#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lfp n HIS 6 N 0.00 0.55 -1.99 7.33 -0.00 -1.26 -3.23 115.22 116.62 1lfp n HIS 6 Ca 0.00 0.03 -0.00 0.00 -0.00 0.00 0.00 57.72 57.75 1lfp n HIS 6 Cb 0.00 -1.54 -0.00 0.00 -0.00 0.00 0.00 29.99 28.44 1lfp n HIS 6 CO 0.00 0.00 0.00 0.91 -0.00 0.00 0.00 176.34 177.25 1lfp n TRP 7 N 11.27 -1.67 -1.87 4.41 7.02 -1.26 -5.00 117.44 130.35 1lfp n TRP 7 Ca 0.59 0.77 -0.05 0.00 -1.02 0.00 0.00 57.50 57.79 1lfp n TRP 7 Cb 0.26 -2.53 -0.05 0.00 -2.42 0.00 0.00 31.31 26.57 1lfp n TRP 7 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1lfp n ALA 8 N 0.33 2.41 -2.92 6.99 0.00 -1.20 -5.10 120.51 121.02 1lfp n ALA 8 Ca -0.02 -0.47 -0.44 0.00 0.00 0.00 0.00 53.44 52.52 1lfp n ALA 8 Cb 0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 19.45 19.17 1lfp n ALA 8 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1lfp s GLN 9 N 0.00 3.29 -0.12 0.00 0.74 -1.26 -4.72 119.66 117.59 1lfp s GLN 9 Ca 0.00 -1.27 0.15 0.00 0.05 0.00 0.00 55.36 54.28 1lfp s GLN 9 Cb 0.00 -4.50 0.47 0.00 1.10 0.00 0.00 33.01 30.07 1lfp s GLN 9 CO 0.00 -1.76 1.38 0.44 -0.55 0.00 0.00 175.29 174.80 1lfp n ILE 10 N 5.69 1.88 0.00 -2.34 -5.35 -1.26 -4.96 119.36 113.02 1lfp n ILE 10 Ca 0.06 -1.58 0.00 0.00 -0.27 0.00 0.00 62.75 60.96 1lfp n ILE 10 Cb 0.46 -0.01 0.00 0.00 -1.74 0.00 0.00 39.64 38.35 1lfp n ILE 10 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1lfp n LYS 11 N -0.14 0.00 0.00 6.28 5.02 -1.26 -3.61 118.16 124.44 1lfp n LYS 11 Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1lfp n LYS 11 Cb 0.75 -0.66 0.00 0.00 -0.02 0.00 0.00 35.03 35.10 1lfp n LYS 11 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 1lfp n HIS 12 N -0.04 0.00 -2.92 2.13 1.44 -1.26 -5.05 115.22 109.52 1lfp n HIS 12 Ca 0.00 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.63 1lfp n HIS 12 Cb 0.00 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.12 1lfp n HIS 12 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 1lfp n LYS 13 N 0.00 -2.51 -0.75 -1.40 4.81 -1.26 -4.83 118.16 112.22 1lfp n LYS 13 Ca 0.00 2.14 0.10 0.00 -0.87 0.00 0.00 58.31 59.68 1lfp n LYS 13 Cb 0.00 -4.59 -0.03 0.00 0.02 0.00 0.00 35.03 30.42 1lfp n LYS 13 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1lfp n LYS 14 N 0.27 -1.61 -0.12 1.64 5.02 -1.26 -4.82 118.16 117.28 1lfp n LYS 14 Ca 0.04 1.20 -0.26 0.00 -2.02 0.00 0.00 58.31 57.27 1lfp n LYS 14 Cb 0.32 -1.93 -0.11 0.00 -0.02 0.00 0.00 35.03 33.30 1lfp n LYS 14 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1lfp n ALA 15 N -2.89 1.06 -3.15 7.82 0.00 -1.24 -4.46 120.51 117.65 1lfp n ALA 15 Ca -0.02 -0.87 0.05 0.00 0.00 0.00 0.00 53.44 52.60 1lfp n ALA 15 Cb 0.35 -0.16 -0.00 0.00 0.00 0.00 0.00 19.45 19.63 1lfp n ALA 15 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1lfp s LYS 16 N -2.46 0.29 0.00 0.00 -0.14 -1.26 -4.98 119.74 111.19 1lfp s LYS 16 Ca -0.34 0.32 -0.03 0.00 -1.36 0.00 0.00 55.97 54.57 1lfp s LYS 16 Cb 0.11 0.16 -0.11 0.00 -1.68 0.00 0.00 37.83 36.30 1lfp s LYS 16 CO 0.55 -0.51 2.22 0.28 -0.76 0.00 0.00 175.35 177.13 1lfp n VAL 17 N 5.26 1.89 0.20 3.17 0.31 -1.26 -2.52 118.33 125.37 1lfp n VAL 17 Ca 0.06 -0.78 0.00 0.00 -0.01 0.00 0.00 64.34 63.60 1lfp n VAL 17 Cb 0.56 -1.65 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 1lfp n VAL 17 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1lfp n ASP 18 N 2.20 -3.62 0.09 4.52 5.68 -1.26 -4.92 116.55 119.24 1lfp n ASP 18 Ca 0.18 0.81 -0.13 0.00 -0.50 0.00 0.00 54.79 55.16 1lfp n ASP 18 Cb 0.54 3.43 -0.09 0.00 -1.14 0.00 0.00 41.12 43.86 1lfp n ASP 18 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1lfp h ALA 19 N 0.00 0.28 -0.04 2.12 0.00 -1.99 -3.32 119.26 116.30 1lfp h ALA 19 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 54.91 54.10 1lfp h ALA 19 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1lfp h ALA 19 CO 0.00 0.96 0.00 1.04 0.00 0.00 0.00 179.25 181.25 1lfp n GLN 20 N -3.58 1.59 -0.26 0.00 1.13 -1.05 -4.52 117.38 110.68 1lfp n GLN 20 Ca -0.06 -0.86 -0.06 0.00 -1.94 0.00 0.00 57.00 54.08 1lfp n GLN 20 Cb 0.92 -1.46 0.08 0.00 0.11 0.00 0.00 30.24 29.90 1lfp n GLN 20 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 1lfp h ARG 21 N 2.03 1.13 -0.44 -1.09 0.11 -1.67 -2.13 114.38 112.32 1lfp h ARG 21 Ca 0.00 -0.22 0.02 0.00 0.10 0.00 0.00 59.98 59.88 1lfp h ARG 21 Cb 0.43 -0.18 -0.03 0.00 1.11 0.00 0.00 29.97 31.31 1lfp h ARG 21 CO 0.00 0.94 0.26 0.78 0.10 0.00 0.00 179.97 182.06 1lfp h GLY 22 N 1.12 0.62 0.97 0.08 0.00 -1.87 0.22 103.07 104.21 1lfp h GLY 22 Ca 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1lfp h GLY 22 CO -0.01 0.18 0.22 0.50 0.00 0.00 0.00 176.54 177.42 1lfp h LYS 23 N 0.53 0.60 -0.16 4.80 1.57 -1.84 0.19 116.57 122.26 1lfp h LYS 23 Ca 0.17 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 1lfp h LYS 23 Cb 0.00 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 1lfp h LYS 23 CO -0.08 0.50 0.07 1.25 -0.57 0.00 0.00 179.45 180.62 1lfp h LEU 24 N 0.55 0.22 -1.38 2.94 5.85 -0.98 -2.51 115.31 119.99 1lfp h LEU 24 Ca 0.15 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1lfp h LEU 24 Cb 0.08 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.04 1lfp h LEU 24 CO -0.02 0.31 0.10 -0.26 -0.34 0.00 0.00 178.44 178.24 1lfp h PHE 25 N 0.10 0.52 -0.62 1.25 0.05 -0.42 0.36 116.94 118.18 1lfp h PHE 25 Ca 0.05 -0.03 -0.00 0.00 3.82 0.00 0.00 57.97 61.82 1lfp h PHE 25 Cb 0.16 -0.16 -0.03 0.00 2.00 0.00 0.00 35.95 37.92 1lfp h PHE 25 CO -0.02 0.45 0.39 1.03 -0.18 0.00 0.00 178.31 179.98 1lfp h SER 26 N 0.52 0.74 0.04 2.17 0.87 -0.71 0.15 113.55 117.33 1lfp h SER 26 Ca 0.12 -0.05 -0.14 0.00 -1.23 0.00 0.00 61.79 60.50 1lfp h SER 26 Cb 0.17 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 1lfp h SER 26 CO -0.01 0.56 -0.47 0.11 -0.53 0.00 0.00 176.83 176.50 1lfp h LYS 27 N 0.84 0.50 -0.27 2.24 1.57 -0.91 -1.87 116.57 118.67 1lfp h LYS 27 Ca 0.22 -0.28 -0.12 0.00 -1.87 0.00 0.00 60.65 58.60 1lfp h LYS 27 Cb -0.05 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1lfp h LYS 27 CO -0.04 0.87 -0.35 -0.07 -0.57 0.00 0.00 179.45 179.29 1lfp h LEU 28 N 0.40 0.61 -0.38 2.94 -0.00 -0.40 -1.90 115.31 116.59 1lfp h LEU 28 Ca 0.02 -0.25 -0.01 0.00 -0.00 0.00 0.00 57.88 57.64 1lfp h LEU 28 Cb 0.98 -0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 41.45 1lfp h LEU 28 CO 0.09 0.91 0.20 0.40 -0.00 0.00 0.00 178.44 180.04 1lfp h ILE 29 N 0.49 1.15 -0.44 1.22 2.04 -0.53 -1.93 117.51 119.51 1lfp h ILE 29 Ca 0.05 -0.39 0.03 0.00 1.00 0.00 0.00 64.86 65.56 1lfp h ILE 29 Cb 0.83 0.72 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 1lfp h ILE 29 CO 0.07 0.15 0.22 0.03 0.00 0.00 0.00 178.15 178.62 1lfp h ARG 30 N 0.48 0.43 -0.93 2.37 -0.00 -1.08 -0.57 114.38 115.08 1lfp h ARG 30 Ca 0.13 -0.03 0.02 0.00 -0.50 0.00 0.00 59.98 59.61 1lfp h ARG 30 Cb 0.06 -0.10 -0.05 0.00 0.00 0.00 0.00 29.97 29.89 1lfp h ARG 30 CO -0.02 0.28 0.61 1.49 0.00 0.00 0.00 179.97 182.33 1lfp h GLU 31 N 0.44 1.18 -0.44 0.04 4.57 -1.13 -0.32 114.58 118.92 1lfp h GLU 31 Ca 0.19 -0.07 -0.09 0.00 -1.18 0.00 0.00 59.36 58.20 1lfp h GLU 31 Cb 0.09 -0.27 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 1lfp h GLU 31 CO -0.13 0.78 -0.09 0.82 -1.18 0.00 0.00 179.01 179.20 1lfp h ILE 32 N 1.21 1.27 0.10 2.32 2.04 -0.91 0.25 117.51 123.80 1lfp h ILE 32 Ca 0.36 -1.