#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1itf n ASP 2 N 0.00 5.88 0.09 0.00 2.03 -1.26 -4.79 116.55 118.49 1itf n ASP 2 Ca 0.00 -3.23 -0.13 0.00 0.52 0.00 0.00 54.79 51.96 1itf n ASP 2 Cb 0.00 -1.36 -0.08 0.00 -0.72 0.00 0.00 41.12 38.96 1itf n ASP 2 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1itf h LEU 3 N 6.51 -0.21 -9.96 -2.67 3.38 -2.03 -3.43 115.31 106.90 1itf h LEU 3 Ca 0.23 -0.28 -0.49 0.00 0.09 0.00 0.00 57.88 57.43 1itf h LEU 3 Cb 0.71 0.05 0.03 0.00 0.09 0.00 0.00 40.66 41.55 1itf h LEU 3 CO 1.28 0.20 0.44 -2.16 0.09 0.00 0.00 178.44 178.30 1itf s PRO 4 N -4.41 4.09 -0.80 1.13 0.04 -1.26 -5.00 135.00 128.79 1itf s PRO 4 Ca -0.14 1.63 -0.08 0.00 0.04 0.00 0.00 61.00 62.44 1itf s PRO 4 Cb 0.02 -2.57 0.21 0.00 0.04 0.00 0.00 34.50 32.20 1itf s PRO 4 CO 0.57 -0.23 0.70 1.14 0.04 0.00 0.00 177.00 179.21 1itf s GLN 5 N -2.46 3.28 -0.17 4.56 -2.07 -1.26 -4.85 119.66 116.70 1itf s GLN 5 Ca 0.58 -2.67 -0.14 0.00 -1.82 0.00 0.00 55.36 51.32 1itf s GLN 5 Cb -0.25 -4.15 -0.22 0.00 -1.09 0.00 0.00 33.01 27.29 1itf s GLN 5 CO 0.31 -1.24 0.27 0.25 -1.32 0.00 0.00 175.29 173.56 1itf n THR 6 N 3.48 1.66 -2.10 3.63 -2.24 -1.26 -4.96 114.28 112.49 1itf n THR 6 Ca 0.14 -0.35 -0.18 0.00 -2.27 0.00 0.00 64.05 61.39 1itf n THR 6 Cb 0.42 -1.89 0.11 0.00 -2.10 0.00 0.00 70.33 66.87 1itf n THR 6 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1itf n HIS 7 N -3.96 -3.50 -2.22 4.78 8.25 -1.26 -5.11 115.22 112.21 1itf n HIS 7 Ca -0.33 -1.02 0.00 0.00 -0.26 0.00 0.00 57.72 56.11 1itf n HIS 7 Cb 0.87 -0.59 0.00 0.00 1.12 0.00 0.00 29.99 31.39 1itf n HIS 7 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1itf n SER 8 N -3.23 0.00 -4.60 0.41 3.41 -1.26 -4.98 113.62 103.37 1itf n SER 8 Ca 0.11 -0.77 -0.43 0.00 -0.26 0.00 0.00 58.87 57.53 1itf n SER 8 Cb 0.40 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 1itf n SER 8 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1itf s LEU 9 N 0.00 3.53 0.31 1.04 1.43 -1.26 -4.85 118.68 118.88 1itf s LEU 9 Ca 0.00 1.29 -0.01 0.00 -1.03 0.00 0.00 54.13 54.39 1itf s LEU 9 Cb 0.00 -3.53 0.48 0.00 0.03 0.00 0.00 46.19 43.17 1itf s LEU 9 CO 0.00 -1.66 1.93 1.23 0.23 0.00 0.00 176.35 178.08 1itf h GLY 10 N 13.44 1.00 1.73 -3.19 0.00 -1.97 -1.67 103.07 112.41 1itf h GLY 10 Ca -0.33 -0.43 -0.08 0.00 0.00 0.00 0.00 47.33 46.49 1itf h GLY 10 CO 1.03 0.42 -0.22 1.48 0.00 0.00 0.00 176.54 179.25 1itf h SER 11 N 0.95 0.32 -0.37 0.19 4.64 -1.95 0.10 113.55 117.42 1itf h SER 11 Ca 0.24 -0.09 -0.15 0.00 -0.47 0.00 0.00 61.79 61.32 1itf h SER 11 Cb 0.01 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 1itf h SER 11 CO -0.04 0.55 -0.33 -0.09 -0.87 0.00 0.00 176.83 176.04 1itf h ARG 12 N 0.29 0.91 0.03 4.77 1.12 -1.71 -0.45 114.38 119.35 1itf h ARG 12 Ca 0.05 -0.45 -0.28 0.00 -1.11 0.00 0.00 59.98 58.19 1itf h ARG 12 Cb 0.56 0.00 0.02 0.00 -0.01 0.00 0.00 29.97 30.54 1itf h ARG 12 CO 0.04 1.10 -1.10 -0.09 -3.11 0.00 0.00 179.97 176.81 1itf h ARG 13 N 0.76 0.69 -0.35 0.20 2.43 -1.14 -1.22 114.38 115.75 1itf h ARG 13 Ca 0.07 -0.78 -0.02 0.00 -0.81 0.00 0.00 59.98 58.44 1itf h ARG 13 Cb 0.91 0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.68 1itf h ARG 13 CO 0.08 1.34 0.13 1.15 -1.51 0.00 0.00 179.97 181.17 1itf h THR 14 N 0.37 1.19 -0.00 0.20 2.02 -0.79 -0.79 112.91 115.11 1itf h THR 14 Ca -0.15 -0.60 -0.08 0.00 0.77 0.00 0.00 66.41 66.36 1itf h THR 14 Cb 1.76 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 1itf h THR 14 CO 0.21 0.21 -0.38 -0.07 0.37 0.00 0.00 175.52 175.87 1itf h LEU 15 N 0.42 0.00 -0.87 2.58 3.38 -1.13 -1.87 115.31 117.82 1itf h LEU 15 Ca 0.12 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1itf h LEU 15 Cb 0.20 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1itf h LEU 15 CO -0.01 0.38 0.06 -0.03 0.09 0.00 0.00 178.44 178.94 1itf h MET 16 N 0.00 0.90 -0.74 1.13 4.05 -0.55 -1.28 114.93 118.44 1itf h MET 16 Ca -0.00 -0.23 -0.04 0.00 -0.28 0.00 0.00 59.70 59.15 1itf h MET 16 Cb 0.67 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 31.32 1itf h MET 16 CO 0.05 0.85 0.32 -0.07 0.23 0.00 0.00 176.91 178.30 1itf h LEU 17 N 0.84 1.00 -1.33 3.39 3.38 -0.39 -1.70 115.31 120.51 1itf h LEU 17 Ca 0.17 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1itf h LEU 17 Cb 0.41 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1itf h LEU 17 CO 0.01 0.88 0.17 -0.07 0.09 0.00 0.00 178.44 179.52 1itf h LEU 18 N 1.05 0.57 0.04 1.67 3.38 -0.76 0.21 115.31 121.47 1itf h LEU 18 Ca 0.25 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 1itf h LEU 18 Cb 0.17 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1itf h LEU 18 CO -0.03 0.53 -0.02 0.00 0.09 0.00 0.00 178.44 179.01 1itf h ALA 19 N 1.56 -0.05 0.00 1.53 0.00 -0.40 -2.54 119.26 119.36 1itf h ALA 19 Ca 0.15 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1itf h ALA 19 Cb 0.14 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1itf h ALA 19 CO -0.01 -0.41 -0.19 1.96 0.00 0.00 0.00 179.25 180.60 1itf h GLN 20 N -0.29 0.00 -0.49 0.00 4.20 -1.06 -2.51 115.11 114.96 1itf h GLN 20 Ca -0.01 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.72 1itf h GLN 20 Cb 0.27 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.02 1itf h GLN 20 CO 0.01 0.19 0.32 1.98 -0.67 0.00 0.00 178.83 180.66 1itf h MET 21 N 0.00 0.60 -6.00 1.46 4.05 -0.16 -3.41 114.93 111.46 1itf h MET 21 Ca -0.00 -0.04 -0.65 0.00 -0.28 0.00 0.00 59.70 58.73 1itf h MET 21 Cb 0.52 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.18 1itf h MET 21 CO 0.02 0.40 1.42 -2.13 0.23 0.00 0.00 176.91 176.85 1itf n ARG 22 N -4.47 1.34 -0.05 0.39 0.63 -0.95 -4.79 116.66 108.77 1itf n ARG 22 Ca 0.05 0.37 -0.19 0.00 -0.92 0.00 0.00 57.85 57.16 1itf n ARG 22 Cb 0.09 -2.66 -0.13 0.00 0.45 0.00 0.00 32.46 30.20 1itf n ARG 22 CO 0.00 0.00 0.00 0.36 -2.51 0.00 0.00 177.63 175.48 1itf n LYS 23 N 8.25 0.71 -3.77 -0.14 2.85 -1.26 -4.96 118.16 119.84 1itf n LYS 23 Ca 0.37 0.21 -0.22 0.00 -1.05 0.00 0.00 58.31 57.63 1itf n LYS 23 Cb 0.29 -1.64 -0.05 0.00 -0.65 0.00 0.00 35.03 32.98 1itf n LYS 23 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 177.40 178.31 1itf s ILE 24 N -2.54 2.50 0.09 0.58 -4.36 -1.26 -5.12 121.20 111.09 1itf s ILE 24 Ca -0.26 -1.47 -0.10 0.00 -0.26 0.00 0.00 60.65 58.56 1itf s ILE 24 Cb 0.08 -2.97 -0.06 0.00 1.25 0.00 0.00 42.46 40.76 1itf s ILE 24 CO 0.71 0.00 0.42 -0.44 0.24 0.00 0.00 174.94 175.87 1itf s SER 25 N -4.06 6.65 0.42 4.36 0.01 -1.26 -4.97 113.70 114.85 1itf s SER 25 Ca 0.45 0.81 0.11 0.00 1.31 0.00 0.00 55.95 58.63 1itf s SER 25 Cb -0.01 -2.18 0.90 0.00 0.21 0.00 0.00 66.02 64.94 1itf s SER 25 CO 0.26 0.15 1.98 0.25 0.41 0.00 0.00 173.24 176.29 1itf h LEU 26 N 3.61 0.19 -0.81 2.44 5.85 -1.93 -1.01 115.31 123.65 1itf h LEU 26 Ca -0.49 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.12 1itf h LEU 26 Cb 1.19 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 1itf h LEU 26 CO 0.67 0.29 -0.06 -0.26 -0.34 0.00 0.00 178.44 178.73 1itf h PHE 27 N 0.20 0.90 0.00 1.25 0.04 -2.00 -1.11 116.94 116.22 1itf h PHE 27 Ca 0.05 -0.15 -0.04 0.00 2.80 0.00 0.00 57.97 60.62 1itf h PHE 27 Cb 0.25 -0.24 -0.01 0.00 2.20 0.00 0.00 35.95 38.16 1itf h PHE 27 CO 0.00 0.86 -0.21 1.03 -0.60 0.00 0.00 178.31 179.39 1itf h SER 28 N 0.76 0.00 -1.91 2.17 0.87 -1.61 -3.03 113.55 110.81 1itf h SER 28 Ca 0.13 0.00 -0.67 0.00 -1.23 0.00 0.00 61.79 60.03 1itf h SER 28 Cb 0.55 0.00 -0.36 0.00 -0.44 0.00 0.00 62.40 62.15 1itf h SER 28 CO 0.03 0.21 -0.01 0.00 -0.53 0.00 0.00 176.83 176.53 1itf n LEU 30 N -0.39 1.06 0.07 0.00 4.77 -0.97 -3.65 117.00 117.89 1itf n LEU 30 Ca 0.42 -0.50 -0.16 0.00 -0.03 0.00 0.00 56.01 55.74 1itf n LEU 30 Cb 0.44 -0.11 -0.08 0.00 -2.33 0.00 0.00 43.42 41.34 1itf n LEU 30 CO 0.40 0.25 0.10 0.50 -1.33 0.00 0.00 177.39 177.31 1itf h LYS 31 N 1.25 0.47 -0.26 3.23 1.63 -1.88 -3.27 116.57 117.75 1itf h LYS 31 Ca 0.00 -0.56 -0.11 0.00 -0.85 0.00 0.00 60.65 59.14 1itf h LYS 31 Cb 0.28 0.17 -0.06 0.00 -0.60 0.00 0.00 32.23 32.02 1itf h LYS 31 CO 0.00 1.20 -0.11 -0.40 -3.45 0.00 0.00 179.45 176.69 1itf n ASP 32 N -3.74 2.63 -4.67 4.20 5.68 -1.24 -5.01 116.55 114.40 1itf n ASP 32 Ca -0.09 -3.59 -0.43 0.00 -0.50 0.00 0.00 54.79 50.19 1itf n ASP 32 Cb 0.89 -0.59 -0.02 0.00 -1.14 0.00 0.00 41.12 40.26 1itf n ASP 32 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1itf s ARG 33 N -3.13 4.26 0.15 0.11 3.52 -1.24 -4.84 118.95 117.77 1itf s ARG 33 Ca 0.42 1.82 -0.24 0.00 -0.13 0.00 0.00 55.73 57.60 1itf s ARG 33 Cb 0.38 -3.72 0.06 0.00 -1.56 0.00 0.00 34.95 30.11 1itf s ARG 33 CO 0.01 -0.66 0.78 -3.38 -0.81 0.00 0.00 175.30 171.24 1itf s HIS 34 N 3.11 -0.31 -0.25 5.12 -3.43 -1.26 -5.07 115.29 113.20 1itf s HIS 34 Ca 0.60 0.03 -0.07 0.00 -0.80 0.00 0.00 55.06 54.82 1itf s HIS 34 Cb -0.26 0.61 -0.03 0.00 -1.43 0.00 0.00 32.58 31.47 1itf s HIS 34 CO 0.21 -0.87 0.07 0.34 -2.00 0.00 0.00 174.74 172.49 1itf s ASP 35 N -2.78 5.15 0.09 7.38 2.15 -1.26 -4.98 116.67 122.42 1itf s ASP 35 Ca 0.07 -0.19 -0.18 0.00 0.43 0.00 0.00 52.55 52.67 1itf s ASP 35 Cb -0.02 -1.92 -0.07 0.00 -0.30 0.00 0.00 42.92 40.60 1itf s ASP 35 CO -0.03 -0.02 1.56 -0.26 -0.17 0.00 0.00 175.17 176.24 1itf h PHE 36 N 8.15 0.46 0.00 -5.34 0.04 -1.96 -3.48 116.94 114.81 1itf h PHE 36 Ca -0.38 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.32 1itf h PHE 36 Cb 1.17 -0.13 0.00 0.00 2.20 0.00 0.00 35.95 39.20 1itf h PHE 36 CO 0.67 0.54 0.00 0.41 -0.60 0.00 0.00 178.31 179.33 1itf n GLY 37 N -0.45 0.66 3.72 -1.45 0.00 -1.26 -5.03 105.19 101.37 1itf n GLY 37 Ca -0.03 -0.73 -0.42 0.00 0.00 0.00 0.00 46.02 44.85 1itf n GLY 37 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1itf s PHE 38 N -0.63 3.35 -1.42 1.61 5.36 -1.26 -4.79 117.98 120.20 1itf s PHE 38 Ca 0.00 1.22 -0.13 0.00 -0.96 0.00 0.00 56.93 57.05 1itf s PHE 38 Cb 0.00 -3.53 0.06 0.00 -0.34 0.00 0.00 43.02 39.21 1itf s PHE 38 CO 0.00 -1.68 2.14 -0.35 -1.46 0.00 0.00 175.22 173.87 1itf n PRO 39 N 3.38 2.99 0.26 10.12 -0.04 -1.26 -4.65 135.00 145.79 1itf n PRO 39 Ca 0.08 -2.79 0.15 0.00 -0.04 0.00 0.00 63.50 60.90 1itf n PRO 39 Cb 0.44 -3.24 0.50 0.00 -0.04 0.00 0.00 33.50 31.16 1itf n PRO 39 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1itf h GLN 40 N 6.06 0.00 -0.08 0.54 -0.00 -1.96 -2.66 115.11 117.01 1itf h GLN 40 Ca 0.53 0.00 0.02 0.00 -0.00 0.00 0.00 58.65 59.21 1itf h GLN 40 Cb 0.65 0.00 -0.00 0.00 0.00 0.00 0.00 27.48 28.13 1itf h GLN 40 CO 1.82 0.00 0.06 1.05 0.00 0.00 0.00 178.83 181.76 1itf h GLU 41 N 0.00 0.00 -1.00 1.69 4.11 -2.00 0.31 114.58 117.70 1itf h GLU 41 Ca 0.00 0.00 -0.43 0.00 0.07 0.00 0.00 59.36 59.00 1itf h GLU 41 Cb 0.68 0.00 -0.25 0.00 0.50 0.00 0.00 28.75 29.68 1itf h GLU 41 CO 0.00 0.00 0.54 0.39 0.07 0.00 0.00 179.01 180.01 1itf n GLU 42 N -4.38 2.03 -0.32 1.06 -0.58 -1.00 -4.01 120.64 113.44 1itf n GLU 42 Ca -0.01 -2.47 0.00 0.00 -0.42 0.00 0.00 57.16 54.26 1itf n GLU 42 Cb 0.17 -1.97 0.00 0.00 -0.57 0.00 0.00 31.44 29.08 1itf n GLU 42 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 1itf n PHE 43 N -0.85 0.00 0.00 -0.32 3.72 0.11 -4.73 117.46 115.39 1itf n PHE 43 Ca 0.49 -0.04 0.00 0.00 -0.05 0.00 0.00 57.45 57.86 1itf n PHE 43 Cb 1.47 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 39.97 1itf n PHE 43 