#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f6m n THR 2 N 0.00 3.55 -2.58 2.61 5.66 -1.26 -5.03 114.28 117.23 1f6m n THR 2 Ca 0.00 -5.41 -0.43 0.00 -3.05 0.00 0.00 64.05 55.17 1f6m n THR 2 Cb 0.00 -2.20 -0.02 0.00 -1.55 0.00 0.00 70.33 66.55 1f6m n THR 2 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1f6m s THR 3 N -2.16 4.54 -0.28 1.09 2.01 -1.26 -4.78 115.64 114.80 1f6m s THR 3 Ca 0.33 1.85 -0.29 0.00 0.31 0.00 0.00 61.69 63.88 1f6m s THR 3 Cb 0.03 -4.19 0.01 0.00 0.01 0.00 0.00 72.50 68.36 1f6m s THR 3 CO -0.02 -0.11 1.13 -0.75 -0.69 0.00 0.00 174.62 174.18 1f6m s LYS 4 N 2.89 4.11 0.10 4.92 2.20 -0.92 -4.91 119.74 128.13 1f6m s LYS 4 Ca 0.49 1.24 0.04 0.00 -0.36 0.00 0.00 55.97 57.38 1f6m s LYS 4 Cb -0.19 -3.74 -0.04 0.00 -1.51 0.00 0.00 37.83 32.35 1f6m s LYS 4 CO 0.13 -0.85 0.08 -1.58 -0.36 0.00 0.00 175.35 172.77 1f6m s HIS 5 N 3.66 3.15 -0.07 4.03 5.65 -1.26 -2.17 115.29 128.28 1f6m s HIS 5 Ca 0.48 0.04 -0.30 0.00 0.25 0.00 0.00 55.06 55.52 1f6m s HIS 5 Cb -0.15 -1.58 0.07 0.00 -1.18 0.00 0.00 32.58 29.74 1f6m s HIS 5 CO 0.14 0.52 0.69 0.45 -0.65 0.00 0.00 174.74 175.89 1f6m s SER 6 N -2.57 -0.66 0.13 9.88 0.15 -1.00 -4.99 113.70 114.64 1f6m s SER 6 Ca 0.29 0.78 -0.22 0.00 0.70 0.00 0.00 55.95 57.50 1f6m s SER 6 Cb -0.12 0.61 -0.03 0.00 -1.71 0.00 0.00 66.02 64.78 1f6m s SER 6 CO 0.22 -0.58 1.67 0.11 1.20 0.00 0.00 173.24 175.87 1f6m h LYS 7 N 3.16 -0.17 -5.97 5.44 1.57 -1.86 -2.91 116.57 115.84 1f6m h LYS 7 Ca -0.27 0.01 -0.54 0.00 -1.87 0.00 0.00 60.65 57.98 1f6m h LYS 7 Cb 1.14 0.04 -0.24 0.00 0.08 0.00 0.00 32.23 33.25 1f6m h LYS 7 CO 0.36 -0.12 -0.82 -1.17 -0.57 0.00 0.00 179.45 177.13 1f6m s LEU 8 N -10.40 2.23 -0.03 2.94 2.96 -1.26 -1.11 118.68 114.01 1f6m s LEU 8 Ca -0.14 -0.59 0.01 0.00 -0.22 0.00 0.00 54.13 53.19 1f6m s LEU 8 Cb 0.10 -0.86 0.01 0.00 0.50 0.00 0.00 46.19 45.95 1f6m s LEU 8 CO 0.67 0.09 -0.03 -0.22 -1.32 0.00 0.00 176.35 175.54 1f6m s LEU 9 N -1.51 1.51 -0.09 -0.68 2.96 -0.86 -2.88 118.68 117.13 1f6m s LEU 9 Ca 0.06 -0.09 0.01 0.00 -0.22 0.00 0.00 54.13 53.89 1f6m s LEU 9 Cb -0.09 -0.32 -0.02 0.00 0.50 0.00 0.00 46.19 46.26 1f6m s LEU 9 CO 0.03 -0.03 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.29 1f6m s ILE 10 N 0.59 3.29 -0.32 6.68 1.01 0.90 -1.51 121.20 131.84 1f6m s ILE 10 Ca -0.07 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 59.89 1f6m s ILE 10 Cb -0.10 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 40.04 1f6m s ILE 10 CO -0.00 0.56 0.13 -0.76 0.00 0.00 0.00 174.94 174.86 1f6m s LEU 11 N -0.28 4.19 0.00 2.97 1.02 0.13 -1.69 118.68 125.02 1f6m s LEU 11 Ca 0.03 -0.82 0.00 0.00 0.02 0.00 0.00 54.13 53.36 1f6m s LEU 11 Cb -0.13 -1.94 0.00 0.00 0.02 0.00 0.00 46.19 44.15 1f6m s LEU 11 CO 0.03 -0.26 0.00 0.61 0.02 0.00 0.00 176.35 176.75 1f6m n GLY 12 N 4.91 3.74 2.19 -3.19 0.00 -0.22 0.16 105.19 112.78 1f6m n GLY 12 Ca -0.13 -1.47 -0.25 0.00 0.00 0.00 0.00 46.02 44.17 1f6m n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1f6m n SER 13 N 0.00 4.94 -3.39 1.61 3.41 -1.03 -4.47 113.62 114.69 1f6m n SER 13 Ca 0.00 -3.74 -0.12 0.00 -0.26 0.00 0.00 58.87 54.75 1f6m n SER 13 Cb 0.00 -0.40 0.01 0.00 -0.26 0.00 0.00 64.21 63.56 1f6m n SER 13 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f6m n GLY 14 N -0.63 2.66 0.36 5.00 0.00 -1.26 -0.82 105.19 110.50 1f6m n GLY 14 Ca 0.43 -2.22 0.05 0.00 0.00 0.00 0.00 46.02 44.27 1f6m n GLY 14 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1f6m h PRO 15 N 0.00 1.04 0.24 1.61 0.13 -1.92 -1.01 132.00 132.09 1f6m h PRO 15 Ca -0.16 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 64.90 1f6m h PRO 15 Cb 0.61 -0.24 0.00 0.00 0.13 0.00 0.00 31.00 31.51 1f6m h PRO 15 CO 0.25 0.69 -0.12 0.00 -0.23 0.00 0.00 178.00 178.59 1f6m h ALA 16 N 1.49 -0.33 -0.26 -0.56 0.00 -1.88 -2.51 119.26 115.21 1f6m h ALA 16 Ca 0.46 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1f6m h ALA 16 Cb 0.32 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1f6m h ALA 16 CO -0.22 -0.65 0.08 0.78 0.00 0.00 0.00 179.25 179.24 1f6m h GLY 17 N -0.40 0.44 1.47 0.00 0.00 -1.70 -2.01 103.07 100.87 1f6m h GLY 17 Ca -0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1f6m h GLY 17 CO 0.05 0.25 0.27 -0.97 0.00 0.00 0.00 176.54 176.15 1f6m h TYR 18 N 0.25 0.68 -0.25 5.60 0.05 -1.24 0.59 116.97 122.64 1f6m h TYR 18 Ca 0.08 -0.01 -0.08 0.00 0.05 0.00 0.00 58.73 58.78 1f6m h TYR 18 Cb 0.25 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.77 1f6m h TYR 18 CO 0.01 0.48 -0.15 1.15 -1.05 0.00 0.00 178.16 178.60 1f6m h THR 19 N 0.70 1.30 -0.74 -2.88 2.02 -1.26 -0.83 112.91 111.23 1f6m h THR 19 Ca 0.18 -1.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.10 1f6m h THR 19 Cb 0.03 1.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.97 1f6m h THR 19 CO -0.03 0.39 0.42 0.00 0.37 0.00 0.00 175.52 176.67 1f6m h ALA 20 N 0.72 1.35 0.42 6.16 0.00 -0.75 -1.20 119.26 125.97 1f6m h ALA 20 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1f6m h ALA 20 Cb 0.67 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1f6m h ALA 20 CO 0.04 0.54 -0.42 0.00 0.00 0.00 0.00 179.25 179.42 1f6m h ALA 21 N 1.44 -0.92 -0.68 0.00 0.00 0.73 -0.50 119.26 119.33 1f6m h ALA 21 Ca 0.26 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1f6m h ALA 21 Cb -0.00 0.60 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1f6m h ALA 21 CO -0.05 -1.05 0.25 -0.24 0.00 0.00 0.00 179.25 178.16 1f6m h VAL 22 N -0.86 1.25 -0.63 0.00 3.04 -0.79 0.22 116.25 118.49 1f6m h VAL 22 Ca -0.04 -0.79 -0.09 0.00 -1.01 0.00 0.00 66.70 64.77 1f6m h VAL 22 Cb 0.76 0.49 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 1f6m h VAL 22 CO -0.06 0.31 0.03 1.88 -1.01 0.00 0.00 177.57 178.73 1f6m h TYR 23 N 0.97 1.18 -0.20 3.17 -1.99 -1.18 -1.99 116.97 116.93 1f6m h TYR 23 Ca 0.22 -0.19 -0.14 0.00 2.00 0.00 0.00 58.73 60.62 1f6m h TYR 23 Cb 0.24 -0.31 -0.01 0.00 2.00 0.00 0.00 36.73 38.64 1f6m h TYR 23 CO 0.02 1.02 -0.48 0.00 -0.00 0.00 0.00 178.16 178.72 1f6m h ALA 24 N 1.01 0.79 -0.01 3.88 0.00 -0.86 -2.75 119.26 121.32 1f6m h ALA 24 Ca 0.18 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 1f6m h ALA 24 Cb 0.53 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1f6m h ALA 24 CO 0.03 0.67 -0.23 0.00 0.00 0.00 0.00 179.25 179.71 1f6m h ALA 25 N 1.06 1.60 0.00 0.00 0.00 -0.25 -2.07 119.26 119.60 1f6m h ALA 25 Ca 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1f6m h ALA 25 Cb 0.99 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1f6m h ALA 25 CO 0.09 0.30 -0.10 0.00 0.00 0.00 0.00 179.25 179.54 1f6m h ARG 26 N 0.02 0.00 -0.08 0.00 3.08 -1.11 -2.54 114.38 113.74 1f6m h ARG 26 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1f6m h ARG 26 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1f6m h ARG 26 CO 0.03 0.07 0.00 0.00 -1.07 0.00 0.00 179.97 179.00 1f6m n ALA 27 N -2.12 2.54 -3.64 0.04 0.00 -0.80 -4.89 120.51 111.63 1f6m n ALA 27 Ca 0.04 -0.23 -0.27 0.00 0.00 0.00 0.00 53.44 52.98 1f6m n ALA 27 Cb 0.56 -1.13 0.04 0.00 0.00 0.00 0.00 19.45 18.92 1f6m n ALA 27 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1f6m n ASN 28 N -0.31 -4.48 -0.86 0.00 5.03 -0.96 -4.90 115.26 108.78 1f6m n ASN 28 Ca 0.10 -0.94 0.09 0.00 0.87 0.00 0.00 54.58 54.70 1f6m n ASN 28 Cb 0.13 -3.74 0.15 0.00 -1.02 0.00 0.00 39.78 35.30 1f6m n ASN 28 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1f6m n LEU 29 N -4.07 2.93 -4.01 3.41 4.77 -1.05 -4.99 117.00 113.99 1f6m n LEU 29 Ca -0.14 -1.41 -0.37 0.00 -0.03 0.00 0.00 56.01 54.06 1f6m n LEU 29 Cb 0.62 -0.16 -0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1f6m n LEU 29 CO 0.67 0.62 -0.21 1.67 -1.33 0.00 0.00 177.39 178.81 1f6m n GLN 30 N 1.08 -1.07 -1.72 3.23 -0.06 -1.26 -4.27 117.38 113.31 1f6m n GLN 30 Ca 0.14 0.22 -0.40 0.00 -2.00 0.00 0.00 57.00 54.96 1f6m n GLN 30 Cb 0.49 -3.40 0.03 0.00 -4.06 0.00 0.00 30.24 23.30 1f6m n GLN 30 CO 0.00 0.00 0.00 -0.35 -0.20 0.00 0.00 177.06 176.51 1f6m n PRO 31 N -4.67 1.87 -4.52 3.69 -0.04 -1.26 -4.76 135.00 125.30 1f6m n PRO 31 Ca -0.18 0.67 -0.33 0.00 -0.04 0.00 0.00 63.50 63.63 1f6m n PRO 31 Cb 0.61 -2.49 -0.16 0.00 -0.04 0.00 0.00 33.50 31.42 1f6m n PRO 31 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1f6m s VAL 32 N -1.25 2.43 -0.07 0.52 1.01 -1.14 -1.41 120.40 120.49 1f6m s VAL 32 Ca 0.65 -0.85 0.04 0.00 0.00 0.00 0.00 61.98 61.83 1f6m s VAL 32 Cb -0.46 -2.01 -0.00 0.00 0.00 0.00 0.00 36.38 33.91 1f6m s VAL 32 CO 0.54 0.53 -0.21 -0.22 0.00 0.00 0.00 175.10 175.74 1f6m s LEU 33 N 0.87 1.98 -0.24 3.92 0.20 0.83 -0.07 118.68 126.18 1f6m s LEU 33 Ca -0.05 -0.46 -0.08 0.00 0.69 0.00 0.00 54.13 54.23 1f6m s LEU 33 Cb -0.15 -1.22 -0.03 0.00 -0.43 0.00 0.00 46.19 44.36 1f6m s LEU 33 CO -0.02 0.17 0.08 -0.63 -0.29 0.00 0.00 176.35 175.66 1f6m s ILE 34 N 0.16 4.52 0.03 6.68 1.01 -0.68 0.11 121.20 133.03 1f6m s ILE 34 Ca -0.10 -0.11 -0.26 0.00 0.00 0.00 0.00 60.65 60.18 1f6m s ILE 34 Cb -0.15 -3.10 -0.17 0.00 0.01 0.00 0.00 42.46 39.05 1f6m s ILE 34 CO 0.05 0.36 1.37 0.71 0.00 0.00 0.00 174.94 177.42 1f6m h THR 35 N 5.37 0.71 0.00 2.92 1.35 -1.38 -0.58 112.91 121.30 1f6m h THR 35 Ca -0.37 -0.45 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 1f6m h THR 35 Cb 1.18 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 1f6m h THR 35 CO 0.60 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 176.57 1f6m n GLY 36 N -0.58 0.58 0.21 5.82 0.00 0.90 -2.48 105.19 109.65 1f6m n GLY 36 Ca -0.10 -2.12 -0.11 0.00 0.00 0.00 0.00 46.02 43.69 1f6m n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f6m h MET 37 N 0.00 0.61 -3.35 1.61 -0.00 -1.98 -3.32 114.93 108.51 1f6m h MET 37 Ca 0.00 -0.42 -0.77 0.00 -0.00 0.00 0.00 59.70 58.52 1f6m h MET 37 Cb 0.00 0.06 -0.18 0.00 -0.00 0.00 0.00 31.60 31.48 1f6m h MET 37 CO 0.00 1.03 1.82 -1.91 -0.00 0.00 0.00 176.91 177.85 1f6m n GLU 38 N -3.94 3.83 -1.73 -0.10 2.13 -1.26 -4.99 120.64 114.58 1f6m n GLU 38 Ca -0.04 -3.71 -0.42 0.00 0.66 0.00 0.00 57.16 53.64 1f6m n GLU 38 Cb 0.64 -2.84 -0.03 0.00 0.27 0.00 0.00 31.44 29.49 1f6m n GLU 38 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 1f6m s LYS 39 N -0.29 3.96 0.00 5.31 2.20 -1.25 -1.12 119.74 128.55 1f6m s LYS 39 Ca 0.38 2.41 0.00 0.00 -0.36 0.00 0.00 55.97 58.40 1f6m s LYS 39 Cb 0.09 -4.17 0.00 0.00 -1.51 0.00 0.00 37.83 32.24 1f6m s LYS 39 CO 0.02 -1.15 0.00 0.41 -0.36 0.00 0.00 175.35 174.27 1f6m n GLY 40 N 4.70 2.72 4.76 5.54 0.00 0.00 -4.94 105.19 117.97 1f6m n GLY 40 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1f6m n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f6m n GLY 41 N -0.92 -2.09 0.36 -0.02 0.00 -0.28 -4.30 105.19 97.94 1f6m n GLY 41 Ca 0.00 -1.59 0.03 0.00 0.00 0.00 0.00 46.02 44.47 1f6m n GLY 41 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1f6m h GLN 42 N 0.00 1.02 -1.00 1.61 4.20 -1.91 -2.08 