29 32.11 3gaf h VAL 51 CO -0.49 0.41 0.34 0.00 0.02 0.00 0.00 177.57 177.86 3gaf h ALA 52 N 0.68 0.86 -0.01 1.67 0.00 -0.88 -2.01 119.26 119.57 3gaf h ALA 52 Ca 0.04 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3gaf h ALA 52 Cb 0.73 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 3gaf h ALA 52 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.31 3gaf h ALA 53 N 1.35 0.01 0.00 0.00 0.00 -0.64 -2.09 119.26 117.89 3gaf h ALA 53 Ca 0.29 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 3gaf h ALA 53 Cb 0.21 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 3gaf h ALA 53 CO -0.19 -0.43 -0.02 0.00 0.00 0.00 0.00 179.25 178.61 3gaf h ALA 54 N 0.88 1.74 0.10 0.00 0.00 -1.16 0.60 119.26 121.42 3gaf h ALA 54 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3gaf h ALA 54 Cb 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3gaf h ALA 54 CO -0.00 0.02 -0.05 0.82 0.00 0.00 0.00 179.25 180.04 3gaf h ILE 55 N 0.00 1.11 -0.73 0.00 2.04 -1.11 -2.21 117.51 116.61 3gaf h ILE 55 Ca -0.00 -1.19 0.10 0.00 1.00 0.00 0.00 64.86 64.77 3gaf h ILE 55 Cb 0.04 1.81 -0.07 0.00 -0.74 0.00 0.00 36.82 37.86 3gaf h ILE 55 CO 0.00 0.27 0.36 0.03 0.00 0.00 0.00 178.15 178.81 3gaf h ARG 56 N -0.73 0.58 -0.48 2.37 3.08 -0.71 -0.37 114.38 118.11 3gaf h ARG 56 Ca -0.01 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.04 3gaf h ARG 56 Cb 0.55 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.43 3gaf h ARG 56 CO 0.02 0.38 0.26 1.96 -1.07 0.00 0.00 179.97 181.53 3gaf h GLN 57 N 0.60 0.49 0.00 0.04 1.08 -0.97 -1.15 115.11 115.20 3gaf h GLN 57 Ca 0.36 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.53 3gaf h GLN 57 Cb 0.41 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.72 3gaf h GLN 57 CO -0.28 0.33 -0.00 0.00 -0.95 0.00 0.00 178.83 177.92 3gaf h ALA 58 N 1.24 1.01 0.00 3.87 0.00 -0.57 -3.46 119.26 121.36 3gaf h ALA 58 Ca 0.20 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3gaf h ALA 58 Cb 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3gaf h ALA 58 CO -0.13 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.54 3gaf n GLY 59 N -0.62 1.84 3.37 0.00 0.00 -0.27 -5.08 105.19 104.42 3gaf n GLY 59 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 3gaf n GLY 59 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gaf s GLY 60 N -2.00 1.52 -0.07 -0.02 0.00 -0.48 -4.97 107.32 101.29 3gaf s GLY 60 Ca 0.00 -1.71 -0.23 0.00 0.00 0.00 0.00 44.72 42.78 3gaf s GLY 60 CO 0.00 -1.80 0.70 1.25 0.00 0.00 0.00 173.10 173.25 3gaf s LYS 61 N -3.62 4.43 -0.04 2.90 2.20 -1.26 -3.20 119.74 121.14 3gaf s LYS 61 Ca 0.24 0.87 -0.29 0.00 -0.36 0.00 0.00 55.97 56.43 3gaf s LYS 61 Cb -0.01 -3.45 0.11 0.00 -1.51 0.00 0.00 37.83 32.96 3gaf s LYS 61 CO 0.08 0.05 0.90 0.00 -0.36 0.00 0.00 175.35 176.03 3gaf s ALA 62 N 0.84 -1.84 0.01 3.13 0.00 -1.26 -1.62 121.76 121.02 3gaf s ALA 62 Ca 0.37 1.16 -0.03 0.00 0.00 0.00 0.00 51.96 53.45 3gaf s ALA 62 Cb -0.18 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.07 3gaf s ALA 62 CO 0.18 -0.58 0.05 0.96 0.00 0.00 0.00 175.76 176.37 3gaf s ILE 63 N -2.56 0.10 -0.11 0.00 -4.36 -0.24 -4.93 121.20 109.09 3gaf s ILE 63 Ca 0.02 -0.79 0.02 0.00 -0.26 0.00 0.00 60.65 59.65 3gaf s ILE 63 Cb -0.01 -0.34 -0.00 0.00 1.25 0.00 0.00 42.46 43.36 3gaf s ILE 63 CO -0.06 -0.43 -0.20 -0.83 0.24 0.00 0.00 174.94 173.66 3gaf s GLY 64 N -1.40 1.40 0.08 6.27 0.00 -1.26 -0.54 107.32 111.88 3gaf s GLY 64 Ca -0.15 -0.96 0.06 0.00 0.00 0.00 0.00 44.72 43.67 3gaf s GLY 64 CO 0.00 -0.25 -0.16 1.08 0.00 0.00 0.00 173.10 173.77 3gaf s LEU 65 N 0.40 2.29 0.11 0.66 1.43 0.70 -4.55 118.68 119.72 3gaf s LEU 65 Ca -0.15 -0.64 -0.31 0.00 -1.03 0.00 0.00 54.13 52.00 3gaf s LEU 65 Cb -0.17 -0.63 -0.07 0.00 0.03 0.00 0.00 46.19 45.35 3gaf s LEU 65 CO 0.07 -0.04 1.30 -0.70 0.23 0.00 0.00 176.35 177.21 3gaf s GLU 66 N -1.82 4.38 -0.20 1.70 2.12 -1.26 -1.72 118.70 121.90 3gaf s GLU 66 Ca 0.01 1.95 -0.04 0.00 0.36 0.00 0.00 54.97 57.25 3gaf s GLU 66 Cb -0.10 -3.28 0.10 0.00 0.26 0.00 0.00 34.13 31.12 3gaf s GLU 66 CO 0.03 -0.33 0.33 0.00 -0.54 0.00 0.00 175.26 174.75 3gaf s ASN 68 N 2.49 6.43 0.10 0.00 3.84 -1.26 -3.57 114.94 122.97 3gaf s ASN 68 Ca 0.06 -0.04 0.16 0.00 0.21 0.00 0.00 52.86 53.25 3gaf s ASN 68 Cb -0.14 -2.49 0.68 0.00 -0.55 0.00 0.00 41.25 38.75 3gaf s ASN 68 CO -0.13 -1.28 1.48 1.33 -2.79 0.00 0.00 177.10 175.71 3gaf n VAL 69 N 6.46 1.10 -0.20 -5.21 0.24 -1.26 -1.33 118.33 118.12 3gaf n VAL 69 Ca 0.06 0.32 -0.04 0.00 -2.04 0.00 0.00 64.34 62.64 3gaf n VAL 69 Cb 0.48 -1.18 0.18 0.00 -1.47 0.00 0.00 33.84 31.86 3gaf n VAL 69 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3gaf n THR 70 N -1.77 1.93 -3.91 3.34 -2.24 -1.26 -4.62 114.28 105.75 3gaf n THR 70 Ca 0.02 -0.96 -0.29 0.00 -2.27 0.00 0.00 64.05 60.55 3gaf n THR 70 Cb 0.15 -0.51 -0.16 0.00 -2.10 0.00 0.00 70.33 67.71 3gaf n THR 70 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3gaf s ASP 71 N -0.41 2.96 0.43 3.42 -1.08 -0.44 -5.03 116.67 116.52 3gaf s ASP 71 Ca 0.33 -0.71 0.12 0.00 -0.52 0.00 0.00 52.55 51.76 3gaf s ASP 71 Cb 0.26 -0.98 0.93 0.00 -1.46 0.00 0.00 42.92 41.67 3gaf s ASP 71 CO 0.08 -0.18 1.98 -0.08 0.52 0.00 0.00 175.17 177.50 3gaf h GLU 72 N 8.09 0.13 0.18 4.34 4.57 -1.87 0.30 114.58 130.32 3gaf h GLU 72 Ca -0.25 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 57.90 3gaf h GLU 72 Cb 1.11 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.68 3gaf h GLU 72 CO 0.42 0.25 -0.09 1.96 -1.18 0.00 0.00 179.01 180.38 3gaf h GLN 73 N 0.13 -0.23 -0.89 1.92 7.50 -1.95 -2.60 115.11 118.99 3gaf h GLN 73 Ca 0.03 0.02 0.16 0.00 0.50 0.00 0.00 58.65 59.36 3gaf h GLN 73 Cb 0.28 0.05 -0.10 0.00 0.05 0.00 0.00 27.48 27.77 3gaf h GLN 73 CO 0.02 0.17 0.47 0.45 -1.50 0.00 0.00 178.83 178.43 3gaf h HIS 74 N -0.75 0.82 -0.14 2.96 3.86 -1.70 -1.31 115.15 118.89 3gaf h HIS 74 Ca -0.02 0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 3gaf h HIS 74 Cb 0.51 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 3gaf h HIS 74 CO 0.06 0.17 0.08 0.00 0.86 0.00 0.00 177.93 179.10 3gaf h ARG 75 N 0.63 0.19 0.00 2.45 3.08 -0.45 -2.54 114.38 117.73 3gaf h ARG 75 Ca 0.50 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 60.40 3gaf h ARG 75 Cb 0.75 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.75 3gaf h ARG 75 CO -0.39 0.19 -0.62 0.93 -1.07 0.00 0.00 179.97 179.01 3gaf h GLU 76 N 0.13 0.00 -0.68 0.04 5.08 -1.11 -2.84 114.58 115.20 3gaf h GLU 76 Ca 0.05 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3gaf h GLU 76 Cb 0.06 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 3gaf h GLU 76 CO -0.01 0.62 0.35 