#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gfl s SER 2 N 0.00 -0.09 0.53 0.00 1.04 -1.26 -5.15 113.70 108.77 1gfl s SER 2 Ca 0.00 0.16 -0.22 0.00 0.48 0.00 0.00 55.95 56.38 1gfl s SER 2 Cb 0.00 0.18 -0.05 0.00 0.10 0.00 0.00 66.02 66.24 1gfl s SER 2 CO 0.00 -0.04 1.33 -0.54 0.98 0.00 0.00 173.24 174.97 1gfl s LYS 3 N 0.02 3.25 0.00 4.02 1.02 -1.26 -3.09 119.74 123.70 1gfl s LYS 3 Ca -0.00 2.17 0.00 0.00 0.02 0.00 0.00 55.97 58.15 1gfl s LYS 3 Cb -0.01 -2.29 0.00 0.00 -0.52 0.00 0.00 37.83 35.01 1gfl s LYS 3 CO 0.00 -1.08 0.00 0.41 -0.92 0.00 0.00 175.35 173.76 1gfl n GLY 4 N 0.68 3.09 0.30 -3.33 0.00 -1.26 -4.58 105.19 100.08 1gfl n GLY 4 Ca 0.10 -0.91 0.09 0.00 0.00 0.00 0.00 46.02 45.30 1gfl n GLY 4 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1gfl h GLU 5 N 0.00 0.12 -0.20 1.61 5.08 -1.72 -1.83 114.58 117.65 1gfl h GLU 5 Ca 0.00 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.41 1gfl h GLU 5 Cb 0.00 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1gfl h GLU 5 CO 0.00 0.08 0.25 1.05 -1.00 0.00 0.00 179.01 179.39 1gfl h GLU 6 N 0.13 0.00 0.00 2.33 -0.00 -1.88 -0.06 114.58 115.09 1gfl h GLU 6 Ca 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.84 1gfl h GLU 6 Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.66 1gfl h GLU 6 CO -0.70 0.00 0.00 1.28 -0.00 0.00 0.00 179.01 179.59 1gfl n LEU 7 N -3.65 0.32 -0.03 3.06 4.77 -0.69 -3.40 117.00 117.38 1gfl n LEU 7 Ca 0.02 0.57 0.04 0.00 -0.03 0.00 0.00 56.01 56.61 1gfl n LEU 7 Cb 0.37 -0.52 0.06 0.00 -2.33 0.00 0.00 43.42 41.00 1gfl n LEU 7 CO 0.26 -0.35 0.53 0.49 -1.33 0.00 0.00 177.39 176.98 1gfl n PHE 8 N -1.84 0.00 0.10 -1.77 3.72 -0.04 -4.65 117.46 112.98 1gfl n PHE 8 Ca 0.03 -0.71 -0.03 0.00 -0.05 0.00 0.00 57.45 56.69 1gfl n PHE 8 Cb 0.22 -0.09 0.16 0.00 -0.94 0.00 0.00 39.48 38.83 1gfl n PHE 8 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1gfl h THR 9 N 0.00 1.38 -2.93 4.37 1.35 -1.61 -3.39 112.91 112.09 1gfl h THR 9 Ca 0.00 -1.92 0.00 0.00 -0.55 0.00 0.00 66.41 63.94 1gfl h THR 9 Cb 0.71 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 69.10 1gfl h THR 9 CO 0.00 0.56 0.00 0.61 -0.25 0.00 0.00 175.52 176.44 1gfl n GLY 10 N 0.17 2.26 3.69 5.82 0.00 -1.26 -4.80 105.19 111.07 1gfl n GLY 10 Ca -0.02 -2.03 -0.39 0.00 0.00 0.00 0.00 46.02 43.58 1gfl n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gfl s VAL 11 N 1.98 5.10 -0.16 1.61 1.01 -1.26 -4.49 120.40 124.18 1gfl s VAL 11 Ca 0.00 1.12 -0.03 0.00 0.00 0.00 0.00 61.98 63.07 1gfl s VAL 11 Cb 0.00 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 1gfl s VAL 11 CO 0.00 0.22 -0.06 -0.69 0.00 0.00 0.00 175.10 174.58 1gfl s VAL 12 N 1.22 3.62 0.38 2.92 1.01 -0.09 -4.93 120.40 124.53 1gfl s VAL 12 Ca 0.29 -0.45 -0.27 0.00 0.00 0.00 0.00 61.98 61.55 1gfl s VAL 12 Cb -0.16 -2.59 -0.10 0.00 0.00 0.00 0.00 36.38 33.54 1gfl s VAL 12 CO 0.12 0.48 1.38 -2.84 0.00 0.00 0.00 175.10 174.24 1gfl s PRO 13 N 0.59 4.07 -0.03 2.72 0.02 -1.26 -0.62 135.00 140.49 1gfl s PRO 13 Ca -0.04 2.34 0.06 0.00 0.02 0.00 0.00 61.00 63.39 1gfl s PRO 13 Cb -0.15 -2.89 -0.01 0.00 0.02 0.00 0.00 34.50 31.47 1gfl s PRO 13 CO 0.03 -0.47 -0.23 0.42 -0.33 0.00 0.00 177.00 176.42 1gfl s ILE 14 N -1.18 1.80 -0.06 2.83 1.01 -0.17 -0.76 121.20 124.68 1gfl s ILE 14 Ca 0.54 -0.96 0.04 0.00 0.00 0.00 0.00 60.65 60.27 1gfl s ILE 14 Cb -0.42 -1.51 -0.00 0.00 0.01 0.00 0.00 42.46 40.54 1gfl s ILE 14 CO 0.55 0.51 -0.19 -0.22 0.00 0.00 0.00 174.94 175.59 1gfl s LEU 15 N -0.39 1.94 -0.05 2.97 1.98 0.36 -2.54 118.68 122.95 1gfl s LEU 15 Ca 0.05 -0.42 0.04 0.00 -2.89 0.00 0.00 54.13 50.90 1gfl s LEU 15 Cb -0.10 -1.13 0.00 0.00 0.66 0.00 0.00 46.19 45.62 1gfl s LEU 15 CO 0.00 0.15 -0.15 -0.69 -1.89 0.00 0.00 176.35 173.77 1gfl s VAL 16 N 0.17 1.32 -0.02 1.68 1.01 -0.31 -0.25 120.40 124.00 1gfl s VAL 16 Ca -0.09 -0.63 -0.00 0.00 0.00 0.00 0.00 61.98 61.26 1gfl s VAL 16 Cb -0.14 -1.16 0.03 0.00 0.00 0.00 0.00 36.38 35.11 1gfl s VAL 16 CO 0.04 0.39 0.03 -1.61 0.00 0.00 0.00 175.10 173.95 1gfl s GLU 17 N 0.25 0.05 -0.03 2.72 2.02 -0.06 -0.54 118.70 123.11 1gfl s GLU 17 Ca -0.08 0.18 0.03 0.00 0.02 0.00 0.00 54.97 55.12 1gfl s GLU 17 Cb -0.13 -0.33 0.00 0.00 0.10 0.00 0.00 34.13 33.77 1gfl s GLU 17 CO 0.03 -0.18 -0.10 -1.17 0.02 0.00 0.00 175.26 173.86 1gfl s LEU 18 N 1.16 1.82 -0.10 1.80 1.98 -0.28 -0.49 118.68 124.57 1gfl s LEU 18 Ca -0.08 -0.20 0.02 0.00 -2.89 0.00 0.00 54.13 50.98 1gfl s LEU 18 Cb -0.13 -0.59 0.01 0.00 0.66 0.00 0.00 46.19 46.14 1gfl s LEU 18 CO -0.03 0.08 -0.15 -1.81 -1.89 0.00 0.00 176.35 172.55 1gfl s ASP 19 N 0.14 2.35 0.20 3.68 1.01 -0.76 -1.84 116.67 121.46 1gfl s ASP 19 Ca -0.02 -0.41 0.01 0.00 0.71 0.00 0.00 52.55 52.84 1gfl s ASP 19 Cb -0.08 -1.06 -0.05 0.00 1.01 0.00 0.00 42.92 42.74 1gfl s ASP 19 CO 0.01 0.03 0.06 -0.83 0.21 0.00 0.00 175.17 174.64 1gfl s GLY 20 N 0.88 1.41 -0.23 0.21 0.00 -0.46 -1.63 107.32 107.50 1gfl s GLY 20 Ca -0.09 -1.69 -0.07 0.00 0.00 0.00 0.00 44.72 42.87 1gfl s GLY 20 CO 0.00 -1.52 0.48 -0.35 0.00 0.00 0.00 173.10 171.71 1gfl s ASP 21 N -3.21 -0.47 -0.21 1.64 -1.08 -0.75 -1.89 116.67 110.70 1gfl s ASP 21 Ca 0.31 1.01 0.01 0.00 -0.52 0.00 0.00 52.55 53.35 1gfl s ASP 21 Cb 0.07 1.59 0.05 0.00 -1.46 0.00 0.00 42.92 43.17 1gfl s ASP 21 CO 0.08 -0.24 -0.07 -0.69 0.52 0.00 0.00 175.17 174.77 1gfl s VAL 22 N 2.69 1.50 -1.68 1.11 1.01 0.48 -0.39 120.40 125.12 1gfl s VAL 22 Ca 0.01 -1.07 -0.01 0.00 0.00 0.00 0.00 61.98 60.92 1gfl s VAL 22 Cb -0.13 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.56 1gfl s VAL 22 CO -0.15 0.01 0.06 0.59 0.00 0.00 0.00 175.10 175.61 1gfl n ASN 23 N 4.71 -5.69 0.00 3.32 5.03 0.35 -1.30 115.26 121.67 1gfl n ASN 23 Ca -0.13 -0.02 0.00 0.00 0.87 0.00 0.00 54.58 55.30 1gfl n ASN 23 Cb 0.45 -4.73 0.00 0.00 -1.02 0.00 0.00 39.78 34.48 1gfl n ASN 23 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1gfl n GLY 24 N -1.04 3.19 3.66 7.41 0.00 -1.26 -5.02 105.19 112.14 1gfl n GLY 24 Ca -0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.37 1gfl n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1gfl s HIS 25 N -2.10 2.55 0.01 1.61 3.76 -0.42 -5.01 115.29 115.68 1gfl s HIS 25 Ca 0.00 0.72 -0.01 0.00 -0.15 0.00 0.00 55.06 55.62 1gfl s HIS 25 Cb 0.00 -3.65 -0.04 0.00 1.11 0.00 0.00 32.58 30.00 1gfl s HIS 25 CO 0.00 -2.47 0.13 0.15 -0.85 0.00 0.00 174.74 171.70 1gfl s LYS 26 N 3.62 3.23 0.12 1.40 1.02 -1.26 -0.38 119.74 127.49 1gfl s LYS 26 Ca 0.61 -0.43 -0.24 0.00 0.02 0.00 0.00 55.97 55.93 1gfl s LYS 26 Cb -0.26 -2.96 0.08 0.00 -0.52 0.00 0.00 37.83 34.17 1gfl s LYS 26 CO 0.20 0.65 0.65 -0.59 -0.92 0.00 0.00 175.35 175.34 1gfl s PHE 27 N -1.29 -0.52 0.08 3.18 -0.71 -0.79 -4.99 117.98 112.93 1gfl s PHE 27 Ca 0.26 0.37 0.06 0.00 -1.04 0.00 0.00 56.93 56.58 1gfl s PHE 27 Cb -0.12 0.55 -0.03 0.00 -1.21 0.00 0.00 43.02 42.20 1gfl s PHE 27 CO 0.18 -0.79 -0.16 -1.12 -1.34 0.00 0.00 175.22 171.99 1gfl s SER 28 N -2.60 1.94 0.00 1.98 0.01 -1.26 -1.36 113.70 112.41 1gfl s SER 28 Ca 0.01 -0.62 0.01 0.00 1.31 0.00 0.00 55.95 56.65 1gfl s SER 28 Cb -0.01 -0.08 -0.00 0.00 0.21 0.00 0.00 66.02 66.13 1gfl s SER 28 CO -0.11 -0.02 -0.03 0.54 0.41 0.00 0.00 173.24 174.03 1gfl s VAL 29 N -1.20 0.21 0.07 3.43 0.11 -0.76 -1.57 120.40 120.68 1gfl s VAL 29 Ca 0.01 -0.16 0.06 0.00 -2.93 0.00 0.00 61.98 58.95 1gfl s VAL 29 Cb -0.10 -0.19 -0.04 0.00 -1.53 0.00 0.00 36.38 34.53 1gfl s VAL 29 CO 0.03 0.03 -0.08 -0.44 -3.33 0.00 0.00 175.10 171.30 1gfl s SER 30 N -0.15 4.52 0.03 3.54 0.01 -0.65 -1.13 113.70 119.87 1gfl s SER 30 Ca 0.00 -0.29 -0.06 0.00 1.31 0.00 0.00 55.95 56.91 1gfl s SER 30 Cb -0.02 -0.94 -0.01 0.00 0.21 0.00 0.00 66.02 65.26 1gfl s SER 30 CO -0.00 0.21 0.10 -0.83 0.41 0.00 0.00 173.24 173.13 1gfl s GLY 31 N -1.96 0.15 0.04 3.44 0.00 0.30 -0.60 107.32 108.68 1gfl s GLY 31 Ca 0.20 -0.46 -0.01 0.00 0.00 0.00 0.00 44.72 44.46 1gfl s GLY 31 CO 0.12 -0.59 -0.02 -1.83 0.00 0.00 0.00 173.10 170.78 1gfl s GLU 32 N -2.28 0.54 0.00 2.90 -1.05 -0.61 -1.16 118.70 117.04 1gfl s GLU 32 Ca -0.08 -1.04 0.00 0.00 -0.15 0.00 0.00 54.97 53.71 1gfl s GLU 32 Cb -0.03 0.19 0.00 0.00 -0.44 0.00 0.00 34.13 33.85 1gfl s GLU 32 CO -0.03 -0.10 0.00 0.41 0.95 0.00 0.00 175.26 176.49 1gfl n GLY 33 N 0.51 -0.73 3.25 -3.83 0.00 -1.05 -1.25 105.19 102.10 1gfl n GLY 33 Ca -0.17 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 1gfl n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1gfl s GLU 34 N -0.40 0.73 -0.01 1.61 -1.05 -0.48 -1.00 118.70 118.10 1gfl s GLU 34 Ca 0.00 -0.30 0.05 0.00 -0.15 0.00 0.00 54.97 54.57 1gfl s GLU 34 Cb 0.00 0.32 -0.01 0.00 -0.44 0.00 0.00 34.13 34.00 1gfl s GLU 34 CO 0.00 -0.22 -0.18 0.20 0.95 0.00 0.00 175.26 176.02 1gfl s GLY 35 N -1.61 0.86 -0.37 -3.83 0.00 0.21 -1.62 107.32 100.96 1gfl s GLY 35 Ca -0.10 -0.76 0.01 0.00 0.00 0.00 0.00 44.72 43.87 1gfl s GLY 35 CO 0.01 -0.63 0.15 -0.35 0.00 0.00 0.00 173.10 172.28 1gfl s ASP 36 N -0.42 3.96 0.51 1.64 -1.08 0.97 -0.91 116.67 121.33 1gfl s ASP 36 Ca 0.07 -2.10 0.29 0.00 -0.52 0.00 0.00 52.55 50.29 1gfl s ASP 36 Cb -0.07 -1.02 0.99 0.00 -1.46 0.00 0.00 42.92 41.36 1gfl s ASP 36 CO -0.01 -0.35 1.84 0.00 0.52 0.00 0.00 175.17 177.18 1gfl h ALA 37 N 7.48 1.00 -0.44 3.66 0.00 -1.75 0.28 119.26 129.49 1gfl h ALA 37 Ca -0.07 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1gfl h ALA 37 Cb 0.98 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1gfl h ALA 37 CO 0.48 0.02 -0.06 1.15 0.00 0.00 0.00 179.25 180.84 1gfl h THR 38 N 0.00 1.25 0.00 0.00 2.02 -1.87 -2.84 112.91 111.47 1gfl h THR 38 Ca -0.00 -1.08 0.00 0.00 0.77 0.00 0.00 66.41 66.10 1gfl h THR 38 Cb 0.70 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1gfl h THR 38 CO 0.00 0.37 -1.51 0.00 0.37 0.00 0.00 175.52 174.75 1gfl n TYR 39 N -4.19 0.42 -1.99 3.16 4.19 -0.98 -4.93 117.16 112.84 1gfl n TYR 39 Ca 0.02 0.12 0.00 0.00 3.31 0.00 0.00 57.90 61.35 1gfl n TYR 39 Cb 0.33 -0.68 0.00 0.00 0.49 0.00 0.00 39.34 39.48 1gfl n TYR 39 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1gfl n GLY 40 N 1.24 0.79 3.04 2.98 0.00 0.80 -4.79 105.19 109.25 1gfl n GLY 40 Ca -0.02 -0.68 -0.17 0.00 0.00 0.00 0.00 46.02 45.15 1gfl n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gfl s LYS 41 N -4.04 0.65 -0.01 1.61 -2.85 -0.15 -0.07 119.74 114.87 1gfl s LYS 41 Ca 0.00 -0.46 0.05 0.00 -1.00 0.00 0.00 55.97 54.56 1gfl s LYS 41 Cb 0.00 -0.59 -0.01 0.00 -2.06 0.00 0.00 37.83 35.16 1gfl s LYS 41 CO 0.00 0.15 -0.17 -0.51 0.10 0.00 0.00 175.35 174.92 1gfl s LEU 42 N -0.65 2.03 -0.10 2.77 1.43 -0.60 -0.02 118.68 123.53 1gfl s LEU 42 Ca -0.00 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1gfl s LEU 42 Cb -0.05 -0.89 0.02 0.00 0.03 0.00 0.00 46.19 45.30 1gfl s LEU 42 CO 0.00 0.21 -0.11 -0.89 0.23 0.00 0.00 176.35 175.80 1gfl s THR 43 N -0.39 1.17 0.01 5.49 2.01 -0.64 -1.79 115.64 121.49 1gfl s THR 43 Ca 0.06 -0.42 0.01 0.00 0.31 0.00 0.00 61.69 61.65 1gfl s THR 43 Cb -0.07 -1.12 -0.01 0.00 0.01 0.00 0.00 72.50 71.31 1gfl s THR 43 CO -0.01 0.38 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.51 1gfl s LEU 44 N 1.27 2.07 -0.09 4.42 1.43 -0.45 -1.39 118.68 125.94 1gfl s LEU 44 Ca -0.03 -0.18 0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1gfl s LEU 44 Cb -0.14 -0.14 0.00 0.00 0.03 0.00 0.00 46.19 45.94 1gfl s LEU 44 CO -0.04 -0.04 -0.22 -0.75 0.23 0.00 0.00 176.35 175.54 1gfl s LYS 45 N -0.47 2.75 -0.06 1.70 2.20 -0.38 -0.69 119.74 124.79 1gfl s LYS 45 Ca -0.02 -0.79 0.05 0.00 -0.36 0.00 0.00 55.97 54.85 1gfl s LYS 45 Cb -0.04 -2.11 -0.02 0.00 -1.51 0.00 0.00 37.83 34.16 1gfl s LYS 45 CO -0.00 0.16 -0.20 -0.06 -0.36 0.00 0.00 175.35 174.89 1gfl s PHE 46 N 0.37 2.56 -0.08 4.03 0.08 0.25 -1.57 117.98 123.61 1gfl s PHE 46 Ca -0.17 -0.45 0.04 0.00 0.12 0.00 0.00 56.93 56.47 1gfl s PHE 46 Cb -0.17 -1.62 -0.00 0.00 -0.57 0.00 0.00 43.02 40.66 1gfl s PHE 46 CO 0.08 -0.03 -0.22 0.42 -0.10 0.00 0.00 175.22 175.36 1gfl s ILE 47 N -0.40 1.88 -0.40 0.64 -1.09 0.23 -1.66 121.20 120.40 1gfl s ILE 47 Ca 0.04 -0.93 -0.29 0.00 -2.23 0.00 0.00 60.65 57.24 1gfl s ILE 47 Cb -0.12 -1.63 0.02 0.00 -1.58 0.00 0.00 42.46 39.15 1gfl s ILE 47 CO 0.02 0.52 1.19 0.00 -1.23 0.00 0.00 174.94 175.44 1gfl n THR 49 N 6.56 0.10 -0.68 0.00 -2.24 -0.61 -3.83 114.28 113.58 1gfl n THR 49 Ca 0.13 -0.05 0.08 0.00 -2.27 0.00 0.00 64.05 61.94 1gfl n THR 49 Cb 0.48 -0.37 0.28 0.00 -2.10 0.00 0.00 70.33 68.62 1gfl n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1gfl n THR 50 N -1.63 1.90 0.00 4.28 -2.24 -1.25 -4.99 114.28 110.35 1gfl n THR 50 Ca 0.06 -1.42 0.00 0.00 -2.27 0.00 0.00 64.05 60.42 1gfl n THR 50 Cb 0.36 0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.62 1gfl n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gfl n GLY 51 N 0.33 0.12 3.78 3.38 0.00 -1.25 -4.97 105.19 106.58 1gfl n GLY 51 Ca 0.21 -1.57 -0.36 0.00 0.00 0.00 0.00 46.02 44.30 1gfl n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gfl s LYS 52 N -0.11 3.81 0.18 1.61 1.02 -1.26 -4.52 119.74 120.48 1gfl s LYS 52 Ca 0.00 -0.20 -0.32 0.00 0.02 0.00 0.00 55.97 55.47 1gfl s LYS 52 Cb 0.00 -3.28 -0.11 0.00 -0.52 0.00 0.00 37.83 33.92 1gfl s LYS 52 CO 0.00 0.51 1.64 -1.17 -0.92 0.00 0.00 175.35 175.41 1gfl s LEU 53 N -0.27 4.37 0.02 3.17 0.20 -1.26 -4.88 118.68 120.03 1gfl s LEU 53 Ca 0.11 2.73 0.28 0.00 0.69 0.00 0.00 54.13 57.94 1gfl s LEU 53 Cb -0.12 -3.60 1.07 0.00 -0.43 0.00 0.00 46.19 43.12 1gfl s LEU 53 CO 0.01 -0.89 1.82 -0.81 -0.29 0.00 0.00 176.35 176.19 1gfl n PRO 54 N 3.98 0.02 -4.49 0.98 -0.04 -1.26 -4.83 135.00 129.36 1gfl n PRO 54 Ca 0.15 0.02 -0.25 0.00 -0.04 0.00 0.00 63.50 63.37 1gfl n PRO 54 Cb 0.37 -1.53 -0.10 0.00 -0.04 0.00 0.00 33.50 32.20 1gfl n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1gfl s VAL 55 N -3.01 2.36 0.32 0.52 -7.23 -1.26 -4.90 120.40 107.20 1gfl s VAL 55 Ca 0.13 -2.17 -0.29 0.00 -1.81 0.00 0.00 61.98 57.84 1gfl s VAL 55 Cb 0.18 -2.65 -0.10 0.00 0.56 0.00 0.00 36.38 34.37 1gfl s VAL 55 CO 0.57 -0.22 1.35 -2.84 -0.31 0.00 0.00 175.10 173.65 1gfl s PRO 56 N -3.62 4.31 0.29 4.82 0.02 -1.26 -4.92 135.00 134.63 1gfl s PRO 56 Ca 0.33 2.28 0.04 0.00 0.02 0.00 0.00 61.00 63.66 1gfl s PRO 56 Cb 0.01 -3.06 0.65 0.00 0.02 0.00 0.00 34.50 32.12 1gfl s PRO 56 CO 0.17 -0.28 1.80 -1.49 -0.33 0.00 0.00 177.00 176.88 1gfl h TRP 57 N 3.60 1.11 -0.02 6.54 4.06 -1.97 -2.09 115.95 127.18 1gfl h TRP 57 Ca -0.49 0.03 0.01 0.00 2.06 0.00 0.00 58.89 60.50 1gfl h TRP 57 Cb 1.23 -0.34 -0.00 0.00 -1.00 0.00 0.00 29.16 29.04 1gfl h TRP 57 CO 0.56 0.34 0.02 -1.35 -3.56 0.00 0.00 178.44 174.45 1gfl h PRO 58 N 0.88 0.00 0.00 0.49 0.11 -1.91 -2.36 132.00 129.21 1gfl h PRO 58 Ca 0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.65 1gfl h PRO 58 Cb 0.70 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1gfl h PRO 58 CO -0.33 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.71 1gfl n THR 59 N -3.96 0.99 0.57 -1.15 -2.24 -0.78 -2.71 114.28 105.00 1gfl n THR 59 Ca -0.02 0.25 0.06 0.00 -2.27 0.00 0.00 64.05 62.07 1gfl n THR 59 Cb 0.11 -1.00 0.01 0.00 -2.10 0.00 0.00 70.33 67.35 1gfl n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1gfl n LEU 60 N -1.51 1.54 -0.27 3.22 4.77 -0.89 -4.67 117.00 119.20 1gfl n LEU 60 Ca 0.04 -0.81 -0.02 0.00 -0.03 0.00 0.00 56.01 55.19 1gfl n LEU 60 Cb 0.17 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.36 1gfl n LEU 60 CO 0.14 0.30 1.15 0.58 -1.33 0.00 0.00 177.39 178.23 