115.11 116.95 1f6m h GLN 42 Ca 0.00 -0.06 0.29 0.00 0.06 0.00 0.00 58.65 58.94 1f6m h GLN 42 Cb 0.00 -0.23 -0.04 0.00 0.30 0.00 0.00 27.48 27.51 1f6m h GLN 42 CO 0.00 0.67 0.72 -0.07 -0.67 0.00 0.00 178.83 179.48 1f6m h LEU 43 N 1.05 0.01 -0.32 1.46 4.07 -1.94 0.46 115.31 120.11 1f6m h LEU 43 Ca 0.38 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.34 1f6m h LEU 43 Cb 0.16 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.90 1f6m h LEU 43 CO -0.14 0.00 0.00 0.35 -1.08 0.00 0.00 178.44 177.57 1f6m n THR 44 N -4.24 1.05 -0.42 0.22 -2.24 -0.78 -1.99 114.28 105.87 1f6m n THR 44 Ca 0.21 0.30 0.11 0.00 -2.27 0.00 0.00 64.05 62.39 1f6m n THR 44 Cb 1.06 -1.15 0.34 0.00 -2.10 0.00 0.00 70.33 68.48 1f6m n THR 44 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1f6m n THR 45 N -1.79 1.32 -4.70 4.28 -2.24 0.16 -4.70 114.28 106.62 1f6m n THR 45 Ca 0.02 -1.05 -0.31 0.00 -2.27 0.00 0.00 64.05 60.44 1f6m n THR 45 Cb 0.16 0.33 -0.08 0.00 -2.10 0.00 0.00 70.33 68.64 1f6m n THR 45 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1f6m s THR 46 N -1.37 1.12 0.00 4.28 -1.32 -0.84 -4.56 115.64 112.95 1f6m s THR 46 Ca 0.50 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.98 1f6m s THR 46 Cb 0.28 -2.27 0.00 0.00 -1.51 0.00 0.00 72.50 69.00 1f6m s THR 46 CO 0.29 0.00 0.00 0.35 -2.21 0.00 0.00 174.62 173.05 1f6m n THR 47 N -1.16 0.00 -1.72 5.08 -2.24 -1.26 -4.33 114.28 108.65 1f6m n THR 47 Ca -0.15 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 1f6m n THR 47 Cb 0.67 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.89 1f6m n THR 47 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1f6m n GLU 48 N 0.00 2.28 -3.94 -0.78 4.71 -1.26 -0.74 120.64 120.91 1f6m n GLU 48 Ca 0.00 0.80 -0.30 0.00 -0.01 0.00 0.00 57.16 57.65 1f6m n GLU 48 Cb 0.00 -2.42 -0.16 0.00 -1.01 0.00 0.00 31.44 27.85 1f6m n GLU 48 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1f6m s VAL 49 N -1.06 1.53 -2.65 2.62 1.01 0.88 -4.74 120.40 118.00 1f6m s VAL 49 Ca 0.55 -1.21 0.24 0.00 0.00 0.00 0.00 61.98 61.56 1f6m s VAL 49 Cb -0.55 -1.79 0.36 0.00 0.00 0.00 0.00 36.38 34.40 1f6m s VAL 49 CO 0.62 -0.09 1.41 -0.62 0.00 0.00 0.00 175.10 176.43 1f6m n GLU 50 N 4.67 2.23 -0.55 2.72 1.02 -1.26 -4.47 120.64 125.00 1f6m n GLU 50 Ca -0.12 -1.82 0.05 0.00 -0.02 0.00 0.00 57.16 55.25 1f6m n GLU 50 Cb 0.44 -1.47 0.08 0.00 -0.02 0.00 0.00 31.44 30.47 1f6m n GLU 50 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1f6m n ASN 51 N 1.11 1.20 -4.52 1.62 6.94 -1.26 -4.94 115.26 115.42 1f6m n ASN 51 Ca 0.17 -2.66 -0.42 0.00 -0.02 0.00 0.00 54.58 51.65 1f6m n ASN 51 Cb 0.53 -0.34 -0.04 0.00 -2.36 0.00 0.00 39.78 37.57 1f6m n ASN 51 CO 0.00 0.00 0.00 0.86 -1.03 0.00 0.00 177.26 177.09 1f6m s TRP 52 N -1.45 2.64 -0.08 -2.53 -0.11 -1.26 -4.89 118.94 111.27 1f6m s TRP 52 Ca 0.22 -0.09 -0.39 0.00 1.22 0.00 0.00 56.10 57.06 1f6m s TRP 52 Cb 0.22 -4.29 -0.17 0.00 -1.50 0.00 0.00 33.47 27.72 1f6m s TRP 52 CO -0.03 -1.59 1.42 -0.35 -4.62 0.00 0.00 176.95 171.78 1f6m n PRO 53 N 8.01 0.85 -0.24 5.86 -0.04 -1.26 -1.91 135.00 146.25 1f6m n PRO 53 Ca 0.02 0.31 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 1f6m n PRO 53 Cb 0.47 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 32.01 1f6m n PRO 53 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1f6m n GLY 54 N 2.91 0.81 2.31 0.55 0.00 -1.26 -4.98 105.19 105.53 1f6m n GLY 54 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 1f6m n GLY 54 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f6m n ASP 55 N 0.00 1.53 -0.11 1.61 8.00 -0.80 -4.98 116.55 121.80 1f6m n ASP 55 Ca 0.00 -3.02 0.26 0.00 0.71 0.00 0.00 54.79 52.74 1f6m n ASP 55 Cb 0.00 -0.64 0.72 0.00 -0.02 0.00 0.00 41.12 41.18 1f6m n ASP 55 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1f6m h PRO 56 N 3.75 0.00 -3.66 -0.24 0.13 -1.93 -3.43 132.00 126.62 1f6m h PRO 56 Ca 0.11 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.13 1f6m h PRO 56 Cb 0.81 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 31.77 1f6m h PRO 56 CO 0.59 0.00 -0.43 -0.80 -0.23 0.00 0.00 178.00 177.13 1f6m s ASN 57 N -5.75 0.09 -0.62 1.44 0.01 -1.26 -4.94 114.94 103.91 1f6m s ASN 57 Ca -0.05 -0.45 0.00 0.00 -0.71 0.00 0.00 52.86 51.65 1f6m s ASN 57 Cb 0.20 0.27 0.00 0.00 0.41 0.00 0.00 41.25 42.14 1f6m s ASN 57 CO 0.74 -0.56 0.00 0.47 -1.51 0.00 0.00 177.10 176.24 1f6m n ASP 58 N 0.63 -3.23 -4.78 -1.22 8.00 -1.26 -4.96 116.55 109.73 1f6m n ASP 58 Ca -0.18 0.14 -0.37 0.00 0.71 0.00 0.00 54.79 55.09 1f6m n ASP 58 Cb 0.59 -2.56 -0.06 0.00 -0.02 0.00 0.00 41.12 39.07 1f6m n ASP 58 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1f6m s LEU 59 N -1.75 4.32 0.06 0.64 2.96 -1.26 -4.96 118.68 118.69 1f6m s LEU 59 Ca 0.00 1.86 0.05 0.00 -0.22 0.00 0.00 54.13 55.82 1f6m s LEU 59 Cb 0.00 -4.04 -0.03 0.00 0.50 0.00 0.00 46.19 42.62 1f6m s LEU 59 CO 0.00 -0.11 -0.13 0.42 -1.32 0.00 0.00 176.35 175.21 1f6m s THR 60 N -1.63 1.01 0.16 3.68 -4.23 -1.26 -0.08 115.64 113.30 1f6m s THR 60 Ca 0.51 -1.25 -0.24 0.00 -1.18 0.00 0.00 61.69 59.53 1f6m s THR 60 Cb -0.19 -0.99 0.04 0.00 1.34 0.00 0.00 72.50 72.71 1f6m s THR 60 CO 0.24 -0.24 1.59 1.23 -0.54 0.00 0.00 174.62 176.90 1f6m h GLY 61 N 4.36 -0.37 -0.26 3.99 0.00 -1.10 0.03 103.07 109.73 1f6m h GLY 61 Ca -0.40 0.48 0.12 0.00 0.00 0.00 0.00 47.33 47.53 1f6m h GLY 61 CO 0.40 -0.20 -0.17 -2.55 0.00 0.00 0.00 176.54 174.03 1f6m h PRO 62 N -0.27 -0.01 -0.01 4.80 0.11 -1.77 0.10 132.00 134.95 1f6m h PRO 62 Ca 0.17 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.28 1f6m h PRO 62 Cb 0.56 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 1f6m h PRO 62 CO -0.58 -0.01 0.00 1.25 -0.21 0.00 0.00 178.00 178.46 1f6m h LEU 63 N -0.01 0.01 -0.63 2.35 6.46 -1.59 0.20 115.31 122.10 1f6m h LEU 63 Ca 0.30 -0.06 0.04 0.00 -0.12 0.00 0.00 57.88 58.04 1f6m h LEU 63 Cb 0.46 -0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.35 1f6m h LEU 63 CO -0.65 0.06 0.37 0.25 -0.62 0.00 0.00 178.44 177.86 1f6m h LEU 64 N -0.05 0.57 -0.68 2.25 6.46 -0.22 -1.69 115.31 121.94 1f6m h LEU 64 Ca 0.00 0.02 -0.14 0.00 -0.12 0.00 0.00 57.88 57.64 1f6m h LEU 64 Cb 0.06 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 39.87 1f6m h LEU 64 CO -0.00 0.38 -0.64 0.24 -0.62 0.00 0.00 178.44 177.80 1f6m h MET 65 N 0.70 0.07 -0.01 1.25 2.86 -0.73 -1.70 114.93 117.38 1f6m h MET 65 Ca 0.27 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.76 1f6m h MET 65 Cb 0.10 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1f6m h MET 65 CO -0.14 0.69 -0.46 0.93 1.06 0.00 0.00 176.91 178.99 1f6m h GLU 66 N 0.05 0.02 -0.29 1.72 4.39 -0.17 -1.56 114.58 118.73 1f6m h GLU 66 Ca -0.01 -0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.53 1f6m h GLU 66 Cb 1.15 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.79 1f6m h GLU 66 CO 0.09 0.48 -0.42 -0.09 -1.16 0.00 0.00 179.01 177.90 1f6m h ARG 67 N 0.02 0.72 -0.04 2.33 9.65 -1.04 -2.07 114.38 123.94 1f6m h ARG 67 Ca -0.00 -0.39 -0.15 0.00 -1.10 0.00 0.00 59.98 58.33 1f6m h ARG 67 Cb 0.82 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.40 1f6m h ARG 67 CO 0.06 1.01 -0.67 0.52 2.80 0.00 0.00 179.97 183.69 1f6m h MET 68 N 0.59 0.20 0.11 0.20 2.86 -0.95 -0.82 114.93 117.12 1f6m h MET 68 Ca 0.04 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1f6m h MET 68 Cb 0.97 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.66 1f6m h MET 68 CO 0.09 0.79 -0.05 1.25 1.06 0.00 0.00 176.91 180.04 1f6m h HIS 69 N 0.14 -0.14 -0.67 -0.22 -0.00 -1.15 -0.37 115.15 112.73 1f6m h HIS 69 Ca -0.01 -0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.43 1f6m h HIS 69 Cb 1.19 0.05 -0.06 0.00 -0.00 0.00 0.00 27.41 28.59 1f6m h HIS 69 CO 0.02 0.05 0.34 1.49 -0.00 0.00 0.00 177.93 179.84 1f6m h GLU 70 N -0.31 0.59 0.15 5.26 4.81 -1.25 -1.36 114.58 122.47 1f6m h GLU 70 Ca -0.02 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1f6m h GLU 70 Cb 0.26 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.50 1f6m h GLU 70 CO 0.03 0.39 -0.09 1.25 -0.73 0.00 0.00 179.01 179.86 1f6m h HIS 71 N 0.61 -0.22 -0.25 0.92 2.76 -0.88 0.53 115.15 118.62 1f6m h HIS 71 Ca 0.32 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.46 1f6m h HIS 71 Cb 0.29 0.08 -0.01 0.00 1.55 0.00 0.00 27.41 29.31 1f6m h HIS 71 CO -0.10 -0.14 0.03 0.00 -1.30 0.00 0.00 177.93 176.42 1f6m h ALA 72 N 0.62 1.58 0.00 5.26 0.00 -0.61 -2.27 119.26 123.83 1f6m h ALA 72 Ca -0.02 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 1f6m h ALA 72 Cb 0.18 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1f6m h ALA 72 CO 0.02 0.31 -0.93 1.79 0.00 0.00 0.00 179.25 180.44 1f6m h THR 73 N 0.36 1.55 -0.86 0.00 1.35 -1.04 -2.81 112.91 111.45 1f6m h THR 73 Ca 0.09 -3.20 0.10 0.00 -0.55 0.00 0.00 66.41 62.85 1f6m h THR 73 Cb 0.20 2.76 -0.06 0.00 -1.73 0.00 0.00 68.15 69.32 1f6m h THR 73 CO 0.00 0.88 0.56 0.50 -0.25 0.00 0.00 175.52 177.21 1f6m h LYS 74 N 0.00 0.80 -1.07 4.72 3.64 -0.28 -0.00 116.57 124.38 1f6m h LYS 74 Ca -0.02 -0.05 -0.51 0.00 -1.27 0.00 0.00 60.65 58.80 1f6m h LYS 74 Cb 1.71 -0.18 -0.26 0.00 -0.41 0.00 0.00 32.23 33.09 1f6m h LYS 74 CO 0.12 0.53 0.66 1.19 -2.27 0.00 0.00 179.45 179.67 1f6m n PHE 75 N -4.52 2.71 -3.59 1.91 3.72 -1.20 -4.92 117.46 111.57 1f6m n PHE 75 Ca 0.15 -2.18 -0.23 0.00 -0.05 0.00 0.00 57.45 55.14 1f6m n PHE 75 Cb 0.32 -1.07 0.02 0.00 -0.94 0.00 0.00 39.48 37.80 1f6m n PHE 75 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1f6m n GLU 76 N -0.76 -1.28 -3.73 -1.08 1.02 -0.01 -4.80 120.64 110.00 1f6m n GLU 76 Ca 0.53 0.76 -0.36 0.00 -0.02 0.00 0.00 57.16 58.07 1f6m n GLU 76 Cb 1.10 -3.86 -0.07 0.00 -0.02 0.00 0.00 31.44 28.59 1f6m n GLU 76 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1f6m s THR 77 N -3.22 5.39 -0.70 2.62 2.01 -1.06 -4.67 115.64 116.01 1f6m s THR 77 Ca 0.23 0.32 -0.25 0.00 0.31 0.00 0.00 61.69 62.31 1f6m s THR 77 Cb -0.09 -3.49 0.05 0.00 0.01 0.00 0.00 72.50 68.98 1f6m s THR 77 CO 0.85 0.51 1.11 -0.70 -0.69 0.00 0.00 174.62 175.71 1f6m s GLU 78 N -0.30 3.15 -0.24 4.92 2.12 -0.50 -4.71 118.70 123.13 1f6m s GLU 78 Ca 0.14 -0.56 -0.18 0.00 0.36 0.00 0.00 54.97 54.73 1f6m s GLU 78 Cb -0.12 -4.21 -0.03 0.00 0.26 0.00 0.00 34.13 30.03 1f6m s GLU 78 CO 0.03 -1.97 0.50 0.42 -0.54 0.00 0.00 175.26 173.70 1f6m s ILE 79 N 4.85 5.09 -0.16 -3.70 1.01 -1.26 -0.12 121.20 126.91 1f6m s ILE 79 Ca 0.28 0.88 0.01 0.00 0.00 0.00 0.00 60.65 61.81 1f6m s ILE 79 Cb -0.13 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.53 1f6m s ILE 79 CO 0.12 0.12 -0.17 -0.63 0.00 0.00 0.00 174.94 174.39 1f6m s ILE 80 N 2.06 2.49 -0.63 2.92 1.01 0.30 -4.96 121.20 124.38 1f6m s ILE 80 Ca 0.22 -0.82 -0.27 0.00 0.00 0.00 0.00 60.65 59.77 1f6m s ILE 80 Cb -0.16 -2.05 0.01 0.00 0.01 0.00 0.00 42.46 40.28 1f6m s ILE 80 CO 0.09 0.52 1.47 0.12 0.00 0.00 0.00 174.94 177.14 1f6m s PHE 81 N 0.95 