#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yum s LYS 3 N 0.00 3.82 -0.26 1.61 -0.14 -1.26 -4.83 119.74 118.67 1yum s LYS 3 Ca 0.00 0.46 -0.11 0.00 -1.36 0.00 0.00 55.97 54.96 1yum s LYS 3 Cb 0.00 -2.44 -0.05 0.00 -1.68 0.00 0.00 37.83 33.66 1yum s LYS 3 CO 0.00 0.05 0.18 1.03 -0.76 0.00 0.00 175.35 175.85 1yum s ARG 4 N -3.55 4.01 -0.09 1.68 0.52 -1.26 -0.90 118.95 119.35 1yum s ARG 4 Ca 0.51 -0.30 -0.00 0.00 -0.52 0.00 0.00 55.73 55.42 1yum s ARG 4 Cb -0.10 -3.60 0.02 0.00 0.52 0.00 0.00 34.95 31.79 1yum s ARG 4 CO 0.27 -0.07 -0.06 0.42 0.02 0.00 0.00 175.30 175.89 1yum s ILE 5 N 1.43 0.78 0.16 1.52 1.01 0.25 -0.26 121.20 126.09 1yum s ILE 5 Ca 0.07 -0.17 0.03 0.00 0.00 0.00 0.00 60.65 60.58 1yum s ILE 5 Cb -0.15 -0.83 -0.03 0.00 0.01 0.00 0.00 42.46 41.46 1yum s ILE 5 CO 0.08 0.31 0.29 -0.83 0.00 0.00 0.00 174.94 174.80 1yum s GLY 6 N 1.54 1.66 -0.09 6.18 0.00 0.15 -0.43 107.32 116.32 1yum s GLY 6 Ca 0.00 -1.05 0.03 0.00 0.00 0.00 0.00 44.72 43.70 1yum s GLY 6 CO -0.05 -1.05 -0.19 -2.27 0.00 0.00 0.00 173.10 169.54 1yum s LEU 7 N -3.31 1.91 -0.35 0.66 2.96 0.26 0.19 118.68 121.01 1yum s LEU 7 Ca 0.34 -0.46 -0.01 0.00 -0.22 0.00 0.00 54.13 53.79 1yum s LEU 7 Cb -0.11 -1.18 0.12 0.00 0.50 0.00 0.00 46.19 45.52 1yum s LEU 7 CO 0.29 0.10 0.18 0.12 -1.32 0.00 0.00 176.35 175.71 1yum s PHE 8 N 0.50 1.10 0.64 5.38 5.36 -0.25 -1.36 117.98 129.36 1yum s PHE 8 Ca -0.17 -1.65 -0.15 0.00 -0.96 0.00 0.00 56.93 54.00 1yum s PHE 8 Cb -0.17 -1.28 -0.01 0.00 -0.34 0.00 0.00 43.02 41.21 1yum s PHE 8 CO 0.06 -0.83 1.08 0.20 -1.46 0.00 0.00 175.22 174.27 1yum s GLY 9 N 1.26 2.06 0.00 13.12 0.00 -1.26 -1.42 107.32 121.07 1yum s GLY 9 Ca 0.14 0.40 0.00 0.00 0.00 0.00 0.00 44.72 45.26 1yum s GLY 9 CO -0.13 0.73 0.00 0.61 0.00 0.00 0.00 173.10 174.31 1yum n GLY 10 N -0.95 1.25 0.11 0.20 0.00 -0.97 -4.88 105.19 99.94 1yum n GLY 10 Ca 0.09 -0.87 -0.16 0.00 0.00 0.00 0.00 46.02 45.08 1yum n GLY 10 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1yum h THR 11 N 0.41 1.02 -5.47 2.61 1.35 -1.89 -0.32 112.91 110.62 1yum h THR 11 Ca 0.00 -2.71 -0.06 0.00 -0.55 0.00 0.00 66.41 63.09 1yum h THR 11 Cb 0.00 2.65 0.02 0.00 -1.73 0.00 0.00 68.15 69.09 1yum h THR 11 CO 0.00 0.77 -0.16 0.49 -0.25 0.00 0.00 175.52 176.38 1yum n PHE 12 N -3.38 -2.87 -3.20 4.73 0.99 -1.26 -4.60 117.46 107.87 1yum n PHE 12 Ca -0.19 1.09 -0.26 0.00 -0.00 0.00 0.00 57.45 58.09 1yum n PHE 12 Cb 1.04 -4.03 -0.06 0.00 -1.00 0.00 0.00 39.48 35.43 1yum n PHE 12 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 1yum n ASP 13 N -1.97 3.17 -4.99 4.37 2.03 -1.26 -3.14 116.55 114.75 1yum n ASP 13 Ca -0.03 -3.37 -0.19 0.00 0.52 0.00 0.00 54.79 51.72 1yum n ASP 13 Cb 0.52 -0.62 0.02 0.00 -0.72 0.00 0.00 41.12 40.32 1yum n ASP 13 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1yum s PRO 14 N -2.62 2.78 0.34 -0.67 0.04 -1.26 -4.75 135.00 128.86 1yum s PRO 14 Ca 0.42 -1.02 -0.28 0.00 0.04 0.00 0.00 61.00 60.16 1yum s PRO 14 Cb 0.22 -2.67 -0.12 0.00 0.04 0.00 0.00 34.50 31.97 1yum s PRO 14 CO -0.07 -0.38 1.37 1.55 0.04 0.00 0.00 177.00 179.50 1yum n VAL 15 N -2.00 1.87 -4.01 -0.36 3.14 -1.19 -4.75 118.33 111.03 1yum n VAL 15 Ca 0.07 -0.47 -0.04 0.00 -2.96 0.00 0.00 64.34 60.94 1yum n VAL 15 Cb 0.59 -1.69 -0.01 0.00 -1.06 0.00 0.00 33.84 31.67 1yum n VAL 15 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1yum n HIS 16 N 0.57 -0.20 0.04 1.45 1.44 -1.26 -4.70 115.22 112.56 1yum n HIS 16 Ca 0.04 -0.53 -0.01 0.00 -2.01 0.00 0.00 57.72 55.22 1yum n HIS 16 Cb 0.36 0.06 0.26 0.00 0.12 0.00 0.00 29.99 30.80 1yum n HIS 16 CO 0.00 0.00 0.00 0.97 -2.81 0.00 0.00 176.34 174.50 1yum h ILE 17 N 1.20 1.24 0.12 0.61 2.10 -1.24 -1.39 117.51 120.15 1yum h ILE 17 Ca -0.05 -1.09 -0.01 0.00 1.08 0.00 0.00 64.86 64.80 1yum h ILE 17 Cb 0.23 1.27 0.00 0.00 -1.09 0.00 0.00 36.82 37.23 1yum h ILE 17 CO 0.07 0.35 -0.06 1.23 -1.08 0.00 0.00 178.15 178.65 1yum h GLY 18 N 0.95 -0.17 0.65 8.18 0.00 -1.86 -1.27 103.07 109.53 1yum h GLY 18 Ca 0.06 0.06 0.06 0.00 0.00 0.00 0.00 47.33 47.52 1yum h GLY 18 CO 0.04 -0.06 0.26 0.45 0.00 0.00 0.00 176.54 177.22 1yum h HIS 19 N -0.36 0.47 -0.14 5.60 3.86 -1.86 -2.74 115.15 119.99 1yum h HIS 19 Ca -0.02 0.02 -0.16 0.00 -1.16 0.00 0.00 60.37 59.06 1yum h HIS 19 Cb 0.29 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 1yum h HIS 19 CO -0.01 0.21 -0.58 0.52 0.86 0.00 0.00 177.93 178.93 1yum h MET 20 N 0.49 0.43 -0.39 2.45 2.86 -1.10 -2.12 114.93 117.55 1yum h MET 20 Ca 0.25 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1yum h MET 20 Cb 0.19 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1yum h MET 20 CO -0.19 0.89 0.19 0.00 1.06 0.00 0.00 176.91 178.85 1yum h ARG 21 N 0.33 0.56 -0.79 1.72 2.47 -1.19 -1.01 114.38 116.48 1yum h ARG 21 Ca -0.00 -0.08 0.08 0.00 -1.26 0.00 0.00 59.98 58.72 1yum h ARG 21 Cb 1.11 -0.10 -0.07 0.00 -1.65 0.00 0.00 29.97 29.26 1yum h ARG 21 CO 0.10 0.50 0.45 0.77 0.56 0.00 0.00 179.97 182.34 1yum h SER 22 N 0.49 0.64 0.06 7.04 0.02 -1.34 0.07 113.55 120.54 1yum h SER 22 Ca 0.13 0.04 0.02 0.00 -0.84 0.00 0.00 61.79 61.15 1yum h SER 22 Cb 0.12 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.55 1yum h SER 22 CO -0.02 0.38 -0.18 0.00 -1.14 0.00 0.00 176.83 175.88 1yum h ALA 23 N 1.43 -0.27 -0.76 3.77 0.00 -1.08 0.67 119.26 123.01 1yum h ALA 23 Ca 0.37 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.30 1yum h ALA 23 Cb 0.31 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 1yum h ALA 23 CO -0.23 -0.69 0.48 0.28 0.00 0.00 0.00 179.25 179.09 1yum h VAL 24 N -0.32 1.10 -0.30 0.00 2.07 -0.25 -0.96 116.25 117.60 1yum h VAL 24 Ca 0.04 -0.32 -0.12 0.00 0.82 0.00 0.00 66.70 67.12 1yum h VAL 24 Cb 0.36 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1yum h VAL 24 CO -0.13 0.17 -0.27 -0.33 0.02 0.00 0.00 177.57 177.03 1yum h GLU 25 N 0.94 0.72 0.21 1.57 5.08 -0.90 -2.59 114.58 119.60 1yum h GLU 25 Ca 0.31 -0.37 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1yum h GLU 25 Cb 0.03 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1yum h GLU 25 CO -0.12 0.98 -0.17 1.98 -1.00 0.00 0.00 179.01 180.69 1yum h MET 26 N 0.47 -0.37 -0.88 2.33 4.05 -0.14 -2.02 114.93 118.35 1yum h MET 26 Ca 0.05 0.03 0.07 0.00 -0.28 0.00 0.00 59.70 59.57 1yum h MET 26 Cb 0.84 0.09 -0.06 0.00 -0.80 0.00 0.00 31.60 31.66 1yum h MET 26 CO 0.07 -0.25 0.57 0.00 0.23 0.00 0.00 176.91 177.53 1yum h ALA 27 N 0.37 1.57 0.67 0.39 0.00 -1.20 -1.00 119.26 120.06 1yum h ALA 27 Ca -0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1yum h ALA 27 Cb 0.35 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1yum h ALA 27 CO -0.02 0.29 -0.32 0.93 0.00 0.00 0.00 179.25 180.13 1yum h GLU 28 N 0.96 -0.87 -0.68 0.00 5.08 -1.37 -0.35 114.58 117.35 1yum h GLU 28 Ca 0.39 0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.87 1yum h GLU 28 Cb 0.26 0.20 -0.09 0.00 0.50 0.00 0.00 28.75 29.62 1yum h GLU 28 CO -0.15 -0.58 -0.46 0.37 -1.00 0.00 0.00 179.01 177.19 1yum h GLN 29 N -1.09 -0.07 -0.08 2.33 4.15 -1.06 0.59 115.11 119.89 1yum h GLN 29 Ca -0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.33 1yum h GLN 29 Cb 0.69 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.40 1yum h GLN 29 CO 0.15 -0.05 