0.00 -1.00 0.00 0.00 179.01 178.97 3gaf h ALA 77 N 1.38 0.88 -0.43 3.43 0.00 -1.19 -1.50 119.26 121.82 3gaf h ALA 77 Ca -0.01 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3gaf h ALA 77 Cb 1.18 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3gaf h ALA 77 CO 0.08 0.42 0.28 0.28 0.00 0.00 0.00 179.25 180.31 3gaf h VAL 78 N 0.94 1.12 0.68 0.00 2.07 -1.22 0.04 116.25 119.88 3gaf h VAL 78 Ca 0.24 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 3gaf h VAL 78 Cb 0.08 0.51 0.01 0.00 -1.52 0.00 0.00 31.29 30.37 3gaf h VAL 78 CO -0.03 0.12 -0.33 0.40 0.02 0.00 0.00 177.57 177.75 3gaf h ILE 79 N 0.58 0.32 -0.36 4.57 1.08 -1.37 -1.10 117.51 121.23 3gaf h ILE 79 Ca 0.16 -0.04 0.07 0.00 -0.39 0.00 0.00 64.86 64.66 3gaf h ILE 79 Cb -0.04 0.33 -0.07 0.00 -3.07 0.00 0.00 36.82 33.98 3gaf h ILE 79 CO -0.03 0.01 -0.06 0.11 -0.69 0.00 0.00 178.15 177.48 3gaf h LYS 80 N -0.94 0.03 0.00 2.37 6.56 -1.23 -1.07 116.57 122.28 3gaf h LYS 80 Ca -0.09 -0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.47 3gaf h LYS 80 Cb 0.71 -0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 32.36 3gaf h LYS 80 CO 0.15 0.02 -0.11 0.00 -2.06 0.00 0.00 179.45 177.45 3gaf h ALA 81 N 1.35 1.66 -0.18 3.86 0.00 -0.95 0.11 119.26 125.11 3gaf h ALA 81 Ca 0.17 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3gaf h ALA 81 Cb 0.26 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3gaf h ALA 81 CO -0.35 0.13 -0.25 0.00 0.00 0.00 0.00 179.25 178.79 3gaf h ALA 82 N 1.89 0.27 -0.20 0.00 0.00 -0.26 -3.11 119.26 117.86 3gaf h ALA 82 Ca -0.00 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 3gaf h ALA 82 Cb 0.21 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3gaf h ALA 82 CO 0.01 0.25 -0.18 -0.07 0.00 0.00 0.00 179.25 179.25 3gaf h LEU 83 N 0.13 0.51 -0.05 0.00 3.38 -0.01 -1.60 115.31 117.67 3gaf h LEU 83 Ca 0.02 -0.47 0.02 0.00 0.09 0.00 0.00 57.88 57.54 3gaf h LEU 83 Cb 0.82 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 3gaf h LEU 83 CO 0.06 0.87 -0.10 0.44 0.09 0.00 0.00 178.44 179.80 3gaf h ASP 84 N 0.15 -0.30 -0.06 -0.43 3.32 -0.98 -0.98 116.42 117.14 3gaf h ASP 84 Ca 0.03 0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 3gaf h ASP 84 Cb 0.72 0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 3gaf h ASP 84 CO 0.05 -0.14 -0.03 -0.61 -1.72 0.00 0.00 179.24 176.79 3gaf h GLN 85 N -0.15 0.13 0.00 3.56 5.75 -1.53 -3.39 115.11 119.48 3gaf h GLN 85 Ca 0.06 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3gaf h GLN 85 Cb 0.22 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.77 3gaf h GLN 85 CO -0.14 0.51 -0.53 1.19 -2.65 0.00 0.00 178.83 177.22 3gaf n PHE 86 N -4.78 0.00 -0.17 3.99 3.72 -0.61 -5.03 117.46 114.57 3gaf n PHE 86 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 3gaf n PHE 86 Cb 0.25 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 3gaf n PHE 86 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gaf n GLY 87 N 1.44 0.62 0.00 1.37 0.00 -0.37 -5.00 105.19 103.25 3gaf n GLY 87 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3gaf n GLY 87 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3gaf n LYS 88 N -2.02 0.00 -4.37 1.61 2.85 -1.26 -4.99 118.16 109.98 3gaf n LYS 88 Ca 0.00 0.00 -0.26 0.00 -1.05 0.00 0.00 58.31 57.00 3gaf n LYS 88 Cb 0.00 0.00 -0.17 0.00 -0.65 0.00 0.00 35.03 34.21 3gaf n LYS 88 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 3gaf s ILE 89 N -2.00 1.18 0.00 0.58 1.01 -1.26 -4.62 121.20 116.09 3gaf s ILE 89 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.19 3gaf s ILE 89 Cb 0.00 -1.11 0.00 0.00 0.01 0.00 0.00 42.46 41.36 3gaf s ILE 89 CO 0.00 0.38 0.00 1.07 0.00 0.00 0.00 174.94 176.39 3gaf n THR 90 N 4.20 0.00 -4.27 2.92 5.66 -0.29 -3.38 114.28 119.12 3gaf n THR 90 Ca -0.19 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.60 3gaf n THR 90 Cb 0.51 -0.84 -0.16 0.00 -1.55 0.00 0.00 70.33 68.29 3gaf n THR 90 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 3gaf s VAL 91 N -1.86 0.66 -0.13 1.08 1.01 0.55 -1.99 120.40 119.72 3gaf s VAL 91 Ca 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.77 3gaf s VAL 91 Cb 0.00 -0.65 0.02 0.00 0.00 0.00 0.00 36.38 35.75 3gaf s VAL 91 CO 0.00 0.24 -0.15 -0.22 0.00 0.00 0.00 175.10 174.97 3gaf s LEU 92 N 0.71 1.73 -0.33 3.92 2.96 -0.67 -0.56 118.68 126.44 3gaf s LEU 92 Ca -0.11 -0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.32 3gaf s LEU 92 Cb -0.13 -1.17 0.08 0.00 0.50 0.00 0.00 46.19 45.46 3gaf s LEU 92 CO 0.01 -0.02 0.05 -0.69 -1.32 0.00 0.00 176.35 174.39 3gaf s VAL 93 N 1.23 2.89 -1.00 1.68 1.01 0.45 -0.58 120.40 126.08 3gaf s VAL 93 Ca -0.01 -1.74 -0.20 0.00 0.00 0.00 0.00 61.98 60.03 3gaf s VAL 93 Cb -0.14 -2.83 0.10 0.00 0.00 0.00 0.00 36.38 33.51 3gaf s VAL 93 CO -0.06 -0.34 1.32 0.20 0.00 0.00 0.00 175.10 176.21 3gaf s ASN 94 N 1.35 6.61 -0.03 3.32 -0.87 0.87 -2.20 114.94 123.99 3gaf s ASN 94 Ca 0.01 -1.87 0.19 0.00 -1.57 0.00 0.00 52.86 49.62 3gaf s ASN 94 Cb -0.21 -2.48 -0.30 0.00 -0.02 0.00 0.00 41.25 38.25 3gaf s ASN 94 CO -0.03 -1.24 0.42 -3.20 -2.57 0.00 0.00 177.10 170.48 3gaf n ASN 95 N 7.59 0.62 -4.72 -1.22 4.05 -1.26 -1.29 115.26 119.03 3gaf n ASN 95 Ca 0.30 -0.01 -0.42 0.00 0.45 0.00 0.00 54.58 54.90 3gaf n ASN 95 Cb 0.49 1.87 -0.03 0.00 1.23 0.00 0.00 39.78 43.34 3gaf n ASN 95 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3gaf s ALA 96 N -3.33 3.65 -0.08 5.20 0.00 -1.24 -4.80 121.76 121.17 3gaf s ALA 96 Ca -0.07 1.23 -0.30 0.00 0.00 0.00 0.00 51.96 52.82 3gaf s ALA 96 Cb 0.12 -3.56 0.10 0.00 0.00 0.00 0.00 23.12 19.78 3gaf s ALA 96 CO 0.80 -0.68 1.36 0.20 0.00 0.00 0.00 175.76 177.43 3gaf s GLY 97 N 0.92 -0.20 0.00 0.00 0.00 -1.26 -4.81 107.32 101.97 3gaf s GLY 97 Ca 0.65 0.13 0.00 0.00 0.00 0.00 0.00 44.72 45.50 3gaf s GLY 97 CO 0.33 6.74 0.00 0.61 0.00 0.00 0.00 173.10 180.79 3gaf n GLY 98 N -0.97 1.36 0.00 0.20 0.00 -1.26 -5.01 105.19 99.50 3gaf n GLY 98 Ca 0.06 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.29 3gaf n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gaf n GLY 99 N 0.00 0.56 0.00 -0.02 0.00 -1.26 -4.83 105.19 99.63 3gaf n GLY 99 Ca 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.00 3gaf n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gaf n GLY 100 N 0.57 1.04 3.66 -0.02 0.00 -1.26 -5.07 105.19 104.11 3gaf n GLY 100 Ca 0.00 -0.43 -0.46 0.00 0.00 0.00 0.00 46.02 45.13 3gaf n GLY 100 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3gaf n PRO 101 N 0.00 1.99 -3.78 1.61 -0.02 -1.26 -4.52 135.00 129.02 3gaf n PRO 101 Ca 0.00 0.71 -0.13 0.00 -2.02 0.00 0.00 63.50 62.07 3gaf n PRO 101 Cb 0.00 -2.41 -0.11 