2.14 0.34 3.97 5.36 -1.26 -1.35 117.98 128.13 1f6m s PHE 81 Ca -0.03 0.36 -0.18 0.00 -0.96 0.00 0.00 56.93 56.12 1f6m s PHE 81 Cb -0.15 -4.41 0.04 0.00 -0.34 0.00 0.00 43.02 38.17 1f6m s PHE 81 CO -0.03 -2.09 0.77 0.34 -1.46 0.00 0.00 175.22 172.75 1f6m s ASP 82 N 5.03 -0.10 -0.03 6.13 2.15 -1.26 -4.92 116.67 123.66 1f6m s ASP 82 Ca 0.50 -0.92 -0.01 0.00 0.43 0.00 0.00 52.55 52.55 1f6m s ASP 82 Cb -0.10 0.79 0.03 0.00 -0.30 0.00 0.00 42.92 43.34 1f6m s ASP 82 CO 0.21 -1.53 0.03 -2.28 -0.17 0.00 0.00 175.17 171.43 1f6m s HIS 83 N -2.93 0.11 -0.09 -5.34 5.65 -1.26 -0.07 115.29 111.35 1f6m s HIS 83 Ca 0.14 0.14 -0.28 0.00 0.25 0.00 0.00 55.06 55.31 1f6m s HIS 83 Cb -0.05 -0.37 -0.02 0.00 -1.18 0.00 0.00 32.58 30.96 1f6m s HIS 83 CO 0.09 -0.14 0.92 0.42 -0.65 0.00 0.00 174.74 175.38 1f6m s ILE 84 N 1.46 4.86 -0.11 0.89 -1.09 -1.26 -2.97 121.20 122.98 1f6m s ILE 84 Ca -0.04 1.87 0.18 0.00 -2.23 0.00 0.00 60.65 60.42 1f6m s ILE 84 Cb -0.13 -4.23 -0.26 0.00 -1.58 0.00 0.00 42.46 36.26 1f6m s ILE 84 CO -0.03 0.08 0.23 0.59 -1.23 0.00 0.00 174.94 174.58 1f6m n ASN 85 N 4.63 0.52 -3.79 3.58 3.02 0.29 -4.96 115.26 118.54 1f6m n ASN 85 Ca 0.06 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.48 1f6m n ASN 85 Cb 0.50 1.37 -0.09 0.00 -0.61 0.00 0.00 39.78 40.94 1f6m n ASN 85 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1f6m s LYS 86 N -2.85 0.60 -0.03 3.52 2.20 -1.08 -4.86 119.74 117.23 1f6m s LYS 86 Ca -0.08 -0.21 -0.03 0.00 -0.36 0.00 0.00 55.97 55.29 1f6m s LYS 86 Cb 0.09 0.26 0.01 0.00 -1.51 0.00 0.00 37.83 36.68 1f6m s LYS 86 CO 0.78 -0.16 0.09 0.14 -0.36 0.00 0.00 175.35 175.84 1f6m s VAL 87 N -1.25 -0.00 -0.28 4.02 -7.23 -1.26 -0.03 120.40 114.37 1f6m s VAL 87 Ca -0.13 0.00 0.02 0.00 -1.81 0.00 0.00 61.98 60.07 1f6m s VAL 87 Cb -0.06 -0.13 0.07 0.00 0.56 0.00 0.00 36.38 36.82 1f6m s VAL 87 CO 0.03 0.00 -0.06 -0.62 -0.31 0.00 0.00 175.10 174.15 1f6m s ASP 88 N 0.07 4.60 -0.24 4.85 2.15 0.14 -4.97 116.67 123.26 1f6m s ASP 88 Ca -0.00 -1.51 0.13 0.00 0.43 0.00 0.00 52.55 51.60 1f6m s ASP 88 Cb -0.01 -1.60 0.62 0.00 -0.30 0.00 0.00 42.92 41.63 1f6m s ASP 88 CO 0.00 -0.24 1.57 0.18 -0.17 0.00 0.00 175.17 176.51 1f6m n LEU 89 N 4.44 4.74 -0.01 -1.34 4.32 -1.26 -1.83 117.00 126.06 1f6m n LEU 89 Ca -0.11 -3.19 0.08 0.00 -0.02 0.00 0.00 56.01 52.78 1f6m n LEU 89 Cb 0.42 -0.63 -0.12 0.00 -1.62 0.00 0.00 43.42 41.47 1f6m n LEU 89 CO 0.22 0.80 -0.57 0.00 -1.22 0.00 0.00 177.39 176.63 1f6m n GLN 90 N -0.39 0.73 -4.82 3.23 1.13 -1.26 -4.92 117.38 111.07 1f6m n GLN 90 Ca 0.29 -0.12 -0.33 0.00 -1.94 0.00 0.00 57.00 54.90 1f6m n GLN 90 Cb 1.09 -1.38 -0.16 0.00 0.11 0.00 0.00 30.24 29.90 1f6m n GLN 90 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 1f6m s ASN 91 N -3.67 3.49 -0.19 1.08 0.02 -1.26 -5.11 114.94 109.30 1f6m s ASN 91 Ca -0.04 -0.48 -0.10 0.00 -1.02 0.00 0.00 52.86 51.22 1f6m s ASN 91 Cb 0.11 -1.51 -0.05 0.00 0.02 0.00 0.00 41.25 39.82 1f6m s ASN 91 CO 0.70 0.13 0.13 -0.13 0.02 0.00 0.00 177.10 177.95 1f6m s ARG 92 N 0.56 4.08 0.57 -0.60 3.00 -1.26 -2.49 118.95 122.81 1f6m s ARG 92 Ca -0.11 -0.20 -0.20 0.00 0.00 0.00 0.00 55.73 55.22 1f6m s ARG 92 Cb -0.16 -3.39 -0.04 0.00 0.00 0.00 0.00 34.95 31.36 1f6m s ARG 92 CO 0.04 0.37 1.22 -1.25 0.00 0.00 0.00 175.30 175.68 1f6m s PRO 93 N 0.16 3.09 0.38 3.54 0.04 -1.26 -5.11 135.00 135.84 1f6m s PRO 93 Ca 0.09 1.88 -0.27 0.00 0.04 0.00 0.00 61.00 62.74 1f6m s PRO 93 Cb -0.11 -2.03 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 1f6m s PRO 93 CO -0.01 -1.13 1.40 -0.06 0.04 0.00 0.00 177.00 177.24 1f6m s PHE 94 N -1.54 2.73 -0.22 0.56 0.08 -0.73 -4.74 117.98 114.11 1f6m s PHE 94 Ca 0.75 1.29 -0.06 0.00 0.12 0.00 0.00 56.93 59.03 1f6m s PHE 94 Cb -0.32 -3.86 -0.03 0.00 -0.57 0.00 0.00 43.02 38.25 1f6m s PHE 94 CO 0.35 -2.53 0.04 1.03 -0.10 0.00 0.00 175.22 174.01 1f6m s ARG 95 N -2.10 3.69 -0.07 0.44 1.81 -0.76 -2.22 118.95 119.73 1f6m s ARG 95 Ca 0.54 -0.47 0.03 0.00 -1.72 0.00 0.00 55.73 54.10 1f6m s ARG 95 Cb -0.43 -3.19 0.01 0.00 -0.45 0.00 0.00 34.95 30.89 1f6m s ARG 95 CO 0.57 -0.02 -0.16 -0.51 -0.68 0.00 0.00 175.30 174.50 1f6m s LEU 96 N 1.13 1.79 -0.22 2.53 1.02 0.12 0.27 118.68 125.32 1f6m s LEU 96 Ca 0.03 -0.37 -0.05 0.00 0.02 0.00 0.00 54.13 53.76 1f6m s LEU 96 Cb -0.14 -1.00 -0.02 0.00 0.02 0.00 0.00 46.19 45.05 1f6m s LEU 96 CO 0.02 0.08 -0.00 0.20 0.02 0.00 0.00 176.35 176.67 1f6m s ASN 97 N 0.51 4.69 0.20 2.29 0.01 0.96 -0.59 114.94 123.02 1f6m s ASN 97 Ca -0.15 -0.27 0.07 0.00 -0.71 0.00 0.00 52.86 51.80 1f6m s ASN 97 Cb -0.16 -1.81 -0.05 0.00 0.41 0.00 0.00 41.25 39.64 1f6m s ASN 97 CO 0.05 0.01 -0.14 -0.83 -1.51 0.00 0.00 177.10 174.68 1f6m s GLY 98 N 1.31 1.37 0.58 0.66 0.00 -0.69 0.10 107.32 110.66 1f6m s GLY 98 Ca 0.04 -1.63 0.29 0.00 0.00 0.00 0.00 44.72 43.42 1f6m s GLY 98 CO 0.00 -1.73 1.91 -0.55 0.00 0.00 0.00 173.10 172.73 1f6m h ASP 99 N 2.60 0.00 -0.12 1.64 3.32 -1.94 -1.46 116.42 120.45 1f6m h ASP 99 Ca -0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.67 1f6m h ASP 99 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 1f6m h ASP 99 CO 0.62 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.73 1f6m n ASN 100 N -3.77 2.73 0.00 6.45 3.02 -1.26 -5.07 115.26 117.37 1f6m n ASN 100 Ca 0.09 -1.82 0.00 0.00 -0.03 0.00 0.00 54.58 52.82 1f6m n ASN 100 Cb 0.66 -0.07 0.00 0.00 -0.61 0.00 0.00 39.78 39.76 1f6m n ASN 100 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1f6m n GLY 101 N 1.07 -2.54 3.61 7.41 0.00 -0.55 -5.14 105.19 109.06 1f6m n GLY 101 Ca 0.12 -1.37 -0.34 0.00 0.00 0.00 0.00 46.02 44.43 1f6m n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1f6m s GLU 102 N -1.92 2.76 0.08 1.61 2.12 -1.26 -1.70 118.70 120.39 1f6m s GLU 102 Ca 0.00 -0.55 0.07 0.00 0.36 0.00 0.00 54.97 54.85 1f6m s GLU 102 Cb 0.00 -2.62 -0.03 0.00 0.26 0.00 0.00 34.13 31.74 1f6m s GLU 102 CO 0.00 0.66 -0.19 0.71 -0.54 0.00 0.00 175.26 175.91 1f6m s TYR 103 N -0.87 1.60 0.04 5.30 2.02 0.25 -2.16 117.35 123.53 1f6m s TYR 103 Ca 0.14 -0.41 0.03 0.00 -0.37 0.00 0.00 57.07 56.45 1f6m s TYR 103 Cb -0.11 -0.90 -0.02 0.00 -0.40 0.00 0.00 41.96 40.52 1f6m s TYR 103 CO 0.03 0.13 -0.08 0.95 -1.57 0.00 0.00 175.55 175.00 1f6m s THR 104 N -1.08 0.60 -0.05 -0.71 -4.23 -0.92 0.14 115.64 109.39 1f6m s THR 104 Ca 0.04 -1.05 -0.24 0.00 -1.18 0.00 0.00 61.69 59.25 1f6m s THR 104 Cb -0.09 -0.65 0.05 0.00 1.34 0.00 0.00 72.50 73.15 1f6m s THR 104 CO 0.03 -0.33 0.54 0.00 -0.54 0.00 0.00 174.62 174.32 1f6m h ASP 106 N 3.53 0.00 -4.26 0.00 3.32 -0.91 -1.95 116.42 116.14 1f6m h ASP 106 Ca -0.28 -0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.64 1f6m h ASP 106 Cb 1.16 0.00 -0.23 0.00 0.22 0.00 0.00 39.33 40.48 1f6m h ASP 106 CO 0.37 0.00 -0.28 0.00 -1.72 0.00 0.00 179.24 177.61 1f6m s ALA 107 N -3.14 -0.88 -0.04 3.45 0.00 -0.27 -4.89 121.76 115.99 1f6m s ALA 107 Ca 0.09 0.80 0.03 0.00 0.00 0.00 0.00 51.96 52.89 1f6m s ALA 107 Cb 0.10 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.86 1f6m s ALA 107 CO 0.62 -0.21 -0.14 -1.17 0.00 0.00 0.00 175.76 174.87 1f6m s LEU 108 N -0.34 1.84 -0.27 0.00 2.96 0.66 -2.03 118.68 121.49 1f6m s LEU 108 Ca -0.05 -0.29 -0.00 0.00 -0.22 0.00 0.00 54.13 53.57 1f6m s LEU 108 Cb -0.03 -0.82 0.05 0.00 0.50 0.00 0.00 46.19 45.89 1f6m s LEU 108 CO 0.02 0.11 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.47 1f6m s ILE 109 N 0.17 2.64 -0.49 6.68 1.01 -0.57 0.15 121.20 130.80 1f6m s ILE 109 Ca -0.05 -1.36 -0.20 0.00 0.00 0.00 0.00 60.65 59.03 1f6m s ILE 109 Cb -0.11 -2.47 0.04 0.00 0.01 0.00 0.00 42.46 39.93 1f6m s ILE 109 CO 0.02 0.03 0.68 -0.63 0.00 0.00 0.00 174.94 175.03 1f6m s ILE 110 N 1.22 4.78 -0.42 2.92 1.01 0.42 -0.69 121.20 130.44 1f6m s ILE 110 Ca -0.05 -0.14 0.08 0.00 0.00 0.00 0.00 60.65 60.54 1f6m s ILE 110 Cb -0.19 -4.30 0.42 0.00 0.01 0.00 0.00 42.46 38.40 1f6m s ILE 110 CO -0.04 -0.77 1.05 0.00 0.00 0.00 0.00 174.94 175.18 1f6m n ALA 111 N 6.40 4.58 1.07 9.38 0.00 0.12 -2.06 120.51 140.00 1f6m n ALA 111 Ca -0.03 -4.07 0.12 0.00 0.00 0.00 0.00 53.44 49.46 1f6m n ALA 111 Cb 0.47 -0.66 0.59 0.00 0.00 0.00 0.00 19.45 19.85 1f6m n ALA 111 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1f6m n THR 112 N -0.34 0.26 -3.46 0.00 -2.24 -1.16 -4.11 114.28 103.22 1f6m n THR 112 Ca 0.31 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 62.16 1f6m n THR 112 Cb 0.67 -0.66 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 1f6m n THR 112 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f6m n GLY 113 N 0.82 2.99 3.32 3.38 0.00 -1.26 -4.49 105.19 109.95 1f6m n GLY 113 Ca 0.10 -0.29 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 1f6m n GLY 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f6m s ALA 114 N -1.90 -0.62 0.16 4.61 0.00 -1.26 -1.11 121.76 121.64 1f6m s ALA 114 Ca 0.00 -0.34 0.07 0.00 0.00 0.00 0.00 51.96 51.69 1f6m s ALA 114 Cb 0.00 0.68 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 1f6m s ALA 114 CO 0.00 -0.63 0.01 -1.12 0.00 0.00 0.00 175.76 174.03 1f6m s SER 115 N -2.85 4.88 0.30 0.00 0.01 -0.82 -4.86 113.70 110.37 1f6m s SER 115 Ca 0.06 -0.34 -0.29 0.00 1.31 0.00 0.00 55.95 56.69 1f6m s SER 115 Cb 0.02 -1.08 -0.13 0.00 0.21 0.00 0.00 66.02 65.04 1f6m s SER 115 CO -0.09 0.10 1.37 0.00 0.41 0.00 0.00 173.24 175.03 1f6m n ALA 116 N -0.06 1.36 -2.61 1.44 0.00 -1.26 -2.16 120.51 117.22 1f6m n ALA 116 Ca -0.10 0.38 -0.33 0.00 0.00 0.00 0.00 53.44 53.39 1f6m n ALA 116 Cb 0.55 -2.28 -0.05 0.00 0.00 0.00 0.00 19.45 17.66 1f6m n ALA 116 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1f6m s ARG 117 N -1.16 3.70 0.25 0.00 3.52 -0.60 -4.81 118.95 119.85 1f6m s ARG 117 Ca 0.61 0.08 0.10 0.00 -0.13 0.00 0.00 55.73 56.39 1f6m s ARG 117 Cb -0.59 -2.93 -0.05 0.00 -1.56 0.00 0.00 34.95 29.81 1f6m s ARG 117 CO 0.56 0.52 -0.16 0.71 -0.81 0.00 0.00 175.30 176.12 1f6m s TYR 118 N -1.50 2.01 0.06 5.12 1.51 -1.26 -4.48 117.35 118.82 1f6m s TYR 118 Ca 0.36 -0.46 -0.17 0.00 -1.01 0.00 0.00 57.07 55.79 1f6m s TYR 118 Cb -0.13 -0.92 -0.14 0.00 -0.11 0.00 0.00 41.96 40.66 1f6m s TYR 118 CO 0.20 0.53 1.32 -0.07 -1.11 0.00 0.00 175.55 176.42 1f6m h LEU 119 N 2.39 0.64 0.00 -1.29 3.38 -1.99 -3.48 115.31 114.97 1f6m h LEU 119 Ca -0.39 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.02 1f6m h LEU 119 Cb 1.24 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1f6m h LEU 119 CO 0.62 1.08 0.00 0.61 0.09 0.00 0.00 178.44 180.84 1f6m n GLY 120 N 0.44 1.30 3.73 0.83 0.00 -1.26 -5.10 105.19 105.14 1f6m n GLY 120 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1f6m n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f6m s LEU 121 N 0.00 4.49 0.31 0.99 1.02 -1.26 -4.94 118.68 119.29 1f6m s LEU 121 Ca 0.00 1.86 0.04 0.00 0.02 0.00 0.00 54.13 56.05 1f6m s LEU 121 Cb 0.00 -3.59 0.52 0.00 0.02 0.00 0.00 46.19 43.14 1f6m s LEU 121 CO 0.00 -0.12 1.80 