0.00 1.19 -1.93 0.00 0.00 178.83 178.20 1yum n PHE 30 N -4.78 0.09 -4.12 3.99 3.01 -0.41 -4.90 117.46 110.34 1yum n PHE 30 Ca 0.01 -0.05 -0.29 0.00 1.01 0.00 0.00 57.45 58.13 1yum n PHE 30 Cb 0.22 -0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.64 1yum n PHE 30 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1yum n ALA 31 N -0.30 -1.91 -1.92 4.37 0.00 0.20 -4.89 120.51 116.05 1yum n ALA 31 Ca 0.02 -0.29 -0.41 0.00 0.00 0.00 0.00 53.44 52.76 1yum n ALA 31 Cb 0.06 -1.47 -0.03 0.00 0.00 0.00 0.00 19.45 18.01 1yum n ALA 31 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yum s LEU 32 N -7.15 4.45 0.10 0.00 1.43 -0.19 -4.81 118.68 112.51 1yum s LEU 32 Ca 0.10 2.39 -0.10 0.00 -1.03 0.00 0.00 54.13 55.49 1yum s LEU 32 Cb -0.05 -3.62 -0.16 0.00 0.03 0.00 0.00 46.19 42.39 1yum s LEU 32 CO 0.93 -0.42 1.26 0.44 0.23 0.00 0.00 176.35 178.80 1yum h ASP 33 N 4.66 0.79 -3.72 2.29 3.32 -0.97 -3.46 116.42 119.33 1yum h ASP 33 Ca -0.46 -0.60 -0.18 0.00 0.02 0.00 0.00 57.03 55.81 1yum h ASP 33 Cb 1.22 -0.24 -0.27 0.00 0.22 0.00 0.00 39.33 40.26 1yum h ASP 33 CO 0.72 1.39 -0.49 -0.70 -1.72 0.00 0.00 179.24 178.45 1yum s GLU 34 N -3.42 0.22 -0.15 3.56 2.12 -1.02 -4.51 118.70 115.50 1yum s GLU 34 Ca -0.08 0.32 0.02 0.00 0.36 0.00 0.00 54.97 55.58 1yum s GLU 34 Cb 0.08 0.06 0.02 0.00 0.26 0.00 0.00 34.13 34.55 1yum s GLU 34 CO 0.90 -0.05 -0.20 -1.17 -0.54 0.00 0.00 175.26 174.20 1yum s LEU 35 N 0.33 2.03 -0.38 2.70 2.96 0.19 -0.67 118.68 125.84 1yum s LEU 35 Ca -0.02 -0.59 -0.13 0.00 -0.22 0.00 0.00 54.13 53.17 1yum s LEU 35 Cb -0.03 -1.39 0.01 0.00 0.50 0.00 0.00 46.19 45.28 1yum s LEU 35 CO -0.01 0.03 0.26 -0.13 -1.32 0.00 0.00 176.35 175.18 1yum s ARG 36 N 1.06 3.15 0.05 1.98 0.52 0.13 -0.98 118.95 124.85 1yum s ARG 36 Ca -0.02 -0.88 -0.30 0.00 -0.52 0.00 0.00 55.73 54.00 1yum s ARG 36 Cb -0.14 -3.86 -0.05 0.00 0.52 0.00 0.00 34.95 31.41 1yum s ARG 36 CO -0.06 -0.62 1.16 -0.51 0.02 0.00 0.00 175.30 175.29 1yum s LEU 37 N 1.67 4.37 -0.69 2.53 1.02 0.53 -1.09 118.68 127.01 1yum s LEU 37 Ca 0.05 1.94 -0.00 0.00 0.02 0.00 0.00 54.13 56.14 1yum s LEU 37 Cb -0.18 -3.58 0.17 0.00 0.02 0.00 0.00 46.19 42.62 1yum s LEU 37 CO 0.09 -0.44 0.51 -0.22 0.02 0.00 0.00 176.35 176.32 1yum s LEU 38 N 1.11 5.13 0.32 1.79 2.96 -0.51 -0.29 118.68 129.19 1yum s LEU 38 Ca 0.57 -3.26 -0.29 0.00 -0.22 0.00 0.00 54.13 50.93 1yum s LEU 38 Cb -0.28 -1.81 -0.10 0.00 0.50 0.00 0.00 46.19 44.50 1yum s LEU 38 CO 0.29 -0.26 1.29 -2.16 -1.32 0.00 0.00 176.35 174.19 1yum s PRO 39 N -0.65 4.38 0.16 0.98 0.04 -1.25 -2.30 135.00 136.36 1yum s PRO 39 Ca 0.21 2.17 -0.05 0.00 0.04 0.00 0.00 61.00 63.37 1yum s PRO 39 Cb -0.15 -3.09 -0.06 0.00 0.04 0.00 0.00 34.50 31.24 1yum s PRO 39 CO -0.07 -0.16 0.41 -0.80 0.04 0.00 0.00 177.00 176.42 1yum s ASN 40 N -0.47 6.50 0.62 6.66 0.02 -0.13 -4.43 114.94 123.70 1yum s ASN 40 Ca 0.49 0.62 -0.13 0.00 -1.02 0.00 0.00 52.86 52.82 1yum s ASN 40 Cb -0.39 -2.10 -0.03 0.00 0.02 0.00 0.00 41.25 38.75 1yum s ASN 40 CO 0.51 0.02 1.04 0.00 0.02 0.00 0.00 177.10 178.69 1yum s ALA 41 N -1.71 2.85 0.11 0.60 0.00 -1.26 -4.87 121.76 117.48 1yum s ALA 41 Ca 0.42 0.16 -0.25 0.00 0.00 0.00 0.00 51.96 52.28 1yum s ALA 41 Cb -0.12 -3.16 0.08 0.00 0.00 0.00 0.00 23.12 19.92 1yum s ALA 41 CO 0.25 -0.82 0.76 -0.98 0.00 0.00 0.00 175.76 174.96 1yum s ARG 42 N -4.61 1.15 0.75 0.00 1.70 -1.26 -4.68 118.95 111.99 1yum s ARG 42 Ca 0.59 -0.47 -0.14 0.00 -0.47 0.00 0.00 55.73 55.23 1yum s ARG 42 Cb -0.13 0.49 0.05 0.00 -0.57 0.00 0.00 34.95 34.79 1yum s ARG 42 CO 0.45 -0.51 1.20 -2.14 -1.08 0.00 0.00 175.30 173.23 1yum s PRO 43 N -3.48 2.03 0.59 3.89 0.02 -1.26 -4.83 135.00 131.96 1yum s PRO 43 Ca 0.05 1.74 0.31 0.00 0.02 0.00 0.00 61.00 63.12 1yum s PRO 43 Cb -0.02 -1.82 1.85 0.00 0.02 0.00 0.00 34.50 34.53 1yum s PRO 43 CO -0.08 -1.91 2.25 -1.35 -0.33 0.00 0.00 177.00 175.57 1yum h PRO 44 N -0.45 0.00 0.00 5.54 0.11 -1.99 -1.69 132.00 133.52 1yum h PRO 44 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1yum h PRO 44 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1yum h PRO 44 CO 0.49 0.02 -0.18 1.12 -0.21 0.00 0.00 178.00 179.24 1yum h HIS 45 N 0.00 0.00 -0.17 0.65 2.07 -2.01 -2.82 115.15 112.87 1yum h HIS 45 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1yum h HIS 45 Cb 0.05 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.03 1yum h HIS 45 CO 0.00 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 175.40 1yum n ARG 46 N -2.92 1.80 -1.75 5.12 5.12 -0.64 -4.91 116.66 118.48 1yum n ARG 46 Ca 0.04 -1.19 -0.30 0.00 -1.93 0.00 0.00 57.85 54.46 1yum n ARG 46 Cb 0.52 -1.41 0.07 0.00 -1.16 0.00 0.00 32.46 30.48 1yum n ARG 46 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1yum s GLU 47 N -1.78 2.51 0.34 5.56 0.41 -1.07 -4.98 118.70 119.69 1yum s GLU 47 Ca 0.33 0.52 -0.28 0.00 -0.41 0.00 0.00 54.97 55.13 1yum s GLU 47 Cb 0.18 -1.98 -0.10 0.00 -1.78 0.00 0.00 34.13 30.46 1yum s GLU 47 CO 0.27 -1.29 1.27 0.99 -0.49 0.00 0.00 175.26 176.01 1yum s THR 48 N -3.28 2.82 0.27 3.63 2.01 -1.26 -4.92 115.64 114.91 1yum s THR 48 Ca 0.59 0.81 -0.30 0.00 0.31 0.00 0.00 61.69 63.10 1yum s THR 48 Cb -0.12 -3.51 -0.13 0.00 0.01 0.00 0.00 72.50 68.75 1yum s THR 48 CO 0.53 0.18 1.46 -2.65 -0.69 0.00 0.00 174.62 173.44 1yum n PRO 49 N 0.71 2.26 -1.16 4.92 -0.02 -1.26 -1.92 135.00 138.54 1yum n PRO 49 Ca 0.01 0.80 -0.05 0.00 -2.02 0.00 0.00 63.50 62.24 1yum n PRO 49 Cb 0.43 -2.49 -0.02 0.00 -0.02 0.00 0.00 33.50 31.39 1yum n PRO 49 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1yum n GLN 50 N 1.90 -1.56 -3.94 -0.52 6.02 -1.26 -4.77 117.38 113.25 1yum n GLN 50 Ca 0.10 0.64 -0.30 0.00 -0.01 0.00 0.00 57.00 57.42 1yum n GLN 50 Cb 0.34 -4.91 -0.16 0.00 1.02 0.00 0.00 30.24 26.53 1yum n GLN 50 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1yum s VAL 51 N -1.61 1.54 0.51 5.09 1.01 -0.81 -4.80 120.40 121.34 1yum s VAL 51 Ca 0.00 -1.26 0.02 0.00 0.00 0.00 0.00 61.98 60.74 1yum s VAL 51 Cb 0.00 -1.82 0.02 0.00 0.00 0.00 0.00 36.38 34.58 1yum s VAL 51 CO 0.00 -0.13 0.72 -0.94 0.00 0.00 0.00 175.10 174.75 1yum s SER 52 N 1.38 5.42 0.23 3.32 1.04 -1.26 -4.02 113.70 119.81 1yum s SER 52 Ca -0.05 -0.04 -0.07 0.00 0.48 0.00 0.00 55.95 56.26 1yum s SER 52 Cb -0.19 -0.93 0.39 0.00 0.10 0.00 0.00 66.02 65.39 1yum s SER 52 CO -0.07 -1.01 1.69 0.00 0.98 0.00 0.00 173.24 174.84 1yum h ALA 53 N 0.22 0.84 0.00 5.32 0.00 -1.97 0.10 119.26 123.78 1yum h ALA 53 Ca -0.42 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.61 1yum h ALA 53 Cb 1.29 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 1yum h ALA 53 CO 0.52 -0.32 -0.14 0.00 0.00 0.00 0.00 179.25 179.30 1yum h ALA 54 N 1.56 1.07 0.09 0.00 0.00 -1.99 -1.02 119.26 118.98 1yum h ALA 54 Ca 0.37 -0.13 -0.27 0.00 0.00 0.00 0.00 54.91 54.88 1yum h ALA 54 Cb 0.61 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.40 1yum h ALA 54 CO -0.47 0.18 -1.12 1.96 0.00 0.00 0.00 179.25 179.79 1yum h GLN 55 N 0.00 0.59 -0.46 0.00 4.20 -1.42 -0.28 115.11 117.74 1yum h GLN 55 Ca -0.00 -0.76 0.08 0.00 0.06 0.00 0.00 58.65 58.02 1yum h GLN 55 Cb 0.57 0.25 -0.07 0.00 0.30 0.00 0.00 27.48 28.53 1yum h GLN 55 CO 0.02 1.34 0.06 0.00 -0.67 0.00 0.00 178.83 179.58 1yum h ARG 56 N 