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.02 1lfp h ILE 32 Cb -0.07 1.14 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 1lfp h ILE 32 CO -0.10 0.41 -0.06 0.40 0.00 0.00 0.00 178.15 178.80 1lfp h ILE 33 N 0.67 0.87 -0.50 -0.67 2.04 -0.61 -0.66 117.51 118.65 1lfp h ILE 33 Ca 0.11 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.85 1lfp h ILE 33 Cb 0.63 0.87 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1lfp h ILE 33 CO 0.04 0.00 -0.18 1.62 0.00 0.00 0.00 178.15 179.63 1lfp h VAL 34 N -0.16 1.27 -0.35 1.67 3.04 -1.04 0.42 116.25 121.10 1lfp h VAL 34 Ca -0.01 -1.34 -0.02 0.00 -1.01 0.00 0.00 66.70 64.33 1lfp h VAL 34 Cb 0.13 1.09 -0.02 0.00 -2.01 0.00 0.00 31.29 30.48 1lfp h VAL 34 CO 0.01 0.47 0.15 0.00 -1.01 0.00 0.00 177.57 177.19 1lfp h ALA 35 N 0.88 1.61 -0.08 3.17 0.00 -0.85 0.70 119.26 124.69 1lfp h ALA 35 Ca 0.12 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1lfp h ALA 35 Cb 0.75 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1lfp h ALA 35 CO 0.06 0.31 -0.22 1.79 0.00 0.00 0.00 179.25 181.20 1lfp h THR 36 N 0.49 1.42 -0.44 0.00 1.35 -0.57 -1.83 112.91 113.33 1lfp h THR 36 Ca 0.12 -1.58 -0.02 0.00 -0.55 0.00 0.00 66.41 64.38 1lfp h THR 36 Cb 0.08 2.25 -0.02 0.00 -1.73 0.00 0.00 68.15 68.73 1lfp h THR 36 CO -0.01 0.45 0.17 -0.09 -0.25 0.00 0.00 175.52 175.79 1lfp h ARG 37 N -0.20 0.63 0.02 4.72 2.43 -0.42 0.40 114.38 121.96 1lfp h ARG 37 Ca -0.01 -0.09 -0.22 0.00 -0.81 0.00 0.00 59.98 58.86 1lfp h ARG 37 Cb 0.83 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.25 1lfp h ARG 37 CO 0.05 0.52 -1.02 -0.07 -1.51 0.00 0.00 179.97 177.94 1lfp h LEU 38 N 0.63 0.10 -1.98 3.80 3.38 -0.85 -3.39 115.31 116.99 1lfp h LEU 38 Ca 0.15 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1lfp h LEU 38 Cb 0.13 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1lfp h LEU 38 CO -0.01 1.05 -0.39 0.61 0.09 0.00 0.00 178.44 179.78 1lfp n GLY 39 N 1.29 0.49 0.00 0.83 0.00 -0.69 -5.09 105.19 102.02 1lfp n GLY 39 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1lfp n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lfp n GLY 40 N -0.13 -1.09 0.00 -0.02 0.00 0.12 -4.49 105.19 99.59 1lfp n GLY 40 Ca 0.01 -1.50 0.11 0.00 0.00 0.00 0.00 46.02 44.64 1lfp n GLY 40 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1lfp n PRO 41 N -0.46 0.16 -3.16 1.61 -0.04 -1.26 -4.55 135.00 127.29 1lfp n PRO 41 Ca 0.00 0.10 -0.44 0.00 -0.04 0.00 0.00 63.50 63.12 1lfp n PRO 41 Cb 0.00 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 31.90 1lfp n PRO 41 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1lfp s ASN 42 N -2.79 6.22 0.63 3.54 3.04 -1.26 -4.93 114.94 119.38 1lfp s ASN 42 Ca 0.16 -0.95 0.31 0.00 0.04 0.00 0.00 52.86 52.42 1lfp s ASN 42 Cb 0.15 -2.29 1.69 0.00 -1.54 0.00 0.00 41.25 39.26 1lfp s ASN 42 CO 0.38 -0.89 2.02 1.55 -3.04 0.00 0.00 177.10 177.11 1lfp h PRO 43 N 8.99 0.00 0.00 0.43 0.13 -1.85 -2.19 132.00 137.52 1lfp h PRO 43 Ca -0.28 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.83 1lfp h PRO 43 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 1lfp h PRO 43 CO 0.97 0.00 -0.13 0.93 -0.23 0.00 0.00 178.00 179.54 1lfp h GLU 44 N 0.00 0.00 -0.35 0.86 5.08 -1.96 -1.54 114.58 116.67 1lfp h GLU 44 Ca 0.07 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.29 1lfp h GLU 44 Cb 0.65 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.82 1lfp h GLU 44 CO -0.00 0.13 -0.03 1.19 -1.00 0.00 0.00 179.01 179.30 1lfp n PHE 45 N -4.22 1.11 -3.18 4.33 3.72 -0.83 -4.83 117.46 113.56 1lfp n PHE 45 Ca -0.02 -1.43 -0.14 0.00 -0.05 0.00 0.00 57.45 55.81 1lfp n PHE 45 Cb 0.21 -0.46 -0.05 0.00 -0.94 0.00 0.00 39.48 38.24 1lfp n PHE 45 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1lfp s ASN 46 N -2.35 0.20 0.34 4.37 3.04 -0.58 -4.85 114.94 115.10 1lfp s ASN 46 Ca 0.44 -1.96 0.04 0.00 0.04 0.00 0.00 52.86 51.42 1lfp s ASN 46 Cb 0.39 0.82 0.66 0.00 -1.54 0.00 0.00 41.25 41.58 1lfp s ASN 46 CO 0.02 -0.16 1.94 -0.65 -3.04 0.00 0.00 177.10 175.21 1lfp h PRO 47 N 6.05 0.84 -0.52 0.43 0.11 -1.88 -1.65 132.00 135.38 1lfp h PRO 47 Ca 0.11 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.16 1lfp h PRO 47 Cb 1.04 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.94 1lfp h PRO 47 CO 0.18 0.55 0.27 -0.09 -0.21 0.00 0.00 178.00 178.70 1lfp h ARG 48 N 0.86 0.73 -0.77 1.05 2.43 -1.94 -1.70 114.38 115.05 1lfp h ARG 48 Ca 0.34 -0.10 -0.05 0.00 -0.81 0.00 0.00 59.98 59.36 1lfp h ARG 48 Cb 0.22 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 1lfp h ARG 48 CO -0.12 0.59 0.27 1.25 -1.51 0.00 0.00 179.97 180.45 1lfp h LEU 49 N 0.69 1.09 -1.08 3.80 5.85 -1.71 -0.49 115.31 123.47 1lfp h LEU 49 Ca 0.18 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.76 1lfp h LEU 49 Cb 0.08 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.77 1lfp h LEU 49 CO -0.03 0.99 0.62 -0.09 -0.34 0.00 0.00 178.44 179.60 1lfp h ARG 50 N 1.13 1.12 0.02 1.25 9.65 -0.98 0.23 114.38 126.79 1lfp h ARG 50 Ca 0.25 -0.07 -0.23 0.00 -1.10 0.00 0.00 59.98 58.84 1lfp h ARG 50 Cb 0.27 -0.25 -0.00 0.00 -1.39 0.00 0.00 29.97 28.60 1lfp h ARG 50 CO -0.01 0.74 -0.97 1.15 2.80 0.00 0.00 179.97 183.68 1lfp h THR 51 N 1.15 1.43 -0.44 0.20 2.02 -0.74 -2.39 112.91 114.14 1lfp h THR 51 Ca 0.39 -2.56 -0.11 0.00 0.77 0.00 0.00 66.41 64.90 1lfp h THR 51 Cb 0.10 2.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.99 1lfp h THR 51 CO -0.14 0.76 -0.16 0.00 0.37 0.00 0.00 175.52 176.35 1lfp h ALA 52 N 0.77 0.88 -0.45 6.16 0.00 -0.52 -1.69 119.26 124.41 1lfp h ALA 52 Ca -0.08 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 1lfp h ALA 52 Cb 1.61 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 1lfp h ALA 52 CO 0.16 0.63 0.07 0.82 0.00 0.00 0.00 179.25 180.94 1lfp h ILE 53 N 0.75 1.25 -0.83 0.00 2.04 -0.94 -2.07 117.51 117.71 1lfp h ILE 53 Ca 0.11 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 65.04 1lfp h ILE 53 Cb 0.68 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.68 1lfp h ILE 53 CO 0.05 0.32 0.41 -0.08 0.00 0.00 0.00 178.15 178.85 1lfp h GLU 54 N 0.62 1.19 -0.12 2.37 4.81 -1.17 -1.23 114.58 121.04 1lfp h GLU 54 Ca 0.14 -0.17 -0.12 0.00 -0.13 0.00 0.00 59.36 59.08 1lfp h GLU 54 Cb 0.39 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1lfp h GLU 54 CO 0.01 0.91 -0.47 1.96 -0.73 0.00 0.00 179.01 180.69 1lfp h GLN 55 N 1.17 0.30 -0.35 1.92 1.08 -1.22 -1.04 115.11 116.96 1lfp h GLN 55 Ca 0.29 -0.16 -0.15 0.00 -1.45 0.00 0.00 58.65 57.18 1lfp h GLN 55 Cb 0.10 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1lfp h GLN 55 CO -0.04 0.70 -0.37 0.00 -0.95 0.00 0.00 178.83 178.18 1lfp h ALA 56 N 1.27 0.52 -0.43 3.87 0.00 -1.03 -2.30 119.26 121.16 1lfp h ALA 56 Ca 0.01 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.38 1lfp h ALA 56 Cb 0.92 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1lfp h ALA 56 CO 0.08 0.61 -0.15 0.87 0.00 0.00 0.00 179.25 180.65 1lfp h LYS 57 N 0.67 0.80 0.00 0.00 1.57 -0.95 -2.75 116.57 115.92 1lfp h LYS 57 Ca 0.05 -0.29 -0.04 0.00 -1.87 0.00 0.00 60.65 58.50 1lfp h LYS 57 Cb 0.96 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1lfp h LYS 57 CO 0.09 0.90 -0.18 -0.22 -0.57 0.00 0.00 179.45 179.47 1lfp h LYS 58 N 0.72 0.00 -0.26 3.15 1.63 -1.04 -2.22 116.57 118.55 1lfp h LYS 58 Ca 0.11 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 1lfp h LYS 58 Cb 0.65 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.28 1lfp h LYS 58 CO 0.05 0.18 0.00 0.00 -3.45 0.00 0.00 179.45 176.23 1lfp n ALA 59 N -2.30 2.48 -1.47 5.00 0.00 -0.88 -5.09 120.51 118.25 1lfp n ALA 59 Ca -0.01 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.77 1lfp n ALA 59 Cb 0.31 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1lfp n ALA 59 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1lfp n ASN 60 N 0.62 -5.85 -4.64 0.00 5.03 -0.84 -5.07 115.26 104.51 1lfp n ASN 60 Ca 0.16 0.82 -0.35 0.00 0.87 0.00 0.00 54.58 56.09 1lfp n ASN 60 Cb 0.38 -3.21 -0.10 0.00 -1.02 0.00 0.00 39.78 35.83 1lfp n ASN 60 CO 0.00 0.00 0.00 -2.84 -1.83 0.00 0.00 177.26 172.59 1lfp s PRO 62 N -1.58 3.44 0.52 3.52 0.02 -1.26 -5.05 135.00 134.61 1lfp s PRO 62 Ca 0.00 -0.40 0.22 0.00 0.02 0.00 0.00 61.00 60.84 1lfp s PRO 62 Cb 0.00 -2.96 1.40 0.00 0.02 0.00 0.00 34.50 32.96 1lfp s PRO 62 CO 0.00 0.49 2.12 -1.49 -0.33 0.00 0.00 177.00 177.79 1lfp h TRP 63 N 5.91 0.00 -0.11 6.54 4.06 -2.00 -0.74 115.95 129.61 1lfp h TRP 63 Ca -0.43 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.48 1lfp h TRP 63 Cb 1.19 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.34 1lfp h TRP 63 CO 0.60 0.07 -0.12 1.05 -3.56 0.00 0.00 178.44 176.48 1lfp h GLU 64 N 0.00 0.17 -0.01 0.49 9.09 -2.03 -1.59 114.58 120.70 1lfp h GLU 64 Ca -0.00 -0.04 -0.16 0.00 0.05 0.00 0.00 59.36 59.22 1lfp h GLU 64 Cb 0.15 -0.03 -0.02 0.00 -1.65 0.00 0.00 28.75 27.21 1lfp h GLU 64 CO 0.01 0.31 -0.72 -0.91 0.05 0.00 0.00 179.01 177.75 1lfp h ASN 65 N 0.17 0.09 -0.19 3.06 2.35 -1.57 -2.02 115.58 117.46 1lfp h ASN 65 Ca 0.04 -0.06 -0.05 0.00 -0.55 0.00 0.00 56.30 55.68 1lfp h ASN 65 Cb 0.33 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.67 1lfp h ASN 65 CO 0.02 0.77 -0.06 0.40 -1.65 0.00 0.00 177.43 176.91 1lfp h ILE 66 N 0.05 1.29 -0.48 2.81 