#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f6m s THR 2 N 0.00 4.75 -0.05 2.61 2.01 -1.26 -5.08 115.64 118.62 1f6m s THR 2 Ca 0.00 -0.75 0.00 0.00 0.31 0.00 0.00 61.69 61.26 1f6m s THR 2 Cb 0.00 -3.62 -0.03 0.00 0.01 0.00 0.00 72.50 68.86 1f6m s THR 2 CO 0.00 -0.21 -0.03 -0.89 -0.69 0.00 0.00 174.62 172.79 1f6m s THR 3 N 1.59 3.97 -0.11 -0.82 2.01 -1.26 -2.74 115.64 118.27 1f6m s THR 3 Ca 0.03 -0.47 0.03 0.00 0.31 0.00 0.00 61.69 61.59 1f6m s THR 3 Cb -0.19 -2.68 0.01 0.00 0.01 0.00 0.00 72.50 69.65 1f6m s THR 3 CO 0.07 0.53 -0.20 -0.75 -0.69 0.00 0.00 174.62 173.59 1f6m s LYS 4 N -1.05 2.71 0.08 4.92 2.20 0.52 -4.96 119.74 124.17 1f6m s LYS 4 Ca 0.15 -0.75 0.05 0.00 -0.36 0.00 0.00 55.97 55.06 1f6m s LYS 4 Cb -0.11 -2.16 -0.04 0.00 -1.51 0.00 0.00 37.83 34.01 1f6m s LYS 4 CO 0.04 0.04 -0.05 -1.58 -0.36 0.00 0.00 175.35 173.44 1f6m s HIS 5 N 0.69 2.88 -0.17 4.03 5.65 -1.26 0.37 115.29 127.49 1f6m s HIS 5 Ca -0.12 -0.08 -0.25 0.00 0.25 0.00 0.00 55.06 54.86 1f6m s HIS 5 Cb -0.16 -1.51 0.06 0.00 -1.18 0.00 0.00 32.58 29.80 1f6m s HIS 5 CO 0.02 0.45 0.65 0.45 -0.65 0.00 0.00 174.74 175.66 1f6m s SER 6 N -2.15 -0.66 0.11 9.88 0.15 -0.29 -4.95 113.70 115.80 1f6m s SER 6 Ca 0.23 1.07 -0.22 0.00 0.70 0.00 0.00 55.95 57.72 1f6m s SER 6 Cb -0.11 1.03 -0.08 0.00 -1.71 0.00 0.00 66.02 65.15 1f6m s SER 6 CO 0.15 -0.37 1.71 0.11 1.20 0.00 0.00 173.24 176.03 1f6m h LYS 7 N 4.30 -0.08 -5.30 5.44 1.57 -1.84 -2.89 116.57 117.78 1f6m h LYS 7 Ca -0.28 0.01 -0.67 0.00 -1.87 0.00 0.00 60.65 57.84 1f6m h LYS 7 Cb 1.16 0.02 -0.30 0.00 0.08 0.00 0.00 32.23 33.18 1f6m h LYS 7 CO 0.20 -0.05 -0.82 -1.17 -0.57 0.00 0.00 179.45 177.05 1f6m s LEU 8 N -10.31 2.42 -0.13 2.94 2.96 -1.26 -0.64 118.68 114.66 1f6m s LEU 8 Ca -0.14 -0.45 0.02 0.00 -0.22 0.00 0.00 54.13 53.34 1f6m s LEU 8 Cb 0.08 -1.52 0.01 0.00 0.50 0.00 0.00 46.19 45.27 1f6m s LEU 8 CO 0.67 0.14 -0.18 -0.22 -1.32 0.00 0.00 176.35 175.45 1f6m s LEU 9 N 0.46 1.88 -0.20 -0.68 2.96 -1.02 -2.27 118.68 119.81 1f6m s LEU 9 Ca -0.13 -0.52 -0.07 0.00 -0.22 0.00 0.00 54.13 53.20 1f6m s LEU 9 Cb -0.17 -1.26 -0.04 0.00 0.50 0.00 0.00 46.19 45.23 1f6m s LEU 9 CO 0.05 0.02 0.06 -0.63 -1.32 0.00 0.00 176.35 174.54 1f6m s ILE 10 N 1.04 4.61 -0.56 6.68 1.01 0.14 -1.54 121.20 132.58 1f6m s ILE 10 Ca -0.04 -0.09 -0.13 0.00 0.00 0.00 0.00 60.65 60.39 1f6m s ILE 10 Cb -0.15 -3.10 0.14 0.00 0.01 0.00 0.00 42.46 39.37 1f6m s ILE 10 CO -0.04 0.43 0.49 -0.76 0.00 0.00 0.00 174.94 175.06 1f6m s LEU 11 N 0.71 6.11 0.00 2.97 1.02 -0.19 -0.85 118.68 128.44 1f6m s LEU 11 Ca 0.03 -1.99 0.00 0.00 0.02 0.00 0.00 54.13 52.19 1f6m s LEU 11 Cb -0.13 -2.14 0.00 0.00 0.02 0.00 0.00 46.19 43.93 1f6m s LEU 11 CO 0.02 -0.76 0.00 0.61 0.02 0.00 0.00 176.35 176.24 1f6m n GLY 12 N 4.92 4.38 2.22 -3.19 0.00 0.07 -0.20 105.19 113.39 1f6m n GLY 12 Ca -0.08 -1.26 -0.20 0.00 0.00 0.00 0.00 46.02 44.48 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 4.28 -3.41 1.61 3.41 -1.13 -4.38 113.62 113.99 1f6m n SER 13 Ca 0.00 -3.45 -0.10 0.00 -0.26 0.00 0.00 58.87 55.06 1f6m n SER 13 Cb 0.00 -0.38 0.04 0.00 -0.26 0.00 0.00 64.21 63.61 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 -0.65 1.71 0.29 5.00 0.00 -1.26 -1.90 105.19 108.38 1f6m n GLY 14 Ca 0.37 -2.14 0.05 0.00 0.00 0.00 0.00 46.02 44.30 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 0.34 0.24 1.61 0.13 -1.91 -0.69 132.00 131.72 1f6m h PRO 15 Ca -0.14 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.96 1f6m h PRO 15 Cb 0.61 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.67 1f6m h PRO 15 CO 0.19 0.23 -0.12 0.00 -0.23 0.00 0.00 178.00 178.07 1f6m h ALA 16 N 1.83 -0.33 -0.06 -0.56 0.00 -1.88 -2.16 119.26 116.10 1f6m h ALA 16 Ca 0.09 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.84 1f6m h ALA 16 Cb -0.03 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1f6m h ALA 16 CO -0.02 -0.53 0.02 0.78 0.00 0.00 0.00 179.25 179.50 1f6m h GLY 17 N -0.63 0.07 1.79 0.00 0.00 -1.70 -2.06 103.07 100.54 1f6m h GLY 17 Ca -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 1f6m h GLY 17 CO 0.05 0.01 0.01 -0.97 0.00 0.00 0.00 176.54 175.64 1f6m h TYR 18 N 0.05 0.27 -0.11 5.60 0.05 -1.18 -0.92 116.97 120.73 1f6m h TYR 18 Ca 0.03 -0.01 -0.16 0.00 0.05 0.00 0.00 58.73 58.64 1f6m h TYR 18 Cb 0.01 -0.08 0.01 0.00 1.01 0.00 0.00 36.73 37.68 1f6m h TYR 18 CO -0.09 0.28 -0.56 1.15 -1.05 0.00 0.00 178.16 177.88 1f6m h THR 19 N 0.27 1.35 -0.47 -2.88 2.02 -1.24 -1.81 112.91 110.15 1f6m h THR 19 Ca 0.06 -1.86 0.06 0.00 0.77 0.00 0.00 66.41 65.44 1f6m h THR 19 Cb 0.17 2.17 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 1f6m h THR 19 CO 0.00 0.57 0.32 0.00 0.37 0.00 0.00 175.52 176.77 1f6m h ALA 20 N 0.48 1.94 0.19 6.16 0.00 -1.01 -1.84 119.26 125.18 1f6m h ALA 20 Ca -0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1f6m h ALA 20 Cb 1.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1f6m h ALA 20 CO 0.12 -0.03 -0.09 0.00 0.00 0.00 0.00 179.25 179.25 1f6m h ALA 21 N 1.75 -0.25 -0.40 0.00 0.00 -0.80 -1.03 119.26 118.53 1f6m h ALA 21 Ca 0.20 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1f6m h ALA 21 Cb 0.32 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1f6m h ALA 21 CO -0.05 -0.46 0.14 -0.39 0.00 0.00 0.00 179.25 178.49 1f6m h VAL 22 N -0.62 1.16 -0.10 0.00 -1.51 -0.84 0.31 116.25 114.66 1f6m h VAL 22 Ca -0.03 -0.52 -0.03 0.00 -1.23 0.00 0.00 66.70 64.89 1f6m h VAL 22 Cb 0.45 0.71 -0.00 0.00 -2.13 0.00 0.00 31.29 30.32 1f6m h VAL 22 CO 0.04 0.20 -0.07 1.88 -1.23 0.00 0.00 177.57 178.39 1f6m h TYR 23 N 0.57 0.26 -0.50 5.19 -1.99 -1.33 -2.35 116.97 116.82 1f6m h TYR 23 Ca 0.14 -0.07 -0.04 0.00 2.00 0.00 0.00 58.73 60.76 1f6m h TYR 23 Cb 0.14 -0.06 -0.02 0.00 2.00 0.00 0.00 36.73 38.79 1f6m h TYR 23 CO 0.01 0.61 0.16 0.00 -0.00 0.00 0.00 178.16 178.94 1f6m h ALA 24 N 0.62 1.35 -0.35 3.88 0.00 -0.87 -2.66 119.26 121.22 1f6m h ALA 24 Ca 0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1f6m h ALA 24 Cb 0.55 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1f6m h ALA 24 CO 0.02 0.47 0.17 0.00 0.00 0.00 0.00 179.25 179.91 1f6m h ALA 25 N 1.46 0.45 0.00 0.00 0.00 -0.88 -1.54 119.26 118.76 1f6m h ALA 25 Ca 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1f6m h ALA 25 Cb 0.20 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1f6m h ALA 25 CO -0.01 0.01 0.00 0.54 0.00 0.00 0.00 179.25 179.79 1f6m n ARG 26 N -4.74 0.30 -0.55 0.00 1.74 -0.89 -0.76 116.66 111.75 1f6m n ARG 26 Ca -0.01 0.10 0.08 0.00 -0.77 0.00 0.00 57.85 57.25 1f6m n ARG 26 Cb 0.11 -1.50 0.30 0.00 -1.02 0.00 0.00 32.46 30.34 1f6m n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1f6m n ALA 27 N -1.20 3.15 -4.34 7.54 0.00 -0.65 -4.94 120.51 120.07 1f6m n ALA 27 Ca 0.09 -2.02 -0.35 0.00 0.00 0.00 0.00 53.44 51.16 1f6m n ALA 27 Cb 0.10 -0.82 -0.08 0.00 0.00 0.00 0.00 19.45 18.65 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 0.06 -0.65 -0.64 0.00 5.03 0.06 -4.82 115.26 114.30 1f6m n ASN 28 Ca 0.23 -1.21 0.13 0.00 0.87 0.00 0.00 54.58 54.60 1f6m n ASN 28 Cb 0.93 -1.91 0.39 0.00 -1.02 0.00 0.00 39.78 38.16 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 -4.36 1.97 -3.70 3.41 4.77 -0.80 -4.99 117.00 113.29 1f6m n LEU 29 Ca -0.13 -0.72 -0.22 0.00 -0.03 0.00 0.00 56.01 54.91 1f6m n LEU 29 Cb 0.59 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1f6m n LEU 29 CO 0.88 0.36 -0.16 0.00 -1.33 0.00 0.00 177.39 177.14 1f6m n GLN 30 N 0.53 -1.47 -2.85 3.23 3.00 -1.26 -4.35 117.38 114.20 1f6m n GLN 30 Ca 0.17 0.83 -0.34 0.00 -0.01 0.00 0.00 57.00 57.66 1f6m n GLN 30 Cb 0.41 -2.79 -0.07 0.00 0.00 0.00 0.00 30.24 27.80 1f6m n GLN 30 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1f6m s PRO 31 N -4.77 4.29 -0.15 -1.09 0.04 -1.26 -4.53 135.00 127.52 1f6m s PRO 31 Ca 0.02 1.11 0.00 0.00 0.04 0.00 0.00 61.00 62.18 1f6m s PRO 31 Cb -0.01 -2.38 -0.00 0.00 0.04 0.00 0.00 34.50 32.15 1f6m s PRO 31 CO 0.88 0.08 -0.15 0.08 0.04 0.00 0.00 177.00 177.93 1f6m s VAL 32 N -2.00 2.69 -0.05 -0.36 1.01 -0.96 -2.03 120.40 118.68 1f6m s VAL 32 Ca 0.58 -0.76 0.06 0.00 0.00 0.00 0.00 61.98 61.85 1f6m s VAL 32 Cb -0.12 -2.13 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 1f6m s VAL 32 CO 0.16 0.51 -0.22 -0.22 0.00 0.00 0.00 175.10 175.34 1f6m s LEU 33 N 0.80 2.26 -0.25 3.92 0.20 0.36 0.24 118.68 126.21 1f6m s LEU 33 Ca -0.05 -0.42 -0.07 0.00 0.69 0.00 0.00 54.13 54.27 1f6m s LEU 33 Cb -0.15 -1.42 -0.03 0.00 -0.43 0.00 0.00 46.19 44.16 1f6m s LEU 33 CO 0.00 0.28 0.07 -0.63 -0.29 0.00 0.00 176.35 175.78 1f6m s ILE 34 N -0.34 4.31 0.12 6.68 1.01 -0.03 -0.32 121.20 132.62 1f6m s ILE 34 Ca 0.02 -0.18 -0.18 0.00 0.00 0.00 0.00 60.65 60.31 1f6m s ILE 34 Cb -0.12 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.29 1f6m s ILE 34 CO 0.02 0.34 1.73 0.71 0.00 0.00 0.00 174.94 177.73 1f6m h THR 35 N 5.55 1.13 0.00 2.92 1.35 -1.43 0.24 112.91 122.66 1f6m h THR 35 Ca -0.38 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 1f6m h THR 35 Cb 1.17 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 1f6m h THR 35 CO 0.58 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 176.58 1f6m n GLY 36 N -0.96 0.48 0.25 5.82 0.00 0.25 -2.84 105.19 108.19 1f6m n GLY 36 Ca -0.02 -1.86 0.01 0.00 0.00 0.00 0.00 46.02 44.15 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 0.37 -3.49 1.61 -0.00 -1.97 -3.29 114.93 108.17 1f6m h MET 37 Ca 0.00 -0.09 -0.79 0.00 -0.00 0.00 0.00 59.70 58.82 1f6m h MET 37 Cb 0.00 -0.05 -0.26 0.00 -0.00 0.00 0.00 31.60 31.29 1f6m h MET 37 CO 0.00 0.47 0.82 -1.91 -0.00 0.00 0.00 176.91 176.29 1f6m n GLU 38 N -4.27 3.85 -1.74 -0.10 2.13 -1.26 -5.01 120.64 114.24 1f6m n GLU 38 Ca 0.00 -4.33 -0.42 0.00 0.66 0.00 0.00 57.16 53.07 1f6m n GLU 38 Cb 0.27 -2.63 -0.03 0.00 0.27 0.00 0.00 31.44 29.31 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 -1.30 4.14 0.00 5.31 2.20 -1.24 -1.45 119.74 127.40 1f6m s LYS 39 Ca 0.33 2.57 0.00 0.00 -0.36 0.00 0.00 55.97 58.51 1f6m s LYS 39 Cb -0.02 -3.58 0.00 0.00 -1.51 0.00 0.00 37.83 32.71 1f6m s LYS 39 CO 0.00 -0.83 0.00 0.41 -0.36 0.00 0.00 175.35 174.57 1f6m n GLY 40 N 4.20 2.81 4.98 5.54 0.00 -0.80 -4.93 105.19 116.99 1f6m n GLY 40 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.88 -2.09 0.32 -0.02 0.00 -0.53 -4.39 105.19 97.60 1f6m n GLY 41 Ca 0.00 -1.57 0.01 0.00 0.00 0.00 0.00 46.02 44.46 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 0.93 0.00 1.61 4.20 -1.91 -2.21 115.11 117.72 1f6m h GLN 42 Ca 