0.20 0.18 -0.27 1.46 3.08 -0.49 0.31 114.38 118.85 1yum h ARG 56 Ca -0.17 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 59.81 1yum h ARG 56 Cb 1.81 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.80 1yum h ARG 56 CO 0.22 0.12 -0.11 1.25 -1.07 0.00 0.00 179.97 180.38 1yum h LEU 57 N 0.19 0.43 -0.21 3.04 5.85 -1.18 -1.33 115.31 122.09 1yum h LEU 57 Ca 0.23 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 1yum h LEU 57 Cb 0.31 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1yum h LEU 57 CO -0.32 0.58 0.09 0.00 -0.34 0.00 0.00 178.44 178.44 1yum h ALA 58 N 1.47 0.28 -0.53 1.25 0.00 0.12 -0.55 119.26 121.30 1yum h ALA 58 Ca 0.08 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1yum h ALA 58 Cb 0.45 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1yum h ALA 58 CO 0.03 -0.15 0.30 0.52 0.00 0.00 0.00 179.25 179.95 1yum h MET 59 N 0.20 0.58 -0.62 0.00 2.86 -0.67 -0.77 114.93 116.51 1yum h MET 59 Ca 0.07 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.65 1yum h MET 59 Cb 0.15 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1yum h MET 59 CO -0.01 0.39 0.27 0.28 1.06 0.00 0.00 176.91 178.89 1yum h VAL 60 N 0.60 1.21 -0.93 -2.22 2.07 -0.90 -0.67 116.25 115.42 1yum h VAL 60 Ca 0.22 -0.64 0.01 0.00 0.82 0.00 0.00 66.70 67.11 1yum h VAL 60 Cb 0.06 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.24 1yum h VAL 60 CO -0.12 0.26 0.61 -0.33 0.02 0.00 0.00 177.57 178.02 1yum h GLU 61 N 0.88 1.22 -0.51 1.57 5.08 -0.50 -2.40 114.58 119.93 1yum h GLU 61 Ca 0.21 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 1yum h GLU 61 Cb 0.14 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 1yum h GLU 61 CO -0.02 0.81 0.10 0.00 -1.00 0.00 0.00 179.01 178.90 1yum h ARG 62 N 1.26 0.78 -0.00 2.33 2.47 0.25 -0.37 114.38 121.10 1yum h ARG 62 Ca 0.34 -0.17 -0.10 0.00 -1.26 0.00 0.00 59.98 58.79 1yum h ARG 62 Cb -0.14 -0.11 -0.01 0.00 -1.65 0.00 0.00 29.97 28.05 1yum h ARG 62 CO -0.07 0.73 -0.47 0.00 0.56 0.00 0.00 179.97 180.71 1yum h ALA 63 N 1.36 1.21 0.00 0.04 0.00 -0.72 -3.25 119.26 117.90 1yum h ALA 63 Ca 0.16 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1yum h ALA 63 Cb 0.31 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1yum h ALA 63 CO 0.00 0.59 -1.53 1.33 0.00 0.00 0.00 179.25 179.65 1yum n VAL 64 N -3.98 0.00 -1.67 0.00 0.24 -1.05 -4.86 118.33 107.02 1yum n VAL 64 Ca -0.02 -0.30 -0.55 0.00 -2.04 0.00 0.00 64.34 61.44 1yum n VAL 64 Cb 0.49 0.41 -0.07 0.00 -1.47 0.00 0.00 33.84 33.21 1yum n VAL 64 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1yum n ALA 65 N -1.91 -0.29 -0.95 2.33 0.00 -0.17 -0.38 120.51 119.14 1yum n ALA 65 Ca -0.01 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1yum n ALA 65 Cb 0.44 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.68 1yum n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yum n GLY 66 N 3.68 0.62 3.19 0.00 0.00 -1.26 -4.98 105.19 106.44 1yum n GLY 66 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 1yum n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yum s VAL 67 N -2.67 4.54 0.70 1.61 1.01 0.49 -5.05 120.40 121.03 1yum s VAL 67 Ca 0.00 -2.90 -0.17 0.00 0.00 0.00 0.00 61.98 58.91 1yum s VAL 67 Cb 0.00 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 1yum s VAL 67 CO 0.00 -0.96 0.37 1.21 0.00 0.00 0.00 175.10 175.72 1yum n GLU 68 N 3.51 0.26 0.00 2.72 4.07 -1.26 -1.29 120.64 128.65 1yum n GLU 68 Ca 0.12 0.12 0.00 0.00 -0.06 0.00 0.00 57.16 57.34 1yum n GLU 68 Cb 0.41 -1.67 0.00 0.00 -0.06 0.00 0.00 31.44 30.12 1yum n GLU 68 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 1yum n ARG 69 N -0.22 0.00 -3.70 5.31 0.63 -1.26 -4.95 116.66 112.46 1yum n ARG 69 Ca 0.09 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.66 1yum n ARG 69 Cb 0.50 -0.05 -0.07 0.00 0.45 0.00 0.00 32.46 33.29 1yum n ARG 69 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1yum s LEU 70 N 0.00 4.30 0.00 6.15 1.43 -0.41 0.53 118.68 130.68 1yum s LEU 70 Ca 0.00 0.45 0.06 0.00 -1.03 0.00 0.00 54.13 53.61 1yum s LEU 70 Cb 0.00 -2.20 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 1yum s LEU 70 CO 0.00 0.25 0.24 0.35 0.23 0.00 0.00 176.35 177.41 1yum n THR 71 N 2.88 0.00 -5.21 5.49 -2.24 -0.15 -4.75 114.28 110.30 1yum n THR 71 Ca -0.16 -1.92 -0.31 0.00 -2.27 0.00 0.00 64.05 59.39 1yum n THR 71 Cb 0.53 0.97 -0.15 0.00 -2.10 0.00 0.00 70.33 69.57 1yum n THR 71 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1yum s VAL 72 N -3.06 2.20 -0.32 2.28 0.11 -1.26 -0.35 120.40 120.00 1yum s VAL 72 Ca 0.31 -1.09 -0.02 0.00 -2.93 0.00 0.00 61.98 58.25 1yum s VAL 72 Cb 0.01 -1.78 0.06 0.00 -1.53 0.00 0.00 36.38 33.14 1yum s VAL 72 CO 0.22 0.56 0.03 -0.62 -3.33 0.00 0.00 175.10 171.97 1yum s ASP 73 N -0.70 4.98 -0.10 3.54 3.68 0.61 -4.84 116.67 123.83 1yum s ASP 73 Ca 0.10 -1.36 0.06 0.00 2.13 0.00 0.00 52.55 53.48 1yum s ASP 73 Cb -0.10 -1.74 0.36 0.00 -1.45 0.00 0.00 42.92 39.99 1yum s ASP 73 CO -0.00 -0.30 1.05 -0.81 0.13 0.00 0.00 175.17 175.24 1yum n PRO 74 N 4.63 2.71 0.12 4.34 -0.04 -1.26 -3.87 135.00 141.63 1yum n PRO 74 Ca -0.11 -1.38 -0.01 0.00 -0.04 0.00 0.00 63.50 61.95 1yum n PRO 74 Cb 0.43 -1.83 0.25 0.00 -0.04 0.00 0.00 33.50 32.31 1yum n PRO 74 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1yum h ARG 75 N 1.76 0.14 0.00 0.54 2.43 -1.95 -1.92 114.38 115.39 1yum h ARG 75 Ca 0.00 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1yum h ARG 75 Cb 1.14 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1yum h ARG 75 CO 0.21 0.55 0.00 0.39 -1.51 0.00 0.00 179.97 179.62 1yum n GLU 76 N -4.01 0.16 -0.08 0.20 1.02 -1.26 -3.53 120.64 113.14 1yum n GLU 76 Ca -0.02 0.21 -0.16 0.00 -0.02 0.00 0.00 57.16 57.18 1yum n GLU 76 Cb 0.48 -1.71 -0.13 0.00 -0.02 0.00 0.00 31.44 30.06 1yum n GLU 76 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1yum h LEU 77 N 0.00 0.00 0.00 -4.62 3.38 -1.56 -3.36 115.31 109.15 1yum h LEU 77 Ca 0.00 -0.90 0.00 0.00 0.09 0.00 0.00 57.88 57.07 1yum h LEU 77 Cb 0.55 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1yum h LEU 77 CO 0.00 1.10 0.00 0.00 0.09 0.00 0.00 178.44 179.63 1yum n GLN 78 N -4.57 0.00 -0.90 1.13 6.02 -1.14 -4.67 117.38 113.25 1yum n GLN 78 Ca -0.14 0.77 -0.35 0.00 -0.01 0.00 0.00 57.00 57.26 1yum n GLN 78 Cb 0.52 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 30.25 1yum n GLN 78 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1yum n ARG 79 N -2.51 0.00 -0.34 -1.09 1.74 -1.26 -4.83 116.66 108.38 1yum n ARG 79 Ca 0.00 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 1yum n ARG 79 Cb 0.00 -0.80 -0.08 0.00 -1.02 0.00 0.00 32.46 30.56 1yum n ARG 79 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1yum n ASP 80 N 1.78 -0.85 -4.25 0.55 5.75 -1.26 -4.53 116.55 113.74 1yum n ASP 80 Ca 0.15 1.49 -0.25 0.00 -0.01 0.00 0.00 54.79 56.17 1yum n ASP 80 Cb -0.01 -0.22 -0.14 0.00 -1.03 0.00 0.00 41.12 39.72 1yum n ASP 80 CO 0.00 0.00 0.00 -0.75 -0.11 0.00 0.00 177.20 176.34 1yum s LYS 81 N -5.25 1.38 0.00 0.11 2.47 -1.26 -5.11 119.74 112.08 1yum s LYS 81 Ca -0.10 -0.95 0.00 0.00 -1.56 0.00 0.00 55.97 53.36 1yum s LYS 81 Cb 0.09 -1.50 0.00 0.00 -1.46 0.00 0.00 37.83 34.96 1yum s LYS 81 CO 0.50 0.38 0.00 -2.30 0.16 0.00 0.00 175.35 174.09 1yum n PRO 82 N 1.82 0.00 -4.55 4.03 -0.02 -1.26 -5.00 135.00 130.02 1yum n PRO 82 Ca -0.17 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.02 1yum n PRO 82 Cb 0.53 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.88 1yum n PRO 82 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1yum s SER 83 N 0.00 3.23 -0.20 2.55 1.04 -1.26 -5.07 113.70 113.99 1yum s SER 83 Ca 0.00 -0.70 -0.08 0.00 0.48 0.00 0.00 55.95 55.65 1yum s SER 83 Cb 0.00 -0.24 -0.04 0.00 0.10 0.00 0.00 66.02 65.84 1yum s SER 83 CO 0.00 0.20 0.08 -0.31 0.98 0.00 0.00 173.24 174.19 1yum s TYR 84 N -0.98 3.24 0.28 5.02 4.12 -1.26 -4.99 117.35 122.78 1yum s TYR 84 Ca 0.13 0.04 0.01 0.00 0.02 0.00 0.00 57.07 57.27 1yum s TYR 84 Cb -0.10 -2.14 0.58 0.00 -1.52 0.00 0.00 41.96 38.78 1yum s TYR 84 CO 0.05 0.07 1.78 1.15 0.02 0.00 0.00 175.55 178.62 1yum h THR 85 N 4.99 0.77 -0.57 -0.71 2.02 -2.00 -1.15 112.91 116.25 1yum h THR 85 Ca -0.37 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 66.57 1yum h THR 85 Cb 1.17 -0.