1gfl h VAL 61 N 1.66 1.07 0.00 4.08 2.07 -1.60 -1.15 116.25 122.39 1gfl h VAL 61 Ca 0.00 -0.30 -0.07 0.00 0.82 0.00 0.00 66.70 67.15 1gfl h VAL 61 Cb 0.46 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1gfl h VAL 61 CO 0.00 0.16 -0.34 0.71 0.02 0.00 0.00 177.57 178.12 1gfl h THR 62 N 0.88 0.75 -0.03 2.57 1.35 -1.83 -0.42 112.91 116.17 1gfl h THR 62 Ca 0.31 -1.52 -0.07 0.00 -0.55 0.00 0.00 66.41 64.58 1gfl h THR 62 Cb 0.07 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1gfl h THR 62 CO -0.13 0.34 -0.27 0.74 -0.25 0.00 0.00 175.52 175.94 1gfl h THR 63 N 0.00 1.48 -0.41 6.82 2.02 -1.66 -1.16 112.91 120.00 1gfl h THR 63 Ca -0.00 -1.80 -0.04 0.00 0.77 0.00 0.00 66.41 65.33 1gfl h THR 63 Cb 0.95 2.53 -0.02 0.00 -1.74 0.00 0.00 68.15 69.87 1gfl h THR 63 CO 0.04 0.50 0.10 -0.26 0.37 0.00 0.00 175.52 176.27 1gfl h PHE 64 N -0.34 0.70 0.00 3.16 0.04 -1.22 -3.37 116.94 115.91 1gfl h PHE 64 Ca -0.03 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.66 1gfl h PHE 64 Cb 0.96 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 38.92 1gfl h PHE 64 CO 0.15 0.66 0.00 0.45 -0.60 0.00 0.00 178.31 178.97 1gfl n SER 65 N -4.54 0.00 0.00 2.17 2.88 -0.17 -4.08 113.62 109.87 1gfl n SER 65 Ca -0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1gfl n SER 65 Cb 0.21 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 1gfl n SER 65 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gfl n TYR 66 N 0.00 0.00 0.00 0.66 0.18 -1.15 -5.69 117.16 111.16 1gfl n TYR 66 Ca 0.00 0.00 -0.02 0.00 1.88 0.00 0.00 57.90 59.76 1gfl n TYR 66 Cb 0.00 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 38.85 1gfl n TYR 66 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1gfl n GLY 67 N 0.00 -1.13 2.54 -7.48 0.00 -0.45 -4.57 105.19 94.10 1gfl n GLY 67 Ca 0.00 -0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.63 1gfl n GLY 67 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1gfl n VAL 68 N -2.86 1.51 1.81 1.61 0.24 -1.26 -4.93 118.33 114.45 1gfl n VAL 68 Ca -0.13 -5.03 0.11 0.00 -2.04 0.00 0.00 64.34 57.24 1gfl n VAL 68 Cb 0.90 -1.22 0.63 0.00 -1.47 0.00 0.00 33.84 32.68 1gfl n VAL 68 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1gfl n GLN 69 N 0.29 0.90 0.07 7.34 6.02 -1.26 -1.61 117.38 129.13 1gfl n GLN 69 Ca 0.28 0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.36 1gfl n GLN 69 Cb 0.49 -1.37 0.41 0.00 1.02 0.00 0.00 30.24 30.79 1gfl n GLN 69 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1gfl n PHE 71 N -1.91 0.26 -1.71 0.00 3.72 -0.63 -4.74 117.46 112.45 1gfl n PHE 71 Ca 0.03 -0.13 -0.42 0.00 -0.05 0.00 0.00 57.45 56.87 1gfl n PHE 71 Cb 0.20 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.73 1gfl n PHE 71 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1gfl n SER 72 N 0.37 2.98 -4.65 4.37 7.64 -0.89 -4.01 113.62 119.43 1gfl n SER 72 Ca 0.16 1.20 -0.42 0.00 1.01 0.00 0.00 58.87 60.82 1gfl n SER 72 Cb 0.33 -1.51 -0.03 0.00 -1.01 0.00 0.00 64.21 61.99 1gfl n SER 72 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1gfl s ARG 73 N -1.76 4.18 -0.26 1.43 3.52 -0.53 -4.83 118.95 120.70 1gfl s ARG 73 Ca 0.56 1.08 -0.09 0.00 -0.13 0.00 0.00 55.73 57.15 1gfl s ARG 73 Cb -0.56 -3.66 -0.04 0.00 -1.56 0.00 0.00 34.95 29.13 1gfl s ARG 73 CO 0.61 -0.61 0.14 0.71 -0.81 0.00 0.00 175.30 175.34 1gfl s TYR 74 N 3.06 3.18 0.61 5.12 1.51 -1.26 -0.94 117.35 128.62 1gfl s TYR 74 Ca 0.39 -0.08 -0.19 0.00 -1.01 0.00 0.00 57.07 56.18 1gfl s TYR 74 Cb -0.15 -2.30 -0.04 0.00 -0.11 0.00 0.00 41.96 39.36 1gfl s TYR 74 CO 0.08 -0.21 1.13 -2.30 -1.11 0.00 0.00 175.55 173.14 1gfl n PRO 75 N 4.88 1.08 -0.24 -1.71 -0.02 -1.26 -4.75 135.00 132.99 1gfl n PRO 75 Ca -0.15 0.42 0.28 0.00 -2.02 0.00 0.00 63.50 62.02 1gfl n PRO 75 Cb 0.52 -2.34 0.67 0.00 -0.02 0.00 0.00 33.50 32.32 1gfl n PRO 75 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1gfl h ASP 76 N 0.65 0.13 1.72 2.55 5.19 -2.00 0.33 116.42 124.98 1gfl h ASP 76 Ca -0.50 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 55.93 1gfl h ASP 76 Cb 1.35 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.85 1gfl h ASP 76 CO 0.52 0.04 -0.07 1.12 -3.12 0.00 0.00 179.24 177.73 1gfl h HIS 77 N 0.12 0.00 -0.23 4.55 2.07 -1.99 -3.20 115.15 116.47 1gfl h HIS 77 Ca 0.49 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.86 1gfl h HIS 77 Cb 1.72 0.00 -0.10 0.00 2.57 0.00 0.00 27.41 31.60 1gfl h HIS 77 CO -0.00 0.00 -0.40 0.00 -3.07 0.00 0.00 177.93 174.46 1gfl n MET 78 N -2.74 1.97 0.16 5.12 -0.00 0.11 -4.65 117.12 117.09 1gfl n MET 78 Ca 0.04 -3.40 0.13 0.00 -0.00 0.00 0.00 57.70 54.47 1gfl n MET 78 Cb 0.49 -1.78 0.48 0.00 -0.00 0.00 0.00 33.22 32.41 1gfl n MET 78 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1gfl h LYS 79 N 1.19 0.00 0.00 3.17 1.57 -1.50 -1.74 116.57 119.25 1gfl h LYS 79 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1gfl h LYS 79 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 1gfl h LYS 79 CO 0.25 0.00 0.00 -2.13 -0.57 0.00 0.00 179.45 177.00 1gfl n ARG 80 N -2.50 0.13 -0.22 3.15 0.63 -1.26 -2.92 116.66 113.67 1gfl n ARG 80 Ca 0.03 0.37 0.08 0.00 -0.92 0.00 0.00 57.85 57.41 1gfl n ARG 80 Cb 0.33 -1.75 0.20 0.00 0.45 0.00 0.00 32.46 31.68 1gfl n ARG 80 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1gfl n HIS 81 N -2.00 0.58 -2.92 -0.14 8.25 -0.65 -4.77 115.22 113.58 1gfl n HIS 81 Ca 0.02 -0.46 -0.44 0.00 -0.26 0.00 0.00 57.72 56.59 1gfl n HIS 81 Cb 0.21 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 31.29 1gfl n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1gfl s ASP 82 N -1.02 6.92 0.21 0.41 -1.08 -1.15 -4.60 116.67 116.37 1gfl s ASP 82 Ca 0.30 -2.66 -0.09 0.00 -0.52 0.00 0.00 52.55 49.58 1gfl s ASP 82 Cb 0.16 -2.41 0.31 0.00 -1.46 0.00 0.00 42.92 39.52 1gfl s ASP 82 CO 0.21 -0.87 1.74 0.15 0.52 0.00 0.00 175.17 176.92 1gfl h PHE 83 N 7.71 0.38 -0.30 -5.34 3.57 -1.90 -3.04 116.94 118.03 1gfl h PHE 83 Ca 0.27 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.83 1gfl h PHE 83 Cb 0.92 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 1gfl h PHE 83 CO 1.14 0.07 0.12 0.74 -2.23 0.00 0.00 178.31 178.16 1gfl h PHE 84 N 0.39 0.23 0.00 0.41 0.04 -1.89 -1.62 116.94 114.51 1gfl h PHE 84 Ca 0.33 0.01 -0.09 0.00 2.80 0.00 0.00 57.97 61.02 1gfl h PHE 84 Cb 0.43 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.51 1gfl h PHE 84 CO -0.18 0.11 -0.44 0.87 -0.60 0.00 0.00 178.31 178.08 1gfl h LYS 85 N 0.27 0.00 0.00 1.51 1.57 -1.85 -3.20 116.57 114.88 1gfl h LYS 85 Ca 0.13 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1gfl h LYS 85 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.38 1gfl h LYS 85 CO -0.11 0.44 -0.01 0.66 -0.57 0.00 0.00 179.45 179.85 1gfl h SER 86 N 0.00 0.00 0.46 0.86 4.64 -1.18 -2.67 113.55 115.66 1gfl h SER 86 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1gfl h SER 86 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1gfl h SER 86 CO 0.06 0.01 -0.18 0.00 -0.87 0.00 0.00 176.83 175.85 1gfl n ALA 87 N -2.10 2.87 -2.44 5.18 0.00 -0.98 -4.76 120.51 118.29 1gfl n ALA 87 Ca 0.01 -0.27 -0.31 0.00 0.00 0.00 0.00 53.44 52.87 1gfl n ALA 87 Cb 0.33 -1.29 -0.04 0.00 0.00 0.00 0.00 19.45 18.45 1gfl n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1gfl s MET 88 N -2.64 3.73 0.00 0.00 1.00 -1.00 -0.85 119.30 119.54 1gfl s MET 88 Ca 0.23 0.19 0.28 0.00 0.00 0.00 0.00 55.69 56.39 1gfl s MET 88 Cb 0.19 -2.63 1.23 0.00 0.00 0.00 0.00 34.83 33.63 1gfl s MET 88 CO 0.53 0.25 1.91 -0.35 0.00 0.00 0.00 175.02 177.36 1gfl n PRO 89 N -0.53 0.04 -0.02 2.03 -0.04 -1.26 -4.65 135.00 130.57 1gfl n PRO 89 Ca -0.00 0.01 -0.07 0.00 -0.04 0.00 0.00 63.50 63.40 1gfl n PRO 89 Cb 0.53 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.59 