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1itf n GLY 44 N -0.05 0.42 3.78 1.37 0.00 -1.21 -4.77 105.19 104.74 1itf n GLY 44 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1itf n GLY 44 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1itf s ASN 45 N 0.63 5.82 -1.10 1.61 2.47 -1.26 -2.86 114.94 120.25 1itf s ASN 45 Ca 0.00 2.02 0.00 0.00 0.42 0.00 0.00 52.86 55.30 1itf s ASN 45 Cb 0.00 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.24 1itf s ASN 45 CO 0.00 -1.14 0.00 1.67 -3.72 0.00 0.00 177.10 173.91 1itf n GLN 46 N -1.48 -0.79 -3.30 0.43 7.27 -1.26 -4.94 117.38 113.31 1itf n GLN 46 Ca 0.10 0.85 -0.23 0.00 0.07 0.00 0.00 57.00 57.80 1itf n GLN 46 Cb 0.52 -4.81 -0.08 0.00 2.41 0.00 0.00 30.24 28.28 1itf n GLN 46 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1itf s PHE 47 N -2.35 0.47 0.00 3.69 0.08 -1.13 -4.80 117.98 113.94 1itf s PHE 47 Ca 0.00 -1.81 0.00 0.00 0.12 0.00 0.00 56.93 55.24 1itf s PHE 47 Cb 0.00 -0.67 0.00 0.00 -0.57 0.00 0.00 43.02 41.78 1itf s PHE 47 CO 0.00 -0.91 0.00 1.04 -0.10 0.00 0.00 175.22 175.25 1itf n GLN 48 N 3.16 0.46 0.00 0.44 1.13 -1.26 -4.62 117.38 116.69 1itf n GLN 48 Ca 0.24 0.00 0.12 0.00 -1.94 0.00 0.00 57.00 55.42 1itf n GLN 48 Cb 0.48 0.00 0.69 0.00 0.11 0.00 0.00 30.24 31.51 1itf n GLN 48 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 1itf n LYS 49 N -0.49 0.59 0.00 -1.09 2.85 -1.26 -3.07 118.16 115.69 1itf n LYS 49 Ca 0.00 0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.29 1itf n LYS 49 Cb 0.00 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 32.88 1itf n LYS 49 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1itf n ALA 50 N -1.13 1.48 -0.08 0.58 0.00 -1.26 -4.62 120.51 115.48 1itf n ALA 50 Ca 0.16 -0.51 -0.08 0.00 0.00 0.00 0.00 53.44 53.00 1itf n ALA 50 Cb 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.47 1itf n ALA 50 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1itf n GLU 51 N -0.13 1.40 0.00 0.00 -0.58 -1.18 -4.34 120.64 115.82 1itf n GLU 51 Ca 0.00 0.01 0.13 0.00 -0.42 0.00 0.00 57.16 56.88 1itf n GLU 51 Cb 0.22 -1.38 0.45 0.00 -0.57 0.00 0.00 31.44 30.17 1itf n GLU 51 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1itf n THR 52 N -2.63 0.00 -0.21 2.62 -1.04 -1.20 -4.17 114.28 107.64 1itf n THR 52 Ca -0.26 -0.07 0.01 0.00 -2.04 0.00 0.00 64.05 61.70 1itf n THR 52 Cb 0.96 0.12 0.13 0.00 -1.82 0.00 0.00 70.33 69.72 1itf n THR 52 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1itf h ILE 53 N 0.63 0.71 -0.09 12.58 2.04 -1.82 0.69 117.51 132.24 1itf h ILE 53 Ca 0.00 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 1itf h ILE 53 Cb 0.45 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1itf h ILE 53 CO 0.00 0.07 -0.14 1.55 0.00 0.00 0.00 178.15 179.63 1itf h PRO 54 N 0.37 0.14 0.05 2.37 0.13 -1.87 0.23 132.00 133.43 1itf h PRO 54 Ca 0.33 -0.03 -0.23 0.00 -0.87 0.00 0.00 66.00 65.20 1itf h PRO 54 Cb 0.46 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.56 1itf h PRO 54 CO -0.36 0.29 -1.04 0.28 -0.23 0.00 0.00 178.00 176.95 1itf h VAL 55 N 0.14 1.52 0.00 1.56 2.07 -1.17 -2.52 116.25 117.85 1itf h VAL 55 Ca 0.03 -2.89 -0.11 0.00 0.82 0.00 0.00 66.70 64.55 1itf h VAL 55 Cb 0.34 2.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 1itf h VAL 55 CO 0.02 0.84 -0.53 -0.07 0.02 0.00 0.00 177.57 177.85 1itf h LEU 56 N 0.09 0.00 0.02 2.57 3.38 0.12 0.17 115.31 121.66 1itf h LEU 56 Ca -0.07 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.72 1itf h LEU 56 Cb 1.72 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.49 1itf h LEU 56 CO 0.16 0.53 -0.71 -0.74 0.09 0.00 0.00 178.44 177.78 1itf h HIS 57 N 0.00 0.68 -0.07 1.13 2.76 -0.54 0.09 115.15 119.19 1itf h HIS 57 Ca -0.01 -0.38 -0.16 0.00 -2.20 0.00 0.00 60.37 57.62 1itf h HIS 57 Cb 1.06 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.94 1itf h HIS 57 CO 0.00 1.21 -0.67 1.49 -1.30 0.00 0.00 177.93 178.67 1itf h GLU 58 N -0.04 0.31 -0.21 5.26 4.57 -1.44 0.34 114.58 123.36 1itf h GLU 58 Ca -0.09 -0.23 -0.14 0.00 -1.18 0.00 0.00 59.36 57.71 1itf h GLU 58 Cb 1.42 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 30.05 1itf h GLU 58 CO 0.14 0.86 -0.42 1.98 -1.18 0.00 0.00 179.01 180.39 1itf h MET 59 N 0.22 0.66 0.00 1.92 4.05 -1.00 -0.67 114.93 120.11 1itf h MET 59 Ca -0.02 -0.43 -0.04 0.00 -0.28 0.00 0.00 59.70 58.94 1itf h MET 59 Cb 1.21 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 32.05 1itf h MET 59 CO 0.11 1.04 -0.20 0.82 0.23 0.00 0.00 176.91 178.92 1itf h ILE 60 N 0.36 0.50 -0.08 1.77 2.04 -0.94 -0.39 117.51 120.77 1itf h ILE 60 Ca 0.01 -1.03 -0.16 0.00 1.00 0.00 0.00 64.86 64.68 1itf h ILE 60 Cb 1.02 1.72 -0.01 0.00 -0.74 0.00 0.00 36.82 38.81 1itf h ILE 60 CO 0.09 0.19 -0.66 1.56 0.00 0.00 0.00 178.15 179.34 1itf h GLN 61 N 0.00 0.32 -0.13 2.37 1.08 -0.63 0.21 115.11 118.32 1itf h GLN 61 Ca -0.00 -0.24 -0.18 0.00 -1.45 0.00 0.00 58.65 56.78 1itf h GLN 61 Cb 0.70 0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.17 1itf h GLN 61 CO 0.03 0.86 -0.66 1.96 -0.95 0.00 0.00 178.83 180.07 1itf h GLN 62 N 0.23 0.52 -0.00 1.46 1.08 -0.22 -2.14 115.11 116.03 1itf h GLN 62 Ca -0.02 -0.39 -0.18 0.00 -1.45 0.00 0.00 58.65 56.62 1itf h GLN 62 Cb 1.20 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.68 1itf h GLN 62 CO 0.11 1.01 -0.81 0.82 -0.95 0.00 0.00 178.83 179.00 1itf h ILE 63 N 0.38 1.52 -0.48 2.54 2.04 -0.97 0.75 117.51 123.28 1itf h ILE 63 Ca -0.02 -2.60 -0.03 0.00 1.00 0.00 0.00 64.86 63.21 1itf h ILE 63 Cb 1.23 2.42 -0.02 0.00 -0.74 0.00 0.00 36.82 39.71 1itf h ILE 63 CO 0.12 0.75 0.17 0.15 0.00 0.00 0.00 178.15 179.34 1itf h PHE 64 N 0.06 0.75 