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 1yum h THR 85 CO 0.68 0.14 0.38 -0.29 0.37 0.00 0.00 175.52 176.79 1yum h ILE 86 N 0.74 1.11 -0.32 3.11 6.09 -1.94 0.78 117.51 127.09 1yum h ILE 86 Ca 0.50 -0.25 -0.15 0.00 -1.37 0.00 0.00 64.86 63.59 1yum h ILE 86 Cb 0.67 0.32 -0.01 0.00 0.47 0.00 0.00 36.82 38.27 1yum h ILE 86 CO -0.34 0.13 -0.39 0.44 -3.07 0.00 0.00 178.15 174.92 1yum h ASP 87 N 0.73 0.81 -0.70 2.19 3.32 -1.58 -1.28 116.42 119.91 1yum h ASP 87 Ca 0.22 -0.37 0.02 0.00 0.02 0.00 0.00 57.03 56.92 1yum h ASP 87 Cb -0.01 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.27 1yum h ASP 87 CO -0.05 1.10 0.45 0.74 -1.72 0.00 0.00 179.24 179.76 1yum h THR 88 N 0.62 1.14 -0.54 0.35 2.02 -0.90 -2.37 112.91 113.24 1yum h THR 88 Ca 0.05 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.87 1yum h THR 88 Cb 0.94 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1yum h THR 88 CO 0.09 0.17 0.13 -0.07 0.37 0.00 0.00 175.52 176.20 1yum h LEU 89 N 0.91 0.82 -1.26 2.58 3.38 -0.61 -1.41 115.31 119.71 1yum h LEU 89 Ca 0.27 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1yum h LEU 89 Cb -0.04 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1yum h LEU 89 CO -0.08 0.84 0.16 -0.33 0.09 0.00 0.00 178.44 179.12 1yum h GLU 90 N 0.76 0.67 -0.18 1.13 5.08 -1.00 0.28 114.58 121.32 1yum h GLU 90 Ca 0.17 -0.10 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 1yum h GLU 90 Cb 0.34 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 1yum h GLU 90 CO 0.00 0.58 -0.29 1.03 -1.00 0.00 0.00 179.01 179.33 1yum h SER 91 N 0.67 0.56 -0.55 1.42 0.87 -1.32 -0.64 113.55 114.56 1yum h SER 91 Ca 0.16 -0.53 0.05 0.00 -1.23 0.00 0.00 61.79 60.24 1yum h SER 91 Cb 0.17 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 61.93 1yum h SER 91 CO -0.01 0.98 0.28 0.58 -0.53 0.00 0.00 176.83 178.14 1yum h VAL 92 N 0.16 0.96 -0.18 2.23 2.07 -1.12 -2.42 116.25 117.94 1yum h VAL 92 Ca 0.01 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 1yum h VAL 92 Cb 0.87 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1yum h VAL 92 CO 0.07 0.10 -0.10 0.03 0.02 0.00 0.00 177.57 177.68 1yum h ARG 93 N 0.54 0.28 0.00 1.57 2.47 -0.74 -2.03 114.38 116.48 1yum h ARG 93 Ca 0.24 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.90 1yum h ARG 93 Cb 0.15 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.43 1yum h ARG 93 CO -0.17 0.40 0.00 0.00 0.56 0.00 0.00 179.97 180.76 1yum n ALA 94 N -2.49 1.28 0.51 0.04 0.00 -0.26 -2.21 120.51 117.37 1yum n ALA 94 Ca -0.00 0.14 0.07 0.00 0.00 0.00 0.00 53.44 53.65 1yum n ALA 94 Cb 0.26 -1.33 -0.09 0.00 0.00 0.00 0.00 19.45 18.29 1yum n ALA 94 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1yum n GLU 95 N -2.20 1.67 -3.58 0.00 1.02 -0.77 -5.00 120.64 111.79 1yum n GLU 95 Ca -0.00 -0.04 -0.37 0.00 -0.02 0.00 0.00 57.16 56.74 1yum n GLU 95 Cb 0.11 -1.24 -0.08 0.00 -0.02 0.00 0.00 31.44 30.20 1yum n GLU 95 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1yum s LEU 96 N -3.07 4.16 0.35 -4.62 1.43 -0.94 -5.07 118.68 110.93 1yum s LEU 96 Ca 0.03 0.31 -0.28 0.00 -1.03 0.00 0.00 54.13 53.16 1yum s LEU 96 Cb 0.11 -2.26 -0.12 0.00 0.03 0.00 0.00 46.19 43.95 1yum s LEU 96 CO 0.61 0.05 1.34 0.00 0.23 0.00 0.00 176.35 178.59 1yum n ALA 97 N 4.08 1.57 -0.23 4.21 0.00 -1.26 -4.82 120.51 124.06 1yum n ALA 97 Ca -0.13 0.36 0.04 0.00 0.00 0.00 0.00 53.44 53.71 1yum n ALA 97 Cb 0.52 -2.30 0.09 0.00 0.00 0.00 0.00 19.45 17.76 1yum n ALA 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yum n ALA 98 N 0.43 0.14 1.14 0.00 0.00 -1.26 0.19 120.51 121.15 1yum n ALA 98 Ca 0.04 0.70 0.05 0.00 0.00 0.00 0.00 53.44 54.23 1yum n ALA 98 Cb 0.37 -0.41 0.14 0.00 0.00 0.00 0.00 19.45 19.54 1yum n ALA 98 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1yum n ASP 99 N -5.04 1.46 -4.77 0.00 5.75 -1.26 -4.77 116.55 107.93 1yum n ASP 99 Ca 0.10 -1.97 -0.39 0.00 -0.01 0.00 0.00 54.79 52.52 1yum n ASP 99 Cb 0.32 -0.18 -0.01 0.00 -1.03 0.00 0.00 41.12 40.22 1yum n ASP 99 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1yum s ASP 100 N -1.04 6.37 -0.26 -1.12 1.01 0.49 0.19 116.67 122.30 1yum s ASP 100 Ca 0.19 2.51 -0.13 0.00 0.71 0.00 0.00 52.55 55.83 1yum s ASP 100 Cb 0.10 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.36 1yum s ASP 100 CO 0.13 -0.80 0.29 -1.10 0.21 0.00 0.00 175.17 173.91 1yum s GLN 101 N -2.29 4.02 -0.16 8.23 -0.21 -0.08 -4.43 119.66 124.74 1yum s GLN 101 Ca 0.58 -0.10 -0.02 0.00 0.02 0.00 0.00 55.36 55.84 1yum s GLN 101 Cb -0.35 -3.63 -0.02 0.00 1.00 0.00 0.00 33.01 30.02 1yum s GLN 101 CO 0.44 -0.18 -0.09 -1.17 -2.12 0.00 0.00 175.29 172.17 1yum s LEU 102 N 1.77 2.90 -0.20 2.90 2.96 -0.97 -0.58 118.68 127.45 1yum s LEU 102 Ca 0.12 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.75 1yum s LEU 102 Cb -0.15 -1.69 0.03 0.00 0.50 0.00 0.00 46.19 44.88 1yum s LEU 102 CO 0.09 0.12 -0.17 -0.36 -1.32 0.00 0.00 176.35 174.72 1yum s PHE 103 N 0.61 2.92 -0.30 5.38 0.40 0.42 -0.94 117.98 126.48 1yum s PHE 103 Ca -0.05 -1.82 -0.13 0.00 -0.60 0.00 0.00 56.93 54.33 1yum s PHE 103 Cb -0.15 -1.93 -0.04 0.00 0.51 0.00 0.00 43.02 41.41 1yum s PHE 103 CO 0.03 -0.82 0.27 1.41 0.70 0.00 0.00 175.22 176.80 1yum s MET 104 N 1.24 3.83 -0.21 0.44 1.75 -0.15 -0.57 119.30 125.64 1yum s MET 104 Ca 0.01 -0.30 -0.13 0.00 -1.25 0.00 0.00 55.69 54.02 1yum s MET 104 Cb -0.15 -3.70 -0.05 0.00 2.84 0.00 0.00 34.83 33.77 1yum s MET 104 CO -0.10 -0.30 0.25 -1.17 -0.65 0.00 0.00 175.02 173.05 1yum s LEU 105 N 1.87 4.17 0.01 4.11 2.96 -0.46 -0.27 118.68 131.07 1yum s LEU 105 Ca 0.09 0.33 0.01 0.00 -0.22 0.00 0.00 54.13 54.34 1yum s LEU 105 Cb -0.16 -2.28 -0.01 0.00 0.50 0.00 0.00 46.19 44.24 1yum s LEU 105 CO 0.11 0.05 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.52 1yum s ILE 106 N 0.91 0.18 0.72 6.68 1.01 -0.29 -4.35 121.20 126.05 1yum s ILE 106 Ca 0.13 -0.55 -0.12 0.00 0.00 0.00 0.00 60.65 60.11 1yum s ILE 106 Cb -0.13 -0.24 0.03 0.00 0.01 0.00 0.00 42.46 42.12 1yum s ILE 106 CO 0.04 -0.24 1.08 -0.83 0.00 0.00 0.00 174.94 175.00 1yum s GLY 107 N -0.83 1.78 0.11 6.18 0.00 -1.26 -0.90 107.32 112.41 1yum s GLY 107 Ca -0.08 0.28 -0.33 0.00 0.00 0.00 0.00 44.72 44.59 1yum s GLY 107 CO -0.00 0.61 1.57 -0.25 0.00 0.00 0.00 173.10 175.03 1yum h TRP 108 N -0.73 -1.41 -0.58 1.90 2.91 -1.84 0.52 115.95 116.72 1yum h TRP 108 Ca -0.44 0.04 0.02 0.00 1.13 0.00 0.00 58.89 59.64 1yum h TRP 108 Cb 1.23 0.61 -0.04 0.00 -0.51 0.00 0.00 29.16 30.46 1yum h TRP 108 CO 0.58 -0.55 0.36 -0.44 -1.03 0.00 0.00 178.44 177.36 1yum h ASP 109 N -0.66 0.60 -0.47 2.65 3.32 -1.93 0.12 116.42 120.05 1yum h ASP 109 Ca 0.02 -0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.12 1yum h ASP 109 Cb 0.71 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 1yum h ASP 109 CO -0.33 0.42 0.31 0.00 -1.72 0.00 0.00 179.24 177.93 1yum h ALA 110 N 1.24 1.88 0.23 3.45 0.00 -1.82 -2.39 119.26 121.87 1yum h ALA 110 Ca 0.23 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1yum h ALA 110 Cb -0.