0.00 -0.02 0.00 0.00 33.50 30.97 3gaf n PRO 101 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3gaf s LYS 102 N 0.15 0.42 0.74 -0.52 1.02 -0.49 -5.04 119.74 116.02 3gaf s LYS 102 Ca 0.73 0.21 -0.15 0.00 0.02 0.00 0.00 55.97 56.79 3gaf s LYS 102 Cb -0.69 0.20 0.04 0.00 -0.52 0.00 0.00 37.83 36.86 3gaf s LYS 102 CO 0.45 -0.08 1.21 -1.25 -0.92 0.00 0.00 175.35 174.76 3gaf s PRO 103 N -0.29 2.07 0.23 -1.68 0.04 -1.26 -4.15 135.00 129.97 3gaf s PRO 103 Ca -0.04 1.76 -0.06 0.00 0.04 0.00 0.00 61.00 62.70 3gaf s PRO 103 Cb -0.03 -1.83 0.40 0.00 0.04 0.00 0.00 34.50 33.08 3gaf s PRO 103 CO 0.01 -1.89 1.74 0.35 0.04 0.00 0.00 177.00 177.26 3gaf h PHE 104 N -0.38 0.51 -0.12 0.56 3.57 -2.00 -1.99 116.94 117.09 3gaf h PHE 104 Ca -0.47 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.04 3gaf h PHE 104 Cb 1.30 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.90 3gaf h PHE 104 CO 0.47 0.10 0.03 -0.40 -2.23 0.00 0.00 178.31 176.28 3gaf n ASP 105 N -4.98 2.17 -4.44 0.41 5.68 -1.26 -4.96 116.55 109.17 3gaf n ASP 105 Ca 0.13 -2.19 -0.37 0.00 -0.50 0.00 0.00 54.79 51.86 3gaf n ASP 105 Cb 0.36 -0.54 0.06 0.00 -1.14 0.00 0.00 41.12 39.86 3gaf n ASP 105 CO 0.00 0.00 0.00 1.15 -1.33 0.00 0.00 177.20 177.02 3gaf n MET 106 N 0.14 0.31 -1.73 0.11 0.00 -0.75 -4.96 117.12 110.24 3gaf n MET 106 Ca 0.06 0.14 -0.40 0.00 0.00 0.00 0.00 57.70 57.50 3gaf n MET 106 Cb 0.49 -1.74 0.02 0.00 0.00 0.00 0.00 33.22 32.00 3gaf n MET 106 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 3gaf n PRO 107 N -0.39 1.96 0.25 3.17 -0.04 -1.26 -4.91 135.00 133.78 3gaf n PRO 107 Ca 0.10 0.70 0.07 0.00 -0.04 0.00 0.00 63.50 64.34 3gaf n PRO 107 Cb 0.49 -2.52 0.61 0.00 -0.04 0.00 0.00 33.50 32.04 3gaf n PRO 107 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 3gaf h MET 108 N 1.94 0.02 -0.95 0.54 2.86 -2.00 -1.10 114.93 116.24 3gaf h MET 108 Ca -0.50 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.16 3gaf h MET 108 Cb 1.29 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.90 3gaf h MET 108 CO 0.59 0.04 0.63 0.66 1.06 0.00 0.00 176.91 179.89 3gaf h SER 109 N 0.02 1.08 0.14 1.22 4.64 -1.99 0.79 113.55 119.46 3gaf h SER 109 Ca 0.01 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3gaf h SER 109 Cb 0.04 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.86 3gaf h SER 109 CO 0.00 0.78 -0.10 0.44 -0.87 0.00 0.00 176.83 177.08 3gaf h ASP 110 N 1.28 -0.25 -0.50 4.97 3.32 -1.58 -1.18 116.42 122.48 3gaf h ASP 110 Ca 0.36 0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.49 3gaf h ASP 110 Cb -0.12 0.08 -0.05 0.00 0.22 0.00 0.00 39.33 39.46 3gaf h ASP 110 CO -0.09 -0.16 0.20 0.15 -1.72 0.00 0.00 179.24 177.62 3gaf h PHE 111 N -0.24 0.35 -0.12 4.55 3.57 -1.13 -2.53 116.94 121.39 3gaf h PHE 111 Ca -0.01 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.37 3gaf h PHE 111 Cb 0.21 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3gaf h PHE 111 CO -0.10 0.13 -0.55 0.93 -2.23 0.00 0.00 178.31 176.50 3gaf h GLU 112 N 0.39 0.34 -0.22 1.11 5.08 -0.80 -2.82 114.58 117.67 3gaf h GLU 112 Ca 0.23 -0.21 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 3gaf h GLU 112 Cb 0.22 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3gaf h GLU 112 CO -0.22 0.80 -0.17 2.35 -1.00 0.00 0.00 179.01 180.77 3gaf h TRP 113 N 0.27 0.41 -0.40 4.33 2.91 -0.91 -0.76 115.95 121.79 3gaf h TRP 113 Ca 0.00 -0.06 0.07 0.00 1.13 0.00 0.00 58.89 60.03 3gaf h TRP 113 Cb 1.04 -0.11 -0.06 0.00 -0.51 0.00 0.00 29.16 29.52 3gaf h TRP 113 CO 0.03 0.54 0.03 0.00 -1.03 0.00 0.00 178.44 178.01 3gaf h ALA 114 N 1.48 0.40 -0.34 2.65 0.00 -1.19 -0.09 119.26 122.17 3gaf h ALA 114 Ca 0.06 0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 3gaf h ALA 114 Cb 0.50 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3gaf h ALA 114 CO 0.03 -0.36 -0.41 0.74 0.00 0.00 0.00 179.25 179.25 3gaf h PHE 115 N 0.15 1.01 0.18 0.00 0.04 -1.48 -0.53 116.94 116.31 3gaf h PHE 115 Ca 0.20 -0.31 0.00 0.00 2.80 0.00 0.00 57.97 60.66 3gaf h PHE 115 Cb 0.26 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 3gaf h PHE 115 CO -0.24 1.11 -0.15 0.87 -0.60 0.00 0.00 178.31 179.29 3gaf h LYS 116 N 0.68 -0.34 0.08 1.51 1.79 -0.59 0.39 116.57 120.09 3gaf h LYS 116 Ca 0.05 0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.54 3gaf h LYS 116 Cb 0.98 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 3gaf h LYS 116 CO 0.09 -0.23 -0.04 1.25 -1.08 0.00 0.00 179.45 179.45 3gaf h LEU 117 N -0.35 -0.09 0.13 2.94 5.85 -1.05 -1.31 115.31 121.43 3gaf h LEU 117 Ca -0.00 -0.46 -0.28 0.00 0.84 0.00 0.00 57.88 57.98 3gaf h LEU 117 Cb 0.32 0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.38 3gaf h LEU 117 CO -0.02 0.45 -1.26 0.78 -0.34 0.00 0.00 178.44 178.05 3gaf h ASN 118 N -0.67 0.46 0.00 1.25 2.35 -1.15 -3.39 115.58 114.43 3gaf h ASN 118 Ca -0.01 -0.49 -0.04 0.00 -0.55 0.00 0.00 56.30 55.21 3gaf h ASN 118 Cb 0.54 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 3gaf h ASN 118 CO 0.02 1.38 -0.68 -0.11 -1.65 0.00 0.00 177.43 176.39 3gaf n LEU 119 N -3.55 1.40 -0.13 1.61 7.94 0.35 -4.49 117.00 120.12 3gaf n LEU 119 Ca -0.09 0.22 -0.04 0.00 -1.11 0.00 0.00 56.01 54.99 3gaf n LEU 119 Cb 1.03 -0.50 0.03 0.00 0.53 0.00 0.00 43.42 44.51 3gaf n LEU 119 CO 0.54 -0.40 0.83 -0.26 -1.11 0.00 0.00 177.39 177.00 3gaf h PHE 120 N -0.46 -0.07 0.13 1.96 0.04 -0.37 -1.88 116.94 116.29 3gaf h PHE 120 Ca -0.06 0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.76 3gaf h PHE 120 Cb 0.60 0.10 -0.05 0.00 2.20 0.00 0.00 35.95 38.80 3gaf h PHE 120 CO -0.17 -0.11 -0.47 0.66 -0.60 0.00 0.00 178.31 177.62 3gaf h SER 121 N 0.08 -1.39 0.69 2.17 4.64 -1.43 -2.50 113.55 115.80 3gaf h SER 121 Ca 0.21 0.15 -0.04 0.00 -0.47 0.00 0.00 61.79 61.65 3gaf h SER 121 Cb 0.31 0.52 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 3gaf h SER 121 CO -0.38 -0.53 -0.17 0.17 -0.87 0.00 0.00 176.83 175.05 3gaf h LEU 122 N -0.71 0.00 -0.40 5.97 8.10 -1.72 -2.49 115.31 124.06 3gaf h LEU 122 Ca 0.01 0.00 -0.18 0.00 0.11 0.00 0.00 57.88 57.82 3gaf h LEU 122 Cb 0.72 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.94 3gaf h LEU 122 CO -0.26 0.17 -0.62 0.15 -4.11 0.00 0.00 178.44 173.78 3gaf h PHE 123 N 0.00 0.80 0.44 0.17 3.57 -1.10 -2.53 116.94 118.29 3gaf h PHE 123 Ca -0.00 -0.31 -0.02 0.00 3.53 0.00 0.00 57.97 61.17 3gaf h PHE 123 Cb 0.56 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.17 3gaf h PHE 123 CO 0.00 1.08 -0.21 -0.09 -2.23 0.00 0.00 178.31 176.86 3gaf h ARG 124 N 0.46 -0.57 -0.72 1.11 9.65 -1.06 -2.26 114.38 120.99 3gaf h ARG 124 Ca -0.01 0.04 0.16 0.00 -1.10 0.00 0.00 59.98 59.07 3gaf