0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1f6m h GLN 42 Cb 0.00 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.57 1f6m h GLN 42 CO 0.00 0.61 0.50 -0.07 -0.67 0.00 0.00 178.83 179.21 1f6m h LEU 43 N 0.96 0.00 -0.04 1.46 4.07 -1.90 0.48 115.31 120.33 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 0.19 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.93 1f6m h LEU 43 CO -0.18 0.00 0.00 0.35 -1.08 0.00 0.00 178.44 177.53 1f6m n THR 44 N -2.62 0.37 -0.01 0.22 -2.24 -0.83 -3.02 114.28 106.15 1f6m n THR 44 Ca -0.01 -0.10 0.10 0.00 -2.27 0.00 0.00 64.05 61.77 1f6m n THR 44 Cb 0.53 -0.61 0.28 0.00 -2.10 0.00 0.00 70.33 68.44 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 -1.89 0.83 -4.30 4.28 -2.24 0.17 -4.73 114.28 106.41 1f6m n THR 45 Ca 0.06 -0.85 -0.13 0.00 -2.27 0.00 0.00 64.05 60.86 1f6m n THR 45 Cb 0.36 0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 69.02 1f6m n THR 45 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1f6m n THR 46 N 1.37 0.00 0.00 4.28 5.66 -1.17 -4.62 114.28 119.81 1f6m n THR 46 Ca 0.21 -0.98 0.00 0.00 -3.05 0.00 0.00 64.05 60.23 1f6m n THR 46 Cb 0.54 0.19 0.00 0.00 -1.55 0.00 0.00 70.33 69.51 1f6m n THR 46 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1f6m n THR 47 N -0.53 0.00 -2.08 1.09 -2.24 -1.26 -4.54 114.28 104.72 1f6m n THR 47 Ca -0.08 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.28 1f6m n THR 47 Cb 0.26 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 1f6m n THR 47 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1f6m s GLU 48 N 1.97 4.30 -0.16 -0.78 2.12 -1.26 -0.84 118.70 124.05 1f6m s GLU 48 Ca 0.00 2.21 -0.03 0.00 0.36 0.00 0.00 54.97 57.52 1f6m s GLU 48 Cb 0.00 -3.16 -0.02 0.00 0.26 0.00 0.00 34.13 31.21 1f6m s GLU 48 CO 0.00 -0.40 -0.07 0.08 -0.54 0.00 0.00 175.26 174.33 1f6m s VAL 49 N 0.33 3.50 -0.49 3.70 1.01 -0.48 -4.82 120.40 123.15 1f6m s VAL 49 Ca 0.61 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 62.16 1f6m s VAL 49 Cb -0.40 -2.53 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 1f6m s VAL 49 CO 0.39 0.49 0.43 -0.62 0.00 0.00 0.00 175.10 175.78 1f6m n GLU 50 N 3.81 3.04 -0.67 2.72 1.02 -1.26 -4.41 120.64 124.88 1f6m n GLU 50 Ca -0.18 -0.35 0.04 0.00 -0.02 0.00 0.00 57.16 56.65 1f6m n GLU 50 Cb 0.52 -0.91 0.20 0.00 -0.02 0.00 0.00 31.44 31.23 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 -0.54 1.89 -4.32 1.62 0.23 -1.26 -4.90 115.26 107.98 1f6m n ASN 51 Ca 0.02 -3.90 -0.46 0.00 -0.53 0.00 0.00 54.58 49.71 1f6m n ASN 51 Cb 0.12 -0.53 -0.04 0.00 -2.08 0.00 0.00 39.78 37.25 1f6m n ASN 51 CO 0.00 0.00 0.00 0.86 -0.93 0.00 0.00 177.26 177.19 1f6m s TRP 52 N -3.26 3.36 -0.48 -2.53 -0.11 -1.26 -4.84 118.94 109.82 1f6m s TRP 52 Ca 0.39 -1.45 -0.43 0.00 1.22 0.00 0.00 56.10 55.83 1f6m s TRP 52 Cb 0.37 -3.83 -0.19 0.00 -1.50 0.00 0.00 33.47 28.33 1f6m s TRP 52 CO -0.06 -1.05 1.83 -0.35 -4.62 0.00 0.00 176.95 172.70 1f6m n PRO 53 N 5.04 0.00 0.00 5.86 -0.04 -1.26 -0.74 135.00 143.85 1f6m n PRO 53 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 1f6m n PRO 53 Cb 0.42 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 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 5.77 2.53 2.87 0.55 0.00 -1.26 -4.99 105.19 110.67 1f6m n GLY 54 Ca 0.43 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.14 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 3.66 0.19 1.61 8.00 0.08 -4.91 116.55 125.18 1f6m n ASP 55 Ca 0.00 -3.25 0.14 0.00 0.71 0.00 0.00 54.79 52.39 1f6m n ASP 55 Cb 0.00 -0.85 0.51 0.00 -0.02 0.00 0.00 41.12 40.77 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 5.31 0.00 -3.97 -0.24 0.13 -1.91 -3.42 132.00 127.91 1f6m h PRO 56 Ca 0.17 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.15 1f6m h PRO 56 Cb 0.74 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 31.68 1f6m h PRO 56 CO 0.81 0.00 -0.65 -0.80 -0.23 0.00 0.00 178.00 177.13 1f6m s ASN 57 N -5.02 0.27 -0.77 1.44 0.01 -1.26 -4.91 114.94 104.69 1f6m s ASN 57 Ca 0.04 -0.60 0.00 0.00 -0.71 0.00 0.00 52.86 51.60 1f6m s ASN 57 Cb 0.09 0.15 0.00 0.00 0.41 0.00 0.00 41.25 41.91 1f6m s ASN 57 CO 0.51 -0.41 0.00 0.47 -1.51 0.00 0.00 177.10 176.15 1f6m n ASP 58 N 1.09 -2.24 -4.83 -1.22 8.00 -1.26 -4.93 116.55 111.16 1f6m n ASP 58 Ca -0.21 0.22 -0.36 0.00 0.71 0.00 0.00 54.79 55.16 1f6m n ASP 58 Cb 0.57 -2.19 -0.06 0.00 -0.02 0.00 0.00 41.12 39.42 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 -3.65 4.33 0.02 0.64 2.96 -1.26 -5.02 118.68 116.70 1f6m s LEU 59 Ca 0.00 1.23 0.03 0.00 -0.22 0.00 0.00 54.13 55.16 1f6m s LEU 59 Cb 0.00 -3.42 -0.01 0.00 0.50 0.00 0.00 46.19 43.26 1f6m s LEU 59 CO 0.00 0.07 -0.08 0.42 -1.32 0.00 0.00 176.35 175.43 1f6m s THR 60 N -1.50 0.64 0.25 3.68 -4.23 -1.26 -1.38 115.64 111.84 1f6m s THR 60 Ca 0.40 -0.70 -0.07 0.00 -1.18 0.00 0.00 61.69 60.15 1f6m s THR 60 Cb -0.16 -0.61 0.29 0.00 1.34 0.00 0.00 72.50 73.36 1f6m s THR 60 CO 0.20 -0.06 1.63 1.23 -0.54 0.00 0.00 174.62 177.08 1f6m h GLY 61 N 5.27 0.85 0.85 3.99 0.00 -1.11 0.40 103.07 113.31 1f6m h GLY 61 Ca -0.33 0.12 0.02 0.00 0.00 0.00 0.00 47.33 47.15 1f6m h GLY 61 CO 0.46 -0.30 0.20 -2.55 0.00 0.00 0.00 176.54 174.35 1f6m h PRO 62 N 0.09 0.40 -0.67 4.80 0.11 -1.79 -1.97 132.00 132.97 1f6m h PRO 62 Ca 0.42 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.44 1f6m h PRO 62 Cb 0.74 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 31.73 1f6m h PRO 62 CO -0.69 0.26 0.14 -0.07 -0.21 0.00 0.00 178.00 177.44 1f6m h LEU 63 N 0.41 1.04 -0.12 2.35 3.38 -1.43 0.04 115.31 120.98 1f6m h LEU 63 Ca 0.16 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1f6m h LEU 63 Cb 0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1f6m h LEU 63 CO -0.10 1.02 0.07 0.25 0.09 0.00 0.00 178.44 179.76 1f6m h LEU 64 N 1.02 0.14 -1.42 1.67 7.12 -0.80 -0.05 115.31 122.99 1f6m h LEU 64 Ca 0.21 -0.07 -0.05 0.00 0.13 0.00 0.00 57.88 58.10 1f6m h LEU 64 Cb 0.40 -0.04 -0.01 0.00 -0.53 0.00 0.00 40.66 40.48 1f6m h LEU 64 CO 0.01 0.17 -0.23 0.24 -0.13 0.00 0.00 178.44 178.50 1f6m h MET 65 N 0.11 0.00 -0.49 1.25 2.86 -1.18 0.15 114.93 117.62 1f6m h MET 65 Ca 0.04 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.63 1f6m h MET 65 Cb 0.05 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.70 1f6m h MET 65 CO -0.01 0.23 0.09 1.49 1.06 0.00 0.00 176.91 179.77 1f6m h GLU 66 N 0.00 0.81 -0.20 1.72 4.22 -0.23 -1.17 114.58 119.73 1f6m h GLU 66 Ca -0.00 -0.21 -0.05 0.00 0.08 0.00 0.00 59.36 59.18 1f6m h GLU 66 Cb 0.60 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1f6m h GLU 66 CO 0.03 0.80 -0.06 0.00 -2.18 0.00 0.00 179.01 177.60 1f6m h ARG 67 N 0.68 0.39 -0.71 1.92 3.08 -0.01 -2.06 114.38 117.68 1f6m h ARG 67 Ca 0.15 -0.15 0.02 0.00 0.07 0.00 0.00 59.98 60.06 1f6m h ARG 67 Cb 0.37 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 1f6m h ARG 67 CO 0.01 0.65 0.46 0.52 -1.07 0.00 0.00 179.97 180.54 1f6m h MET 68 N 0.11 0.90 0.36 0.04 2.86 -0.65 -0.75 114.93 117.80 1f6m h MET 68 Ca 0.05 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1f6m h MET 68 Cb 0.51 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1f6m h MET 68 CO 0.02 0.59 -0.28 1.25 1.06 0.00 0.00 176.91 179.55 1f6m h HIS 69 N 0.93 -0.75 -0.74 -0.22 -0.00 -1.16 0.66 115.15 113.86 1f6m h HIS 69 Ca 0.27 -0.00 0.16 0.00 -0.00 0.00 0.00 60.37 60.80 1f6m h HIS 69 Cb -0.06 0.28 -0.11 0.00 -0.00 0.00 0.00 27.41 27.52 1f6m h HIS 69 CO -0.03 -0.42 0.19 1.49 -0.00 0.00 0.00 177.93 179.16 1f6m h GLU 70 N -0.65 0.27 -0.61 5.26 4.81 -1.08 -0.49 114.58 122.09 1f6m h GLU 70 Ca -0.03 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.15 1f6m h GLU 70 Cb 0.56 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 1f6m h GLU 70 CO -0.01 0.18 0.22 1.25 -0.73 0.00 0.00 179.01 179.93 1f6m h HIS 71 N 0.28 0.91 -0.21 0.92 2.76 -0.54 -1.22 115.15 118.05 1f6m h HIS 71 Ca 0.42 -0.06 -0.15 0.00 -2.20 0.00 0.00 60.37 58.38 1f6m h HIS 71 Cb 0.72 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 29.40 1f6m h HIS 71 CO -0.26 0.71 -0.51 0.00 -1.30 0.00 0.00 177.93 176.58 1f6m h ALA 72 N 1.37 0.72 0.00 5.26 0.00 0.73 -3.09 119.26 124.24 1f6m h ALA 72 Ca 0.21 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1f6m h ALA 72 Cb 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1f6m h ALA 72 CO -0.02 0.68 -0.07 1.79 0.00 0.00 0.00 179.25 181.64 1f6m h THR 73 N 0.46 0.00 -0.79 0.00 1.35 -1.13 -2.53 112.91 110.26 1f6m h THR 73 Ca 0.02 -0.91 0.05 0.00 -0.55 0.00 0.00 66.41 65.02 1f6m h THR 73 Cb 1.04 1.87 -0.06 0.00 -1.73 0.00 0.00 68.15 69.28 1f6m h THR 73 CO 0.10 0.00 0.49 0.50 -0.25 0.00 0.00 175.52 176.36 1f6m h LYS 74 N 0.00 0.89 -1.22 4.72 3.64 -1.13 -0.44 116.57 123.02 1f6m h LYS 74 Ca 0.00 -0.05 -0.48 0.00 -1.27 0.00 0.00 60.65 58.85 1f6m h LYS 74 Cb 0.95 -0.20 -0.21 0.00 -0.41 0.00 0.00 32.23 32.36 1f6m h LYS 74 CO 0.00 0.59 0.61 1.19 -2.27 0.00 0.00 179.45 179.57 1f6m n PHE 75 N -4.65 2.34 -3.32 1.91 3.72 -1.23 -4.89 117.46 111.35 1f6m n PHE 75 Ca 0.10 -2.31 -0.22 0.00 -0.05 0.00 0.00 57.45 54.97 1f6m n PHE 75 Cb 0.15 -1.12 -0.01 0.00 -0.94 0.00 0.00 39.48 37.56 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 -0.35 -3.27 -2.03 -1.08 1.02 -0.18 -4.79 120.64 109.96 1f6m n GLU 76 Ca 0.46 0.46 -0.37 0.00 -0.02 0.00 0.00 57.16 57.69 1f6m n GLU 76 Cb 0.75 -5.16 0.02 0.00 -0.02 0.00 0.00 31.44 27.03 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 -2.90 2.63 -0.52 2.62 2.01 -0.95 -4.85 115.64 113.68 1f6m s THR 77 Ca 0.38 0.45 -0.16 0.00 0.31 0.00 0.00 61.69 62.66 1f6m s THR 77 Cb -0.20 -3.22 0.10 0.00 0.01 0.00 0.00 72.50 69.20 1f6m s THR 77 CO 0.46 -0.03 0.50 -0.70 -0.69 0.00 0.00 174.62 174.17 1f6m s GLU 78 N -2.95 3.00 -0.29 4.92 2.12 -0.86 -4.65 118.70 119.99 1f6m s GLU 78 Ca 0.70 -1.50 -0.18 0.00 0.36 0.00 0.00 54.97 54.35 1f6m s GLU 78 Cb -0.33 -4.23 -0.02 0.00 0.26 0.00 0.00 34.13 29.81 1f6m s GLU 78 CO 0.39 -1.26 0.54 0.42 -0.54 0.00 0.00 175.26 174.81 1f6m s ILE 79 N 1.82 5.02 -0.17 -3.70 1.09 -1.26 -0.48 121.20 123.52 1f6m s ILE 79 Ca 0.05 0.73 -0.03 0.00 -1.10 0.00 0.00 60.65 60.31 1f6m s ILE 79 Cb -0.27 -3.90 -0.02 0.00 -1.06 0.00 0.00 42.46 37.21 1f6m s ILE 79 CO 0.05 -0.04 -0.07 -0.63 -0.10 0.00 0.00 174.94 174.15 1f6m s ILE 80 N 2.40 3.42 -0.57 2.92 1.01 0.56 -4.98 121.20 125.97 1f6m s ILE 80 Ca 0.21 -0.51 -0.28 0.00 0.00 0.00 0.00 60.65 60.07 1f6m s ILE 80 Cb -0.15 -2.50 0.03 0.00 0.01 0.00 0.00 42.46 39.84 1f6m s ILE 80 CO 0.11 0.48 1.24 0.12 0.00 0.00 0.00 174.94 176.89 1f6m s