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1yum h ALA 110 CO -0.09 0.04 -0.11 0.35 0.00 0.00 0.00 179.25 179.45 1yum h PHE 111 N 0.44 -0.29 -0.11 0.00 3.57 0.25 -3.16 116.94 117.64 1yum h PHE 111 Ca 0.20 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.72 1yum h PHE 111 Cb 0.23 0.10 -0.00 0.00 2.79 0.00 0.00 35.95 39.07 1yum h PHE 111 CO -0.00 -0.00 0.09 0.00 -2.23 0.00 0.00 178.31 176.16 1yum n GLY 113 N -1.51 -1.04 0.32 0.00 0.00 -1.09 -4.11 105.19 97.75 1yum n GLY 113 Ca -0.00 -0.14 0.16 0.00 0.00 0.00 0.00 46.02 46.04 1yum n GLY 113 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1yum h LEU 114 N 0.00 0.26 0.00 0.99 5.85 -0.50 0.16 115.31 122.08 1yum h LEU 114 Ca 0.00 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1yum h LEU 114 Cb 0.17 0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.38 1yum h LEU 114 CO 0.00 -0.09 0.02 -2.65 -0.34 0.00 0.00 178.44 175.38 1yum n PRO 115 N -5.11 0.00 0.00 5.25 -0.02 -1.26 -1.40 135.00 132.47 1yum n PRO 115 Ca 0.25 0.43 -0.04 0.00 -2.02 0.00 0.00 63.50 62.12 1yum n PRO 115 Cb 0.76 -1.52 -0.11 0.00 -0.02 0.00 0.00 33.50 32.61 1yum n PRO 115 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1yum n THR 116 N -1.42 1.34 -1.48 3.45 -2.24 0.57 -4.92 114.28 109.57 1yum n THR 116 Ca 0.00 -0.74 -0.36 0.00 -2.27 0.00 0.00 64.05 60.69 1yum n THR 116 Cb 0.02 -0.83 0.09 0.00 -2.10 0.00 0.00 70.33 67.52 1yum n THR 116 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1yum n TRP 117 N -2.93 1.60 -2.29 4.78 7.02 -0.49 -4.89 117.44 120.24 1yum n TRP 117 Ca -0.13 0.41 -0.43 0.00 -1.02 0.00 0.00 57.50 56.33 1yum n TRP 117 Cb 0.93 -2.20 -0.02 0.00 -2.42 0.00 0.00 31.31 27.60 1yum n TRP 117 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 1yum s HIS 118 N -1.68 2.55 -1.29 -5.99 2.46 -1.26 -2.63 115.29 107.45 1yum s HIS 118 Ca 0.79 0.75 -0.08 0.00 0.47 0.00 0.00 55.06 56.99 1yum s HIS 118 Cb -0.35 -3.69 0.01 0.00 -0.13 0.00 0.00 32.58 28.42 1yum s HIS 118 CO 0.45 -2.34 1.12 0.54 -2.47 0.00 0.00 174.74 172.04 1yum n ARG 119 N 6.91 -7.56 -0.08 2.88 1.74 -1.26 -4.54 116.66 114.75 1yum n ARG 119 Ca 0.15 0.79 0.20 0.00 -0.77 0.00 0.00 57.85 58.22 1yum n ARG 119 Cb 0.45 -5.74 0.63 0.00 -1.02 0.00 0.00 32.46 26.78 1yum n ARG 119 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 1yum h TRP 120 N -2.54 0.16 0.00 -1.55 5.08 -1.78 0.25 115.95 115.56 1yum h TRP 120 Ca -0.55 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.43 1yum h TRP 120 Cb 1.35 -0.05 0.00 0.00 -3.00 0.00 0.00 29.16 27.46 1yum h TRP 120 CO 0.47 0.06 0.00 0.39 -1.28 0.00 0.00 178.44 178.08 1yum n GLU 121 N -4.40 0.31 0.00 0.12 1.02 -1.26 -2.74 120.64 113.69 1yum n GLU 121 Ca 0.12 0.07 0.10 0.00 -0.02 0.00 0.00 57.16 57.44 1yum n GLU 121 Cb 0.63 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.46 1yum n GLU 121 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1yum n ALA 122 N -1.30 4.37 -0.34 0.62 0.00 0.87 -4.41 120.51 120.31 1yum n ALA 122 Ca 0.11 -0.56 0.09 0.00 0.00 0.00 0.00 53.44 53.07 1yum n ALA 122 Cb 0.19 -0.81 0.25 0.00 0.00 0.00 0.00 19.45 19.09 1yum n ALA 122 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1yum h LEU 123 N 0.00 0.78 0.00 0.00 3.38 -1.57 -0.10 115.31 117.80 1yum h LEU 123 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1yum h LEU 123 Cb 0.57 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1yum h LEU 123 CO 0.00 0.36 0.00 0.18 0.09 0.00 0.00 178.44 179.07 1yum n LEU 124 N -4.73 0.00 0.31 1.67 4.77 -1.26 -2.00 117.00 115.76 1yum n LEU 124 Ca 0.19 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.37 1yum n LEU 124 Cb 0.43 0.00 0.97 0.00 -2.33 0.00 0.00 43.42 42.49 1yum n LEU 124 CO 0.24 0.00 1.09 0.44 -1.33 0.00 0.00 177.39 177.83 1yum h ASP 125 N 0.00 0.00 0.00 -1.43 3.32 -1.27 -2.67 116.42 114.36 1yum h ASP 125 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yum h ASP 125 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1yum h ASP 125 CO 0.00 0.00 -0.33 1.41 -1.72 0.00 0.00 179.24 178.60 1yum n HIS 126 N -3.05 0.00 -3.61 4.55 8.25 -0.84 -4.87 115.22 115.65 1yum n HIS 126 Ca -0.01 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.36 1yum n HIS 126 Cb 0.17 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.26 1yum n HIS 126 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1yum s HIS 128 N -3.69 3.39 -0.19 0.00 0.09 -0.12 -1.67 115.29 113.11 1yum s HIS 128 Ca 0.06 1.13 -0.05 0.00 -0.00 0.00 0.00 55.06 56.20 1yum s HIS 128 Cb -0.03 -2.47 -0.03 0.00 -0.00 0.00 0.00 32.58 30.05 1yum s HIS 128 CO -0.04 0.10 -0.00 0.42 -0.00 0.00 0.00 174.74 175.21 1yum s ILE 129 N -2.01 4.05 -0.23 0.60 1.01 -0.40 -0.98 121.20 123.24 1yum s ILE 129 Ca 0.53 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.84 1yum s ILE 129 Cb -0.10 -2.82 -0.02 0.00 0.01 0.00 0.00 42.46 39.53 1yum s ILE 129 CO 0.20 0.45 0.01 -0.69 0.00 0.00 0.00 174.94 174.90 1yum s VAL 130 N 0.76 3.80 -0.17 2.92 1.01 0.63 -1.56 120.40 127.78 1yum s VAL 130 Ca 0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 61.56 1yum s VAL 130 Cb -0.14 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.44 1yum s VAL 130 CO 0.02 0.39 0.09 -0.69 0.00 0.00 0.00 175.10 174.91 1yum s VAL 131 N 1.52 5.08 -0.40 2.92 1.01 0.49 -1.14 120.40 129.88 1yum s VAL 131 Ca 0.06 0.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.90 1yum s VAL 131 Cb -0.15 -3.28 0.01 0.00 0.00 0.00 0.00 36.38 32.97 1yum s VAL 131 CO -0.00 0.48 0.65 -0.22 0.00 0.00 0.00 175.10 176.01 1yum s LEU 132 N 0.10 4.37 -0.08 3.92 1.98 -0.07 0.42 118.68 129.30 1yum s LEU 132 Ca 0.07 -0.10 -0.04 0.00 -2.89 0.00 0.00 54.13 51.17 1yum s LEU 132 Cb -0.12 -2.77 -0.04 0.00 0.66 0.00 0.00 46.19 43.92 1yum s LEU 132 CO -0.00 -0.70 0.09 -1.10 -1.89 0.00 0.00 176.35 172.74 1yum s GLN 133 N 2.81 3.23 0.19 1.98 -1.52 0.25 -2.35 119.66 124.25 1yum s GLN 133 Ca 0.24 -0.29 -0.12 0.00 -1.95 0.00 0.00 55.36 53.24 1yum s GLN 133 Cb -0.14 -3.00 0.00 0.00 -0.22 0.00 0.00 33.01 29.65 1yum s GLN 133 CO 0.17 0.73 0.38 -0.98 -0.25 0.00 0.00 175.29 175.34 1yum s ARG 134 N -1.15 1.30 0.58 2.91 1.70 -1.26 -1.75 118.95 121.28 1yum s ARG 134 Ca 0.16 -1.13 -0.20 0.00 -0.47 0.00 0.00 55.73 54.10 1yum s ARG 134 Cb -0.12 0.43 -0.05 0.00 -0.57 0.00 0.00 34.95 34.65 1yum s ARG 134 CO 0.06 -0.51 1.10 -2.30 -1.08 0.00 0.00 175.30 172.57 1yum n PRO 135 N -0.28 1.13 -1.24 3.89 -0.02 -1.26 -2.48 135.00 134.73 1yum n PRO 135 Ca -0.06 0.43 -0.08 