#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ee1 h MET 2 N 0.00 0.69 -0.05 -1.46 -1.53 -2.04 -1.43 114.93 109.10 1ee1 h MET 2 Ca 0.00 -0.23 0.02 0.00 -3.44 0.00 0.00 59.70 56.05 1ee1 h MET 2 Cb 0.00 -0.06 -0.02 0.00 -0.55 0.00 0.00 31.60 30.97 1ee1 h MET 2 CO 0.00 0.80 -0.06 0.37 0.14 0.00 0.00 176.91 178.16 1ee1 h GLN 3 N 0.50 -0.07 -1.00 0.39 4.15 -1.98 0.58 115.11 117.67 1ee1 h GLN 3 Ca 0.11 0.00 0.03 0.00 0.77 0.00 0.00 58.65 59.56 1ee1 h GLN 3 Cb 0.50 0.02 -0.06 0.00 0.21 0.00 0.00 27.48 28.15 1ee1 h GLN 3 CO 0.02 -0.05 0.66 1.49 -1.93 0.00 0.00 178.83 179.02 1ee1 h GLU 4 N -0.08 1.24 -0.21 1.69 4.81 -1.93 -0.54 114.58 119.57 1ee1 h GLU 4 Ca 0.04 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 1ee1 h GLU 4 Cb 0.13 -0.28 -0.00 0.00 0.63 0.00 0.00 28.75 29.23 1ee1 h GLU 4 CO -0.09 0.82 -0.23 -0.22 -0.73 0.00 0.00 179.01 178.55 1ee1 h LYS 5 N 1.28 0.53 -0.69 1.92 3.64 -0.69 -2.36 116.57 120.20 1ee1 h LYS 5 Ca 0.40 -0.29 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 1ee1 h LYS 5 Cb -0.02 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.79 1ee1 h LYS 5 CO -0.12 0.88 0.30 0.82 -2.27 0.00 0.00 179.45 179.05 1ee1 h ILE 6 N 0.21 1.23 -0.31 2.00 2.04 -0.67 -1.08 117.51 120.93 1ee1 h ILE 6 Ca 0.03 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 65.20 1ee1 h ILE 6 Cb 0.79 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 1ee1 h ILE 6 CO 0.06 0.28 0.16 0.24 0.00 0.00 0.00 178.15 178.89 1ee1 h MET 7 N 0.98 0.45 -0.50 2.37 2.86 -0.98 -1.52 114.93 118.58 1ee1 h MET 7 Ca 0.23 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.72 1ee1 h MET 7 Cb 0.15 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1ee1 h MET 7 CO -0.03 0.40 -0.07 0.07 1.06 0.00 0.00 176.91 178.35 1ee1 h ARG 8 N 0.38 0.92 -0.06 1.72 0.11 -1.13 -1.35 114.38 114.96 1ee1 h ARG 8 Ca 0.11 -0.33 -0.08 0.00 0.10 0.00 0.00 59.98 59.78 1ee1 h ARG 8 Cb 0.09 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.10 1ee1 h ARG 8 CO -0.02 0.98 -0.33 0.93 0.10 0.00 0.00 179.97 181.63 1ee1 h GLU 9 N 0.78 0.11 -0.02 0.08 5.08 -1.06 -2.18 114.58 117.38 1ee1 h GLU 9 Ca 0.13 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1ee1 h GLU 9 Cb 0.61 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1ee1 h GLU 9 CO 0.04 0.44 -0.08 1.28 -1.00 0.00 0.00 179.01 179.69 1ee1 n LEU 10 N -4.11 1.86 -2.75 1.33 4.77 -0.59 -4.96 117.00 112.54 1ee1 n LEU 10 Ca -0.02 -0.61 -0.19 0.00 -0.03 0.00 0.00 56.01 55.16 1ee1 n LEU 10 Cb 0.40 -0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.51 1ee1 n LEU 10 CO 0.39 0.32 0.08 1.41 -1.33 0.00 0.00 177.39 178.26 1ee1 n HIS 11 N 0.33 -1.94 -2.97 -1.77 8.25 -0.60 -3.17 115.22 113.35 1ee1 n HIS 11 Ca 0.16 0.60 -0.40 0.00 -0.26 0.00 0.00 57.72 57.82 1ee1 n HIS 11 Cb 0.43 -4.11 -0.06 0.00 1.12 0.00 0.00 29.99 27.38 1ee1 n HIS 11 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ee1 s VAL 12 N -3.15 4.47 -0.16 1.59 1.01 -0.69 -4.53 120.40 118.95 1ee1 s VAL 12 Ca 0.35 1.70 -0.06 0.00 0.00 0.00 0.00 61.98 63.96 1ee1 s VAL 12 Cb -0.15 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 1ee1 s VAL 12 CO 0.43 0.47 0.04 -0.54 0.00 0.00 0.00 175.10 175.50 1ee1 s LYS 13 N -0.79 3.76 0.39 2.72 1.02 -1.26 -4.80 119.74 120.78 1ee1 s LYS 13 Ca 0.37 -0.38 0.18 0.00 0.02 0.00 0.00 55.97 56.17 1ee1 s LYS 13 Cb -0.22 -3.10 0.81 0.00 -0.52 0.00 0.00 37.83 34.80 