0.23 1.37 3.57 -0.42 -0.47 116.94 122.04 1itf h PHE 64 Ca -0.02 -0.07 -0.33 0.00 3.53 0.00 0.00 57.97 61.08 1itf h PHE 64 Cb 1.41 -0.22 0.03 0.00 2.79 0.00 0.00 35.95 39.96 1itf h PHE 64 CO 0.01 0.65 -1.46 -0.97 -2.23 0.00 0.00 178.31 174.31 1itf h ASN 65 N 0.64 0.77 -0.35 0.41 -0.73 -1.38 0.18 115.58 115.12 1itf h ASN 65 Ca 0.16 -0.84 0.06 0.00 1.87 0.00 0.00 56.30 57.55 1itf h ASN 65 Cb 0.23 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.55 1itf h ASN 65 CO -0.01 1.66 0.24 0.25 -0.37 0.00 0.00 177.43 179.20 1itf h LEU 66 N 0.13 0.20 0.00 0.34 5.85 -0.77 0.79 115.31 121.86 1itf h LEU 66 Ca -0.24 -0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.20 1itf h LEU 66 Cb 2.14 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 43.08 1itf h LEU 66 CO 0.26 0.13 -1.93 0.49 -0.34 0.00 0.00 178.44 177.06 1itf n PHE 67 N -4.48 0.56 0.46 1.25 3.01 -0.19 -4.05 117.46 114.02 1itf n PHE 67 Ca 0.04 0.20 0.13 0.00 1.01 0.00 0.00 57.45 58.83 1itf n PHE 67 Cb 0.26 -1.05 0.45 0.00 -0.01 0.00 0.00 39.48 39.13 1itf n PHE 67 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1itf h SER 68 N 0.00 0.00 -3.88 4.37 0.87 0.16 -3.18 113.55 111.90 1itf h SER 68 Ca -0.34 0.00 -0.55 0.00 -1.23 0.00 0.00 61.79 59.67 1itf h SER 68 Cb 1.95 0.00 0.18 0.00 -0.44 0.00 0.00 62.40 64.09 1itf h SER 68 CO 0.05 0.00 0.18 0.35 -0.53 0.00 0.00 176.83 176.88 1itf n THR 69 N -2.42 2.87 0.30 2.23 -2.24 0.20 -4.67 114.28 110.55 1itf n THR 69 Ca 0.04 -0.35 0.19 0.00 -2.27 0.00 0.00 64.05 61.65 1itf n THR 69 Cb 0.35 -1.15 0.92 0.00 -2.10 0.00 0.00 70.33 68.34 1itf n THR 69 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1itf h LYS 70 N -0.30 0.00 0.03 -0.78 1.63 -1.91 0.12 116.57 115.36 1itf h LYS 70 Ca -0.47 0.00 -0.25 0.00 -0.85 0.00 0.00 60.65 59.07 1itf h LYS 70 Cb 1.33 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.98 1itf h LYS 70 CO 0.47 0.03 -1.01 -0.44 -3.45 0.00 0.00 179.45 175.05 1itf h ASP 71 N 0.00 0.84 0.81 4.20 3.32 -1.92 -2.72 116.42 120.94 1itf h ASP 71 Ca -0.00 -0.76 -0.24 0.00 0.02 0.00 0.00 57.03 56.04 1itf h ASP 71 Cb 0.26 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1itf h ASP 71 CO 0.00 1.50 -1.13 -1.28 -1.72 0.00 0.00 179.24 176.61 1itf h SER 72 N 0.27 0.23 -0.41 6.45 0.87 -1.63 -1.14 113.55 118.19 1itf h SER 72 Ca -0.13 -0.24 -0.07 0.00 -1.23 0.00 0.00 61.79 60.11 1itf h SER 72 Cb 1.68 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 63.54 1itf h SER 72 CO 0.20 1.19 0.01 0.77 -0.53 0.00 0.00 176.83 178.46 1itf h SER 73 N 0.04 0.76 1.65 6.23 4.64 -0.75 -0.23 113.55 125.89 1itf h SER 73 Ca -0.08 -0.18 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1itf h SER 73 Cb 1.88 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.76 1itf h SER 73 CO 0.17 0.83 -0.34 0.00 -0.87 0.00 0.00 176.83 176.62 1itf h ALA 74 N 1.26 0.83 0.00 5.18 0.00 -1.52 -3.26 119.26 121.75 1itf h ALA 74 Ca 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.89 1itf h ALA 74 Cb 0.44 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1itf h ALA 74 CO 0.02 0.00 -0.81 0.00 0.00 0.00 0.00 179.25 178.46 1itf h ALA 75 N 2.02 0.66 -1.08 0.00 0.00 -0.27 -3.46 119.26 117.13 1itf h ALA 75 Ca 0.00 -0.72 -0.65 0.00 0.00 0.00 0.00 54.91 53.54 1itf h ALA 75 Cb 0.99 -0.12 -0.13 0.00 0.00 0.00 0.00 17.79 18.54 1itf h ALA 75 CO 0.00 0.98 -0.55 -1.58 0.00 0.00 0.00 179.25 178.10 1itf s TRP 76 N -3.20 2.23 0.13 0.00 0.52 -0.19 -5.01 118.94 113.42 1itf s TRP 76 Ca -0.01 -0.79 -0.31 0.00 0.02 0.00 0.00 56.10 55.01 1itf s TRP 76 Cb 0.11 -1.72 -0.08 0.00 -1.15 0.00 0.00 33.47 30.63 1itf s TRP 76 CO 0.80 0.33 1.38 -0.51 0.02 0.00 0.00 176.95 178.97 1itf s ASP 77 N -3.80 6.82 0.49 2.95 1.01 -1.26 -4.80 116.67 118.08 1itf s ASP 77 Ca 0.23 2.36 0.20 0.00 0.71 0.00 0.00 52.55 56.04 1itf s ASP 77 Cb 0.06 -2.59 1.25 0.00 1.01 0.00 0.00 42.92 42.65 1itf s ASP 77 CO 0.12 -0.64 2.06 1.05 0.21 0.00 0.00 175.17 177.97 1itf h GLU 78 N 6.51 0.00 0.07 8.23 4.11 -1.96 0.27 114.58 131.81 1itf h GLU 78 Ca -0.43 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 58.83 1itf h GLU 78 Cb 1.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.48 1itf h GLU 78 CO 0.85 0.12 -0.74 1.15 0.07 0.00 0.00 179.01 180.46 1itf h THR 79 N 0.00 1.45 -0.68 -1.06 2.02 -1.96 0.25 112.91 112.94 1itf h THR 79 Ca -0.00 -2.30 -0.04 0.00 0.77 0.00 0.00 66.41 64.83 1itf h THR 79 Cb 0.25 2.87 -0.03 0.00 -1.74 0.00 0.00 68.15 69.49 1itf h THR 79 CO 0.02 0.66 0.25 -0.07 0.37 0.00 0.00 175.52 176.75 1itf h LEU 80 N -0.19 0.93 -0.70 2.58 3.38 -1.86 -1.38 115.31 118.07 1itf h LEU 80 Ca -0.11 -0.15 -0.14 0.00 0.09 0.00 0.00 57.88 57.57 1itf h LEU 80 Cb 1.50 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1itf h LEU 80 CO 0.14 0.85 -0.55 -0.07 0.09 0.00 0.00 178.44 178.90 1itf h LEU 81 N 0.99 0.30 0.10 1.67 3.38 -0.49 -1.22 115.31 120.04 1itf h LEU 81 Ca 0.23 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1itf h LEU 81 Cb 0.23 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1itf h LEU 81 CO -0.02 0.79 -0.19 -0.78 0.09 0.00 0.00 178.44 178.34 1itf h ASP 82 N 0.21 -0.52 0.16 -0.43 1.82 0.55 0.34 116.42 118.54 1itf h ASP 82 Ca 0.00 0.06 -0.06 0.00 -0.39 0.00 0.00 57.03 56.65 1itf h ASP 82 Cb 1.04 0.20 -0.01 0.00 0.68 0.00 0.00 39.33 41.24 1itf h ASP 82 CO 0.09 -0.27 -0.22 0.11 -1.61 0.00 0.00 179.24 177.34 1itf h LYS 83 N -0.36 0.12 -0.06 0.28 6.56 -1.28 -1.63 116.57 120.20 1itf h LYS 83 Ca 0.03 -0.03 -0.07 0.00 -1.06 0.00 0.00 60.65 59.51 1itf h LYS 83 Cb 0.38 -0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.01 1itf h LYS 83 CO -0.10 0.34 -0.30 0.35 -2.06 0.00 0.00 179.45 177.67 1itf h PHE 84 N 0.11 0.11 