#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 -0.69 -0.10 0.00 -0.08 -1.26 -4.96 116.55 109.46 1itf n ASP 2 Ca 0.00 -3.09 -0.17 0.00 -1.51 0.00 0.00 54.79 50.01 1itf n ASP 2 Cb 0.00 0.32 -0.07 0.00 2.34 0.00 0.00 41.12 43.70 1itf n ASP 2 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1itf n LEU 3 N 0.92 1.88 -4.95 -2.67 7.99 -1.26 -4.98 117.00 113.93 1itf n LEU 3 Ca 0.17 0.44 -0.23 0.00 -0.01 0.00 0.00 56.01 56.38 1itf n LEU 3 Cb 0.62 -0.87 0.05 0.00 -0.11 0.00 0.00 43.42 43.11 1itf n LEU 3 CO 0.14 0.07 0.49 -2.16 -1.51 0.00 0.00 177.39 174.42 1itf s PRO 4 N -2.45 2.34 -0.45 3.23 0.04 -1.26 -5.07 135.00 131.38 1itf s PRO 4 Ca -0.28 -0.54 0.07 0.00 0.04 0.00 0.00 61.00 60.30 1itf s PRO 4 Cb 0.07 -2.33 0.28 0.00 0.04 0.00 0.00 34.50 32.56 1itf s PRO 4 CO 0.45 -0.99 0.85 0.00 0.04 0.00 0.00 177.00 177.34 1itf n GLN 5 N -2.64 0.85 0.00 4.56 10.64 -1.26 -5.04 117.38 124.50 1itf n GLN 5 Ca 0.08 -2.31 0.00 0.00 -1.83 0.00 0.00 57.00 52.94 1itf n GLN 5 Cb 0.60 -1.33 0.00 0.00 -0.86 0.00 0.00 30.24 28.65 1itf n GLN 5 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1itf n THR 6 N 1.08 0.00 -4.18 -0.39 -2.24 -1.26 -5.14 114.28 102.16 1itf n THR 6 Ca 0.13 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.67 1itf n THR 6 Cb 0.63 -0.03 -0.06 0.00 -2.10 0.00 0.00 70.33 68.77 1itf n THR 6 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1itf s HIS 7 N 0.00 2.93 -0.30 4.78 3.76 -1.26 -5.11 115.29 120.10 1itf s HIS 7 Ca 0.00 -0.13 -0.09 0.00 -0.15 0.00 0.00 55.06 54.69 1itf s HIS 7 Cb 0.00 -1.36 0.19 0.00 1.11 0.00 0.00 32.58 32.52 1itf s HIS 7 CO 0.00 0.55 0.97 -1.54 -0.85 0.00 0.00 174.74 173.86 1itf s SER 8 N -3.41 -0.63 -0.37 1.40 1.04 -1.26 -5.11 113.70 105.36 1itf s SER 8 Ca 0.31 0.15 -0.04 0.00 0.48 0.00 0.00 55.95 56.84 1itf s SER 8 Cb -0.08 1.43 0.20 0.00 0.10 0.00 0.00 66.02 67.67 1itf s SER 8 CO 0.21 -0.12 0.98 -0.22 0.98 0.00 0.00 173.24 175.08 1itf s LEU 9 N 2.93 -0.59 -0.10 2.42 2.96 -1.26 -5.05 118.68 119.99 1itf s LEU 9 Ca 0.19 -0.52 -0.07 0.00 -0.22 0.00 0.00 54.13 53.51 1itf s LEU 9 Cb -0.05 0.76 -0.05 0.00 0.50 0.00 0.00 46.19 47.35 1itf s LEU 9 CO -0.21 -0.04 -0.16 0.61 -1.32 0.00 0.00 176.35 175.23 1itf n GLY 10 N 3.18 -0.21 0.36 7.98 0.00 -1.26 -4.43 105.19 110.81 1itf n GLY 10 Ca 0.10 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.13 1itf n GLY 10 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1itf h SER 11 N -0.44 0.67 -0.15 1.61 0.02 -1.95 0.79 113.55 114.10 1itf h SER 11 Ca -0.24 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.71 1itf h SER 11 Cb 1.08 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.49 1itf h SER 11 CO -0.15 0.40 0.05 -0.09 -1.14 0.00 0.00 176.83 175.90 1itf h ARG 12 N 0.75 0.23 -0.01 3.45 9.65 -1.99 -2.15 114.38 124.32 1itf h ARG 12 Ca 0.37 -0.05 -0.12 0.00 -1.10 0.00 0.00 59.98 59.08 1itf h ARG 12 Cb 0.44 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 28.97 1itf h ARG 12 CO -0.14 0.36 -0.56 -0.09 2.80 0.00 0.00 179.97 182.34 1itf h ARG 13 N 0.06 0.02 -0.59 0.20 2.43 -1.62 -1.87 114.38 113.01 1itf h ARG 13 Ca 0.05 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 1itf h ARG 13 Cb 0.22 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1itf h ARG 13 CO -0.00 0.57 0.32 1.15 -1.51 0.00 0.00 179.97 180.50 1itf h THR 14 N 0.01 1.19 -0.07 0.20 2.02 -0.64 0.71 112.91 116.33 1itf h THR 14 Ca -0.01 -0.48 -0.13 0.00 0.77 0.00 0.00 66.41 66.56 1itf h THR 14 Cb 0.99 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 1itf h THR 14 CO 0.07 0.21 -0.54 -0.07 0.37 0.00 0.00 175.52 175.56 1itf h LEU 15 N 0.79 0.22 -1.18 2.58 3.38 -1.26 -2.40 115.31 117.44 1itf h LEU 15 Ca 0.21 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1itf h LEU 15 Cb 0.04 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1itf h LEU 15 CO -0.03 0.72 0.07 -0.03 0.09 0.00 0.00 178.44 179.26 1itf h MET 16 N 0.15 0.64 -0.26 1.13 4.05 -0.49 -1.19 114.93 118.97 1itf h MET 16 Ca 0.00 -0.13 -0.02 0.00 -0.28 0.00 0.00 59.70 59.28 1itf h MET 16 Cb 1.01 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.70 1itf h MET 16 CO 0.08 0.61 0.09 -0.07 0.23 0.00 0.00 176.91 177.86 1itf h LEU 17 N 0.62 0.37 -1.47 3.39 3.38 -0.44 -1.89 115.31 119.26 1itf h LEU 17 Ca 0.14 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 57.99 1itf h LEU 17 Cb 0.29 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 1itf h LEU 17 CO 0.00 0.46 0.43 -0.07 0.09 0.00 0.00 178.44 179.35 1itf h LEU 18 N 0.26 0.56 -0.59 1.67 3.38 -0.90 -0.04 115.31 119.65 1itf h LEU 18 Ca 0.09 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1itf h LEU 18 Cb 0.21 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1itf h LEU 18 CO -0.00 0.36 -0.06 0.00 0.09 0.00 0.00 178.44 178.83 1itf h ALA 19 N 1.65 0.80 -0.18 1.53 0.00 -0.64 -2.41 119.26 120.01 1itf h ALA 19 Ca 0.29 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.72 1itf h ALA 19 Cb 0.30 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1itf h ALA 19 CO -0.09 0.67 -0.47 1.96 0.00 0.00 0.00 179.25 181.32 1itf h GLN 20 N 0.95 0.46 0.00 0.00 4.20 -0.43 -2.79 115.11 117.49 1itf h GLN 20 Ca 0.16 -0.25 -0.05 0.00 0.06 0.00 0.00 58.65 58.56 1itf h GLN 20 Cb 0.63 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 1itf h GLN 20 CO 0.04 0.83 -0.24 0.52 -0.67 0.00 0.00 178.83 179.31 1itf h MET 21 N 0.37 0.00 -6.16 1.46 2.86 -0.83 -3.44 114.93 109.19 1itf h MET 21 Ca 0.02 0.00 -0.73 0.00 -2.06 0.00 0.00 59.70 56.93 1itf h MET 21 Cb 0.96 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.65 1itf h MET 21 CO 0.08 0.24 0.77 -2.13 1.06 0.00 