1ee1 s LYS 13 CO 0.25 0.35 1.81 -1.00 -0.92 0.00 0.00 175.35 175.84 1ee1 h PRO 14 N 6.39 0.00 -3.88 -1.68 0.13 -1.88 -3.43 132.00 127.65 1ee1 h PRO 14 Ca -0.39 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.34 1ee1 h PRO 14 Cb 1.18 0.00 -0.35 0.00 0.13 0.00 0.00 31.00 31.96 1ee1 h PRO 14 CO 0.66 0.34 -0.77 0.45 -0.23 0.00 0.00 178.00 178.46 1ee1 s SER 15 N -6.52 0.99 0.25 1.44 0.15 -1.26 -4.95 113.70 103.79 1ee1 s SER 15 Ca -0.01 -0.10 0.11 0.00 0.70 0.00 0.00 55.95 56.65 1ee1 s SER 15 Cb 0.12 -0.40 -0.05 0.00 -1.71 0.00 0.00 66.02 63.98 1ee1 s SER 15 CO 0.68 -0.10 -0.20 0.27 1.20 0.00 0.00 173.24 175.09 1ee1 s ILE 16 N 1.18 2.32 -0.41 6.45 -4.36 -1.26 -5.09 121.20 120.03 1ee1 s ILE 16 Ca -0.07 -2.28 -0.08 0.00 -0.26 0.00 0.00 60.65 57.95 1ee1 s ILE 16 Cb -0.14 -2.20 0.08 0.00 1.25 0.00 0.00 42.46 41.45 1ee1 s ILE 16 CO -0.02 -0.36 0.24 -0.62 0.24 0.00 0.00 174.94 174.42 1ee1 s ASP 17 N -3.27 5.58 0.23 4.36 -1.08 -1.26 -4.99 116.67 116.23 1ee1 s ASP 17 Ca 0.26 -1.50 -0.10 0.00 -0.52 0.00 0.00 52.55 50.69 1ee1 s ASP 17 Cb -0.05 -1.96 0.33 0.00 -1.46 0.00 0.00 42.92 39.78 1ee1 s ASP 17 CO 0.12 -0.52 1.64 -0.65 0.52 0.00 0.00 175.17 176.28 1ee1 h PRO 18 N 8.36 0.07 -0.50 4.34 0.11 -1.98 -0.92 132.00 141.48 1ee1 h PRO 18 Ca -0.22 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1ee1 h PRO 18 Cb 1.08 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1ee1 h PRO 18 CO 0.74 0.04 0.32 0.87 -0.21 0.00 0.00 178.00 179.76 1ee1 h LYS 19 N 0.07 0.66 -0.43 1.05 1.79 -1.97 -2.37 116.57 115.37 1ee1 h LYS 19 Ca 0.35 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 58.67 1ee1 h LYS 19 Cb 0.58 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 31.07 1ee1 h LYS 19 CO -0.63 0.46 -0.16 0.37 -1.08 0.00 0.00 179.45 178.41 1ee1 h GLN 20 N 0.67 0.81 -0.85 3.15 5.75 -1.77 -2.35 115.11 120.53 1ee1 h GLN 20 Ca 0.18 -0.30 0.01 0.00 -0.15 0.00 0.00 58.65 58.39 1ee1 h GLN 20 Cb -0.05 -0.05 -0.04 0.00 1.07 0.00 0.00 27.48 28.40 1ee1 h GLN 20 CO -0.04 0.92 0.55 0.93 -2.65 0.00 0.00 178.83 178.54 1ee1 h GLU 21 N 0.72 1.12 -0.23 1.69 4.39 -0.96 0.12 114.58 121.44 1ee1 h GLU 21 Ca 0.11 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.71 1ee1 h GLU 21 Cb 0.66 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1ee1 h GLU 21 CO 0.05 0.75 0.03 0.82 -1.16 0.00 0.00 179.01 179.50 1ee1 h ILE 22 N 1.15 1.23 -0.47 3.13 2.04 -1.33 -1.49 117.51 121.77 1ee1 h ILE 22 Ca 0.31 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.42 1ee1 h ILE 22 Cb -0.12 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 1ee1 h ILE 22 CO -0.07 0.24 0.27 -0.08 0.00 0.00 0.00 178.15 178.52 1ee1 h GLU 23 N 0.18 0.52 -0.32 2.37 4.81 -0.88 -0.30 114.58 120.97 1ee1 h GLU 23 Ca 0.07 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1ee1 h GLU 23 Cb 0.33 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1ee1 h GLU 23 CO 0.01 0.35 0.20 -0.44 -0.73 0.00 0.00 179.01 178.39 1ee1 h ASP 24 N 0.54 0.38 0.52 1.04 3.32 -0.70 -0.63 116.42 120.89 1ee1 h ASP 24 Ca 0.19 -0.04 -0.16 0.00 0.02 0.00 0.00 57.03 57.04 1ee1 h ASP 24 Cb 0.04 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1ee1 h ASP 24 CO -0.10 0.31 -0.72 0.03 -1.72 0.00 0.00 179.24 177.04 1ee1 h ARG 25 N 0.42 0.17 -0.23 3.56 3.08 -1.00 0.03 114.38 120.41 1ee1 h ARG 25 Ca 0.12 -0.14 -0.18 0.00 0.07 0.00 0.00 59.98 59.84 1ee1 h ARG 25 Cb -0.01 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1ee1 h ARG 25 CO -0.02 0.81 -0.57 0.28 -1.07 0.00 0.00 179.97 179.40 1ee1 h VAL 26 N 0.11 1.29 -0.45 2.04 2.07 -1.00 -2.49 116.25 117.81 1ee1 h VAL 26 Ca -0.02 -1.77 -0.06 0.00 0.82 0.00 0.00 66.70 65.67 1ee1 h VAL 26 Cb 1.27 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.82 1ee1 h VAL 26 CO 0.11 0.57 0.02 0.78 0.02 0.00 0.00 177.57 179.06 1ee1 h ASN 27 N 0.53 0.69 -0.21 0.57 2.35 -0.99 -1.40 115.58 117.13 1ee1 h ASN 27 Ca -0.01 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 1ee1 h ASN 27 Cb 1.18 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 39.36 1ee1 h ASN 27 CO 0.12 0.75 0.11 0.15 -1.65 0.00 0.00 177.43 176.91 1ee1 h PHE 28 N 0.69 0.29 -0.69 1.19 3.57 -0.92 0.78 116.94 121.85 1ee1 h PHE 28 Ca 0.14 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.67 1ee1 h PHE 28 Cb 0.40 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 39.00 1ee1 h PHE 28 CO 0.02 0.27 0.42 -0.07 -2.23 0.00 0.00 178.31 176.72 1ee1 h LEU 29 N 0.22 0.66 -0.20 0.59 3.38 -1.00 -0.44 115.31 118.52 1ee1 h LEU 29 Ca 0.07 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1ee1 h LEU 29 Cb 0.09 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1ee1 h LEU 29 CO -0.01 0.45 -0.01 0.11 0.09 0.00 0.00 178.44 179.07 1ee1 h LYS 30 N 0.80 0.36 -0.64 1.13 1.57 -1.04 -1.97 116.57 116.78 1ee1 h LYS 30 Ca 0.29 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1ee1 h LYS 30 Cb 0.09 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 1ee1 h LYS 30 CO -0.14 0.56 0.40 1.96 -0.57 0.00 0.00 179.45 181.67 1ee1 h GLN 31 N 0.11 0.86 -0.40 3.15 1.08 -0.61 -1.75 115.11 117.55 1ee1 h GLN 31 Ca 0.06 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 1ee1 h GLN 31 Cb 0.41 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 1ee1 h GLN 31 CO 0.01 0.59 0.18 -0.92 -0.95 0.00 0.00 178.83 177.75 1ee1 h TYR 32 N 0.86 0.58 -0.30 2.96 3.20 -1.03 -1.37 116.97 121.86 1ee1 h TYR 32 Ca 0.23 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.10 1ee1 h TYR 32 Cb -0.06 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.01 1ee1 h TYR 32 CO -0.02 0.49 0.12 0.28 -1.64 0.00 0.00 178.16 177.38 1ee1 h VAL 33 N 0.50 0.94 -0.45 1.81 2.07 -1.13 -1.96 116.25 118.04 1ee1 h VAL 33 Ca 0.13 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 1ee1 h VAL 33 Cb 0.13 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 1ee1 h VAL 33 CO -0.02 0.05 0.24 0.11 0.02 0.00 0.00 177.57 177.97 1ee1 h LYS 34 N 0.26 0.62 -0.83 1.57 1.57 -1.12 0.78 116.57 119.43 1ee1 h LYS 34 Ca 0.13 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1ee1 h LYS 34 Cb 0.09 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.23 1ee1 h LYS 34 CO -0.12 0.50 0.48 -0.22 -0.57 0.00 0.00 179.45 179.52 1ee1 h LYS 35 N 0.58 1.13 0.00 3.15 3.11 -1.03 -3.05 116.57 120.47 1ee1 h LYS 35 Ca 0.16 -0.11 0.00 0.00 -2.81 0.00 0.00 60.65 57.88 1ee1 h LYS 35 Cb 0.06 -0.23 0.00 0.00 -1.00 0.00 0.00 32.23 31.06 1ee1 h LYS 35 CO -0.02 0.81 -0.76 1.79 -2.81 0.00 0.00 179.45 178.46 1ee1 h THR 36 N 1.14 0.00 -0.36 1.00 1.35 -1.17 -3.48 112.91 111.39 1ee1 h THR 36 Ca 0.29 -0.78 -0.16 0.00 -0.55 0.00 0.00 66.41 65.22 1ee1 h THR 36 Cb -0.02 1.36 -0.06 0.00 -1.73 0.00 0.00 68.15 67.70 1ee1 h THR 36 CO -0.05 0.00 -0.14 0.61 -0.25 0.00 0.00 175.52 175.69 1ee1 n GLY 37 N 1.24 0.97 3.74 5.82 0.00 0.25 -4.99 105.19 112.21 1ee1 n GLY 37 Ca 0.02 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.11 1ee1 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ee1 s ALA 38 N -2.26 1.86 -1.97 4.61 0.00 -1.12 -4.95 121.76 117.93 1ee1 s ALA 38 Ca 0.00 0.10 0.26 0.00 0.00 0.00 0.00 51.96 52.32 1ee1 s ALA 38 Cb 0.00 -3.24 0.69 0.00 0.00 0.00 0.00 23.12 20.58 1ee1 s ALA 38 CO 0.00 -2.10 1.53 1.63 0.00 0.00 0.00 175.76 176.81 1ee1 n LYS 39 N -3.73 1.08 0.00 0.00 5.02 -0.35 -4.87 118.16 115.32 1ee1 n LYS 39 Ca 0.08 -0.69 0.00 0.00 -2.02 0.00 0.00 58.31 55.68 1ee1 n LYS 39 Cb 0.54 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 1ee1 n LYS 39 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ee1 n GLY 40 N 1.32 0.28 3.17 0.72 0.00 -1.26 -0.94 105.19 108.49 1ee1 n GLY 40 Ca 0.13 -1.28 -0.11 0.00 0.00 0.00 0.00 46.02 44.77 1ee1 n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ee1 s PHE 41 N -4.00 0.92 -0.01 1.61 0.40 -0.48 -0.62 117.98 115.80 1ee1 s PHE 41 Ca 0.00 -1.02 0.00 0.00 -0.60 0.00 0.00 56.93 55.31 1ee1 s PHE 41 Cb 0.00 -0.54 0.01 0.00 0.51 0.00 0.00 43.02 43.00 1ee1 s PHE 41 CO 0.00 -0.27 -0.01 0.54 0.70 0.00 0.00 175.22 176.18 1ee1 s VAL 42 N -3.75 0.13 -0.14 -0.44 0.11 -0.20 -1.26 120.40 114.84 1ee1 s VAL 42 Ca 0.17 -0.01 -0.09 0.00 -2.93 0.00 0.00 61.98 59.12 1ee1 s VAL 42 Cb 0.06 -0.16 0.05 0.00 -1.53 0.00 0.00 36.38 34.80 1ee1 s VAL 42 CO -0.02 0.07 0.35 -0.22 -3.33 0.00 0.00 175.10 171.95 1ee1 s LEU 43 N 0.32 0.28 0.11 2.54 2.96 -0.80 -2.02 118.68 122.08 1ee1 s LEU 43 Ca -0.03 0.75 -0.31 0.00 -0.22 0.00 0.00 54.13 54.32 1ee1 s LEU 43 Cb -0.05 1.16 -0.07 0.00 0.50 0.00 0.00 46.19 47.73 1ee1 s LEU 43 CO -0.01 -0.16 1.27 -0.83 -1.32 0.00 0.00 176.35 175.30 1ee1 s GLY 44 N 0.95 2.33 -0.34 7.98 0.00 -1.26 -1.30 107.32 115.68 1ee1 s GLY 44 Ca -0.06 0.97 -0.08 0.00 0.00 0.00 0.00 44.72 45.55 1ee1 s GLY 44 CO -0.07 2.10 0.13 -0.42 0.00 0.00 0.00 173.10 174.84 1ee1 s ILE 45 N 0.79 4.07 -0.17 0.90 -1.09 0.95 -4.85 121.20 121.79 1ee1 s ILE 45 Ca 0.59 -0.93 0.22 0.00 -2.23 0.00 0.00 60.65 58.31 1ee1 s ILE 45 Cb -0.33 -3.24 -0.10 0.00 -1.58 0.00 0.00 42.46 37.21 1ee1 s ILE 45 CO 0.32 -0.12 0.88 -1.54 -1.23 0.00 0.00 174.94 173.24 1ee1 n SER 46 N 4.88 0.61 0.00 3.58 3.41 -1.26 -4.48 113.62 120.36 1ee1 n SER 46 Ca -0.13 0.24 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1ee1 n SER 46 Cb 0.46 0.87 0.00 0.00 -0.26 0.00 0.00 64.21 65.28 1ee1 n SER 46 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ee1 n GLY 47 N 1.21 0.52 3.94 5.00 0.00 -1.26 -4.37 105.19 110.24 1ee1 n GLY 47 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 1ee1 n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ee1 s GLY 48 N -1.01 1.51 0.23 -0.02 0.00 -1.26 -4.63 107.32 102.14 1ee1 s GLY 48 Ca 0.00 -0.96 -0.06 0.00 0.00 0.00 0.00 44.72 43.70 1ee1 s GLY 48 CO 0.00 -0.81 1.72 -1.61 0.00 0.00 0.00 173.10 172.41 1ee1 h GLN 49 N 0.43 0.38 -0.23 2.90 4.15 -1.94 -2.72 115.11 118.08 1ee1 h GLN 49 Ca -0.47 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 58.90 1ee1 h GLN 49 Cb 1.24 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.84 1ee1 h GLN 49 CO 0.59 0.25 0.04 -0.44 -1.93 0.00 0.00 178.83 177.34 1ee1 h ASP 50 N 0.39 0.37 0.96 -0.69 3.32 -1.93 -1.63 116.42 117.20 1ee1 h ASP 50 Ca 0.38 -0.26 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 1ee1 h ASP 50 Cb 0.55 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1ee1 h ASP 50 CO -0.39 0.53 -0.39 0.77 -1.72 0.00 0.00 179.24 178.03 1ee1 h SER 51 N 0.19 0.00 -0.14 6.45 4.64 -1.88 -0.70 113.55 122.10 1ee1 h SER 51 Ca 0.07 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 1ee1 h SER 51 Cb 0.