0.01 -1.35 3.57 0.11 -0.56 116.94 118.95 1itf h PHE 84 Ca 0.02 -0.02 -0.23 0.00 3.53 0.00 0.00 57.97 61.27 1itf h PHE 84 Cb 0.45 -0.03 0.01 0.00 2.79 0.00 0.00 35.95 39.17 1itf h PHE 84 CO 0.00 0.40 -0.97 1.88 -2.23 0.00 0.00 178.31 177.39 1itf h TYR 85 N 0.09 0.66 -0.48 0.41 0.05 0.53 -1.79 116.97 116.45 1itf h TYR 85 Ca 0.01 -0.37 -0.13 0.00 0.05 0.00 0.00 58.73 58.29 1itf h TYR 85 Cb 0.59 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.24 1itf h TYR 85 CO 0.00 1.19 -0.22 1.15 -1.05 0.00 0.00 178.16 179.23 1itf h THR 86 N 0.25 1.27 -0.11 -2.88 2.02 -0.97 -0.46 112.91 112.02 1itf h THR 86 Ca -0.09 -1.39 -0.15 0.00 0.77 0.00 0.00 66.41 65.56 1itf h THR 86 Cb 1.61 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 69.14 1itf h THR 86 CO 0.17 0.48 -0.57 -0.33 0.37 0.00 0.00 175.52 175.64 1itf h GLU 87 N 0.85 0.35 -0.47 6.66 4.39 -1.13 -0.39 114.58 124.84 1itf h GLU 87 Ca 0.11 -0.22 -0.12 0.00 0.34 0.00 0.00 59.36 59.47 1itf h GLU 87 Cb 0.80 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 1itf h GLU 87 CO 0.07 0.82 -0.16 -0.07 -1.16 0.00 0.00 179.01 178.50 1itf h LEU 88 N 0.26 0.95 -0.52 1.33 3.38 -1.11 -2.06 115.31 117.55 1itf h LEU 88 Ca 0.00 -0.38 -0.16 0.00 0.09 0.00 0.00 57.88 57.42 1itf h LEU 88 Cb 1.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1itf h LEU 88 CO 0.09 1.12 -0.64 0.22 0.09 0.00 0.00 178.44 179.32 1itf h TYR 89 N 0.78 0.49 0.11 1.13 5.03 -0.95 0.69 116.97 124.26 1itf h TYR 89 Ca 0.11 -0.20 -0.01 0.00 2.58 0.00 0.00 58.73 61.22 1itf h TYR 89 Cb 0.73 -0.08 0.00 0.00 1.55 0.00 0.00 36.73 38.93 1itf h TYR 89 CO 0.05 0.91 -0.05 0.37 -1.32 0.00 0.00 178.16 178.12 1itf h GLN 90 N 0.27 -0.15 0.00 1.82 4.15 -0.95 0.16 115.11 120.42 1itf h GLN 90 Ca -0.01 0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.36 1itf h GLN 90 Cb 1.18 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.90 1itf h GLN 90 CO 0.11 0.10 -0.27 0.37 -1.93 0.00 0.00 178.83 177.21 1itf h GLN 91 N -0.39 0.00 -0.20 1.69 4.15 -1.40 -1.96 115.11 117.01 1itf h GLN 91 Ca -0.02 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.28 1itf h GLN 91 Cb 0.32 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1itf h GLN 91 CO 0.03 0.27 -0.39 -0.07 -1.93 0.00 0.00 178.83 176.73 1itf h LEU 92 N 0.00 0.47 -0.28 -2.39 3.38 -0.35 0.20 115.31 116.33 1itf h LEU 92 Ca -0.00 -0.20 -0.20 0.00 0.09 0.00 0.00 57.88 57.57 1itf h LEU 92 Cb 0.57 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1itf h LEU 92 CO 0.03 0.82 -0.65 0.78 0.09 0.00 0.00 178.44 179.51 1itf h ASN 93 N 0.37 0.88 -0.41 -0.43 4.21 0.04 -0.68 115.58 119.57 1itf h ASN 93 Ca 0.03 -0.52 -0.13 0.00 1.21 0.00 0.00 56.30 56.89 1itf h ASN 93 Cb 0.86 -0.26 -0.01 0.00 -1.12 0.00 0.00 38.32 37.79 1itf h ASN 93 CO 0.07 1.31 -0.25 0.44 -1.29 0.00 0.00 177.43 177.71 1itf h ASP 94 N 0.56 0.96 -0.08 5.81 3.32 -1.27 -1.36 116.42 124.37 1itf h ASP 94 Ca -0.01 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.65 1itf h ASP 94 Cb 1.26 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.54 1itf h ASP 94 CO 0.13 1.15 0.01 -0.07 -1.72 0.00 0.00 179.24 178.74 1itf h LEU 95 N 0.79 0.13 -1.50 1.55 3.38 -0.88 -2.88 115.31 115.92 1itf h LEU 95 Ca 0.10 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.73 1itf h LEU 95 Cb 0.81 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1itf h LEU 95 CO 0.07 0.38 -0.26 1.05 0.09 0.00 0.00 178.44 179.77 1itf h GLU 96 N -0.12 0.00 -0.52 1.13 4.11 -1.10 -2.83 114.58 115.25 1itf h GLU 96 Ca 0.02 0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.49 1itf h GLU 96 Cb 0.31 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.52 1itf h GLU 96 CO 0.00 0.26 0.30 0.00 0.07 0.00 0.00 179.01 179.64 1itf h ALA 97 N 1.74 0.67 -0.49 1.06 0.00 -1.02 0.27 119.26 121.50 1itf h ALA 97 Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1itf h ALA 97 Cb 0.51 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1itf h ALA 97 CO 0.03 -0.02 0.29 0.00 0.00 0.00 0.00 179.25 179.56 1itf h VAL 99 N 0.67 1.30 0.44 0.00 2.07 -1.04 -3.26 116.25 116.43 1itf h VAL 99 Ca 0.18 -1.83 -0.01 0.00 0.82 0.00 0.00 66.70 65.86 1itf h VAL 99 Cb -0.03 1.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1itf h VAL 99 CO -0.03 0.58 -0.33 0.40 0.02 0.00 0.00 177.57 178.20 1itf h ILE 100 N 0.52 0.32 -3.25 4.57 1.08 0.25 -3.43 117.51 117.55 1itf h ILE 100 Ca -0.00 0.00 -0.12 0.00 -0.39 0.00 0.00 64.86 64.35 1itf h ILE 100 Cb 1.18 0.32 0.03 0.00 -3.07 0.00 0.00 36.82 35.28 1itf h ILE 100 CO 0.12 0.00 0.06 0.00 -0.69 0.00 0.00 178.15 177.64 1itf n GLN 101 N -5.46 0.10 -2.92 2.37 3.00 -0.97 -5.02 117.38 108.49 1itf n GLN 101 Ca -0.11 -0.63 -0.32 0.00 -0.01 0.00 0.00 57.00 55.93 1itf n GLN 101 Cb 0.35 -0.25 -0.03 0.00 0.00 0.00 0.00 30.24 30.32 1itf n GLN 101 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1itf n GLY 102 N 2.89 5.65 2.25 1.08 0.00 -1.26 -4.85 105.19 110.95 1itf n GLY 102 Ca 0.04 -2.73 -0.25 0.00 0.00 0.00 0.00 46.02 43.09 1itf n GLY 102 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1itf n VAL 103 N -0.00 3.17 -0.07 1.61 0.31 -1.26 -4.75 118.33 117.34 1itf n VAL 103 Ca 0.35 -2.52 0.00 0.00 -0.01 0.00 0.00 64.34 62.15 1itf n VAL 103 Cb 0.35 -1.39 0.00 0.00 -0.91 0.00 0.00 33.84 31.89 1itf n VAL 103 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1itf n GLY 104 N 0.27 -0.32 3.12 2.92 0.00 -1.26 -4.86 105.19 105.06 1itf n GLY 104 Ca 0.44 -0.73 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 1itf n GLY 104 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1itf s VAL 105 N 0.00 0.06 0.27 1.61 1.01 -1.26 -4.40 120.40 117.70 1itf s VAL 105 Ca 0.00 -0.50 