2.04 -1.24 -2.13 117.51 119.86 1lfp h ILE 66 Ca -0.01 -1.07 -0.00 0.00 1.00 0.00 0.00 64.86 64.77 1lfp h ILE 66 Cb 1.27 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.92 1lfp h ILE 66 CO 0.10 0.32 0.29 -0.08 0.00 0.00 0.00 178.15 178.78 1lfp h GLU 67 N 0.10 0.66 -0.85 2.37 4.81 -1.26 -2.21 114.58 118.19 1lfp h GLU 67 Ca 0.05 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.26 1lfp h GLU 67 Cb 0.52 -0.14 -0.06 0.00 0.63 0.00 0.00 28.75 29.71 1lfp h GLU 67 CO 0.02 0.48 0.53 -0.09 -0.73 0.00 0.00 179.01 179.23 1lfp h ARG 68 N 0.65 0.98 -0.58 1.92 2.43 -1.35 -1.96 114.38 116.47 1lfp h ARG 68 Ca 0.17 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.25 1lfp h ARG 68 Cb -0.01 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.30 1lfp h ARG 68 CO -0.03 0.65 0.23 0.00 -1.51 0.00 0.00 179.97 179.31 1lfp h ALA 69 N 1.37 0.75 -0.76 2.80 0.00 -0.98 -1.49 119.26 120.95 1lfp h ALA 69 Ca 0.35 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1lfp h ALA 69 Cb 0.08 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1lfp h ALA 69 CO -0.14 0.37 0.28 0.82 0.00 0.00 0.00 179.25 180.57 1lfp h ILE 70 N 0.80 1.26 -0.10 0.00 2.04 -0.87 -1.93 117.51 118.72 1lfp h ILE 70 Ca 0.19 -0.85 -0.08 0.00 1.00 0.00 0.00 64.86 65.13 1lfp h ILE 70 Cb 0.20 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 1lfp h ILE 70 CO -0.02 0.34 -0.29 0.07 0.00 0.00 0.00 178.15 178.26 1lfp h LYS 71 N 1.11 0.17 -0.25 2.37 2.10 -1.01 -2.06 116.57 119.00 1lfp h LYS 71 Ca 0.25 -0.06 -0.16 0.00 -2.00 0.00 0.00 60.65 58.68 1lfp h LYS 71 Cb 0.25 -0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.56 1lfp h LYS 71 CO -0.02 0.46 -0.48 0.87 -2.00 0.00 0.00 179.45 178.28 1lfp h LYS 72 N 0.16 0.68 0.00 0.07 6.56 -0.88 0.54 116.57 123.69 1lfp h LYS 72 Ca 0.02 -0.39 -0.08 0.00 -1.06 0.00 0.00 60.65 59.14 1lfp h LYS 72 Cb 0.60 0.03 -0.01 0.00 -0.57 0.00 0.00 32.23 32.28 1lfp h LYS 72 CO 0.04 1.01 -0.38 0.78 -2.06 0.00 0.00 179.45 178.85 1lfp h GLY 73 N 0.95 0.00 0.01 3.86 0.00 -1.07 -2.99 103.07 103.83 1lfp h GLY 73 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 47.33 46.97 1lfp h GLY 73 CO 0.10 0.00 -2.14 0.00 0.00 0.00 0.00 176.54 174.49 1lfp n ALA 74 N -2.26 1.08 0.46 3.60 0.00 -0.80 -3.59 120.51 119.00 1lfp n ALA 74 Ca 0.01 -0.91 0.01 0.00 0.00 0.00 0.00 53.44 52.55 1lfp n ALA 74 Cb 0.56 -0.11 0.08 0.00 0.00 0.00 0.00 19.45 19.98 1lfp n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lfp n GLY 75 N 1.37 -0.23 0.00 0.00 0.00 0.19 -4.65 105.19 101.87 1lfp n GLY 75 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1lfp n GLY 75 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1lfp n GLU 76 N -0.67 3.05 -2.61 1.61 0.28 -1.13 -4.85 120.64 116.33 1lfp n GLU 76 Ca 0.02 0.00 -0.01 0.00 -0.16 0.00 0.00 57.16 57.01 1lfp n GLU 76 Cb 0.01 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.88 1lfp n GLU 76 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1lfp n LEU 77 N 0.00 -7.46 -0.51 -1.84 4.77 -1.26 -4.90 117.00 105.80 1lfp n LEU 77 Ca 0.00 1.25 0.00 0.00 -0.03 0.00 0.00 56.01 57.23 1lfp n LEU 77 Cb 0.00 -3.14 0.00 0.00 -2.33 0.00 0.00 43.42 37.95 1lfp n LEU 77 CO 0.00 -2.87 0.00 -0.62 -1.33 0.00 0.00 177.39 172.57 1lfp n GLU 78 N 0.57 0.00 -0.95 3.23 -0.58 -1.26 -4.99 120.64 116.66 1lfp n GLU 78 Ca 0.01 0.49 0.00 0.00 -0.42 0.00 0.00 57.16 57.24 1lfp n GLU 78 Cb 0.03 -0.02 0.00 0.00 -0.57 0.00 0.00 31.44 30.88 1lfp n GLU 78 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1lfp n GLY 79 N 0.05 0.82 0.00 0.62 0.00 -1.26 -4.95 105.19 100.47 1lfp n GLY 79 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1lfp n GLY 79 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1lfp n GLU 80 N -0.27 0.00 -2.55 1.61 2.13 -1.26 -5.02 120.64 115.28 1lfp n GLU 80 Ca 0.00 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.75 1lfp n GLU 80 Cb 0.20 0.00 0.04 0.00 0.27 0.00 0.00 31.44 31.95 1lfp n GLU 80 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1lfp n GLN 81 N 0.00 -2.54 -3.09 5.31 6.02 -1.26 -4.80 117.38 117.02 1lfp n GLN 81 Ca 0.00 0.34 -0.40 0.00 -0.01 0.00 0.00 57.00 56.93 1lfp n GLN 81 Cb 0.00 -3.81 -0.05 0.00 1.02 0.00 0.00 30.24 27.40 1lfp n GLN 81 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1lfp s PHE 82 N -3.14 3.45 0.10 1.08 0.08 -1.26 -4.07 117.98 114.22 1lfp s PHE 82 Ca 0.01 1.06 0.03 0.00 0.12 0.00 0.00 56.93 58.14 1lfp s PHE 82 Cb -0.00 -2.80 -0.04 0.00 -0.57 0.00 0.00 43.02 39.61 1lfp s PHE 82 CO 0.29 -0.07 -0.08 -2.00 -0.10 0.00 0.00 175.22 173.26 1lfp s GLU 83 N 1.48 0.85 -0.11 0.44 -6.30 -0.56 -4.88 118.70 109.62 1lfp s GLU 83 Ca 0.32 -1.28 -0.19 0.00 -2.50 0.00 0.00 54.97 51.32 1lfp s GLU 83 Cb -0.16 -0.34 -0.04 0.00 0.00 0.00 0.00 34.13 33.58 1lfp s GLU 83 CO 0.13 0.02 0.52 -1.21 0.02 0.00 0.00 175.26 174.74 1lfp s GLU 84 N -3.45 4.35 0.02 4.30 2.02 -1.26 -1.39 118.70 123.30 1lfp s GLU 84 Ca 0.10 0.53 0.05 0.00 0.02 0.00 0.00 54.97 55.67 1lfp s GLU 84 Cb 0.02 -3.44 -0.02 0.00 0.10 0.00 0.00 34.13 30.80 1lfp s GLU 84 CO -0.03 0.15 -0.16 0.54 0.02 0.00 0.00 175.26 175.78 1lfp s VAL 85 N 0.63 1.30 -0.21 2.63 0.11 0.10 -4.98 120.40 119.97 1lfp s VAL 85 Ca 0.28 -0.93 -0.04 0.00 -2.93 0.00 0.00 61.98 58.36 1lfp s VAL 85 Cb -0.16 -1.13 -0.02 0.00 -1.53 0.00 0.00 36.38 33.55 1lfp s VAL 85 CO 0.12 0.18 -0.02 -0.63 -3.33 0.00 0.00 175.10 171.42 1lfp s ILE 86 N -0.66 3.64 0.06 7.04 -1.09 -1.26 -1.01 121.20 127.92 1lfp s ILE 86 Ca 0.05 -0.41 0.02 0.00 -2.23 0.00 0.00 60.65 58.07 1lfp s ILE 86 Cb -0.07 -2.65 -0.04 0.00 -1.58 0.00 0.00 42.46 38.12 1lfp s ILE 86 CO 0.01 0.42 0.12 -0.31 -1.23 0.00 0.00 174.94 173.95 1lfp s TYR 87 N 1.24 3.30 -0.02 3.97 2.02 0.54 -4.92 117.35 123.50 1lfp s TYR 87 Ca 0.03 0.15 0.01 0.00 -0.37 0.00 0.00 57.07 56.89 1lfp s TYR 87 Cb -0.14 -1.68 0.01 0.00 -0.40 0.00 0.00 41.96 39.75 1lfp s TYR 87 CO -0.00 0.55 -0.02 -1.21 -1.57 0.00 0.00 175.55 173.30 1lfp s GLU 88 N -2.35 0.28 0.04 -0.62 2.02 -1.26 -0.65 118.70 116.16 1lfp s GLU 88 Ca 0.30 -0.02 -0.05 0.00 0.02 0.00 0.00 54.97 55.22 1lfp s GLU 88 Cb -0.12 -0.35 0.02 0.00 0.10 0.00 0.00 34.13 33.77 1lfp s GLU 88 CO 0.23 -0.03 0.23 0.41 0.02 0.00 0.00 175.26 176.13 1lfp n GLY 89 N 3.53 1.16 3.20 -1.39 0.00 -0.72 -0.84 105.19 110.15 1lfp n GLY 89 Ca -0.19 -0.98 -0.25 0.00 0.00 0.00 0.00 46.02 44.60 1lfp n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lfp s TYR 90 N -5.19 1.70 0.44 1.61 2.02 -0.54 -0.57 117.35 116.81 1lfp s TYR 90 Ca 0.05 -0.33 0.08 0.00 -0.37 0.00 0.00 57.07 56.50 1lfp s TYR 90 Cb -0.01 -1.07 0.01 0.00 -0.40 0.00 0.00 41.96 40.50 1lfp s TYR 90 CO 0.01 0.01 0.53 0.00 -1.57 0.00 0.00 175.55 174.53 1lfp s ALA 91 N -0.55 4.40 0.50 3.71 0.00 0.32 -0.23 121.76 129.90 1lfp s ALA 91 Ca 0.07 -1.78 -0.23 0.00 0.00 0.00 0.00 51.96 50.02 1lfp s ALA 91 Cb -0.08 -1.37 -0.06 0.00 0.00 0.00 0.00 23.12 21.60 1lfp s ALA 91 CO 0.00 -0.34 1.38 -1.25 0.00 0.00 0.00 175.76 175.55 1lfp s PRO 92 N -4.31 3.42 0.00 0.00 0.04 -1.26 -2.83 135.00 130.06 1lfp s PRO 92 Ca 0.53 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.86 1lfp s PRO 92 Cb -0.07 -2.45 0.00 0.00 0.04 0.00 0.00 34.50 32.02 1lfp s PRO 92 CO 0.32 -0.99 0.00 0.41 0.04 0.00 0.00 177.00 176.78 1lfp n GLY 93 N 0.65 0.77 2.22 0.56 0.00 -1.26 -4.05 105.19 104.09 1lfp n GLY 93 Ca 0.08 -0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.99 1lfp n GLY 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lfp n GLY 94 N -2.45 0.90 3.71 -0.02 0.00 -1.13 -4.98 105.19 101.22 1lfp n GLY 94 Ca 0.00 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.92 1lfp n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lfp s VAL 95 N -2.30 4.54 0.11 1.61 1.01 -1.16 -4.90 120.40 119.31 1lfp s VAL 95 Ca 0.00 1.85 -0.20 0.00 0.00 0.00 0.00 61.98 63.63 1lfp s VAL 95 Cb 0.00 -4.18 -0.07 0.00 0.00 0.00 0.00 36.38 32.13 1lfp s VAL 95 CO 0.00 0.16 0.62 0.00 0.00 0.00 0.00 175.10 175.88 1lfp s ALA 96 N 0.94 3.54 0.08 5.51 0.00 -1.26 -0.52 121.76 130.05 1lfp s ALA 96 Ca 0.54 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.61 1lfp s ALA 96 Cb -0.24 -2.71 -0.00 0.00 0.00 0.00 0.00 23.12 20.17 1lfp s ALA 96 CO 0.29 0.38 0.04 0.28 0.00 0.00 0.00 175.76 176.75 1lfp n VAL 97 N 1.52 0.00 -3.46 0.00 0.31 0.26 -2.18 118.33 114.77 1lfp n VAL 97 Ca -0.08 -0.51 0.02 0.00 -0.01 0.00 0.00 