1gfl n PRO 89 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1gfl h GLU 90 N 0.00 0.60 0.00 0.54 3.07 -1.88 -2.45 114.58 114.46 1gfl h GLU 90 Ca 0.00 -0.30 0.00 0.00 -0.50 0.00 0.00 59.36 58.56 1gfl h GLU 90 Cb 0.46 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 1gfl h GLU 90 CO 0.00 0.88 0.00 0.41 -1.40 0.00 0.00 179.01 178.90 1gfl n GLY 91 N -0.04 -1.63 3.15 -3.84 0.00 -0.03 -4.65 105.19 98.16 1gfl n GLY 91 Ca -0.02 -2.08 -0.09 0.00 0.00 0.00 0.00 46.02 43.83 1gfl n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1gfl s TYR 92 N -0.04 0.20 -0.15 1.61 -0.85 -0.43 -0.86 117.35 116.84 1gfl s TYR 92 Ca 0.00 -0.57 -0.13 0.00 -0.52 0.00 0.00 57.07 55.85 1gfl s TYR 92 Cb 0.00 -0.13 -0.05 0.00 0.38 0.00 0.00 41.96 42.16 1gfl s TYR 92 CO 0.00 -0.44 0.29 0.08 -1.52 0.00 0.00 175.55 173.96 1gfl s VAL 93 N -3.21 5.30 -0.18 -3.49 1.01 0.10 -1.16 120.40 118.77 1gfl s VAL 93 Ca 0.00 0.54 -0.00 0.00 0.00 0.00 0.00 61.98 62.51 1gfl s VAL 93 Cb 0.02 -3.62 0.00 0.00 0.00 0.00 0.00 36.38 32.79 1gfl s VAL 93 CO -0.07 0.42 -0.15 -1.58 0.00 0.00 0.00 175.10 173.71 1gfl s GLN 94 N 0.27 3.16 0.02 2.72 0.74 -0.09 -1.70 119.66 124.79 1gfl s GLN 94 Ca 0.17 -0.76 0.07 0.00 0.05 0.00 0.00 55.36 54.89 1gfl s GLN 94 Cb -0.13 -2.67 -0.02 0.00 1.10 0.00 0.00 33.01 31.28 1gfl s GLN 94 CO 0.04 -0.10 -0.22 -1.21 -0.55 0.00 0.00 175.29 173.26 1gfl s GLU 95 N 1.10 1.58 0.02 1.67 2.02 -0.13 -0.63 118.70 124.34 1gfl s GLU 95 Ca 0.00 -0.87 -0.02 0.00 0.02 0.00 0.00 54.97 54.10 1gfl s GLU 95 Cb -0.14 -1.63 -0.02 0.00 0.10 0.00 0.00 34.13 32.44 1gfl s GLU 95 CO -0.05 0.43 0.00 1.03 0.02 0.00 0.00 175.26 176.69 1gfl s ARG 96 N -0.87 0.39 -0.12 1.61 0.52 -0.86 -1.09 118.95 118.54 1gfl s ARG 96 Ca 0.08 -0.66 0.01 0.00 -0.52 0.00 0.00 55.73 54.64 1gfl s ARG 96 Cb -0.09 0.14 -0.01 0.00 0.52 0.00 0.00 34.95 35.52 1gfl s ARG 96 CO 0.01 -0.07 -0.16 0.99 0.02 0.00 0.00 175.30 176.09 1gfl s THR 97 N -1.82 2.83 -0.24 0.02 2.01 -0.79 -0.69 115.64 116.96 1gfl s THR 97 Ca -0.12 -0.74 -0.00 0.00 0.31 0.00 0.00 61.69 61.13 1gfl s THR 97 Cb -0.07 -2.16 0.03 0.00 0.01 0.00 0.00 72.50 70.31 1gfl s THR 97 CO -0.02 0.53 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.72 1gfl s ILE 98 N 0.31 2.56 -0.37 1.82 1.01 0.20 -1.40 121.20 125.33 1gfl s ILE 98 Ca -0.12 -1.16 -0.13 0.00 0.00 0.00 0.00 60.65 59.23 1gfl s ILE 98 Cb -0.16 -2.31 -0.00 0.00 0.01 0.00 0.00 42.46 39.99 1gfl s ILE 98 CO 0.06 0.20 0.26 -0.36 0.00 0.00 0.00 174.94 175.10 1gfl s PHE 99 N 1.26 3.23 -0.18 3.97 0.08 0.43 -1.42 117.98 125.36 1gfl s PHE 99 Ca -0.01 -0.39 -0.28 0.00 0.12 0.00 0.00 56.93 56.36 1gfl s PHE 99 Cb -0.17 -2.51 -0.00 0.00 -0.57 0.00 0.00 43.02 39.77 1gfl s PHE 99 CO -0.06 -0.46 0.98 -0.06 -0.10 0.00 0.00 175.22 175.52 1gfl s PHE 100 N 1.70 3.41 0.10 0.36 0.40 -0.70 -1.25 117.98 122.01 1gfl s PHE 100 Ca 0.05 1.46 -0.31 0.00 -0.60 0.00 0.00 56.93 57.53 1gfl s PHE 100 Cb -0.18 -3.18 -0.09 0.00 0.51 0.00 0.00 43.02 40.08 1gfl s PHE 100 CO 0.10 -0.34 1.65 0.21 0.70 0.00 0.00 175.22 177.54 1gfl s LYS 101 N 2.56 4.19 -1.16 0.44 2.20 -0.58 -0.82 119.74 126.58 1gfl s LYS 101 Ca 0.44 2.37 0.00 0.00 -0.36 0.00 0.00 55.97 58.42 1gfl s LYS 101 Cb -0.16 -3.48 0.00 0.00 -1.51 0.00 0.00 37.83 32.68 1gfl s LYS 101 CO 0.11 -0.71 0.00 -0.25 -0.36 0.00 0.00 175.35 174.14 1gfl n ASP 102 N 5.17 -4.17 -0.27 1.43 8.00 -1.26 -4.81 116.55 120.64 1gfl n ASP 102 Ca 0.16 0.03 0.00 0.00 0.71 0.00 0.00 54.79 55.69 1gfl n ASP 102 Cb 0.40 -3.29 0.00 0.00 -0.02 0.00 0.00 41.12 38.21 1gfl n ASP 102 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1gfl n ASP 103 N -0.47 0.00 -2.85 -2.24 -0.08 0.00 -4.95 116.55 105.97 1gfl n ASP 103 Ca -0.15 -0.27 0.00 0.00 -1.51 0.00 0.00 54.79 52.86 1gfl n ASP 103 Cb 0.60 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.06 1gfl n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1gfl n GLY 104 N 0.00 -0.97 3.16 0.27 0.00 -0.96 -4.62 105.19 102.07 1gfl n GLY 104 Ca 0.00 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 44.29 1gfl n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gfl s ASN 105 N -1.05 -0.07 -0.05 1.61 2.20 -0.64 -1.72 114.94 115.22 1gfl s ASN 105 Ca 0.00 -0.07 -0.02 0.00 -0.94 0.00 0.00 52.86 51.83 1gfl s ASN 105 Cb 0.00 0.26 -0.04 0.00 -2.00 0.00 0.00 41.25 39.47 1gfl s ASN 105 CO 0.00 -0.39 0.07 -0.31 -2.94 0.00 0.00 177.10 173.54 1gfl s TYR 106 N -1.30 3.32 -0.10 1.54 2.02 -0.51 -1.83 117.35 120.49 1gfl s TYR 106 Ca -0.14 0.28 0.02 0.00 -0.37 0.00 0.00 57.07 56.86 1gfl s TYR 106 Cb -0.06 -1.80 0.01 0.00 -0.40 0.00 0.00 41.96 39.71 1gfl s TYR 106 CO 0.03 0.57 -0.16 0.15 -1.57 0.00 0.00 175.55 174.57 1gfl s LYS 107 N -1.36 2.27 0.11 -0.62 1.02 0.19 -0.63 119.74 120.73 1gfl s LYS 107 Ca 0.19 -0.59 0.06 0.00 0.02 0.00 0.00 55.97 55.65 1gfl s LYS 107 Cb -0.12 -1.90 -0.04 0.00 -0.52 0.00 0.00 37.83 35.26 1gfl s LYS 107 CO 0.09 -0.03 -0.15 0.95 -0.92 0.00 0.00 175.35 175.29 1gfl s THR 108 N 0.89 1.32 -0.01 2.17 -4.23 0.13 -1.43 115.64 114.48 1gfl s THR 108 Ca -0.08 -1.61 0.00 0.00 -1.18 0.00 0.00 61.69 58.82 1gfl s THR 108 Cb -0.15 -1.43 0.02 0.00 1.34 0.00 0.00 72.50 72.27 1gfl s THR 108 CO -0.00 -0.34 0.01 -0.60 -0.54 0.00 0.00 174.62 173.15 1gfl s ARG 109 N -2.40 0.07 0.05 3.99 3.52 -0.43 -2.02 118.95 121.73 1gfl s ARG 109 Ca 0.06 0.08 0.01 0.00 -0.13 0.00 0.00 55.73 55.76 1gfl s ARG 109 Cb -0.06 -0.23 -0.03 0.00 -1.56 0.00 0.00 34.95 33.07 1gfl s ARG 109 CO 0.03 -0.09 -0.05 0.00 -0.81 0.00 0.00 175.30 174.37 1gfl s ALA 110 N 0.66 0.50 -0.10 6.12 0.00 0.20 -0.81 121.76 128.33 1gfl s ALA 110 Ca -0.06 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.04 1gfl s ALA 110 Cb -0.08 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 1gfl s ALA 110 CO -0.02 -0.16 -0.21 -1.21 0.00 0.00 0.00 175.76 174.16 1gfl s GLU 111 N -2.36 3.08 -0.19 0.00 2.02 -0.28 -0.91 118.70 120.05 1gfl s GLU 111 Ca -0.05 -0.82 0.01 0.00 0.02 0.00 0.00 54.97 54.13 1gfl s GLU 111 Cb -0.04 -2.38 0.03 0.00 0.10 0.00 0.00 34.13 31.84 1gfl s GLU 111 CO -0.03 0.22 -0.15 0.08 0.02 0.00 0.00 175.26 175.41 1gfl s VAL 112 N 0.26 1.88 0.20 2.63 1.01 -0.31 -1.76 120.40 124.31 1gfl s VAL 112 Ca -0.14 -1.00 -0.22 0.00 0.00 0.00 0.00 61.98 60.62 1gfl s VAL 112 Cb -0.17 -1.81 0.05 0.00 0.00 0.00 0.00 36.38 34.45 1gfl s VAL 112 CO 0.07 0.35 0.64 -1.59 0.00 0.00 0.00 175.10 174.57 1gfl s LYS 113 N 1.33 1.47 0.00 2.72 -2.85 -0.96 -1.31 119.74 120.13 1gfl s LYS 113 Ca 0.01 -0.67 -0.28 0.00 -1.00 0.00 0.00 55.97 54.03 1gfl s LYS 113 Cb -0.15 0.60 -0.04 0.00 -2.06 0.00 0.00 37.83 36.18 1gfl s LYS 113 CO -0.10 -0.65 0.90 -0.06 0.10 0.00 0.00 175.35 175.53 1gfl s PHE 114 N -3.81 3.66 -0.46 1.78 0.08 -0.92 -1.34 117.98 116.96 1gfl s PHE 114 Ca 0.05 1.59 0.04 0.00 0.12 0.00 0.00 56.93 58.73 1gfl s PHE 114 Cb -0.03 -3.02 0.12 0.00 -0.57 0.00 0.00 43.02 39.52 1gfl s PHE 114 CO -0.06 0.06 0.19 -1.21 -0.10 0.00 0.00 175.22 174.10 1gfl s GLU 115 N 0.78 1.82 6.69 0.44 2.02 -0.68 -4.92 118.70 124.86 1gfl s GLU 115 Ca 0.47 -2.39 0.00 0.00 0.02 0.00 0.00 54.97 53.07 1gfl s GLU 115 Cb -0.20 -3.29 0.00 0.00 0.10 0.00 0.00 34.13 30.74 1gfl s GLU 115 CO 0.26 -1.06 0.00 0.41 0.02 0.00 0.00 175.26 174.89 1gfl n GLY 116 N 3.47 1.06 0.90 -1.39 0.00 -1.26 -3.00 105.19 104.98 1gfl n GLY 116 Ca 0.05 -0.62 0.12 0.00 0.00 0.00 0.00 46.02 45.57 1gfl n GLY 116 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gfl n ASP 117 N 7.68 2.75 -4.35 1.61 5.68 -1.26 -4.94 116.55 123.72 1gfl n ASP 117 Ca 0.00 -1.88 -0.31 0.00 -0.50 0.00 0.00 54.79 52.10 1gfl n ASP 117 Cb 0.00 -0.11 -0.15 0.00 -1.14 0.00 0.00 41.12 39.72 1gfl n ASP 117 CO 0.00 0.00 0.00 0.42 -1.33 0.00 0.00 177.20 176.29 1gfl s THR 118 N -1.77 