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 1itf s VAL 105 Cb 0.00 -0.43 -0.10 0.00 0.00 0.00 0.00 36.38 35.85 1itf s VAL 105 CO 0.00 -0.27 1.45 0.42 0.00 0.00 0.00 175.10 176.70 1itf s THR 106 N -1.03 2.52 0.01 3.92 -4.23 -1.26 -4.95 115.64 110.62 1itf s THR 106 Ca -0.11 0.45 -0.17 0.00 -1.18 0.00 0.00 61.69 60.68 1itf s THR 106 Cb -0.06 -3.29 -0.09 0.00 1.34 0.00 0.00 72.50 70.40 1itf s THR 106 CO 0.02 0.08 0.98 -0.33 -0.54 0.00 0.00 174.62 174.82 1itf h GLU 107 N 4.67 -0.58 0.00 3.99 3.07 -2.04 -3.45 114.58 120.24 1itf h GLU 107 Ca -0.47 0.04 -0.14 0.00 -0.50 0.00 0.00 59.36 58.29 1itf h GLU 107 Cb 1.22 0.13 -0.12 0.00 -0.84 0.00 0.00 28.75 29.15 1itf h GLU 107 CO 0.76 -0.39 -0.04 0.25 -1.40 0.00 0.00 179.01 178.19 1itf n THR 108 N -4.08 0.00 -2.46 1.13 -2.24 -1.26 -5.14 114.28 100.22 1itf n THR 108 Ca -0.07 -0.93 -0.23 0.00 -2.27 0.00 0.00 64.05 60.54 1itf n THR 108 Cb 0.24 0.95 0.05 0.00 -2.10 0.00 0.00 70.33 69.47 1itf n THR 108 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1itf s PRO 109 N 0.10 2.41 0.37 -0.78 0.04 -1.26 -4.99 135.00 130.89 1itf s PRO 109 Ca 0.15 -0.57 0.17 0.00 0.04 0.00 0.00 61.00 60.79 1itf s PRO 109 Cb 0.23 -2.36 0.70 0.00 0.04 0.00 0.00 34.50 33.11 1itf s PRO 109 CO -0.09 -0.92 1.76 1.25 0.04 0.00 0.00 177.00 179.03 1itf h LEU 110 N -0.20 0.00 0.00 -3.56 5.85 -2.02 -2.35 115.31 113.04 1itf h LEU 110 Ca -0.43 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1itf h LEU 110 Cb 1.30 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1itf h LEU 110 CO 0.55 0.39 0.00 1.15 -0.34 0.00 0.00 178.44 180.19 1itf n MET 111 N -3.66 0.26 0.27 1.25 0.00 -1.26 -2.97 117.12 111.01 1itf n MET 111 Ca -0.01 0.11 -0.16 0.00 0.00 0.00 0.00 57.70 57.64 1itf n MET 111 Cb 0.49 -1.50 -0.09 0.00 0.00 0.00 0.00 33.22 32.12 1itf n MET 111 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 1itf h LYS 112 N 0.00 -0.88 -0.51 3.17 3.11 -1.80 -2.98 116.57 116.67 1itf h LYS 112 Ca 0.00 0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.90 1itf h LYS 112 Cb 0.18 0.20 0.00 0.00 -1.00 0.00 0.00 32.23 31.61 1itf h LYS 112 CO 0.00 -0.59 0.00 -0.85 -2.81 0.00 0.00 179.45 175.20 1itf n GLU 113 N -5.20 3.77 -0.05 1.90 0.28 -1.24 -4.43 120.64 115.66 1itf n GLU 113 Ca -0.11 -2.87 -0.15 0.00 -0.16 0.00 0.00 57.16 53.87 1itf n GLU 113 Cb 0.42 -1.92 -0.07 0.00 1.43 0.00 0.00 31.44 31.30 1itf n GLU 113 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 177.13 177.19 1itf h ASP 114 N 3.33 0.66 -0.16 -1.84 3.58 -1.41 0.67 116.42 121.25 1itf h ASP 114 Ca 0.00 -0.57 -0.09 0.00 0.42 0.00 0.00 57.03 56.79 1itf h ASP 114 Cb 1.52 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 42.36 1itf h ASP 114 CO 0.27 1.11 -0.19 -1.28 -2.88 0.00 0.00 179.24 176.27 1itf h SER 115 N 0.25 0.59 0.00 2.28 0.87 -1.78 0.71 113.55 116.47 1itf h SER 115 Ca -0.00 -0.19 -0.14 0.00 -1.23 0.00 0.00 61.79 60.23 1itf h SER 115 Cb 1.02 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.81 1itf h SER 115 CO 0.09 0.79 -0.46 0.40 -0.53 0.00 0.00 176.83 177.12 1itf h ILE 116 N 0.53 1.31 -0.28 2.23 2.04 -1.76 -1.95 117.51 119.63 1itf h ILE 116 Ca 0.08 -1.66 -0.11 0.00 1.00 0.00 0.00 64.86 64.18 1itf h ILE 116 Cb 0.63 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.34 1itf h ILE 116 CO 0.04 0.52 -0.28 0.25 0.00 0.00 0.00 178.15 178.68 1itf h LEU 117 N 0.43 0.58 -0.39 1.44 6.46 0.10 0.21 115.31 124.16 1itf h LEU 117 Ca 0.03 -0.22 -0.05 0.00 -0.12 0.00 0.00 57.88 57.52 1itf h LEU 117 Cb 0.97 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.73 1itf h LEU 117 CO 0.09 0.84 0.03 0.00 -0.62 0.00 0.00 178.44 178.78 1itf h ALA 118 N 1.20 0.52 0.00 1.25 0.00 -0.67 -1.19 119.26 120.37 1itf h ALA 118 Ca 0.06 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1itf h ALA 118 Cb 0.75 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1itf h ALA 118 CO 0.06 0.26 -0.15 0.28 0.00 0.00 0.00 179.25 179.69 1itf h VAL 119 N 0.49 0.55 -0.17 0.00 2.07 -1.02 -1.61 116.25 116.56 1itf h VAL 119 Ca 0.11 -0.71 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 1itf h VAL 119 Cb 0.42 1.47 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 1itf h VAL 119 CO 0.01 0.15 -0.08 -0.09 0.02 0.00 0.00 177.57 177.58 1itf h ARG 120 N 0.00 0.35 -0.03 1.57 2.43 0.59 -0.05 114.38 119.23 1itf h ARG 120 Ca -0.00 -0.15 -0.11 0.00 -0.81 0.00 0.00 59.98 58.90 1itf h ARG 120 Cb 0.46 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1itf h ARG 120 CO 0.02 0.66 -0.51 0.87 -1.51 0.00 0.00 179.97 179.50 1itf h LYS 121 N 0.03 0.09 -0.08 0.20 1.79 -1.09 0.21 116.57 117.72 1itf h LYS 121 Ca 0.04 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 1itf h LYS 121 Cb 0.56 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.21 1itf h LYS 121 CO 0.02 0.58 0.00 -0.92 -1.08 0.00 0.00 179.45 178.06 1itf h TYR 122 N 0.07 0.14 0.00 -1.35 3.20 -1.14 -2.04 116.97 115.86 1itf h TYR 122 Ca -0.00 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 1itf h TYR 122 Cb 0.93 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 1itf h TYR 122 CO 0.01 0.38 -0.14 0.74 -1.64 0.00 0.00 178.16 177.52 1itf h PHE 123 N -0.14 0.00 -0.50 -3.82 -1.00 -0.91 -2.25 116.94 108.32 1itf h PHE 123 Ca 0.02 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.67 1itf h PHE 123 Cb 0.33 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.87 1itf h PHE 123 CO 0.03 0.14 -0.20 0.37 -1.61 0.00 0.00 178.31 177.04 1itf h GLN 124 N 0.00 1.01 -0.36 1.51 4.15 -0.63 0.11 115.11 120.91 1itf h GLN 124 Ca -0.00 -0.42 -0.15 0.00 0.77 0.00 0.00 58.65 58.84 1itf h GLN 124 Cb 0.69 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 1itf h GLN 124 CO 0.02 1.11 -0.37 -0.09 -1.93 0.00 0.00 178.83 177.56 1itf h ARG 125 N 0.88 0.86 -0.71 1.69 9.65 -1.07 -1.21 114.38 124.47 1itf h ARG 125 Ca 0.12 -0.44 -0.02 0.00 -1.10 0.00 0.00 59.98 58.54 1itf h ARG 125 Cb 0.78 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.33 1itf h ARG 125 CO 0.06 1.08 0.36 0.82 2.80 0.00 0.00 179.97 185.09 1itf h ILE 126 N 0.71 1.23 -0.52 1.20 2.04 -1.15 -0.80 117.51 120.22 1itf h ILE 126 Ca 0.06 -0.61 -0.12 0.00 1.00 0.00 0.00 64.86 65.19 1itf h ILE 126 Cb 0.94 0.