1.55 0.02 0.00 0.00 176.35 179.60 1f6m h PRO 122 N 5.57 0.46 0.00 1.29 0.13 -1.98 -1.54 132.00 135.92 1f6m h PRO 122 Ca -0.43 -0.14 -0.02 0.00 -0.87 0.00 0.00 66.00 64.54 1f6m h PRO 122 Cb 1.21 -0.05 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1f6m h PRO 122 CO 0.72 0.61 -0.09 0.66 -0.23 0.00 0.00 178.00 179.66 1f6m h SER 123 N 0.42 0.00 -0.28 1.44 4.64 -1.92 0.79 113.55 118.64 1f6m h SER 123 Ca 0.08 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.33 1f6m h SER 123 Cb 0.52 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.60 1f6m h SER 123 CO 0.03 0.09 -0.09 -0.08 -0.87 0.00 0.00 176.83 175.92 1f6m h GLU 124 N 0.00 0.55 -0.10 4.77 4.81 -1.62 -2.74 114.58 120.25 1f6m h GLU 124 Ca -0.00 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 58.96 1f6m h GLU 124 Cb 0.18 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 1f6m h GLU 124 CO 0.01 0.77 -0.14 1.49 -0.73 0.00 0.00 179.01 180.41 1f6m h GLU 125 N 0.30 0.27 -0.61 1.92 4.22 -0.54 -2.49 114.58 117.65 1f6m h GLU 125 Ca 0.07 -0.16 0.16 0.00 0.08 0.00 0.00 59.36 59.51 1f6m h GLU 125 Cb 0.57 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 1f6m h GLU 125 CO 0.03 0.73 0.43 0.00 -2.18 0.00 0.00 179.01 178.02 1f6m h ALA 126 N 0.54 2.46 -0.07 2.92 0.00 0.51 -2.12 119.26 123.49 1f6m h ALA 126 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1f6m h ALA 126 Cb 0.70 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1f6m h ALA 126 CO 0.03 -0.63 0.00 1.19 0.00 0.00 0.00 179.25 179.85 1f6m n PHE 127 N -4.39 0.07 -1.67 0.00 3.72 -1.04 -4.93 117.46 109.23 1f6m n PHE 127 Ca 0.11 -0.06 -0.46 0.00 -0.05 0.00 0.00 57.45 57.00 1f6m n PHE 127 Cb 0.62 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 39.12 1f6m n PHE 127 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1f6m n LYS 128 N 0.86 2.43 0.00 -1.08 5.02 -0.80 0.27 118.16 124.86 1f6m n LYS 128 Ca 0.10 0.88 0.00 0.00 -2.02 0.00 0.00 58.31 57.27 1f6m n LYS 128 Cb 0.39 -2.80 0.00 0.00 -0.02 0.00 0.00 35.03 32.61 1f6m n LYS 128 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1f6m n GLY 129 N 4.53 2.38 0.33 0.72 0.00 -0.59 -4.88 105.19 107.67 1f6m n GLY 129 Ca 0.22 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.31 1f6m n GLY 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f6m n ARG 130 N -1.46 0.91 0.00 1.61 1.74 0.14 -4.91 116.66 114.69 1f6m n ARG 130 Ca 0.00 -2.22 0.00 0.00 -0.77 0.00 0.00 57.85 54.86 1f6m n ARG 130 Cb 0.00 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 30.27 1f6m n ARG 130 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1f6m n GLY 131 N -0.91 0.94 3.58 -0.13 0.00 -1.09 -1.18 105.19 106.40 1f6m n GLY 131 Ca 0.12 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1f6m n GLY 131 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f6m s VAL 132 N 0.00 5.29 0.10 1.61 1.01 -1.07 0.08 120.40 127.42 1f6m s VAL 132 Ca 0.00 0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.16 1f6m s VAL 132 Cb 0.00 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1f6m s VAL 132 CO 0.00 0.20 -0.07 -0.55 0.00 0.00 0.00 175.10 174.68 1f6m s SER 133 N 1.74 1.21 -0.11 3.32 0.15 -0.74 -1.55 113.70 117.72 1f6m s SER 133 Ca 0.08 -0.94 0.13 0.00 0.70 0.00 0.00 55.95 55.92 1f6m s SER 133 Cb -0.16 0.07 -0.18 0.00 -1.71 0.00 0.00 66.02 64.04 1f6m s SER 133 CO 0.11 -0.40 0.09 0.00 1.20 0.00 0.00 173.24 174.24 1f6m n ALA 134 N 0.17 1.82 -3.99 5.45 0.00 -1.26 -2.45 120.51 120.24 1f6m n ALA 134 Ca -0.13 -0.80 -0.33 0.00 0.00 0.00 0.00 53.44 52.17 1f6m n ALA 134 Cb 0.60 -0.12 -0.15 0.00 0.00 0.00 0.00 19.45 19.78 1f6m n ALA 134 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1f6m s SER 135 N -4.50 4.11 0.08 0.00 0.15 -1.26 -4.76 113.70 107.52 1f6m s SER 135 Ca -0.06 -1.10 -0.17 0.00 0.70 0.00 0.00 55.95 55.32 1f6m s SER 135 Cb 0.05 -1.56 -0.10 0.00 -1.71 0.00 0.00 66.02 62.70 1f6m s SER 135 CO 0.57 -0.13 1.42 0.00 1.20 0.00 0.00 173.24 176.29 1f6m h ALA 136 N 7.87 0.36 -0.05 5.45 0.00 -1.92 -1.59 119.26 129.39 1f6m h ALA 136 Ca -0.29 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.29 1f6m h ALA 136 Cb 1.08 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1f6m h ALA 136 CO 0.53 0.29 0.29 1.79 0.00 0.00 0.00 179.25 182.15 1f6m h THR 137 N 0.29 0.06 0.03 0.00 1.35 -1.95 1.18 112.91 113.88 1f6m h THR 137 Ca 0.05 0.00 -0.35 0.00 -0.55 0.00 0.00 66.41 65.56 1f6m h THR 137 Cb 0.72 0.72 -0.05 0.00 -1.73 0.00 0.00 68.15 67.81 1f6m h THR 137 CO 0.05 0.00 -1.97 0.00 -0.25 0.00 0.00 175.52 173.35 1f6m n ASP 139 N -4.00 1.17 0.23 0.00 8.00 -0.63 -4.46 116.55 116.85 1f6m n ASP 139 Ca -0.41 -1.09 0.11 0.00 0.71 0.00 0.00 54.79 54.12 1f6m n ASP 139 Cb 0.87 0.77 0.58 0.00 -0.02 0.00 0.00 41.12 43.32 1f6m n ASP 139 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1f6m h GLY 140 N 3.81 0.00 1.00 0.44 0.00 0.12 -0.41 103.07 108.03 1f6m h GLY 140 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1f6m h GLY 140 CO 0.00 0.00 0.33 -2.75 0.00 0.00 0.00 176.54 174.12 1f6m h PHE 141 N 0.00 0.64 0.00 5.60 3.57 -1.78 -2.85 116.94 122.12 1f6m h PHE 141 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1f6m h PHE 141 Cb 0.49 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.02 1f6m h PHE 141 CO 0.00 0.41 0.00 1.19 -2.23 0.00 0.00 178.31 177.68 1f6m n PHE 142 N -4.73 0.00 -1.60 0.41 3.72 -0.16 -3.31 117.46 111.79 1f6m n PHE 142 Ca 0.02 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.49 1f6m n PHE 142 Cb 0.03 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 38.73 1f6m n PHE 142 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1f6m n TYR 143 N -0.73 0.00 -1.68 1.38 4.01 -1.08 -5.02 117.16 114.05 1f6m n TYR 143 Ca 0.05 -1.20 -0.47 0.00 -0.16 0.00 0.00 57.90 56.12 1f6m n TYR 143 Cb 0.02 -0.21 -0.04 0.00 -0.31 0.00 0.00 39.34 38.81 1f6m n TYR 143 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1f6m n ARG 144 N -0.96 2.28 -3.72 -0.72 1.74 -1.21 -1.96 116.66 112.10 1f6m n ARG 144 Ca 0.16 0.83 -0.28 0.00 -0.77 0.00 0.00 57.85 57.79 1f6m n ARG 144 Cb 0.73 -2.67 0.02 0.00 -1.02 0.00 0.00 32.46 29.52 1f6m n ARG 144 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1f6m n ASN 145 N 5.61 -4.75 -4.24 0.55 3.02 -0.89 -4.86 115.26 109.69 1f6m n ASN 145 Ca 0.20 -0.66 -0.14 0.00 -0.03 0.00 0.00 54.58 53.96 1f6m n ASN 145 Cb 0.31 -3.82 -0.10 0.00 -0.61 0.00 0.00 39.78 35.56 1f6m n ASN 145 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1f6m s GLN 146 N -6.42 1.06 0.16 3.52 -0.21 -0.83 -4.44 119.66 112.51 1f6m s GLN 146 Ca 0.58 -1.47 -0.30 0.00 0.02 0.00 0.00 55.36 54.20 1f6m s GLN 146 Cb -0.29 -0.51 -0.07 0.00 1.00 0.00 0.00 33.01 33.14 1f6m s GLN 146 CO 0.72 0.01 0.96 0.15 -2.12 0.00 0.00 175.29 175.01 1f6m s LYS 147 N -3.80 4.75 0.01 2.91 1.02 -1.26 -1.71 119.74 121.66 1f6m s LYS 147 Ca 0.18 1.48 -0.06 0.00 0.02 0.00 0.00 55.97 57.59 1f6m s LYS 147 Cb 0.04 -3.34 -0.00 0.00 -0.52 0.00 0.00 37.83 34.01 1f6m s LYS 147 CO 0.01 0.32 0.12 0.54 -0.92 0.00 0.00 175.35 175.41 1f6m s VAL 148 N -0.44 0.09 0.18 3.17 0.11 -0.72 0.20 120.40 122.99 1f6m s VAL 148 Ca 0.45 -0.74 0.09 0.00 -2.93 0.00 0.00 61.98 58.84 1f6m s VAL 148 Cb -0.25 -0.43 -0.04 0.00 -1.53 0.00 0.00 36.38 34.13 1f6m s VAL 148 CO 0.31 -0.41 -0.08 0.00 -3.33 0.00 0.00 175.10 171.60 1f6m s ALA 149 N -1.46 3.00 0.00 1.54 0.00 0.12 -1.29 121.76 123.66 1f6m s ALA 149 Ca -0.15 -1.46 0.03 0.00 0.00 0.00 0.00 51.96 50.38 1f6m s ALA 149 Cb -0.08 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.25 1f6m s ALA 149 CO 0.01 0.46 -0.08 0.08 0.00 0.00 0.00 175.76 176.23 1f6m s VAL 150 N -1.72 0.64 -0.11 0.00 1.01 -0.45 -0.40 120.40 119.36 1f6m s VAL 150 Ca 0.25 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1f6m s VAL 150 Cb -0.09 -0.55 0.03 0.00 0.00 0.00 0.00 36.38 35.77 1f6m s VAL 150 CO 0.16 0.12 -0.06 -0.51 0.00 0.00 0.00 175.10 174.81 1f6m s ILE 151 N -0.32 0.89 0.00 2.22 2.07 -0.73 0.29 121.20 125.62 1f6m s ILE 151 Ca 0.02 -0.21 0.00 0.00 -1.41 0.00 0.00 60.65 59.05 1f6m s ILE 151 Cb -0.04 -0.94 0.00 0.00 0.13 0.00 0.00 42.46 41.61 1f6m s ILE 151 CO -0.00 0.34 0.00 0.61 -1.91 0.00 0.00 174.94 173.98 1f6m n GLY 152 N 4.99 4.30 0.22 1.50 0.00 0.05 -0.35 105.19 115.90 1f6m n GLY 152 Ca -0.11 -1.31 0.02 0.00 0.00 0.00 0.00 46.02 44.62 1f6m n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f6m n GLY 153 N -1.83 2.79 0.19 -0.02 0.00 -1.26 -4.66 105.19 100.39 1f6m n GLY 153 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 45.88 1f6m n GLY 153 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f6m n GLY 154 N -0.14 0.49 0.26 -0.02 0.00 -1.26 -0.72 105.19 103.79 1f6m n GLY 154 Ca 0.04 -1.92 -0.04 0.00 0.00 0.00 0.00 46.02 44.10 1f6m n GLY 154 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1f6m h ASN 155 N -0.04 0.68 -0.81 1.61 2.35 -1.92 -2.20 115.58 115.26 1f6m h ASN 155 Ca -0.02 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1f6m h ASN 155 Cb 0.06 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.24 1f6m h ASN 155 CO 0.02 0.48 0.51 0.74 -1.65 0.00 0.00 177.43 177.53 1f6m h THR 156 N 0.81 1.22 0.46 2.81 2.02 -1.94 0.21 112.91 118.50 1f6m h THR 156 Ca 0.25 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 1f6m h THR 156 Cb -0.01 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.46 1f6m h THR 156 CO -0.09 0.22 -0.22 0.00 0.37 0.00 0.00 175.52 175.79 1f6m h ALA 157 N 1.28 -0.62 -0.25 6.16 0.00 -1.72 -1.02 119.26 123.09 1f6m h ALA 157 Ca 0.29 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.08 1f6m h ALA 157 Cb -0.09 0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 1f6m h ALA 157 CO -0.06 -0.70 -0.17 0.28 0.00 0.00 0.00 179.25 178.59 1f6m h VAL 158 N -0.91 0.51 -0.70 0.00 2.07 -1.30 0.56 116.25 116.47 1f6m h VAL 158 Ca -0.06 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.48 1f6m h VAL 158 Cb 0.58 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 1f6m h VAL 158 CO 0.10 0.00 0.45 -0.33 0.02 0.00 0.00 177.57 177.82 1f6m h GLU 159 N -0.16 0.88 -0.74 1.57 5.08 -1.00 0.51 114.58 120.72 1f6m h GLU 159 Ca 0.14 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1f6m h GLU 159 Cb 0.37 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.39 1f6m h GLU 159 CO -0.35 0.58 0.26 0.93 -1.00 0.00 0.00 179.01 179.43 1f6m h GLU 160 N 0.90 1.12 -0.30 2.33 5.08 -0.34 0.72 114.58 124.09 1f6m h GLU 160 Ca 0.27 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1f6m h GLU 160 Cb -0.04 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 1f6m h GLU 160 CO -0.08 0.93 0.10 0.00 -1.00 0.00 0.00 179.01 178.95 1f6m h ALA 161 N 1.20 0.39 -0.68 3.43 0.00 0.11 0.28 119.26 124.00 1f6m h ALA 161 Ca 0.24 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1f6m h ALA 161 Cb 0.25 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1f6m h ALA 161 CO -0.01 0.02 0.23 -0.07 0.00 0.00 0.00 179.25 179.42 1f6m h LEU 162 N 0.33 0.96 0.06 0.00 