2.21 -0.16 2.12 -4.23 -1.16 -4.47 115.64 108.17 1gfl s THR 118 Ca 0.34 -1.24 -0.26 0.00 -1.18 0.00 0.00 61.69 59.35 1gfl s THR 118 Cb 0.21 -1.83 -0.01 0.00 1.34 0.00 0.00 72.50 72.20 1gfl s THR 118 CO 0.30 0.45 0.86 -0.22 -0.54 0.00 0.00 174.62 175.47 1gfl s LEU 119 N -1.01 4.18 0.01 4.79 0.20 0.06 -1.68 118.68 125.24 1gfl s LEU 119 Ca 0.11 1.23 0.08 0.00 0.69 0.00 0.00 54.13 56.24 1gfl s LEU 119 Cb -0.10 -3.28 -0.02 0.00 -0.43 0.00 0.00 46.19 42.35 1gfl s LEU 119 CO 0.01 -0.41 -0.25 0.68 -0.29 0.00 0.00 176.35 176.09 1gfl s VAL 120 N 2.13 1.99 -0.26 1.68 -7.23 -0.45 -0.49 120.40 117.77 1gfl s VAL 120 Ca 0.40 -1.19 0.02 0.00 -1.81 0.00 0.00 61.98 59.40 1gfl s VAL 120 Cb -0.17 -1.67 0.07 0.00 0.56 0.00 0.00 36.38 35.17 1gfl s VAL 120 CO 0.13 0.45 -0.04 0.21 -0.31 0.00 0.00 175.10 175.54 1gfl s ASN 121 N -0.87 4.13 -0.18 4.85 3.04 0.66 -2.27 114.94 124.30 1gfl s ASN 121 Ca 0.10 -1.39 -0.04 0.00 0.04 0.00 0.00 52.86 51.57 1gfl s ASN 121 Cb -0.10 -1.31 -0.02 0.00 -1.54 0.00 0.00 41.25 38.28 1gfl s ASN 121 CO 0.00 -0.26 -0.03 -0.13 -3.04 0.00 0.00 177.10 173.65 1gfl s ARG 122 N 1.27 3.60 0.01 0.43 0.52 -0.72 -0.88 118.95 123.19 1gfl s ARG 122 Ca -0.03 -0.54 0.05 0.00 -0.52 0.00 0.00 55.73 54.68 1gfl s ARG 122 Cb -0.19 -2.96 -0.02 0.00 0.52 0.00 0.00 34.95 32.30 1gfl s ARG 122 CO -0.07 0.12 -0.14 0.42 0.02 0.00 0.00 175.30 175.64 1gfl s ILE 123 N 0.70 1.13 -0.08 1.52 1.01 0.35 -1.13 121.20 124.70 1gfl s ILE 123 Ca -0.02 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 59.89 1gfl s ILE 123 Cb -0.14 -0.98 -0.01 0.00 0.01 0.00 0.00 42.46 41.34 1gfl s ILE 123 CO 0.02 0.18 -0.19 -1.61 0.00 0.00 0.00 174.94 173.34 1gfl s GLU 124 N -0.69 2.83 -0.02 2.79 2.02 0.01 -1.84 118.70 123.80 1gfl s GLU 124 Ca 0.04 -0.80 0.03 0.00 0.02 0.00 0.00 54.97 54.26 1gfl s GLU 124 Cb -0.06 -2.36 0.00 0.00 0.10 0.00 0.00 34.13 31.81 1gfl s GLU 124 CO 0.00 0.36 -0.09 -1.17 0.02 0.00 0.00 175.26 174.38 1gfl s LEU 125 N -0.09 1.82 -0.06 1.80 0.20 -0.64 -1.32 118.68 120.39 1gfl s LEU 125 Ca -0.04 -0.19 0.03 0.00 0.69 0.00 0.00 54.13 54.62 1gfl s LEU 125 Cb -0.14 -0.56 0.01 0.00 -0.43 0.00 0.00 46.19 45.07 1gfl s LEU 125 CO 0.04 0.08 -0.16 -0.75 -0.29 0.00 0.00 176.35 175.27 1gfl s LYS 126 N 0.14 1.94 -0.02 1.98 2.36 -0.51 -1.80 119.74 123.81 1gfl s LYS 126 Ca -0.02 -0.55 0.05 0.00 -2.55 0.00 0.00 55.97 52.91 1gfl s LYS 126 Cb -0.08 -1.59 -0.01 0.00 -1.05 0.00 0.00 37.83 35.10 1gfl s LYS 126 CO 0.00 0.12 -0.18 0.20 1.55 0.00 0.00 175.35 177.04 1gfl s GLY 127 N 0.42 0.92 0.20 5.54 0.00 0.48 -0.64 107.32 114.24 1gfl s GLY 127 Ca -0.12 -0.78 -0.05 0.00 0.00 0.00 0.00 44.72 43.77 1gfl s GLY 127 CO 0.04 -0.58 0.23 -0.26 0.00 0.00 0.00 173.10 172.52 1gfl s ILE 128 N -0.30 0.03 -0.87 0.90 -5.25 -0.76 -0.50 121.20 114.44 1gfl s ILE 128 Ca 0.04 -1.75 0.00 0.00 -0.99 0.00 0.00 60.65 57.95 1gfl s ILE 128 Cb -0.08 -2.26 0.00 0.00 2.95 0.00 0.00 42.46 43.07 1gfl s ILE 128 CO 0.00 -0.12 0.00 0.47 -1.79 0.00 0.00 174.94 173.51 1gfl n ASP 129 N -0.26 -3.51 -4.76 4.36 8.00 -1.26 -1.62 116.55 117.50 1gfl n ASP 129 Ca -0.01 0.06 -0.39 0.00 0.71 0.00 0.00 54.79 55.16 1gfl n ASP 129 Cb 0.64 -2.52 -0.06 0.00 -0.02 0.00 0.00 41.12 39.17 1gfl n ASP 129 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1gfl s PHE 130 N -2.44 3.64 0.29 1.24 0.08 -1.26 -2.26 117.98 117.27 1gfl s PHE 130 Ca 0.00 1.12 -0.29 0.00 0.12 0.00 0.00 56.93 57.88 1gfl s PHE 130 Cb 0.00 -2.59 -0.10 0.00 -0.57 0.00 0.00 43.02 39.76 1gfl s PHE 130 CO 0.00 0.31 1.22 0.15 -0.10 0.00 0.00 175.22 176.80 1gfl s LYS 131 N 0.00 4.48 0.00 0.44 1.02 -1.26 -4.92 119.74 119.50 1gfl s LYS 131 Ca 0.30 2.02 0.26 0.00 0.02 0.00 0.00 55.97 58.57 1gfl s LYS 131 Cb -0.17 -3.14 1.22 0.00 -0.52 0.00 0.00 37.83 35.22 1gfl s LYS 131 CO 0.15 -0.02 1.86 0.39 -0.92 0.00 0.00 175.35 176.82 1gfl n GLU 132 N 1.16 0.19 0.00 1.68 -0.58 -1.26 -1.65 120.64 120.19 1gfl n GLU 132 Ca 0.00 0.05 0.04 0.00 -0.42 0.00 0.00 57.16 56.82 1gfl n GLU 132 Cb 0.43 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.83 1gfl n GLU 132 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1gfl n ASP 133 N -1.39 1.56 -3.58 1.62 5.75 -1.26 -3.97 116.55 115.28 1gfl n ASP 133 Ca 0.09 -1.28 -0.26 0.00 -0.01 0.00 0.00 54.79 53.33 1gfl n ASP 133 Cb 0.25 0.02 0.20 0.00 -1.03 0.00 0.00 41.12 40.56 1gfl n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gfl n GLY 134 N 0.41 -1.97 0.25 6.12 0.00 -0.66 -4.68 105.19 104.66 1gfl n GLY 134 Ca 0.04 -1.62 0.02 0.00 0.00 0.00 0.00 46.02 44.46 1gfl n GLY 134 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1gfl h ASN 135 N -1.94 0.28 0.00 1.61 -0.26 -1.94 0.13 115.58 113.45 1gfl h ASN 135 Ca -0.37 -0.05 -0.01 0.00 -0.56 0.00 0.00 56.30 55.31 1gfl h ASN 135 Cb 1.07 -0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 38.26 1gfl h ASN 135 CO 0.26 0.39 -0.10 0.40 -1.06 0.00 0.00 177.43 177.32 1gfl h ILE 136 N 0.28 0.25 0.00 2.81 5.03 -1.92 -1.27 117.51 122.70 1gfl h ILE 136 Ca 0.06 -1.20 -0.02 0.00 -0.12 0.00 0.00 64.86 63.58 1gfl h ILE 136 Cb 0.32 0.49 -0.00 0.00 -3.03 0.00 0.00 36.82 34.60 1gfl h ILE 136 CO 0.02 0.09 -0.10 -0.07 -0.68 0.00 0.00 178.15 177.40 1gfl h LEU 137 N -1.00 0.00 -0.07 1.44 -0.00 -1.70 -1.46 115.31 112.52 1gfl h LEU 137 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1gfl h LEU 137 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.89 1gfl h LEU 137 CO -0.01 0.10 0.00 0.61 -0.00 0.00 0.00 178.44 179.15 1gfl n GLY 138 N 0.49 -1.53 3.40 0.83 0.00 0.46 -4.89 105.19 103.94 1gfl n GLY 138 Ca 0.02 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.82 1gfl n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1gfl n HIS 139 N -1.91 -2.25 0.45 1.61 8.25 -0.55 -4.92 115.22 115.90 1gfl n HIS 139 Ca 0.06 0.90 0.10 0.00 -0.26 0.00 0.00 57.72 58.51 1gfl n HIS 139 Cb 0.36 -4.72 0.14 0.00 1.12 0.00 0.00 29.99 26.89 1gfl n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1gfl n LYS 140 N -3.87 2.08 -2.62 -0.41 5.02 -0.52 -4.98 118.16 112.86 1gfl n LYS 140 Ca -0.22 -1.94 -0.40 0.00 -2.02 0.00 0.00 58.31 53.73 1gfl n LYS 140 Cb 0.65 -1.41 -0.05 0.00 -0.02 0.00 0.00 35.03 34.20 1gfl n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1gfl s LEU 141 N -1.44 4.56 0.46 -0.35 1.43 -1.26 -0.66 118.68 121.43 1gfl s LEU 141 Ca 0.29 2.09 -0.22 0.00 -1.03 0.00 0.00 54.13 55.26 1gfl s LEU 141 Cb 0.18 -3.67 -0.08 0.00 0.03 0.00 0.00 46.19 42.65 1gfl s LEU 141 CO 0.26 -0.02 1.08 -1.61 0.23 0.00 0.00 176.35 176.29 1gfl s GLU 142 N -1.42 3.84 -1.30 1.70 2.02 -0.21 -4.79 118.70 118.55 1gfl s GLU 142 Ca 0.44 1.53 -0.17 0.00 0.02 0.00 0.00 54.97 56.79 1gfl s GLU 142 Cb -0.28 -2.29 0.09 0.00 0.10 0.00 0.00 34.13 31.75 1gfl s GLU 142 CO 0.35 -0.42 1.72 0.98 0.02 0.00 0.00 175.26 177.91 1gfl n TYR 143 N -0.63 4.61 -3.85 1.61 9.36 -1.26 -4.81 117.16 122.19 1gfl n TYR 143 Ca 0.08 -2.94 -0.05 0.00 3.32 0.00 0.00 57.90 58.30 1gfl n TYR 143 Cb 0.50 -2.54 0.02 0.00 -0.63 0.00 0.00 39.34 36.69 1gfl n TYR 143 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1gfl s ASN 144 N 3.84 0.00 0.03 2.98 2.20 -1.26 -4.84 114.94 117.89 1gfl s ASN 144 Ca 0.51 -0.86 -0.15 0.00 -0.94 0.00 0.00 52.86 51.42 1gfl s ASN 144 Cb 0.04 0.64 0.03 0.00 -2.00 0.00 0.00 41.25 39.95 1gfl s ASN 144 CO 0.05 -1.27 0.34 -0.47 -2.94 0.00 0.00 177.10 172.81 1gfl s TYR 145 N -2.22 -0.17 0.48 1.54 5.04 -1.26 -4.88 117.35 115.87 1gfl s TYR 145 Ca 0.19 0.13 0.06 0.00 -2.44 0.00 0.00 57.07 55.01 1gfl s TYR 145 Cb -0.04 0.13 -0.00 0.00 0.35 0.00 0.00 41.96 42.40 1gfl s TYR 145 CO 0.08 -0.50 0.29 -0.80 -1.34 0.00 0.00 175.55 173.28 1gfl s ASN 146 N -1.85 4.58 0.16 4.32 0.01 -1.26 -4.82 114.94 116.08 1gfl s ASN 146 Ca -0.07 -1.16 -0.21 0.00 -0.71 0.00 0.00 52.86 