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1ee1 h SER 51 CO 0.00 0.39 -0.00 0.74 -0.87 0.00 0.00 176.83 177.09 1ee1 h THR 52 N 0.00 1.26 0.09 2.95 2.02 -1.38 0.28 112.91 118.13 1ee1 h THR 52 Ca -0.00 -0.85 -0.00 0.00 0.77 0.00 0.00 66.41 66.32 1ee1 h THR 52 Cb 0.98 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.94 1ee1 h THR 52 CO 0.05 0.25 -0.04 0.25 0.37 0.00 0.00 175.52 176.40 1ee1 h LEU 53 N -0.03 -0.10 -0.87 2.58 5.85 -1.18 -1.15 115.31 120.42 1ee1 h LEU 53 Ca 0.04 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.52 1ee1 h LEU 53 Cb 0.38 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1ee1 h LEU 53 CO 0.01 0.19 0.57 0.00 -0.34 0.00 0.00 178.44 178.87 1ee1 h ALA 54 N 0.49 1.10 -0.26 1.25 0.00 -1.15 -1.82 119.26 118.87 1ee1 h ALA 54 Ca -0.01 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ee1 h ALA 54 Cb 0.34 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1ee1 h ALA 54 CO 0.02 0.50 0.10 0.78 0.00 0.00 0.00 179.25 180.65 1ee1 h GLY 55 N 1.17 0.33 1.29 0.00 0.00 -0.33 -0.62 103.07 104.92 1ee1 h GLY 55 Ca 0.32 -0.07 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 1ee1 h GLY 55 CO -0.07 0.04 0.23 -0.09 0.00 0.00 0.00 176.54 176.65 1ee1 h ARG 56 N 0.23 0.90 -0.62 4.80 9.65 -0.81 -1.76 114.38 126.77 1ee1 h ARG 56 Ca 0.11 -0.15 -0.06 0.00 -1.10 0.00 0.00 59.98 58.78 1ee1 h ARG 56 Cb 0.06 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.47 1ee1 h ARG 56 CO -0.10 0.75 0.17 -0.07 2.80 0.00 0.00 179.97 183.51 1ee1 h LEU 57 N 0.88 0.92 -0.78 3.80 3.38 -0.65 -0.89 115.31 121.97 1ee1 h LEU 57 Ca 0.21 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1ee1 h LEU 57 Cb 0.20 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1ee1 h LEU 57 CO -0.02 0.90 0.14 0.00 0.09 0.00 0.00 178.44 179.56 1ee1 h ALA 58 N 1.05 1.00 -0.49 1.53 0.00 -0.67 -0.44 119.26 121.24 1ee1 h ALA 58 Ca 0.20 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1ee1 h ALA 58 Cb 0.33 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ee1 h ALA 58 CO -0.00 0.64 -0.18 0.37 0.00 0.00 0.00 179.25 180.09 1ee1 h GLN 59 N 1.00 0.98 -0.39 0.00 5.75 -0.99 -1.68 115.11 119.78 1ee1 h GLN 59 Ca 0.21 -0.40 -0.09 0.00 -0.15 0.00 0.00 58.65 58.21 1ee1 h GLN 59 Cb 0.38 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.87 1ee1 h GLN 59 CO 0.00 1.08 -0.15 -0.07 -2.65 0.00 0.00 178.83 177.04 1ee1 h LEU 60 N 0.84 0.70 -0.20 -2.39 3.38 -0.83 -1.24 115.31 115.57 1ee1 h LEU 60 Ca 0.12 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1ee1 h LEU 60 Cb 0.75 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1ee1 h LEU 60 CO 0.06 0.86 0.02 0.00 0.09 0.00 0.00 178.44 179.47 1ee1 h ALA 61 N 1.20 0.27 -0.71 1.53 0.00 -0.88 -0.68 119.26 119.98 1ee1 h ALA 61 Ca 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1ee1 h ALA 61 Cb 0.61 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1ee1 h ALA 61 CO 0.04 -0.05 0.40 0.28 0.00 0.00 0.00 179.25 179.92 1ee1 h VAL 62 N 0.12 1.22 -0.42 0.00 2.07 -1.21 0.80 116.25 118.82 1ee1 h VAL 62 Ca 0.06 -0.53 -0.14 0.00 0.82 0.00 0.00 66.70 66.91 