h ARG 124 Cb 1.20 0.13 -0.12 0.00 -1.39 0.00 0.00 29.97 29.78 3gaf h ARG 124 CO 0.12 -0.28 0.04 -0.07 2.80 0.00 0.00 179.97 182.58 3gaf h LEU 125 N -0.83 -0.26 -0.50 3.80 3.38 -1.56 0.30 115.31 119.63 3gaf h LEU 125 Ca -0.06 0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.14 3gaf h LEU 125 Cb 0.56 0.30 -0.05 0.00 0.09 0.00 0.00 40.66 41.56 3gaf h LEU 125 CO 0.10 -0.14 0.22 0.28 0.09 0.00 0.00 178.44 178.99 3gaf h SER 126 N 0.13 0.28 -0.27 -0.43 0.02 -1.39 0.61 113.55 112.49 3gaf h SER 126 Ca 0.40 0.04 0.01 0.00 -0.84 0.00 0.00 61.79 61.40 3gaf h SER 126 Cb 0.69 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.21 3gaf h SER 126 CO -0.61 0.20 0.17 1.56 -1.14 0.00 0.00 176.83 177.00 3gaf h GLN 127 N 0.43 0.33 -0.23 3.45 4.20 -0.50 -0.93 115.11 121.86 3gaf h GLN 127 Ca 0.23 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.91 3gaf h GLN 127 Cb 0.19 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 3gaf h GLN 127 CO -0.20 0.22 0.10 -0.07 -0.67 0.00 0.00 178.83 178.21 3gaf h LEU 128 N 0.34 0.31 -0.85 1.46 3.38 0.31 -3.18 115.31 117.09 3gaf h LEU 128 Ca 0.10 -0.15 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 3gaf h LEU 128 Cb -0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3gaf h LEU 128 CO -0.04 0.38 -0.42 0.00 0.09 0.00 0.00 178.44 178.45 3gaf h ALA 129 N 0.95 1.02 -0.08 1.53 0.00 0.26 -3.38 119.26 119.55 3gaf h ALA 129 Ca 0.08 -0.43 0.03 0.00 0.00 0.00 0.00 54.91 54.59 3gaf h ALA 129 Cb 0.16 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3gaf h ALA 129 CO -0.01 0.61 -0.13 0.00 0.00 0.00 0.00 179.25 179.72 3gaf h ALA 130 N 1.28 -0.09 -0.36 0.00 0.00 -1.14 -2.92 119.26 116.04 3gaf h ALA 130 Ca 0.02 0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.01 3gaf h ALA 130 Cb 0.86 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3gaf h ALA 130 CO 0.07 -0.60 0.24 -1.35 0.00 0.00 0.00 179.25 177.61 3gaf h PRO 131 N -0.19 0.31 -0.09 0.00 0.11 -1.75 -0.59 132.00 129.81 3gaf h PRO 131 Ca 0.07 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 66.04 3gaf h PRO 131 Cb 0.29 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 3gaf h PRO 131 CO -0.19 0.20 -0.49 0.45 -0.21 0.00 0.00 178.00 177.77 3gaf h HIS 132 N 0.32 0.28 -0.13 0.65 3.86 -1.77 -1.52 115.15 116.84 3gaf h HIS 132 Ca 0.15 -0.09 -0.18 0.00 -1.16 0.00 0.00 60.37 59.09 3gaf h HIS 132 Cb 0.21 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.62 3gaf h HIS 132 CO -0.00 0.67 -0.68 0.52 0.86 0.00 0.00 177.93 179.31 3gaf h MET 133 N 0.18 0.54 -0.39 2.45 2.86 -1.04 -2.45 114.93 117.09 3gaf h MET 133 Ca 0.01 -0.40 -0.06 0.00 -2.06 0.00 0.00 59.70 57.19 3gaf h MET 133 Cb 0.93 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 3gaf h MET 133 CO 0.07 1.03 0.02 0.37 1.06 0.00 0.00 176.91 179.46 3gaf h GLN 134 N 0.38 0.68 0.00 1.72 4.15 -1.22 0.13 115.11 120.95 3gaf h GLN 134 Ca -0.02 -0.21 0.00 0.00 0.77 0.00 0.00 58.65 59.19 3gaf h GLN 134 Cb 1.25 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.88 3gaf h GLN 134 CO 0.13 0.76 0.00 -0.22 -1.93 0.00 0.00 178.83 177.56 3gaf h LYS 135 N 0.51 0.00 -0.71 1.69 3.64 -1.14 0.96 116.57 121.52 3gaf h LYS 135 Ca 0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 3gaf h LYS 135 Cb 0.44 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 3gaf h LYS 135 CO 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.20 3gaf n ALA 136 N -1.84 2.64 -2.10 5.00 0.00 -0.93 -4.95 120.51 118.33 3gaf n ALA 136 Ca 0.00 -1.42 -0.13 0.00 0.00 0.00 0.00 53.44 51.90 3gaf n ALA 136 Cb 0.17 -0.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.64 3gaf n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gaf n GLY 137 N 1.46 0.10 0.00 0.00 0.00 0.33 -4.93 105.19 102.15 3gaf n GLY 137 Ca 0.25 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3gaf n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gaf n GLY 138 N -1.08 3.31 2.70 -0.02 0.00 0.44 -4.98 105.19 105.57 3gaf n GLY 138 Ca -0.15 -1.87 0.02 0.00 0.00 0.00 0.00 46.02 44.02 3gaf n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gaf n GLY 139 N -1.42 0.36 2.96 -0.02 0.00 -0.95 -4.69 105.19 101.42 3gaf n GLY 139 Ca 0.00 -0.98 -0.13 0.00 0.00 0.00 0.00 46.02 44.91 3gaf n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gaf s ALA 140 N -1.68 -0.36 -0.11 4.61 0.00 -0.84 -1.61 121.76 121.77 3gaf s ALA 140 Ca 0.20 0.78 -0.05 0.00 0.00 0.00 0.00 51.96 52.90 3gaf s ALA 140 Cb -0.01 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 3gaf s ALA 140 CO -0.00 -0.22 0.08 0.42 0.00 0.00 0.00 175.76 176.03 3gaf s ILE 141 N 1.34 4.95 -0.07 0.00 1.01 0.15 -1.67 121.20 126.90 3gaf s ILE 141 Ca -0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 60.65 60.55 3gaf s ILE 141 Cb -0.11 -3.13 0.03 0.00 0.01 0.00 0.00 42.46 39.26 3gaf s ILE 141 CO -0.07 0.61 -0.00 -0.22 0.00 0.00 0.00 174.94 175.26 3gaf s LEU 142 N -0.91 0.63 -0.19 2.97 2.96 0.25 -1.87 118.68 122.51 3gaf s LEU 142 Ca 0.14 -0.10 -0.07 0.00 -0.22 0.00 0.00 54.13 53.88 3gaf s LEU 142 Cb -0.12 -0.47 -0.04 0.00 0.50 0.00 0.00 46.19 46.07 3gaf s LEU 142 CO 0.03 -0.19 0.06 0.20 -1.32 0.00 0.00 176.35 175.13 3gaf s ASN 143 N 1.95 5.49 -0.55 3.68 0.01 -0.41 -0.09 114.94 125.03 3gaf s ASN 143 Ca 0.05 0.02 -0.21 0.00 -0.71 0.00 0.00 52.86 52.01 3gaf s ASN 143 Cb -0.12 -1.95 0.06 0.00 0.41 0.00 0.00 41.25 39.65 3gaf s ASN 143 CO -0.05 0.14 0.78 -0.63 -1.51 0.00 0.00 177.10 175.82 3gaf s ILE 144 N 0.58 4.65 0.00 0.60 -1.09 -0.41 -1.12 121.20 124.40 3gaf s ILE 144 Ca 0.03 -0.32 0.00 0.00 -2.23 0.00 0.00 60.65 58.13 3gaf s ILE 144 Cb -0.13 -4.45 0.00 0.00 -1.58 0.00 0.00 42.46 36.30 3gaf s ILE 144 CO 0.01 -1.03 0.00 -0.24 -1.23 0.00 0.00 174.94 172.45 3gaf n SER 145 N 6.79 0.00 -3.94 3.58 2.88 0.15 -4.84 113.62 118.24 3gaf n SER 145 Ca -0.04 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.41 3gaf n SER 145 Cb 0.46 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.82 3gaf n SER 145 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3gaf s SER 146 N -1.00 0.19 0.46 -3.46 0.15 -1.26 -4.34 113.70 104.44 3gaf s SER 146 Ca 0.00 -0.55 0.23 0.00 0.70 0.00 0.00 55.95 56.32 3gaf s SER 146 Cb 0.00 0.22 1.12 0.00 -1.71 0.00 0.00 66.02 65.65 3gaf s SER 146 CO 0.00 -0.50 1.94 0.24 1.20 0.00 0.00 173.24 176.12 3gaf h MET 147 N 3.68 0.00 0.00 5.44 2.86 -1.86 -2.28 114.93 122.78 3gaf h MET 147 Ca -0.33 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 3gaf h MET 147 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 3gaf h MET 147 CO 0.51 0.22 0.21 0.00 1.06 0.00 0.00 176.91 178.90 3gaf h ALA 148 N 1.78 1.20 0.00 6.32 0.00 -1.93 -0.27 119.26 126.36 3gaf h ALA 148 