50.71 1gfl s ASN 146 Cb -0.02 -0.01 -0.08 0.00 0.41 0.00 0.00 41.25 41.55 1gfl s ASN 146 CO -0.01 -0.83 0.70 -0.44 -1.51 0.00 0.00 177.10 175.01 1gfl s SER 147 N -4.10 7.17 0.03 -1.22 0.01 -1.26 -4.33 113.70 110.00 1gfl s SER 147 Ca 0.36 1.45 -0.04 0.00 1.31 0.00 0.00 55.95 59.02 1gfl s SER 147 Cb -0.00 -2.43 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 1gfl s SER 147 CO 0.21 0.16 0.07 -1.00 0.41 0.00 0.00 173.24 173.09 1gfl s HIS 148 N -1.28 0.19 -0.06 2.43 3.76 -0.59 -4.99 115.29 114.76 1gfl s HIS 148 Ca 0.37 -0.45 -0.04 0.00 -0.15 0.00 0.00 55.06 54.78 1gfl s HIS 148 Cb -0.20 -0.14 -0.04 0.00 1.11 0.00 0.00 32.58 33.31 1gfl s HIS 148 CO 0.22 -0.31 0.13 -0.80 -0.85 0.00 0.00 174.74 173.13 1gfl s ASN 149 N -1.86 6.12 -0.23 1.40 0.02 -1.26 -0.70 114.94 118.43 1gfl s ASN 149 Ca -0.09 0.33 0.02 0.00 -1.02 0.00 0.00 52.86 52.10 1gfl s ASN 149 Cb -0.04 -1.90 0.05 0.00 0.02 0.00 0.00 41.25 39.38 1gfl s ASN 149 CO -0.03 0.33 -0.13 -0.69 0.02 0.00 0.00 177.10 176.61 1gfl s VAL 150 N -1.14 2.00 -0.11 1.60 1.01 -0.13 -4.73 120.40 118.90 1gfl s VAL 150 Ca 0.20 -1.31 -0.17 0.00 0.00 0.00 0.00 61.98 60.70 1gfl s VAL 150 Cb -0.12 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1gfl s VAL 150 CO 0.10 0.16 0.43 -0.31 0.00 0.00 0.00 175.10 175.48 1gfl s TYR 151 N 1.23 3.53 -0.09 5.22 2.02 -0.88 -0.57 117.35 127.80 1gfl s TYR 151 Ca -0.04 0.84 0.04 0.00 -0.37 0.00 0.00 57.07 57.54 1gfl s TYR 151 Cb -0.17 -2.48 0.00 0.00 -0.40 0.00 0.00 41.96 38.91 1gfl s TYR 151 CO -0.08 0.23 -0.21 0.42 -1.57 0.00 0.00 175.55 174.34 1gfl s ILE 152 N 0.40 1.85 0.06 2.71 1.01 -0.74 -1.74 121.20 124.75 1gfl s ILE 152 Ca 0.24 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 60.01 1gfl s ILE 152 Cb -0.15 -1.61 -0.03 0.00 0.01 0.00 0.00 42.46 40.69 1gfl s ILE 152 CO 0.09 0.51 -0.08 0.00 0.00 0.00 0.00 174.94 175.46 1gfl s MET 153 N 0.39 0.62 0.51 2.79 0.23 -0.53 -2.56 119.30 120.74 1gfl s MET 153 Ca -0.17 -0.89 -0.20 0.00 -1.03 0.00 0.00 55.69 53.40 1gfl s MET 153 Cb -0.17 -0.33 -0.07 0.00 -1.53 0.00 0.00 34.83 32.73 1gfl s MET 153 CO 0.08 0.05 1.09 0.00 -2.03 0.00 0.00 175.02 174.21 1gfl s ALA 154 N -1.80 2.79 -0.52 3.16 0.00 -1.24 -0.85 121.76 123.30 1gfl s ALA 154 Ca -0.05 0.74 0.04 0.00 0.00 0.00 0.00 51.96 52.69 1gfl s ALA 154 Cb -0.07 -3.32 0.13 0.00 0.00 0.00 0.00 23.12 19.87 1gfl s ALA 154 CO -0.00 -0.57 0.28 0.34 0.00 0.00 0.00 175.76 175.81 1gfl s ASP 155 N -1.83 4.24 0.25 0.00 2.15 0.30 -4.61 116.67 117.16 1gfl s ASP 155 Ca 0.70 -3.04 -0.03 0.00 0.43 0.00 0.00 52.55 50.60 1gfl s ASP 155 Cb -0.21 -1.54 0.43 0.00 -0.30 0.00 0.00 42.92 41.30 1gfl s ASP 155 CO 0.24 -0.22 1.81 0.50 -0.17 0.00 0.00 175.17 177.33 1gfl h LYS 156 N 6.42 0.76 -0.10 4.34 1.63 -1.95 -2.00 116.57 125.67 1gfl h LYS 156 Ca -0.05 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.70 1gfl h LYS 156 Cb 0.88 -0.17 -0.01 0.00 -0.60 0.00 0.00 32.23 32.33 1gfl h LYS 156 CO 0.66 0.50 0.01 1.96 -3.45 0.00 0.00 179.45 179.14 1gfl h GLN 157 N 0.79 0.13 -0.31 1.90 4.20 -1.94 -1.92 115.11 117.96 1gfl h GLN 157 Ca 0.41 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.11 1gfl h GLN 157 Cb 0.41 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1gfl h GLN 157 CO -0.26 0.14 0.00 1.63 -0.67 0.00 0.00 178.83 179.66 1gfl n LYS 158 N -4.47 2.27 -4.00 1.46 4.01 -0.94 -4.97 118.16 111.52 1gfl n LYS 158 Ca -0.01 -2.09 -0.31 0.00 -0.51 0.00 0.00 58.31 55.38 1gfl n LYS 158 Cb 0.12 -1.44 0.01 0.00 -0.51 0.00 0.00 35.03 33.21 1gfl n LYS 158 CO 0.00 0.00 0.00 -1.71 -1.11 0.00 0.00 177.40 174.58 1gfl n ASN 159 N 1.26 -3.65 0.00 4.39 5.15 -0.72 -4.80 115.26 116.89 1gfl n ASN 159 Ca 0.16 -0.88 0.00 0.00 -0.60 0.00 0.00 54.58 53.27 1gfl n ASN 159 Cb 0.54 -3.47 0.00 0.00 -0.53 0.00 0.00 39.78 36.32 1gfl n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1gfl n GLY 160 N -1.62 4.71 3.07 8.20 0.00 -0.80 -4.34 105.19 114.42 1gfl n GLY 160 Ca -0.01 -0.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.92 1gfl n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1gfl s ILE 161 N -0.09 0.44 -0.02 -0.61 -4.36 -0.85 -0.54 121.20 115.17 1gfl s ILE 161 Ca 0.00 -1.35 0.04 0.00 -0.26 0.00 0.00 60.65 59.08 1gfl s ILE 161 Cb 0.00 -0.92 -0.03 0.00 1.25 0.00 0.00 42.46 42.76 1gfl s ILE 161 CO 0.00 -0.61 -0.14 -0.54 0.24 0.00 0.00 174.94 173.89 1gfl s LYS 162 N -2.42 2.43 -0.04 0.37 1.02 -0.03 -1.96 119.74 119.11 1gfl s LYS 162 Ca -0.04 -0.75 0.01 0.00 0.02 0.00 0.00 55.97 55.21 1gfl s LYS 162 Cb -0.04 -2.37 0.02 0.00 -0.52 0.00 0.00 37.83 34.93 1gfl s LYS 162 CO -0.03 0.60 -0.04 0.08 -0.92 0.00 0.00 175.35 175.05 1gfl s VAL 163 N -0.82 0.49 0.03 3.17 1.01 -0.44 -1.46 120.40 122.39 1gfl s VAL 163 Ca 0.13 -0.11 0.04 0.00 0.00 0.00 0.00 61.98 62.03 1gfl s VAL 163 Cb -0.11 -0.52 -0.02 0.00 0.00 0.00 0.00 36.38 35.74 1gfl s VAL 163 CO 0.03 0.21 -0.11 0.20 0.00 0.00 0.00 175.10 175.43 1gfl s ASN 164 N 0.82 1.26 -0.14 3.32 0.01 -0.71 -1.13 114.94 118.36 1gfl s ASN 164 Ca -0.11 -0.43 -0.33 0.00 -0.71 0.00 0.00 52.86 51.29 1gfl s ASN 164 Cb -0.13 -0.06 0.13 0.00 0.41 0.00 0.00 41.25 41.60 1gfl s ASN 164 CO 0.00 -0.03 1.11 0.72 -1.51 0.00 0.00 177.10 177.39 1gfl s PHE 165 N -0.89 -0.21 -0.13 2.20 -0.71 -1.13 -2.06 117.98 115.06 1gfl s PHE 165 Ca -0.02 0.17 0.01 0.00 -1.04 0.00 0.00 56.93 56.06 1gfl s PHE 165 Cb -0.08 0.51 -0.01 0.00 -1.21 0.00 0.00 43.02 42.24 1gfl s PHE 165 CO 0.01 -0.30 -0.18 0.15 -1.34 0.00 0.00 175.22 173.56 1gfl s LYS 166 N -2.38 3.21 0.01 1.99 1.02 -1.26 -0.79 119.74 121.53 1gfl s LYS 166 Ca 0.07 -0.78 -0.16 0.00 0.02 0.00 0.00 55.97 55.13 1gfl s LYS 166 Cb -0.01 -2.51 -0.06 0.00 -0.52 0.00 0.00 37.83 34.74 1gfl s LYS 166 CO -0.05 0.14 0.44 0.42 -0.92 0.00 0.00 175.35 175.38 1gfl s ILE 167 N 0.48 4.98 -0.31 2.17 -1.09 0.33 -4.92 121.20 122.83 1gfl s ILE 167 Ca -0.12 0.92 -0.04 0.00 -2.23 0.00 0.00 60.65 59.17 1gfl s ILE 167 Cb -0.16 -3.75 0.04 0.00 -1.58 0.00 0.00 42.46 37.00 1gfl s ILE 167 CO 0.05 0.56 0.05 -0.13 -1.23 0.00 0.00 174.94 174.24 1gfl s ARG 168 N -1.01 2.61 -0.21 2.79 0.52 -1.26 -1.31 118.95 121.08 1gfl s ARG 168 Ca 0.25 -1.17 -0.10 0.00 -0.52 0.00 0.00 55.73 54.19 1gfl s ARG 168 Cb -0.17 -3.31 -0.05 0.00 0.52 0.00 0.00 34.95 31.94 1gfl s ARG 168 CO 0.14 -0.61 0.15 -1.01 0.02 0.00 0.00 175.30 173.99 1gfl s HIS 169 N 1.35 3.40 0.10 -0.53 3.76 -0.57 -4.55 115.29 118.24 1gfl s HIS 169 Ca -0.03 0.33 -0.30 0.00 -0.15 0.00 0.00 55.06 54.91 1gfl s HIS 169 Cb -0.19 -2.19 -0.05 0.00 1.11 0.00 0.00 32.58 31.25 1gfl s HIS 169 CO 0.01 0.25 0.97 -0.80 -0.85 0.00 0.00 174.74 174.31 1gfl s ASN 170 N 0.49 7.47 0.16 1.40 0.01 -1.26 -1.08 114.94 122.14 1gfl s ASN 170 Ca 0.08 1.78 -0.03 0.00 -0.71 0.00 0.00 52.86 53.99 1gfl s ASN 170 Cb -0.12 -2.59 -0.05 0.00 0.41 0.00 0.00 41.25 38.91 1gfl s ASN 170 CO -0.01 -0.10 0.37 -0.63 -1.51 0.00 0.00 177.10 175.23 1gfl s ILE 171 N 0.14 5.19 -1.17 0.60 -1.09 -0.14 -1.04 121.20 123.70 1gfl s ILE 171 Ca 0.48 -0.16 0.15 0.00 -2.23 0.00 0.00 60.65 58.89 1gfl s ILE 171 Cb -0.23 -3.67 0.18 0.00 -1.58 0.00 0.00 42.46 37.15 1gfl s ILE 171 CO 0.30 -0.05 1.45 -1.84 -1.23 0.00 0.00 174.94 173.57 1gfl n GLU 172 N -0.23 0.08 -0.05 2.79 0.28 0.17 -0.81 120.64 122.87 1gfl n GLU 172 Ca -0.03 0.21 0.12 0.00 -0.16 0.00 0.00 57.16 57.29 1gfl n GLU 172 Cb 0.53 -1.50 0.21 0.00 1.43 0.00 0.00 31.44 32.11 1gfl n GLU 172 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1gfl n ASP 173 N -1.42 2.79 0.00 -1.84 5.75 -1.26 -4.94 116.55 115.63 1gfl n ASP 173 Ca 0.05 -1.90 0.00 0.00 -0.01 0.00 0.00 54.79 52.93 1gfl n ASP 173 Cb 0.15 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 1gfl n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1gfl n GLY 174 N 1.35 1.17 3.82 