1ee1 h VAL 62 Cb 0.34 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 1ee1 h VAL 62 CO 0.01 0.24 -0.29 -0.33 0.02 0.00 0.00 177.57 177.21 1ee1 h GLU 63 N 0.98 0.92 -0.75 1.57 5.08 -1.14 -1.86 114.58 119.37 1ee1 h GLU 63 Ca 0.25 -0.43 -0.05 0.00 -1.00 0.00 0.00 59.36 58.13 1ee1 h GLU 63 Cb 0.02 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1ee1 h GLU 63 CO -0.04 1.09 0.27 1.03 -1.00 0.00 0.00 179.01 180.36 1ee1 h SER 64 N 0.78 1.06 -0.28 1.42 0.87 -0.62 -1.02 113.55 115.77 1ee1 h SER 64 Ca 0.09 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.45 1ee1 h SER 64 Cb 0.86 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 62.53 1ee1 h SER 64 CO 0.08 0.97 0.15 0.40 -0.53 0.00 0.00 176.83 177.89 1ee1 h ILE 65 N 1.10 1.13 -0.86 2.23 2.04 -0.64 -2.69 117.51 119.82 1ee1 h ILE 65 Ca 0.25 -0.35 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 1ee1 h ILE 65 Cb 0.26 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1ee1 h ILE 65 CO -0.01 0.13 0.43 0.03 0.00 0.00 0.00 178.15 178.72 1ee1 h ARG 66 N 0.33 1.23 -0.70 2.37 3.08 -1.13 -0.15 114.38 119.40 1ee1 h ARG 66 Ca 0.10 -0.17 0.06 0.00 0.07 0.00 0.00 59.98 60.04 1ee1 h ARG 66 Cb 0.08 -0.23 -0.04 0.00 0.08 0.00 0.00 29.97 29.86 1ee1 h ARG 66 CO -0.01 0.93 0.46 1.49 -1.07 0.00 0.00 179.97 181.77 1ee1 h GLU 67 N 1.22 0.70 0.00 0.04 4.81 -1.03 0.42 114.58 120.74 1ee1 h GLU 67 Ca 0.30 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1ee1 h GLU 67 Cb 0.10 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1ee1 h GLU 67 CO -0.04 0.46 0.00 0.39 -0.73 0.00 0.00 179.01 179.09 1ee1 n GLU 68 N -4.48 0.51 0.00 1.92 1.02 -0.89 -4.86 120.64 113.86 1ee1 n GLU 68 Ca 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1ee1 n GLU 68 Cb 0.23 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 1ee1 n GLU 68 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ee1 n GLY 69 N 1.23 0.82 3.82 0.62 0.00 0.14 -5.09 105.19 106.72 1ee1 n GLY 69 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 1ee1 n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ee1 n GLY 70 N -1.45 -0.56 2.94 -0.02 0.00 -0.12 -4.97 105.19 101.01 1ee1 n GLY 70 Ca 0.00 -1.85 -0.28 0.00 0.00 0.00 0.00 46.02 43.89 1ee1 n GLY 70 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ee1 s ASP 71 N -5.46 2.48 -0.12 1.61 2.15 -1.26 -4.05 116.67 112.02 1ee1 s ASP 71 Ca 0.70 -0.44 -0.29 0.00 0.43 0.00 0.00 52.55 52.95 1ee1 s ASP 71 Cb -0.03 -0.96 0.08 0.00 -0.30 0.00 0.00 42.92 41.71 1ee1 s ASP 71 CO 0.48 -0.11 0.76 0.00 -0.17 0.00 0.00 175.17 176.13 1ee1 s ALA 72 N 1.62 -1.81 0.08 3.66 0.00 -1.26 -4.81 121.76 119.24 1ee1 s ALA 72 Ca 0.04 1.52 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1ee1 s ALA 72 Cb -0.13 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.54 1ee1 s ALA 72 CO -0.09 -0.35 -0.04 1.14 0.00 0.00 0.00 175.76 176.42 1ee1 s GLN 73 N -0.83 0.74 -0.09 0.00 -2.07 -0.11 -4.89 119.66 112.41 1ee1 s GLN 73 Ca -0.07 -1.29 -0.00 0.00 -1.82 0.00 0.00 55.36 52.18 1ee1 s GLN 73 Cb -0.01 0.01 0.02 0.00 -1.09 0.00 0.00 33.01 31.94 1ee1 s GLN 73 CO 0.06 -0.08 -0.06 0.12 -1.32 0.00 0.00 175.29 174.01 1ee1 s PHE 74 N -3.79 1.25 -0.29 9.60 5.36 -1.26 -1.39 117.98 127.46 1ee1 s PHE 74 Ca 0.10 -0.56 -0.06 0.00 -0.96 0.00 0.00 56.93 55.46 1ee1 s PHE 74 Cb 0.07 -1.08 0.02 0.00 -0.34 0.00 0.00 43.02 41.68 1ee1 s PHE 74 CO -0.07 -0.43 0.06 