0.00 176.91 176.93 1itf n ARG 22 N -3.94 1.07 -0.07 1.72 0.63 -0.93 -4.79 116.66 110.35 1itf n ARG 22 Ca -0.02 0.39 -0.08 0.00 -0.92 0.00 0.00 57.85 57.22 1itf n ARG 22 Cb 0.32 -2.05 -0.10 0.00 0.45 0.00 0.00 32.46 31.08 1itf n ARG 22 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 1itf n LYS 23 N 4.55 1.36 -4.46 -0.14 5.02 -1.26 -5.04 118.16 118.19 1itf n LYS 23 Ca 0.25 0.03 -0.22 0.00 -2.02 0.00 0.00 58.31 56.34 1itf n LYS 23 Cb 0.13 -1.35 -0.10 0.00 -0.02 0.00 0.00 35.03 33.70 1itf n LYS 23 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1itf s ILE 24 N -2.33 1.07 0.23 -0.18 -4.36 -1.26 -5.15 121.20 109.22 1itf s ILE 24 Ca -0.12 -2.00 -0.07 0.00 -0.26 0.00 0.00 60.65 58.21 1itf s ILE 24 Cb 0.05 -2.71 -0.06 0.00 1.25 0.00 0.00 42.46 40.99 1itf s ILE 24 CO 0.50 0.00 0.51 -0.44 0.24 0.00 0.00 174.94 175.75 1itf s SER 25 N -3.51 6.52 0.34 4.36 0.01 -1.26 -4.98 113.70 115.18 1itf s SER 25 Ca 0.34 0.76 0.09 0.00 1.31 0.00 0.00 55.95 58.44 1itf s SER 25 Cb 0.08 -2.16 0.60 0.00 0.21 0.00 0.00 66.02 64.75 1itf s SER 25 CO 0.15 -0.09 1.79 0.25 0.41 0.00 0.00 173.24 175.75 1itf h LEU 26 N 2.27 0.18 -0.61 2.44 5.85 -1.91 -1.75 115.31 121.78 1itf h LEU 26 Ca -0.47 -0.06 -0.12 0.00 0.84 0.00 0.00 57.88 58.07 1itf h LEU 26 Cb 1.18 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 1itf h LEU 26 CO 0.69 0.51 -0.23 -0.26 -0.34 0.00 0.00 178.44 178.80 1itf h PHE 27 N 0.15 0.98 0.00 1.25 0.04 -2.00 -2.12 116.94 115.23 1itf h PHE 27 Ca 0.02 -0.23 -0.07 0.00 2.80 0.00 0.00 57.97 60.49 1itf h PHE 27 Cb 0.67 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 1itf h PHE 27 CO 0.01 1.00 -0.32 0.77 -0.60 0.00 0.00 178.31 179.17 1itf h SER 28 N 0.74 0.00 -1.84 2.17 0.02 -1.84 -3.03 113.55 109.76 1itf h SER 28 Ca 0.10 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 60.35 1itf h SER 28 Cb 0.77 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 62.97 1itf h SER 28 CO 0.06 0.32 0.27 0.00 -1.14 0.00 0.00 176.83 176.34 1itf n LEU 30 N -0.47 0.28 0.09 0.00 4.77 -1.00 -3.16 117.00 117.52 1itf n LEU 30 Ca 0.46 -0.05 -0.02 0.00 -0.03 0.00 0.00 56.01 56.37 1itf n LEU 30 Cb 0.41 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.41 1itf n LEU 30 CO 0.43 0.05 0.23 0.11 -1.33 0.00 0.00 177.39 176.88 1itf h LYS 31 N 0.43 0.00 -0.50 3.23 1.79 -1.88 -3.19 116.57 116.44 1itf h LYS 31 Ca 0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 1itf h LYS 31 Cb 0.14 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.76 1itf h LYS 31 CO 0.00 0.66 0.05 -0.25 -1.08 0.00 0.00 179.45 178.83 1itf n ASP 32 N -3.23 4.89 -4.68 0.86 9.92 -1.19 -4.96 116.55 118.16 1itf n ASP 32 Ca -0.01 -3.05 -0.43 0.00 -0.53 0.00 0.00 54.79 50.77 1itf n ASP 32 Cb 0.83 -0.65 -0.02 0.00 -0.64 0.00 0.00 41.12 40.64 1itf n ASP 32 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1itf s ARG 33 N -2.86 4.33 -0.25 -1.24 6.06 -1.21 -4.79 118.95 119.00 1itf s ARG 33 Ca 0.51 1.49 -0.10 0.00 -2.50 0.00 0.00 55.73 55.13 1itf s ARG 33 Cb 0.40 -3.61 0.10 0.00 0.06 0.00 0.00 34.95 31.90 1itf s ARG 33 CO 0.13 -0.49 0.55 -1.01 -2.50 0.00 0.00 175.30 171.98 1itf s HIS 34 N 2.60 -1.02 -0.07 5.12 3.76 -1.26 -5.09 115.29 119.33 1itf s HIS 34 Ca 0.50 1.89 -0.30 0.00 -0.15 0.00 0.00 55.06 57.00 1itf s HIS 34 Cb -0.19 0.54 -0.04 0.00 1.11 0.00 0.00 32.58 33.99 1itf s HIS 34 CO 0.15 -0.54 1.50 0.34 -0.85 0.00 0.00 174.74 175.35 1itf s ASP 35 N 2.38 6.77 -0.09 1.40 -1.08 -1.26 -4.91 116.67 119.88 1itf s ASP 35 Ca -0.06 2.07 -0.23 0.00 -0.52 0.00 0.00 52.55 53.82 1itf s ASP 35 Cb -0.10 -2.54 -0.19 0.00 -1.46 0.00 0.00 42.92 38.63 1itf s ASP 35 CO -0.16 -0.84 0.80 -0.26 0.52 0.00 0.00 175.17 175.22 1itf h PHE 36 N 8.83 -0.07 0.00 -5.34 -1.00 -1.99 -3.49 116.94 113.89 1itf h PHE 36 Ca -0.36 -0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.42 1itf h PHE 36 Cb 1.16 0.02 0.00 0.00 3.61 0.00 0.00 35.95 40.74 1itf h PHE 36 CO 0.84 0.55 0.00 0.41 -1.61 0.00 0.00 178.31 178.49 1itf n GLY 37 N 1.06 0.56 3.70 -1.45 0.00 -1.26 -5.05 105.19 102.76 1itf n GLY 37 Ca -0.08 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.21 2.85 -1.41 1.61 5.36 -1.26 -4.82 117.98 120.10 1itf s PHE 38 Ca 0.00 0.61 -0.15 0.00 -0.96 0.00 0.00 56.93 56.43 1itf s PHE 38 Cb 0.00 -3.85 0.04 0.00 -0.34 0.00 0.00 43.02 38.86 1itf s PHE 38 CO 0.00 -3.23 2.14 -0.35 -1.46 0.00 0.00 175.22 172.32 1itf n PRO 39 N 4.71 2.84 0.13 10.12 -0.04 -1.26 -4.64 135.00 146.86 1itf n PRO 39 Ca 0.14 -2.67 0.13 0.00 -0.04 0.00 0.00 63.50 61.06 1itf n PRO 39 Cb 0.41 -3.31 0.45 0.00 -0.04 0.00 0.00 33.50 31.01 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 6.32 0.00 -0.17 0.54 4.15 -1.96 -2.89 115.11 121.10 1itf h GLN 40 Ca 0.54 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.98 1itf h GLN 40 Cb 0.68 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.36 1itf h GLN 40 CO 1.83 0.00 0.11 1.49 -1.93 0.00 0.00 178.83 180.33 1itf h GLU 41 N 0.00 0.17 -0.84 1.69 4.81 -2.01 0.27 114.58 118.68 1itf h GLU 41 Ca 0.00 -0.01 -0.14 0.00 -0.13 0.00 0.00 59.36 59.08 1itf h GLU 41 Cb 0.58 -0.04 -0.09 0.00 0.63 0.00 0.00 28.75 29.83 1itf h GLU 41 CO 0.00 0.11 0.18 -1.91 -0.73 0.00 0.00 179.01 176.67 1itf n GLU 42 N -4.51 2.88 -0.76 1.92 4.07 -1.09 -3.90 120.64 119.25 1itf n GLU 42 Ca -0.00 -2.07 0.03 0.00 -0.06 0.00 0.00 57.16 55.06 1itf n GLU 42 Cb 0.12 -1.92 0.03 0.00 -0.06 0.00 0.00 31.44 29.61 1itf n GLU 42 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 1itf n PHE 43 N -0.00 0.00 0.00 4.31 3.01 0.96 -4.82 117.46 120.92 1itf n PHE 43 Ca 0.27 -0.33 0.00 0.00 1.01 0.00 0.00 57.45 58.40 1itf n PHE 43 Cb 