64.34 63.76 1lfp n VAL 97 Cb 0.50 0.21 -0.05 0.00 -0.91 0.00 0.00 33.84 33.59 1lfp n VAL 97 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1lfp s VAL 99 N -2.03 -0.12 -0.31 2.52 1.01 0.18 -1.75 120.40 119.90 1lfp s VAL 99 Ca 0.06 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.94 1lfp s VAL 99 Cb 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 36.38 35.37 1lfp s VAL 99 CO 0.04 0.00 0.17 -0.76 0.00 0.00 0.00 175.10 174.55 1lfp s LEU 100 N 1.67 4.16 0.21 3.92 1.02 0.02 -0.34 118.68 129.34 1lfp s LEU 100 Ca -0.05 -0.46 0.11 0.00 0.02 0.00 0.00 54.13 53.75 1lfp s LEU 100 Cb -0.03 -2.03 -0.04 0.00 0.02 0.00 0.00 46.19 44.11 1lfp s LEU 100 CO -0.14 -0.19 -0.21 0.00 0.02 0.00 0.00 176.35 175.83 1lfp s ALA 101 N 1.64 2.43 -0.20 4.21 0.00 -0.18 -0.61 121.76 129.05 1lfp s ALA 101 Ca 0.05 -1.66 -0.02 0.00 0.00 0.00 0.00 51.96 50.34 1lfp s ALA 101 Cb -0.17 -0.27 0.06 0.00 0.00 0.00 0.00 23.12 22.74 1lfp s ALA 101 CO 0.07 0.34 0.01 0.99 0.00 0.00 0.00 175.76 177.16 1lfp s THR 102 N -1.99 0.84 0.06 0.00 2.01 -0.11 -0.72 115.64 115.72 1lfp s THR 102 Ca 0.22 -0.75 0.01 0.00 0.31 0.00 0.00 61.69 61.47 1lfp s THR 102 Cb -0.06 -1.26 -0.03 0.00 0.01 0.00 0.00 72.50 71.15 1lfp s THR 102 CO 0.10 -0.16 -0.05 0.28 -0.69 0.00 0.00 174.62 174.09 1lfp s THR 103 N 1.72 0.44 -1.99 -0.82 -1.32 -0.48 -4.63 115.64 108.54 1lfp s THR 103 Ca -0.02 -1.59 0.19 0.00 -1.21 0.00 0.00 61.69 59.05 1lfp s THR 103 Cb -0.18 -1.23 0.34 0.00 -1.51 0.00 0.00 72.50 69.93 1lfp s THR 103 CO -0.07 -0.77 1.28 -0.90 -2.21 0.00 0.00 174.62 171.95 1lfp n ASP 104 N 0.52 3.11 -2.98 8.08 3.85 -1.26 -1.50 116.55 126.38 1lfp n ASP 104 Ca -0.16 -1.90 -0.09 0.00 -0.71 0.00 0.00 54.79 51.92 1lfp n ASP 104 Cb 0.59 -0.20 -0.02 0.00 -1.35 0.00 0.00 41.12 40.13 1lfp n ASP 104 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.20 176.40 1lfp s ASN 105 N -1.29 -0.67 0.26 -1.12 3.84 -1.26 -4.89 114.94 109.80 1lfp s ASN 105 Ca 0.31 -1.93 -0.04 0.00 0.21 0.00 0.00 52.86 51.41 1lfp s ASN 105 Cb 0.18 1.31 0.53 0.00 -0.55 0.00 0.00 41.25 42.73 1lfp s ASN 105 CO 0.26 -0.10 1.64 0.03 -2.79 0.00 0.00 177.10 176.14 1lfp h ARG 106 N 5.45 0.14 -0.94 0.43 3.08 -1.95 -1.13 114.38 119.46 1lfp h ARG 106 Ca 0.10 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.18 1lfp h ARG 106 Cb 1.07 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 31.03 1lfp h ARG 106 CO 0.11 0.10 0.61 -0.97 -1.07 0.00 0.00 179.97 178.75 1lfp h ASN 107 N 0.15 1.02 0.34 7.04 -1.24 -1.99 0.17 115.58 121.06 1lfp h ASN 107 Ca 0.46 -0.01 -0.02 0.00 0.71 0.00 0.00 56.30 57.45 1lfp h ASN 107 Cb 0.85 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 39.67 1lfp h ASN 107 CO -0.66 0.69 -0.16 -0.09 -1.29 0.00 0.00 177.43 175.92 1lfp h ARG 108 N 1.18 -0.44 -0.77 6.67 2.43 -1.67 -2.27 114.38 119.51 1lfp h ARG 108 Ca 0.38 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.61 1lfp h ARG 108 Cb 0.02 0.10 -0.05 0.00 -0.42 0.00 0.00 29.97 29.62 1lfp h ARG 108 CO -0.13 -0.18 0.49 1.15 -1.51 0.00 0.00 179.97 179.79 1lfp h THR 109 N -0.65 1.11 -0.77 0.20 2.02 -1.08 -1.47 112.91 112.27 1lfp h THR 109 Ca -0.05 -0.33 0.03 0.00 0.77 0.00 0.00 66.41 66.84 1lfp h THR 109 Cb 0.46 0.08 -0.05 0.00 -1.74 0.00 0.00 68.15 66.90 1lfp h THR 109 CO 0.08 0.17 0.48 0.74 0.37 0.00 0.00 175.52 177.36 1lfp h THR 110 N 0.95 1.10 -0.53 3.16 2.02 -0.58 0.75 112.91 119.78 1lfp h THR 110 Ca 0.31 -0.32 -0.12 0.00 0.77 0.00 0.00 66.41 67.04 1lfp h THR 110 Cb 0.01 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.49 1lfp h THR 110 CO -0.11 0.17 -0.14 -1.28 0.37 0.00 0.00 175.52 174.53 1lfp h SER 111 N 0.94 1.04 -0.79 4.18 0.87 -0.92 0.19 113.55 119.06 1lfp h SER 111 Ca 0.31 -0.36 -0.02 0.00 -1.23 0.00 0.00 61.79 60.48 1lfp h SER 111 Cb 0.03 -0.29 -0.04 0.00 -0.44 0.00 0.00 62.40 61.67 1lfp h SER 111 CO -0.12 1.17 0.40 -0.33 -0.53 0.00 0.00 176.83 177.42 1lfp h GLU 112 N 0.91 1.12 -0.25 2.24 5.08 -0.49 0.24 114.58 123.43 1lfp h GLU 112 Ca 0.13 -0.15 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 1lfp h GLU 112 Cb 0.72 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1lfp h GLU 112 CO 0.06 0.85 -0.36 0.28 -1.00 0.00 0.00 179.01 178.83 1lfp h VAL 113 N 1.11 1.31 -0.49 3.13 2.07 -0.61 -1.10 116.25 121.67 1lfp h VAL 113 Ca 0.27 -1.56 0.02 0.00 0.82 0.00 0.00 66.70 66.25 1lfp h VAL 113 Cb 0.08 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 1lfp h VAL 113 CO -0.04 0.49 0.29 -0.09 0.02 0.00 0.00 177.57 178.25 1lfp h ARG 114 N 0.41 0.57 -0.38 1.57 2.43 -0.40 -0.29 114.38 118.28 1lfp h ARG 114 Ca 0.03 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1lfp h ARG 114 Cb 0.95 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.35 1lfp h ARG 114 CO 0.08 0.38 0.25 0.45 -1.51 0.00 0.00 179.97 179.62 1lfp h HIS 115 N 0.59 0.47 -0.39 2.20 3.86 -0.74 -1.41 115.15 119.72 1lfp h HIS 115 Ca 0.19 0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.44 1lfp h HIS 115 Cb 0.01 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.29 1lfp h HIS 115 CO -0.06 0.29 0.20 0.28 0.86 0.00 0.00 177.93 179.50 1lfp h VAL 116 N 0.51 0.99 0.12 2.45 2.07 -0.50 -0.94 116.25 120.94 1lfp h VAL 116 Ca 0.14 -0.14 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1lfp h VAL 116 Cb -0.04 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 1lfp h VAL 116 CO -0.04 0.08 -0.14 -0.26 0.02 0.00 0.00 177.57 177.22 1lfp h PHE 117 N 0.41 -0.37 -0.25 1.57 0.04 -0.60 -2.88 116.94 114.86 1lfp h PHE 117 Ca 0.17 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.97 1lfp h PHE 117 Cb 0.06 0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 1lfp h PHE 117 CO -0.10 -0.22 0.06 1.15 -0.60 0.00 0.00 178.31 178.61 1lfp h THR 118 N -0.30 0.90 -0.91 -1.55 2.02 -1.09 0.46 112.91 112.43 1lfp h THR 118 Ca 0.01 -0.06 0.15 0.00 0.77 0.00 0.00 66.41 67.29 1lfp h THR 118 Cb 0.30 0.72 -0.08 0.00 -1.74 0.00 0.00 68.15 67.36 1lfp h THR 118 CO -0.06 0.03 0.59 0.11 0.37 0.00 0.00 175.52 176.56 1lfp h LYS 119 N 0.16 0.67 -0.65 6.66 6.56 -1.13 -0.82 116.57 128.03 1lfp h LYS 119 Ca 0.11 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.66 1lfp h LYS 119 Cb 0.10 -0.15 0.00 0.00 -0.57 0.00 0.00 32.23 31.61 1lfp h LYS 119 CO -0.14 0.45 0.00 0.72 -2.06 0.00 0.00 179.45 178.42 1lfp n HIS 120 N -4.58 1.48 -0.99 -1.35 8.25 -1.03 -4.91 115.22 112.08 1lfp n HIS 120 Ca 0.18 -0.54 0.00 0.00 -0.26 0.00 0.00 57.72 57.10 1lfp n HIS 120 Cb 0.50 -0.32 0.00 0.00 1.12 0.00 0.00 29.99 31.28 1lfp n HIS 120 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lfp n GLY 121 N 0.77 0.45 0.00 -1.41 0.00 -0.31 -4.65 105.19 100.03 1lfp n GLY 121 Ca 0.22 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1lfp n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lfp n GLY 122 N -2.99 2.39 3.45 -0.02 0.00 0.16 -4.05 105.19 104.13 1lfp n GLY 122 Ca 0.00 -2.09 -0.01 0.00 0.00 0.00 0.00 46.02 43.91 1lfp n GLY 122 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1lfp s ASN 123 N -0.89 -1.03 0.16 1.61 3.04 0.68 -3.80 114.94 114.71 1lfp s ASN 123 Ca 0.00 1.28 -0.30 0.00 0.04 0.00 0.00 52.86 53.88 1lfp s ASN 123 Cb 0.00 2.10 -0.08 0.00 -1.54 0.00 0.00 41.25 41.73 1lfp s ASN 123 CO 0.00 -0.23 1.27 -0.22 -3.04 0.00 0.00 177.10 174.88 1lfp s LEU 124 N 2.84 4.41 0.00 3.21 2.96 -1.26 -1.47 118.68 129.36 1lfp s LEU 124 Ca 0.02 2.28 0.00 0.00 -0.22 0.00 0.00 54.13 56.21 1lfp s LEU 124 Cb -0.13 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.96 1lfp s LEU 124 CO -0.18 -0.50 0.00 0.61 -1.32 0.00 0.00 176.35 174.96 1lfp n GLY 125 N 2.64 3.85 3.95 7.98 0.00 -0.02 -4.94 105.19 118.65 1lfp n GLY 125 Ca 0.07 -2.13 -0.23 0.00 0.00 0.00 0.00 46.02 43.73 1lfp n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lfp s ALA 126 N -2.00 3.77 0.08 4.61 0.00 -1.26 -4.58 121.76 122.38 1lfp s ALA 126 Ca 0.00 -1.04 -0.35 0.00 0.00 0.00 0.00 51.96 50.57 1lfp s ALA 126 Cb 0.00 -2.11 -0.15 0.00 0.00 0.00 0.00 23.12 20.86 1lfp s ALA 126 CO 0.00 -0.28 1.55 0.43 0.00 0.00 0.00 175.76 177.46 1lfp n SER 127 N -2.00 2.65 0.00 0.00 7.64 -1.26 -1.74 113.62 118.92 1lfp n SER 127 Ca 0.00 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.96 1lfp n SER 127 Cb 0.57 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.44 1lfp n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1lfp n GLY 128 N 3.31 0.75 0.15 0.23 0.00 -1.26 -4.95 105.19 103.42 1lfp n GLY 128 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.34 1lfp n GLY 128 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lfp n VAL 130 N -2.39 0.00 0.29 0.00 0.31 -1.26 -4.91 118.33 110.36 1lfp n VAL 130 Ca 0.02 -0.09 0.14 0.00 -0.01 0.00 0.00 64.34 64.40 1lfp n VAL 130 Cb 0.28 0.89 0.85 0.00 -0.91 0.00 0.00 33.84 34.96 1lfp n VAL 130 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1lfp h SER 131 N 0.00 0.00 0.29 4.52 4.64 -1.95 0.90 113.55 121.95 1lfp h SER 131 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1lfp h SER 131 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1lfp h SER 131 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1lfp n TYR 132 N -4.00 0.00 0.54 4.77 4.11 -1.26 -1.48 117.16 119.84 1lfp n TYR 132 Ca -0.03 0.00 0.11 0.00 -0.00 0.00 0.00 57.90 57.98 1lfp n TYR 132 Cb 0.09 -0.49 0.27 0.00 -0.00 0.00 0.00 39.34 39.21 1lfp n TYR 132 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.86 178.14 1lfp n LEU 133 N -1.49 2.83 -4.18 -3.48 4.77 0.31 -4.95 117.00 110.81 1lfp n LEU 133 Ca 0.02 -1.27 -0.11 0.00 -0.03 0.00 0.00 56.01 54.62 1lfp n LEU 133 Cb 0.10 -0.25 -0.10 0.00 -2.33 0.00 0.00 43.42 40.84 1lfp n LEU 133 CO 0.08 0.64 -0.30 -0.36 -1.33 0.00 0.00 177.39 176.12 1lfp s PHE 134 N -1.51 1.01 0.01 -1.77 0.08 -0.55 -1.07 117.98 114.18 1lfp s PHE 134 Ca 0.37 -1.19 0.04 0.00 0.12 0.00 0.00 56.93 56.27 1lfp s PHE 134 Cb 0.20 -0.56 -0.01 0.00 -0.57 0.00 0.00 43.02 42.08 1lfp s PHE 134 CO 0.28 -0.44 -0.13 -1.21 -0.10 0.00 0.00 175.22 173.63 1lfp s GLU 135 N -4.02 0.95 0.02 0.44 2.02 -0.02 -4.85 118.70 113.25 1lfp s GLU 135 Ca 0.26 -0.58 -0.30 0.00 0.02 0.00 0.00 54.97 54.36 1lfp s GLU 135 Cb 0.07 -0.93 -0.05 0.00 0.10 0.00 0.00 34.13 33.32 1lfp s GLU 135 CO 0.04 0.24 1.22 0.50 0.02 0.00 0.00 175.26 177.28 1lfp s ARG 136 N -0.69 4.40 0.06 1.61 3.52 -1.26 -0.24 118.95 126.34 1lfp s ARG 136 Ca 0.03 1.76 -0.03 0.00 -0.13 0.00 0.00 55.73 57.36 1lfp s ARG 136 Cb -0.06 -3.42 -0.03 0.00 -1.56 0.00 0.00 34.95 29.87 1lfp s ARG 136 CO 0.00 -0.34 0.03 0.15 -0.81 0.00 0.00 175.30 174.33 1lfp s LYS 137 N 1.50 0.66 0.40 5.12 -0.14 0.24 -4.39 119.74 123.12 1lfp s LYS 137 Ca 0.58 -1.13 -0.23 0.00 -1.36 0.00 0.00 55.97 53.84 1lfp s LYS 137 Cb -0.28 0.24 -0.11 0.00 -1.68 0.00 0.00 37.83 36.00 1lfp s LYS 137 CO 0.27 -0.15 0.95 0.20 -0.76 0.00 0.00 175.35 175.86 1lfp s GLY 138 N -2.84 2.52 -0.05 -3.33 0.00 0.11 -0.19 107.32 103.54 1lfp s GLY 138 Ca 0.06 0.44 0.00 0.00 0.00 0.00 0.00 44.72 45.21 1lfp s GLY 138 CO -0.10 0.77 -0.02 -0.47 0.00 0.00 0.00 173.10 173.28 1lfp s TYR 139 N -2.00 0.65 -0.06 1.90 6.14 0.12 -0.77 117.35 123.34 1lfp s TYR 139 Ca 0.58 -0.16 0.04 0.00 0.64 0.00 0.00 57.07 58.17 1lfp s TYR 139 Cb -0.12 -0.66 0.00 0.00 0.42 0.00 0.00 41.96 41.60 1lfp s TYR 139 CO 0.16 -0.22 -0.17 0.42 0.64 0.00 0.00 175.55 176.38 1lfp s ILE 140 N 1.26 1.48 -0.08 3.14 1.01 0.53 -0.77 121.20 127.77 1lfp s ILE 140 Ca -0.06 -0.72 0.01 0.00 0.00 0.00 0.00 60.65 59.89 1lfp s ILE 140 Cb -0.14 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 1lfp s ILE 140 CO -0.02 0.43 -0.10 -1.61 0.00 0.00 0.00 174.94 173.64 1lfp s GLU 141 N 0.26 2.85 -0.04 2.79 2.02 0.14 -0.64 118.70 126.09 1lfp s GLU 141 Ca -0.10 -0.61 0.01 0.00 0.02 0.00 0.00 54.97 54.30 1lfp s GLU 141 Cb -0.14 -2.57 0.02 0.00 0.10 0.00 0.00 34.13 31.54 1lfp s GLU 141 CO 0.04 0.55 -0.05 0.54 0.02 0.00 0.00 175.26 176.36 1lfp s VAL 142 N -0.52 0.56 0.04 2.63 0.11 -0.67 0.02 120.40 122.58 1lfp s VAL 142 Ca 0.07 -0.15 -0.30 0.00 -2.93 0.00 0.00 61.98 58.67 1lfp s VAL 142 Cb -0.12 -0.57 -0.09 0.00 -1.53 0.00 0.00 36.38 34.06 1lfp s VAL 142 CO 0.02 0.23 1.95 -0.81 -3.33 0.00 0.00 175.10 173.15 1lfp n PRO 143 N 3.96 2.83 0.05 1.54 -0.04 -1.26 -0.72 135.00 141.35 1lfp n PRO 143 Ca -0.25 1.04 -0.12 0.00 -0.04 0.00 0.00 63.50 64.12 1lfp n PRO 143 Cb 0.51 -2.98 -0.07 0.00 -0.04 0.00 0.00 33.50 30.92 1lfp n PRO 143 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1lfp h ALA 144 N 10.20 -0.02 -1.12 0.55 0.00 -1.54 -2.72 119.26 124.61 1lfp h ALA 144 Ca -0.49 -0.01 0.37 0.00 0.00 0.00 0.00 54.91 54.78 1lfp h ALA 144 Cb 1.24 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 18.90 1lfp h ALA 144 CO 0.94 -0.51 0.68 0.87 0.00 0.00 0.00 179.25 181.23 1lfp h LYS 145 N -0.03 0.19 -0.01 0.00 1.57 -1.87 0.09 116.57 116.52 1lfp h LYS 145 Ca -0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1lfp h LYS 145 Cb 0.02 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1lfp h LYS 145 CO 0.00 0.12 -0.38 0.39 -0.57 0.00 0.00 179.45 179.02 1lfp n GLU 146 N -4.91 0.62 0.00 3.15 -0.58 -1.03 -4.96 120.64 112.93 1lfp n GLU 146 Ca 0.34 -0.39 0.00 0.00 -0.42 0.00 0.00 57.16 56.69 1lfp n GLU 146 Cb 1.18 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 30.56 1lfp n GLU 146 CO 0.00 0.00 0.00 1.33 -0.48 0.00 0.00 177.13 177.98 1lfp n VAL 147 N -0.85 0.00 -3.71 2.62 0.24 0.02 -5.00 118.33 111.65 1lfp n VAL 147 Ca 0.10 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.28 1lfp n VAL 147 Cb 0.36 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.66 1lfp n VAL 147 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1lfp s SER 148 N 1.00 -0.17 0.05 -1.34 0.01 -1.26 -4.99 113.70 107.00 1lfp s SER 148 Ca 0.00 -0.19 -0.23 0.00 1.31 0.00 0.00 55.95 56.84 1lfp s SER 148 Cb 0.00 0.40 -0.16 0.00 0.21 0.00 0.00 66.02 66.47 1lfp s SER 148 CO 0.00 -0.68 1.56 -0.33 0.41 0.00 0.00 173.24 174.20 1lfp h GLU 149 N 2.97 0.06 0.68 12.44 3.07 -1.98 -2.57 114.58 129.24 1lfp h GLU 149 Ca -0.32 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.49 1lfp h GLU 149 Cb 1.21 -0.01 0.01 0.00 -0.84 0.00 0.00 28.75 29.12 1lfp h GLU 149 CO 0.46 0.23 -0.33 1.49 -1.40 0.00 0.00 179.01 179.47 1lfp h GLU 150 N -0.13 -0.88 -0.58 2.33 4.81 -1.99 -0.40 114.58 117.75 1lfp h GLU 150 Ca 0.01 0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.34 1lfp h GLU 150 Cb 0.20 0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 1lfp h GLU 150 CO -0.00 -0.57 0.33 1.49 -0.73 0.00 0.00 179.01 179.53 1lfp h GLU 151 N -0.98 0.61 -0.39 1.92 4.81 -1.97 -1.75 114.58 116.83 1lfp h GLU 151 Ca -0.09 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.00 1lfp h GLU 151 Cb 0.72 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 1lfp h GLU 151 CO 0.15 0.40 -0.14 1.25 -0.73 0.00 0.00 179.01 179.95 1lfp h LEU 152 N 0.63 0.80 -0.83 1.64 5.85 -1.47 -0.93 115.31 121.00 1lfp h LEU 152 Ca 0.25 -0.39 0.05 0.00 0.84 0.00 0.00 57.88 58.63 1lfp h LEU 152 Cb 0.10 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 40.86 1lfp h LEU 152 CO -0.14 1.00 0.52 -0.07 -0.34 0.00 0.00 178.44 179.41 1lfp h LEU 153 N 0.58 0.82 -0.17 2.25 4.07 -0.77 0.66 115.31 122.76 1lfp h LEU 153 Ca 0.09 0.01 -0.04 0.00 0.08 0.00 0.00 57.88 58.02 1lfp h LEU 153 Cb 0.68 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 42.25 1lfp h LEU 153 CO 0.05 0.54 -0.05 1.05 -1.08 0.00 0.00 178.44 178.95 1lfp h GLU 154 N 0.96 0.34 -0.72 1.13 4.11 -1.11 -2.90 114.58 116.40 1lfp h GLU 154 Ca 0.35 -0.13 -0.01 0.00 0.07 0.00 0.00 59.36 59.64 1lfp h GLU 154 Cb 0.11 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1lfp h GLU 154 CO -0.15 0.62 0.41 0.87 0.07 0.00 0.00 179.01 180.83 1lfp h LYS 155 N 0.03 0.98 -0.51 1.06 1.57 -0.63 0.17 116.57 119.24 1lfp h LYS 155 Ca 0.04 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1lfp h LYS 155 Cb 0.50 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.58 1lfp h LYS 155 CO 0.02 0.70 0.33 0.00 -0.57 0.00 0.00 179.45 179.93 1lfp h ALA 156 N 1.46 0.65 -0.48 3.86 0.00 -0.82 -0.07 119.26 123.87 1lfp h ALA 156 Ca 0.26 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 1lfp h ALA 156 Cb -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1lfp h ALA 156 CO -0.05 0.07 0.05 0.82 0.00 0.00 0.00 179.25 180.14 1lfp h ILE 157 N 0.67 1.26 -0.77 0.00 2.04 -1.21 -1.53 117.51 117.96 1lfp h ILE 157 Ca 0.19 -0.98 0.03 0.00 1.00 0.00 0.00 64.86 65.10 1lfp h ILE 157 Cb -0.05 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 1lfp h ILE 157 CO -0.06 0.35 0.51 -0.08 0.00 0.00 0.00 178.15 178.87 1lfp h GLU 158 N 0.69 0.92 0.00 2.37 4.81 0.01 -1.18 114.58 122.19 1lfp h GLU 158 Ca 0.14 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1lfp h GLU 158 Cb 0.44 