PHE 81 N 0.77 2.54 0.07 3.97 5.36 -1.26 -1.53 117.98 127.89 1f6m s PHE 81 Ca -0.03 0.44 -0.27 0.00 -0.96 0.00 0.00 56.93 56.11 1f6m s PHE 81 Cb -0.15 -4.49 0.09 0.00 -0.34 0.00 0.00 43.02 38.13 1f6m s PHE 81 CO 0.02 -1.68 0.86 0.34 -1.46 0.00 0.00 175.22 173.30 1f6m s ASP 82 N 3.28 -0.34 0.23 6.13 -1.08 -1.26 -4.96 116.67 118.67 1f6m s ASP 82 Ca 0.45 -0.12 0.11 0.00 -0.52 0.00 0.00 52.55 52.47 1f6m s ASP 82 Cb -0.08 0.45 -0.05 0.00 -1.46 0.00 0.00 42.92 41.78 1f6m s ASP 82 CO 0.26 -0.77 -0.14 -2.28 0.52 0.00 0.00 175.17 172.76 1f6m s HIS 83 N -3.28 2.46 -0.12 -5.34 5.65 -1.26 -0.58 115.29 112.82 1f6m s HIS 83 Ca 0.06 -0.29 0.03 0.00 0.25 0.00 0.00 55.06 55.11 1f6m s HIS 83 Cb -0.01 -1.14 0.00 0.00 -1.18 0.00 0.00 32.58 30.24 1f6m s HIS 83 CO -0.06 0.59 -0.21 0.42 -0.65 0.00 0.00 174.74 174.83 1f6m s ILE 84 N -2.05 2.23 -0.03 0.89 -1.09 -1.26 -3.66 121.20 116.23 1f6m s ILE 84 Ca 0.27 -0.94 0.04 0.00 -2.23 0.00 0.00 60.65 57.78 1f6m s ILE 84 Cb -0.07 -1.88 0.06 0.00 -1.58 0.00 0.00 42.46 38.98 1f6m s ILE 84 CO 0.15 0.55 0.99 -0.46 -1.23 0.00 0.00 174.94 174.93 1f6m n ASN 85 N 3.78 1.85 -3.64 3.58 0.23 -0.53 -4.95 115.26 115.57 1f6m n ASN 85 Ca -0.19 -2.13 -0.05 0.00 -0.53 0.00 0.00 54.58 51.67 1f6m n ASN 85 Cb 0.52 -0.09 -0.07 0.00 -2.08 0.00 0.00 39.78 38.06 1f6m n ASN 85 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1f6m s LYS 86 N -1.27 0.27 -0.05 -3.83 2.36 -1.24 -4.91 119.74 111.08 1f6m s LYS 86 Ca 0.06 0.34 -0.12 0.00 -2.55 0.00 0.00 55.97 53.71 1f6m s LYS 86 Cb 0.06 0.13 0.02 0.00 -1.05 0.00 0.00 37.83 36.98 1f6m s LYS 86 CO 0.01 -0.03 0.27 0.14 1.55 0.00 0.00 175.35 177.28 1f6m s VAL 87 N 0.24 0.04 -0.33 4.02 -7.23 -1.26 -0.86 120.40 115.03 1f6m s VAL 87 Ca 0.04 -0.34 0.01 0.00 -1.81 0.00 0.00 61.98 59.87 1f6m s VAL 87 Cb -0.05 -0.50 0.08 0.00 0.56 0.00 0.00 36.38 36.47 1f6m s VAL 87 CO -0.11 -0.19 0.04 -0.62 -0.31 0.00 0.00 175.10 173.91 1f6m s ASP 88 N -0.80 4.84 0.00 4.85 2.15 0.12 -4.94 116.67 122.89 1f6m s ASP 88 Ca -0.09 -1.76 0.23 0.00 0.43 0.00 0.00 52.55 51.37 1f6m s ASP 88 Cb -0.05 -1.68 0.47 0.00 -0.30 0.00 0.00 42.92 41.37 1f6m s ASP 88 CO 0.02 -0.35 1.42 0.18 -0.17 0.00 0.00 175.17 176.27 1f6m n LEU 89 N 4.46 2.90 0.11 -1.34 4.32 -1.26 -2.13 117.00 124.05 1f6m n LEU 89 Ca -0.05 -1.16 0.13 0.00 -0.02 0.00 0.00 56.01 54.90 1f6m n LEU 89 Cb 0.42 -0.15 0.35 0.00 -1.62 0.00 0.00 43.42 42.43 1f6m n LEU 89 CO 0.25 0.58 0.80 1.56 -1.22 0.00 0.00 177.39 179.36 1f6m h GLN 90 N 3.98 0.00 -4.73 3.23 1.08 -1.92 -3.46 115.11 113.30 1f6m h GLN 90 Ca 0.00 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 56.85 1f6m h GLN 90 Cb 0.87 0.00 -0.25 0.00 -0.05 0.00 0.00 27.48 28.04 1f6m h GLN 90 CO 0.00 0.00 -0.76 -0.80 -0.95 0.00 0.00 178.83 176.32 1f6m s ASN 91 N -4.60 1.04 -0.12 1.46 0.01 -1.26 -5.14 114.94 106.33 1f6m s ASN 91 Ca 0.10 -0.34 -0.05 0.00 -0.71 0.00 0.00 52.86 51.86 1f6m s ASN 91 Cb 0.12 -0.05 -0.04 0.00 0.41 0.00 0.00 41.25 41.69 1f6m s ASN 91 CO 0.62 -0.02 0.06 -0.13 -1.51 0.00 0.00 177.10 176.12 1f6m s ARG 92 N -0.86 3.35 0.99 -0.60 3.00 -1.26 -3.32 118.95 120.24 1f6m s ARG 92 Ca -0.02 -0.31 -0.12 0.00 0.00 0.00 0.00 55.73 55.28 1f6m s ARG 92 Cb -0.06 -3.00 0.18 0.00 0.00 0.00 0.00 34.95 32.07 1f6m s ARG 92 CO 0.00 0.63 1.08 -1.25 0.00 0.00 0.00 175.30 175.76 1f6m s PRO 93 N -0.64 0.48 0.46 3.54 0.04 -1.26 -5.12 135.00 132.51 1f6m s PRO 93 Ca 0.11 0.71 -0.21 0.00 0.04 0.00 0.00 61.00 61.65 1f6m s PRO 93 Cb -0.12 -1.73 -0.09 0.00 0.04 0.00 0.00 34.50 32.61 1f6m s PRO 93 CO 0.02 -2.74 1.04 -0.06 0.04 0.00 0.00 177.00 175.30 1f6m s PHE 94 N -2.86 3.07 -0.21 0.56 0.08 -0.90 -4.85 117.98 112.88 1f6m s PHE 94 Ca 0.65 1.59 -0.03 0.00 0.12 0.00 0.00 56.93 59.27 1f6m s PHE 94 Cb -0.20 -3.09 -0.01 0.00 -0.57 0.00 0.00 43.02 39.16 1f6m s PHE 94 CO 0.59 -0.78 -0.06 1.03 -0.10 0.00 0.00 175.22 175.89 1f6m s ARG 95 N -3.02 3.35 -0.05 0.44 1.81 -0.91 -3.25 118.95 117.32 1f6m s ARG 95 Ca 0.65 -0.64 0.02 0.00 -1.72 0.00 0.00 55.73 54.03 1f6m s ARG 95 Cb -0.18 -2.94 0.02 0.00 -0.45 0.00 0.00 34.95 31.40 1f6m s ARG 95 CO 0.22 -0.15 -0.08 -0.51 -0.68 0.00 0.00 175.30 174.10 1f6m s LEU 96 N 1.34 1.48 -0.09 2.53 1.02 -0.35 0.12 118.68 124.73 1f6m s LEU 96 Ca 0.04 -0.20 0.01 0.00 0.02 0.00 0.00 54.13 54.00 1f6m s LEU 96 Cb -0.14 -0.60 -0.02 0.00 0.02 0.00 0.00 46.19 45.44 1f6m s LEU 96 CO -0.03 -0.01 -0.11 0.20 0.02 0.00 0.00 176.35 176.41 1f6m s ASN 97 N 0.78 4.23 0.00 2.29 -0.87 -0.04 0.10 114.94 121.42 1f6m s ASN 97 Ca -0.13 -0.20 0.00 0.00 -1.57 0.00 0.00 52.86 50.97 1f6m s ASN 97 Cb -0.15 -1.26 0.00 0.00 -0.02 0.00 0.00 41.25 39.82 1f6m s ASN 97 CO 0.02 0.27 0.00 0.61 -2.57 0.00 0.00 177.10 175.43 1f6m n GLY 98 N 2.82 4.14 0.21 0.66 0.00 -0.56 -1.46 105.19 111.00 1f6m n GLY 98 Ca -0.18 -1.96 0.02 0.00 0.00 0.00 0.00 46.02 43.90 1f6m n GLY 98 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f6m n ASP 99 N -1.89 0.60 0.00 1.61 8.00 -1.24 -3.62 116.55 120.00 1f6m n ASP 99 Ca 0.00 -2.01 0.00 0.00 0.71 0.00 0.00 54.79 53.49 1f6m n ASP 99 Cb 0.00 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 1f6m n ASP 99 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1f6m n ASN 100 N -0.19 0.00 0.00 -2.24 3.02 -1.26 -5.07 115.26 109.52 1f6m n ASN 100 Ca 0.03 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 1f6m n ASN 100 Cb 0.10 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 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 0.00 -0.45 3.90 7.41 0.00 -1.24 -4.96 105.19 109.86 1f6m n GLY 101 Ca 0.00 -1.71 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.45 3.45 -0.00 1.61 2.12 -1.11 -1.49 118.70 121.83 1f6m s GLU 102 Ca 0.00 -0.30 0.05 0.00 0.36 0.00 0.00 54.97 55.07 1f6m s GLU 102 Cb 0.00 -3.10 -0.01 0.00 0.26 0.00 0.00 34.13 31.28 1f6m s GLU 102 CO 0.00 0.67 -0.15 0.71 -0.54 0.00 0.00 175.26 175.95 1f6m s TYR 103 N -1.32 1.36 -0.00 5.30 2.02 0.11 -0.36 117.35 124.46 1f6m s TYR 103 Ca 0.27 -0.27 0.03 0.00 -0.37 0.00 0.00 57.07 56.73 1f6m s TYR 103 Cb -0.13 -0.86 -0.01 0.00 -0.40 0.00 0.00 41.96 40.56 1f6m s TYR 103 CO 0.18 -0.01 -0.10 0.95 -1.57 0.00 0.00 175.55 175.00 1f6m s THR 104 N -0.44 0.80 0.00 -0.71 -4.23 0.16 -1.21 115.64 110.01 1f6m s THR 104 Ca 0.05 -0.47 -0.12 0.00 -1.18 0.00 0.00 61.69 59.98 1f6m s THR 104 Cb -0.06 -0.68 0.01 0.00 1.34 0.00 0.00 72.50 73.12 1f6m s THR 104 CO -0.00 0.20 0.24 0.00 -0.54 0.00 0.00 174.62 174.52 1f6m h ASP 106 N 3.86 0.00 -4.85 0.00 3.32 -0.65 -2.38 116.42 115.73 1f6m h ASP 106 Ca -0.31 -0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.60 1f6m h ASP 106 Cb 1.19 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.53 1f6m h ASP 106 CO 0.42 0.00 -0.44 0.00 -1.72 0.00 0.00 179.24 177.50 1f6m s ALA 107 N -3.24 -0.44 -0.05 3.45 0.00 -0.19 -4.91 121.76 116.37 1f6m s ALA 107 Ca 0.05 0.04 0.01 0.00 0.00 0.00 0.00 51.96 52.06 1f6m s ALA 107 Cb 0.07 0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.27 1f6m s ALA 107 CO 0.70 -0.21 -0.05 -1.17 0.00 0.00 0.00 175.76 175.03 1f6m s LEU 108 N -1.21 1.24 -0.32 0.00 2.96 -0.21 -2.44 118.68 118.70 1f6m s LEU 108 Ca -0.13 -0.14 -0.07 0.00 -0.22 0.00 0.00 54.13 53.56 1f6m s LEU 108 Cb -0.06 -0.49 0.02 0.00 0.50 0.00 0.00 46.19 46.15 1f6m s LEU 108 CO 0.02 -0.07 0.11 -0.63 -1.32 0.00 0.00 176.35 174.46 1f6m s ILE 109 N 1.08 4.02 -0.33 6.68 1.01 -0.59 -0.46 121.20 132.61 1f6m s ILE 109 Ca -0.08 -0.85 -0.22 0.00 0.00 0.00 0.00 60.65 59.50 1f6m s ILE 109 Cb -0.14 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.17 1f6m s ILE 109 CO -0.01 -0.05 0.70 -0.63 0.00 0.00 0.00 174.94 174.95 1f6m s ILE 110 N 1.48 4.85 -0.36 2.92 1.01 0.21 -1.02 121.20 130.29 1f6m s ILE 110 Ca 0.01 0.84 0.14 0.00 0.00 0.00 0.00 60.65 61.65 1f6m s ILE 110 Cb -0.18 -4.10 0.44 0.00 0.01 0.00 0.00 42.46 38.63 1f6m s ILE 110 CO 0.03 -0.28 0.98 0.00 0.00 0.00 0.00 174.94 175.67 1f6m n ALA 111 N 6.12 3.78 1.61 9.38 0.00 0.72 -1.59 120.51 140.53 1f6m n ALA 111 Ca 0.01 -3.48 0.14 0.00 0.00 0.00 0.00 53.44 50.11 1f6m n ALA 111 Cb 0.48 -0.84 0.79 0.00 0.00 0.00 0.00 19.45 19.89 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 -0.15 0.04 -3.06 0.00 -2.24 -1.13 -4.19 114.28 103.55 1f6m n THR 112 Ca 0.18 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.97 1f6m n THR 112 Cb 0.76 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 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 0.86 1.75 3.17 3.38 0.00 -1.26 -4.49 105.19 108.60 1f6m n GLY 113 Ca 0.18 -0.44 -0.09 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.61 0.58 0.19 4.61 0.00 -1.26 -0.56 121.76 123.71 1f6m s ALA 114 Ca 0.00 -1.27 0.08 0.00 0.00 0.00 0.00 51.96 50.77 1f6m s ALA 114 Cb 0.00 0.71 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 1f6m s ALA 114 CO 0.00 -0.49 -0.04 -1.12 0.00 0.00 0.00 175.76 174.11 1f6m s SER 115 N -3.00 4.50 0.31 0.00 0.01 0.73 -4.85 113.70 111.41 1f6m s SER 115 Ca 0.18 -0.51 -0.30 0.00 1.31 0.00 0.00 55.95 56.63 1f6m s SER 115 Cb 0.07 -0.86 -0.12 0.00 0.21 0.00 0.00 66.02 65.33 1f6m s SER 115 CO -0.02 0.08 1.57 0.00 0.41 0.00 0.00 173.24 175.28 1f6m n ALA 116 N -0.15 2.48 -1.17 1.44 0.00 -1.26 -0.39 120.51 121.46 1f6m n ALA 116 Ca -0.10 0.37 -0.15 0.00 0.00 0.00 0.00 53.44 53.56 1f6m n ALA 116 Cb 0.56 -2.45 0.18 0.00 0.00 0.00 0.00 19.45 17.74 1f6m n ALA 116 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1f6m n ARG 117 N 1.75 -2.28 -3.88 0.00 0.63 0.59 -4.73 116.66 108.73 1f6m n ARG 117 Ca 0.07 -1.34 -0.09 0.00 -0.92 0.00 0.00 57.85 55.57 1f6m n ARG 117 Cb 0.37 -1.17 -0.07 0.00 0.45 0.00 0.00 32.46 32.04 1f6m n ARG 117 CO 0.00 0.00 0.00 1.52 -2.51 0.00 0.00 177.63 176.64 1f6m s TYR 118 N -2.60 0.23 -0.11 -0.14 -0.85 -1.26 -4.87 117.35 107.75 1f6m s TYR 118 Ca 0.53 -0.62 0.16 0.00 -0.52 0.00 0.00 57.07 56.62 1f6m s TYR 118 Cb -0.04 -0.03 -0.19 0.00 0.38 0.00 0.00 41.96 42.07 1f6m s TYR 118 CO 0.40 -0.63 0.63 1.28 -1.52 0.00 0.00 175.55 175.71 1f6m n LEU 119 N -0.14 0.65 -0.63 -3.49 4.77 -1.26 -4.99 117.00 111.91 1f6m n LEU 119 Ca -0.12 0.30 -0.03 0.00 -0.03 0.00 0.00 56.01 56.13 1f6m n LEU 119 Cb 0.63 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.89 1f6m n LEU 119 CO 0.23 0.26 -0.00 0.61 -1.33 0.00 0.00 177.39 177.15 1f6m n GLY 120 N 1.49 0.49 3.67 -0.72 0.00 -1.26 -5.05 105.19 103.81 1f6m n GLY 120 Ca -0.15 -0.66 -0.35 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.36 3.60 0.37 0.99 1.02 -1.26 -5.01 118.68 117.03 1f6m s LEU 121 Ca 0.04 0.13 0.06 0.00 0.02 0.00 0.00 54.13 54.38 1f6m s LEU 121 Cb -0.02 -1.84 0.73 0.00 0.02 0.00 0.00 46.19 45.08 1f6m s LEU 121 CO 0.05 0.34 1.94 1.55 0.02 0.00 0.00 176.35 180.25 1f6m h PRO 122 N 5.42 0.46 -0.18 1.29 0.13 -1.97 -1.45 132.00 135.71 1f6m h PRO 122 Ca -0.48 -0.08 -0.08 0.00 -0.87 0.00 0.00 66.00 64.49 1f6m h PRO 122 Cb 1.19 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 1f6m h PRO 122 CO 0.57 0.45 -0.26 0.66 -0.23 0.00 0.00 178.00 179.19 1f6m h SER 123 N 0.45 0.33 -0.24 1.44 4.64 -1.95 0.80 113.55 119.02 1f6m h SER 123 Ca 0.11 -0.10 -0.14 0.00 -0.47 0.00 0.00 61.79 61.19 1f6m h SER 123 Cb 0.22 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 1f6m h SER 123 CO 0.00 0.59 -0.33 -0.08 -0.87 0.00 0.00 176.83 176.14 1f6m h GLU 124 N 0.29 0.76 0.01 4.77 4.81 -1.67 -2.50 114.58 121.06 1f6m h GLU 124 Ca 0.04 -0.36 -0.24 0.00 -0.13 0.00 0.00 59.36 58.67 1f6m h GLU 124 Cb 0.62 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.96 1f6m h GLU 124 CO 0.04 0.99 -1.24 1.49 -0.73 0.00 0.00 179.01 179.56 1f6m h GLU 125 N 0.64 0.03 0.00 1.92 4.22 -0.83 -3.28 114.58 117.28 1f6m h GLU 125 Ca 0.07 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 59.46 1f6m h GLU 125 Cb 0.87 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1f6m h GLU 125 CO 0.08 0.88 0.00 0.00 -2.18 0.00 0.00 179.01 177.78 1f6m h ALA 126 N 0.95 1.00 -0.09 2.92 0.00 0.71 -3.26 119.26 121.50 1f6m h ALA 126 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1f6m h ALA 126 Cb 1.