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3gaf h ALA 148 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.32 3gaf h ALA 148 CO 0.03 -0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.49 3gaf n GLY 149 N -1.19 -1.31 0.00 0.00 0.00 -0.86 -3.69 105.19 98.14 3gaf n GLY 149 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3gaf n GLY 149 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3gaf n GLU 150 N -1.67 3.84 -2.60 1.61 4.07 -0.44 -4.21 120.64 121.24 3gaf n GLU 150 Ca 0.05 0.00 -0.22 0.00 -0.06 0.00 0.00 57.16 56.93 3gaf n GLU 150 Cb 0.27 -1.00 0.04 0.00 -0.06 0.00 0.00 31.44 30.70 3gaf n GLU 150 CO 0.00 0.00 0.00 -0.80 -0.06 0.00 0.00 177.13 176.27 3gaf s ASN 151 N -2.95 5.28 -0.06 4.31 0.01 -0.24 -5.10 114.94 116.18 3gaf s ASN 151 Ca 0.00 0.11 0.01 0.00 -0.71 0.00 0.00 52.86 52.27 3gaf s ASN 151 Cb 0.00 -1.00 0.02 0.00 0.41 0.00 0.00 41.25 40.68 3gaf s ASN 151 CO 0.00 -1.16 -0.06 0.42 -1.51 0.00 0.00 177.10 174.79 3gaf s THR 152 N -2.82 0.68 0.31 1.60 -4.23 -1.26 -4.81 115.64 105.12 3gaf s THR 152 Ca 0.57 -0.17 -0.09 0.00 -1.18 0.00 0.00 61.69 60.82 3gaf s THR 152 Cb -0.10 -0.71 0.01 0.00 1.34 0.00 0.00 72.50 73.04 3gaf s THR 152 CO 0.39 0.27 0.53 0.20 -0.54 0.00 0.00 174.62 175.48 3gaf s ASN 153 N 1.13 0.37 0.61 3.99 0.01 -1.26 -5.16 114.94 114.63 3gaf s ASN 153 Ca -0.07 -1.21 -0.16 0.00 -0.71 0.00 0.00 52.86 50.70 3gaf s ASN 153 Cb -0.14 0.67 -0.03 0.00 0.41 0.00 0.00 41.25 42.16 3gaf s ASN 153 CO -0.01 -1.31 1.08 0.54 -1.51 0.00 0.00 177.10 175.89 3gaf s VAL 154 N -3.28 3.56 -1.61 1.60 0.11 -1.26 -4.06 120.40 115.45 3gaf s VAL 154 Ca 0.25 0.76 -0.01 0.00 -2.93 0.00 0.00 61.98 60.05 3gaf s VAL 154 Cb -0.01 -3.28 0.00 0.00 -1.53 0.00 0.00 36.38 31.56 3gaf s VAL 154 CO 0.14 -0.41 0.17 0.54 -3.33 0.00 0.00 175.10 172.22 3gaf n ARG 155 N -2.05 -2.49 -0.13 1.54 1.74 -1.26 -4.88 116.66 109.13 3gaf n ARG 155 Ca 0.10 0.92 0.04 0.00 -0.77 0.00 0.00 57.85 58.13 3gaf n ARG 155 Cb 0.52 -5.56 0.05 0.00 -1.02 0.00 0.00 32.46 26.45 3gaf n ARG 155 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 3gaf n MET 156 N -3.17 1.29 -0.03 5.56 1.56 -1.26 -1.40 117.12 119.67 3gaf n MET 156 Ca -0.20 -1.62 -0.09 0.00 -0.27 0.00 0.00 57.70 55.53 3gaf n MET 156 Cb 0.66 -0.99 -0.03 0.00 2.15 0.00 0.00 33.22 35.01 3gaf n MET 156 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3gaf h ALA 157 N 0.00 0.16 0.17 -5.12 0.00 -1.87 0.35 119.26 112.95 3gaf h ALA 157 Ca 0.00 0.05 -0.33 0.00 0.00 0.00 0.00 54.91 54.63 3gaf h ALA 157 Cb 0.94 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.82 3gaf h ALA 157 CO 0.00 -0.43 -1.64 0.66 0.00 0.00 0.00 179.25 177.84 3gaf h SER 158 N 0.07 0.58 -0.02 0.00 4.64 -1.90 -3.23 113.55 113.68 3gaf h SER 158 Ca 0.08 -0.92 -0.20 0.00 -0.47 0.00 0.00 61.79 60.28 3gaf h SER 158 Cb 0.10 -0.19 0.02 0.00 -0.31 0.00 0.00 62.40 62.02 3gaf h SER 158 CO -0.14 1.74 -0.78 0.22 -0.87 0.00 0.00 176.83 177.01 3gaf h TYR 159 N 0.01 0.83 -0.24 4.77 3.20 -1.78 -2.81 116.97 120.94 3gaf h TYR 159 Ca -0.33 -0.43 -0.03 0.00 3.14 0.00 0.00 58.73 61.08 3gaf h TYR 159 Cb 2.02 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 40.18 3gaf h TYR 159 CO 0.11 1.26 0.03 0.78 -1.64 0.00 0.00 178.16 178.70 3gaf h GLY 160 N 0.17 0.42 1.89 1.82 0.00 -1.13 -2.53 103.07 103.72 3gaf h GLY 160 Ca -0.09 -0.29 -0.13 0.00 0.00 0.00 0.00 47.33 46.82 3gaf h GLY 160 CO 0.15 0.26 -0.58 1.48 0.00 0.00 0.00 176.54 177.86 3gaf h SER 161 N 0.19 0.12 -0.07 0.19 4.64 -1.64 -0.75 113.55 116.24 3gaf h SER 161 Ca 0.07 -0.07 -0.24 0.00 -0.47 0.00 0.00 61.79 61.09 3gaf h SER 161 Cb 0.33 -0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.40 3gaf h SER 161 CO 0.01 0.67 -0.87 0.77 -0.87 0.00 0.00 176.83 176.54 3gaf h SER 162 N 0.08 0.91 0.44 4.97 4.64 -1.54 -1.32 113.55 121.73 3gaf h SER 162 Ca -0.00 -0.64 -0.06 0.00 -0.47 0.00 0.00 61.79 60.62 3gaf h SER 162 Cb 1.04 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.85 3gaf h SER 162 CO 0.08 1.44 -0.28 0.11 -0.87 0.00 0.00 176.83 177.31 3gaf h LYS 163 N 0.48 0.00 -0.26 4.77 1.79 -1.38 -1.46 116.57 120.51 3gaf h LYS 163 Ca -0.08 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.29 3gaf h LYS 163 Cb 1.50 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 32.15 3gaf h LYS 163 CO 0.17 0.28 -0.24 0.00 -1.08 0.00 0.00 179.45 178.58 3gaf h ALA 164 N 1.72 0.38 -0.77 3.86 0.00 -0.97 -2.58 119.26 120.88 3gaf h ALA 164 Ca -0.00 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.55 3gaf h ALA 164 Cb 0.58 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 3gaf h ALA 164 CO 0.04 0.35 0.51 0.00 0.00 0.00 0.00 179.25 180.15 3gaf h ALA 165 N 0.69 1.51 -0.56 0.00 0.00 -1.04 -2.24 119.26 117.61 3gaf h ALA 165 Ca 0.04 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3gaf h ALA 165 Cb 0.80 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3gaf h ALA 165 CO 0.06 0.43 0.19 0.28 0.00 0.00 0.00 179.25 180.21 3gaf h VAL 166 N 0.99 1.23 -0.35 0.00 2.07 -1.23 0.52 116.25 119.48 3gaf h VAL 166 Ca 0.30 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 67.05 3gaf h VAL 166 Cb -0.01 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3gaf h VAL 166 CO -0.08 0.29 0.22 0.78 0.02 0.00 0.00 177.57 178.80 3gaf h ASN 167 N 0.78 0.42 0.80 0.57 2.35 -1.19 -1.66 115.58 117.65 3gaf h ASN 167 Ca 0.18 -0.04 -0.24 0.00 -0.55 0.00 0.00 56.30 55.65 3gaf h ASN 167 Cb 0.26 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3gaf h ASN 167 CO -0.01 0.33 -1.15 -0.74 -1.65 0.00 0.00 177.43 174.22 3gaf h HIS 168 N 0.46 0.24 -0.64 1.19 2.76 -1.33 -2.61 115.15 115.22 3gaf h HIS 168 Ca 0.13 -0.18 0.12 0.00 -2.20 0.00 0.00 60.37 58.24 3gaf h HIS 168 Cb -0.01 -0.01 -0.09 0.00 1.55 0.00 0.00 27.41 28.86 3gaf h HIS 168 CO -0.04 1.14 0.19 1.25 -1.30 0.00 0.00 177.93 179.17 3gaf h LEU 169 N 0.04 0.12 -0.42 0.26 5.85 -0.91 -1.01 115.31 119.24 3gaf h LEU 169 Ca -0.08 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.79 3gaf h LEU 169 Cb 1.88 0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.98 3gaf h LEU 169 CO 0.16 0.06 0.16 0.74 -0.34 0.00 0.00 178.44 179.23 3gaf h THR 170 N 0.34 0.90 -0.72 1.05 2.02 -0.97 0.18 112.91 115.71 3gaf h THR 170 Ca 0.34 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 67.36 3gaf h THR 170 Cb 0.49 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 3gaf h THR 170 CO -0.38 0.06 0.29 0.03 0.37 0.00 0.00 175.52 175.89 3gaf h ARG 171 N 0.34 1.05 0.00 6.66 3.08 -1.17 -2.90 114.38 121.45 3gaf h ARG 171 Ca 0.19 -0.18 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 3gaf h ARG 171 Cb 0.16 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 3gaf h ARG 171 