1.05 -0.10 0.00 0.00 -0.01 0.00 0.00 39.48 40.42 1itf n PHE 43 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1itf n GLY 44 N -0.06 0.60 3.77 1.37 0.00 -1.19 -4.84 105.19 104.85 1itf n GLY 44 Ca 0.04 0.00 -0.38 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 0.47 6.88 -1.86 1.61 2.47 -1.26 -2.60 114.94 120.65 1itf s ASN 45 Ca 0.00 2.19 0.00 0.00 0.42 0.00 0.00 52.86 55.47 1itf s ASN 45 Cb 0.00 -2.61 0.00 0.00 -1.45 0.00 0.00 41.25 37.19 1itf s ASN 45 CO 0.00 -0.41 0.00 0.00 -3.72 0.00 0.00 177.10 172.97 1itf n GLN 46 N 0.40 -1.64 -2.87 0.43 1.13 -1.26 -4.87 117.38 108.70 1itf n GLN 46 Ca 0.03 1.05 -0.12 0.00 -1.94 0.00 0.00 57.00 56.02 1itf n GLN 46 Cb 0.47 -5.67 0.04 0.00 0.11 0.00 0.00 30.24 25.19 1itf n GLN 46 CO 0.00 0.00 0.00 1.19 -1.44 0.00 0.00 177.06 176.81 1itf n PHE 47 N -3.78 -0.72 -1.42 1.08 3.72 -1.07 -4.85 117.46 110.43 1itf n PHE 47 Ca -0.24 -2.86 -0.27 0.00 -0.05 0.00 0.00 57.45 54.02 1itf n PHE 47 Cb 0.69 0.40 0.21 0.00 -0.94 0.00 0.00 39.48 39.84 1itf n PHE 47 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1itf n GLN 48 N 0.07 -2.13 0.08 -1.08 3.00 -1.26 -4.49 117.38 111.57 1itf n GLN 48 Ca 0.12 -1.76 0.10 0.00 -0.01 0.00 0.00 57.00 55.45 1itf n GLN 48 Cb 0.74 -1.40 0.42 0.00 0.00 0.00 0.00 30.24 30.01 1itf n GLN 48 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 1itf n LYS 49 N -4.12 0.12 -0.09 -1.09 5.02 -1.26 -0.71 118.16 116.02 1itf n LYS 49 Ca 0.15 0.34 0.10 0.00 -2.02 0.00 0.00 58.31 56.87 1itf n LYS 49 Cb 0.54 -1.72 0.14 0.00 -0.02 0.00 0.00 35.03 33.96 1itf n LYS 49 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1itf n ALA 50 N -1.67 2.42 -0.02 7.82 0.00 -1.26 -4.10 120.51 123.70 1itf n ALA 50 Ca 0.03 -0.83 -0.02 0.00 0.00 0.00 0.00 53.44 52.62 1itf n ALA 50 Cb 0.22 -0.69 -0.03 0.00 0.00 0.00 0.00 19.45 18.95 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 1.15 2.29 -0.02 0.00 1.02 -0.62 -3.97 120.64 120.48 1itf n GLU 51 Ca 0.14 0.01 0.12 0.00 -0.02 0.00 0.00 57.16 57.41 1itf n GLU 51 Cb 0.51 -1.10 0.57 0.00 -0.02 0.00 0.00 31.44 31.40 1itf n GLU 51 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1itf n THR 52 N -2.31 0.06 -0.23 2.62 -2.24 0.11 -4.27 114.28 108.03 1itf n THR 52 Ca -0.07 -0.16 0.02 0.00 -2.27 0.00 0.00 64.05 61.58 1itf n THR 52 Cb 0.61 0.03 0.11 0.00 -2.10 0.00 0.00 70.33 68.98 1itf n THR 52 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1itf h ILE 53 N 1.14 0.41 -0.37 2.28 2.04 -1.79 0.92 117.51 122.13 1itf h ILE 53 Ca 0.00 -0.03 -0.07 0.00 1.00 0.00 0.00 64.86 65.76 1itf h ILE 53 Cb 0.25 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 1itf h ILE 53 CO 0.00 0.02 -0.06 1.55 0.00 0.00 0.00 178.15 179.66 1itf h PRO 54 N 0.09 0.62 -0.32 2.37 0.13 -1.87 0.15 132.00 133.16 1itf h PRO 54 Ca 0.35 -0.17 -0.16 0.00 -0.87 0.00 0.00 66.00 65.16 1itf h PRO 54 Cb 0.59 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 1itf h PRO 54 CO -0.61 0.69 -0.42 0.28 -0.23 0.00 0.00 178.00 177.71 1itf h VAL 55 N 0.58 1.28 0.00 1.56 2.07 -0.91 -2.33 116.25 118.50 1itf h VAL 55 Ca 0.11 -1.60 -0.10 0.00 0.82 0.00 0.00 66.70 65.94 1itf h VAL 55 Cb 0.46 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 1itf h VAL 55 CO 0.02 0.52 -0.46 -0.07 0.02 0.00 0.00 177.57 177.61 1itf h LEU 56 N 0.65 0.00 -0.25 2.57 3.38 0.12 0.26 115.31 122.04 1itf h LEU 56 Ca 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 1itf h LEU 56 Cb 0.99 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1itf h LEU 56 CO 0.09 0.46 -0.06 -0.74 0.09 0.00 0.00 178.44 178.28 1itf h HIS 57 N 0.00 0.55 0.00 1.13 2.76 -0.40 -0.21 115.15 118.98 1itf h HIS 57 Ca -0.00 -0.12 -0.15 0.00 -2.20 0.00 0.00 60.37 57.90 1itf h HIS 57 Cb 0.81 -0.13 -0.02 0.00 1.55 0.00 0.00 27.41 29.62 1itf h HIS 57 CO 0.00 0.71 -0.71 1.49 -1.30 0.00 0.00 177.93 178.12 1itf h GLU 58 N 0.23 0.00 -0.25 5.26 4.22 -1.29 -1.43 114.58 121.33 1itf h GLU 58 Ca 0.06 0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.46 1itf h GLU 58 Cb 0.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1itf h GLU 58 CO 0.03 0.71 -0.01 1.98 -2.18 0.00 0.00 179.01 179.54 1itf h MET 59 N 0.00 0.44 0.00 1.92 4.05 -0.79 0.71 114.93 121.25 1itf h MET 59 Ca -0.01 -0.14 -0.05 0.00 -0.28 0.00 0.00 59.70 59.22 1itf h MET 59 Cb 1.27 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 32.02 1itf h MET 59 CO 0.09 0.62 -0.23 0.82 0.23 0.00 0.00 176.91 178.44 1itf h ILE 60 N 0.21 0.59 -0.10 1.77 2.04 -1.00 -0.29 117.51 120.72 1itf h ILE 60 Ca 0.07 -1.11 -0.18 0.00 1.00 0.00 0.00 64.86 64.64 1itf h ILE 60 Cb 0.43 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 1itf h ILE 60 CO 0.01 0.23 -0.68 -0.61 0.00 0.00 0.00 178.15 177.10 1itf h GLN 61 N 0.00 0.43 -0.34 2.37 5.75 -0.84 0.18 115.11 122.65 1itf h GLN 61 Ca -0.00 -0.33 -0.16 0.00 -0.15 0.00 0.00 58.65 58.01 1itf h GLN 61 Cb 0.73 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 1itf h GLN 61 CO 0.03 0.95 -0.42 1.96 -2.65 0.00 0.00 178.83 178.70 1itf h GLN 62 N 0.30 0.87 -0.12 1.69 1.08 -0.15 -2.30 115.11 116.48 1itf h GLN 62 Ca -0.02 -0.48 -0.15 0.00 -1.45 0.00 0.00 58.65 56.55 1itf h GLN 62 Cb 1.25 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.69 1itf h GLN 62 CO 0.12 1.12 -0.59 0.82 -0.95 0.00 0.00 178.83 179.35 1itf h ILE 63 N 0.70 1.36 -0.60 2.54 2.04 -0.97 0.23 117.51 122.80 1itf h ILE 63 Ca 0.05 -1.90 0.01 0.00 1.00 0.00 0.00 64.86 64.02 1itf h ILE 63 Cb 1.01 1.91 -0.03 0.00 -0.74 0.00 0.00 36.82 38.97 1itf h ILE 63 CO 0.10 0.57 0.39 0.15 0.00 0.00 0.00 178.15 179.37 1itf h PHE 64 N 0.29 0.75 0.21 1.37 3.57 -0.42 -0.58 116.94 122.13 1itf h PHE 