0.00 -2.02 0.00 0.00 63.50 61.76 1yum n PRO 135 Cb 0.63 -2.30 -0.03 0.00 -0.02 0.00 0.00 33.50 31.77 1yum n PRO 135 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1yum n ASP 136 N -0.89 -4.45 -3.98 2.55 10.43 -1.26 -4.95 116.55 113.99 1yum n ASP 136 Ca 0.13 0.20 -0.31 0.00 2.57 0.00 0.00 54.79 57.38 1yum n ASP 136 Cb 0.46 -2.67 -0.15 0.00 1.84 0.00 0.00 41.12 40.60 1yum n ASP 136 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1yum s ALA 137 N -2.15 2.19 0.64 2.24 0.00 -1.04 -5.13 121.76 118.52 1yum s ALA 137 Ca 0.00 -1.54 -0.11 0.00 0.00 0.00 0.00 51.96 50.31 1yum s ALA 137 Cb 0.00 -1.51 -0.08 0.00 0.00 0.00 0.00 23.12 21.53 1yum s ALA 137 CO 0.00 -1.22 -0.62 -0.40 0.00 0.00 0.00 175.76 173.52 1yum n ASP 138 N 4.58 -2.15 -2.76 0.00 5.75 -1.26 -4.65 116.55 116.06 1yum n ASP 138 Ca -0.12 0.00 -0.03 0.00 -0.01 0.00 0.00 54.79 54.64 1yum n ASP 138 Cb 0.43 -0.44 0.07 0.00 -1.03 0.00 0.00 41.12 40.15 1yum n ASP 138 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1yum n SER 139 N 2.82 0.66 -3.52 -1.12 2.88 -1.26 -4.96 113.62 109.13 1yum n SER 139 Ca -0.01 -2.22 -0.16 0.00 -1.33 0.00 0.00 58.87 55.16 1yum n SER 139 Cb 0.30 -0.14 -0.12 0.00 -0.75 0.00 0.00 64.21 63.50 1yum n SER 139 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 1yum s GLU 140 N -2.57 0.20 0.39 -1.46 -1.05 -1.26 -5.17 118.70 107.78 1yum s GLU 140 Ca 0.23 0.40 0.08 0.00 -0.15 0.00 0.00 54.97 55.53 1yum s GLU 140 Cb 0.38 -0.77 -0.00 0.00 -0.44 0.00 0.00 34.13 33.29 1yum s GLU 140 CO -0.05 -0.55 0.48 -1.25 0.95 0.00 0.00 175.26 174.84 1yum s PRO 141 N 2.38 2.84 0.43 -4.83 0.04 -1.26 -5.08 135.00 129.52 1yum s PRO 141 Ca 0.06 -1.24 -0.25 0.00 0.04 0.00 0.00 61.00 59.61 1yum s PRO 141 Cb -0.15 -2.68 -0.08 0.00 0.04 0.00 0.00 34.50 31.64 1yum s PRO 141 CO -0.12 -0.13 1.29 -2.14 0.04 0.00 0.00 177.00 175.94 1yum s PRO 142 N -4.23 3.83 0.55 0.56 0.02 -1.26 -4.90 135.00 129.58 1yum s PRO 142 Ca 0.50 2.11 0.24 0.00 0.02 0.00 0.00 61.00 63.86 1yum s PRO 142 Cb -0.08 -2.64 1.51 0.00 0.02 0.00 0.00 34.50 33.31 1yum s PRO 142 CO 0.31 -0.59 2.13 1.49 -0.33 0.00 0.00 177.00 180.01 1yum h GLU 143 N 2.42 0.00 -0.79 5.54 4.81 -1.98 0.16 114.58 124.74 1yum h GLU 143 Ca -0.50 0.00 0.17 0.00 -0.13 0.00 0.00 59.36 58.90 1yum h GLU 143 Cb 1.25 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 1yum h GLU 143 CO 0.61 0.00 0.53 0.66 -0.73 0.00 0.00 179.01 180.09 1yum h SER 144 N 0.00 0.36 0.38 1.04 4.64 -1.97 -1.90 113.55 116.09 1yum h SER 144 Ca 0.07 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1yum h SER 144 Cb 0.30 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1yum h SER 144 CO -0.00 0.18 -0.36 0.18 -0.87 0.00 0.00 176.83 175.95 1yum n LEU 145 N -4.47 0.74 -0.29 5.97 4.77 0.04 -4.44 117.00 119.32 1yum n LEU 145 Ca 0.16 -0.12 0.02 0.00 -0.03 0.00 0.00 56.01 56.04 1yum n LEU 145 Cb 0.60 -0.19 0.16 0.00 -2.33 0.00 0.00 43.42 41.66 1yum n LEU 145 CO 0.33 0.15 1.13 -0.09 -1.33 0.00 0.00 177.39 177.58 1yum h ARG 146 N 0.59 0.76 0.59 3.23 2.43 -1.40 -0.69 114.38 119.89 1yum h ARG 146 Ca 0.00 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1yum h ARG 146 Cb 0.50 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 1yum h ARG 146 CO 0.00 0.50 -0.41 0.22 -1.51 0.00 0.00 179.97 178.77 1yum h ASP 147 N 0.78 -1.08 -0.89 -3.80 3.58 -1.78 -1.93 116.42 111.31 1yum h ASP 147 Ca 0.39 0.07 0.23 0.00 0.42 0.00 0.00 57.03 58.14 1yum h ASP 147 Cb 0.35 0.33 -0.13 0.00 1.72 0.00 0.00 39.33 41.59 1yum h ASP 147 CO -0.24 -0.61 0.32 0.25 -2.88 0.00 0.00 179.24 176.08 1yum h LEU 148 N -0.96 0.16 -0.07 2.28 5.85 -1.57 0.52 115.31 121.53 1yum h LEU 148 Ca -0.08 0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1yum h LEU 148 Cb 0.78 0.20 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 1yum h LEU 148 CO 0.04 -0.09 -0.04 -0.07 -0.34 0.00 0.00 178.44 177.94 1yum h LEU 149 N 0.29 0.16 -0.72 2.25 3.38 -1.16 0.36 115.31 119.87 1yum h LEU 149 Ca 0.56 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1yum h LEU 149 Cb 1.12 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1yum h LEU 149 CO -0.60 0.55 0.00 0.00 0.09 0.00 0.00 178.44 178.48 1yum h ALA 150 N 0.61 1.00 0.13 1.53 0.00 -0.07 0.05 119.26 122.51 1yum h ALA 150 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.59 1yum h ALA 150 Cb 0.49 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1yum h ALA 150 CO 0.01 0.00 -1.76 0.00 0.00 0.00 0.00 179.25 177.50 1yum h ALA 151 N 2.26 0.30 -0.00 0.00 0.00 0.15 -3.43 119.26 118.53 1yum h ALA 151 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 54.91 53.66 1yum h ALA 151 Cb 0.42 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1yum h ALA 151 CO 0.00 1.09 -0.03 0.54 0.00 0.00 0.00 179.25 180.85 1yum n ARG 152 N -3.68 5.65 -1.75 0.00 1.74 0.12 -5.04 116.66 113.70 1yum n ARG 152 Ca -0.29 -0.08 -0.38 0.00 -0.77 0.00 0.00 57.85 56.33 1yum n ARG 152 Cb 1.00 -0.60 0.05 0.00 -1.02 0.00 0.00 32.46 31.89 1yum n ARG 152 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1yum s SER 153 N -0.92 5.00 -0.11 0.55 0.01 -0.01 -1.39 113.70 116.83 1yum s SER 153 Ca 0.00 2.74 0.01 0.00 1.31 0.00 0.00 55.95 60.01 1yum s SER 153 Cb 0.01 -2.63 0.02 0.00 0.21 0.00 0.00 66.02 63.62 1yum s SER 153 CO 0.03 -1.75 -0.11 0.68 0.41 0.00 0.00 173.24 172.50 1yum s VAL 154 N -1.32 1.20 0.08 3.43 -7.23 0.99 -4.80 120.40 112.74 1yum s VAL 154 Ca 0.76 -0.43 -0.17 0.00 -1.81 0.00 0.00 61.98 60.33 1yum s VAL 154 Cb -0.40 -1.15 -0.11 0.00 0.56 0.00 0.00 36.38 35.28 1yum s VAL 154 CO 0.46 0.39 1.38 0.00 -0.31 0.00 0.00 175.10 177.01 1yum h ALA 155 N 7.81 0.34 -2.23 1.32 0.00 -1.96 -3.41 119.26 121.13 1yum h ALA 155 Ca -0.32 -0.40 -0.66 0.00 0.00 0.00 0.00 54.91 53.54 1yum h ALA 155 Cb 1.15 -0.07 -0.16 0.00 0.00 0.00 0.00 17.79 18.71 1yum h ALA 155 CO 0.45 0.35 0.06 0.34 0.00 0.00 0.00 179.25 180.45 1yum s ASP 156 N -6.46 6.31 0.53 0.00 2.15 -1.26 -4.69 116.67 113.24 1yum s ASP 156 Ca -0.13 -0.36 0.36 0.00 0.43 0.00 0.00 52.55 52.85 1yum s ASP 156 Cb 0.07 -2.30 1.53 0.00 -0.30 0.00 0.00 42.92 41.93 1yum s ASP 156 CO 0.81 -0.72 1.79 -0.65 -0.17 0.00 0.00 175.17 176.22 1yum h PRO 157 N 8.82 0.03 0.00 4.34 0.11 -1.88 0.92 132.00 144.33 1yum h PRO 157 Ca -0.26 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1yum h PRO 157 Cb 1.10 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1yum h PRO 157 CO 0.87 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.68 1yum n GLN 158 N -4.20 0.76 0.00 1.05 10.64 -1.26 -2.75 117.38 121.62 1yum n GLN 158 Ca 0.27 0.01 0.13 0.00 -1.83 0.00 0.00 57.00 55.57 1yum n GLN 158 Cb 1.27 -1.50 0.35 0.00 -0.86 0.00 0.00 30.24 29.50 1yum n GLN 158 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1yum n ALA 159 N -1.05 3.05 -1.73 2.61 0.00 0.32 -4.84 120.51 118.86 1yum n ALA 159 Ca 0.19 -0.44 -0.42 0.00 0.00 0.00 0.00 53.44 52.77 1yum n ALA 159 Cb 0.11 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 1yum n ALA 159 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1yum s LEU 160 N -2.42 4.37 0.06 0.00 1.43 -1.11 -4.98 118.68 116.03 1yum s LEU 160 Ca 0.26 2.86 0.08 0.00 -1.03 0.00 0.00 54.13 56.29 1yum s LEU 160 Cb 0.19 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.79 1yum s LEU 160 CO 0.50 -0.97 -0.21 -0.75 0.23 0.00 0.00 176.35 175.14 1yum s LYS 161 N 1.33 1.34 0.83 1.70 2.20 -1.26 -5.09 119.74 120.79 1yum s LYS 161 Ca 0.75 -1.