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.65 1f6m h ALA 126 CO 0.12 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.56 1f6m n PHE 127 N -2.81 0.10 -1.60 0.00 3.72 -0.95 -4.99 117.46 110.94 1f6m n PHE 127 Ca 0.02 -0.12 -0.43 0.00 -0.05 0.00 0.00 57.45 56.86 1f6m n PHE 127 Cb 0.32 -0.01 -0.01 0.00 -0.94 0.00 0.00 39.48 38.84 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 0.53 1.38 -0.06 -1.08 5.02 -1.23 -0.65 118.16 122.07 1f6m n LYS 128 Ca 0.07 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 1f6m n LYS 128 Cb 0.29 -1.92 0.00 0.00 -0.02 0.00 0.00 35.03 33.38 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 1.20 1.69 0.11 0.72 0.00 -1.10 -4.66 105.19 103.14 1f6m n GLY 129 Ca 0.09 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.00 1.47 0.00 1.61 1.74 0.17 -4.93 116.66 114.72 1f6m n ARG 130 Ca 0.00 -1.71 0.00 0.00 -0.77 0.00 0.00 57.85 55.37 1f6m n ARG 130 Cb 0.00 -1.05 0.00 0.00 -1.02 0.00 0.00 32.46 30.39 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 -0.72 0.78 3.51 -0.13 0.00 -0.86 -1.75 105.19 106.03 1f6m n GLY 131 Ca 0.06 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 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 4.97 0.33 1.61 1.01 -1.04 -0.19 120.40 127.10 1f6m s VAL 132 Ca 0.00 -0.13 0.10 0.00 0.00 0.00 0.00 61.98 61.95 1f6m s VAL 132 Cb 0.00 -3.45 -0.06 0.00 0.00 0.00 0.00 36.38 32.87 1f6m s VAL 132 CO 0.00 0.15 -0.11 -0.55 0.00 0.00 0.00 175.10 174.59 1f6m s SER 133 N 1.69 3.74 -0.01 3.32 0.15 0.27 -2.73 113.70 120.14 1f6m s SER 133 Ca 0.06 -1.15 0.05 0.00 0.70 0.00 0.00 55.95 55.61 1f6m s SER 133 Cb -0.16 -0.36 -0.07 0.00 -1.71 0.00 0.00 66.02 63.72 1f6m s SER 133 CO 0.09 -0.16 0.13 0.00 1.20 0.00 0.00 173.24 174.49 1f6m n ALA 134 N -0.77 2.29 -3.78 5.45 0.00 -1.26 -3.08 120.51 119.35 1f6m n ALA 134 Ca -0.05 -0.12 -0.23 0.00 0.00 0.00 0.00 53.44 53.04 1f6m n ALA 134 Cb 0.63 -0.17 -0.17 0.00 0.00 0.00 0.00 19.45 19.73 1f6m n ALA 134 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1f6m s SER 135 N -2.30 1.64 0.26 0.00 1.04 -1.26 -4.90 113.70 108.18 1f6m s SER 135 Ca -0.01 -0.11 0.09 0.00 0.48 0.00 0.00 55.95 56.40 1f6m s SER 135 Cb 0.03 -0.48 0.33 0.00 0.10 0.00 0.00 66.02 66.00 1f6m s SER 135 CO 0.20 -0.18 1.60 0.00 0.98 0.00 0.00 173.24 175.83 1f6m h ALA 136 N 8.30 0.94 -0.58 5.32 0.00 -1.93 -2.11 119.26 129.20 1f6m h ALA 136 Ca -0.21 -0.56 0.11 0.00 0.00 0.00 0.00 54.91 54.25 1f6m h ALA 136 Cb 1.13 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 1f6m h ALA 136 CO 0.28 0.76 0.39 1.15 0.00 0.00 0.00 179.25 181.83 1f6m h THR 137 N 0.05 0.86 0.00 0.00 2.02 -1.94 0.60 112.91 114.51 1f6m h THR 137 Ca -0.01 -0.11 -0.12 0.00 0.77 0.00 0.00 66.41 66.94 1f6m h THR 137 Cb 1.10 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 1f6m h THR 137 CO 0.08 0.06 -1.07 0.00 0.37 0.00 0.00 175.52 174.96 1f6m h ASP 139 N -1.00 0.00 -0.86 0.00 3.32 -1.41 -3.40 116.42 113.07 1f6m h ASP 139 Ca -0.18 -0.10 0.31 0.00 0.02 0.00 0.00 57.03 57.08 1f6m h ASP 139 Cb 0.95 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.35 1f6m h ASP 139 CO -0.11 0.05 0.27 0.61 -1.72 0.00 0.00 179.24 178.34 1f6m n GLY 140 N 1.24 -0.88 0.08 2.75 0.00 0.21 0.55 105.19 109.14 1f6m n GLY 140 Ca 0.01 0.76 0.09 0.00 0.00 0.00 0.00 46.02 46.89 1f6m n GLY 140 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1f6m n PHE 141 N -5.08 0.45 1.99 1.61 -0.00 -1.26 -1.81 117.46 113.36 1f6m n PHE 141 Ca 0.27 0.18 0.13 0.00 -0.00 0.00 0.00 57.45 58.04 1f6m n PHE 141 Cb 0.91 -0.80 0.76 0.00 -0.00 0.00 0.00 39.48 40.36 1f6m n PHE 141 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 1f6m n PHE 142 N -1.92 0.00 -0.37 2.97 3.72 0.19 -3.49 117.46 118.56 1f6m n PHE 142 Ca 0.02 -0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1f6m n PHE 142 Cb 0.18 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 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 -0.89 0.00 -1.56 1.38 4.01 -0.75 -5.05 117.16 114.30 1f6m n TYR 143 Ca 0.19 -0.35 -0.52 0.00 -0.16 0.00 0.00 57.90 57.07 1f6m n TYR 143 Cb 0.09 -0.04 -0.05 0.00 -0.31 0.00 0.00 39.34 39.03 1f6m n TYR 143 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1f6m n ARG 144 N -0.36 0.91 -2.89 -0.72 0.63 -1.23 -0.91 116.66 112.08 1f6m n ARG 144 Ca 0.00 0.32 -0.22 0.00 -0.92 0.00 0.00 57.85 57.04 1f6m n ARG 144 Cb 0.34 -1.86 0.02 0.00 0.45 0.00 0.00 32.46 31.42 1f6m n ARG 144 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1f6m n ASN 145 N 2.13 -5.68 -4.23 6.15 3.02 0.15 -4.82 115.26 111.99 1f6m n ASN 145 Ca 0.17 -0.21 -0.13 0.00 -0.03 0.00 0.00 54.58 54.38 1f6m n ASN 145 Cb 0.20 -4.64 -0.10 0.00 -0.61 0.00 0.00 39.78 34.63 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 -5.56 1.03 0.18 3.52 -0.21 -0.09 -4.31 119.66 114.23 1f6m s GLN 146 Ca 0.23 -1.47 -0.30 0.00 0.02 0.00 0.00 55.36 53.85 1f6m s GLN 146 Cb -0.11 -0.34 -0.08 0.00 1.00 0.00 0.00 33.01 33.49 1f6m s GLN 146 CO 0.29 -0.05 1.12 0.15 -2.12 0.00 0.00 175.29 174.68 1f6m s LYS 147 N -3.85 4.57 0.04 2.91 1.02 -1.26 -0.72 119.74 122.44 1f6m s LYS 147 Ca 0.19 1.76 -0.00 0.00 0.02 0.00 0.00 55.97 57.94 1f6m s LYS 147 Cb 0.05 -3.26 -0.03 0.00 -0.52 0.00 0.00 37.83 34.07 1f6m s LYS 147 CO 0.01 0.04 -0.03 0.54 -0.92 0.00 0.00 175.35 174.99 1f6m s VAL 148 N -0.24 0.21 0.00 3.17 0.11 -0.42 -0.89 120.40 122.34 1f6m s VAL 148 Ca 0.50 -1.37 0.05 0.00 -2.93 0.00 0.00 61.98 58.22 1f6m s VAL 148 Cb -0.30 -0.91 -0.01 0.00 -1.53 0.00 0.00 36.38 33.62 1f6m s VAL 148 CO 0.36 -0.74 -0.14 0.00 -3.33 0.00 0.00 175.10 171.25 1f6m s ALA 149 N -2.67 1.18 0.07 1.54 0.00 0.23 -0.71 121.76 121.40 1f6m s ALA 149 Ca -0.04 -0.68 0.09 0.00 0.00 0.00 0.00 51.96 51.33 1f6m s ALA 149 Cb -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.81 1f6m s ALA 149 CO -0.05 0.27 -0.23 0.08 0.00 0.00 0.00 175.76 175.83 1f6m s VAL 150 N -0.49 1.89 -0.14 0.00 1.01 0.13 -0.39 120.40 122.41 1f6m s VAL 150 Ca 0.04 -1.39 -0.03 0.00 0.00 0.00 0.00 61.98 60.61 1f6m s VAL 150 Cb -0.06 -1.65 0.05 0.00 0.00 0.00 0.00 36.38 34.72 1f6m s VAL 150 CO 0.00 0.19 0.04 -0.51 0.00 0.00 0.00 175.10 174.81 1f6m s ILE 151 N -0.90 0.32 0.00 2.22 2.07 -0.64 0.39 121.20 124.66 1f6m s ILE 151 Ca 0.09 -0.19 0.00 0.00 -1.41 0.00 0.00 60.65 59.15 1f6m s ILE 151 Cb -0.09 -0.72 0.00 0.00 0.13 0.00 0.00 42.46 41.78 1f6m s ILE 151 CO 0.03 -0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.64 1f6m n GLY 152 N 5.14 1.41 0.00 1.50 0.00 -0.40 -0.94 105.19 111.91 1f6m n GLY 152 Ca -0.08 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.91 -0.92 2.46 -0.02 0.00 -1.26 -4.55 105.19 100.00 1f6m n GLY 153 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.05 1.82 0.30 -0.02 0.00 -1.26 -0.40 105.19 105.58 1f6m n GLY 154 Ca 0.00 -2.17 0.10 0.00 0.00 0.00 0.00 46.02 43.95 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 0.02 0.15 0.66 1.61 2.35 -1.91 -2.03 115.58 116.44 1f6m h ASN 155 Ca -0.17 0.16 -0.03 0.00 -0.55 0.00 0.00 56.30 55.71 1f6m h ASN 155 Cb 0.78 0.18 -0.00 0.00 0.05 0.00 0.00 38.32 39.33 1f6m h ASN 155 CO 0.24 -0.04 -0.39 0.74 -1.65 0.00 0.00 177.43 176.33 1f6m h THR 156 N 0.32 0.21 -0.42 2.81 2.02 -1.94 0.30 112.91 116.20 1f6m h THR 156 Ca 0.50 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.73 1f6m h THR 156 Cb 0.94 0.21 -0.08 0.00 -1.74 0.00 0.00 68.15 67.47 1f6m h THR 156 CO -0.55 0.00 -0.54 0.00 0.37 0.00 0.00 175.52 174.80 1f6m h ALA 157 N -0.72 -0.76 -0.28 6.16 0.00 -1.61 0.21 119.26 122.25 1f6m h ALA 157 Ca -0.08 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.86 1f6m h ALA 157 Cb 0.79 1.