64 Ca -0.00 0.02 -0.32 0.00 3.53 0.00 0.00 57.97 61.20 1itf h PHE 64 Cb 1.11 -0.25 0.03 0.00 2.79 0.00 0.00 35.95 39.63 1itf h PHE 64 CO 0.03 0.46 -1.41 -0.97 -2.23 0.00 0.00 178.31 174.20 1itf h ASN 65 N 0.80 0.77 -0.43 0.41 -0.73 -1.34 0.13 115.58 115.19 1itf h ASN 65 Ca 0.23 -0.81 0.07 0.00 1.87 0.00 0.00 56.30 57.66 1itf h ASN 65 Cb -0.07 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 38.25 1itf h ASN 65 CO -0.06 1.63 0.29 0.25 -0.37 0.00 0.00 177.43 179.17 1itf h LEU 66 N 0.15 0.25 0.00 0.34 5.85 -0.74 -0.55 115.31 120.60 1itf h LEU 66 Ca -0.22 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.17 1itf h LEU 66 Cb 2.10 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 43.02 1itf h LEU 66 CO 0.26 0.16 -2.11 0.49 -0.34 0.00 0.00 178.44 176.90 1itf n PHE 67 N -4.47 0.38 0.28 1.25 3.01 -0.24 -4.11 117.46 113.56 1itf n PHE 67 Ca 0.06 0.14 0.17 0.00 1.01 0.00 0.00 57.45 58.83 1itf n PHE 67 Cb 0.30 -1.06 0.75 0.00 -0.01 0.00 0.00 39.48 39.46 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 -3.61 4.37 0.87 -0.13 -3.11 113.55 111.93 1itf h SER 68 Ca -0.43 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.56 1itf h SER 68 Cb 2.12 0.00 0.16 0.00 -0.44 0.00 0.00 62.40 64.24 1itf h SER 68 CO 0.05 0.03 0.13 0.35 -0.53 0.00 0.00 176.83 176.86 1itf n THR 69 N -3.17 3.82 0.30 2.23 -2.24 -0.27 -4.67 114.28 110.28 1itf n THR 69 Ca -0.00 -0.50 0.18 0.00 -2.27 0.00 0.00 64.05 61.45 1itf n THR 69 Cb 0.28 -1.15 0.90 0.00 -2.10 0.00 0.00 70.33 68.26 1itf n THR 69 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1itf h LYS 70 N 0.42 0.00 0.01 -0.78 1.79 -1.92 0.15 116.57 116.24 1itf h LYS 70 Ca -0.49 0.00 -0.25 0.00 -2.18 0.00 0.00 60.65 57.73 1itf h LYS 70 Cb 1.37 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 32.03 1itf h LYS 70 CO 0.50 0.04 -1.02 0.38 -1.08 0.00 0.00 179.45 178.28 1itf h ASP 71 N 0.00 0.70 0.85 0.86 2.03 -1.91 -2.31 116.42 116.64 1itf h ASP 71 Ca -0.00 -0.58 -0.23 0.00 -0.73 0.00 0.00 57.03 55.49 1itf h ASP 71 Cb 0.25 -0.22 -0.03 0.00 -0.83 0.00 0.00 39.33 38.50 1itf h ASP 71 CO 0.01 1.38 -1.18 -1.28 -1.03 0.00 0.00 179.24 177.14 1itf h SER 72 N 0.29 0.05 -0.39 4.15 0.87 -1.61 -1.71 113.55 115.21 1itf h SER 72 Ca -0.11 -0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.29 1itf h SER 72 Cb 1.67 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 63.59 1itf h SER 72 CO 0.19 1.05 -0.09 0.77 -0.53 0.00 0.00 176.83 178.22 1itf h SER 73 N 0.01 0.82 1.91 6.23 4.64 -0.65 -0.84 113.55 125.68 1itf h SER 73 Ca -0.08 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 60.98 1itf h SER 73 Cb 1.84 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 63.71 1itf h SER 73 CO 0.13 0.94 -0.09 0.00 -0.87 0.00 0.00 176.83 176.94 1itf h ALA 74 N 1.14 0.95 -0.03 5.18 0.00 -1.46 -3.22 119.26 121.82 1itf h ALA 74 Ca 0.13 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 1itf h ALA 74 Cb 0.59 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1itf h ALA 74 CO 0.04 0.06 -0.78 0.00 0.00 0.00 0.00 179.25 178.57 1itf h ALA 75 N 1.95 0.63 -1.00 0.00 0.00 -0.43 -3.46 119.26 116.94 1itf h ALA 75 Ca -0.00 -0.66 -0.63 0.00 0.00 0.00 0.00 54.91 53.62 1itf h ALA 75 Cb 1.04 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.64 1itf h ALA 75 CO 0.01 0.84 -0.52 -1.58 0.00 0.00 0.00 179.25 178.00 1itf s TRP 76 N -3.41 2.17 0.19 0.00 0.52 -0.40 -5.04 118.94 112.97 1itf s TRP 76 Ca -0.03 -0.79 -0.30 0.00 0.02 0.00 0.00 56.10 54.99 1itf s TRP 76 Cb 0.11 -1.76 -0.09 0.00 -1.15 0.00 0.00 33.47 30.58 1itf s TRP 76 CO 0.82 0.21 1.33 -0.51 0.02 0.00 0.00 176.95 178.82 1itf s ASP 77 N -3.87 6.87 0.43 2.95 1.11 -1.26 -4.81 116.67 118.09 1itf s ASP 77 Ca 0.24 2.40 0.16 0.00 0.18 0.00 0.00 52.55 55.53 1itf s ASP 77 Cb 0.04 -2.61 0.95 0.00 1.07 0.00 0.00 42.92 42.37 1itf s ASP 77 CO 0.13 -0.55 1.93 1.05 1.18 0.00 0.00 175.17 178.91 1itf h GLU 78 N 5.57 0.00 0.12 8.23 4.11 -1.97 0.27 114.58 130.91 1itf h GLU 78 Ca -0.44 0.00 -0.24 0.00 0.07 0.00 0.00 59.36 58.75 1itf h GLU 78 Cb 1.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.49 1itf h GLU 78 CO 0.79 0.25 -0.99 1.15 0.07 0.00 0.00 179.01 180.27 1itf h THR 79 N 0.00 1.39 -0.53 -1.06 2.02 -1.96 0.20 112.91 112.97 1itf h THR 79 Ca -0.00 -2.44 -0.07 0.00 0.77 0.00 0.00 66.41 64.67 1itf h THR 79 Cb 0.47 2.90 -0.02 0.00 -1.74 0.00 0.00 68.15 69.75 1itf h THR 79 CO 0.03 0.72 0.06 -0.07 0.37 0.00 0.00 175.52 176.63 1itf h LEU 80 N -0.04 0.81 -0.69 2.58 3.38 -1.89 -1.61 115.31 117.85 1itf h LEU 80 Ca -0.16 -0.18 -0.14 0.00 0.09 0.00 0.00 57.88 57.49 1itf h LEU 80 Cb 1.73 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 42.25 1itf h LEU 80 CO 0.19 0.84 -0.56 -0.07 0.09 0.00 0.00 178.44 178.94 1itf h LEU 81 N 0.81 0.32 -0.24 1.67 3.38 -0.48 -1.80 115.31 118.97 1itf h LEU 81 Ca 0.16 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1itf h LEU 81 Cb 0.40 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1itf h LEU 81 CO 0.01 0.81 0.02 -0.78 0.09 0.00 0.00 178.44 178.59 1itf h ASP 82 N 0.22 -0.06 -0.04 -0.43 3.58 0.32 0.35 116.42 120.37 1itf h ASP 82 Ca 0.00 0.05 -0.07 0.00 0.42 0.00 0.00 57.03 57.43 1itf h ASP 82 Cb 1.04 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 42.16 1itf h ASP 82 CO 0.09 0.00 -0.18 0.11 -2.88 0.00 0.00 179.24 176.38 1itf h LYS 83 N 0.10 0.40 -0.04 0.28 1.57 -1.26 -1.96 116.57 115.65 1itf h LYS 83 Ca 0.11 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 1itf h LYS 83 Cb 0.13 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 1itf h LYS 83 CO -0.17 0.57 -0.30 0.35 -0.57 0.00 0.00 179.45 179.32 1itf h PHE 