0.42 -1.46 0.00 0.00 175.22 173.74 1ee1 s ILE 75 N 1.61 3.73 -0.07 3.12 1.01 -0.39 -2.26 121.20 127.94 1ee1 s ILE 75 Ca 0.02 -0.84 -0.17 0.00 0.00 0.00 0.00 60.65 59.66 1ee1 s ILE 75 Cb -0.13 -2.96 -0.05 0.00 0.01 0.00 0.00 42.46 39.34 1ee1 s ILE 75 CO -0.06 0.05 0.44 0.00 0.00 0.00 0.00 174.94 175.37 1ee1 s ALA 76 N 1.45 3.57 -0.07 9.38 0.00 -0.32 -1.91 121.76 133.86 1ee1 s ALA 76 Ca 0.01 -0.22 0.04 0.00 0.00 0.00 0.00 51.96 51.80 1ee1 s ALA 76 Cb -0.18 -2.53 -0.00 0.00 0.00 0.00 0.00 23.12 20.42 1ee1 s ALA 76 CO 0.01 0.20 -0.20 0.08 0.00 0.00 0.00 175.76 175.85 1ee1 s VAL 77 N -0.06 1.69 -0.10 0.00 1.01 -0.42 -0.38 120.40 122.14 1ee1 s VAL 77 Ca 0.24 -0.83 -0.21 0.00 0.00 0.00 0.00 61.98 61.18 1ee1 s VAL 77 Cb -0.16 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.72 1ee1 s VAL 77 CO 0.11 0.48 0.60 -0.13 0.00 0.00 0.00 175.10 176.16 1ee1 s ARG 78 N 0.22 4.37 -0.55 2.72 1.81 0.42 -0.04 118.95 127.90 1ee1 s ARG 78 Ca -0.11 0.67 0.06 0.00 -1.72 0.00 0.00 55.73 54.64 1ee1 s ARG 78 Cb -0.15 -3.46 0.33 0.00 -0.45 0.00 0.00 34.95 31.22 1ee1 s ARG 78 CO 0.05 0.07 0.88 1.28 -0.68 0.00 0.00 175.30 176.90 1ee1 n LEU 79 N 3.88 3.78 -4.80 2.53 4.77 -1.26 -0.67 117.00 125.22 1ee1 n LEU 79 Ca -0.04 -5.54 -0.31 0.00 -0.03 0.00 0.00 56.01 50.09 1ee1 n LEU 79 Cb 0.51 -0.36 0.05 0.00 -2.33 0.00 0.00 43.42 41.29 1ee1 n LEU 79 CO 0.45 2.30 0.71 -2.16 -1.33 0.00 0.00 177.39 177.36 1ee1 s PRO 80 N -3.14 2.87 -0.65 3.23 0.04 -1.25 -4.73 135.00 131.37 1ee1 s PRO 80 Ca 0.46 1.06 -0.04 0.00 0.04 0.00 0.00 61.00 62.53 1ee1 s PRO 80 Cb 0.27 -1.98 0.17 0.00 0.04 0.00 0.00 34.50 33.00 1ee1 s PRO 80 CO -0.11 -1.16 0.48 -1.58 0.04 0.00 0.00 177.00 174.67 1ee1 s HIS 81 N -2.88 3.43 0.00 0.56 2.46 -1.26 -1.26 115.29 116.35 1ee1 s HIS 81 Ca 0.60 -2.68 0.00 0.00 0.47 0.00 0.00 55.06 53.45 1ee1 s HIS 81 Cb -0.15 -3.25 0.00 0.00 -0.13 0.00 0.00 32.58 29.05 1ee1 s HIS 81 CO 0.51 -0.85 0.00 0.41 -2.47 0.00 0.00 174.74 172.35 1ee1 n GLY 82 N 3.46 2.17 3.74 1.59 0.00 -1.26 -4.63 105.19 110.26 1ee1 n GLY 82 Ca 0.09 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 1ee1 n GLY 82 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ee1 s THR 83 N 0.00 5.38 -0.24 2.61 2.01 -1.26 -5.03 115.64 119.11 1ee1 s THR 83 Ca 0.00 0.31 -0.16 0.00 0.31 0.00 0.00 61.69 62.15 1ee1 s THR 83 Cb 0.00 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 1ee1 s THR 83 CO 0.00 0.43 0.40 -1.58 -0.69 0.00 0.00 174.62 173.18 1ee1 s GLN 84 N 0.33 4.10 0.31 4.92 0.74 -1.26 -4.96 119.66 123.83 1ee1 s GLN 84 Ca 0.11 0.14 0.06 0.00 0.05 0.00 0.00 55.36 55.73 1ee1 s GLN 84 Cb -0.12 -3.60 0.76 0.00 1.10 0.00 0.00 33.01 31.15 1ee1 s GLN 84 CO 0.00 -0.16 1.78 0.37 -0.55 0.00 0.00 175.29 176.73 1ee1 h GLN 85 N 7.75 0.73 -0.69 1.67 4.15 -1.97 -1.55 115.11 125.21 1ee1 h GLN 85 Ca -0.34 -0.04 -0.41 0.00 0.77 0.00 0.00 58.65 58.63 1ee1 h GLN 85 Cb 1.16 -0.16 -0.24 0.00 0.21 0.00 0.00 27.48 28.45 1ee1 h GLN 85 CO 0.69 0.48 0.18 -0.40 -1.93 0.00 0.00 178.83 177.85 1ee1 n ASP 86 N -4.75 4.11 -0.35 -0.69 5.75 -1.26 -4.73 116.55 114.64 1ee1 n ASP 86 Ca 0.23 -3.75 0.22 0.00 -0.01 0.00 0.00 54.79 51.49 1ee1 n ASP 86 Cb 0.58 -0.71 0.47 0.00 -1.03 0.00 0.00 41.12 40.42 1ee1 n ASP 86 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1ee1 h GLU 87 N 1.36 0.41 -0.63 0.11 4.57 -1.64 0.36 114.58 119.12 1ee1 h GLU 87 Ca 0.42 -0.02 0.08 