4.07 0.44 -1.16 115.31 120.02 1f6m h LEU 162 Ca 0.10 -0.20 -0.00 0.00 0.08 0.00 0.00 57.88 57.86 1f6m h LEU 162 Cb 0.23 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.72 1f6m h LEU 162 CO -0.00 0.90 -0.03 0.22 -1.08 0.00 0.00 178.44 178.45 1f6m h TYR 163 N 0.97 -0.08 -0.45 1.13 3.20 0.67 -3.06 116.97 119.35 1f6m h TYR 163 Ca 0.22 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.16 1f6m h TYR 163 Cb 0.27 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 1f6m h TYR 163 CO 0.02 0.30 0.30 -0.07 -1.64 0.00 0.00 178.16 177.07 1f6m h LEU 164 N -0.48 0.29 -1.74 2.82 4.07 -0.40 -2.82 115.31 117.05 1f6m h LEU 164 Ca -0.01 0.00 0.18 0.00 0.08 0.00 0.00 57.88 58.13 1f6m h LEU 164 Cb 0.42 -0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.07 1f6m h LEU 164 CO 0.01 0.19 0.67 -1.28 -1.08 0.00 0.00 178.44 176.95 1f6m h SER 165 N 0.33 0.00 -0.23 -0.43 0.87 -1.10 0.24 113.55 113.22 1f6m h SER 165 Ca 0.20 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1f6m h SER 165 Cb 0.37 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.33 1f6m h SER 165 CO -0.05 0.00 0.00 0.59 -0.53 0.00 0.00 176.83 176.84 1f6m n ASN 166 N -3.60 3.11 -0.04 6.23 3.02 -1.06 -4.54 115.26 118.38 1f6m n ASN 166 Ca 0.12 -1.93 -0.09 0.00 -0.03 0.00 0.00 54.58 52.65 1f6m n ASN 166 Cb 0.89 -0.14 -0.03 0.00 -0.61 0.00 0.00 39.78 39.89 1f6m n ASN 166 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1f6m n ILE 167 N 1.29 1.11 -1.90 2.41 5.41 0.63 -5.05 119.36 123.26 1f6m n ILE 167 Ca 0.16 0.07 -0.31 0.00 1.00 0.00 0.00 62.75 63.67 1f6m n ILE 167 Cb 0.55 -1.85 0.02 0.00 -0.71 0.00 0.00 39.64 37.65 1f6m n ILE 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1f6m s ALA 168 N -2.37 3.06 0.11 -1.39 0.00 -0.04 -2.09 121.76 119.04 1f6m s ALA 168 Ca -0.17 -0.17 -0.14 0.00 0.00 0.00 0.00 51.96 51.49 1f6m s ALA 168 Cb 0.04 -3.05 -0.09 0.00 0.00 0.00 0.00 23.12 20.03 1f6m s ALA 168 CO 0.23 -0.79 1.41 0.66 0.00 0.00 0.00 175.76 177.27 1f6m h SER 169 N -0.38 0.85 -4.31 0.00 4.64 -1.54 -3.43 113.55 109.37 1f6m h SER 169 Ca -0.44 -0.50 -0.12 0.00 -0.47 0.00 0.00 61.79 60.25 1f6m h SER 169 Cb 1.21 -0.24 -0.23 0.00 -0.31 0.00 0.00 62.40 62.83 1f6m h SER 169 CO 0.62 1.18 -0.26 -1.83 -0.87 0.00 0.00 176.83 175.67 1f6m s GLU 170 N -4.26 0.54 -0.13 4.77 -1.05 -1.24 -4.83 118.70 112.52 1f6m s GLU 170 Ca -0.12 0.26 0.00 0.00 -0.15 0.00 0.00 54.97 54.96 1f6m s GLU 170 Cb 0.09 0.25 -0.01 0.00 -0.44 0.00 0.00 34.13 34.02 1f6m s GLU 170 CO 0.85 -0.11 -0.14 0.08 0.95 0.00 0.00 175.26 176.89 1f6m s VAL 171 N -0.40 2.96 -0.34 1.83 1.01 0.72 -1.76 120.40 124.42 1f6m s VAL 171 Ca -0.05 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.21 1f6m s VAL 171 Cb -0.03 -2.23 0.07 0.00 0.00 0.00 0.00 36.38 34.18 1f6m s VAL 171 CO 0.02 0.53 0.07 -1.00 0.00 0.00 0.00 175.10 174.73 1f6m s HIS 172 N 0.33 3.38 -0.25 5.22 3.76 -0.41 0.14 115.29 127.46 1f6m s HIS 172 Ca -0.11 -2.03 -0.21 0.00 -0.15 0.00 0.00 55.06 52.55 1f6m s HIS 172 Cb -0.16 -2.50 -0.02 0.00 1.11 0.00 0.00 32.58 31.02 1f6m s HIS 172 CO 0.06 -0.85 0.67 -1.17 -0.85 0.00 0.00 174.74 172.59 1f6m s LEU 173 N 1.22 4.07 -0.13 0.89 0.20 0.76 -1.35 118.68 124.34 1f6m s LEU 173 Ca -0.00 0.77 -0.04 0.00 0.69 0.00 0.00 54.13 55.54 1f6m s LEU 173 Cb -0.21 -2.91 -0.03 0.00 -0.43 0.00 0.00 46.19 42.60 1f6m s LEU 173 CO -0.02 -0.40 0.02 -0.63 -0.29 0.00 0.00 176.35 175.04 1f6m s ILE 174 N 2.56 4.45 -0.11 6.68 1.01 0.15 -0.13 121.20 135.80 1f6m s ILE 174 Ca 0.28 -0.18 -0.17 0.00 0.00 0.00 0.00 60.65 60.59 1f6m s ILE 174 Cb -0.15 -2.93 0.04 0.00 0.01 0.00 0.00 42.46 39.42 1f6m s ILE 174 CO 0.08 0.54 0.42 -2.28 0.00 0.00 0.00 174.94 173.70 1f6m s HIS 175 N -0.23 -0.42 -1.05 3.97 2.46 -0.94 -0.77 115.29 118.32 1f6m s HIS 175 Ca 0.06 0.92 0.00 0.00 0.47 0.00 0.00 55.06 56.52 1f6m s HIS 175 Cb -0.12 0.17 0.00 0.00 -0.13 0.00 0.00 32.58 32.49 1f6m s HIS 175 CO 0.02 -0.31 0.96 0.54 -2.47 0.00 0.00 174.74 173.48 1f6m n ARG 176 N 2.24 0.00 -1.81 2.88 1.74 -1.21 -0.65 116.66 119.86 1f6m n ARG 176 Ca -0.16 0.46 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 1f6m n ARG 176 Cb 0.57 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.50 1f6m n ARG 176 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1f6m n ARG 177 N -1.46 0.00 -0.00 5.56 1.74 -1.26 -4.38 116.66 116.87 1f6m n ARG 177 Ca 0.00 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.18 1f6m n ARG 177 Cb 0.01 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.33 1f6m n ARG 177 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1f6m n ASP 178 N -2.70 0.92 -4.40 0.55 4.64 -1.26 -2.32 116.55 111.97 1f6m n ASP 178 Ca 0.00 -0.92 -0.29 0.00 -1.38 0.00 0.00 54.79 52.20 1f6m n ASP 178 Cb 0.00 1.07 -0.13 0.00 -1.04 0.00 0.00 41.12 41.01 1f6m n ASP 178 CO 0.00 0.00 0.00 -0.83 -0.82 0.00 0.00 177.20 175.55 1f6m s GLY 179 N -3.11 1.55 0.02 0.27 0.00 -1.26 -5.06 107.32 99.73 1f6m s GLY 179 Ca 0.07 -1.39 0.02 0.00 0.00 0.00 0.00 44.72 43.42 1f6m s GLY 179 CO 0.87 -1.34 0.01 -1.36 0.00 0.00 0.00 173.10 171.28 1f6m s PHE 180 N -1.00 3.07 -2.95 1.90 0.08 -1.26 -4.95 117.98 112.86 1f6m s PHE 180 Ca 0.14 0.06 0.24 0.00 0.12 0.00 0.00 56.93 57.49 1f6m s PHE 180 Cb -0.10 -1.64 0.26 0.00 -0.57 0.00 0.00 43.02 40.97 1f6m s PHE 180 CO 0.06 0.47 1.30 2.89 -0.10 0.00 0.00 175.22 179.84 1f6m n ARG 181 N 1.17 2.28 -1.05 0.44 1.85 0.10 -4.97 116.66 116.49 1f6m n ARG 181 Ca -0.13 -1.86 -0.30 0.00 -1.00 0.00 0.00 57.85 54.55 1f6m n ARG 181 Cb 0.52 -1.46 0.14 0.00 -1.05 0.00 0.00 32.46 30.61 1f6m n ARG 181 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1f6m s ALA 182 N -1.99 1.52 0.45 2.89 0.00 -1.20 -4.68 121.76 118.74 1f6m s ALA 182 Ca 0.29 0.15 -0.23 0.00 0.00 0.00 0.00 51.96 52.17 1f6m s ALA 182 Cb 0.20 -3.27 -0.10 0.00 0.00 0.00 0.00 23.12 19.95 1f6m s ALA 182 CO 0.30 -2.43 0.98 0.39 0.00 0.00 0.00 175.76 175.00 1f6m n GLU 183 N -3.96 1.25 0.17 0.00 1.02 -1.26 -4.69 120.64 113.16 1f6m n GLU 183 Ca 0.08 0.45 -0.14 0.00 -0.02 0.00 0.00 57.16 57.53 1f6m n GLU 183 Cb 0.54 -2.03 -0.07 0.00 -0.02 0.00 0.00 31.44 29.86 1f6m n GLU 183 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1f6m h LYS 184 N 1.35 -0.54 -1.56 3.49 1.79 -1.97 -0.56 116.57 118.57 1f6m h LYS 184 Ca -0.45 0.04 0.50 0.00 -2.18 0.00 0.00 60.65 58.56 1f6m h LYS 184 Cb 1.34 0.12 -0.12 0.00 -1.58 0.00 0.00 32.23 32.00 1f6m h LYS 184 CO 0.56 -0.36 1.05 0.97 -1.08 0.00 0.00 179.45 180.59 1f6m h ILE 185 N -0.56 0.04 0.07 1.86 6.09 -1.99 0.45 117.51 123.46 1f6m h ILE 185 Ca -0.00 -0.01 -0.18 0.00 -1.37 0.00 0.00 64.86 63.30 1f6m h ILE 185 Cb 0.53 0.02 -0.00 0.00 0.47 0.00 0.00 36.82 37.83 1f6m h ILE 185 CO -0.07 0.00 -0.90 -0.07 -3.07 0.00 0.00 178.15 174.04 1f6m h LEU 186 N 0.02 0.22 -1.63 2.19 4.07 -1.69 -3.04 115.31 115.45 1f6m h LEU 186 Ca 0.88 -0.84 0.15 0.00 0.08 0.00 0.00 57.88 58.15 1f6m h LEU 186 Cb 3.08 -0.07 -0.05 0.00 1.08 0.00 0.00 40.66 44.71 1f6m h LEU 186 CO -0.30 1.39 0.48 0.40 -1.08 0.00 0.00 178.44 179.33 1f6m h ILE 187 N -0.65 0.80 -0.16 1.22 2.04 0.12 0.22 117.51 121.10 1f6m h ILE 187 Ca -0.20 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.49 1f6m h ILE 187 Cb 1.44 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 37.91 1f6m h ILE 187 CO 0.00 0.07 -0.04 0.50 0.00 0.00 0.00 178.15 178.68 1f6m h LYS 188 N 0.38 0.32 -0.51 2.37 3.64 -0.42 -1.91 116.57 120.43 1f6m h LYS 188 Ca 0.35 -0.12 0.01 0.00 -1.27 0.00 0.00 60.65 59.62 1f6m h LYS 188 Cb 0.84 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 1f6m h LYS 188 CO -0.10 0.59 0.34 0.00 -2.27 0.00 0.00 179.45 178.01 1f6m h ARG 189 N 0.02 0.65 0.91 1.90 3.08 -0.60 -0.31 114.38 120.04 1f6m h ARG 189 Ca 0.04 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 1f6m h ARG 189 Cb 0.48 -0.15 0.01 0.00 0.08 0.00 0.00 29.97 30.39 1f6m h ARG 189 CO 0.02 0.43 -0.44 1.25 -1.07 0.00 0.00 179.97 180.16 1f6m h LEU 190 N 0.67 -1.04 -0.48 3.04 5.85 -0.42 -2.10 115.31 120.84 1f6m h LEU 190 Ca 0.19 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.98 1f6m h LEU 190 Cb -0.04 0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1f6m h LEU 190 CO -0.04 -0.69 0.27 0.24 -0.34 0.00 0.00 178.44 177.88 1f6m h MET 191 N -1.32 0.53 -0.55 1.25 2.86 -1.17 1.00 114.93 117.54 1f6m h MET 191 Ca -0.13 -0.03 0.15 0.00 -2.06 0.00 0.00 59.70 57.64 1f6m h MET 191 Cb 0.94 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.46 1f6m h MET 191 CO 0.21 0.35 0.39 0.22 1.06 0.00 0.00 176.91 179.14 1f6m h ASP 192 N 0.54 0.03 0.70 1.22 3.58 -1.06 0.96 116.42 122.40 1f6m h ASP 192 Ca 0.20 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.58 1f6m h ASP 192 Cb 0.05 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 1f6m h ASP 192 CO -0.11 0.02 -1.36 1.17 -2.88 0.00 0.00 179.24 176.08 1f6m n LYS 193 N -4.39 0.62 0.02 0.28 4.81 0.16 -2.61 118.16 117.06 1f6m n LYS 193 Ca 0.10 0.10 -0.09 0.00 -0.87 0.00 0.00 58.31 57.55 1f6m n LYS 193 Cb 0.60 -1.76 0.05 0.00 0.02 0.00 0.00 35.03 33.94 1f6m n LYS 193 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1f6m h VAL 194 N 0.00 1.34 0.06 3.15 2.07 0.45 0.68 116.25 124.01 1f6m h VAL 194 Ca -0.08 -1.91 -0.24 0.00 0.82 0.00 0.00 66.70 65.29 1f6m h VAL 194 Cb 1.26 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 32.91 1f6m h VAL 194 CO 0.02 0.59 -1.07 -0.08 0.02 0.00 0.00 177.57 177.04 1f6m h GLU 195 N 0.37 0.21 0.00 1.57 4.81 0.67 -3.39 114.58 118.81 1f6m h GLU 195 Ca -0.01 -0.31 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 1f6m h GLU 195 Cb 1.16 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1f6m h GLU 195 CO 0.11 1.10 0.00 0.09 -0.73 0.00 0.00 179.01 179.58 1f6m n ASN 196 N -3.55 0.65 0.00 1.04 5.03 -1.07 -5.09 115.26 112.27 1f6m n ASN 196 Ca -0.05 -1.15 0.00 0.00 0.87 0.00 0.00 54.58 54.24 1f6m n ASN 196 Cb 0.94 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.70 1f6m n ASN 196 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1f6m n GLY 197 N -0.08 4.50 1.08 7.41 0.00 0.24 -5.00 105.19 113.35 1f6m n GLY 197 Ca 0.00 -1.78 -0.01 0.00 0.00 0.00 0.00 46.02 44.23 1f6m n GLY 197 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1f6m n ASN 198 N 0.00 2.76 -4.61 1.61 6.94 -1.23 -4.86 115.26 115.88 1f6m n ASN 198 Ca 0.00 -3.60 -0.35 0.00 -0.02 0.00 0.00 54.58 50.61 1f6m n ASN 198 Cb 0.00 -0.61 -0.10 0.00 -2.36 0.00 0.00 39.78 36.71 1f6m n ASN 198 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1f6m s ILE 199 N -3.15 4.90 -0.19 1.53 1.01 -1.25 -0.20 121.20 123.85 1f6m s ILE 199 Ca 0.44 0.01 -0.05 0.00 0.00 0.00 0.00 60.65 61.06 1f6m s ILE 199 Cb 0.39 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 1f6m s ILE 199 CO 0.02 0.40 -0.01 -0.63 0.00 0.00 0.00 174.94 174.72 1f6m s ILE 200 N 0.80 3.91 0.01 2.92 1.09 0.38 -4.43 121.20 125.88 1f6m s ILE 200 Ca 0.05 -0.33 -0.24 0.00 -1.10 0.00 0.00 60.65 59.03 1f6m s ILE 200 Cb -0.13 -2.75 -0.05 0.00 -1.06 0.00 