84 N 0.36 0.08 -0.06 -1.35 3.57 -0.20 -0.30 116.94 119.05 1itf h PHE 84 Ca 0.06 -0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.34 1itf h PHE 84 Cb 0.53 -0.02 0.01 0.00 2.79 0.00 0.00 35.95 39.26 1itf h PHE 84 CO 0.01 0.37 -0.80 1.88 -2.23 0.00 0.00 178.31 177.55 1itf h TYR 85 N 0.07 0.91 -0.54 0.41 0.05 0.33 -0.45 116.97 117.74 1itf h TYR 85 Ca 0.01 -0.46 -0.09 0.00 0.05 0.00 0.00 58.73 58.24 1itf h TYR 85 Cb 0.57 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 38.17 1itf h TYR 85 CO 0.00 1.28 -0.01 1.15 -1.05 0.00 0.00 178.16 179.54 1itf h THR 86 N 0.28 1.26 -0.00 -2.88 2.02 -1.11 0.07 112.91 112.55 1itf h THR 86 Ca -0.08 -1.10 -0.16 0.00 0.77 0.00 0.00 66.41 65.84 1itf h THR 86 Cb 1.46 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 68.70 1itf h THR 86 CO 0.16 0.39 -0.73 -0.33 0.37 0.00 0.00 175.52 175.38 1itf h GLU 87 N 0.86 0.04 -0.20 6.66 4.39 -1.06 -0.95 114.58 124.32 1itf h GLU 87 Ca 0.16 -0.03 -0.14 0.00 0.34 0.00 0.00 59.36 59.69 1itf h GLU 87 Cb 0.52 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1itf h GLU 87 CO 0.03 0.75 -0.45 -0.07 -1.16 0.00 0.00 179.01 178.11 1itf h LEU 88 N 0.02 0.54 -0.33 1.33 3.38 -0.67 -0.29 115.31 119.30 1itf h LEU 88 Ca -0.01 -0.25 -0.19 0.00 0.09 0.00 0.00 57.88 57.52 1itf h LEU 88 Cb 1.29 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1itf h LEU 88 CO 0.10 0.91 -0.65 1.88 0.09 0.00 0.00 178.44 180.77 1itf h TYR 89 N 0.41 0.90 -0.26 1.13 0.05 -0.80 -1.70 116.97 116.70 1itf h TYR 89 Ca 0.03 -0.36 -0.19 0.00 0.05 0.00 0.00 58.73 58.26 1itf h TYR 89 Cb 0.94 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.53 1itf h TYR 89 CO 0.03 1.15 -0.59 0.37 -1.05 0.00 0.00 178.16 178.08 1itf h GLN 90 N 0.51 0.84 -0.39 4.88 5.75 -1.02 -0.62 115.11 125.05 1itf h GLN 90 Ca -0.01 -0.56 -0.08 0.00 -0.15 0.00 0.00 58.65 57.85 1itf h GLN 90 Cb 1.24 0.08 -0.02 0.00 1.07 0.00 0.00 27.48 29.85 1itf h GLN 90 CO 0.13 1.18 -0.09 0.37 -2.65 0.00 0.00 178.83 177.77 1itf h GLN 91 N 0.63 0.68 0.05 1.69 -0.00 -1.06 -0.77 115.11 116.34 1itf h GLN 91 Ca 0.00 -0.21 -0.00 0.00 -0.00 0.00 0.00 58.65 58.44 1itf h GLN 91 Cb 1.20 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 28.61 1itf h GLN 91 CO 0.13 0.76 -0.02 -0.07 0.00 0.00 0.00 178.83 179.63 1itf h LEU 92 N 0.63 -0.05 -0.76 -2.39 3.38 -1.15 -0.55 115.31 114.41 1itf h LEU 92 Ca 0.11 -0.20 0.09 0.00 0.09 0.00 0.00 57.88 57.98 1itf h LEU 92 Cb 0.53 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.22 1itf h LEU 92 CO 0.03 0.17 0.41 -1.13 0.09 0.00 0.00 178.44 178.00 1itf h ASN 93 N -0.28 0.56 -0.26 -0.43 -0.73 -0.81 0.30 115.58 113.93 1itf h ASN 93 Ca -0.01 0.05 -0.01 0.00 1.87 0.00 0.00 56.30 58.21 1itf h ASN 93 Cb 0.25 -0.05 -0.01 0.00 0.27 0.00 0.00 38.32 38.78 1itf h ASN 93 CO 0.01 0.32 0.12 -0.78 -0.37 0.00 0.00 177.43 176.73 1itf h ASP 94 N 0.69 0.34 0.03 1.15 3.58 -0.95 0.19 116.42 121.45 1itf h ASP 94 Ca 0.37 -0.13 -0.00 0.00 0.42 0.00 0.00 57.03 57.69 1itf h ASP 94 Cb 0.37 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 41.33 1itf h ASP 94 CO -0.26 0.37 -0.02 -0.07 -2.88 0.00 0.00 179.24 176.38 1itf h LEU 95 N 0.29 0.00 0.08 2.28 3.38 0.10 -1.95 115.31 119.49 1itf h LEU 95 Ca 0.09 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.79 1itf h LEU 95 Cb 0.12 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.88 1itf h LEU 95 CO -0.01 0.02 -1.21 -0.08 0.09 0.00 0.00 178.44 177.25 1itf h GLU 96 N 0.00 0.34 -0.72 1.13 4.81 0.58 -3.20 114.58 117.53 1itf h GLU 96 Ca -0.00 -0.53 0.13 0.00 -0.13 0.00 0.00 59.36 58.83 1itf h GLU 96 Cb 0.04 0.19 -0.09 0.00 0.63 0.00 0.00 28.75 29.52 1itf h GLU 96 CO 0.00 1.23 0.27 0.00 -0.73 0.00 0.00 179.01 179.79 1itf h ALA 97 N 0.55 0.98 -0.34 2.92 0.00 -0.18 0.33 119.26 123.51 1itf h ALA 97 Ca -0.14 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1itf h ALA 97 Cb 1.92 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.78 1itf h ALA 97 CO 0.21 -0.21 0.20 0.00 0.00 0.00 0.00 179.25 179.45 1itf h VAL 99 N 0.44 1.08 0.20 0.00 2.07 -0.85 -2.86 116.25 116.32 1itf h VAL 99 Ca 0.12 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1itf h VAL 99 Cb 0.03 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1itf h VAL 99 CO -0.02 0.09 -0.20 0.40 0.02 0.00 0.00 177.57 177.85 1itf h ILE 100 N 0.23 0.55 -3.29 4.57 2.04 0.20 -3.44 117.51 118.37 1itf h ILE 100 Ca 0.06 0.00 -0.46 0.00 1.00 0.00 0.00 64.86 65.46 1itf h ILE 100 Cb 0.07 0.55 0.11 0.00 -0.74 0.00 0.00 36.82 36.81 1itf h ILE 100 CO -0.01 0.00 0.25 -1.10 0.00 0.00 0.00 178.15 177.29 1itf s GLN 101 N -6.10 1.54 0.39 2.37 1.11 -1.08 -4.96 119.66 112.93 1itf s GLN 101 Ca -0.15 -0.59 0.06 0.00 0.01 0.00 0.00 55.36 54.68 1itf s GLN 101 Cb 0.07 -2.13 0.78 0.00 -1.01 0.00 0.00 33.01 30.72 1itf s GLN 101 CO 0.65 -1.67 2.03 0.78 0.01 0.00 0.00 175.29 177.08 1itf h GLY 102 N -0.89 0.63 -1.98 3.09 0.00 -1.84 -3.44 103.07 98.63 1itf h GLY 102 Ca -0.42 -0.25 -0.54 0.00 0.00 0.00 0.00 47.33 46.13 1itf h GLY 102 CO 0.47 0.25 -0.44 3.33 0.00 0.00 0.00 176.54 180.14 1itf n VAL 103 N -4.44 0.42 0.00 4.60 0.24 -1.26 -3.01 118.33 114.88 1itf n VAL 103 Ca 0.03 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1itf n VAL 103 Cb 0.08 -0.70 0.00 0.00 -1.47 0.00 0.00 33.84 31.75 1itf n VAL 103 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1itf n GLY 104 N 1.40 2.23 3.85 7.63 0.00 -1.25 -4.24 105.19 114.80 1itf n GLY 104 Ca 0.08 -0.40 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 1itf n GLY 104 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1itf s VAL 105 N 0.00 1.77 0.00 1.61 -7.23 -1.17 -4.40 