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.68 1f6m h ALA 157 CO 0.10 -1.03 0.10 0.28 0.00 0.00 0.00 179.25 178.70 1f6m h VAL 158 N -0.37 0.93 0.00 0.00 2.07 -1.26 -0.93 116.25 116.70 1f6m h VAL 158 Ca 0.07 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1f6m h VAL 158 Cb 0.57 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1f6m h VAL 158 CO -0.59 0.04 -0.06 -0.33 0.02 0.00 0.00 177.57 176.65 1f6m h GLU 159 N 0.24 0.00 -0.14 1.57 5.08 0.16 -0.43 114.58 121.06 1f6m h GLU 159 Ca 0.13 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.30 1f6m h GLU 159 Cb 0.09 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.34 1f6m h GLU 159 CO -0.12 0.06 -0.64 0.93 -1.00 0.00 0.00 179.01 178.24 1f6m h GLU 160 N 0.00 0.68 -0.39 2.33 5.08 0.50 -0.96 114.58 121.82 1f6m h GLU 160 Ca -0.00 -0.54 -0.06 0.00 -1.00 0.00 0.00 59.36 57.76 1f6m h GLU 160 Cb 0.11 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1f6m h GLU 160 CO 0.01 1.16 0.01 0.00 -1.00 0.00 0.00 179.01 179.18 1f6m h ALA 161 N 0.52 0.52 -0.02 3.43 0.00 -0.57 0.77 119.26 123.91 1f6m h ALA 161 Ca -0.04 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.63 1f6m h ALA 161 Cb 1.27 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1f6m h ALA 161 CO 0.13 0.29 -0.04 -0.07 0.00 0.00 0.00 179.25 179.56 1f6m h LEU 162 N 0.51 -0.12 0.45 0.00 -0.00 -1.10 0.40 115.31 115.44 1f6m h LEU 162 Ca 0.11 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 58.00 1f6m h LEU 162 Cb 0.46 0.06 -0.01 0.00 -0.00 0.00 0.00 40.66 41.17 1f6m h LEU 162 CO 0.02 -0.06 -0.29 0.22 -0.00 0.00 0.00 178.44 178.32 1f6m h TYR 163 N -0.06 -0.78 -0.34 1.13 3.20 -1.05 -2.95 116.97 116.11 1f6m h TYR 163 Ca 0.03 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.93 1f6m h TYR 163 Cb 0.10 0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 1f6m h TYR 163 CO -0.13 -0.45 0.23 -0.07 -1.64 0.00 0.00 178.16 176.11 1f6m h LEU 164 N -0.72 0.27 -0.98 2.82 -0.00 -0.72 -2.81 115.31 113.16 1f6m h LEU 164 Ca -0.05 -0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.83 1f6m h LEU 164 Cb 0.60 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 41.20 1f6m h LEU 164 CO 0.04 0.18 0.07 -1.54 -0.00 0.00 0.00 178.44 177.19 1f6m n SER 165 N -4.49 0.38 -1.33 -0.43 3.41 0.12 -0.11 113.62 111.18 1f6m n SER 165 Ca 0.03 0.65 0.11 0.00 -0.26 0.00 0.00 58.87 59.40 1f6m n SER 165 Cb 0.19 -0.68 0.31 0.00 -0.26 0.00 0.00 64.21 63.77 1f6m n SER 165 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1f6m n ASN 166 N -2.02 4.01 0.07 4.04 3.02 -1.06 -4.56 115.26 118.76 1f6m n ASN 166 Ca -0.01 -2.09 0.00 0.00 -0.03 0.00 0.00 54.58 52.45 1f6m n ASN 166 Cb 0.09 -0.48 0.00 0.00 -0.61 0.00 0.00 39.78 38.78 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 1.43 0.69 -1.56 2.41 5.41 0.84 -5.03 119.36 123.55 1f6m n ILE 167 Ca 0.24 0.23 -0.32 0.00 1.00 0.00 0.00 62.75 63.89 1f6m n ILE 167 Cb 0.66 -1.12 0.06 0.00 -0.71 0.00 0.00 39.64 38.53 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 -2.00 2.38 0.26 -1.39 0.00 -0.16 0.34 121.76 121.19 1f6m s ALA 168 Ca 0.00 0.45 0.01 0.00 0.00 0.00 0.00 51.96 52.42 1f6m s ALA 168 Cb 0.00 -3.30 0.35 0.00 0.00 0.00 0.00 23.12 20.17 1f6m s ALA 168 CO 0.00 -1.47 1.69 0.66 0.00 0.00 0.00 175.76 176.64 1f6m h SER 169 N -0.41 0.55 -4.73 0.00 4.64 -1.11 -3.41 113.55 109.06 1f6m h SER 169 Ca -0.46 -0.19 -0.06 0.00 -0.47 0.00 0.00 61.79 60.61 1f6m h SER 169 Cb 1.24 -0.15 -0.20 0.00 -0.31 0.00 0.00 62.40 62.98 1f6m h SER 169 CO 0.53 0.79 0.13 -1.83 -0.87 0.00 0.00 176.83 175.58 1f6m s GLU 170 N -4.50 0.96 -0.13 4.77 -1.05 -1.21 -4.85 118.70 112.69 1f6m s GLU 170 Ca -0.07 0.40 0.00 0.00 -0.15 0.00 0.00 54.97 55.15 1f6m s GLU 170 Cb 0.14 0.45 -0.01 0.00 -0.44 0.00 0.00 34.13 34.27 1f6m s GLU 170 CO 0.80 -0.26 -0.14 0.08 0.95 0.00 0.00 175.26 176.69 1f6m s VAL 171 N -0.80 2.90 -0.36 1.83 1.01 -0.25 -1.30 120.40 123.43 1f6m s VAL 171 Ca -0.08 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.12 1f6m s VAL 171 Cb -0.02 -2.21 0.05 0.00 0.00 0.00 0.00 36.38 34.20 1f6m s VAL 171 CO 0.07 0.53 0.15 -1.00 0.00 0.00 0.00 175.10 174.84 1f6m s HIS 172 N 0.42 3.29 -0.38 5.22 3.76 0.11 0.36 115.29 128.07 1f6m s HIS 172 Ca -0.11 -1.48 -0.22 0.00 -0.15 0.00 0.00 55.06 53.11 1f6m s HIS 172 Cb -0.16 -2.47 0.01 0.00 1.11 0.00 0.00 32.58 31.07 1f6m s HIS 172 CO 0.05 -0.76 0.70 -1.17 -0.85 0.00 0.00 174.74 172.71 1f6m s LEU 173 N 1.40 4.24 -0.18 0.89 0.20 -0.64 0.21 118.68 124.79 1f6m s LEU 173 Ca -0.00 0.13 -0.06 0.00 0.69 0.00 0.00 54.13 54.89 1f6m s LEU 173 Cb -0.20 -2.88 -0.04 0.00 -0.43 0.00 0.00 46.19 42.64 1f6m s LEU 173 CO 0.02 -0.70 0.04 -0.63 -0.29 0.00 0.00 176.35 174.80 1f6m s ILE 174 N 2.92 4.54 -0.02 6.68 1.01 0.16 -0.77 121.20 135.71 1f6m s ILE 174 Ca 0.27 -0.12 -0.18 0.00 0.00 0.00 0.00 60.65 60.61 1f6m s ILE 174 Cb -0.14 -3.04 0.03 0.00 0.01 0.00 0.00 42.46 39.33 1f6m s ILE 174 CO 0.17 0.46 0.39 -2.28 0.00 0.00 0.00 174.94 173.68 1f6m s HIS 175 N 0.46 -0.28 0.01 3.97 2.46 -0.98 -1.28 115.29 119.65 1f6m s HIS 175 Ca 0.01 0.45 -0.26 0.00 0.47 0.00 0.00 55.06 55.74 1f6m s HIS 175 Cb -0.13 0.16 -0.14 0.00 -0.13 0.00 0.00 32.58 32.34 1f6m s HIS 175 CO 0.01 -0.44 1.08 0.00 -2.47 0.00 0.00 174.74 172.92 1f6m h ARG 176 N 3.68 -0.90 0.00 2.88 3.08 -1.85 0.21 114.38 121.48 1f6m h ARG 176 Ca -0.29 0.06 -0.39 0.00 0.07 0.00 0.00 59.98 59.43 1f6m h ARG 176 Cb 1.17 0.20 0.20 0.00 0.08 0.00 0.00 29.97 31.63 1f6m h ARG 176 CO 0.40 -0.60 0.02 0.54 -1.07 0.00 0.00 179.97 179.26 1f6m n ARG 177 N -5.34 -3.72 0.00 0.04 5.12 -1.26 -2.14 116.66 109.36 1f6m n ARG 177 Ca -0.12 -1.66 0.10 0.00 -1.93 0.00 0.00 57.85 54.25 1f6m n ARG 177 Cb 0.37 -1.73 0.02 0.00 -1.16 0.00 0.00 32.46 29.96 1f6m n ARG 177 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1f6m n ASP 178 N -5.19 2.17 -4.29 0.55 4.64 -1.26 -1.75 116.55 111.41 1f6m n ASP 178 Ca 0.15 -1.58 -0.17 0.00 -1.38 0.00 0.00 54.79 51.81 1f6m n ASP 178 Cb 0.59 0.34 -0.10 0.00 -1.04 0.00 0.00 41.12 40.91 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 -2.16 1.22 0.20 0.27 0.00 -1.26 -4.98 107.32 100.61 1f6m s GLY 179 Ca 0.19 -1.53 0.07 0.00 0.00 0.00 0.00 44.72 43.45 1f6m s GLY 179 CO 0.45 -1.62 0.06 -1.36 0.00 0.00 0.00 173.10 170.62 1f6m s PHE 180 N -3.00 2.92 -1.62 1.90 0.08 -1.26 -4.96 117.98 112.05 1f6m s PHE 180 Ca 0.18 -0.12 0.15 0.00 0.12 0.00 0.00 56.93 57.26 1f6m s PHE 180 Cb 0.00 -1.38 0.27 0.00 -0.57 0.00 0.00 43.02 41.34 1f6m s PHE 180 CO 0.03 0.53 1.16 2.89 -0.10 0.00 0.00 175.22 179.74 1f6m n ARG 181 N -0.43 1.95 -1.50 0.44 1.85 0.46 -4.99 116.66 114.44 1f6m n ARG 181 Ca -0.09 -1.82 -0.33 0.00 -1.00 0.00 0.00 57.85 54.61 1f6m n ARG 181 Cb 0.56 -1.33 0.08 0.00 -1.05 0.00 0.00 32.46 30.71 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 -1.15 2.25 0.65 2.89 0.00 -1.14 -4.63 121.76 120.62 1f6m s ALA 182 Ca 0.25 0.61 -0.17 0.00 0.00 0.00 0.00 51.96 52.65 1f6m s ALA 182 Cb 0.15 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.81 1f6m s ALA 182 CO 0.21 -1.65 0.23 0.39 0.00 0.00 0.00 175.76 174.93 1f6m n GLU 183 N -2.82 0.25 0.44 0.00 1.02 -1.26 -4.70 120.64 113.57 1f6m n GLU 183 Ca 0.11 0.11 -0.19 0.00 -0.02 0.00 0.00 57.16 57.17 1f6m n GLU 183 Cb 0.52 -1.49 -0.09 0.00 -0.02 0.00 0.00 31.44 30.35 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 -0.16 -1.05 -1.42 3.49 1.79 -1.98 -2.31 116.57 114.93 1f6m h LYS 184 Ca -0.44 0.07 0.42 0.00 -2.18 0.00 0.00 60.65 58.52 1f6m h LYS 184 Cb 1.39 0.24 -0.09 0.00 -1.58 0.00 0.00 32.23 32.18 1f6m h LYS 184 CO 0.42 -0.70 0.97 0.97 -1.08 0.00 0.00 179.45 180.03 1f6m h ILE 185 N -1.09 0.22 0.12 1.86 6.09 -2.01 0.14 117.51 122.85 1f6m h ILE 185 Ca -0.11 -0.03 -0.21 0.00 -1.37 0.00 0.00 64.86 63.14 1f6m h ILE 185 Cb 0.84 0.13 0.02 0.00 0.47 0.00 0.00 36.82 38.28 1f6m h ILE 185 CO 0.18 0.02 -0.89 -0.07 -3.07 0.00 0.00 178.15 174.32 1f6m h LEU 186 N 0.08 0.57 -2.06 2.19 4.07 -1.83 -3.11 115.31 115.22 1f6m h LEU 186 Ca 0.76 -0.90 0.01 0.00 0.08 0.00 0.00 57.88 57.83 1f6m h LEU 186 Cb 2.66 -0.18 -0.00 0.00 1.08 0.00 0.00 40.66 44.22 1f6m h LEU 186 CO -0.19 1.42 0.02 0.40 -1.08 0.00 0.00 178.44 179.00 1f6m h ILE 187 N -0.19 0.93 0.08 1.22 2.04 -0.20 -0.27 117.51 121.12 1f6m h ILE 187 Ca -0.15 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1f6m h ILE 187 Cb 1.66 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.73 1f6m h ILE 187 CO 0.17 0.00 -0.04 0.50 0.00 0.00 0.00 178.15 178.78 1f6m h LYS 188 N 0.00 -0.10 -0.94 2.37 3.64 -1.38 0.19 116.57 120.36 1f6m h LYS 188 Ca 0.01 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.51 1f6m h LYS 188 Cb 0.05 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 31.82 1f6m h LYS 188 CO -0.00 0.29 0.60 0.00 -2.27 0.00 0.00 179.45 178.07 1f6m h ARG 189 N -0.51 0.88 0.58 1.90 3.08 -1.30 0.17 114.38 119.18 1f6m h ARG 189 Ca -0.01 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1f6m h ARG 189 Cb 0.44 -0.20 0.01 0.00 0.08 0.00 0.00 29.97 30.29 1f6m h ARG 189 CO 0.02 0.59 -0.28 1.25 -1.07 0.00 0.00 179.97 180.47 1f6m h LEU 190 N 0.91 -0.66 -1.47 3.04 5.85 -0.76 -2.62 115.31 119.60 1f6m h LEU 190 Ca 0.45 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 59.15 1f6m h LEU 190 Cb 0.47 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 1f6m h LEU 190 CO -0.21 -0.40 0.28 0.24 -0.34 0.00 0.00 178.44 178.00 1f6m h MET 191 N -0.88 0.63 -0.61 1.25 2.86 0.10 0.11 114.93 118.39 1f6m h MET 191 Ca -0.08 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1f6m h MET 191 Cb 0.63 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.13 1f6m h MET 191 CO 0.13 0.45 0.39 0.22 1.06 0.00 0.00 176.91 179.16 1f6m h ASP 192 N 0.64 0.71 0.71 1.22 3.58 -0.58 -1.59 116.42 121.12 1f6m h ASP 192 Ca 0.17 -0.03 -0.26 0.00 0.42 0.00 0.00 57.03 57.33 1f6m h ASP 192 Cb -0.02 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 40.84 1f6m h ASP 192 CO -0.03 0.53 -1.25 0.11 -2.88 0.00 0.00 179.24 175.72 1f6m h LYS 193 N 0.83 0.16 0.00 0.28 1.57 -0.76 -0.66 116.57 117.99 1f6m h LYS 193 Ca 0.22 -0.27 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1f6m h LYS 193 Cb -0.07 0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 1f6m h LYS 193 CO -0.05 1.08 -0.01 0.28 -0.57 0.00 0.00 179.45 180.19 1f6m h VAL 194 N 0.04 0.07 0.00 0.50 2.07 -0.26 0.21 116.25 118.88 1f6m h VAL 194 Ca -0.12 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1f6m h VAL 194 Cb 1.92 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.81 1f6m h VAL 194 CO 0.16 0.01 0.00 -0.62 0.02 0.00 0.00 177.57 177.14 1f6m n GLU 195 N -3.17 0.00 0.00 1.57 -0.58 -0.65 -4.71 120.64 113.10 1f6m n GLU 195 Ca -0.02 0.12 0.13 0.00 -0.42 0.00 0.00 57.16 56.97 1f6m n GLU 195 Cb 0.13 -0.56 0.40 0.00 -0.57 0.00 0.00 31.44 30.84 1f6m n GLU 195 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1f6m n ASN 196 N -2.14 0.69 0.00 1.62 3.02 -0.26 -4.96 115.26 113.23 1f6m n ASN 196 Ca 0.00 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 54.01 1f6m n ASN 196 Cb 0.00 0.08 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 1f6m n ASN 196 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1f6m n GLY 197 N 1.38 5.99 1.99 7.41 0.00 0.73 -4.99 105.19 117.70 1f6m n GLY 197 Ca 0.10 -1.98 -0.04 0.00 0.00 0.00 0.00 46.02 44.10 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 4.96 -4.78 1.61 6.94 -1.23 -4.73 115.26 118.02 1f6m n ASN 198 Ca 0.00 -3.20 -0.36 0.00 -0.02 0.00 0.00 54.58 51.00 1f6m n ASN 198 Cb 0.00 -0.74 -0.07 0.00 -2.36 0.00 0.00 39.78 36.61 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 -2.98 5.40 -0.14 1.53 1.01 -1.22 -1.09 121.20 123.70 1f6m s ILE 199 Ca 0.55 0.30 0.01 0.00 0.00 0.00 0.00 60.65 61.51 1f6m s ILE 199 Cb 0.44 -3.49 0.02 0.00 0.01 0.00 0.00 42.46 39.43 1f6m s ILE 199 CO 0.14 0.49 -0.18 -0.63 0.00 0.00 0.00 174.94 174.76 1f6m s ILE 200 N -0.09 1.81 0.36 2.92 1.01 0.16 -3.96 121.20 123.40 1f6m s ILE 200 Ca 0.12 -0.80 -0.24 0.00 0.00 0.00 0.00 60.65 59.72 1f6m s ILE 200 Cb -0.12 -1.64 -0.10 0.00 0.01 