CO -0.18 0.85 -0.18 -0.91 -1.07 0.00 0.00 179.97 178.48 3gaf h ASN 172 N 1.03 0.00 0.37 7.04 2.35 -0.93 -3.34 115.58 122.11 3gaf h ASN 172 Ca 0.24 -0.87 0.00 0.00 -0.55 0.00 0.00 56.30 55.12 3gaf h ASN 172 Cb 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 3gaf h ASN 172 CO -0.02 1.04 0.00 0.16 -1.65 0.00 0.00 177.43 176.96 3gaf h ILE 173 N -1.00 0.00 -0.75 2.81 3.07 -1.06 0.10 117.51 120.68 3gaf h ILE 173 Ca -0.05 -0.18 0.13 0.00 1.55 0.00 0.00 64.86 66.31 3gaf h ILE 173 Cb 0.99 1.12 -0.05 0.00 -0.27 0.00 0.00 36.82 38.61 3gaf h ILE 173 CO -0.03 0.00 0.50 0.00 -1.05 0.00 0.00 178.15 177.57 3gaf h ALA 174 N 2.01 2.03 -0.34 0.16 0.00 -1.63 -0.12 119.26 121.38 3gaf h ALA 174 Ca 0.00 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3gaf h ALA 174 Cb 0.19 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3gaf h ALA 174 CO 0.00 -0.22 -0.42 0.74 0.00 0.00 0.00 179.25 179.35 3gaf h PHE 175 N 0.48 1.07 0.25 0.00 -1.00 -0.95 -1.54 116.94 115.25 3gaf h PHE 175 Ca 0.36 -0.34 -0.01 0.00 2.81 0.00 0.00 57.97 60.79 3gaf h PHE 175 Cb 0.74 -0.22 0.00 0.00 3.61 0.00 0.00 35.95 40.08 3gaf h PHE 175 CO -0.00 1.16 -0.12 -0.44 -1.61 0.00 0.00 178.31 177.30 3gaf h ASP 176 N 0.67 -0.29 0.21 2.17 3.45 -1.36 -3.33 116.42 117.95 3gaf h ASP 176 Ca 0.04 -0.23 0.00 0.00 0.43 0.00 0.00 57.03 57.28 3gaf h ASP 176 Cb 1.02 0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.86 3gaf h ASP 176 CO 0.10 0.11 -0.14 1.33 -1.57 0.00 0.00 179.24 179.07 3gaf n VAL 177 N -5.07 0.00 0.08 -1.35 0.24 -0.13 -4.18 118.33 107.92 3gaf n VAL 177 Ca -0.09 -0.12 -0.15 0.00 -2.04 0.00 0.00 64.34 61.94 3gaf n VAL 177 Cb 0.26 0.21 -0.08 0.00 -1.47 0.00 0.00 33.84 32.76 3gaf n VAL 177 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 3gaf h GLY 178 N 4.93 -0.93 2.00 7.63 0.00 -1.30 -0.98 103.07 114.42 3gaf h GLY 178 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 47.33 47.89 3gaf h GLY 178 CO 0.00 -0.25 0.00 -2.55 0.00 0.00 0.00 176.54 173.74 3gaf h PRO 179 N -0.65 0.00 -0.08 4.80 0.11 -1.79 0.57 132.00 134.97 3gaf h PRO 179 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3gaf h PRO 179 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 3gaf h PRO 179 CO -0.31 0.00 0.00 -1.33 -0.21 0.00 0.00 178.00 176.15 3gaf n MET 180 N -2.71 1.23 -1.32 1.05 2.81 -0.90 -4.89 117.12 112.39 3gaf n MET 180 Ca -0.02 -0.36 -0.11 0.00 -1.81 0.00 0.00 57.70 55.41 3gaf n MET 180 Cb 0.08 -1.19 -0.05 0.00 -0.71 0.00 0.00 33.22 31.35 3gaf n MET 180 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3gaf n GLY 181 N 0.77 1.22 3.67 3.03 0.00 0.19 -4.42 105.19 109.65 3gaf n GLY 181 Ca 0.09 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.25 3gaf n GLY 181 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gaf s ILE 182 N -2.39 4.73 -0.08 -0.61 1.01 -0.42 -2.24 121.20 121.20 3gaf s ILE 182 Ca 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.52 3gaf s ILE 182 Cb 0.00 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 3gaf s ILE 182 CO 0.00 0.52 0.18 -0.13 0.00 0.00 0.00 174.94 175.51 3gaf s ARG 183 N -0.14 3.48 -0.09 2.79 0.52 -0.63 -3.44 118.95 121.44 3gaf s ARG 183 Ca 0.07 -0.14 -0.00 0.00 -0.52 0.00 0.00 55.73 55.14 3gaf s ARG 183 Cb -0.12 -3.16 0.02 0.00 0.52 0.00 0.00 34.95 32.21 3gaf s ARG 183 CO 0.01 0.74 -0.06 0.08 0.02 0.00 0.00 175.30 176.09 3gaf s VAL 184 N -1.12 0.85 0.15 3.52 1.01 -1.26 0.34 120.40 123.89 3gaf s VAL 184 Ca 0.19 -0.21 -0.01 0.00 0.00 0.00 0.00 61.98 61.95 3gaf s VAL 184 Cb -0.12 -0.88 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 3gaf s VAL 184 CO 0.09 0.33 0.06 0.20 0.00 0.00 0.00 175.10 175.77 3gaf s ASN 185 N 1.50 0.43 0.15 3.32 0.01 -0.78 0.68 114.94 120.26 3gaf s ASN 185 Ca 0.00 -1.23 0.05 0.00 -0.71 0.00 0.00 52.86 50.97 3gaf s ASN 185 Cb -0.13 0.28 -0.04 0.00 0.41 0.00 0.00 41.25 41.76 3gaf s ASN 185 CO -0.05 -0.72 -0.11 0.00 -1.51 0.00 0.00 177.10 174.71 3gaf s ALA 186 N -4.00 1.51 -0.06 0.60 0.00 0.46 -1.28 121.76 118.99 3gaf s ALA 186 Ca 0.26 -1.50 0.05 0.00 0.00 0.00 0.00 51.96 50.77 3gaf s ALA 186 Cb 0.07 0.03 -0.00 0.00 0.00 0.00 0.00 23.12 23.22 3gaf s ALA 186 CO 0.03 -0.07 -0.20 0.42 0.00 0.00 0.00 175.76 175.95 3gaf s ILE 187 N -3.22 1.67 -0.39 0.00 1.01 -0.28 -1.67 121.20 118.33 3gaf s ILE 187 Ca 0.17 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 59.90 3gaf s ILE 187 Cb 0.02 -1.44 0.07 0.00 0.01 0.00 0.00 42.46 41.12 3gaf s ILE 187 CO 0.01 0.47 0.19 0.00 0.00 0.00 0.00 174.94 175.62 3gaf s ALA 188 N 0.07 3.18 0.04 9.38 0.00 0.51 0.31 121.76 135.25 3gaf s ALA 188 Ca -0.07 -2.04 -0.19 0.00 0.00 0.00 0.00 51.96 49.67 3gaf s ALA 188 Cb -0.13 -2.48 -0.06 0.00 0.00 0.00 0.00 23.12 20.45 3gaf s ALA 188 CO 0.04 -1.54 0.54 -1.25 0.00 0.00 0.00 175.76 173.54 3gaf s PRO 189 N 1.39 4.16 0.53 0.00 0.04 -1.26 -1.02 135.00 138.84 3gaf s PRO 189 Ca 0.02 0.66 -0.09 0.00 0.04 0.00 0.00 61.00 61.63 3gaf s PRO 189 Cb -0.22 -3.26 0.13 0.00 0.04 0.00 0.00 34.50 31.20 3gaf s PRO 189 CO 0.02 0.60 0.51 0.41 0.04 0.00 0.00 177.00 178.57 3gaf n GLY 190 N 1.89 -2.38 3.65 0.56 0.00 0.98 -4.41 105.19 105.48 3gaf n GLY 190 Ca -0.11 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 3gaf n GLY 190 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gaf s ALA 191 N -3.16 3.45 -0.22 4.61 0.00 -1.26 -4.89 121.76 120.28 3gaf s ALA 191 Ca 0.32 1.04 -0.15 0.00 0.00 0.00 0.00 51.96 53.17 3gaf s ALA 191 Cb -0.03 -3.85 -0.04 0.00 0.00 0.00 0.00 23.12 19.21 3gaf s ALA 191 CO 0.24 -1.72 0.37 0.42 0.00 0.00 0.00 175.76 175.07 3gaf s ILE 192 N 4.91 5.21 -0.29 0.00 -1.09 -1.26 -1.58 121.20 127.11 3gaf s ILE 192 Ca 0.83 0.63 -0.29 0.00 -2.23 0.00 0.00 60.65 59.59 3gaf s ILE 192 Cb -0.37 -3.70 -0.00 0.00 -1.58 0.00 0.00 42.46 36.82 3gaf s ILE 192 CO 0.36 0.24 1.31 -1.59 -1.23 0.00 0.00 174.94 174.03 3gaf s LYS 193 N 1.42 3.93 0.00 2.79 -2.85 -0.23 -4.89 119.74 119.92 3gaf s LYS 193 Ca 0.17 1.29 0.00 0.00 -1.00 0.00 0.00 55.97 56.43 3gaf s LYS 193 Cb -0.15 -3.87 0.00 0.00 -2.06 0.00 0.00 37.83 31.75 3gaf s LYS 193 CO 0.08 -1.09 0.81 2.41 0.10 0.00 0.00 175.35 177.65 3gaf n THR 194 N 6.15 0.00 0.00 3.79 -1.04 -1.26 -4.33 114.28 117.59 3gaf n THR 194 Ca 0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.16 3gaf n THR 194 Cb 0.46 0.52 0.00 0.00 -1.82 0.00 0.00 70.33 69.49 3gaf n THR 194 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3gaf n PRO 203 N 0.00 0.00 0.01 -2.82 -0.02 -1.26 -5.16 135.00 125.75 3gaf n PRO 203 Ca 0.00 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.29 3gaf n PRO 203 Cb 0.63 -0.51 -0.14 0.00 -0.02 0.00 0.00 33.50 33.46 3gaf n PRO 203 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3gaf