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 1itf h ILE 126 CO 0.09 0.26 -0.15 0.74 0.00 0.00 0.00 178.15 179.09 1itf h THR 127 N 0.98 1.27 -0.24 -0.27 2.02 -0.80 -2.12 112.91 113.75 1itf h THR 127 Ca 0.24 -1.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.10 1itf h THR 127 Cb 0.09 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 1itf h THR 127 CO -0.03 0.46 0.10 -0.07 0.37 0.00 0.00 175.52 176.35 1itf h LEU 128 N 0.89 0.32 -1.44 2.58 3.38 -0.84 -0.44 115.31 119.76 1itf h LEU 128 Ca 0.13 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1itf h LEU 128 Cb 0.72 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1itf h LEU 128 CO 0.06 0.37 0.27 0.22 0.09 0.00 0.00 178.44 179.45 1itf h TYR 129 N 0.24 0.63 -0.53 1.13 3.20 -1.08 0.17 116.97 120.74 1itf h TYR 129 Ca 0.08 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.83 1itf h TYR 129 Cb 0.15 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 1itf h TYR 129 CO -0.02 0.43 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.73 1itf h LEU 130 N 0.66 1.02 -0.98 2.82 3.38 -0.87 -1.53 115.31 119.82 1itf h LEU 130 Ca 0.17 -0.35 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 1itf h LEU 130 Cb -0.00 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1itf h LEU 130 CO -0.03 1.14 -0.34 0.11 0.09 0.00 0.00 178.44 179.41 1itf h LYS 131 N 0.90 0.00 0.07 1.13 1.57 0.01 0.64 116.57 120.88 1itf h LYS 131 Ca 0.13 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1itf h LYS 131 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.01 1itf h LYS 131 CO 0.05 0.34 -0.03 0.93 -0.57 0.00 0.00 179.45 180.17 1itf h GLU 132 N 0.00 -0.08 -0.01 3.15 5.08 -0.22 -2.89 114.58 119.61 1itf h GLU 132 Ca -0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1itf h GLU 132 Cb 0.86 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1itf h GLU 132 CO 0.04 0.39 0.00 1.63 -1.00 0.00 0.00 179.01 180.08 1itf n LYS 133 N -4.89 1.06 -3.52 2.33 4.01 -0.62 -4.88 118.16 111.65 1itf n LYS 133 Ca -0.09 -0.09 -0.23 0.00 -0.51 0.00 0.00 58.31 57.40 1itf n LYS 133 Cb 0.26 -1.36 0.07 0.00 -0.51 0.00 0.00 35.03 33.49 1itf n LYS 133 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1itf n LYS 134 N -0.76 -7.50 -3.33 1.97 4.76 -0.19 -2.81 118.16 110.30 1itf n LYS 134 Ca 0.17 0.81 -0.16 0.00 -2.87 0.00 0.00 58.31 56.26 1itf n LYS 134 Cb 0.10 -5.76 0.08 0.00 -1.84 0.00 0.00 35.03 27.61 1itf n LYS 134 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1itf n TYR 135 N -4.90 -2.06 -1.85 2.13 4.01 0.21 -4.99 117.16 109.71 1itf n TYR 135 Ca 0.00 0.87 -0.30 0.00 -0.16 0.00 0.00 57.90 58.31 1itf n TYR 135 Cb 0.56 -4.84 0.04 0.00 -0.31 0.00 0.00 39.34 34.79 1itf n TYR 135 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 1itf s SER 136 N -4.22 5.65 0.21 7.72 0.01 -1.12 -4.90 113.70 117.04 1itf s SER 136 Ca 0.02 1.24 -0.05 0.00 1.31 0.00 0.00 55.95 58.48 1itf s SER 136 Cb -0.00 -2.12 0.17 0.00 0.21 0.00 0.00 66.02 64.28 1itf s SER 136 CO 0.68 -1.23 1.62 1.55 0.41 0.00 0.00 173.24 176.27 1itf h PRO 137 N -0.57 0.78 -0.27 12.44 0.13 -1.94 -0.90 132.00 141.66 1itf h PRO 137 Ca -0.45 -0.32 -0.14 0.00 -0.87 0.00 0.00 66.00 64.22 1itf h PRO 137 Cb 1.23 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 1itf h PRO 137 CO 0.63 0.94 -0.36 0.00 -0.23 0.00 0.00 178.00 178.98 1itf h ALA 139 N 0.68 1.31 -0.15 0.00 0.00 -1.90 -1.27 119.26 117.93 1itf h ALA 139 Ca 0.03 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 1itf h ALA 139 Cb 0.95 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1itf h ALA 139 CO 0.08 0.55 -0.36 -1.49 0.00 0.00 0.00 179.25 178.03 1itf h TRP 140 N 0.98 0.35 -0.76 0.00 4.06 -0.98 -1.45 115.95 118.15 1itf h TRP 140 Ca 0.24 -0.09 -0.05 0.00 2.06 0.00 0.00 58.89 61.06 1itf h TRP 140 Cb 0.07 -0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 28.12 1itf h TRP 140 CO 0.01 0.63 0.29 1.49 -3.56 0.00 0.00 178.44 177.29 1itf h GLU 141 N 0.26 1.16 -0.38 0.49 4.57 -0.10 0.43 114.58 121.01 1itf h GLU 141 Ca 0.03 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 57.94 1itf h GLU 141 Cb 0.76 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.15 1itf h GLU 141 CO 0.06 0.95 0.06 0.28 -1.18 0.00 0.00 179.01 179.19 1itf h VAL 142 N 1.12 1.24 0.00 0.32 2.07 -0.99 -2.18 116.25 117.82 1itf h VAL 142 Ca 0.25 -0.85 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 1itf h VAL 142 Cb 0.24 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1itf h VAL 142 CO -0.02 0.29 -0.10 0.58 0.02 0.00 0.00 177.57 178.34 1itf h VAL 143 N 0.47 0.28 -0.06 2.57 2.07 -0.80 -1.10 116.25 119.69 1itf h VAL 143 Ca 0.12 -0.70 -0.06 0.00 0.82 0.00 0.00 66.70 66.87 1itf h VAL 143 Cb 0.36 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1itf h VAL 143 CO 0.01 0.10 -0.20 -0.09 0.02 0.00 0.00 177.57 177.40 1itf h ARG 144 N 0.00 0.25 -0.25 1.57 2.43 0.44 0.13 114.38 118.94 1itf h ARG 144 Ca -0.00 -0.18 -0.09 0.00 -0.81 0.00 0.00 59.98 58.90 1itf h ARG 144 Cb 0.54 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1itf h ARG 144 CO 0.01 0.81 -0.23 0.00 -1.51 0.00 0.00 179.97 179.05 1itf h ALA 145 N 0.44 1.15 -0.23 2.80 0.00 -1.24 -0.17 119.26 