0.00 0.00 42.46 40.61 1f6m s ILE 200 CO 0.02 0.50 0.96 -0.76 0.00 0.00 0.00 174.94 175.66 1f6m s LEU 201 N 1.13 4.21 -0.37 2.97 1.02 -1.26 -1.63 118.68 124.75 1f6m s LEU 201 Ca -0.01 1.83 0.11 0.00 0.02 0.00 0.00 54.13 56.08 1f6m s LEU 201 Cb -0.14 -4.17 0.34 0.00 0.02 0.00 0.00 46.19 42.23 1f6m s LEU 201 CO -0.07 -0.21 0.70 1.41 0.02 0.00 0.00 176.35 178.21 1f6m n HIS 202 N 0.16 0.12 -1.09 0.29 8.25 0.05 -4.91 115.22 118.10 1f6m n HIS 202 Ca 0.04 -3.78 -0.30 0.00 -0.26 0.00 0.00 57.72 53.41 1f6m n HIS 202 Cb 0.51 -0.41 0.14 0.00 1.12 0.00 0.00 29.99 31.35 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 -2.26 2.72 -1.24 1.59 -4.23 -1.26 -2.32 115.64 108.65 1f6m s THR 203 Ca 0.39 0.23 -0.11 0.00 -1.18 0.00 0.00 61.69 61.03 1f6m s THR 203 Cb 0.32 -2.61 -0.01 0.00 1.34 0.00 0.00 72.50 71.55 1f6m s THR 203 CO -0.08 -0.31 0.68 0.59 -0.54 0.00 0.00 174.62 174.96 1f6m n ASN 204 N -3.91 -3.20 -3.90 3.99 3.02 0.60 -4.84 115.26 107.03 1f6m n ASN 204 Ca 0.08 -0.96 -0.09 0.00 -0.03 0.00 0.00 54.58 53.57 1f6m n ASN 204 Cb 0.54 -3.50 -0.09 0.00 -0.61 0.00 0.00 39.78 36.12 1f6m n ASN 204 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1f6m s ARG 205 N -6.07 0.67 -0.03 3.52 1.81 -0.34 -2.67 118.95 115.84 1f6m s ARG 205 Ca 0.25 -0.78 0.01 0.00 -1.72 0.00 0.00 55.73 53.50 1f6m s ARG 205 Cb -0.09 0.27 0.02 0.00 -0.45 0.00 0.00 34.95 34.70 1f6m s ARG 205 CO 0.85 -0.18 -0.03 0.99 -0.68 0.00 0.00 175.30 176.25 1f6m s THR 206 N -2.90 0.40 -0.10 0.02 2.01 -0.07 -3.16 115.64 111.85 1f6m s THR 206 Ca -0.02 -0.08 -0.29 0.00 0.31 0.00 0.00 61.69 61.60 1f6m s THR 206 Cb 0.01 -0.42 -0.06 0.00 0.01 0.00 0.00 72.50 72.03 1f6m s THR 206 CO -0.06 0.17 1.90 -0.22 -0.69 0.00 0.00 174.62 175.73 1f6m s LEU 207 N 0.69 4.06 -0.11 4.42 2.96 -1.26 -0.79 118.68 128.65 1f6m s LEU 207 Ca -0.08 2.18 -0.01 0.00 -0.22 0.00 0.00 54.13 55.99 1f6m s LEU 207 Cb -0.11 -3.53 -0.25 0.00 0.50 0.00 0.00 46.19 42.80 1f6m s LEU 207 CO -0.00 -1.30 0.40 -0.62 -1.32 0.00 0.00 176.35 173.51 1f6m n GLU 208 N 7.80 0.73 -3.60 1.98 1.02 0.15 -4.91 120.64 123.80 1f6m n GLU 208 Ca 0.22 0.26 -0.11 0.00 -0.02 0.00 0.00 57.16 57.51 1f6m n GLU 208 Cb 0.43 -1.72 -0.06 0.00 -0.02 0.00 0.00 31.44 30.08 1f6m n GLU 208 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1f6m s GLU 209 N -2.56 0.60 -0.34 3.49 2.12 -1.05 -4.99 118.70 115.97 1f6m s GLU 209 Ca -0.19 0.38 -0.15 0.00 0.36 0.00 0.00 54.97 55.37 1f6m s GLU 209 Cb 0.07 0.29 -0.01 0.00 0.26 0.00 0.00 34.13 34.73 1f6m s GLU 209 CO 0.78 -0.14 0.35 0.08 -0.54 0.00 0.00 175.26 175.78 1f6m s VAL 210 N -0.49 5.18 0.19 3.70 1.01 -1.26 -0.24 120.40 128.48 1f6m s VAL 210 Ca -0.00 0.05 0.05 0.00 0.00 0.00 0.00 61.98 62.07 1f6m s VAL 210 Cb -0.03 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 1f6m s VAL 210 CO -0.01 -0.07 0.23 0.42 0.00 0.00 0.00 175.10 175.67 1f6m s THR 211 N 1.99 4.85 -1.23 3.92 -4.23 -0.92 -4.80 115.64 115.22 1f6m s THR 211 Ca 0.11 -1.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.62 1f6m s THR 211 Cb -0.17 -3.54 0.00 0.00 1.34 0.00 0.00 72.50 70.14 1f6m s THR 211 CO 0.11 -0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 1f6m n GLY 212 N -0.72 -1.26 0.00 3.99 0.00 -1.26 -1.88 105.19 104.06 1f6m n GLY 212 Ca -0.08 -0.90 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 0.72 1.64 -0.31 1.61 5.68 -0.91 -4.90 116.55 120.08 1f6m n ASP 213 Ca 0.00 -0.44 0.00 0.00 -0.50 0.00 0.00 54.79 53.85 1f6m n ASP 213 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 1f6m n ASP 213 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1f6m n GLN 214 N -0.08 0.82 0.00 0.11 3.00 -1.26 -2.73 117.38 117.24 1f6m n GLN 214 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1f6m n GLN 214 Cb 0.00 -1.26 0.00 0.00 0.00 0.00 0.00 30.24 28.98 1f6m n GLN 214 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.06 176.94 1f6m n MET 215 N -0.13 1.66 0.00 -1.09 1.56 -1.26 -5.13 117.12 112.73 1f6m n MET 215 Ca 0.00 -0.18 0.00 0.00 -0.27 0.00 0.00 57.70 57.25 1f6m n MET 215 Cb 0.13 -0.61 0.00 0.00 2.15 0.00 0.00 33.22 34.89 1f6m n MET 215 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1f6m n GLY 216 N 0.29 2.45 3.74 -5.12 0.00 -1.11 -4.98 105.19 100.46 1f6m n GLY 216 Ca 0.00 -1.87 -0.40 0.00 0.00 0.00 0.00 46.02 43.74 1f6m n GLY 216 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1f6m n VAL 217 N -1.82 2.78 0.00 1.61 0.31 -0.72 -2.15 118.33 118.35 1f6m n VAL 217 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 1f6m n VAL 217 Cb 0.00 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.21 1f6m n VAL 217 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1f6m n THR 218 N -0.28 0.00 -3.77 2.52 -2.24 -0.79 -4.63 114.28 105.09 1f6m n THR 218 Ca 0.06 -0.10 -0.05 0.00 -2.27 0.00 0.00 64.05 61.69 1f6m n THR 218 Cb 0.41 0.86 0.02 0.00 -2.10 0.00 0.00 70.33 69.52 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 0.30 0.87 3.29 3.38 0.00 -0.87 -2.40 105.19 109.76 1f6m n GLY 219 Ca 0.00 -1.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.72 1f6m n GLY 219 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f6m s VAL 220 N -2.17 0.01 -0.26 1.61 0.11 0.21 -2.17 120.40 117.74 1f6m s VAL 220 Ca 0.17 -0.12 -0.01 0.00 -2.93 0.00 0.00 61.98 59.09 1f6m s VAL 220 Cb -0.03 -0.59 0.03 0.00 -1.53 0.00 0.00 36.38 34.26 1f6m s VAL 220 CO 0.07 -0.06 -0.05 -0.60 -3.33 0.00 0.00 175.10 171.12 1f6m s ARG 221 N -0.23 2.72 0.20 1.54 3.52 0.66 -0.75 118.95 126.61 1f6m s ARG 221 Ca -0.04 -1.05 -0.04 0.00 -0.13 0.00 0.00 55.73 54.46 1f6m s ARG 221 Cb -0.03 -3.01 -0.05 0.00 -1.56 0.00 0.00 34.95 30.29 1f6m s ARG 221 CO 0.02 -0.45 0.44 -0.51 -0.81 0.00 0.00 175.30 173.99 1f6m s LEU 222 N 1.30 4.19 0.03 -0.88 1.02 0.22 0.33 118.68 124.89 1f6m s LEU 222 Ca -0.01 0.61 0.09 0.00 0.02 0.00 0.00 54.13 54.83 1f6m s LEU 222 Cb -0.17 -3.37 -0.03 0.00 0.02 0.00 0.00 46.19 42.64 1f6m s LEU 222 CO -0.04 -0.05 -0.26 -0.60 0.02 0.00 0.00 176.35 175.42 1f6m s ARG 223 N -3.06 1.89 0.37 1.70 6.06 0.03 -1.22 118.95 124.73 1f6m s ARG 223 Ca 0.42 -1.06 -0.25 0.00 -2.50 0.00 0.00 55.73 52.34 1f6m s ARG 223 Cb -0.11 -2.00 -0.09 0.00 0.06 0.00 0.00 34.95 32.80 1f6m s ARG 223 CO 0.27 0.53 1.04 0.34 -2.50 0.00 0.00 175.30 174.97 1f6m s ASP 224 N -1.06 6.94 0.00 -2.12 -1.08 -0.83 -0.89 116.67 117.64 1f6m s ASP 224 Ca 0.11 2.03 0.24 0.00 -0.52 0.00 0.00 52.55 54.42 1f6m s ASP 224 Cb -0.10 -2.59 0.40 0.00 -1.46 0.00 0.00 42.92 39.17 1f6m s ASP 224 CO 0.01 -0.36 1.34 0.35 0.52 0.00 0.00 175.17 177.03 1f6m n THR 225 N 0.23 0.00 -0.08 1.71 -2.24 -1.09 -4.24 114.28 108.57 1f6m n THR 225 Ca 0.04 -0.09 -0.17 0.00 -2.27 0.00 0.00 64.05 61.55 1f6m n THR 225 Cb 0.49 0.58 -0.06 0.00 -2.10 0.00 0.00 70.33 69.24 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 -0.96 0.36 -3.46 -0.78 6.02 -1.26 -4.82 117.38 112.49 1f6m n GLN 226 Ca 0.08 0.15 -0.43 0.00 -0.01 0.00 0.00 57.00 56.79 1f6m n GLN 226 Cb 0.36 -1.12 -0.04 0.00 1.02 0.00 0.00 30.24 30.46 1f6m n GLN 226 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1f6m s ASN 227 N -6.42 6.26 0.50 1.08 3.84 -1.26 -4.95 114.94 113.99 1f6m s ASN 227 Ca -0.23 -2.77 0.41 0.00 0.21 0.00 0.00 52.86 50.48 1f6m s ASN 227 Cb 0.09 -2.09 1.62 0.00 -0.55 0.00 0.00 41.25 40.31 1f6m s ASN 227 CO 0.30 -0.50 1.58 -1.28 -2.79 0.00 0.00 177.10 174.41 1f6m h SER 228 N 7.50 0.11 -0.66 -4.21 0.87 -1.88 -0.08 113.55 115.19 1f6m h SER 228 Ca 0.07 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1f6m h SER 228 Cb 1.01 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1f6m h SER 228 CO 0.74 -0.14 0.00 -0.90 -0.53 0.00 0.00 176.83 176.00 1f6m n ASP 229 N -4.36 4.15 -4.83 6.23 5.75 -1.26 -4.74 116.55 117.49 1f6m n ASP 229 Ca 0.42 -2.17 -0.37 0.00 -0.01 0.00 0.00 54.79 52.66 1f6m n ASP 229 Cb 1.78 -0.50 -0.07 0.00 -1.03 0.00 0.00 41.12 41.31 1f6m n ASP 229 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1f6m s ASN 230 N -0.99 6.39 0.08 -1.12 2.47 -0.04 -5.05 114.94 116.68 1f6m s ASN 230 Ca 0.47 0.46 -0.01 0.00 0.42 0.00 0.00 52.86 54.21 1f6m s ASN 230 Cb 0.27 -2.10 -0.04 0.00 -1.45 0.00 0.00 41.25 37.93 1f6m s ASN 230 CO 0.28 0.33 -0.00 -0.63 -3.72 0.00 0.00 177.10 173.36 1f6m s ILE 231 N -0.61 0.21 -0.11 -5.21 1.01 -1.26 -1.96 121.20 113.28 1f6m s ILE 231 Ca 0.14 -1.86 -0.15 0.00 0.00 0.00 0.00 60.65 58.79 1f6m s ILE 231 Cb -0.12 -1.73 0.04 0.00 0.01 0.00 0.00 42.46 40.65 1f6m s ILE 231 CO 0.03 -0.79 0.38 -1.83 0.00 0.00 0.00 174.94 172.74 1f6m s GLU 232 N -3.96 0.53 0.53 2.79 -1.05 -0.36 -5.01 118.70 112.18 1f6m s GLU 232 Ca 0.14 0.34 -0.05 0.00 -0.15 0.00 0.00 54.97 55.25 1f6m s GLU 232 Cb 0.08 0.25 -0.01 0.00 -0.44 0.00 0.00 34.13 34.01 1f6m s GLU 232 CO -0.05 -0.10 0.84 -1.12 0.95 0.00 0.00 175.26 175.78 1f6m s SER 233 N -0.24 5.89 -0.22 0.83 0.01 -1.26 -0.61 113.70 118.10 1f6m s SER 233 Ca -0.04 0.77 -0.04 0.00 1.31 0.00 0.00 55.95 57.95 1f6m s SER 233 Cb -0.03 -1.92 0.11 0.00 0.21 0.00 0.00 66.02 64.39 1f6m s SER 233 CO 0.02 -0.83 0.38 -0.22 0.41 0.00 0.00 173.24 172.99 1f6m s LEU 234 N -4.85 -0.60 -0.50 2.44 2.96 0.07 -4.88 118.68 113.32 1f6m s LEU 234 Ca 0.51 0.50 -0.28 0.00 -0.22 0.00 0.00 54.13 54.64 1f6m s LEU 234 Cb -0.10 1.14 0.01 0.00 0.50 0.00 0.00 46.19 47.74 1f6m s LEU 234 CO 0.44 -0.27 1.39 -1.81 -1.32 0.00 0.00 176.35 174.79 1f6m s ASP 235 N 2.55 6.24 0.01 3.68 1.01 -1.26 -0.62 116.67 128.29 1f6m s ASP 235 Ca 0.07 0.51 0.00 0.00 0.71 0.00 0.00 52.55 53.84 1f6m s ASP 235 Cb -0.14 -2.54 -0.01 0.00 1.01 0.00 0.00 42.92 41.23 1f6m s ASP 235 CO -0.14 -1.57 -0.03 0.54 0.21 0.00 0.00 175.17 174.18 1f6m s VAL 236 N 5.71 0.12 -0.16 -1.27 0.11 -1.01 -4.87 120.40 119.04 1f6m s VAL 236 Ca 0.56 -0.61 0.21 0.00 -2.93 0.00 0.00 61.98 59.20 1f6m s VAL 236 Cb -0.12 -0.21 -0.12 0.00 -1.53 0.00 0.00 36.38 34.40 1f6m s VAL 236 CO 0.29 -0.31 0.81 0.00 -3.33 0.00 0.00 175.10 172.56 1f6m n ALA 237 N 2.10 2.38 -2.81 1.54 0.00 -0.07 -2.06 120.51 121.59 1f6m n ALA 237 Ca -0.20 -0.43 -0.10 0.00 0.00 0.00 0.00 53.44 52.71 1f6m n ALA 237 Cb 0.57 -0.95 -0.07 0.00 0.00 0.00 0.00 19.45 19.00 1f6m n ALA 237 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1f6m s GLY 238 N -4.57 -0.04 -0.04 0.00 0.00 -1.24 -4.52 107.32 96.92 1f6m s GLY 238 Ca -0.03 -0.28 0.02 0.00 0.00 0.00 0.00 44.72 44.43 1f6m s GLY 238 CO 0.82 -0.48 -0.08 -2.27 0.00 0.00 0.00 173.10 171.09 1f6m s LEU 239 N -2.45 1.59 -0.22 0.66 2.96 0.74 -0.60 118.68 121.35 1f6m s LEU 239 Ca -0.00 -0.20 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 1f6m s LEU 239 Cb 