h GLU 204 N 0.00 0.21 0.00 -0.52 3.07 -2.06 -3.29 114.58 111.98 3gaf h GLU 204 Ca 0.00 -0.36 -0.06 0.00 -0.50 0.00 0.00 59.36 58.44 3gaf h GLU 204 Cb 0.36 0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 3gaf h GLU 204 CO 0.00 1.17 -0.30 -0.84 -1.40 0.00 0.00 179.01 177.64 3gaf h ILE 205 N -0.52 0.85 -0.10 3.13 3.07 -2.06 -3.18 117.51 118.71 3gaf h ILE 205 Ca -0.17 -1.21 -0.18 0.00 1.55 0.00 0.00 64.86 64.85 3gaf h ILE 205 Cb 1.53 1.73 -0.00 0.00 -0.27 0.00 0.00 36.82 39.81 3gaf h ILE 205 CO 0.07 0.30 -0.71 -0.08 -1.05 0.00 0.00 178.15 176.68 3gaf h GLU 206 N 0.00 0.46 -0.60 0.16 4.81 -2.00 -0.18 114.58 117.24 3gaf h GLU 206 Ca -0.00 -0.36 -0.00 0.00 -0.13 0.00 0.00 59.36 58.86 3gaf h GLU 206 Cb 0.71 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.13 3gaf h GLU 206 CO 0.04 0.99 0.37 0.00 -0.73 0.00 0.00 179.01 179.69 3gaf h ARG 207 N 0.32 0.81 0.00 1.92 3.08 -1.62 -2.44 114.38 116.45 3gaf h ARG 207 Ca -0.03 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 59.84 3gaf h ARG 207 Cb 1.28 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 31.14 3gaf h ARG 207 CO 0.13 0.57 -0.56 0.00 -1.07 0.00 0.00 179.97 179.04 3gaf h ALA 208 N 1.19 0.95 -0.12 0.04 0.00 -1.53 -2.76 119.26 117.03 3gaf h ALA 208 Ca 0.22 -0.51 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 3gaf h ALA 208 Cb -0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3gaf h ALA 208 CO -0.04 0.70 -0.30 0.52 0.00 0.00 0.00 179.25 180.13 3gaf h MET 209 N 0.00 0.23 -0.33 0.00 2.07 -0.93 -3.17 114.93 112.80 3gaf h MET 209 Ca -0.01 -0.08 0.00 0.00 -2.07 0.00 0.00 59.70 57.54 3gaf h MET 209 Cb 1.07 -0.02 0.00 0.00 -1.87 0.00 0.00 31.60 30.79 3gaf h MET 209 CO 0.07 0.51 0.00 1.28 1.07 0.00 0.00 176.91 179.84 3gaf n LEU 210 N -4.13 1.87 0.23 1.22 4.32 -0.93 -4.16 117.00 115.43 3gaf n LEU 210 Ca -0.01 -0.91 0.06 0.00 -0.02 0.00 0.00 56.01 55.13 3gaf n LEU 210 Cb 0.39 -0.22 0.53 0.00 -1.62 0.00 0.00 43.42 42.51 3gaf n LEU 210 CO 0.40 0.46 0.92 0.11 -1.22 0.00 0.00 177.39 178.06 3gaf h LYS 211 N 2.11 0.00 -0.37 3.23 6.56 -1.51 -2.69 116.57 123.89 3gaf h LYS 211 Ca 0.00 0.00 -0.28 0.00 -1.06 0.00 0.00 60.65 59.31 3gaf h LYS 211 Cb 0.48 0.00 -0.27 0.00 -0.57 0.00 0.00 32.23 31.87 3gaf h LYS 211 CO 0.00 0.16 -0.77 0.72 -2.06 0.00 0.00 179.45 177.50 3gaf n HIS 212 N -4.28 1.33 -3.92 -1.35 8.25 -1.26 -4.94 115.22 109.04 3gaf n HIS 212 Ca -0.02 -1.78 -0.32 0.00 -0.26 0.00 0.00 57.72 55.33 3gaf n HIS 212 Cb 0.23 -0.28 -0.14 0.00 1.12 0.00 0.00 29.99 30.93 3gaf n HIS 212 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3gaf s THR 213 N -3.56 2.70 0.34 1.59 2.01 -1.02 -2.79 115.64 114.92 3gaf s THR 213 Ca 0.42 -2.64 0.13 0.00 0.31 0.00 0.00 61.69 59.91 3gaf s THR 213 Cb 0.38 -2.90 0.34 0.00 0.01 0.00 0.00 72.50 70.33 3gaf s THR 213 CO -0.03 -0.70 1.73 -0.65 -0.69 0.00 0.00 174.62 174.28 3gaf h PRO 214 N 7.32 0.48 0.00 4.92 0.11 -1.82 -0.49 132.00 142.51 3gaf h PRO 214 Ca -0.06 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.02 3gaf h PRO 214 Cb 0.98 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3gaf h PRO 214 CO 0.62 0.32 0.00 1.28 -0.21 0.00 0.00 178.00 180.00 3gaf n LEU 215 N -4.84 0.00 -1.29 2.35 4.77 -1.02 -4.93 117.00 112.05 3gaf n LEU 215 Ca 0.27 0.49 -0.14 0.00 -0.03 0.00 0.00 56.01 56.61 3gaf n LEU 215 Cb 0.83 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 3gaf n LEU 215 CO 0.18 -0.09 -0.15 0.61 -1.33 0.00 0.00 177.39 176.60 3gaf n GLY 216 N 0.92 0.66 3.16 -0.72 0.00 -0.19 -4.99 105.19 104.03 3gaf n GLY 216 Ca 0.06 -0.35 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 3gaf n GLY 216 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3gaf s ARG 217 N -3.88 0.65 0.63 1.61 1.70 -1.26 -5.08 118.95 113.32 3gaf s ARG 217 Ca 0.00 -0.66 -0.09 0.00 -0.47 0.00 0.00 55.73 54.52 3gaf s ARG 217 Cb 0.00 0.26 0.00 0.00 -0.57 0.00 0.00 34.95 34.64 3gaf s ARG 217 CO 0.00 -0.18 0.99 -1.17 -1.08 0.00 0.00 175.30 173.86 3gaf s LEU 218 N -2.06 3.14 0.67 -1.89 2.96 -1.26 -4.91 118.68 115.32 3gaf s LEU 218 Ca -0.06 1.00 -0.11 0.00 -0.22 0.00 0.00 54.13 54.74 3gaf s LEU 218 Cb -0.01 -3.85 -0.01 0.00 0.50 0.00 0.00 46.19 42.81 3gaf s LEU 218 CO -0.04 -1.10 1.06 -0.83 -1.32 0.00 0.00 176.35 174.12 3gaf s GLY 219 N -4.29 1.65 -0.02 7.98 0.00 -0.61 -4.80 107.32 107.23 3gaf s GLY 219 Ca 0.55 -0.11 0.05 0.00 0.00 0.00 0.00 44.72 45.22 3gaf s GLY 219 CO 0.49 0.21 -0.18 -0.54 0.00 0.00 0.00 173.10 173.08 3gaf s GLU 220 N -5.18 2.30 0.43 2.90 0.41 -1.26 -1.06 118.70 117.23 3gaf s GLU 220 Ca 0.57 -0.83 0.24 0.00 -0.41 0.00 0.00 54.97 54.54 3gaf s GLU 220 Cb -0.12 -2.26 1.24 0.00 -1.78 0.00 0.00 34.13 31.21 3gaf s GLU 220 CO 0.54 0.59 1.74 0.00 -0.49 0.00 0.00 175.26 177.63 3gaf h ALA 221 N 5.13 2.47 -0.60 5.21 0.00 -1.92 -0.93 119.26 128.62 3gaf h ALA 221 Ca -0.46 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 3gaf h ALA 221 Cb 1.15 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 3gaf h ALA 221 CO 0.49 -0.93 0.10 0.37 0.00 0.00 0.00 179.25 179.28 3gaf h GLN 222 N 0.27 0.97 -0.84 0.00 5.75 -1.93 -2.30 115.11 117.04 3gaf h GLN 222 Ca 0.65 -0.24 0.21 0.00 -0.15 0.00 0.00 58.65 59.12 3gaf h GLN 222 Cb 1.88 -0.12 -0.14 0.00 1.07 0.00 0.00 27.48 30.16 3gaf h GLN 222 CO -0.29 0.90 0.15 -0.44 -2.65 0.00 0.00 178.83 176.49 3gaf h ASP 223 N 0.92 -0.14 -0.31 -0.69 3.32 -1.57 0.50 116.42 118.45 3gaf h ASP 223 Ca 0.19 0.20 -0.17 0.00 0.02 0.00 0.00 57.03 57.27 3gaf h ASP 223 Cb 0.39 0.30 -0.00 0.00 0.22 0.00 0.00 39.33 40.24 3gaf h ASP 223 CO 0.01 -0.16 -0.44 0.40 -1.72 0.00 0.00 179.24 177.32 3gaf h ILE 224 N 0.17 1.28 -0.03 0.35 1.08 -1.51 -2.92 117.51 115.92 3gaf h ILE 224 Ca 0.50 -1.62 -0.12 0.00 -0.39 0.00 0.00 64.86 63.23 3gaf h ILE 224 Cb 0.96 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 36.18 3gaf h ILE 224 CO -0.66 0.54 -0.53 0.00 -0.69 0.00 0.00 178.15 176.80 3gaf h ALA 225 N 0.79 1.05 -0.38 1.87 0.00 -0.54 0.15 119.26 122.19 3gaf h ALA 225 Ca 0.04 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 3gaf h ALA 225 Cb 1.03 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3gaf h ALA 225 CO 0.10 0.67 0.17 -0.91 0.00 0.00 0.00 179.25 179.29 3gaf h ASN 226 N 0.07 0.51 -0.21 0.00 2.35 -0.05 -0.28 115.58 117.97 3gaf h ASN 226 Ca -0.00 -0.15 -0.16 0.00 -0.55 0.00 0.00 56.30 55.44 3gaf h ASN 226 Cb 0.97 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.20 3gaf h ASN 226 CO 0.07 0.52 -0.46 0.00 -1.65 0.00 0.00 177.43 175.91 3gaf h ALA 227 N 1.02 0.62 -0.96 -0.83 0.00 -1.29 -2.50 119.26 115.31 3gaf h ALA 227 Ca 0.13 -0.48 0.07 0.00 0.00 0.00 0.00 54.91 54.63 3gaf h ALA 227 Cb 0.15 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.77 3gaf h ALA 227 CO -0.01 0.68 0.61 0.00 0.00 0.00 0.00 179.25 180.52 3gaf h ALA 228 N 0.85 1.35 -0.33 0.00 0.00 -0.60 -2.03 119.26 118.50 3gaf h ALA 228 Ca 0.03 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3gaf h ALA 228 Cb 1.