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1lfp h GLU 158 CO 0.02 0.61 -0.34 0.28 -0.73 0.00 0.00 179.01 178.84 1lfp h VAL 159 N 0.95 0.00 -0.29 0.32 2.07 -0.79 -3.48 116.25 115.03 1lfp h VAL 159 Ca 0.31 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 67.06 1lfp h VAL 159 Cb 0.04 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1lfp h VAL 159 CO -0.09 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.11 1lfp n GLY 160 N 1.22 0.86 3.73 2.17 0.00 -0.45 -4.99 105.19 107.72 1lfp n GLY 160 Ca 0.03 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 1lfp n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lfp s ALA 161 N -2.02 1.73 -0.00 4.61 0.00 -0.83 -4.97 121.76 120.27 1lfp s ALA 161 Ca 0.00 0.06 -0.05 0.00 0.00 0.00 0.00 51.96 51.97 1lfp s ALA 161 Cb 0.00 -3.23 -0.29 0.00 0.00 0.00 0.00 23.12 19.61 1lfp s ALA 161 CO 0.00 -2.21 0.84 1.49 0.00 0.00 0.00 175.76 175.88 1lfp h GLU 162 N -1.45 0.29 -1.70 0.00 4.57 -1.40 -3.49 114.58 111.41 1lfp h GLU 162 Ca -0.48 -0.50 0.04 0.00 -1.18 0.00 0.00 59.36 57.24 1lfp h GLU 162 Cb 1.27 0.18 -0.23 0.00 -0.16 0.00 0.00 28.75 29.81 1lfp h GLU 162 CO 0.53 1.17 0.40 0.34 -1.18 0.00 0.00 179.01 180.27 1lfp s ASP 163 N -7.07 -0.49 -0.01 1.04 3.68 -1.16 -4.98 116.67 107.67 1lfp s ASP 163 Ca -0.10 0.77 0.02 0.00 2.13 0.00 0.00 52.55 55.38 1lfp s ASP 163 Cb 0.06 0.72 -0.00 0.00 -1.45 0.00 0.00 42.92 42.25 1lfp s ASP 163 CO 0.86 -0.29 -0.07 0.68 0.13 0.00 0.00 175.17 176.48 1lfp s VAL 164 N -0.38 0.59 -0.11 1.11 -7.23 -1.26 -0.84 120.40 112.28 1lfp s VAL 164 Ca -0.01 -0.31 -0.03 0.00 -1.81 0.00 0.00 61.98 59.82 1lfp s VAL 164 Cb -0.03 -0.51 0.05 0.00 0.56 0.00 0.00 36.38 36.45 1lfp s VAL 164 CO -0.00 0.17 0.07 0.00 -0.31 0.00 0.00 175.10 175.03 1lfp s GLN 165 N -0.09 0.06 0.97 4.82 -2.07 -0.59 -5.02 119.66 117.74 1lfp s GLN 165 Ca 0.02 0.11 -0.11 0.00 -1.82 0.00 0.00 55.36 53.56 1lfp s GLN 165 Cb -0.04 -1.24 0.18 0.00 -1.09 0.00 0.00 33.01 30.82 1lfp s GLN 165 CO -0.00 -0.50 1.12 -2.14 -1.32 0.00 0.00 175.29 172.45 1lfp s PRO 166 N 2.13 0.57 0.08 9.60 0.02 -1.26 -1.76 135.00 144.37 1lfp s PRO 166 Ca 0.03 1.43 -0.04 0.00 0.02 0.00 0.00 61.00 62.44 1lfp s PRO 166 Cb -0.14 -1.68 -0.02 0.00 0.02 0.00 0.00 34.50 32.67 1lfp s PRO 166 CO -0.06 -2.90 0.08 0.20 -0.33 0.00 0.00 177.00 173.99 1lfp s GLY 167 N -2.60 0.37 0.26 0.52 0.00 -0.84 -4.75 107.32 100.28 1lfp s GLY 167 Ca 0.67 -0.99 0.13 0.00 0.00 0.00 0.00 44.72 44.54 1lfp s GLY 167 CO 0.59 -1.10 1.51 0.83 0.00 0.00 0.00 173.10 174.93 1lfp h GLU 168 N 2.93 0.00 0.00 2.90 4.39 -1.96 -3.37 114.58 119.47 1lfp h GLU 168 Ca -0.34 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.36 1lfp h GLU 168 Cb 1.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 1lfp h GLU 168 CO 0.61 0.62 -0.92 -0.85 -1.16 0.00 0.00 179.01 177.30 1lfp n GLU 169 N -3.43 1.67 -3.91 2.33 0.28 -1.26 -4.80 120.64 111.52 1lfp n GLU 169 Ca 0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 57.16 56.90 1lfp n GLU 169 Cb 0.71 -0.96 -0.11 0.00 1.43 0.00 0.00 31.44 32.51 1lfp n GLU 169 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1lfp s VAL 170 N -1.92 0.08 -0.03 3.84 0.11 -1.26 -1.35 120.40 119.87 1lfp s VAL 170 Ca 0.00 -0.62 -0.02 0.00 -2.93 0.00 0.00 61.98 58.41 1lfp s VAL 170 Cb 0.00 -0.29 -0.04 0.00 -1.53 0.00 0.00 36.38 34.52 1lfp s VAL 170 CO 0.00 -0.34 0.10 -1.00 -3.33 0.00 0.00 175.10 170.53 1lfp s HIS 171 N -1.09 3.38 -0.08 1.54 3.76 0.10 -1.99 115.29 120.91 1lfp s HIS 171 Ca -0.12 0.29 0.04 0.00 -0.15 0.00 0.00 55.06 55.12 1lfp s HIS 171 Cb -0.07 -1.79 -0.01 0.00 1.11 0.00 0.00 32.58 31.82 1lfp s HIS 171 CO 0.00 0.59 -0.20 0.42 -0.85 0.00 0.00 174.74 174.70 1lfp s ILE 172 N -1.17 2.45 -0.09 0.60 1.01 -0.72 -1.66 121.20 121.62 1lfp s ILE 172 Ca 0.22 -0.91 0.03 0.00 0.00 0.00 0.00 60.65 59.98 1lfp s ILE 172 Cb -0.12 -1.95 0.01 0.00 0.01 0.00 0.00 42.46 40.41 1lfp s ILE 172 CO 0.12 0.56 -0.17 -0.63 0.00 0.00 0.00 174.94 174.82 1lfp s ILE 173 N -0.02 1.56 0.04 2.92 1.01 0.19 -1.55 121.20 125.35 1lfp s ILE 173 Ca -0.06 -0.71 0.02 0.00 0.00 0.00 0.00 60.65 59.90 1lfp s ILE 173 Cb -0.15 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1lfp s ILE 173 CO 0.05 0.45 0.07 -0.31 0.00 0.00 0.00 174.94 175.20 1lfp s TYR 174 N 0.69 3.21 0.25 3.97 2.02 -0.02 -0.34 117.35 127.13 1lfp s TYR 174 Ca -0.13 0.12 0.01 0.00 -0.37 0.00 0.00 57.07 56.71 1lfp s TYR 174 Cb -0.16 -1.67 -0.04 0.00 -0.40 0.00 0.00 41.96 39.69 1lfp s TYR 174 CO 0.03 0.53 0.14 0.95 -1.57 0.00 0.00 175.55 175.62 1lfp s THR 175 N -1.29 0.23 0.20 -0.71 -4.23 0.05 -0.98 115.64 108.92 1lfp s THR 175 Ca 0.26 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.47 1lfp s THR 175 Cb -0.12 -2.54 -0.09 0.00 1.34 0.00 0.00 72.50 71.08 1lfp s THR 175 CO 0.18 0.00 1.42 -0.69 -0.54 0.00 0.00 174.62 174.99 1lfp s VAL 176 N -3.87 2.91 0.26 2.29 1.01 -1.26 -0.71 120.40 121.03 1lfp s VAL 176 Ca 0.38 0.72 -0.02 0.00 0.00 0.00 0.00 61.98 63.06 1lfp s VAL 176 Cb 0.06 -3.46 0.24 0.00 0.00 0.00 0.00 36.38 33.22 1lfp s VAL 176 CO 0.15 0.09 1.78 1.55 0.00 0.00 0.00 175.10 178.67 1lfp h PRO 177 N 5.74 0.67 0.00 2.72 0.13 -1.86 0.46 132.00 139.86 1lfp h PRO 177 Ca -0.44 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1lfp h PRO 177 Cb 1.21 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1lfp h PRO 177 CO 0.81 0.44 0.00 0.39 -0.23 0.00 0.00 178.00 179.42 1lfp n GLU 178 N -4.82 0.08 -0.34 0.86 4.71 -1.26 -2.45 120.64 117.41 1lfp n GLU 178 Ca 0.16 0.40 0.07 0.00 -0.01 0.00 0.00 57.16 57.79 1lfp n GLU 178 Cb 0.39 -1.69 0.22 0.00 -1.01 0.00 0.00 31.44 29.35 1lfp n GLU 178 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1lfp n GLU 179 N -1.85 2.96 -0.05 3.49 1.02 0.14 -4.72 120.64 121.64 1lfp n GLU 179 Ca 0.02 -2.52 -0.08 0.00 -0.02 0.00 0.00 57.16 54.56 1lfp n GLU 179 Cb 0.14 -1.61 -0.02 0.00 -0.02 0.00 0.00 31.44 29.93 1lfp n GLU 179 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1lfp h LEU 180 N 1.99 -0.13 -0.42 -4.62 5.85 -1.35 -0.61 115.31 116.02 1lfp h LEU 180 Ca 0.00 0.05 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 1lfp h LEU 180 Cb 1.16 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 1lfp h LEU 180 CO 0.13 -0.04 -0.33 1.88 -0.34 0.00 0.00 178.44 179.75 1lfp h TYR 181 N 0.04 0.00 -0.16 1.25 0.05 -1.85 -1.65 116.97 114.65 1lfp h TYR 181 Ca 0.10 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.71 1lfp h TYR 181 Cb 0.14 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.89 1lfp h TYR 181 CO -0.20 0.33 -0.59 1.49 -1.05 0.00 0.00 178.16 178.15 1lfp h GLU 182 N 0.00 0.68 -0.40 4.88 4.81 -1.82 -1.17 114.58 121.57 1lfp h GLU 182 Ca -0.00 -0.52 -0.09 0.00 -0.13 0.00 0.00 59.36 58.62 1lfp h GLU 182 Cb 1.09 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 1lfp h GLU 182 CO 0.04 1.14 -0.10 0.28 -0.73 0.00 0.00 179.01 179.64 1lfp h VAL 183 N 0.37 1.28 -0.29 0.32 2.07 -1.01 -1.73 116.25 117.25 1lfp h VAL 183 Ca -0.03 -1.19 0.05 0.00 0.82 0.00 0.00 66.70 66.35 1lfp h VAL 183 Cb 1.21 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 1lfp h VAL 183 CO 0.12 0.40 0.01 0.50 0.02 0.00 0.00 177.57 178.63 1lfp h LYS 184 N 0.59 0.10 -0.27 1.57 3.64 -1.25 0.09 116.57 121.04 1lfp h LYS 184 Ca 0.10 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1lfp h LYS 184 Cb 0.63 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.40 1lfp h LYS 184 CO 0.04 0.07 0.13 1.49 -2.27 0.00 0.00 179.45 178.91 1lfp h GLU 185 N 0.11 0.27 -0.15 1.90 4.57 -1.11 -0.31 114.58 119.85 1lfp h GLU 185 Ca 0.14 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.25 1lfp h GLU 185 Cb 0.18 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 1lfp h GLU 185 CO -0.22 0.18 -0.16 -0.91 -1.18 0.00 0.00 179.01 176.72 1lfp h ASN 186 N 0.27 0.23 -0.12 1.04 -0.26 -0.83 -0.40 115.58 115.52 1lfp h ASN 186 Ca 0.11 -0.05 -0.20 0.00 -0.56 0.00 0.00 56.30 55.61 1lfp h ASN 186 Cb 0.04 -0.06 0.01 0.00 -1.06 0.00 0.00 38.32 37.25 1lfp h ASN 186 CO -0.09 0.41 -0.70 -0.07 -1.06 0.00 0.00 177.43 175.93 1lfp h LEU 187 N 0.23 0.81 -0.91 1.61 3.38 -0.50 -2.97 115.31 116.97 1lfp h LEU 187 Ca 0.04 -0.65 -0.11 0.00 0.09 0.00 0.00 57.88 57.25 1lfp h LEU 187 Cb 0.42 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1lfp h LEU 187 CO 0.03 1.33 -0.43 1.05 0.09 0.00 0.00 178.44 180.52 1lfp h GLU 188 N 0.35 0.26 0.00 1.13 4.11 -0.75 -1.61 114.58 118.06 1lfp h GLU 188 Ca -0.05 -0.13 0.00 0.00 0.07 0.00 0.00 59.36 59.25 1lfp h GLU 188 Cb 1.34 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1lfp h GLU 188 CO 0.14 0.64 0.00 -0.22 0.07 0.00 0.00 179.01 179.64 1lfp h LYS 189 N 0.21 0.00 -0.54 1.06 3.64 -1.05 0.04 116.57 119.93 1lfp h LYS 189 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.40 1lfp h LYS 189 Cb 0.84 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1lfp h LYS 189 CO 0.07 0.00 0.00 1.28 -2.27 0.00 0.00 179.45 178.53 1lfp n LEU 190 N -2.31 3.53 0.00 5.20 4.77 -0.81 -4.98 117.00 122.40 1lfp n LEU 190 Ca -0.00 -2.04 0.00 0.00 -0.03 0.00 0.00 56.01 53.94 1lfp n LEU 190 Cb 0.12 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1lfp n LEU 190 CO 0.15 0.86 0.00 0.61 -1.33 0.00 0.00 177.39 177.67 1lfp n GLY 191 N 1.05 0.78 3.68 -0.72 0.00 0.00 -5.05 105.19 104.93 1lfp n GLY 191 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1lfp n GLY 191 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lfp s VAL 192 N -2.83 4.70 0.30 1.61 1.01 -0.67 -4.99 120.40 119.54 1lfp s VAL 192 Ca 0.00 2.00 -0.28 0.00 0.00 0.00 0.00 61.98 63.70 1lfp s VAL 192 Cb 0.00 -4.29 -0.09 0.00 0.00 0.00 0.00 36.38 31.99 1lfp s VAL 192 CO 0.00 -0.08 1.11 -2.16 0.00 0.00 0.00 175.10 173.97 1lfp s PRO 193 N 2.56 4.53 -0.18 2.72 0.04 -1.26 -3.94 135.00 139.46 1lfp s PRO 193 Ca 0.47 1.79 -0.03 0.00 0.04 0.00 0.00 61.00 63.27 1lfp s PRO 193 Cb -0.17 -3.07 -0.02 0.00 0.04 0.00 0.00 34.50 31.28 1lfp s PRO 193 CO 0.13 0.12 -0.05 0.42 0.04 0.00 0.00 177.00 177.65 1lfp s ILE 194 N -1.24 3.48 -0.12 0.56 -1.09 -1.26 -4.37 121.20 117.16 1lfp s ILE 194 Ca 0.47 -0.48 -0.08 0.00 -2.23 0.00 0.00 60.65 58.33 1lfp s ILE 194 Cb -0.31 -2.55 -0.26 0.00 -1.58 0.00 0.00 42.46 37.76 1lfp s ILE 194 CO 0.40 0.46 0.37 1.21 -1.23 0.00 0.00 174.94 176.14 1lfp n GLU 195 N 4.19 0.75 -3.74 2.79 2.13 0.10 -4.97 120.64 121.90 1lfp n GLU 195 Ca -0.18 0.28 -0.13 0.00 0.66 0.00 0.00 57.16 57.79 1lfp n GLU 195 Cb 0.52 -1.71 -0.09 0.00 0.27 0.00 0.00 31.44 30.42 1lfp n GLU 195 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 1lfp s LYS 196 N -2.55 0.62 -0.17 5.31 1.02 -1.15 -4.95 119.74 117.87 1lfp s LYS 196 Ca -0.23 0.04 -0.04 0.00 0.02 0.00 0.00 55.97 55.77 1lfp s LYS 196 Cb 0.07 0.28 0.08 0.00 -0.52 0.00 0.00 37.83 37.73 1lfp s LYS 196 CO 0.76 -0.15 0.18 0.00 -0.92 0.00 0.00 175.35 175.22 1lfp s ALA 197 N -0.87 -0.09 0.25 5.17 0.00 -1.25 0.28 121.76 125.25 1lfp s ALA 197 Ca -0.09 0.18 -0.18 0.00 0.00 0.00 0.00 51.96 51.87 1lfp s ALA 197 Cb -0.04 -1.17 0.01 0.00 0.00 0.00 0.00 23.12 21.93 1lfp s ALA 197 CO 0.03 -1.09 0.60 1.14 0.00 0.00 0.00 175.76 176.45 1lfp s GLN 198 N 2.28 1.62 -0.05 0.00 -2.07 0.05 -4.98 119.66 116.51 1lfp s GLN 198 Ca 0.05 -1.04 -0.20 0.00 -1.82 0.00 0.00 55.36 52.35 1lfp s GLN 198 Cb -0.15 0.55 -0.05 0.00 -1.09 0.00 0.00 33.01 32.27 1lfp s GLN 198 CO -0.10 -0.71 0.58 0.42 -1.32 0.00 0.00 175.29 174.16 1lfp s ILE 199 N -3.94 5.02 0.09 3.63 -1.09 -1.26 0.14 121.20 123.79 1lfp s ILE 199 Ca 0.14 1.20 0.02 0.00 -2.23 0.00 0.00 60.65 59.78 1lfp s ILE 199 Cb -0.03 -3.92 -0.01 0.00 -1.58 0.00 0.00 42.46 36.92 1lfp s ILE 199 CO 0.05 0.36 0.07 1.07 -1.23 0.00 0.00 174.94 175.27 1lfp n THR 200 N 3.18 0.00 -5.13 2.92 5.66 0.74 -4.92 114.28 116.72 1lfp n THR 200 Ca -0.06 -0.65 -0.29 0.00 -3.05 0.00 0.00 64.05 60.00 1lfp n THR 200 Cb 0.51 0.31 -0.16 0.00 -1.55 0.00 0.00 70.33 69.45 1lfp n THR 200 CO 0.00 0.00 0.00 0.26 -3.05 0.00 0.00 175.07 172.28 1lfp s TRP 201 N -2.30 2.09 -0.09 1.09 0.52 -1.26 -0.59 118.94 118.40 1lfp s TRP 201 Ca 0.10 -0.47 0.04 0.00 0.02 0.00 0.00 56.10 55.79 1lfp s TRP 201 Cb 0.00 -1.36 -0.00 0.00 -1.15 0.00 0.00 33.47 30.96 1lfp s TRP 201 CO 0.07 -0.09 -0.23 0.21 0.02 0.00 0.00 176.95 176.93 1lfp s LYS 202 N -0.39 2.95 0.44 4.98 2.20 0.66 -4.89 119.74 125.70 1lfp s LYS 202 Ca 0.05 -0.86 -0.25 0.00 -0.36 0.00 0.00 55.97 54.54 1lfp s LYS 202 Cb -0.10 -2.30 -0.08 0.00 -1.51 0.00 0.00 37.83 33.84 1lfp s LYS 202 CO 0.00 0.24 1.37 -1.25 -0.36 0.00 0.00 175.35 175.36 1lfp s PRO 203 N 0.20 3.74 0.05 4.03 0.04 -1.26 -0.84 135.00 140.96 1lfp s PRO 203 Ca -0.14 2.29 0.26 0.00 0.04 0.00 0.00 61.00 63.45 1lfp s PRO 203 Cb -0.17 -2.65 0.64 0.00 0.04 0.00 0.00 34.50 32.36 1lfp s PRO 203 CO 0.07 -0.73 1.52 0.44 0.04 0.00 0.00 177.00 178.35 1lfp n ILE 204 N -0.16 0.14 -3.58 0.56 -5.35 -0.24 -4.84 119.36 105.88 1lfp n ILE 204 Ca 0.05 -0.09 -0.07 0.00 -0.27 0.00 0.00 62.75 62.36 1lfp n ILE 204 Cb 0.43 -0.07 -0.02 0.00 -1.74 0.00 0.00 39.64 38.24 1lfp n ILE 204 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1lfp s SER 205 N -3.44 -0.33 0.27 7.28 0.15 -1.26 -5.09 113.70 111.28 1lfp s SER 205 Ca 0.10 -0.15 0.11 0.00 0.70 0.00 0.00 55.95 56.72 1lfp s SER 205 Cb 0.16 0.46 -0.05 0.00 -1.71 0.00 0.00 66.02 64.89 1lfp s SER 205 CO 0.66 -0.79 -0.20 0.42 1.20 0.00 0.00 173.24 174.54 1lfp s THR 206 N -3.30 2.39 -0.34 6.45 -4.23 -1.26 -4.85 115.64 110.50 1lfp s THR 206 Ca 0.07 -2.37 -0.05 0.00 -1.18 0.00 0.00 61.69 58.16 1lfp s THR 206 Cb -0.01 -2.26 0.05 0.00 1.34 0.00 0.00 72.50 71.62 1lfp s THR 206 CO -0.05 -0.41 0.10 0.54 -0.54 0.00 0.00 174.62 174.26 1lfp s VAL 207 N -2.52 3.56 0.04 2.29 0.11 0.14 -4.90 120.40 119.12 1lfp s VAL 207 Ca 0.29 -1.32 -0.30 0.00 -2.93 0.00 0.00 61.98 57.71 1lfp s VAL 207 Cb -0.05 -3.09 -0.08 0.00 -1.53 0.00 0.00 36.38 31.64 1lfp s VAL 207 CO 0.14 -0.25 1.69 -1.10 -3.33 0.00 0.00 175.10 172.26 1lfp s GLN 208 N 1.34 4.19 -0.29 1.54 -1.52 -1.26 -0.01 119.66 123.64 1lfp s GLN 208 Ca -0.01 2.34 0.02 0.00 -1.95 0.00 0.00 55.36 55.76 1lfp s GLN 208 Cb -0.20 -3.76 0.08 0.00 -0.22 0.00 0.00 33.01 28.91 1lfp s GLN 208 CO 0.01 -0.79 0.00 -1.50 -0.25 0.00 0.00 175.29 172.76 1lfp s ILE 209 N 3.20 1.77 -0.57 1.08 1.10 0.22 -4.87 121.20 123.13 1lfp s ILE 209 Ca 0.76 -1.72 0.23 0.00 -0.51 0.00 0.00 60.65 59.41 1lfp s ILE 209 Cb -0.39 -2.16 -0.15 0.00 0.15 0.00 0.00 42.46 39.91 1lfp s ILE 209 CO 0.33 -0.37 0.95 0.59 -2.11 0.00 0.00 174.94 174.33 1lfp n ASN 210 N 4.52 0.59 -4.60 4.50 3.02 -1.26 -4.38 115.26 117.64 1lfp n ASN 210 Ca -0.05 -0.24 -0.43 0.00 -0.03 0.00 0.00 54.58 53.83 1lfp n ASN 210 Cb 0.43 0.94 -0.02 0.00 -0.61 0.00 0.00 39.78 40.52 1lfp n ASN 210 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1lfp s ASP 211 N -3.96 6.45 0.44 6.41 1.01 -1.26 -4.87 116.67 120.89 1lfp s ASP 211 Ca 0.03 0.77 0.18 0.00 0.71 0.00 0.00 52.55 54.23 1lfp s ASP 211 Cb 0.14 -2.54 1.11 0.00 1.01 0.00 0.00 42.92 42.64 1lfp s ASP 211 CO 0.82 -1.35 1.93 -0.08 0.21 0.00 0.00 175.17 176.69 1lfp h GLU 212 N 10.17 0.34 0.08 8.23 4.81 -1.99 0.62 114.58 136.83 1lfp h GLU 212 Ca -0.26 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1lfp h GLU 212 Cb 1.09 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1lfp h GLU 212 CO 1.09 0.22 -0.04 0.93 -0.73 0.00 0.00 179.01 180.49 1lfp h GLU 213 N 0.35 -0.10 -0.66 1.92 5.08 -2.00 -2.40 114.58 116.77 1lfp h GLU 213 Ca 0.36 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.67 1lfp h GLU 213 Cb 0.91 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.16 1lfp h GLU 213 CO -0.10 0.06 0.20 1.15 -1.00 0.00 0.00 179.01 179.32 1lfp h THR 214 N -0.24 1.25 -0.96 1.13 2.02 -1.59 -2.94 112.91 111.58 1lfp h THR 214 Ca -0.01 -0.88 0.07 0.00 0.77 0.00 0.00 66.41 66.35 1lfp h THR 214 Cb 0.20 0.57 -0.06 0.00 -1.74 0.00 0.00 68.15 67.11 1lfp h THR 214 CO 0.02 0.34 0.62 0.00 0.37 0.00 0.00 175.52 176.87 1lfp h ALA 215 N 1.08 1.46 -0.17 6.16 0.00 -0.82 -1.38 119.26 125.58 1lfp h ALA 215 Ca 0.21 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 1lfp h ALA 215 Cb 0.31 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1lfp h ALA 215 CO -0.00 0.40 -0.41 0.37 0.00 0.00 0.00 179.25 179.60 1lfp h GLN 216 N 1.11 0.40 -0.19 0.00 4.15 -1.26 -1.96 115.11 117.35 1lfp h GLN 216 Ca 0.42 -0.20 -0.09 0.00 0.77 0.00 0.00 58.65 59.56 1lfp h GLN 216 Cb 0.20 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.89 1lfp h GLN 216 CO -0.17 0.75 -0.22 0.87 -1.93 0.00 0.00 178.83 178.13 1lfp h LYS 217 N 0.33 0.48 -0.03 1.69 1.57 -1.23 -1.44 116.57 117.95 1lfp h LYS 217 Ca 0.03 -0.26 0.03 0.00 -1.87 0.00 0.00 60.65 58.57 1lfp h LYS 217 Cb 0.87 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.16 1lfp h LYS 217 CO 0.07 0.85 -0.18 0.28 -0.57 0.00 0.00 179.45 179.90 1lfp h VAL 218 N 0.15 0.57 -0.89 0.50 2.07 -1.18 -1.05 116.25 116.41 1lfp h VAL 218 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1lfp h VAL 218 Cb 0.77 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.06 1lfp h VAL 218 CO 0.05 0.00 0.56 0.40 0.02 0.00 0.00 177.57 178.60 1lfp h ILE 219 N -0.28 1.24 -0.35 4.57 2.04 -1.32 -1.60 117.51 121.81 1lfp h ILE 219 Ca 0.06 -0.48 -0.10 0.00 1.00 0.00 0.00 64.86 65.34 1lfp h ILE 219 Cb 0.36 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.38 1lfp h ILE 219 CO -0.19 0.24 -0.19 0.11 0.00 0.00 0.00 178.15 178.12 1lfp h LYS 220 N 1.22 0.67 0.11 2.37 1.57 -0.90 -0.78 116.57 120.82 1lfp h LYS 220 Ca 0.32 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1lfp h LYS 220 Cb -0.09 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.18 1lfp h LYS 220 CO -0.06 0.82 -0.05 1.25 -0.57 0.00 0.00 179.45 180.83 1lfp h LEU 221 N 0.59 -0.13 -0.57 2.94 6.46 -0.62 0.62 115.31 124.61 1lfp h LEU 221 Ca 0.09 -0.11 0.02 0.00 -0.12 0.00 0.00 57.88 57.76 1lfp h LEU 221 Cb 0.66 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.59 1lfp h LEU 221 CO 0.05 0.03 0.36 -0.07 -0.62 0.00 0.00 178.44 178.19 1lfp h LEU 222 N -0.28 0.60 -1.03 2.25 3.38 -1.19 -0.31 115.31 118.73 1lfp h LEU 222 Ca -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 1lfp h LEU 222 Cb 0.23 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 1lfp h LEU 222 CO 0.03 0.43 0.40 0.78 0.09 0.00 0.00 178.44 180.17 1lfp h ASN 223 N 0.72 0.97 -0.56 -0.43 -0.26 -0.98 -1.77 115.58 113.28 1lfp h ASN 223 Ca 0.22 -0.09 -0.10 0.00 -0.56 0.00 0.00 56.30 55.77 1lfp h ASN 223 Cb -0.03 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 36.97 1lfp h ASN 223 CO -0.08 0.80 -0.04 0.00 -1.06 0.00 0.00 177.43 177.06 1lfp h ALA 224 N 1.36 0.76 -0.52 -0.83 0.00 -0.03 -2.39 119.26 117.61 1lfp h ALA 224 Ca 0.27 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1lfp h ALA 224 Cb 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1lfp h ALA 224 CO -0.04 0.62 0.10 -0.07 0.00 0.00 0.00 179.25 179.86 1lfp h LEU 225 N 0.90 0.75 -1.74 0.00 3.38 -0.63 -2.12 115.31 115.85 1lfp h LEU 225 Ca 0.15 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1lfp h LEU 225 Cb 0.59 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1lfp h LEU 225 CO 0.04 0.76 -0.17 -0.08 0.09 0.00 0.00 178.44 179.07 1lfp h GLU 226 N 0.77 0.00 0.00 1.13 4.57 -0.95 -2.43 114.58 117.67 1lfp h GLU 226 Ca 0.17 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.35 1lfp h GLU 226 Cb 0.32 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 1lfp h GLU 226 CO 0.00 0.17 0.00 0.39 -1.18 0.00 0.00 179.01 178.39 1lfp n GLU 227 N -3.99 0.83 -3.29 1.92 -0.58 -0.80 -4.71 120.64 110.02 1lfp n GLU 227 Ca -0.02 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.34 1lfp n GLU 227 Cb 0.25 -1.48 -0.06 0.00 -0.57 0.00 0.00 31.44 29.58 1lfp n GLU 227 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1lfp s LEU 228 N -1.97 4.30 0.44 -4.62 1.43 -0.92 -4.94 118.68 112.40 1lfp s LEU 228 Ca 0.39 0.88 0.10 0.00 -1.03 0.00 0.00 54.13 54.47 1lfp s LEU 228 Cb 0.18 -2.74 0.98 0.00 0.03 0.00 0.00 46.19 44.64 1lfp s LEU 228 CO 0.30 0.01 2.06 0.44 0.23 0.00 0.00 176.35 179.39 1lfp h ASP 229 N 6.54 0.36 1.03 2.29 3.45 -1.89 -0.79 116.42 127.42 1lfp h ASP 229 Ca -0.42 -0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.04 1lfp h ASP 229 Cb 1.18 -0.08 0.00 0.00 -0.56 0.00 0.00 39.33 39.87 1lfp h ASP 229 CO 0.74 0.25 0.00 0.44 -1.57 0.00 0.00 179.24 179.11 1lfp h ASP 230 N 0.42 0.00 -3.34 6.45 3.32 -1.92 -3.44 116.42 117.90 1lfp h ASP 230 Ca 0.15 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.63 1lfp h ASP 230 Cb 0.10 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.57 1lfp h ASP 230 CO -0.04 0.00 -0.09 -0.69 -1.72 0.00 0.00 179.24 176.71 1lfp s VAL 231 N -3.32 5.16 -0.26 -1.35 1.01 -0.30 -0.93 120.40 120.41 1lfp s VAL 231 Ca 0.05 1.05 -0.05 0.00 0.00 0.00 0.00 61.98 63.04 1lfp s VAL 231 Cb 0.10 -3.86 -0.16 0.00 0.00 0.00 0.00 36.38 32.45 1lfp s VAL 231 CO 0.48 0.30 -0.23 0.00 0.00 0.00 0.00 175.10 175.66 1lfp n GLN 232 N 3.76 0.63 -3.86 2.72 1.13 0.23 -4.87 117.38 117.11 1lfp n GLN 232 Ca -0.06 0.21 -0.12 0.00 -1.94 0.00 0.00 57.00 55.10 1lfp n GLN 232 Cb 0.51 -1.53 -0.12 0.00 0.11 0.00 0.00 30.24 29.22 1lfp n GLN 232 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1lfp s GLN 233 N -2.51 0.25 -0.07 -1.09 -0.21 -0.98 -5.01 119.66 110.04 1lfp s GLN 233 Ca -0.35 -0.08 0.02 0.00 0.02 0.00 0.00 55.36 54.96 1lfp s GLN 233 Cb 0.11 0.11 0.01 0.00 1.00 0.00 0.00 33.01 34.24 1lfp s GLN 233 CO 0.57 -0.05 -0.13 0.08 -2.12 0.00 0.00 175.29 173.64 1lfp s VAL 234 N -0.52 1.22 -0.05 1.09 1.01 -1.26 -0.80 120.40 121.10 1lfp s VAL 234 Ca -0.06 -0.52 0.03 0.00 0.00 0.00 0.00 61.98 61.43 1lfp s VAL 234 Cb -0.04 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.23 1lfp s VAL 234 CO 0.00 0.38 -0.14 -0.63 0.00 0.00 0.00 175.10 174.71 1lfp s ILE 235 N 0.70 1.24 0.09 2.22 1.09 -1.26 -5.04 121.20 120.24 1lfp s ILE 235 Ca -0.14 -0.59 0.01 0.00 -1.10 0.00 0.00 60.65 58.83 1lfp s ILE 235 Cb -0.16 -1.08 -0.04 0.00 -1.06 0.00 0.00 42.46 40.12 1lfp s ILE 235 CO 0.03 0.37 -0.05 0.00 -0.10 0.00 0.00 174.94 175.19 1lfp s ALA 236 N 0.22 0.91 -0.27 9.38 0.00 -1.26 -4.28 121.76 126.46 1lfp s ALA 236 Ca -0.06 -1.34 0.12 0.00 0.00 0.00 0.00 51.96 50.67 1lfp s ALA 236 Cb -0.12 0.23 0.59 0.00 0.00 0.00 0.00 23.12 23.82 1lfp s ALA 236 CO 0.02 -0.27 1.57 0.27 0.00 0.00 0.00 175.76 177.35 1lfp n ASN 237 N -0.03 3.70 -4.76 0.00 2.04 -0.93 -4.79 115.26 110.50 1lfp n ASN 237 Ca -0.12 -3.34 -0.31 0.00 -0.44 0.00 0.00 54.58 50.37 1lfp n ASN 237 Cb 0.61 -0.64 0.10 0.00 -2.53 0.00 0.00 39.78 37.32 1lfp n ASN 237 CO 0.00 0.00 0.00 0.72 -0.44 0.00 0.00 177.26 177.54 1lfp s PHE 238 N -3.03 2.53 -0.24 -2.53 -0.12 -1.26 0.23 117.98 113.55 1lfp s PHE 238 Ca 0.47 1.52 -0.03 0.00 -0.05 0.00 0.00 56.93 58.85 1lfp s PHE 238 Cb 0.40 -3.07 0.08 0.00 -0.63 0.00 0.00 43.02 39.80 1lfp s PHE 238 CO 0.07 -1.89 0.07 -2.00 -0.05 0.00 0.00 175.22 171.42 1lfp s GLU 239 N -4.90 0.57 -0.08 1.99 2.56 0.98 -4.56 118.70 115.26 1lfp s GLU 239 Ca 0.62 -0.61 0.03 0.00 0.00 0.00 0.00 54.97 55.01 1lfp s GLU 239 Cb -0.17 -1.91 -0.02 0.00 2.00 0.00 0.00 34.13 34.03 1lfp s GLU 239 CO 0.56 -0.80 -0.17 0.96 -0.56 0.00 0.00 175.26 175.24 1lfp s ILE 240 N 1.84 2.73 -0.31 -3.70 -5.25 -1.26 0.69 121.20 115.93 1lfp s ILE 240 Ca 0.04 -0.82 -0.29 0.00 -0.99 0.00 0.00 60.65 58.59 1lfp s ILE 240 Cb -0.17 -2.07 -0.07 0.00 2.95 0.00 0.00 42.46 43.10 1lfp s ILE 240 CO -0.18 0.56 2.28 -2.65 -1.79 0.00 0.00 174.94 173.16 1lfp n PRO 241 N 2.88 1.60 0.00 0.37 -0.02 -1.26 -4.55 135.00 134.01 1lfp n PRO 241 Ca -0.18 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 1lfp n PRO 241 Cb 0.52 -3.16 0.00 0.00 -0.02 0.00 0.00 33.50 30.85 1lfp n PRO 241 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1lfp n GLU 242 N 8.75 0.00 -3.75 -0.52 4.07 -1.26 -4.89 120.64 123.03 1lfp n GLU 242 Ca 0.34 0.00 -0.14 0.00 -0.06 0.00 0.00 57.16 57.29 1lfp n GLU 242 Cb 0.43 0.00 -0.15 0.00 -0.06 0.00 0.00 31.44 31.66 1lfp n GLU 242 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1lfp s GLU 243 N 0.00 0.03 -0.01 5.31 2.02 -1.26 -5.02 118.70 119.77 1lfp s GLU 243 Ca 0.00 0.30 0.16 0.00 0.02 0.00 0.00 54.97 55.45 1lfp s GLU 243 Cb 0.00 -0.22 -0.21 0.00 0.10 0.00 0.00 34.13 33.80 1lfp s GLU 243 CO 0.00 -0.18 0.53 1.51 0.02 0.00 0.00 175.26 177.14 1lfp n ILE 244 N 4.27 0.00 -1.39 -1.63 0.13 -1.26 -4.96 119.36 114.52 1lfp n ILE 244 Ca -0.26 -0.24 -0.50 0.00 -1.10 0.00 0.00 62.75 60.65 1lfp n ILE 244 Cb 0.51 0.60 -0.12 0.00 -0.84 0.00 0.00 39.64 39.79 1lfp n ILE 244 CO 0.00 0.00 0.00 0.18 2.80 0.00 0.00 176.55 179.53 1lfp n LEU 245 N -1.69 0.84 0.00 9.51 7.99 -1.26 -4.50 117.00 127.89 1lfp n LEU 245 Ca 0.00 0.38 0.00 0.00 -0.01 0.00 0.00 56.01 56.38 1lfp n LEU 245 Cb 0.33 -1.00 0.00 0.00 -0.11 0.00 0.00 43.42 42.64 1lfp n LEU 245 CO 0.33 -0.79 0.00 1.67 -1.51 0.00 0.00 177.39 177.09 1lfp n GLN 246 N 8.07 0.00 0.00 3.23 7.27 -1.26 -5.03 117.38 129.66 1lfp n GLN 246 Ca 0.56 0.00 0.04 0.00 0.07 0.00 0.00 57.00 57.68 1lfp n GLN 246 Cb 0.06 0.00 0.26 0.00 2.41 0.00 0.00 30.24 32.97 1lfp n GLN 246 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76