0.02 -0.59 0.04 0.00 0.50 0.00 0.00 46.19 46.16 1f6m s LEU 239 CO -0.07 0.01 -0.14 -0.36 -1.32 0.00 0.00 176.35 174.47 1f6m s PHE 240 N 0.57 2.96 -0.19 5.38 0.40 0.47 -0.57 117.98 127.01 1f6m s PHE 240 Ca -0.09 -1.99 -0.22 0.00 -0.60 0.00 0.00 56.93 54.03 1f6m s PHE 240 Cb -0.13 -1.87 -0.02 0.00 0.51 0.00 0.00 43.02 41.51 1f6m s PHE 240 CO 0.01 -0.83 0.68 0.14 0.70 0.00 0.00 175.22 175.92 1f6m s VAL 241 N 1.21 4.99 -0.43 -0.44 -7.23 -1.18 -1.62 120.40 115.70 1f6m s VAL 241 Ca -0.03 1.30 0.09 0.00 -1.81 0.00 0.00 61.98 61.53 1f6m s VAL 241 Cb -0.17 -3.99 0.31 0.00 0.56 0.00 0.00 36.38 33.09 1f6m s VAL 241 CO -0.08 0.09 0.71 0.00 -0.31 0.00 0.00 175.10 175.50 1f6m n ALA 242 N 5.09 2.73 -1.43 1.32 0.00 -0.11 -4.85 120.51 123.26 1f6m n ALA 242 Ca 0.00 -3.73 -0.33 0.00 0.00 0.00 0.00 53.44 49.38 1f6m n ALA 242 Cb 0.49 -0.86 0.08 0.00 0.00 0.00 0.00 19.45 19.16 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 0.58 3.45 -1.08 0.00 -5.35 -1.24 -4.13 119.36 111.58 1f6m n ILE 243 Ca 0.25 -3.09 0.00 0.00 -0.27 0.00 0.00 62.75 59.64 1f6m n ILE 243 Cb 0.56 -1.12 0.00 0.00 -1.74 0.00 0.00 39.64 37.33 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 -0.90 -2.10 3.04 3.28 0.00 -1.26 -4.74 105.19 102.51 1f6m n GLY 244 Ca 0.60 -1.87 -0.12 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.15 0.57 -0.10 1.61 3.76 -1.26 -0.30 115.29 119.42 1f6m s HIS 245 Ca 0.00 -0.47 0.01 0.00 -0.15 0.00 0.00 55.06 54.45 1f6m s HIS 245 Cb 0.00 -0.35 -0.02 0.00 1.11 0.00 0.00 32.58 33.32 1f6m s HIS 245 CO 0.00 -0.10 -0.11 -1.54 -0.85 0.00 0.00 174.74 172.14 1f6m s SER 246 N -1.43 4.25 0.30 1.40 1.04 0.48 -4.85 113.70 114.88 1f6m s SER 246 Ca -0.10 -0.20 -0.30 0.00 0.48 0.00 0.00 55.95 55.83 1f6m s SER 246 Cb -0.09 -1.33 -0.11 0.00 0.10 0.00 0.00 66.02 64.58 1f6m s SER 246 CO 0.00 0.26 1.61 -0.81 0.98 0.00 0.00 173.24 175.28 1f6m n PRO 247 N 2.92 2.75 -2.37 4.02 -0.04 -1.26 -0.19 135.00 140.82 1f6m n PRO 247 Ca -0.18 0.98 -0.37 0.00 -0.04 0.00 0.00 63.50 63.89 1f6m n PRO 247 Cb 0.53 -2.77 -0.03 0.00 -0.04 0.00 0.00 33.50 31.19 1f6m n PRO 247 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1f6m s ASN 248 N 0.50 6.09 -0.05 3.54 0.01 0.28 -4.65 114.94 120.66 1f6m s ASN 248 Ca 0.64 -1.94 0.07 0.00 -0.71 0.00 0.00 52.86 50.92 1f6m s ASN 248 Cb -0.49 -2.58 0.11 0.00 0.41 0.00 0.00 41.25 38.71 1f6m s ASN 248 CO 0.49 -1.94 0.99 0.35 -1.51 0.00 0.00 177.10 175.48 1f6m n THR 249 N 7.02 0.88 -0.22 1.60 -2.24 -1.26 -4.80 114.28 115.25 1f6m n THR 249 Ca 0.45 -1.02 -0.07 0.00 -2.27 0.00 0.00 64.05 61.13 1f6m n THR 249 Cb 0.47 0.28 0.06 0.00 -2.10 0.00 0.00 70.33 69.04 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 0.00 0.93 0.00 6.98 0.00 -1.93 -2.27 119.26 122.97 1f6m h ALA 250 Ca 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1f6m h ALA 250 Cb 1.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1f6m h ALA 250 CO 0.00 0.66 -0.23 -0.84 0.00 0.00 0.00 179.25 178.84 1f6m h ILE 251 N 1.01 1.00 -0.42 0.00 3.07 -1.91 -1.60 117.51 118.66 1f6m h ILE 251 Ca 0.20 -0.83 0.00 0.00 1.55 0.00 0.00 64.86 65.77 1f6m h ILE 251 Cb 0.45 1.47 0.00 0.00 -0.27 0.00 0.00 36.82 38.47 1f6m h ILE 251 CO 0.01 0.23 0.00 0.49 -1.05 0.00 0.00 178.15 177.83 1f6m n PHE 252 N -4.03 0.69 -1.78 0.16 3.72 -0.90 -4.41 117.46 110.90 1f6m n PHE 252 Ca -0.02 -0.31 -0.42 0.00 -0.05 0.00 0.00 57.45 56.65 1f6m n PHE 252 Cb 0.30 -0.06 -0.02 0.00 -0.94 0.00 0.00 39.48 38.77 1f6m n PHE 252 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1f6m s GLU 253 N -1.52 4.13 -1.57 -1.08 0.41 -0.60 -1.60 118.70 116.87 1f6m s GLU 253 Ca 0.30 2.57 0.00 0.00 -0.41 0.00 0.00 54.97 57.42 1f6m s GLU 253 Cb 0.17 -3.04 0.00 0.00 -1.78 0.00 0.00 34.13 29.47 1f6m s GLU 253 CO 0.18 -0.65 0.00 0.41 -0.49 0.00 0.00 175.26 174.71 1f6m n GLY 254 N 2.63 -0.06 0.00 -1.39 0.00 -1.26 -4.78 105.19 100.32 1f6m n GLY 254 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 -2.78 0.53 -3.59 1.61 1.13 -0.63 -5.08 117.38 108.59 1f6m n GLN 255 Ca -0.20 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 54.75 1f6m n GLN 255 Cb 0.64 -0.97 -0.06 0.00 0.11 0.00 0.00 30.24 29.97 1f6m n GLN 255 CO 0.00 0.00 0.00 -0.48 -1.44 0.00 0.00 177.06 175.14 1f6m s LEU 256 N -2.84 -0.41 -0.47 1.08 0.05 -1.22 -4.87 118.68 109.99 1f6m s LEU 256 Ca 0.00 0.54 -0.45 0.00 0.05 0.00 0.00 54.13 54.26 1f6m s LEU 256 Cb 0.00 1.93 -0.19 0.00 -2.05 0.00 0.00 46.19 45.88 1f6m s LEU 256 CO 0.00 -0.32 1.77 -0.62 -0.55 0.00 0.00 176.35 176.63 1f6m n GLU 257 N 1.07 0.14 -5.15 1.48 1.02 -1.26 -4.92 120.64 113.03 1f6m n GLU 257 Ca -0.11 0.05 -0.31 0.00 -0.02 0.00 0.00 57.16 56.77 1f6m n GLU 257 Cb 0.57 -1.59 -0.17 0.00 -0.02 0.00 0.00 31.44 30.24 1f6m n GLU 257 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1f6m s LEU 258 N 3.97 2.04 -0.45 -4.62 2.96 -1.26 -1.89 118.68 119.42 1f6m s LEU 258 Ca 1.08 -0.52 0.02 0.00 -0.22 0.00 0.00 54.13 54.49 1f6m s LEU 258 Cb -1.44 -1.33 0.12 0.00 0.50 0.00 0.00 46.19 44.04 1f6m s LEU 258 CO 0.75 0.16 0.20 -0.70 -1.32 0.00 0.00 176.35 175.44 1f6m s GLU 259 N 0.27 1.88 -1.05 1.98 2.12 -0.23 -4.65 118.70 119.00 1f6m s GLU 259 Ca -0.15 -2.18 -0.02 0.00 0.36 0.00 0.00 54.97 52.97 1f6m s GLU 259 Cb -0.17 -3.39 0.00 0.00 0.26 0.00 0.00 34.13 30.84 1f6m s GLU 259 CO 0.07 -1.05 0.32 0.09 -0.54 0.00 0.00 175.26 174.16 1f6m n ASN 260 N 3.87 -4.49 0.00 -1.70 5.03 -1.26 -3.01 115.26 113.69 1f6m n ASN 260 Ca 0.04 -0.15 0.00 0.00 0.87 0.00 0.00 54.58 55.33 1f6m n ASN 260 Cb 0.38 -3.42 0.00 0.00 -1.02 0.00 0.00 39.78 35.72 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 -1.21 2.91 3.73 7.41 0.00 -1.26 -4.99 105.19 111.78 1f6m n GLY 261 Ca -0.09 -0.08 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.37 3.73 0.07 1.61 1.51 -1.16 -4.57 117.35 116.16 1f6m s TYR 262 Ca 0.00 1.57 -0.31 0.00 -1.01 0.00 0.00 57.07 57.32 1f6m s TYR 262 Cb 0.00 -2.92 -0.08 0.00 -0.11 0.00 0.00 41.96 38.84 1f6m s TYR 262 CO 0.00 0.20 1.64 0.42 -1.11 0.00 0.00 175.55 176.70 1f6m s ILE 263 N 0.19 3.05 0.26 2.71 1.01 -0.69 -1.07 121.20 126.67 1f6m s ILE 263 Ca 0.43 0.51 -0.30 0.00 0.00 0.00 0.00 60.65 61.29 1f6m s ILE 263 Cb -0.21 -3.33 -0.09 0.00 0.01 0.00 0.00 42.46 38.84 1f6m s ILE 263 CO 0.25 -0.00 1.05 -0.75 0.00 0.00 0.00 174.94 175.49 1f6m s LYS 264 N 2.59 4.71 0.16 2.79 2.20 -0.79 -4.53 119.74 126.87 1f6m s LYS 264 Ca 0.73 1.71 0.06 0.00 -0.36 0.00 0.00 55.97 58.11 1f6m s LYS 264 Cb -0.40 -3.22 -0.04 0.00 -1.51 0.00 0.00 37.83 32.66 1f6m s LYS 264 CO 0.32 0.30 -0.12 0.14 -0.36 0.00 0.00 175.35 175.63 1f6m s VAL 265 N -1.14 1.39 0.17 4.02 -7.23 -1.26 -4.28 120.40 112.06 1f6m s VAL 265 Ca 0.43 -2.06 -0.14 0.00 -1.81 0.00 0.00 61.98 58.40 1f6m s VAL 265 Cb -0.30 -1.87 0.06 0.00 0.56 0.00 0.00 36.38 34.83 1f6m s VAL 265 CO 0.38 -0.65 1.81 -0.61 -0.31 0.00 0.00 175.10 175.72 1f6m h GLN 266 N 2.81 0.56 0.00 4.82 4.15 -1.18 -3.48 115.11 122.79 1f6m h GLN 266 Ca -0.38 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.01 1f6m h GLN 266 Cb 1.20 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.77 1f6m h GLN 266 CO 0.61 0.37 0.00 0.45 -1.93 0.00 0.00 178.83 178.33 1f6m n SER 267 N -4.81 -0.66 0.00 -0.69 2.88 0.33 -5.00 113.62 105.67 1f6m n SER 267 Ca 0.03 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1f6m n SER 267 Cb 0.07 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.53 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 -0.14 1.46 0.46 0.00 -1.26 -4.26 105.19 101.45 1f6m n GLY 268 Ca 0.00 -1.79 -0.10 0.00 0.00 0.00 0.00 46.02 44.13 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 -0.04 2.73 -2.38 -0.61 -5.35 -1.26 -4.53 119.36 107.91 1f6m n ILE 269 Ca 0.00 -2.68 -0.14 0.00 -0.27 0.00 0.00 62.75 59.66 1f6m n ILE 269 Cb 0.00 -0.42 0.03 0.00 -1.74 0.00 0.00 39.64 37.52 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 -1.11 2.14 -0.94 4.28 8.25 -1.26 -5.11 115.22 121.47 1f6m n HIS 270 Ca 0.40 -2.23 0.13 0.00 -0.26 0.00 0.00 57.72 55.75 1f6m n HIS 270 Cb 1.15 -0.29 -0.03 0.00 1.12 0.00 0.00 29.99 31.93 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 -0.64 -1.83 3.46 -1.41 0.00 -1.26 -4.85 105.19 98.65 1f6m n GLY 271 Ca 0.28 -1.28 -0.24 0.00 0.00 0.00 0.00 46.02 44.78 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 -3.23 -3.36 0.26 1.61 2.85 -1.26 -4.82 115.26 107.31 1f6m n ASN 272 Ca -0.00 -0.44 0.16 0.00 -0.11 0.00 0.00 54.58 54.19 1f6m n ASN 272 Cb 0.43 -2.80 0.62 0.00 1.24 0.00 0.00 39.78 39.26 1f6m n ASN 272 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1f6m h ALA 273 N 0.96 1.01 -0.79 5.20 0.00 -1.88 -3.10 119.26 120.66 1f6m h ALA 273 Ca -0.43 -0.04 -0.27 0.00 0.00 0.00 0.00 54.91 54.18 1f6m h ALA 273 Cb 1.28 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.91 1f6m h ALA 273 CO 0.54 0.05 0.34 0.25 0.00 0.00 0.00 179.25 180.43 1f6m n THR 274 N -3.15 2.98 -3.51 0.00 -2.24 -1.26 -0.51 114.28 106.59 1f6m n THR 274 Ca 0.01 -1.66 -0.37 0.00 -2.27 0.00 0.00 64.05 59.76 1f6m n THR 274 Cb 0.34 -0.38 -0.07 0.00 -2.10 0.00 0.00 70.33 68.12 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 -3.02 4.16 0.92 -0.78 0.74 -1.17 -1.12 119.66 119.38 1f6m s GLN 275 Ca 0.55 0.19 -0.14 0.00 0.05 0.00 0.00 55.36 56.01 1f6m s GLN 275 Cb 0.45 -3.38 0.21 0.00 1.10 0.00 0.00 33.01 31.39 1f6m s GLN 275 CO 0.13 0.33 1.25 0.25 -0.55 0.00 0.00 175.29 176.70 1f6m n THR 276 N 3.20 0.00 0.12 -0.34 -2.24 0.36 -1.08 114.28 114.30 1f6m n THR 276 Ca -0.12 -0.99 0.01 0.00 -2.27 0.00 0.00 64.05 60.68 1f6m n THR 276 Cb 0.52 -1.47 0.07 0.00 -2.10 0.00 0.00 70.33 67.35 1f6m n THR 276 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1f6m n SER 277 N -3.74 0.00 -4.18 3.42 3.41 -1.26 -4.39 113.62 106.88 1f6m n SER 277 Ca 0.16 0.38 -0.34 0.00 -0.26 0.00 0.00 58.87 58.81 1f6m n SER 277 Cb 0.56 -0.40 -0.15 0.00 -0.26 0.00 0.00 64.21 63.95 1f6m n SER 277 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1f6m s ILE 278 N -2.80 2.44 0.28 -1.33 1.01 -1.26 -4.97 121.20 114.56 1f6m s ILE 278 Ca 0.02 -0.81 -0.29 0.00 0.00 0.00 0.00 60.65 59.57 1f6m s ILE 278 Cb 0.02 -2.05 -0.14 0.00 0.01 0.00 0.00 42.46 40.30 1f6m s ILE 278 CO 0.05 0.51 1.07 -2.65 0.00 0.00 0.00 174.94 173.92 1f6m n PRO 279 N 4.63 1.43 0.00 2.79 -0.02 -1.26 -1.24 135.00 141.32 1f6m n PRO 279 Ca -0.20 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1f6m n PRO 279 Cb 0.50 -1.91 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 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 1.32 2.41 3.35 -1.23 0.00 -1.26 -4.99 105.19 104.78 1f6m n