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.33 1yum s LYS 161 Cb -0.49 -1.52 0.00 0.00 -1.51 0.00 0.00 37.83 34.31 1yum s LYS 161 CO 0.32 0.38 0.00 0.41 -0.36 0.00 0.00 175.35 176.10 1yum n GLY 162 N 1.58 -1.83 0.26 5.54 0.00 -1.26 -4.20 105.19 105.28 1yum n GLY 162 Ca -0.18 -1.30 0.14 0.00 0.00 0.00 0.00 46.02 44.68 1yum n GLY 162 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yum h PRO 163 N 0.00 0.00 0.00 1.61 0.13 -1.86 -3.44 132.00 128.44 1yum h PRO 163 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1yum h PRO 163 Cb 0.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.41 1yum h PRO 163 CO 0.00 0.11 0.00 0.41 -0.23 0.00 0.00 178.00 178.30 1yum n GLY 164 N -0.20 -1.15 0.00 1.56 0.00 -1.26 -2.30 105.19 101.84 1yum n GLY 164 Ca -0.00 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.12 1yum n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yum n GLY 165 N 0.00 1.84 3.38 -0.02 0.00 -0.67 -4.74 105.19 104.98 1yum n GLY 165 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1yum n GLY 165 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1yum s GLN 166 N -0.46 1.43 0.16 1.61 -0.21 -1.26 -4.87 119.66 116.05 1yum s GLN 166 Ca 0.00 -1.67 0.11 0.00 0.02 0.00 0.00 55.36 53.82 1yum s GLN 166 Cb 0.00 -1.16 -0.04 0.00 1.00 0.00 0.00 33.01 32.81 1yum s GLN 166 CO 0.00 0.13 -0.25 0.42 -2.12 0.00 0.00 175.29 173.48 1yum s ILE 167 N -2.97 2.37 0.14 1.08 1.01 -0.49 -1.28 121.20 121.06 1yum s ILE 167 Ca 0.25 -1.85 -0.13 0.00 0.00 0.00 0.00 60.65 58.93 1yum s ILE 167 Cb 0.01 -2.09 0.01 0.00 0.01 0.00 0.00 42.46 40.40 1yum s ILE 167 CO 0.09 0.00 0.34 0.28 0.00 0.00 0.00 174.94 175.65 1yum s THR 168 N -1.33 0.08 -0.00 2.92 -1.32 -0.60 -0.00 115.64 115.38 1yum s THR 168 Ca 0.17 -0.96 0.08 0.00 -1.21 0.00 0.00 61.69 59.77 1yum s THR 168 Cb -0.09 -1.44 -0.02 0.00 -1.51 0.00 0.00 72.50 69.44 1yum s THR 168 CO 0.08 -0.37 -0.25 -0.36 -2.21 0.00 0.00 174.62 171.51 1yum s PHE 169 N -3.87 2.27 0.07 9.09 0.40 -1.26 -0.38 117.98 124.31 1yum s PHE 169 Ca 0.08 -0.42 0.05 0.00 -0.60 0.00 0.00 56.93 56.03 1yum s PHE 169 Cb 0.03 -1.44 -0.03 0.00 0.51 0.00 0.00 43.02 42.09 1yum s PHE 169 CO -0.07 -0.00 -0.13 0.14 0.70 0.00 0.00 175.22 175.85 1yum s VAL 170 N -0.64 1.07 -0.04 -0.44 -7.23 0.17 -4.83 120.40 108.46 1yum s VAL 170 Ca 0.10 -1.35 -0.00 0.00 -1.81 0.00 0.00 61.98 58.92 1yum s VAL 170 Cb -0.10 -1.09 -0.04 0.00 0.56 0.00 0.00 36.38 35.71 1yum s VAL 170 CO -0.00 -0.28 0.02 0.86 -0.31 0.00 0.00 175.10 175.39 1yum s TRP 171 N -1.43 3.16 0.04 2.82 -0.11 -1.26 0.88 118.94 123.03 1yum s TRP 171 Ca -0.01 0.16 -0.18 0.00 1.22 0.00 0.00 56.10 57.29 1yum s TRP 171 Cb -0.09 -1.74 0.04 0.00 -1.50 0.00 0.00 33.47 30.18 1yum s TRP 171 CO 0.02 0.48 0.41 -0.65 -4.62 0.00 0.00 176.95 172.59 1yum s GLN 172 N -1.27 0.91 -0.68 5.86 -0.21 -0.72 -4.93 119.66 118.62 1yum s GLN 172 Ca 0.17 -0.35 0.05 0.00 0.02 0.00 0.00 55.36 55.25 1yum s GLN 172 Cb -0.11 0.41 0.17 0.00 1.00 0.00 0.00 33.01 34.47 1yum s GLN 172 CO 0.07 -0.31 0.47 0.95 -2.12 0.00 0.00 175.29 174.35 1yum s THR 173 N -2.42 2.70 0.90 -0.19 -4.23 -1.26 -4.18 115.64 106.95 1yum s THR 173 Ca -0.06 -4.12 -0.15 0.00 -1.18 0.00 0.00 61.69 56.18 1yum s THR 173 Cb -0.01 -2.78 -0.04 0.00 1.34 0.00 0.00 72.50 71.01 1yum s THR 173 CO -0.02 -1.01 0.07 -2.65 -0.54 0.00 0.00 174.62 170.47 1yum n PRO 174 N 2.08 -0.08 -2.19 3.99 -0.02 -1.26 -4.92 135.00 132.60 1yum n PRO 174 Ca 0.20 0.01 -0.38 0.00 -2.02 0.00 0.00 63.50 61.31 1yum n PRO 174 Cb 0.36 -1.57 -0.01 0.00 -0.02 0.00 0.00 33.50 32.26 1yum n PRO 174 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1yum s LEU 175 N 1.88 4.10 -0.87 2.45 1.43 -1.26 -4.89 118.68 121.52 1yum s LEU 175 Ca 0.54 2.42 -0.05 0.00 -1.03 0.00 0.00 54.13 56.00 1yum s LEU 175 Cb -0.24 -4.11 -0.05 0.00 0.03 0.00 0.00 46.19 41.81 1yum s LEU 175 CO 0.70 -0.88 2.10 0.00 0.23 0.00 0.00 176.35 178.50 1yum n ALA 176 N -0.23 4.63 -2.61 4.21 0.00 -1.26 -4.78 120.51 120.46 1yum n ALA 176 Ca 0.06 -1.92 -0.21 0.00 0.00 0.00 0.00 53.44 51.37 1yum n ALA 176 Cb 0.46 -2.96 -0.14 0.00 0.00 0.00 0.00 19.45 16.82 1yum n ALA 176 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1yum s VAL 177 N 3.37 1.19 0.02 0.00 1.01 -1.26 -5.12 120.40 119.61 1yum s VAL 177 Ca 0.39 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.36 1yum s VAL 177 Cb 0.10 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 1yum s VAL 177 CO -0.03 0.07 0.01 -0.94 0.00 0.00 0.00 175.10 174.21 1yum s SER 178 N -1.06 0.19 0.36 3.32 1.04 -1.26 -4.84 113.70 111.45 1yum s SER 178 Ca 0.03 -0.43 0.12 0.00 0.48 0.00 0.00 55.95 56.15 1yum s SER 178 Cb -0.08 0.12 0.68 0.00 0.10 0.00 0.00 66.02 66.84 1yum s SER 178 CO 0.01 -0.32 1.81 0.00 0.98 0.00 0.00 173.24 175.72 1yum h ALA 179 N 4.57 1.34 -0.55 5.32 0.00 -1.88 -0.75 119.26 127.32 1yum h ALA 179 Ca -0.32 -0.35 0.04 0.00 0.00 0.00 0.00 54.91 54.29 1yum h ALA 179 Cb 1.21 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1yum h ALA 179 CO 0.41 0.49 0.29 1.15 0.00 0.00 0.00 179.25 181.59 1yum h THR 180 N 0.04 0.98 -0.67 0.00 2.02 -1.96 0.27 112.91 113.59 1yum h THR 180 Ca 0.00 -0.19 -0.08 0.00 0.77 0.00 0.00 66.41 66.91 1yum h THR 180 Cb 0.68 0.36 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 1yum h THR 180 CO 0.05 0.10 0.11 -0.61 0.37 0.00 0.00 175.52 175.54 1yum h GLN 181 N 0.57 1.11 -0.60 6.66 4.15 -1.87 -1.97 115.11 123.17 1yum h GLN 181 Ca 0.24 -0.30 -0.07 0.00 0.77 0.00 0.00 58.65 59.29 1yum h GLN 181 Cb 0.12 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.66 1yum h GLN 181 CO -0.15 1.02 0.08 0.82 -1.93 0.00 0.00 178.83 178.67 1yum h ILE 182 N 1.04 1.25 -0.48 2.39 2.04 -0.44 0.19 117.51 123.50 1yum h ILE 182 Ca 0.20 -1.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.00 1yum h ILE 182 Cb 0.45 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.21 1yum h ILE 182 CO 0.01 0.37 0.01 0.03 0.00 0.00 0.00 178.15 178.57 1yum h ARG 183 N 0.92 0.79 -0.04 2.37 3.08 -0.32 -1.81 114.38 119.37 1yum h ARG 183 Ca 0.18 -0.20 -0.18 0.00 0.07 0.00 0.00 59.98 59.85 1yum h ARG 183 Cb 0.42 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1yum h ARG 183 CO 0.01 0.79 -0.77 0.00 -1.07 0.00 0.00 179.97 178.93 1yum h ALA 184 N 1.27 0.62 -0.31 0.04 0.00 -0.88 -2.05 119.26 117.95 1yum h ALA 184 Ca 0.15 -0.64 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 1yum h ALA 184 Cb 0.43 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1yum h ALA 184 CO 0.02 0.82 0.07 -0.07 0.00 0.00 0.00 179.25 180.09 1yum h LEU 185 N 0.18 0.48 -1.57 0.00 3.38 -0.83 -2.66 115.31 114.28 1yum h LEU 185 Ca -0.03 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1yum h LEU 185 Cb 1.35 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 1yum h LEU 185 CO 0.12 0.59 -0.22 -0.07 0.09 0.00 0.00 178.44 178.95 1yum h LEU 186 N 0.34 0.00 -1.23 1.67 3.38 -1.23 -0.85 115.31 117.40 1yum h LEU 186 Ca 0.10 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1yum h LEU 186 Cb 0.30 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1yum h LEU 186 CO 0.00 0.22 -0.36 1.23 0.09 0.00 0.00 178.44 179.63 1yum h GLY 