120.40 110.98 1itf s VAL 105 Ca 0.00 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 58.57 1itf s VAL 105 Cb 0.00 -2.37 0.00 0.00 0.56 0.00 0.00 36.38 34.57 1itf s VAL 105 CO 0.00 0.00 0.00 1.07 -0.31 0.00 0.00 175.10 175.86 1itf n THR 106 N -1.57 0.00 0.32 5.32 5.66 -1.26 -4.92 114.28 117.82 1itf n THR 106 Ca -0.04 0.00 0.20 0.00 -3.05 0.00 0.00 64.05 61.16 1itf n THR 106 Cb 0.65 0.00 1.04 0.00 -1.55 0.00 0.00 70.33 70.46 1itf n THR 106 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 1itf h GLU 107 N 0.00 0.00 -5.00 1.09 5.08 -2.01 -3.45 114.58 110.30 1itf h GLU 107 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 1itf h GLU 107 Cb 0.00 0.00 0.08 0.00 0.50 0.00 0.00 28.75 29.33 1itf h GLU 107 CO 0.00 0.00 -0.29 -2.37 -1.00 0.00 0.00 179.01 175.35 1itf n THR 108 N -3.16 1.15 -0.96 1.13 5.66 -1.26 -4.91 114.28 111.92 1itf n THR 108 Ca -0.02 -0.29 -0.29 0.00 -3.05 0.00 0.00 64.05 60.40 1itf n THR 108 Cb 0.20 0.00 0.23 0.00 -1.55 0.00 0.00 70.33 69.20 1itf n THR 108 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1itf s PRO 109 N -0.57 -0.84 0.00 1.09 0.04 -1.26 -4.84 135.00 128.61 1itf s PRO 109 Ca 0.60 0.27 0.00 0.00 0.04 0.00 0.00 61.00 61.91 1itf s PRO 109 Cb -0.86 -1.61 0.00 0.00 0.04 0.00 0.00 34.50 32.07 1itf s PRO 109 CO 0.47 -3.53 0.73 1.28 0.04 0.00 0.00 177.00 175.99 1itf n LEU 110 N -4.69 0.00 -0.09 -3.56 4.77 -1.26 -2.96 117.00 109.20 1itf n LEU 110 Ca 0.09 0.27 0.26 0.00 -0.03 0.00 0.00 56.01 56.60 1itf n LEU 110 Cb 0.58 -0.27 0.66 0.00 -2.33 0.00 0.00 43.42 42.06 1itf n LEU 110 CO 0.51 -0.27 1.24 0.00 -1.33 0.00 0.00 177.39 177.54 1itf h MET 111 N 0.00 0.00 0.00 3.23 -0.00 -2.00 0.71 114.93 116.86 1itf h MET 111 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1itf h MET 111 Cb 0.23 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.83 1itf h MET 111 CO 0.00 0.00 -0.00 1.57 -0.00 0.00 0.00 176.91 178.48 1itf h LYS 112 N 0.00 0.00 0.05 -0.10 2.10 -1.89 -1.97 116.57 114.75 1itf h LYS 112 Ca 0.37 0.00 -0.24 0.00 -2.00 0.00 0.00 60.65 58.78 1itf h LYS 112 Cb 1.91 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.24 1itf h LYS 112 CO -0.00 0.00 -1.04 1.49 -2.00 0.00 0.00 179.45 177.90 1itf h GLU 113 N 0.00 0.32 0.00 0.07 4.57 0.14 -3.22 114.58 116.47 1itf h GLU 113 Ca -0.00 -0.41 -0.01 0.00 -1.18 0.00 0.00 59.36 57.76 1itf h GLU 113 Cb 0.01 0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.73 1itf h GLU 113 CO 0.00 1.12 -0.04 0.38 -1.18 0.00 0.00 179.01 179.29 1itf h ASP 114 N 0.15 0.00 -0.34 1.04 3.04 -1.48 0.26 116.42 119.09 1itf h ASP 114 Ca -0.09 0.00 -0.13 0.00 -3.24 0.00 0.00 57.03 53.57 1itf h ASP 114 Cb 1.70 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.99 1itf h ASP 114 CO 0.17 0.04 -0.29 -1.28 -2.04 0.00 0.00 179.24 175.85 1itf h SER 115 N 0.00 0.84 -0.26 4.15 0.87 -1.64 0.85 113.55 118.37 1itf h SER 115 Ca -0.00 -0.45 -0.13 0.00 -1.23 0.00 0.00 61.79 59.98 1itf h SER 115 Cb 0.16 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1itf h SER 115 CO 0.01 1.12 -0.30 0.40 -0.53 0.00 0.00 176.83 177.52 1itf h ILE 116 N 0.58 1.28 -0.32 2.23 2.04 -1.24 -2.24 117.51 119.83 1itf h ILE 116 Ca 0.06 -1.45 -0.05 0.00 1.00 0.00 0.00 64.86 64.43 1itf h ILE 116 Cb 0.86 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 38.25 1itf h ILE 116 CO 0.07 0.48 0.00 -0.07 0.00 0.00 0.00 178.15 178.64 1itf h LEU 117 N 0.65 0.46 -0.33 1.44 3.38 -0.30 0.37 115.31 120.98 1itf h LEU 117 Ca 0.07 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 1itf h LEU 117 Cb 0.84 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1itf h LEU 117 CO 0.07 0.53 0.02 0.00 0.09 0.00 0.00 178.44 179.14 1itf h ALA 118 N 1.53 0.45 0.00 1.53 0.00 -0.49 -0.88 119.26 121.40 1itf h ALA 118 Ca 0.10 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1itf h ALA 118 Cb 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1itf h ALA 118 CO 0.01 0.19 -0.22 0.28 0.00 0.00 0.00 179.25 179.51 1itf h VAL 119 N 0.39 0.72 -0.16 0.00 2.07 -0.79 -1.59 116.25 116.89 1itf h VAL 119 Ca 0.10 -0.92 -0.10 0.00 0.82 0.00 0.00 66.70 66.60 1itf h VAL 119 Cb 0.42 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1itf h VAL 119 CO 0.01 0.21 -0.30 -0.09 0.02 0.00 0.00 177.57 177.42 1itf h ARG 120 N 0.00 0.49 0.00 1.57 2.43 0.56 -1.12 114.38 118.31 1itf h ARG 120 Ca -0.00 -0.31 -0.08 0.00 -0.81 0.00 0.00 59.98 58.78 1itf h ARG 120 Cb 0.55 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 1itf h ARG 120 CO 0.03 0.92 -0.37 1.57 -1.51 0.00 0.00 179.97 180.60 1itf h LYS 121 N 0.12 0.00 0.12 0.20 2.10 -1.01 0.11 116.57 118.20 1itf h LYS 121 Ca 0.01 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.65 1itf h LYS 121 Cb 0.90 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.23 1itf h LYS 121 CO 0.07 0.37 -0.06 -0.92 -2.00 0.00 0.00 179.45 176.91 1itf h TYR 122 N 0.00 -0.15 0.00 0.07 3.20 -1.15 -2.16 116.97 116.78 1itf h TYR 122 Ca -0.00 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 1itf h TYR 122 Cb 0.87 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 1itf h TYR 122 CO 0.00 0.23 -0.28 0.74 -1.64 0.00 0.00 178.16 177.21 1itf h PHE 123 N -0.57 0.00 -0.67 -3.82 -1.00 -1.13 -2.11 116.94 107.64 1itf h PHE 123 Ca -0.02 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 1itf h PHE 123 Cb 0.45 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.98 1itf h PHE 123 CO 0.05 0.28 0.30 0.37 -1.61 0.00 0.00 178.31 177.70 1itf h GLN 124 N 0.00 0.98 -0.42 1.51 4.15 -0.82 0.06 115.11 120.56 1itf h GLN 124 Ca -0.00 -0.16 -0.10 0.00 0.77 0.00 0.00 58.65 59.16 1itf h GLN 124 Cb 0.59 