GLY 280 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.79 3.51 0.14 1.61 1.01 -0.37 -1.04 120.40 122.47 1f6m s VAL 281 Ca 0.00 -0.46 0.10 0.00 0.00 0.00 0.00 61.98 61.62 1f6m s VAL 281 Cb 0.00 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.76 1f6m s VAL 281 CO 0.00 0.43 -0.23 -0.36 0.00 0.00 0.00 175.10 174.95 1f6m s PHE 282 N 1.27 2.04 0.01 5.22 0.08 0.39 -0.49 117.98 126.50 1f6m s PHE 282 Ca 0.03 -0.41 0.05 0.00 0.12 0.00 0.00 56.93 56.73 1f6m s PHE 282 Cb -0.14 -1.07 -0.02 0.00 -0.57 0.00 0.00 43.02 41.22 1f6m s PHE 282 CO -0.01 0.33 -0.15 0.00 -0.10 0.00 0.00 175.22 175.29 1f6m s ALA 283 N -1.44 1.24 0.16 5.36 0.00 -0.28 0.66 121.76 127.46 1f6m s ALA 283 Ca 0.14 -0.72 -0.03 0.00 0.00 0.00 0.00 51.96 51.35 1f6m s ALA 283 Cb -0.09 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.73 1f6m s ALA 283 CO 0.06 0.28 0.13 0.00 0.00 0.00 0.00 175.76 176.24 1f6m s ALA 284 N -0.53 0.72 0.00 0.00 0.00 -0.62 -4.74 121.76 116.60 1f6m s ALA 284 Ca 0.05 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.62 1f6m s ALA 284 Cb -0.07 0.98 0.00 0.00 0.00 0.00 0.00 23.12 24.04 1f6m s ALA 284 CO 0.00 -0.55 0.00 0.41 0.00 0.00 0.00 175.76 175.62 1f6m n GLY 285 N -0.16 -1.83 0.25 0.00 0.00 -1.26 -4.06 105.19 98.13 1f6m n GLY 285 Ca -0.04 -1.37 0.17 0.00 0.00 0.00 0.00 46.02 44.78 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 0.50 1.61 5.19 -1.90 -2.28 116.42 119.54 1f6m h ASP 286 Ca 0.00 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.38 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 0.00 -0.12 1.62 -3.12 0.00 0.00 179.24 177.62 1f6m h VAL 287 N 0.00 0.48 -0.03 -1.35 3.04 -1.71 -2.98 116.25 113.69 1f6m h VAL 287 Ca 0.00 -0.60 0.00 0.00 -1.01 0.00 0.00 66.70 65.09 1f6m h VAL 287 Cb 0.13 1.41 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 1f6m h VAL 287 CO 0.00 0.12 0.00 1.15 -1.01 0.00 0.00 177.57 177.83 1f6m n MET 288 N -3.51 2.29 -3.68 4.17 0.00 -0.87 -1.70 117.12 113.83 1f6m n MET 288 Ca -0.01 -2.01 -0.27 0.00 0.00 0.00 0.00 57.70 55.40 1f6m n MET 288 Cb 0.27 -1.25 -0.17 0.00 0.00 0.00 0.00 33.22 32.07 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 -1.80 2.68 -0.00 3.17 2.15 -1.13 -4.87 116.67 116.87 1f6m s ASP 289 Ca 0.16 -0.74 0.17 0.00 0.43 0.00 0.00 52.55 52.57 1f6m s ASP 289 Cb 0.13 -0.45 0.49 0.00 -0.30 0.00 0.00 42.92 42.79 1f6m s ASP 289 CO 0.02 -0.32 1.41 0.00 -0.17 0.00 0.00 175.17 176.11 1f6m n HIS 290 N 5.14 0.75 -0.04 -5.34 1.44 -1.26 -4.47 115.22 111.44 1f6m n HIS 290 Ca -0.08 -0.50 -0.06 0.00 -2.01 0.00 0.00 57.72 55.07 1f6m n HIS 290 Cb 0.48 -0.02 -0.02 0.00 0.12 0.00 0.00 29.99 30.55 1f6m n HIS 290 CO 0.00 0.00 0.00 -0.89 -2.81 0.00 0.00 176.34 172.64 1f6m n ILE 291 N 1.11 1.20 0.03 0.61 -0.00 -1.26 -4.92 119.36 116.14 1f6m n ILE 291 Ca 0.19 0.24 -0.02 0.00 -0.00 0.00 0.00 62.75 63.15 1f6m n ILE 291 Cb 0.54 -2.02 -0.01 0.00 -0.00 0.00 0.00 39.64 38.15 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 -0.61 -0.15 -6.13 1.39 0.05 -2.01 -3.49 116.97 106.01 1f6m h TYR 292 Ca 0.00 -0.00 -0.28 0.00 0.05 0.00 0.00 58.73 58.50 1f6m h TYR 292 Cb 0.61 0.05 0.01 0.00 1.01 0.00 0.00 36.73 38.41 1f6m h TYR 292 CO -0.26 -0.09 -0.62 0.54 -1.05 0.00 0.00 178.16 176.67 1f6m n ARG 293 N -4.26 -1.42 -4.29 4.88 1.74 -1.26 -5.03 116.66 107.02 1f6m n ARG 293 Ca -0.02 1.05 -0.16 0.00 -0.77 0.00 0.00 57.85 57.95 1f6m n ARG 293 Cb 0.06 -3.88 -0.10 0.00 -1.02 0.00 0.00 32.46 27.53 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 -4.19 1.18 0.16 5.56 -1.52 -1.26 -5.04 119.66 114.55 1f6m s GLN 294 Ca 0.03 -1.52 -0.15 0.00 -1.95 0.00 0.00 55.36 51.77 1f6m s GLN 294 Cb -0.01 -0.78 0.04 0.00 -0.22 0.00 0.00 33.01 32.03 1f6m s GLN 294 CO 0.83 0.09 1.78 0.00 -0.25 0.00 0.00 175.29 177.74 1f6m h ALA 295 N 2.67 0.61 -0.03 6.09 0.00 -1.95 -1.58 119.26 125.07 1f6m h ALA 295 Ca -0.37 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 1f6m h ALA 295 Cb 1.20 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1f6m h ALA 295 CO 0.63 0.12 -0.57 0.97 0.00 0.00 0.00 179.25 180.40 1f6m h ILE 296 N 0.63 1.40 0.00 0.00 6.09 -1.97 -0.68 117.51 122.99 1f6m h ILE 296 Ca 0.17 -1.95 -0.20 0.00 -1.37 0.00 0.00 64.86 61.51 1f6m h ILE 296 Cb 0.03 2.02 -0.01 0.00 0.47 0.00 0.00 36.82 39.33 1f6m h ILE 296 CO -0.03 0.56 -0.88 0.71 -3.07 0.00 0.00 178.15 175.45 1f6m h THR 297 N 0.07 1.49 -0.16 2.19 1.35 -1.94 -2.47 112.91 113.44 1f6m h THR 297 Ca -0.00 -2.59 -0.17 0.00 -0.55 0.00 0.00 66.41 63.09 1f6m h THR 297 Cb 1.04 2.45 -0.00 0.00 -1.73 0.00 0.00 68.15 69.90 1f6m h THR 297 CO 0.08 0.76 -0.62 0.28 -0.25 0.00 0.00 175.52 175.77 1f6m h SER 298 N 0.12 0.64 -0.74 5.36 0.02 -1.14 -2.12 113.55 115.68 1f6m h SER 298 Ca -0.05 -0.37 -0.05 0.00 -0.84 0.00 0.00 61.79 60.49 1f6m h SER 298 Cb 1.50 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.82 1f6m h SER 298 CO 0.13 1.10 0.26 0.00 -1.14 0.00 0.00 176.83 177.19 1f6m h ALA 299 N 0.90 1.05 0.87 3.77 0.00 -1.07 -1.57 119.26 123.22 1f6m h ALA 299 Ca -0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1f6m h ALA 299 Cb 1.18 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.69 1f6m h ALA 299 CO 0.12 0.66 -0.42 0.78 0.00 0.00 0.00 179.25 180.38 1f6m h GLY 300 N 1.13 -1.22 1.87 0.00 0.00 -1.19 -1.38 103.07 102.29 1f6m h GLY 300 Ca 0.25 0.45 0.02 0.00 0.00 0.00 0.00 47.33 48.04 1f6m h GLY 300 CO -0.01 -0.44 0.05 -0.91 0.00 0.00 0.00 176.54 175.22 1f6m h THR 301 N -1.20 0.71 -0.65 4.70 1.35 -1.40 0.22 112.91 116.65 1f6m h THR 301 Ca -0.12 0.00 -0.09 0.00 -0.55 0.00 0.00 66.41 65.65 1f6m h THR 301 Cb 0.89 0.96 -0.02 0.00 -1.73 0.00 0.00 68.15 68.25 1f6m h THR 301 CO 0.20 0.00 0.06 1.23 -0.25 0.00 0.00 175.52 176.75 1f6m h GLY 302 N 0.00 1.19 0.94 5.82 0.00 -1.02 0.99 103.07 110.99 1f6m h GLY 302 Ca 0.03 -0.83 -0.02 0.00 0.00 0.00 0.00 47.33 46.50 1f6m h GLY 302 CO -0.00 0.76 0.14 0.00 0.00 0.00 0.00 176.54 177.45 1f6m h MET 304 N 0.48 1.00 -1.00 0.00 2.86 -0.83 -1.84 114.93 115.60 1f6m h MET 304 Ca 0.13 -0.06 0.09 0.00 -2.06 0.00 0.00 59.70 57.80 1f6m h MET 304 Cb 0.21 -0.23 -0.08 0.00 0.06 0.00 0.00 31.60 31.57 1f6m h MET 304 CO -0.01 0.66 0.63 0.00 1.06 0.00 0.00 176.91 179.26 1f6m h ALA 305 N 1.32 1.45 0.35 6.32 0.00 -0.56 0.25 119.26 128.39 1f6m h ALA 305 Ca 0.31 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1f6m h ALA 305 Cb -0.04 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1f6m h ALA 305 CO -0.09 0.32 -0.17 0.00 0.00 0.00 0.00 179.25 179.31 1f6m h ALA 306 N 1.50 -0.47 -0.54 0.00 0.00 -1.17 -0.12 119.26 118.46 1f6m h ALA 306 Ca 0.47 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.26 1f6m h ALA 306 Cb 0.34 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1f6m h ALA 306 CO -0.22 -0.61 0.36 -0.07 0.00 0.00 0.00 179.25 178.71 1f6m h LEU 307 N -0.79 0.41 -0.21 0.00 3.38 -0.89 0.83 115.31 118.04 1f6m h LEU 307 Ca -0.05 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.77 1f6m h LEU 307 Cb 0.52 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1f6m h LEU 307 CO 0.08 0.27 -0.45 0.44 0.09 0.00 0.00 178.44 178.86 1f6m h ASP 308 N 0.47 0.76 -0.04 -0.43 5.19 -0.41 -2.52 116.42 119.44 1f6m h ASP 308 Ca 0.24 -0.56 -0.12 0.00 -0.62 0.00 0.00 57.03 55.97 1f6m h ASP 308 Cb 0.33 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.61 1f6m h ASP 308 CO -0.06 1.17 -0.34 0.00 -3.12 0.00 0.00 179.24 176.89 1f6m h ALA 309 N 0.60 0.95 -0.12 3.45 0.00 -0.02 -1.75 119.26 122.38 1f6m h ALA 309 Ca 0.00 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 1f6m h ALA 309 Cb 1.06 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1f6m h ALA 309 CO 0.10 0.61 0.01 1.49 0.00 0.00 0.00 179.25 181.46 1f6m h GLU 310 N 0.45 0.21 -0.99 0.00 4.81 -0.90 0.40 114.58 118.56 1f6m h GLU 310 Ca 0.05 -0.06 0.11 0.00 -0.13 0.00 0.00 59.36 59.32 1f6m h GLU 310 Cb 0.81 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 30.09 1f6m h GLU 310 CO 0.07 0.43 0.62 -0.09 -0.73 0.00 0.00 179.01 179.30 1f6m h ARG 311 N -0.04 0.99 0.11 1.92 2.43 -1.35 0.18 114.38 118.62 1f6m h ARG 311 Ca 0.04 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1f6m h ARG 311 Cb 0.32 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1f6m h ARG 311 CO 0.00 0.65 -0.05 -0.92 -1.51 0.00 0.00 179.97 178.14 1f6m h TYR 312 N 1.02 -0.14 0.00 2.20 3.20 -0.76 -3.04 116.97 119.45 1f6m h TYR 312 Ca 0.47 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.31 1f6m h TYR 312 Cb 0.40 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.71 1f6m h TYR 312 CO -0.01 0.21 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.52 1f6m h LEU 313 N -0.51 0.00 -0.44 2.82 3.38 0.34 -1.78 115.31 119.12 1f6m h LEU 313 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1f6m h LEU 313 Cb 0.41 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1f6m h LEU 313 CO 0.03 0.13 0.28 0.44 0.09 0.00 0.00 178.44 179.41 1f6m h ASP 314 N 0.00 0.51 -0.40 -0.43 3.45 -0.60 -2.34 116.42 116.62 1f6m h ASP 314 Ca -0.00 -0.03 0.06 0.00 0.43 0.00 0.00 57.03 57.49 1f6m h ASP 314 Cb 0.25 -0.13 -0.05 0.00 -0.56 0.00 0.00 39.33 38.84 1f6m h ASP 314 CO 0.02 0.39 0.08 1.23 -1.57 0.00 0.00 179.24 179.39 1f6m h GLY 315 N 0.59 0.46 1.76 2.75 0.00 -1.21 -1.64 103.07 105.78 1f6m h GLY 315 Ca 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.46 1f6m h GLY 315 CO -0.03 -0.04 0.11 1.41 0.00 0.00 0.00 176.54 177.99 1f6m h LEU 316 N 0.21 0.28 -0.58 3.11 4.07 -1.32 -1.52 115.31 119.55 1f6m h LEU 316 Ca 0.19 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.13 1f6m h LEU 316 Cb 0.23 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.90 1f6m h LEU 316 CO -0.25 0.24 0.00 0.00 -1.08 0.00 0.00 178.44 177.35 1f6m h ALA 317 N 1.81 1.00 0.00 1.53 0.00 -0.78 -3.04 119.26 119.77 1f6m h ALA 317 Ca 0.08 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 1f6m h ALA 317 Cb 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1f6m h ALA 317 CO -0.01 0.00 -1.25 -0.44 0.00 0.00 0.00 179.25 177.55 1f6m h ASP 318 N 0.00 0.00 1.22 0.00 5.19 -0.85 -3.21 116.42 118.77 1f6m h ASP 318 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1f6m h ASP 318 Cb 0.63 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.14 1f6m h ASP 318 CO 0.00 0.69 -0.06 0.00 -3.12 0.00 0.00 179.24 176.75 1f6m n ALA 319 N -2.39 2.39 1.83 3.45 0.00 -1.09 -5.13 120.51 119.58 1f6m n ALA 319 Ca -0.08 -0.08 0.15 0.00 0.00 0.00 0.00 53.44 53.44 1f6m n ALA 319 Cb 0.87 -1.44 0.80 0.00 0.00 0.00 0.00 19.45 19.69 1f6m n ALA 319 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13