6.12 0.00 0.01 -5.08 105.19 112.58 1gfl n GLY 174 Ca 0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 1gfl n GLY 174 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gfl n SER 175 N 0.00 0.40 -4.12 1.61 3.41 -1.25 -4.85 113.62 108.82 1gfl n SER 175 Ca 0.00 -1.63 -0.26 0.00 -0.26 0.00 0.00 58.87 56.71 1gfl n SER 175 Cb 0.00 -0.92 -0.16 0.00 -0.26 0.00 0.00 64.21 62.87 1gfl n SER 175 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1gfl s VAL 176 N -3.68 1.44 -0.32 -3.33 1.01 -1.26 -0.97 120.40 113.29 1gfl s VAL 176 Ca 0.72 -0.70 -0.16 0.00 0.00 0.00 0.00 61.98 61.84 1gfl s VAL 176 Cb -0.02 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 1gfl s VAL 176 CO 0.50 0.42 0.40 -1.58 0.00 0.00 0.00 175.10 174.84 1gfl s GLN 177 N 0.19 3.70 0.21 2.72 2.00 -0.24 -4.93 119.66 123.32 1gfl s GLN 177 Ca -0.07 -0.23 -0.28 0.00 -2.00 0.00 0.00 55.36 52.78 1gfl s GLN 177 Cb -0.13 -3.76 -0.09 0.00 0.80 0.00 0.00 33.01 29.83 1gfl s GLN 177 CO 0.03 -0.49 0.87 -0.51 -0.50 0.00 0.00 175.29 174.69 1gfl s LEU 178 N 2.12 4.61 -0.28 3.68 1.02 -1.26 -1.51 118.68 127.05 1gfl s LEU 178 Ca 0.14 1.81 -0.00 0.00 0.02 0.00 0.00 54.13 56.10 1gfl s LEU 178 Cb -0.16 -3.50 0.09 0.00 0.02 0.00 0.00 46.19 42.63 1gfl s LEU 178 CO 0.12 0.17 0.06 0.00 0.02 0.00 0.00 176.35 176.71 1gfl s ALA 179 N -1.20 1.66 -0.24 4.21 0.00 -0.43 -1.52 121.76 124.24 1gfl s ALA 179 Ca 0.39 -1.54 -0.26 0.00 0.00 0.00 0.00 51.96 50.56 1gfl s ALA 179 Cb -0.24 -1.55 0.00 0.00 0.00 0.00 0.00 23.12 21.33 1gfl s ALA 179 CO 0.29 -1.50 0.90 0.34 0.00 0.00 0.00 175.76 175.79 1gfl s ASP 180 N 1.55 6.92 -0.17 0.00 -1.08 -0.38 -0.51 116.67 122.99 1gfl s ASP 180 Ca 0.05 1.14 -0.04 0.00 -0.52 0.00 0.00 52.55 53.19 1gfl s ASP 180 Cb -0.18 -2.47 -0.02 0.00 -1.46 0.00 0.00 42.92 38.79 1gfl s ASP 180 CO -0.17 -0.58 -0.03 -1.00 0.52 0.00 0.00 175.17 173.91 1gfl s HIS 181 N 2.98 3.02 -0.10 -5.34 3.76 0.03 -0.43 115.29 119.20 1gfl s HIS 181 Ca 0.38 -0.40 0.04 0.00 -0.15 0.00 0.00 55.06 54.93 1gfl s HIS 181 Cb -0.15 -2.00 0.00 0.00 1.11 0.00 0.00 32.58 31.54 1gfl s HIS 181 CO 0.07 -0.14 -0.23 0.71 -0.85 0.00 0.00 174.74 174.30 1gfl s TYR 182 N 0.63 2.53 0.03 1.40 1.51 -0.49 -2.83 117.35 120.13 1gfl s TYR 182 Ca -0.02 -1.07 0.01 0.00 -1.01 0.00 0.00 57.07 54.98 1gfl s TYR 182 Cb -0.14 -1.70 -0.02 0.00 -0.11 0.00 0.00 41.96 39.99 1gfl s TYR 182 CO 0.02 -0.44 -0.05 -1.14 -1.11 0.00 0.00 175.55 172.84 1gfl s GLN 183 N 0.42 0.43 -0.09 -0.62 0.74 -0.28 -1.89 119.66 118.37 1gfl s GLN 183 Ca -0.17 -0.75 -0.05 0.00 0.05 0.00 0.00 55.36 54.44 1gfl s GLN 183 Cb -0.18 -0.02 0.04 0.00 1.10 0.00 0.00 33.01 33.96 1gfl s GLN 183 CO 0.07 -0.02 0.22 -1.14 -0.55 0.00 0.00 175.29 173.87 1gfl s GLN 184 N -1.85 0.20 -0.05 1.67 0.74 -0.25 -1.33 119.66 118.79 1gfl s GLN 184 Ca -0.11 0.45 0.03 0.00 0.05 0.00 0.00 55.36 55.78 1gfl s GLN 184 Cb -0.08 -0.08 0.01 0.00 1.10 0.00 0.00 33.01 33.97 1gfl s GLN 184 CO -0.02 -0.13 -0.12 -0.80 -0.55 0.00 0.00 175.29 173.67 1gfl s ASN 185 N 0.98 1.68 -0.00 6.67 0.01 -0.83 -0.96 114.94 122.49 1gfl s ASN 185 Ca -0.07 -0.28 0.01 0.00 -0.71 0.00 0.00 52.86 51.81 1gfl s ASN 185 Cb -0.09 -0.68 0.00 0.00 0.41 0.00 0.00 41.25 40.89 1gfl s ASN 185 CO -0.06 0.05 -0.02 0.42 -1.51 0.00 0.00 177.10 175.98 1gfl s THR 186 N 0.51 0.13 0.49 1.60 -4.23 -0.69 -2.01 115.64 111.44 1gfl s THR 186 Ca -0.11 -0.06 -0.22 0.00 -1.18 0.00 0.00 61.69 60.12 1gfl s THR 186 Cb -0.14 -0.13 -0.07 0.00 1.34 0.00 0.00 72.50 73.51 1gfl s THR 186 CO 0.03 0.04 1.17 -2.16 -0.54 0.00 0.00 174.62 173.16 1gfl s PRO 187 N 0.02 3.62 0.10 3.99 0.04 -1.26 -0.72 135.00 140.78 1gfl s PRO 187 Ca 0.00 1.76 0.06 0.00 0.04 0.00 0.00 61.00 62.86 1gfl s PRO 187 Cb -0.01 -2.30 -0.22 0.00 0.04 0.00 0.00 34.50 32.01 1gfl s PRO 187 CO -0.00 -0.67 1.19 0.82 0.04 0.00 0.00 177.00 178.39 1gfl h ILE 188 N 1.67 1.60 -3.76 0.56 2.04 -1.27 -3.44 117.51 114.91 1gfl h ILE 188 Ca -0.50 -3.30 -0.24 0.00 1.00 0.00 0.00 64.86 61.82 1gfl h ILE 188 Cb 1.25 2.82 0.07 0.00 -0.74 0.00 0.00 36.82 40.22 1gfl h ILE 188 CO 0.59 0.92 0.14 0.61 0.00 0.00 0.00 178.15 180.41 1gfl n GLY 189 N 1.40 -0.30 0.10 5.37 0.00 -1.26 -5.01 105.19 105.49 1gfl n GLY 189 Ca -0.03 -1.85 -0.11 0.00 0.00 0.00 0.00 46.02 44.03 1gfl n GLY 189 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gfl n ASP 190 N -3.20 0.49 -4.57 1.61 9.92 -1.26 -5.00 116.55 114.55 1gfl n ASP 190 Ca 0.09 0.09 -0.28 0.00 -0.53 0.00 0.00 54.79 54.16 1gfl n ASP 190 Cb 0.32 0.53 0.21 0.00 -0.64 0.00 0.00 41.12 41.55 1gfl n ASP 190 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1gfl s GLY 191 N -5.51 1.55 0.51 0.44 0.00 -1.26 -4.99 107.32 98.05 1gfl s GLY 191 Ca -0.12 -0.32 -0.21 0.00 0.00 0.00 0.00 44.72 44.07 1gfl s GLY 191 CO 0.80 0.36 1.18 2.56 0.00 0.00 0.00 173.10 178.01 1gfl s PRO 192 N -4.77 3.47 0.26 2.90 0.04 -1.26 -5.05 135.00 130.60 1gfl s PRO 192 Ca 0.67 1.79 0.11 0.00 0.04 0.00 0.00 61.00 63.61 1gfl s PRO 192 Cb -0.21 -2.22 -0.05 0.00 0.04 0.00 0.00 34.50 32.06 1gfl s PRO 192 CO 0.61 -0.79 -0.18 0.14 0.04 0.00 0.00 177.00 176.81 1gfl s VAL 193 N -1.58 2.29 -0.33 -0.36 -7.23 -1.26 -4.84 120.40 107.09 1gfl s VAL 193 Ca 0.69 -2.35 -0.25 0.00 -1.81 0.00 0.00 61.98 58.25 1gfl s VAL 193 Cb -0.29 -2.25 0.01 0.00 0.56 0.00 0.00 36.38 34.40 1gfl s VAL 193 CO 0.34 -0.44 0.88 -0.76 -0.31 0.00 0.00 175.10 174.81 1gfl s LEU 194 N -3.47 4.04 -0.27 1.32 1.43 -1.26 -5.04 118.68 115.43 1gfl s LEU 194 Ca 0.28 0.71 -0.13 0.00 -1.03 0.00 0.00 54.13 53.96 1gfl s LEU 194 Cb -0.04 -3.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.93 1gfl s LEU 194 CO 0.13 -0.73 0.29 -0.76 0.23 0.00 0.00 176.35 175.51 1gfl s LEU 195 N 3.22 4.03 0.49 1.79 1.43 -1.26 -3.81 118.68 124.57 1gfl s LEU 195 Ca 0.36 0.16 -0.09 0.00 -1.03 0.00 0.00 54.13 53.53 1gfl s LEU 195 Cb -0.13 -2.29 -0.05 0.00 0.03 0.00 0.00 46.19 43.75 1gfl s LEU 195 CO 0.15 -0.12 0.84 -2.16 0.23 0.00 0.00 176.35 175.29 1gfl s PRO 196 N 1.89 3.66 0.67 1.29 0.04 -1.26 -4.95 135.00 136.34 1gfl s PRO 196 Ca 0.11 0.45 -0.14 0.00 0.04 0.00 0.00 61.00 61.47 1gfl s PRO 196 Cb -0.16 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1gfl s PRO 196 CO 0.10 -0.22 1.09 -0.51 0.04 0.00 0.00 177.00 177.50 1gfl s ASP 197 N -3.73 5.17 0.21 6.66 1.01 -1.26 -3.59 116.67 121.14 1gfl s ASP 197 Ca 0.51 1.88 -0.32 0.00 0.71 0.00 0.00 52.55 55.32 1gfl s ASP 197 Cb -0.10 -2.53 -0.14 0.00 1.01 0.00 0.00 42.92 41.15 1gfl s ASP 197 CO 0.41 -1.59 1.45 0.59 0.21 0.00 0.00 175.17 176.24 1gfl n ASN 198 N -2.64 2.78 -1.09 0.27 3.02 -1.26 -4.84 115.26 111.50 1gfl n ASN 198 Ca 0.09 1.12 -0.00 0.00 -0.03 0.00 0.00 54.58 55.76 1gfl n ASN 198 Cb 0.53 -1.41 0.00 0.00 -0.61 0.00 0.00 39.78 38.28 1gfl n ASN 198 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gfl n HIS 199 N 2.37 -1.01 -3.82 3.10 1.44 -1.06 -4.66 115.22 111.58 1gfl n HIS 199 Ca 0.14 -0.09 -0.10 0.00 -2.01 0.00 0.00 57.72 55.66 1gfl n HIS 199 Cb 0.30 0.04 -0.05 0.00 0.12 0.00 0.00 29.99 30.40 1gfl n HIS 199 CO 0.00 0.00 0.00 1.52 -2.81 0.00 0.00 176.34 175.05 1gfl s TYR 200 N -8.32 0.08 -0.20 -1.40 -0.85 -0.42 -1.79 117.35 104.45 1gfl s TYR 200 Ca 0.01 -0.44 -0.03 0.00 -0.52 0.00 0.00 57.07 56.09 1gfl s TYR 200 Cb -0.00 0.18 -0.01 0.00 0.38 0.00 0.00 41.96 42.51 1gfl s TYR 200 CO 0.01 -0.79 -0.08 -0.51 -1.52 0.00 0.00 175.55 172.66 1gfl s LEU 201 N -2.90 2.78 -0.32 -3.49 1.43 0.26 -0.76 118.68 115.68 1gfl s LEU 201 Ca 0.11 -0.41 -0.28 0.00 -1.03 0.00 0.00 54.13 52.53 1gfl s LEU 201 Cb 0.01 -1.69 0.01 0.00 0.03 0.00 0.00 46.19 44.56 1gfl s LEU 201 CO -0.03 0.02 1.01 -0.55 0.23 0.00 0.00 176.35 177.02 1gfl s SER 202 N 1.25 6.87 -0.07 2.29 0.15 0.84 -0.96 113.70 124.06 1gfl s SER 202 Ca 0.03 0.95 0.05 0.00 0.70 0.00 0.00 55.95 