0.00 42.46 38.47 1f6m s ILE 200 CO 0.02 0.45 0.73 -0.76 -0.10 0.00 0.00 174.94 175.27 1f6m s LEU 201 N 0.85 4.41 -0.54 2.97 1.02 -1.26 -0.17 118.68 125.96 1f6m s LEU 201 Ca 0.00 1.34 0.07 0.00 0.02 0.00 0.00 54.13 55.56 1f6m s LEU 201 Cb -0.14 -3.15 0.25 0.00 0.02 0.00 0.00 46.19 43.16 1f6m s LEU 201 CO 0.02 -0.01 0.66 1.41 0.02 0.00 0.00 176.35 178.45 1f6m n HIS 202 N 3.06 2.12 -1.57 0.29 8.25 0.82 -4.92 115.22 123.26 1f6m n HIS 202 Ca -0.03 -3.93 -0.31 0.00 -0.26 0.00 0.00 57.72 53.20 1f6m n HIS 202 Cb 0.51 -0.48 0.06 0.00 1.12 0.00 0.00 29.99 31.20 1f6m n HIS 202 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1f6m s THR 203 N -1.99 3.79 -1.44 1.59 -4.23 -1.26 -2.20 115.64 109.90 1f6m s THR 203 Ca 0.38 0.58 -0.08 0.00 -1.18 0.00 0.00 61.69 61.39 1f6m s THR 203 Cb 0.16 -3.33 0.05 0.00 1.34 0.00 0.00 72.50 70.72 1f6m s THR 203 CO -0.05 -0.76 0.85 0.59 -0.54 0.00 0.00 174.62 174.71 1f6m n ASN 204 N -3.20 -3.20 -4.00 3.99 4.13 0.18 -4.87 115.26 108.30 1f6m n ASN 204 Ca 0.07 -0.80 -0.10 0.00 1.68 0.00 0.00 54.58 55.43 1f6m n ASN 204 Cb 0.54 -3.93 -0.11 0.00 -1.54 0.00 0.00 39.78 34.74 1f6m n ASN 204 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 1f6m s ARG 205 N -6.37 0.36 0.02 3.52 1.81 -0.91 -0.89 118.95 116.50 1f6m s ARG 205 Ca 0.38 -0.61 0.02 0.00 -1.72 0.00 0.00 55.73 53.80 1f6m s ARG 205 Cb -0.19 -0.01 -0.02 0.00 -0.45 0.00 0.00 34.95 34.28 1f6m s ARG 205 CO 0.82 -0.02 -0.08 0.95 -0.68 0.00 0.00 175.30 176.30 1f6m s THR 206 N -1.35 0.59 -0.23 0.02 -4.23 -1.26 -3.34 115.64 105.84 1f6m s THR 206 Ca -0.13 -0.71 -0.28 0.00 -1.18 0.00 0.00 61.69 59.38 1f6m s THR 206 Cb -0.09 -0.58 -0.04 0.00 1.34 0.00 0.00 72.50 73.13 1f6m s THR 206 CO -0.01 -0.11 2.05 -0.22 -0.54 0.00 0.00 174.62 175.79 1f6m s LEU 207 N -0.90 3.56 -0.11 4.79 2.96 -1.26 -1.20 118.68 126.51 1f6m s LEU 207 Ca -0.03 1.77 0.09 0.00 -0.22 0.00 0.00 54.13 55.74 1f6m s LEU 207 Cb -0.06 -3.52 -0.24 0.00 0.50 0.00 0.00 46.19 42.87 1f6m s LEU 207 CO 0.00 -1.78 0.39 -0.62 -1.32 0.00 0.00 176.35 173.02 1f6m n GLU 208 N 8.51 0.67 -3.60 1.98 -0.58 -0.14 -4.96 120.64 122.52 1f6m n GLU 208 Ca 0.26 0.21 -0.08 0.00 -0.42 0.00 0.00 57.16 57.13 1f6m n GLU 208 Cb 0.45 -1.69 -0.05 0.00 -0.57 0.00 0.00 31.44 29.58 1f6m n GLU 208 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1f6m s GLU 209 N -2.56 0.43 -0.17 3.49 2.12 -1.18 -5.00 118.70 115.83 1f6m s GLU 209 Ca -0.12 0.13 -0.04 0.00 0.36 0.00 0.00 54.97 55.29 1f6m s GLU 209 Cb 0.07 0.20 -0.03 0.00 0.26 0.00 0.00 34.13 34.64 1f6m s GLU 209 CO 0.80 -0.13 -0.02 0.08 -0.54 0.00 0.00 175.26 175.44 1f6m s VAL 210 N -1.00 3.94 0.17 3.70 1.01 -1.26 -1.76 120.40 125.20 1f6m s VAL 210 Ca 0.02 -0.33 0.08 0.00 0.00 0.00 0.00 61.98 61.74 1f6m s VAL 210 Cb -0.01 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1f6m s VAL 210 CO -0.02 0.47 -0.06 0.42 0.00 0.00 0.00 175.10 175.92 1f6m s THR 211 N 0.55 3.42 -1.78 3.92 -4.23 -0.14 -4.81 115.64 112.57 1f6m s THR 211 Ca -0.02 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1f6m s THR 211 Cb -0.14 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.00 1f6m s THR 211 CO 0.02 -0.09 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 1f6m n GLY 212 N 0.05 -0.95 0.00 3.99 0.00 -1.26 -0.76 105.19 106.26 1f6m n GLY 212 Ca -0.11 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.04 1f6m n GLY 212 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1f6m n ASP 213 N 0.58 0.33 -0.16 1.61 5.68 -0.10 -4.90 116.55 119.59 1f6m n ASP 213 Ca 0.00 -0.85 0.14 0.00 -0.50 0.00 0.00 54.79 53.58 1f6m n ASP 213 Cb 0.00 0.00 0.48 0.00 -1.14 0.00 0.00 41.12 40.46 1f6m n ASP 213 CO 0.00 0.00 0.00 1.56 -1.33 0.00 0.00 177.20 177.43 1f6m h GLN 214 N 0.00 0.45 0.00 0.11 7.50 -2.02 -1.04 115.11 120.11 1f6m h GLN 214 Ca 0.00 -0.03 0.00 0.00 0.50 0.00 0.00 58.65 59.12 1f6m h GLN 214 Cb 0.00 -0.10 0.00 0.00 0.05 0.00 0.00 27.48 27.43 1f6m h GLN 214 CO 0.00 0.30 0.00 -1.33 -1.50 0.00 0.00 178.83 176.30 1f6m n MET 215 N -4.48 0.54 0.00 1.46 2.81 -1.26 -5.02 117.12 111.17 1f6m n MET 215 Ca 0.13 0.02 0.00 0.00 -1.81 0.00 0.00 57.70 56.04 1f6m n MET 215 Cb 0.46 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 1f6m n MET 215 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1f6m n GLY 216 N 1.04 0.64 3.71 3.03 0.00 -0.40 -5.03 105.19 108.18 1f6m n GLY 216 Ca 0.16 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.66 1f6m n GLY 216 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f6m s VAL 217 N -1.10 4.77 -0.04 1.61 1.01 -0.33 -0.92 120.40 125.40 1f6m s VAL 217 Ca 0.00 1.99 0.13 0.00 0.00 0.00 0.00 61.98 64.10 1f6m s VAL 217 Cb 0.00 -4.28 -0.19 0.00 0.00 0.00 0.00 36.38 31.91 1f6m s VAL 217 CO 0.00 0.14 0.24 0.35 0.00 0.00 0.00 175.10 175.83 1f6m n THR 218 N 3.96 0.15 -4.00 3.92 -2.24 0.06 -4.47 114.28 111.66 1f6m n THR 218 Ca 0.07 -0.33 0.03 0.00 -2.27 0.00 0.00 64.05 61.54 1f6m n THR 218 Cb 0.50 0.05 0.01 0.00 -2.10 0.00 0.00 70.33 68.79 1f6m n THR 218 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f6m n GLY 219 N 1.85 0.25 3.13 3.38 0.00 -1.05 -2.02 105.19 110.72 1f6m n GLY 219 Ca -0.05 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.85 1f6m n GLY 219 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f6m s VAL 220 N -2.03 0.16 -0.17 1.61 1.01 -0.13 -0.96 120.40 119.89 1f6m s VAL 220 Ca 0.28 -1.33 0.01 0.00 0.00 0.00 0.00 61.98 60.94 1f6m s VAL 220 Cb -0.01 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 35.19 1f6m s VAL 220 CO -0.01 -0.73 -0.18 -0.13 0.00 0.00 0.00 175.10 174.05 1f6m s ARG 221 N -3.33 3.07 0.67 2.72 0.52 -0.72 -0.50 118.95 121.37 1f6m s ARG 221 Ca 0.01 -0.80 -0.01 0.00 -0.52 0.00 0.00 55.73 54.41 1f6m s ARG 221 Cb 0.03 -2.59 0.09 0.00 0.52 0.00 0.00 34.95 33.00 1f6m s ARG 221 CO -0.08 -0.13 0.93 -0.51 0.02 0.00 0.00 175.30 175.53 1f6m s LEU 222 N 1.14 3.05 -0.04 2.53 2.01 -0.59 -0.97 118.68 125.82 1f6m s LEU 222 Ca 0.01 -0.19 0.02 0.00 0.01 0.00 0.00 54.13 53.98 1f6m s LEU 222 Cb -0.14 -2.34 -0.03 0.00 0.01 0.00 0.00 46.19 43.69 1f6m s LEU 222 CO -0.08 -1.63 -0.01 -1.14 1.01 0.00 0.00 176.35 174.51 1f6m n ARG 223 N -2.70 2.03 -0.71 1.70 0.63 -0.34 -2.47 116.66 114.80 1f6m n ARG 223 Ca 0.12 0.01 0.00 0.00 -0.92 0.00 0.00 57.85 57.06 1f6m n ARG 223 Cb 0.60 -1.08 0.00 0.00 0.45 0.00 0.00 32.46 32.43 1f6m n ARG 223 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1f6m n ASP 224 N -2.34 -1.51 0.06 6.15 -0.08 -1.21 -2.73 116.55 114.89 1f6m n ASP 224 Ca -0.06 0.00 0.13 0.00 -1.51 0.00 0.00 54.79 53.34 1f6m n ASP 224 Cb 0.59 -0.76 0.48 0.00 2.34 0.00 0.00 41.12 43.78 1f6m n ASP 224 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 1f6m n THR 225 N 0.73 0.46 -1.11 5.18 -2.24 -0.06 -3.45 114.28 113.78 1f6m n THR 225 Ca 0.00 -0.07 0.06 0.00 -2.27 0.00 0.00 64.05 61.77 1f6m n THR 225 Cb 0.00 -0.67 0.23 0.00 -2.10 0.00 0.00 70.33 67.78 1f6m n THR 225 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f6m n GLN 226 N -1.93 2.39 -2.70 -0.78 6.02 -1.26 -4.72 117.38 114.39 1f6m n GLN 226 Ca 0.05 -2.88 -0.06 0.00 -0.01 0.00 0.00 57.00 54.11 1f6m n GLN 226 Cb 0.35 -1.78 0.06 0.00 1.02 0.00 0.00 30.24 29.89 1f6m n GLN 226 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1f6m n ASN 227 N -0.82 -2.07 0.00 1.08 4.05 -1.22 -5.04 115.26 111.24 1f6m n ASN 227 Ca 0.23 -2.38 0.00 0.00 0.45 0.00 0.00 54.58 52.88 1f6m n ASN 227 Cb 0.88 1.22 0.00 0.00 1.23 0.00 0.00 39.78 43.10 1f6m n ASN 227 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 1f6m n SER 228 N 1.74 0.00 -2.44 1.20 7.64 -1.26 -0.15 113.62 120.35 1f6m n SER 228 Ca 0.06 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.68 1f6m n SER 228 Cb 0.66 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.87 1f6m n SER 228 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1f6m n ASP 229 N -2.75 4.68 -0.76 6.43 5.75 -1.26 -4.67 116.55 123.97 1f6m n ASP 229 Ca 0.00 -3.71 0.09 0.00 -0.01 0.00 0.00 54.79 51.16 1f6m n ASP 229 Cb 0.00 -0.45 0.10 0.00 -1.03 0.00 0.00 41.12 39.74 1f6m n ASP 229 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1f6m n ASN 230 N -0.50 2.64 0.00 -1.12 5.15 0.78 -5.05 115.26 117.17 1f6m n ASN 230 Ca 0.39 -1.79 0.00 0.00 -0.60 0.00 0.00 54.58 52.58 1f6m n ASN 230 Cb 0.69 -0.05 0.00 0.00 -0.53 0.00 0.00 39.78 39.89 1f6m n ASN 230 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1f6m n ILE 231 N 1.03 0.00 -4.26 -1.44 5.41 -1.11 -4.90 119.36 114.10 1f6m n ILE 231 Ca 0.12 0.00 -0.25 0.00 1.00 0.00 0.00 62.75 63.62 1f6m n ILE 231 Cb 0.46 0.00 -0.08 0.00 -0.71 0.00 0.00 39.64 39.31 1f6m n ILE 231 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1f6m s GLU 232 N 0.00 2.30 -0.10 0.38 -1.05 -1.03 -4.97 118.70 114.23 1f6m s GLU 232 Ca 0.00 -1.26 -0.02 0.00 -0.15 0.00 0.00 54.97 53.54 1f6m s GLU 232 Cb 0.00 -2.24 -0.03 0.00 -0.44 0.00 0.00 34.13 31.41 1f6m s GLU 232 CO 0.00 0.41 -0.02 0.45 0.95 0.00 0.00 175.26 177.05 1f6m s SER 233 N -3.22 5.01 -0.14 0.83 0.15 -1.26 -1.54 113.70 113.53 1f6m s SER 233 Ca 0.28 0.04 -0.00 0.00 0.70 0.00 0.00 55.95 56.98 1f6m s SER 233 Cb -0.08 -1.48 0.03 0.00 -1.71 0.00 0.00 66.02 62.77 1f6m s SER 233 CO 0.18 0.32 -0.10 -0.22 1.20 0.00 0.00 173.24 174.63 1f6m s LEU 234 N -0.55 1.52 -0.46 3.45 2.96 0.34 -4.99 118.68 120.95 1f6m s LEU 234 Ca 0.09 -0.48 -0.29 0.00 -0.22 0.00 0.00 54.13 53.23 1f6m s LEU 234 Cb -0.12 -1.00 0.02 0.00 0.50 0.00 0.00 46.19 45.60 1f6m s LEU 234 CO 0.02 -0.11 1.22 -0.62 -1.32 0.00 0.00 176.35 175.54 1f6m s ASP 235 N 1.60 6.54 0.01 3.68 -1.08 -1.26 -0.96 116.67 125.20 1f6m s ASP 235 Ca 0.04 0.57 -0.08 0.00 -0.52 0.00 0.00 52.55 52.56 1f6m s ASP 235 Cb -0.13 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.78 1f6m s ASP 235 CO -0.09 -1.31 0.15 0.54 0.52 0.00 0.00 175.17 174.97 1f6m s VAL 236 N 4.77 0.09 -0.12 1.11 0.11 -0.86 -4.93 120.40 120.57 1f6m s VAL 236 Ca 0.52 -0.76 0.18 0.00 -2.93 0.00 0.00 61.98 58.99 1f6m s VAL 236 Cb -0.09 -0.56 0.14 0.00 -1.53 0.00 0.00 36.38 34.34 1f6m s VAL 236 CO 0.32 -0.42 1.57 0.00 -3.33 0.00 0.00 175.10 173.24 1f6m h ALA 237 N 4.06 0.81 -1.31 1.54 0.00 -0.47 -2.79 119.26 121.10 1f6m h ALA 237 Ca -0.31 -0.33 0.33 0.00 0.00 0.00 0.00 54.91 54.60 1f6m h ALA 237 Cb 1.19 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.78 1f6m h ALA 237 CO 0.43 0.45 0.88 0.20 0.00 0.00 0.00 179.25 181.21 1f6m s GLY 238 N -4.38 -0.39 0.01 0.00 0.00 -1.25 -4.49 107.32 96.82 1f6m s GLY 238 Ca 0.03 1.06 -0.00 0.00 0.00 0.00 0.00 44.72 45.81 1f6m s GLY 238 CO 0.71 0.27 -0.01 0.48 0.00 0.00 0.00 173.10 174.54 1f6m s LEU 239 N -2.73 2.11 -0.21 0.66 2.34 0.11 0.11 118.68 121.08 1f6m s LEU 239 Ca 0.13 -0.24 -0.03 0.00 0.06 0.00 0.00 54.13 54.05 1f6m s LEU 239 Cb 0.04 0.05 -0.01 0.00 -0.56 0.00 0.00 46.19 45.71 1f6m s LEU 239 CO -0.04 -0.15 -0.06 -0.36 -1.06 0.00 0.00 176.35 174.67 1f6m s PHE 240 N -0.71 2.93 -0.05 3.48 0.40 0.46 -1.80 117.98 