122.01 1itf h ALA 145 Ca -0.01 -0.33 -0.16 0.00 0.00 0.00 0.00 54.91 54.42 1itf h ALA 145 Cb 0.83 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1itf h ALA 145 CO 0.04 0.54 -0.50 0.93 0.00 0.00 0.00 179.25 180.26 1itf h GLU 146 N 0.42 0.65 -0.08 0.00 4.39 -1.15 -0.79 114.58 118.02 1itf h GLU 146 Ca 0.07 -0.38 -0.18 0.00 0.34 0.00 0.00 59.36 59.21 1itf h GLU 146 Cb 0.62 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1itf h GLU 146 CO 0.04 0.99 -0.70 0.82 -1.16 0.00 0.00 179.01 179.00 1itf h ILE 147 N 0.51 1.38 -0.30 3.13 1.08 -0.42 -0.64 117.51 122.25 1itf h ILE 147 Ca 0.02 -2.11 -0.17 0.00 -0.39 0.00 0.00 64.86 62.21 1itf h ILE 147 Cb 1.05 2.08 -0.00 0.00 -3.07 0.00 0.00 36.82 36.88 1itf h ILE 147 CO 0.10 0.63 -0.49 -0.03 -0.69 0.00 0.00 178.15 177.67 1itf h MET 148 N 0.27 0.82 -0.13 2.37 1.85 -0.93 -0.30 114.93 118.87 1itf h MET 148 Ca -0.02 -0.49 -0.06 0.00 -0.61 0.00 0.00 59.70 58.52 1itf h MET 148 Cb 1.27 0.04 -0.00 0.00 0.43 0.00 0.00 31.60 33.34 1itf h MET 148 CO 0.12 1.12 -0.17 -0.09 -0.40 0.00 0.00 176.91 177.49 1itf h ARG 149 N 0.65 0.34 -0.75 0.39 2.43 -1.09 -0.24 114.38 116.11 1itf h ARG 149 Ca 0.03 -0.20 -0.05 0.00 -0.81 0.00 0.00 59.98 58.95 1itf h ARG 149 Cb 1.08 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.61 1itf h ARG 149 CO 0.11 0.77 0.26 0.66 -1.51 0.00 0.00 179.97 180.25 1itf h SER 150 N -0.06 1.06 0.07 -3.80 4.64 -1.12 0.13 113.55 114.47 1itf h SER 150 Ca 0.01 -0.19 -0.18 0.00 -0.47 0.00 0.00 61.79 60.97 1itf h SER 150 Cb 0.72 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1itf h SER 150 CO 0.04 0.97 -0.63 0.15 -0.87 0.00 0.00 176.83 176.49 1itf h PHE 151 N 1.10 0.71 -0.11 4.77 3.57 -1.03 -0.98 116.94 124.97 1itf h PHE 151 Ca 0.24 -0.28 -0.14 0.00 3.53 0.00 0.00 57.97 61.33 1itf h PHE 151 Cb 0.27 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1itf h PHE 151 CO 0.02 1.03 -0.53 0.66 -2.23 0.00 0.00 178.31 177.26 1itf h SER 152 N 0.40 0.36 -0.51 0.41 4.64 -0.77 -1.00 113.55 117.08 1itf h SER 152 Ca -0.01 -0.19 -0.13 0.00 -0.47 0.00 0.00 61.79 61.00 1itf h SER 152 Cb 1.19 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 1itf h SER 152 CO 0.12 0.82 -0.18 -0.07 -0.87 0.00 0.00 176.83 176.65 1itf h LEU 153 N 0.25 1.04 -0.55 5.97 3.38 -0.58 0.45 115.31 125.27 1itf h LEU 153 Ca 0.01 -0.38 -0.15 0.00 0.09 0.00 0.00 57.88 57.44 1itf h LEU 153 Cb 1.02 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 1itf h LEU 153 CO 0.09 1.18 -0.46 0.28 0.09 0.00 0.00 178.44 179.62 1itf h SER 154 N 0.88 0.70 -0.11 -0.43 0.02 -0.98 -3.00 113.55 110.64 1itf h SER 154 Ca 0.12 -0.34 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1itf h SER 154 Cb 0.76 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.10 1itf h SER 154 CO 0.06 1.05 0.00 0.35 -1.14 0.00 0.00 176.83 177.15 1itf n THR 155 N -4.01 0.12 0.48 -2.27 -2.24 -0.40 -4.19 114.28 101.77 1itf n THR 155 Ca -0.02 -0.43 0.06 0.00 -2.27 0.00 0.00 64.05 61.39 1itf n THR 155 Cb 0.56 0.87 0.28 0.00 -2.10 0.00 0.00 70.33 69.94 1itf n THR 155 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1itf n ASN 156 N 0.79 0.00 -0.06 3.42 5.15 0.16 -2.97 115.26 121.74 1itf n ASN 156 Ca 0.17 0.38 0.11 0.00 -0.60 0.00 0.00 54.58 54.64 1itf n ASN 156 Cb 0.47 -0.43 0.51 0.00 -0.53 0.00 0.00 39.78 39.79 1itf n ASN 156 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1itf h LEU 157 N 0.00 0.35 -0.06 1.20 -0.00 -1.77 0.47 115.31 115.50 1itf h LEU 157 Ca 0.00 0.01 -0.23 0.00 -0.00 0.00 0.00 57.88 57.65 1itf h LEU 157 Cb 0.18 -0.07 -0.01 0.00 -0.00 0.00 0.00 40.66 40.76 1itf h LEU 157 CO 0.00 0.22 -1.05 1.56 -0.00 0.00 0.00 178.44 179.17 1itf h GLN 158 N 0.39 0.19 -0.02 1.13 1.08 -1.87 -3.32 115.11 112.70 1itf h GLN 158 Ca 0.26 -0.28 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1itf h GLN 158 Cb 0.50 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.02 1itf h GLN 158 CO -0.07 1.08 -0.23 -1.91 -0.95 0.00 0.00 178.83 176.74 1itf n GLU 159 N -3.55 1.72 -0.04 1.46 4.07 -0.72 -2.13 120.64 121.46 1itf n GLU 159 Ca -0.05 -1.41 -0.01 0.00 -0.06 0.00 0.00 57.16 55.64 1itf n GLU 159 Cb 0.92 -1.44 -0.00 0.00 -0.06 0.00 0.00 31.44 30.86 1itf n GLU 159 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 1itf h SER 160 N 3.39 0.00 0.00 4.31 0.02 -0.19 -3.40 113.55 117.68 1itf h SER 160 Ca 0.00 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.77 1itf h SER 160 Cb 0.84 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.34 1itf h SER 160 CO 0.00 0.42 -1.70 0.18 -1.14 0.00 0.00 176.83 174.59 1itf n LEU 161 N -4.16 2.87 -2.20 5.07 4.32 -1.25 -4.63 117.00 117.03 1itf n LEU 161 Ca -0.01 -0.06 -0.24 0.00 -0.02 0.00 0.00 56.01 55.68 1itf n LEU 161 Cb 0.03 -0.41 0.02 0.00 -1.62 0.00 0.00 43.42 41.45 1itf n LEU 161 CO 0.01 0.69 1.38 0.54 -1.22 0.00 0.00 177.39 178.80 1itf n ARG 162 N -2.84 2.18 -2.93 3.23 1.74 -1.24 -4.86 116.66 111.94 1itf n ARG 162 Ca -0.22 -2.20 -0.44 0.00 -0.77 0.00 0.00 57.85 54.23 1itf n ARG 162 Cb 0.74 -1.92 -0.03 0.00 -1.02 0.00 0.00 32.46 30.23 1itf n ARG 162 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1itf s SER 163 N -0.19 6.44 -0.40 0.55 1.04 -0.90 -4.60 113.70 115.64 1itf s SER 163 Ca 0.46 -1.66 0.03 0.00 0.48 0.00 0.00 55.95 55.27 1itf s SER 163 Cb 0.34 -2.39 0.16 0.00 0.10 0.00 0.00 66.02 64.23 1itf s SER 163 CO -0.09 -1.18 0.36 -0.75 0.98 0.00 0.00 173.24 172.56 1itf s LYS 164 N 3.10 0.78 0.00 4.02 2.20 -1.26 -5.06 119.74 123.52 1itf s LYS 164 Ca 0.27 -1.54 0.00 0.00 -0.36 0.00 0.00 55.97 54.34 1itf s LYS 164 Cb -0.11 -1.08 0.00 0.00 -1.51 0.00 0.00 37.83 35.13 1itf s LYS 164 CO -0.02 -1.30 0.00 -1.91 -0.36 0.00 0.00 175.35 171.76