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 28.09 1itf h GLN 124 CO 0.04 0.79 -0.12 -0.09 -1.93 0.00 0.00 178.83 177.51 1itf h ARG 125 N 0.93 0.77 -0.61 1.69 2.43 -0.84 -2.10 114.38 116.65 1itf h ARG 125 Ca 0.23 -0.26 -0.04 0.00 -0.81 0.00 0.00 59.98 59.09 1itf h ARG 125 Cb 0.16 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 1itf h ARG 125 CO -0.02 0.86 0.22 0.82 -1.51 0.00 0.00 179.97 180.33 1itf h ILE 126 N 0.69 1.23 -0.46 1.20 2.04 -0.72 0.51 117.51 122.00 1itf h ILE 126 Ca 0.12 -0.74 -0.10 0.00 1.00 0.00 0.00 64.86 65.13 1itf h ILE 126 Cb 0.60 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1itf h ILE 126 CO 0.04 0.29 -0.10 0.74 0.00 0.00 0.00 178.15 179.12 1itf h THR 127 N 0.89 1.27 -0.16 -0.27 2.02 -0.54 -1.43 112.91 114.68 1itf h THR 127 Ca 0.21 -1.22 -0.12 0.00 0.77 0.00 0.00 66.41 66.05 1itf h THR 127 Cb 0.22 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 1itf h THR 127 CO -0.01 0.42 -0.42 0.25 0.37 0.00 0.00 175.52 176.13 1itf h LEU 128 N 0.71 0.40 -0.84 2.58 7.12 -1.05 -2.09 115.31 122.14 1itf h LEU 128 Ca 0.12 -0.17 -0.07 0.00 0.13 0.00 0.00 57.88 57.88 1itf h LEU 128 Cb 0.64 -0.11 -0.02 0.00 -0.53 0.00 0.00 40.66 40.64 1itf h LEU 128 CO 0.04 0.77 0.06 0.22 -0.13 0.00 0.00 178.44 179.41 1itf h TYR 129 N 0.31 0.99 -0.46 1.25 5.03 -0.65 0.38 116.97 123.81 1itf h TYR 129 Ca 0.03 -0.13 -0.13 0.00 2.58 0.00 0.00 58.73 61.08 1itf h TYR 129 Cb 0.87 -0.27 -0.01 0.00 1.55 0.00 0.00 36.73 38.86 1itf h TYR 129 CO 0.02 0.86 -0.21 -0.07 -1.32 0.00 0.00 178.16 177.44 1itf h LEU 130 N 0.88 0.96 -0.89 2.82 3.38 -0.97 -1.54 115.31 119.95 1itf h LEU 130 Ca 0.17 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.71 1itf h LEU 130 Cb 0.43 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1itf h LEU 130 CO 0.01 1.13 -0.34 0.11 0.09 0.00 0.00 178.44 179.44 1itf h LYS 131 N 0.81 0.00 -0.06 1.13 1.57 -1.02 0.66 116.57 119.67 1itf h LYS 131 Ca 0.11 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.84 1itf h LYS 131 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1itf h LYS 131 CO 0.06 0.34 -0.16 1.49 -0.57 0.00 0.00 179.45 180.62 1itf h GLU 132 N 0.00 0.20 -0.02 3.15 4.57 -0.56 -2.94 114.58 118.98 1itf h GLU 132 Ca -0.00 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1itf h GLU 132 Cb 0.90 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.52 1itf h GLU 132 CO 0.04 0.76 0.00 1.63 -1.18 0.00 0.00 179.01 180.26 1itf n LYS 133 N -4.60 1.14 -3.10 1.92 4.01 -0.61 -4.88 118.16 112.03 1itf n LYS 133 Ca -0.08 -0.20 -0.21 0.00 -0.51 0.00 0.00 58.31 57.31 1itf n LYS 133 Cb 0.39 -1.37 0.04 0.00 -0.51 0.00 0.00 35.03 33.59 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 -0.64 -5.25 -3.52 1.97 5.02 -0.26 -2.68 118.16 112.81 1itf n LYS 134 Ca 0.17 0.81 -0.19 0.00 -2.02 0.00 0.00 58.31 57.09 1itf n LYS 134 Cb 0.13 -5.54 0.07 0.00 -0.02 0.00 0.00 35.03 29.67 1itf n LYS 134 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1itf n TYR 135 N -4.52 -2.16 -1.76 2.13 4.01 0.22 -4.98 117.16 110.10 1itf n TYR 135 Ca -0.07 0.92 -0.31 0.00 -0.16 0.00 0.00 57.90 58.28 1itf n TYR 135 Cb 0.60 -4.88 0.04 0.00 -0.31 0.00 0.00 39.34 34.78 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 -4.28 5.63 0.26 7.72 0.01 -1.09 -4.89 113.70 117.05 1itf s SER 136 Ca 0.05 1.39 0.02 0.00 1.31 0.00 0.00 55.95 58.72 1itf s SER 136 Cb -0.02 -2.30 0.33 0.00 0.21 0.00 0.00 66.02 64.24 1itf s SER 136 CO 0.75 -1.25 1.64 1.55 0.41 0.00 0.00 173.24 176.34 1itf h PRO 137 N -0.59 0.41 -0.21 12.44 0.13 -1.93 -0.51 132.00 141.75 1itf h PRO 137 Ca -0.45 -0.20 -0.20 0.00 -0.87 0.00 0.00 66.00 64.28 1itf h PRO 137 Cb 1.22 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1itf h PRO 137 CO 0.61 0.75 -0.67 0.00 -0.23 0.00 0.00 178.00 178.46 1itf h ALA 139 N 0.67 0.94 -0.08 0.00 0.00 -1.83 -1.84 119.26 117.12 1itf h ALA 139 Ca -0.02 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 1itf h ALA 139 Cb 1.28 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 1itf h ALA 139 CO 0.14 0.67 -0.36 -1.49 0.00 0.00 0.00 179.25 178.21 1itf h TRP 140 N 1.09 0.18 -0.64 0.00 4.06 -0.98 -1.03 115.95 118.64 1itf h TRP 140 Ca 0.22 -0.04 -0.09 0.00 2.06 0.00 0.00 58.89 61.04 1itf h TRP 140 Cb 0.38 -0.04 -0.02 0.00 -1.00 0.00 0.00 29.16 28.47 1itf h TRP 140 CO 0.03 0.51 0.04 1.49 -3.56 0.00 0.00 178.44 176.94 1itf h GLU 141 N 0.14 1.10 -0.47 0.49 4.57 -0.49 0.44 114.58 120.36 1itf h GLU 141 Ca 0.02 -0.33 -0.10 0.00 -1.18 0.00 0.00 59.36 57.76 1itf h GLU 141 Cb 0.71 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.17 1itf h GLU 141 CO 0.05 1.04 -0.11 0.28 -1.18 0.00 0.00 179.01 179.10 1itf h VAL 142 N 1.01 1.27 0.00 0.32 2.07 -0.96 -1.67 116.25 118.28 1itf h VAL 142 Ca 0.18 -1.23 -0.04 0.00 0.82 0.00 0.00 66.70 66.44 1itf h VAL 142 Cb 0.53 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1itf h VAL 142 CO 0.03 0.42 -0.18 0.58 0.02 0.00 0.00 177.57 178.44 1itf h VAL 143 N 0.75 0.45 -0.07 2.57 2.07 -0.87 0.07 116.25 121.22 1itf h VAL 143 Ca 0.12 -0.97 -0.07 0.00 0.82 0.00 0.00 66.70 66.60 1itf h VAL 143 Cb 0.65 1.69 0.00 0.00 -1.52 0.00 0.00 31.29 32.12 1itf h VAL 143 CO 0.04 0.17 -0.23 -0.09 0.02 0.00 0.00 177.57 177.49 1itf h ARG 144 N 0.00 0.27 -0.19 1.57 2.43 0.40 0.13 114.38 119.00 1itf h ARG 144 Ca -0.00 -0.21 -0.11 0.00 -0.81 0.00 0.00 59.98 58.85 1itf h ARG 144 Cb 0.68 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.25 1itf h ARG 144 CO 0.02 0.83 -0.35 0.00 -1.51 0.00 0.00 179.97 178.96 1itf h ALA 145 N 0.44 1.04 -0.20 2.80 0.00 -1.16 -0.26 119.26 121.92 1itf h ALA 145 Ca -0.01 -0.39 -0.18 0.00 0.00 0.00 0.00 54.91 