122.69 1f6m s PHE 240 Ca -0.08 -0.95 -0.21 0.00 -0.60 0.00 0.00 56.93 55.09 1f6m s PHE 240 Cb -0.05 -2.06 -0.04 0.00 0.51 0.00 0.00 43.02 41.38 1f6m s PHE 240 CO -0.00 -0.52 0.60 0.14 0.70 0.00 0.00 175.22 176.14 1f6m s VAL 241 N 1.32 5.02 -0.42 -0.44 -7.23 -1.03 -1.78 120.40 115.86 1f6m s VAL 241 Ca 0.04 1.24 0.08 0.00 -1.81 0.00 0.00 61.98 61.53 1f6m s VAL 241 Cb -0.14 -3.94 0.25 0.00 0.56 0.00 0.00 36.38 33.11 1f6m s VAL 241 CO -0.03 0.34 0.56 0.00 -0.31 0.00 0.00 175.10 175.65 1f6m n ALA 242 N 3.31 2.60 -1.87 1.32 0.00 0.53 -4.78 120.51 121.62 1f6m n ALA 242 Ca -0.05 -3.55 -0.29 0.00 0.00 0.00 0.00 53.44 49.55 1f6m n ALA 242 Cb 0.51 -0.82 0.04 0.00 0.00 0.00 0.00 19.45 19.18 1f6m n ALA 242 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1f6m n ILE 243 N 1.29 2.94 -3.44 0.00 -5.35 -1.25 -4.09 119.36 109.46 1f6m n ILE 243 Ca 0.22 -3.94 0.00 0.00 -0.27 0.00 0.00 62.75 58.76 1f6m n ILE 243 Cb 0.52 -1.17 0.00 0.00 -1.74 0.00 0.00 39.64 37.25 1f6m n ILE 243 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1f6m n GLY 244 N -0.73 -1.93 3.31 3.28 0.00 -1.26 -4.77 105.19 103.09 1f6m n GLY 244 Ca 0.50 -1.49 -0.20 0.00 0.00 0.00 0.00 46.02 44.83 1f6m n GLY 244 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1f6m s HIS 245 N 0.00 1.71 -0.03 1.61 0.09 -1.26 -1.56 115.29 115.85 1f6m s HIS 245 Ca 0.00 -1.58 0.00 0.00 -0.00 0.00 0.00 55.06 53.49 1f6m s HIS 245 Cb 0.00 -0.78 0.03 0.00 -0.00 0.00 0.00 32.58 31.83 1f6m s HIS 245 CO 0.00 -0.75 0.01 -1.54 -0.00 0.00 0.00 174.74 172.46 1f6m s SER 246 N -3.39 0.34 0.33 1.40 1.04 -0.92 -4.84 113.70 107.67 1f6m s SER 246 Ca 0.38 0.00 -0.26 0.00 0.48 0.00 0.00 55.95 56.55 1f6m s SER 246 Cb 0.03 -0.16 -0.13 0.00 0.10 0.00 0.00 66.02 65.85 1f6m s SER 246 CO 0.24 -0.12 0.87 -0.81 0.98 0.00 0.00 173.24 174.40 1f6m n PRO 247 N 4.23 1.07 -2.84 4.02 -0.04 -1.26 -1.93 135.00 138.24 1f6m n PRO 247 Ca -0.26 0.38 -0.44 0.00 -0.04 0.00 0.00 63.50 63.15 1f6m n PRO 247 Cb 0.50 -1.74 0.00 0.00 -0.04 0.00 0.00 33.50 32.22 1f6m n PRO 247 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1f6m n ASN 248 N 1.16 5.15 -0.18 3.54 3.02 -0.27 -4.61 115.26 123.07 1f6m n ASN 248 Ca 0.11 -2.96 0.02 0.00 -0.03 0.00 0.00 54.58 51.71 1f6m n ASN 248 Cb 0.34 -1.62 0.05 0.00 -0.61 0.00 0.00 39.78 37.95 1f6m n ASN 248 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1f6m n THR 249 N 5.04 1.10 -0.06 3.41 -2.24 -1.26 -4.75 114.28 115.52 1f6m n THR 249 Ca 0.40 -1.12 -0.10 0.00 -2.27 0.00 0.00 64.05 60.97 1f6m n THR 249 Cb 0.43 0.42 -0.03 0.00 -2.10 0.00 0.00 70.33 69.06 1f6m n THR 249 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f6m h ALA 250 N 0.52 0.29 0.00 6.98 0.00 -1.92 -1.88 119.26 123.25 1f6m h ALA 250 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1f6m h ALA 250 Cb 0.62 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1f6m h ALA 250 CO 0.01 -0.24 0.00 0.44 0.00 0.00 0.00 179.25 179.46 1f6m n ILE 251 N -4.93 1.10 -0.28 0.00 -5.35 -1.26 -1.11 119.36 107.53 1f6m n ILE 251 Ca -0.03 0.27 0.07 0.00 -0.27 0.00 0.00 62.75 62.79 1f6m n ILE 251 Cb 0.03 -1.23 0.18 0.00 -1.74 0.00 0.00 39.64 36.88 1f6m n ILE 251 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1f6m n PHE 252 N -1.30 0.59 -1.58 4.28 3.72 -0.71 -4.15 117.46 118.31 1f6m n PHE 252 Ca 0.01 -0.54 -0.60 0.00 -0.05 0.00 0.00 57.45 56.28 1f6m n PHE 252 Cb 0.02 -0.06 -0.08 0.00 -0.94 0.00 0.00 39.48 38.42 1f6m n PHE 252 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1f6m n GLU 253 N 0.54 0.28 -2.71 -1.08 -0.58 -0.27 -1.63 120.64 115.20 1f6m n GLU 253 Ca 0.14 0.10 -0.15 0.00 -0.42 0.00 0.00 57.16 56.84 1f6m n GLU 253 Cb 0.50 -1.64 -0.00 0.00 -0.57 0.00 0.00 31.44 29.73 1f6m n GLU 253 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1f6m n GLY 254 N 2.39 -0.50 0.00 0.62 0.00 -1.26 -4.73 105.19 101.71 1f6m n GLY 254 Ca 0.22 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1f6m n GLY 254 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1f6m n GLN 255 N -3.07 2.92 -4.28 1.61 6.02 -0.65 -5.02 117.38 114.92 1f6m n GLN 255 Ca -0.10 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.72 1f6m n GLN 255 Cb 0.58 -0.66 -0.14 0.00 1.02 0.00 0.00 30.24 31.04 1f6m n GLN 255 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1f6m s LEU 256 N -1.80 2.02 -0.17 1.08 1.43 -1.23 -4.81 118.68 115.21 1f6m s LEU 256 Ca 0.00 -0.15 -0.29 0.00 -1.03 0.00 0.00 54.13 52.66 1f6m s LEU 256 Cb 0.00 -0.38 -0.04 0.00 0.03 0.00 0.00 46.19 45.80 1f6m s LEU 256 CO 0.00 0.08 1.73 -1.61 0.23 0.00 0.00 176.35 176.79 1f6m s GLU 257 N -0.22 3.81 0.30 1.70 2.02 -1.26 -4.96 118.70 120.09 1f6m s GLU 257 Ca 0.03 1.89 0.08 0.00 0.02 0.00 0.00 54.97 56.98 1f6m s GLU 257 Cb -0.03 -4.08 -0.03 0.00 0.10 0.00 0.00 34.13 30.08 1f6m s GLU 257 CO -0.00 -1.29 0.23 -0.51 0.02 0.00 0.00 175.26 173.71 1f6m s LEU 258 N 5.32 3.61 -0.30 1.80 1.02 -1.26 -2.13 118.68 126.73 1f6m s LEU 258 Ca 0.77 -0.46 -0.01 0.00 0.02 0.00 0.00 54.13 54.46 1f6m s LEU 258 Cb -0.29 -2.17 0.13 0.00 0.02 0.00 0.00 46.19 43.88 1f6m s LEU 258 CO 0.31 -0.22 0.26 -0.70 0.02 0.00 0.00 176.35 176.01 1f6m s GLU 259 N -3.91 0.34 -1.13 1.70 2.12 -0.34 -4.84 118.70 112.65 1f6m s GLU 259 Ca 0.37 -0.42 -0.06 0.00 0.36 0.00 0.00 54.97 55.22 1f6m s GLU 259 Cb -0.06 -0.84 0.01 0.00 0.26 0.00 0.00 34.13 33.49 1f6m s GLU 259 CO 0.25 -1.06 0.79 0.09 -0.54 0.00 0.00 175.26 174.79 1f6m n ASN 260 N 5.06 -5.40 0.00 -1.70 5.03 -1.26 -2.56 115.26 114.43 1f6m n ASN 260 Ca -0.00 -0.36 0.00 0.00 0.87 0.00 0.00 54.58 55.08 1f6m n ASN 260 Cb 0.44 -4.08 0.00 0.00 -1.02 0.00 0.00 39.78 35.12 1f6m n ASN 260 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1f6m n GLY 261 N -1.59 2.66 3.74 7.41 0.00 -1.26 -4.92 105.19 111.23 1f6m n GLY 261 Ca -0.02 -0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 1f6m n GLY 261 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1f6m s TYR 262 N -1.47 3.88 0.18 1.61 1.51 -1.06 -4.57 117.35 117.43 1f6m s TYR 262 Ca 0.00 1.84 -0.31 0.00 -1.01 0.00 0.00 57.07 57.60 1f6m s TYR 262 Cb 0.00 -3.05 -0.09 0.00 -0.11 0.00 0.00 41.96 38.71 1f6m s TYR 262 CO 0.00 0.23 1.40 0.42 -1.11 0.00 0.00 175.55 176.49 1f6m s ILE 263 N -0.75 3.01 -0.08 2.71 1.01 0.38 -1.20 121.20 126.28 1f6m s ILE 263 Ca 0.44 0.79 -0.22 0.00 0.00 0.00 0.00 60.65 61.65 1f6m s ILE 263 Cb -0.26 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 1f6m s ILE 263 CO 0.32 0.10 0.64 -0.75 0.00 0.00 0.00 174.94 175.25 1f6m s LYS 264 N 0.33 4.41 0.24 2.79 2.20 -0.90 -4.45 119.74 124.36 1f6m s LYS 264 Ca 0.61 0.77 0.12 0.00 -0.36 0.00 0.00 55.97 57.11 1f6m s LYS 264 Cb -0.39 -3.44 -0.05 0.00 -1.51 0.00 0.00 37.83 32.44 1f6m s LYS 264 CO 0.36 0.09 -0.21 0.14 -0.36 0.00 0.00 175.35 175.37 1f6m s VAL 265 N 0.75 2.47 0.26 4.02 -7.23 -1.26 -4.07 120.40 115.34 1f6m s VAL 265 Ca 0.35 -2.23 -0.03 0.00 -1.81 0.00 0.00 61.98 58.25 1f6m s VAL 265 Cb -0.17 -2.25 0.25 0.00 0.56 0.00 0.00 36.38 34.77 1f6m s VAL 265 CO 0.16 -0.28 1.86 -0.61 -0.31 0.00 0.00 175.10 175.92 1f6m h GLN 266 N 2.64 1.02 0.00 4.82 4.15 -0.99 -3.48 115.11 123.28 1f6m h GLN 266 Ca -0.43 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 58.93 1f6m h GLN 266 Cb 1.24 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.70 1f6m h GLN 266 CO 0.55 0.68 0.00 0.45 -1.93 0.00 0.00 178.83 178.58 1f6m n SER 267 N -4.58 -0.39 0.00 -0.69 2.88 0.03 -4.98 113.62 105.90 1f6m n SER 267 Ca 0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 1f6m n SER 267 Cb 0.22 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.68 1f6m n SER 267 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1f6m n GLY 268 N 0.00 -2.09 2.06 0.46 0.00 -1.26 -4.32 105.19 100.04 1f6m n GLY 268 Ca 0.00 -1.48 -0.24 0.00 0.00 0.00 0.00 46.02 44.30 1f6m n GLY 268 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1f6m n ILE 269 N -1.48 3.08 -2.10 -0.61 -5.35 -1.26 -4.33 119.36 107.31 1f6m n ILE 269 Ca 0.00 -2.11 0.04 0.00 -0.27 0.00 0.00 62.75 60.41 1f6m n ILE 269 Cb 0.00 -1.15 0.05 0.00 -1.74 0.00 0.00 39.64 36.80 1f6m n ILE 269 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1f6m n HIS 270 N -0.31 0.00 -0.02 4.28 8.25 -1.26 -5.14 115.22 121.02 1f6m n HIS 270 Ca 0.45 -0.55 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 1f6m n HIS 270 Cb 0.73 -0.14 -0.00 0.00 1.12 0.00 0.00 29.99 31.70 1f6m n HIS 270 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1f6m n GLY 271 N -0.05 -1.91 2.38 -1.41 0.00 -1.26 -4.88 105.19 98.06 1f6m n GLY 271 Ca 0.07 -1.50 -0.17 0.00 0.00 0.00 0.00 46.02 44.43 1f6m n GLY 271 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1f6m n ASN 272 N -2.44 -4.81 0.26 1.61 5.15 -1.26 -4.81 115.26 108.97 1f6m n ASN 272 Ca -0.00 0.17 0.18 0.00 -0.60 0.00 0.00 54.58 54.33 1f6m n ASN 272 Cb 0.01 -4.11 0.91 0.00 -0.53 0.00 0.00 39.78 36.05 1f6m n ASN 272 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1f6m h ALA 273 N 0.85 1.00 -0.57 5.20 0.00 -1.86 -1.86 119.26 122.01 1f6m h ALA 273 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1f6m h ALA 273 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1f6m h ALA 273 CO 0.48 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.98 1f6m n THR 274 N -2.79 1.01 -1.89 0.00 -2.24 -1.26 -0.79 114.28 106.33 1f6m n THR 274 Ca -0.02 -1.00 -0.42 0.00 -2.27 0.00 0.00 64.05 60.34 1f6m n THR 274 Cb 0.11 0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 68.81 1f6m n THR 274 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1f6m s GLN 275 N -1.01 4.19 0.00 -0.78 2.00 -0.70 -1.80 119.66 121.56 1f6m s GLN 275 Ca 0.38 2.40 0.00 0.00 -2.00 0.00 0.00 55.36 56.14 1f6m s GLN 275 Cb 0.20 -3.43 0.00 0.00 0.80 0.00 0.00 33.01 30.58 1f6m s GLN 275 CO 0.26 -0.71 0.00 0.25 -0.50 0.00 0.00 175.29 174.59 1f6m n THR 276 N 4.45 0.00 0.23 -0.34 -2.24 -0.65 -0.70 114.28 115.03 1f6m n THR 276 Ca 0.15 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.06 1f6m n THR 276 Cb 0.39 -1.04 0.25 0.00 -2.10 0.00 0.00 70.33 67.83 1f6m n THR 276 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1f6m h SER 277 N 0.00 0.00 -3.42 3.42 4.64 -1.84 -3.43 113.55 112.91 1f6m h SER 277 Ca 0.00 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.66 1f6m h SER 277 Cb 0.00 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 61.80 1f6m h SER 277 CO 0.00 0.03 -0.72 -0.63 -0.87 0.00 0.00 176.83 174.63 1f6m s ILE 278 N -3.28 3.28 0.11 0.95 1.01 -1.26 -4.99 121.20 117.02 1f6m s ILE 278 Ca 0.06 -0.62 -0.35 0.00 0.00 0.00 0.00 60.65 59.74 1f6m s ILE 278 Cb 0.06 -2.54 -0.14 0.00 0.01 0.00 0.00 42.46 39.85 1f6m s ILE 278 CO 0.65 0.36 1.57 -2.65 0.00 0.00 0.00 174.94 174.87 1f6m n PRO 279 N 4.77 1.95 0.00 2.79 -0.02 -1.26 -1.19 135.00 142.04 1f6m n PRO 279 Ca -0.18 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1f6m n PRO 279 Cb 0.50 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1f6m n PRO 279 