187 N 1.00 0.05 0.48 0.83 0.00 -1.20 -2.59 103.07 101.63 1yum h GLY 187 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1yum h GLY 187 CO 0.03 0.04 -0.08 0.00 0.00 0.00 0.00 176.54 176.53 1yum n ALA 188 N -2.47 2.73 -0.84 3.60 0.00 -0.37 -4.26 120.51 118.91 1yum n ALA 188 Ca -0.02 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1yum n ALA 188 Cb 0.41 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1yum n ALA 188 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yum n GLY 189 N 1.21 0.63 3.92 0.00 0.00 -0.97 -5.03 105.19 104.94 1yum n GLY 189 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1yum n GLY 189 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yum s ARG 190 N -0.16 1.75 0.02 1.61 1.81 -0.92 -5.02 118.95 118.04 1yum s ARG 190 Ca 0.00 -0.22 -0.13 0.00 -1.72 0.00 0.00 55.73 53.65 1yum s ARG 190 Cb 0.00 -2.04 -0.06 0.00 -0.45 0.00 0.00 34.95 32.41 1yum s ARG 190 CO 0.00 -1.63 0.40 0.45 -0.68 0.00 0.00 175.30 173.84 1yum s SER 191 N -4.63 6.75 -0.14 0.23 0.15 -1.26 -4.51 113.70 110.28 1yum s SER 191 Ca 0.64 0.90 0.16 0.00 0.70 0.00 0.00 55.95 58.35 1yum s SER 191 Cb -0.09 -2.23 0.42 0.00 -1.71 0.00 0.00 66.02 62.42 1yum s SER 191 CO 0.48 0.29 1.32 1.33 1.20 0.00 0.00 173.24 177.85 1yum n VAL 192 N 1.58 2.00 -1.64 4.45 0.24 -1.26 -4.97 118.33 118.72 1yum n VAL 192 Ca -0.13 -1.85 -0.44 0.00 -2.04 0.00 0.00 64.34 59.88 1yum n VAL 192 Cb 0.52 -0.14 -0.02 0.00 -1.47 0.00 0.00 33.84 32.74 1yum n VAL 192 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1yum n ARG 193 N -0.64 1.75 -0.97 7.34 0.63 -1.26 -1.16 116.66 122.35 1yum n ARG 193 Ca 0.18 0.62 0.00 0.00 -0.92 0.00 0.00 57.85 57.73 1yum n ARG 193 Cb 0.75 -2.13 0.00 0.00 0.45 0.00 0.00 32.46 31.53 1yum n ARG 193 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1yum n PHE 194 N 0.77 0.00 0.13 -0.14 0.99 -1.26 -4.78 117.46 113.17 1yum n PHE 194 Ca 0.09 0.00 0.06 0.00 -0.00 0.00 0.00 57.45 57.60 1yum n PHE 194 Cb 0.32 -0.44 -0.08 0.00 -1.00 0.00 0.00 39.48 38.28 1yum n PHE 194 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.76 178.04 1yum n LEU 195 N 0.00 0.13 -4.41 4.37 4.77 -0.31 -4.97 117.00 116.58 1yum n LEU 195 Ca 0.00 -0.12 -0.21 0.00 -0.03 0.00 0.00 56.01 55.64 1yum n LEU 195 Cb 0.09 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.07 1yum n LEU 195 CO 0.00 0.03 -0.43 0.68 -1.33 0.00 0.00 177.39 176.34 1yum s VAL 196 N -2.63 1.97 0.87 4.08 -7.23 -1.20 -0.76 120.40 115.51 1yum s VAL 196 Ca -0.02 -2.25 -0.11 0.00 -1.81 0.00 0.00 61.98 57.79 1yum s VAL 196 Cb 0.08 -2.24 0.12 0.00 0.56 0.00 0.00 36.38 34.90 1yum s VAL 196 CO 0.48 -0.45 1.15 -2.84 -0.31 0.00 0.00 175.10 173.13 1yum s PRO 197 N -3.62 1.30 0.21 4.82 0.02 -1.26 -4.73 135.00 131.74 1yum s PRO 197 Ca 0.27 1.54 -0.09 0.00 0.02 0.00 0.00 61.00 62.74 1yum s PRO 197 Cb -0.01 -1.76 0.21 0.00 0.02 0.00 0.00 34.50 32.96 1yum s PRO 197 CO 0.11 -2.42 1.85 -0.44 -0.33 0.00 0.00 177.00 175.77 1yum h ASP 198 N -1.59 0.76 0.72 2.53 3.32 -1.98 -0.85 116.42 119.34 1yum h ASP 198 Ca -0.44 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.55 1yum h ASP 198 Cb 1.27 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.64 1yum h ASP 198 CO 0.44 0.52 -0.28 0.00 -1.72 0.00 0.00 179.24 178.20 1yum h ALA 199 N 1.31 1.09 -0.18 3.45 0.00 -1.90 -1.76 119.26 121.28 1yum h ALA 199 Ca 0.30 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1yum h ALA 199 Cb 0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1yum h ALA 199 CO -0.11 0.36 -0.17 0.28 0.00 0.00 0.00 179.25 179.60 1yum h VAL 200 N 0.00 1.34 -0.51 0.00 2.07 -1.50 -2.64 116.25 115.01 1yum h VAL 200 Ca -0.00 -1.33 0.10 0.00 0.82 0.00 0.00 66.70 66.29 1yum h VAL 200 Cb 0.72 1.81 -0.09 0.00 -1.52 0.00 0.00 31.29 32.21 1yum h VAL 200 CO 0.04 0.40 -0.08 0.25 0.02 0.00 0.00 177.57 178.20 1yum h LEU 201 N 0.09 -0.38 -0.80 2.57 7.12 -0.87 -0.55 115.31 122.48 1yum h LEU 201 Ca 0.03 0.14 -0.06 0.00 0.13 0.00 0.00 57.88 58.13 1yum h LEU 201 Cb 0.71 0.28 -0.03 0.00 -0.53 0.00 0.00 40.66 41.09 1yum h LEU 201 CO 0.04 -0.14 0.24 0.78 -0.13 0.00 0.00 178.44 179.24 1yum h ASN 202 N 0.04 1.06 0.30 1.25 2.35 -1.28 -0.20 115.58 119.09 1yum h ASN 202 Ca 0.25 -0.19 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1yum h ASN 202 Cb 0.39 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1yum h ASN 202 CO -0.49 0.97 -0.14 0.22 -1.65 0.00 0.00 177.43 176.34 1yum h TYR 203 N 1.09 -0.37 -0.87 1.19 5.03 -1.02 0.46 116.97 122.48 1yum h TYR 203 Ca 0.24 -0.01 0.18 0.00 2.58 0.00 0.00 58.73 61.72 1yum h TYR 203 Cb 0.29 0.12 -0.11 0.00 1.55 0.00 0.00 36.73 38.58 1yum h TYR 203 CO 0.02 -0.20 0.43 0.82 -1.32 0.00 0.00 178.16 177.92 1yum h ILE 204 N -0.45 0.63 -0.05 1.81 1.08 -1.01 -0.53 117.51 118.99 1yum h ILE 204 Ca -0.04 -0.19 -0.22 0.00 -0.39 0.00 0.00 64.86 64.02 1yum h ILE 204 Cb 0.34 0.04 0.02 0.00 -3.07 0.00 0.00 36.82 34.15 1yum h ILE 204 CO 0.07 0.10 -0.85 -0.33 -0.69 0.00 0.00 178.15 176.45 1yum h GLU 205 N 0.54 0.66 0.00 2.37 5.08 -0.55 -1.39 114.58 121.29 1yum h GLU 205 Ca 0.51 -0.64 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 1yum h GLU 205 Cb 0.83 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 1yum h GLU 205 CO -0.43 1.24 -0.23 0.00 -1.00 0.00 0.00 179.01 178.59 1yum h ALA 206 N 0.43 1.19 -0.16 3.43 0.00 0.47 -2.72 119.26 121.89 1yum h ALA 206 Ca -0.09 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1yum h ALA 206 Cb 1.50 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1yum h ALA 206 CO 0.17 0.29 0.00 0.72 0.00 0.00 0.00 179.25 180.43 1yum n HIS 207 N -3.65 0.19 -4.00 0.00 8.25 -0.26 -4.98 115.22 110.77 1yum n HIS 207 Ca -0.01 -0.12 -0.40 0.00 -0.26 0.00 0.00 57.72 56.93 1yum n HIS 207 Cb 0.36 -0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.47 1yum n HIS 207 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1yum n HIS 208 N 1.12 -1.52 -2.72 4.41 -0.00 -0.60 -4.94 115.22 110.96 1yum n HIS 208 Ca 0.13 0.28 -0.33 0.00 -0.00 0.00 0.00 57.72 57.81 1yum n HIS 208 Cb 0.50 -3.03 -0.06 0.00 -0.00 0.00 0.00 29.99 27.40 1yum n HIS 208 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1yum s LEU 209 N -7.18 3.85 -1.65 2.41 1.43 -0.74 -4.10 118.68 112.71 1yum s LEU 209 Ca 0.39 1.61 0.00 0.00 -1.03 0.00 0.00 54.13 55.11 1yum s LEU 209 Cb -0.19 -4.49 0.00 0.00 0.03 0.00 0.00 46.19 41.54 1yum s LEU 209 CO 0.94 -0.42 0.00 -1.22 0.23 0.00 0.00 176.35 175.88 1yum n TYR 210 N -0.92 0.00 -1.81 0.29 4.02 -1.26 -4.93 117.16 112.55 1yum n TYR 210 Ca 0.07 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.66 1yum n TYR 210 Cb 0.54 -2.90 0.16 0.00 -0.02 0.00 0.00 39.34 37.12 1yum n TYR 210 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1yum s ARG 211 N -3.27 0.91 0.14 -0.72 1.81 -1.26 -3.03 118.95 113.52 1yum s ARG 211 Ca 0.00 -0.17 -0.30 0.00 -1.72 0.00 0.00 55.73 53.54 1yum s ARG 211 Cb 0.00 -1.85 -0.07 0.00 -0.45 0.00 0.00 34.95 32.58 1yum s ARG 211 CO 0.00 -2.27 1.10 0.00 -0.68 0.00 0.00 175.30 173.45 1yum s ALA 212 N -3.67 3.35 -2.00 2.13 0.00 -1.26 -4.82 121.76 115.49 1yum s ALA 212 Ca 0.69 0.78 0.18 0.00 0.00 0.00 0.00 51.96 53.61 1yum s ALA 212 Cb -0.07 -3.36 1.07 0.00 0.00 0.00 0.00 23.12 20.75 1yum s ALA 212 CO 0.52 -0.23 1.47 -2.30 0.00 0.00 0.00 175.76 175.22