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3gaf h ALA 228 CO 0.10 0.36 -0.03 1.25 0.00 0.00 0.00 179.25 180.93 3gaf h LEU 229 N 1.08 0.60 0.40 0.00 5.85 -0.85 -2.07 115.31 120.32 3gaf h LEU 229 Ca 0.43 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 3gaf h LEU 229 Cb 0.22 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 3gaf h LEU 229 CO -0.19 0.78 -0.33 0.15 -0.34 0.00 0.00 178.44 178.52 3gaf h PHE 230 N 0.40 -0.88 -0.41 1.25 3.57 -1.19 -1.10 116.94 118.58 3gaf h PHE 230 Ca 0.09 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.63 3gaf h PHE 230 Cb 0.49 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 3gaf h PHE 230 CO 0.04 -0.48 0.28 -0.07 -2.23 0.00 0.00 178.31 175.85 3gaf h LEU 231 N -0.73 0.36 -0.05 0.59 3.38 -1.39 -2.23 115.31 115.24 3gaf h LEU 231 Ca -0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3gaf h LEU 231 Cb 0.64 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3gaf h LEU 231 CO -0.02 0.25 -0.48 0.00 0.09 0.00 0.00 178.44 178.28 3gaf s SER 233 N -2.95 6.10 0.00 0.00 1.04 -0.43 -4.86 113.70 112.60 3gaf s SER 233 Ca 0.12 0.86 0.08 0.00 0.48 0.00 0.00 55.95 57.50 3gaf s SER 233 Cb 0.18 -2.10 0.43 0.00 0.10 0.00 0.00 66.02 64.62 3gaf s SER 233 CO 0.68 -0.69 1.06 -0.81 0.98 0.00 0.00 173.24 174.46 3gaf n PRO 234 N -2.33 0.16 0.06 4.02 -0.04 -1.20 -2.47 135.00 133.19 3gaf n PRO 234 Ca 0.01 0.14 0.13 0.00 -0.04 0.00 0.00 63.50 63.75 3gaf n PRO 234 Cb 0.56 -1.50 0.49 0.00 -0.04 0.00 0.00 33.50 33.01 3gaf n PRO 234 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gaf n ALA 235 N -1.19 2.28 -1.67 0.55 0.00 -0.94 -2.99 120.51 116.56 3gaf n ALA 235 Ca 0.05 -0.05 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 3gaf n ALA 235 Cb 0.05 -1.46 0.11 0.00 0.00 0.00 0.00 19.45 18.14 3gaf n ALA 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gaf n ALA 236 N -1.67 4.97 0.18 0.00 0.00 -1.03 -4.84 120.51 118.11 3gaf n ALA 236 Ca 0.06 -3.48 0.03 0.00 0.00 0.00 0.00 53.44 50.06 3gaf n ALA 236 Cb 0.39 -0.75 0.41 0.00 0.00 0.00 0.00 19.45 19.50 3gaf n ALA 236 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gaf h ALA 237 N 1.66 1.53 -0.65 0.00 0.00 -1.67 -1.14 119.26 118.98 3gaf h ALA 237 Ca 0.35 -0.24 -0.24 0.00 0.00 0.00 0.00 54.91 54.78 3gaf h ALA 237 Cb 1.43 -0.06 -0.14 0.00 0.00 0.00 0.00 17.79 19.02 3gaf h ALA 237 CO 0.75 0.35 0.24 1.87 0.00 0.00 0.00 179.25 182.46 3gaf n TRP 238 N -4.23 2.10 -3.82 0.00 -0.00 -1.26 -4.88 117.44 105.35 3gaf n TRP 238 Ca -0.02 -1.38 -0.36 0.00 -0.00 0.00 0.00 57.50 55.74 3gaf n TRP 238 Cb 0.31 -0.65 -0.13 0.00 -0.00 0.00 0.00 31.31 30.84 3gaf n TRP 238 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 3gaf s ILE 239 N -3.09 3.74 0.04 5.87 1.01 -0.43 -5.09 121.20 123.24 3gaf s ILE 239 Ca 0.52 -0.64 -0.12 0.00 0.00 0.00 0.00 60.65 60.41 3gaf s ILE 239 Cb 0.43 -2.86 0.01 0.00 0.01 0.00 0.00 42.46 40.05 3gaf s ILE 239 CO 0.09 0.19 0.25 -0.55 0.00 0.00 0.00 174.94 174.93 3gaf s SER 240 N 1.49 -0.05 -0.13 3.58 0.15 -1.26 -4.65 113.70 112.81 3gaf s SER 240 Ca 0.03 -0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.44 3gaf s SER 240 Cb -0.16 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.46 3gaf s SER 240 CO 0.01 -0.57 0.00 0.61 1.20 0.00 0.00 173.24 174.49 3gaf n GLY 241 N 0.72 0.50 3.90 9.45 0.00 0.21 -4.95 105.19 115.03 3gaf n GLY 241 Ca -0.19 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 3gaf n GLY 241 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gaf s GLN 242 N -1.04 3.55 -0.27 1.61 -1.52 -1.25 -4.27 119.66 116.48 3gaf s GLN 242 Ca 0.00 -0.20 0.01 0.00 -1.95 0.00 0.00 55.36 53.22 3gaf s GLN 242 Cb 0.00 -2.94 0.06 0.00 -0.22 0.00 0.00 33.01 29.90 3gaf s GLN 242 CO 0.00 0.54 -0.07 0.08 -0.25 0.00 0.00 175.29 175.58 3gaf s VAL 243 N -1.56 2.45 -0.32 1.09 1.01 -1.26 -0.41 120.40 121.41 3gaf s VAL 243 Ca 0.37 -1.54 -0.13 0.00 0.00 0.00 0.00 61.98 60.69 3gaf s VAL 243 Cb -0.13 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 3gaf s VAL 243 CO 0.25 -0.04 0.26 -0.22 0.00 0.00 0.00 175.10 175.34 3gaf s LEU 244 N 1.16 4.32 -0.23 3.92 2.96 -0.67 -4.94 118.68 125.20 3gaf s LEU 244 Ca -0.07 -0.21 -0.21 0.00 -0.22 0.00 0.00 54.13 53.42 3gaf s LEU 244 Cb -0.20 -2.19 -0.02 0.00 0.50 0.00 0.00 46.19 44.28 3gaf s LEU 244 CO -0.04 -0.19 0.63 -0.89 -1.32 0.00 0.00 176.35 174.54 3gaf s THR 245 N 1.81 5.00 -0.46 3.68 2.01 -1.26 -0.36 115.64 126.06 3gaf s THR 245 Ca 0.08 1.17 -0.01 0.00 0.31 0.00 0.00 61.69 63.23 3gaf s THR 245 Cb -0.17 -3.94 0.12 0.00 0.01 0.00 0.00 72.50 68.52 3gaf s THR 245 CO 0.11 0.07 0.24 -0.69 -0.69 0.00 0.00 174.62 173.66 3gaf s VAL 246 N 2.23 3.19 0.00 3.82 1.01 -0.19 -4.89 120.40 125.57 3gaf s VAL 246 Ca 0.28 -2.41 0.04 0.00 0.00 0.00 0.00 61.98 59.88 3gaf s VAL 246 Cb -0.16 -3.18 0.07 0.00 0.00 0.00 0.00 36.38 33.11 3gaf s VAL 246 CO 0.09 -0.73 0.85 -1.54 0.00 0.00 0.00 175.10 173.77 3gaf n SER 247 N 4.17 -0.13 -2.05 3.32 3.41 -1.26 -0.01 113.62 121.06 3gaf n SER 247 Ca 0.02 -1.64 -0.19 0.00 -0.26 0.00 0.00 58.87 56.79 3gaf n SER 247 Cb 0.40 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.31 3gaf n SER 247 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gaf n GLY 248 N 0.08 0.51 1.05 5.00 0.00 -1.26 -2.82 105.19 107.74 3gaf n GLY 248 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3gaf n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gaf n GLY 249 N -0.72 0.75 0.00 -0.02 0.00 -1.26 -2.42 105.19 101.52 3gaf n GLY 249 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 3gaf n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gaf n GLY 250 N -2.00 3.23 3.48 -0.02 0.00 -1.13 -4.66 105.19 104.10 3gaf n GLY 250 Ca 0.00 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.96 3gaf n GLY 250 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gaf s VAL 251 N -2.41 3.31 -0.25 1.61 -7.23 -1.12 -4.78 120.40 109.52 3gaf s VAL 251 Ca 0.00 -0.61 -0.13 0.00 -1.81 0.00 0.00 61.98 59.43 3gaf s VAL 251 Cb 0.00 -2.35 -0.05 0.00 0.56 0.00 0.00 36.38 34.55 3gaf s VAL 251 CO 0.00 0.57 0.26 -1.10 -0.31 0.00 0.00 175.10 174.52 3gaf s GLN 252 N -0.40 4.05 0.00 4.82 1.11 -1.26 -4.41 119.66 123.57 3gaf s GLN 252 Ca 0.05 -0.12 0.00 0.00 0.01 0.00 0.00 55.36 55.30 3gaf s GLN 252 Cb -0.12 -3.59 0.00 0.00 -1.01 0.00 0.00 33.01 28.29 3gaf s GLN 252 CO 0.02 -0.08 0.00 0.39 0.01 0.00 0.00 175.29 175.63