54.33 1itf h ALA 145 Cb 0.86 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1itf h ALA 145 CO 0.05 0.59 -0.60 0.93 0.00 0.00 0.00 179.25 180.22 1itf h GLU 146 N 0.35 0.66 -0.36 0.00 4.39 -0.95 -0.84 114.58 117.83 1itf h GLU 146 Ca 0.04 -0.44 -0.13 0.00 0.34 0.00 0.00 59.36 59.16 1itf h GLU 146 Cb 0.78 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.49 1itf h GLU 146 CO 0.06 1.06 -0.31 0.82 -1.16 0.00 0.00 179.01 179.48 1itf h ILE 147 N 0.49 1.28 -0.01 3.13 1.08 -0.50 -0.24 117.51 122.74 1itf h ILE 147 Ca -0.00 -1.47 -0.00 0.00 -0.39 0.00 0.00 64.86 63.00 1itf h ILE 147 Cb 1.18 1.34 -0.00 0.00 -3.07 0.00 0.00 36.82 36.26 1itf h ILE 147 CO 0.12 0.48 0.00 -0.03 -0.69 0.00 0.00 178.15 178.04 1itf h MET 148 N 0.67 0.01 -0.17 2.37 4.05 -0.91 -0.27 114.93 120.68 1itf h MET 148 Ca 0.07 -0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.39 1itf h MET 148 Cb 0.85 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.64 1itf h MET 148 CO 0.07 0.21 -0.32 0.00 0.23 0.00 0.00 176.91 177.11 1itf h ARG 149 N -0.19 0.33 -0.01 0.39 2.47 -1.08 0.15 114.38 116.43 1itf h ARG 149 Ca 0.00 -0.13 -0.01 0.00 -1.26 0.00 0.00 59.98 58.57 1itf h ARG 149 Cb 0.20 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.51 1itf h ARG 149 CO -0.00 0.62 -0.05 0.77 0.56 0.00 0.00 179.97 181.87 1itf h SER 150 N 0.29 0.07 0.15 7.04 0.02 -0.94 0.99 113.55 121.17 1itf h SER 150 Ca 0.04 -0.62 -0.07 0.00 -0.84 0.00 0.00 61.79 60.30 1itf h SER 150 Cb 0.71 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 1itf h SER 150 CO 0.05 0.68 -0.24 0.15 -1.14 0.00 0.00 176.83 176.33 1itf h PHE 151 N -0.54 0.18 -0.24 3.45 3.57 -1.01 -0.69 116.94 121.66 1itf h PHE 151 Ca -0.00 -0.03 -0.18 0.00 3.53 0.00 0.00 57.97 61.29 1itf h PHE 151 Cb 0.67 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.37 1itf h PHE 151 CO 0.14 0.41 -0.55 0.77 -2.23 0.00 0.00 178.31 176.85 1itf h SER 152 N 0.16 0.89 -0.62 0.41 0.02 -0.66 -1.88 113.55 111.87 1itf h SER 152 Ca 0.03 -0.56 -0.01 0.00 -0.84 0.00 0.00 61.79 60.41 1itf h SER 152 Cb 0.52 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.77 1itf h SER 152 CO 0.04 1.29 0.36 -0.07 -1.14 0.00 0.00 176.83 177.30 1itf h LEU 153 N 0.53 0.76 -0.82 5.07 3.38 -0.27 0.69 115.31 124.65 1itf h LEU 153 Ca -0.00 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1itf h LEU 153 Cb 1.16 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 1itf h LEU 153 CO 0.12 0.61 -0.03 0.28 0.09 0.00 0.00 178.44 179.52 1itf h SER 154 N 0.84 0.83 -0.10 -0.43 0.02 -1.09 -2.46 113.55 111.16 1itf h SER 154 Ca 0.22 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1itf h SER 154 Cb 0.00 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.32 1itf h SER 154 CO -0.04 0.91 0.00 0.35 -1.14 0.00 0.00 176.83 176.91 1itf n THR 155 N -4.19 0.11 1.91 -2.27 -2.24 -0.71 -4.07 114.28 102.81 1itf n THR 155 Ca 0.02 -0.36 0.13 0.00 -2.27 0.00 0.00 64.05 61.58 1itf n THR 155 Cb 0.33 0.64 0.75 0.00 -2.10 0.00 0.00 70.33 69.95 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 0.50 0.24 -0.13 3.42 4.05 0.24 -4.04 115.26 119.53 1itf n ASN 156 Ca 0.17 -1.22 0.16 0.00 0.45 0.00 0.00 54.58 54.15 1itf n ASN 156 Cb 0.40 -0.01 0.54 0.00 1.23 0.00 0.00 39.78 41.94 1itf n ASN 156 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1itf h LEU 157 N 0.35 0.32 0.36 1.20 -0.00 -1.70 0.90 115.31 116.73 1itf h LEU 157 Ca 0.00 0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 57.88 1itf h LEU 157 Cb 0.07 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 40.69 1itf h LEU 157 CO 0.00 0.17 -0.17 1.56 -0.00 0.00 0.00 178.44 180.00 1itf h GLN 158 N 0.34 -0.46 0.00 1.13 4.20 -1.93 -2.77 115.11 115.62 1itf h GLN 158 Ca 0.34 0.03 -0.07 0.00 0.06 0.00 0.00 58.65 59.01 1itf h GLN 158 Cb 0.85 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.73 1itf h GLN 158 CO -0.09 -0.18 -0.32 1.49 -0.67 0.00 0.00 178.83 179.06 1itf h GLU 159 N -1.02 0.00 -2.69 1.46 4.57 -1.79 -3.39 114.58 111.72 1itf h GLU 159 Ca -0.05 0.00 -0.56 0.00 -1.18 0.00 0.00 59.36 57.57 1itf h GLU 159 Cb 0.50 0.00 -0.39 0.00 -0.16 0.00 0.00 28.75 28.69 1itf h GLU 159 CO 0.08 0.32 -0.82 0.45 -1.18 0.00 0.00 179.01 177.87 1itf s SER 160 N -6.31 3.25 0.03 1.04 0.15 0.31 -4.62 113.70 107.54 1itf s SER 160 Ca 0.02 -1.76 -0.27 0.00 0.70 0.00 0.00 55.95 54.63 1itf s SER 160 Cb 0.09 -0.38 -0.17 0.00 -1.71 0.00 0.00 66.02 63.85 1itf s SER 160 CO 0.68 -0.37 1.35 -0.07 1.20 0.00 0.00 173.24 176.03 1itf h LEU 161 N 7.68 -0.51 0.00 3.45 4.07 -1.64 -3.28 115.31 125.07 1itf h LEU 161 Ca -0.06 -0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.82 1itf h LEU 161 Cb 0.99 0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.86 1itf h LEU 161 CO 0.35 -0.21 -0.18 0.54 -1.08 0.00 0.00 178.44 177.86 1itf n ARG 162 N -5.27 0.00 -3.17 1.13 1.74 -1.26 -4.64 116.66 105.19 1itf n ARG 162 Ca -0.11 0.00 -0.23 0.00 -0.77 0.00 0.00 57.85 56.75 1itf n ARG 162 Cb 0.30 -0.37 -0.06 0.00 -1.02 0.00 0.00 32.46 31.31 1itf n ARG 162 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1itf n SER 163 N -3.34 -0.26 -3.03 0.55 7.64 -1.26 -4.98 113.62 108.94 1itf n SER 163 Ca 0.00 -2.71 -0.17 0.00 1.01 0.00 0.00 58.87 57.00 1itf n SER 163 Cb 0.09 -0.36 -0.02 0.00 -1.01 0.00 0.00 64.21 62.91 1itf n SER 163 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1itf n LYS 164 N 1.64 0.78 0.00 1.43 3.00 -1.26 -5.10 118.16 118.65 1itf n LYS 164 Ca 0.21 -2.71 0.00 0.00 -0.00 0.00 0.00 58.31 55.81 1itf n LYS 164 Cb 0.53 -1.34 0.00 0.00 0.00 0.00 0.00 35.03 34.23 1itf n LYS 164 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55