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1f6m n GLY 280 N 3.38 0.19 3.21 -1.23 0.00 -1.26 -5.05 105.19 104.42 1f6m n GLY 280 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1f6m n GLY 280 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f6m s VAL 281 N -2.00 2.34 0.15 1.61 1.01 -0.33 -0.25 120.40 122.93 1f6m s VAL 281 Ca 0.00 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.17 1f6m s VAL 281 Cb 0.00 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1f6m s VAL 281 CO 0.00 0.53 -0.15 -0.36 0.00 0.00 0.00 175.10 175.12 1f6m s PHE 282 N 0.85 1.58 -0.02 5.22 0.08 0.39 -1.64 117.98 124.43 1f6m s PHE 282 Ca -0.06 -0.54 0.02 0.00 0.12 0.00 0.00 56.93 56.48 1f6m s PHE 282 Cb -0.15 -0.80 0.01 0.00 -0.57 0.00 0.00 43.02 41.51 1f6m s PHE 282 CO -0.02 0.23 -0.07 0.00 -0.10 0.00 0.00 175.22 175.26 1f6m s ALA 283 N -2.28 0.73 0.09 5.36 0.00 -0.75 0.16 121.76 125.07 1f6m s ALA 283 Ca 0.13 -0.25 0.03 0.00 0.00 0.00 0.00 51.96 51.87 1f6m s ALA 283 Cb -0.04 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 1f6m s ALA 283 CO 0.05 0.10 -0.08 0.00 0.00 0.00 0.00 175.76 175.82 1f6m s ALA 284 N 0.28 0.96 0.00 0.00 0.00 -0.88 -4.76 121.76 117.36 1f6m s ALA 284 Ca -0.04 -1.16 0.00 0.00 0.00 0.00 0.00 51.96 50.76 1f6m s ALA 284 Cb -0.09 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.11 1f6m s ALA 284 CO 0.00 -0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.07 1f6m n GLY 285 N 0.54 -1.75 0.31 0.00 0.00 -1.26 -4.28 105.19 98.74 1f6m n GLY 285 Ca -0.16 -1.95 0.18 0.00 0.00 0.00 0.00 46.02 44.09 1f6m n GLY 285 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1f6m h ASP 286 N 0.00 0.00 0.26 1.61 5.19 -1.89 -2.26 116.42 119.34 1f6m h ASP 286 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1f6m h ASP 286 Cb 0.00 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.51 1f6m h ASP 286 CO 0.00 0.03 0.00 1.62 -3.12 0.00 0.00 179.24 177.77 1f6m h VAL 287 N 0.00 0.00 0.00 -1.35 3.04 -1.77 -2.75 116.25 113.42 1f6m h VAL 287 Ca -0.00 -0.09 -0.05 0.00 -1.01 0.00 0.00 66.70 65.55 1f6m h VAL 287 Cb 0.15 0.68 -0.10 0.00 -2.01 0.00 0.00 31.29 30.01 1f6m h VAL 287 CO 0.00 0.00 -0.53 1.15 -1.01 0.00 0.00 177.57 177.19 1f6m n MET 288 N -2.30 0.55 -3.59 4.17 -0.00 -0.85 -0.47 117.12 114.63 1f6m n MET 288 Ca -0.00 -2.00 -0.25 0.00 -0.00 0.00 0.00 57.70 55.45 1f6m n MET 288 Cb 0.11 -0.78 -0.16 0.00 -0.00 0.00 0.00 33.22 32.38 1f6m n MET 288 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1f6m s ASP 289 N -2.05 2.32 0.00 3.17 2.15 -1.04 -4.89 116.67 116.33 1f6m s ASP 289 Ca 0.22 -0.62 0.25 0.00 0.43 0.00 0.00 52.55 52.84 1f6m s ASP 289 Cb 0.23 -0.18 0.54 0.00 -0.30 0.00 0.00 42.92 43.21 1f6m s ASP 289 CO -0.05 -0.35 1.43 1.57 -0.17 0.00 0.00 175.17 177.60 1f6m n HIS 290 N 5.28 0.00 0.00 -5.34 -0.00 -1.26 -4.58 115.22 109.33 1f6m n HIS 290 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.65 1f6m n HIS 290 Cb 0.49 -0.12 0.00 0.00 -0.00 0.00 0.00 29.99 30.36 1f6m n HIS 290 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.34 175.45 1f6m n ILE 291 N -0.72 0.00 0.16 3.57 -0.00 -1.26 -4.92 119.36 116.18 1f6m n ILE 291 Ca 0.10 0.13 -0.13 0.00 -0.00 0.00 0.00 62.75 62.85 1f6m n ILE 291 Cb 0.36 -1.07 -0.08 0.00 -0.00 0.00 0.00 39.64 38.85 1f6m n ILE 291 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.55 178.43 1f6m h TYR 292 N 0.00 -0.39 -6.74 1.39 0.05 -2.01 -3.48 116.97 105.79 1f6m h TYR 292 Ca 0.00 -0.01 -0.49 0.00 0.05 0.00 0.00 58.73 58.28 1f6m h TYR 292 Cb 0.00 0.13 -0.00 0.00 1.01 0.00 0.00 36.73 37.87 1f6m h TYR 292 CO 0.00 -0.05 -1.07 0.54 -1.05 0.00 0.00 178.16 176.53 1f6m n ARG 293 N -5.12 -1.44 -4.57 4.88 1.74 -1.26 -5.01 116.66 105.88 1f6m n ARG 293 Ca -0.09 0.72 -0.26 0.00 -0.77 0.00 0.00 57.85 57.44 1f6m n ARG 293 Cb 0.27 -2.36 -0.10 0.00 -1.02 0.00 0.00 32.46 29.24 1f6m n ARG 293 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1f6m s GLN 294 N -5.10 1.88 0.16 5.56 -1.52 -1.26 -5.05 119.66 114.32 1f6m s GLN 294 Ca 0.04 -2.09 -0.03 0.00 -1.95 0.00 0.00 55.36 51.34 1f6m s GLN 294 Cb -0.02 -1.24 -0.01 0.00 -0.22 0.00 0.00 33.01 31.53 1f6m s GLN 294 CO 0.90 -0.19 1.38 0.00 -0.25 0.00 0.00 175.29 177.13 1f6m h ALA 295 N 1.84 0.50 -0.17 6.09 0.00 -1.96 -2.86 119.26 122.70 1f6m h ALA 295 Ca -0.42 -0.65 -0.10 0.00 0.00 0.00 0.00 54.91 53.74 1f6m h ALA 295 Cb 1.26 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1f6m h ALA 295 CO 0.73 0.79 -0.34 0.97 0.00 0.00 0.00 179.25 181.40 1f6m h ILE 296 N 0.26 1.29 0.01 0.00 6.09 -1.96 -1.63 117.51 121.56 1f6m h ILE 296 Ca -0.05 -1.40 -0.20 0.00 -1.37 0.00 0.00 64.86 61.84 1f6m h ILE 296 Cb 1.41 1.53 -0.01 0.00 0.47 0.00 0.00 36.82 40.22 1f6m h ILE 296 CO 0.14 0.43 -0.92 0.71 -3.07 0.00 0.00 178.15 175.44 1f6m h THR 297 N 0.31 1.51 -0.41 2.19 1.35 -1.97 -2.58 112.91 113.32 1f6m h THR 297 Ca 0.04 -2.72 -0.12 0.00 -0.55 0.00 0.00 66.41 63.06 1f6m h THR 297 Cb 0.75 2.53 -0.01 0.00 -1.73 0.00 0.00 68.15 69.70 1f6m h THR 297 CO 0.06 0.79 -0.21 0.28 -0.25 0.00 0.00 175.52 176.19 1f6m h SER 298 N 0.10 0.89 -0.63 5.36 0.02 -1.30 -1.62 113.55 116.36 1f6m h SER 298 Ca -0.05 -0.41 -0.08 0.00 -0.84 0.00 0.00 61.79 60.41 1f6m h SER 298 Cb 1.56 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 63.83 1f6m h SER 298 CO 0.14 1.10 0.10 0.00 -1.14 0.00 0.00 176.83 177.03 1f6m h ALA 299 N 0.82 0.95 0.42 3.77 0.00 -1.33 0.14 119.26 124.02 1f6m h ALA 299 Ca 0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1f6m h ALA 299 Cb 0.77 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1f6m h ALA 299 CO 0.06 0.66 -0.45 0.78 0.00 0.00 0.00 179.25 180.30 1f6m h GLY 300 N 1.04 -1.08 1.26 0.00 0.00 -1.09 -2.36 103.07 100.84 1f6m h GLY 300 Ca 0.20 0.52 -0.02 0.00 0.00 0.00 0.00 47.33 48.02 1f6m h GLY 300 CO 0.01 -0.34 0.32 -0.91 0.00 0.00 0.00 176.54 175.63 1f6m h THR 301 N -0.89 1.22 -0.67 4.70 1.35 -1.17 -1.76 112.91 115.70 1f6m h THR 301 Ca -0.04 -0.62 0.13 0.00 -0.55 0.00 0.00 66.41 65.33 1f6m h THR 301 Cb 0.79 0.36 -0.04 0.00 -1.73 0.00 0.00 68.15 67.53 1f6m h THR 301 CO -0.08 0.26 0.45 1.23 -0.25 0.00 0.00 175.52 177.12 1f6m h GLY 302 N 1.03 0.57 0.60 5.82 0.00 -0.71 0.13 103.07 110.50 1f6m h GLY 302 Ca 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 1f6m h GLY 302 CO -0.03 0.07 -0.02 0.00 0.00 0.00 0.00 176.54 176.56 1f6m h MET 304 N -0.35 0.87 0.05 0.00 2.86 -0.95 -1.06 114.93 116.36 1f6m h MET 304 Ca 0.01 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1f6m h MET 304 Cb 0.46 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1f6m h MET 304 CO 0.01 0.58 -0.02 0.00 1.06 0.00 0.00 176.91 178.53 1f6m h ALA 305 N 1.58 -0.06 -0.86 6.32 0.00 -0.69 0.32 119.26 125.86 1f6m h ALA 305 Ca 0.28 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.18 1f6m h ALA 305 Cb 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1f6m h ALA 305 CO -0.07 -0.51 0.55 0.00 0.00 0.00 0.00 179.25 179.22 1f6m h ALA 306 N 0.83 1.14 -0.39 0.00 0.00 -0.83 0.19 119.26 120.21 1f6m h ALA 306 Ca -0.01 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1f6m h ALA 306 Cb 0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1f6m h ALA 306 CO 0.01 0.38 -0.37 -0.07 0.00 0.00 0.00 179.25 179.19 1f6m h LEU 307 N 1.06 1.01 -0.61 0.00 3.38 -0.88 -1.90 115.31 117.36 1f6m h LEU 307 Ca 0.35 -0.46 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 1f6m h LEU 307 Cb 0.03 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1f6m h LEU 307 CO -0.12 1.26 0.02 0.44 0.09 0.00 0.00 178.44 180.12 1f6m h ASP 308 N 0.77 1.04 -0.32 -0.43 3.32 0.11 -1.54 116.42 119.37 1f6m h ASP 308 Ca 0.06 -0.30 0.03 0.00 0.02 0.00 0.00 57.03 56.85 1f6m h ASP 308 Cb 0.97 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.21 1f6m h ASP 308 CO 0.09 1.09 0.12 0.00 -1.72 0.00 0.00 179.24 178.83 1f6m h ALA 309 N 0.99 0.37 -0.44 3.45 0.00 -0.50 -1.14 119.26 121.99 1f6m h ALA 309 Ca 0.18 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1f6m h ALA 309 Cb 0.54 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1f6m h ALA 309 CO 0.03 -0.27 0.24 1.49 0.00 0.00 0.00 179.25 180.74 1f6m h GLU 310 N 0.27 0.62 -0.61 0.00 4.81 -1.12 0.33 114.58 118.89 1f6m h GLU 310 Ca 0.14 -0.08 0.07 0.00 -0.13 0.00 0.00 59.36 59.37 1f6m h GLU 310 Cb 0.10 -0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.29 1f6m h GLU 310 CO -0.13 0.50 0.28 -0.09 -0.73 0.00 0.00 179.01 178.84 1f6m h ARG 311 N 0.58 0.50 0.54 1.92 2.43 -0.93 0.13 114.38 119.55 1f6m h ARG 311 Ca 0.16 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 1f6m h ARG 311 Cb 0.06 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 29.51 1f6m h ARG 311 CO -0.02 0.33 -0.26 -0.92 -1.51 0.00 0.00 179.97 177.58 1f6m h TYR 312 N 0.51 -0.68 -0.98 2.20 3.20 -0.59 -1.14 116.97 119.50 1f6m h TYR 312 Ca 0.29 -0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.25 1f6m h TYR 312 Cb 0.28 0.22 -0.08 0.00 1.54 0.00 0.00 36.73 38.69 1f6m h TYR 312 CO -0.12 -0.36 0.62 -0.07 -1.64 0.00 0.00 178.16 176.59 1f6m h LEU 313 N -0.90 0.91 -0.45 2.82 3.38 -0.11 0.07 115.31 121.03 1f6m h LEU 313 Ca -0.07 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1f6m h LEU 313 Cb 0.62 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1f6m h LEU 313 CO 0.12 0.52 0.19 0.44 0.09 0.00 0.00 178.44 179.80 1f6m h ASP 314 N 0.99 0.62 -0.71 -0.43 3.45 -0.67 -1.78 116.42 117.89 1f6m h ASP 314 Ca 0.46 -0.16 0.12 0.00 0.43 0.00 0.00 57.03 57.88 1f6m h ASP 314 Cb 0.42 -0.16 -0.08 0.00 -0.56 0.00 0.00 39.33 38.95 1f6m h ASP 314 CO -0.22 0.61 0.31 1.23 -1.57 0.00 0.00 179.24 179.59 1f6m h GLY 315 N 0.59 1.06 0.94 2.75 0.00 0.29 0.40 103.07 109.10 1f6m h GLY 315 Ca 0.15 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1f6m h GLY 315 CO -0.01 -0.03 -0.05 1.41 0.00 0.00 0.00 176.54 177.86 1f6m h LEU 316 N 0.49 -0.13 -0.50 3.11 4.07 -0.79 0.20 115.31 121.77 1f6m h LEU 316 Ca 0.37 0.01 0.06 0.00 0.08 0.00 0.00 57.88 58.40 1f6m h LEU 316 Cb 0.49 0.04 -0.05 0.00 1.08 0.00 0.00 40.66 42.22 1f6m h LEU 316 CO -0.34 -0.08 0.21 0.00 -1.08 0.00 0.00 178.44 177.15 1f6m h ALA 317 N 0.84 0.63 0.03 1.53 0.00 -0.37 -3.04 119.26 118.87 1f6m h ALA 317 Ca 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1f6m h ALA 317 Cb 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1f6m h ALA 317 CO -0.01 -0.17 -0.02 -0.44 0.00 0.00 0.00 179.25 178.60 1f6m h ASP 318 N 0.41 -0.05 -0.05 0.00 5.19 0.16 -3.22 116.42 118.86 1f6m h ASP 318 Ca 0.24 0.00 -0.56 0.00 -0.62 0.00 0.00 57.03 56.09 1f6m h ASP 318 Cb 0.22 0.02 0.07 0.00 0.18 0.00 0.00 39.33 39.81 1f6m h ASP 318 CO -0.21 -0.03 1.73 0.00 -3.12 0.00 0.00 179.24 177.61 1f6m n ALA 319 N -2.19 2.15 -1.25 3.45 0.00 0.02 -5.09 120.51 117.59 1f6m n ALA 319 Ca -0.01 -3.01 0.00 0.00 0.00 0.00 0.00 53.44 50.42 1f6m n ALA 319 Cb 0.02 -3.64 0.00 0.00 0.00 0.00 0.00 19.45 15.83 1f6m n ALA 319 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13