57.68 1gfl s SER 202 Cb -0.14 -2.51 -0.01 0.00 -1.71 0.00 0.00 66.02 61.65 1gfl s SER 202 CO -0.03 -0.82 -0.24 -0.89 1.20 0.00 0.00 173.24 172.46 1gfl s THR 203 N 3.48 1.99 -0.00 6.45 2.01 0.12 -1.89 115.64 127.81 1gfl s THR 203 Ca 0.42 -1.02 0.05 0.00 0.31 0.00 0.00 61.69 61.45 1gfl s THR 203 Cb -0.13 -1.69 -0.01 0.00 0.01 0.00 0.00 72.50 70.68 1gfl s THR 203 CO 0.15 0.55 -0.16 -1.10 -0.69 0.00 0.00 174.62 173.37 1gfl s GLN 204 N -0.03 1.28 0.02 4.92 -0.21 -0.44 -1.54 119.66 123.67 1gfl s GLN 204 Ca -0.07 -0.61 0.02 0.00 0.02 0.00 0.00 55.36 54.71 1gfl s GLN 204 Cb -0.15 -1.25 -0.02 0.00 1.00 0.00 0.00 33.01 32.60 1gfl s GLN 204 CO 0.05 0.34 -0.06 -1.12 -2.12 0.00 0.00 175.29 172.38 1gfl s SER 205 N -0.48 0.62 -0.04 5.90 0.01 -1.26 -0.71 113.70 117.74 1gfl s SER 205 Ca 0.06 -0.38 0.01 0.00 1.31 0.00 0.00 55.95 56.95 1gfl s SER 205 Cb -0.06 0.02 0.02 0.00 0.21 0.00 0.00 66.02 66.20 1gfl s SER 205 CO -0.00 -0.13 -0.05 0.00 0.41 0.00 0.00 173.24 173.46 1gfl s ALA 206 N -0.96 0.66 -0.12 1.44 0.00 -0.10 -4.47 121.76 118.20 1gfl s ALA 206 Ca -0.07 -0.09 -0.03 0.00 0.00 0.00 0.00 51.96 51.77 1gfl s ALA 206 Cb -0.07 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 1gfl s ALA 206 CO -0.00 0.02 -0.00 -0.51 0.00 0.00 0.00 175.76 175.27 1gfl s LEU 207 N 0.73 3.52 0.32 0.00 1.43 -1.26 -1.66 118.68 121.76 1gfl s LEU 207 Ca -0.10 0.06 0.04 0.00 -1.03 0.00 0.00 54.13 53.10 1gfl s LEU 207 Cb -0.13 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 1gfl s LEU 207 CO 0.00 0.29 0.31 -0.94 0.23 0.00 0.00 176.35 176.25 1gfl s SER 208 N -0.34 1.35 -0.05 2.29 1.04 -0.20 -4.88 113.70 112.90 1gfl s SER 208 Ca 0.07 -1.66 0.06 0.00 0.48 0.00 0.00 55.95 54.90 1gfl s SER 208 Cb -0.12 0.57 -0.01 0.00 0.10 0.00 0.00 66.02 66.55 1gfl s SER 208 CO 0.02 -1.10 -0.24 -0.54 0.98 0.00 0.00 173.24 172.37 1gfl s LYS 209 N -3.42 2.47 -0.29 4.02 -0.14 -1.26 -1.48 119.74 119.65 1gfl s LYS 209 Ca 0.38 -0.88 -0.29 0.00 -1.36 0.00 0.00 55.97 53.82 1gfl s LYS 209 Cb 0.02 -2.18 0.00 0.00 -1.68 0.00 0.00 37.83 34.00 1gfl s LYS 209 CO 0.24 0.45 1.24 0.34 -0.76 0.00 0.00 175.35 176.86 1gfl s ASP 210 N -0.31 6.77 0.00 2.83 -1.08 -1.26 -4.94 116.67 118.67 1gfl s ASP 210 Ca 0.01 1.24 0.30 0.00 -0.52 0.00 0.00 52.55 53.58 1gfl s ASP 210 Cb -0.13 -2.54 1.72 0.00 -1.46 0.00 0.00 42.92 40.51 1gfl s ASP 210 CO 0.02 -0.99 2.09 -0.81 0.52 0.00 0.00 175.17 176.00 1gfl n PRO 211 N 7.12 0.83 0.00 4.34 -0.04 -1.26 -2.07 135.00 143.91 1gfl n PRO 211 Ca 0.14 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.74 1gfl n PRO 211 Cb 0.46 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.88 1gfl n PRO 211 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1gfl n ASN 212 N -1.06 0.79 -4.55 3.54 5.03 -1.26 -4.94 115.26 112.82 1gfl n ASN 212 Ca 0.21 -0.72 -0.37 0.00 0.87 0.00 0.00 54.58 54.57 1gfl n ASN 212 Cb 0.13 0.06 -0.11 0.00 -1.02 0.00 0.00 39.78 38.83 1gfl n ASN 212 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1gfl s GLU 213 N -2.53 3.85 0.20 3.52 2.56 -0.88 -4.96 118.70 120.46 1gfl s GLU 213 Ca 0.25 -0.38 0.22 0.00 0.00 0.00 0.00 54.97 55.06 1gfl s GLU 213 Cb 0.19 -3.43 -0.00 0.00 2.00 0.00 0.00 34.13 32.89 1gfl s GLU 213 CO 0.51 -0.07 1.04 1.63 -0.56 0.00 0.00 175.26 177.81 1gfl n LYS 214 N 4.64 0.61 -1.75 4.30 5.02 -1.26 -4.88 118.16 124.82 1gfl n LYS 214 Ca -0.15 0.12 -0.32 0.00 -2.02 0.00 0.00 58.31 55.94 1gfl n LYS 214 Cb 0.52 -1.83 0.04 0.00 -0.02 0.00 0.00 35.03 33.74 1gfl n LYS 214 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1gfl s ARG 215 N -3.36 2.91 0.03 1.97 3.00 -1.26 -4.98 118.95 117.26 1gfl s ARG 215 Ca -0.01 1.24 -0.30 0.00 0.00 0.00 0.00 55.73 56.66 1gfl s ARG 215 Cb 0.10 -1.98 -0.06 0.00 0.00 0.00 0.00 34.95 33.01 1gfl s ARG 215 CO 0.79 -1.14 1.46 0.34 0.00 0.00 0.00 175.30 176.75 1gfl s ASP 216 N -2.94 6.79 0.22 0.23 2.15 -1.26 -4.95 116.67 116.91 1gfl s ASP 216 Ca 0.64 2.23 -0.18 0.00 0.43 0.00 0.00 52.55 55.66 1gfl s ASP 216 Cb -0.18 -2.56 0.03 0.00 -0.30 0.00 0.00 42.92 39.91 1gfl s ASP 216 CO 0.44 -0.75 0.57 -1.38 -0.17 0.00 0.00 175.17 173.87 1gfl s HIS 217 N 2.32 -0.11 -0.03 -5.34 -3.43 -1.26 -1.94 115.29 105.51 1gfl s HIS 217 Ca 0.66 -0.26 0.00 0.00 -0.80 0.00 0.00 55.06 54.67 1gfl s HIS 217 Cb -0.34 0.45 0.03 0.00 -1.43 0.00 0.00 32.58 31.29 1gfl s HIS 217 CO 0.28 -1.00 0.01 1.41 -2.00 0.00 0.00 174.74 173.45 1gfl s MET 218 N -3.89 0.19 -0.22 -0.38 1.75 -0.66 -4.93 119.30 111.15 1gfl s MET 218 Ca 0.11 0.11 -0.09 0.00 -1.25 0.00 0.00 55.69 54.56 1gfl s MET 218 Cb -0.02 -0.40 -0.05 0.00 2.84 0.00 0.00 34.83 37.21 1gfl s MET 218 CO 0.00 -0.14 0.12 0.08 -0.65 0.00 0.00 175.02 174.44 1gfl s VAL 219 N 1.00 5.18 -0.13 10.11 1.01 -0.55 -0.58 120.40 136.44 1gfl s VAL 219 Ca -0.09 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.02 1gfl s VAL 219 Cb -0.13 -3.38 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1gfl s VAL 219 CO -0.02 0.40 -0.21 -0.22 0.00 0.00 0.00 175.10 175.05 1gfl s LEU 220 N 0.74 2.18 -0.06 3.92 2.96 0.13 -1.04 118.68 127.51 1gfl s LEU 220 Ca 0.07 -0.57 0.04 0.00 -0.22 0.00 0.00 54.13 53.45 1gfl s LEU 220 Cb -0.13 -1.46 -0.02 0.00 0.50 0.00 0.00 46.19 45.08 1gfl s LEU 220 CO 0.02 0.10 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.21 1gfl s LEU 221 N 0.71 2.55 -0.11 -0.68 2.01 -0.66 -1.34 118.68 121.16 1gfl s LEU 221 Ca -0.09 -0.29 -0.10 0.00 0.01 0.00 0.00 54.13 53.65 1gfl s LEU 221 Cb -0.16 -1.51 0.03 0.00 0.01 0.00 0.00 46.19 44.56 1gfl s LEU 221 CO 0.01 0.30 0.30 -0.70 1.01 0.00 0.00 176.35 177.27 1gfl s GLU 222 N -0.48 0.36 -0.09 1.70 2.12 -0.74 -0.93 118.70 120.63 1gfl s GLU 222 Ca 0.06 0.40 0.03 0.00 0.36 0.00 0.00 54.97 55.82 1gfl s GLU 222 Cb -0.12 0.17 0.01 0.00 0.26 0.00 0.00 34.13 34.45 1gfl s GLU 222 CO 0.01 -0.05 -0.18 -0.06 -0.54 0.00 0.00 175.26 174.44 1gfl s PHE 223 N 0.11 2.11 -0.04 5.30 0.08 0.11 -1.55 117.98 124.10 1gfl s PHE 223 Ca -0.00 -0.89 0.01 0.00 0.12 0.00 0.00 56.93 56.16 1gfl s PHE 223 Cb -0.02 -1.46 0.02 0.00 -0.57 0.00 0.00 43.02 40.99 1gfl s PHE 223 CO 0.01 -0.40 -0.02 0.08 -0.10 0.00 0.00 175.22 174.78 1gfl s VAL 224 N 0.62 0.37 -0.02 -0.44 1.01 0.90 -1.33 120.40 121.50 1gfl s VAL 224 Ca -0.14 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.82 1gfl s VAL 224 Cb -0.16 -0.43 0.02 0.00 0.00 0.00 0.00 36.38 35.81 1gfl s VAL 224 CO 0.04 0.19 0.00 -0.89 0.00 0.00 0.00 175.10 174.44 1gfl s THR 225 N 0.96 0.09 0.40 3.92 2.01 -0.79 -1.45 115.64 120.78 1gfl s THR 225 Ca -0.11 0.07 -0.22 0.00 0.31 0.00 0.00 61.69 61.74 1gfl s THR 225 Cb -0.14 -0.16 -0.11 0.00 0.01 0.00 0.00 72.50 72.11 1gfl s THR 225 CO -0.01 0.09 0.95 0.00 -0.69 0.00 0.00 174.62 174.96 1gfl s ALA 226 N 0.66 3.08 0.31 7.40 0.00 -0.11 -0.12 121.76 132.98 1gfl s ALA 226 Ca -0.06 0.43 -0.15 0.00 0.00 0.00 0.00 51.96 52.18 1gfl s ALA 226 Cb -0.09 -3.16 0.02 0.00 0.00 0.00 0.00 23.12 19.89 1gfl s ALA 226 CO -0.02 0.14 0.65 0.00 0.00 0.00 0.00 175.76 176.53 1gfl s ALA 227 N -2.03 -0.61 0.00 0.00 0.00 0.06 -4.57 121.76 114.60 1gfl s ALA 227 Ca 0.59 -0.72 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1gfl s ALA 227 Cb -0.12 0.89 0.00 0.00 0.00 0.00 0.00 23.12 23.90 1gfl s ALA 227 CO 0.16 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.38 1gfl n GLY 228 N -0.47 0.62 3.34 0.00 0.00 -1.26 -1.30 105.19 106.11 1gfl n GLY 228 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 1gfl n GLY 228 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gfl s ILE 229 N -2.00 2.45 -1.53 -0.61 1.01 -1.26 -4.82 121.20 114.44 1gfl s ILE 229 Ca 0.00 -0.93 0.12 0.00 0.00 0.00 0.00 60.65 59.84 1gfl s ILE 229 Cb 0.00 -1.93 0.10 0.00 0.01 0.00 0.00 42.46 40.64 1gfl s ILE 229 CO 0.00 0.57 0.89 0.35 0.00 0.00 0.00 174.94 176.75