0.00 -1.18 0.00 0.00 59.36 58.65 1ee1 h GLU 87 Cb 1.77 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 30.23 1ee1 h GLU 87 CO 0.85 0.27 0.42 -0.44 -1.18 0.00 0.00 179.01 178.93 1ee1 h ASP 88 N 0.42 0.49 -0.32 1.04 5.19 -1.85 -0.29 116.42 121.10 1ee1 h ASP 88 Ca 0.67 0.01 -0.13 0.00 -0.62 0.00 0.00 57.03 56.95 1ee1 h ASP 88 Cb 1.54 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.94 1ee1 h ASP 88 CO -0.45 0.31 -0.28 0.44 -3.12 0.00 0.00 179.24 176.14 1ee1 h ASP 89 N 0.56 0.86 -0.42 6.45 3.32 -0.63 -0.63 116.42 125.93 1ee1 h ASP 89 Ca 0.28 -0.34 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 1ee1 h ASP 89 Cb 0.38 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1ee1 h ASP 89 CO -0.09 1.09 -0.02 0.00 -1.72 0.00 0.00 179.24 178.50 1ee1 h ALA 90 N 0.97 1.03 -0.23 3.45 0.00 -0.94 0.60 119.26 124.14 1ee1 h ALA 90 Ca 0.08 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 1ee1 h ALA 90 Cb 0.83 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1ee1 h ALA 90 CO 0.07 0.60 -0.44 1.96 0.00 0.00 0.00 179.25 181.44 1ee1 h GLN 91 N 0.77 0.58 -0.26 0.00 1.08 -0.89 -1.54 115.11 114.85 1ee1 h GLN 91 Ca 0.14 -0.31 -0.02 0.00 -1.45 0.00 0.00 58.65 57.02 1ee1 h GLN 91 Cb 0.50 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 1ee1 h GLN 91 CO 0.03 0.90 0.10 1.25 -0.95 0.00 0.00 178.83 180.16 1ee1 h LEU 92 N 0.47 0.37 -0.65 1.46 6.46 -0.58 -1.56 115.31 121.27 1ee1 h LEU 92 Ca 0.03 -0.18 0.09 0.00 -0.12 0.00 0.00 57.88 57.70 1ee1 h LEU 92 Cb 0.95 -0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 40.72 1ee1 h LEU 92 CO 0.09 0.45 0.30 0.00 -0.62 0.00 0.00 178.44 178.65 1ee1 h ALA 93 N 0.93 0.87 -0.81 1.25 0.00 -0.61 -1.24 119.26 119.66 1ee1 h ALA 93 Ca 0.09 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1ee1 h ALA 93 Cb 0.20 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1ee1 h ALA 93 CO -0.01 -0.11 0.38 -0.07 0.00 0.00 0.00 179.25 179.45 1ee1 h LEU 94 N 0.52 1.06 -1.37 0.00 3.38 -0.96 0.17 115.31 118.11 1ee1 h LEU 94 Ca 0.32 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 1ee1 h LEU 94 Cb 0.35 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1ee1 h LEU 94 CO -0.27 0.91 0.18 0.50 0.09 0.00 0.00 178.44 179.85 1ee1 h LYS 95 N 1.15 0.61 0.04 1.13 3.64 -0.26 0.15 116.57 123.02 1ee1 h LYS 95 Ca 0.28 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.50 1ee1 h LYS 95 Cb 0.13 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1ee1 h LYS 95 CO -0.03 0.50 -0.35 0.35 -2.27 0.00 0.00 179.45 177.65 1ee1 h PHE 96 N 0.61 0.28 -0.76 1.91 3.57 -0.69 -3.35 116.94 118.51 1ee1 h PHE 96 Ca 0.15 -0.18 -0.04 0.00 3.53 0.00 0.00 57.97 61.44 1ee1 h PHE 96 Cb 0.11 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.80 1ee1 h PHE 96 CO 0.01 1.07 0.34 0.82 -2.23 0.00 0.00 178.31 178.31 1ee1 h ILE 97 N -0.59 1.25 -5.85 1.41 2.04 -0.46 -3.48 117.51 111.84 1ee1 h ILE 97 Ca -0.05 -0.74 -0.35 0.00 1.00 0.00 0.00 64.86 64.71 1ee1 h ILE 97 Cb 1.19 0.32 0.13 0.00 -0.74 0.00 0.00 36.82 37.72 1ee1 h ILE 97 CO 0.07 0.31 -0.87 0.29 0.00 0.00 0.00 178.15 177.94 1ee1 n LYS 98 N -4.35 -2.94 -1.56 2.37 5.02 0.49 -4.85 118.16 112.34 1ee1 n LYS 98 Ca 0.07 0.69 -0.32 0.00 -2.02 0.00 0.00 58.31 56.72 1ee1 n LYS 98 Cb 0.16 -5.17 0.06 0.00 -0.02 0.00 0.00 35.03 30.06 1ee1 n LYS 98 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ee1 s PRO 99 N -5.32 2.69 0.20 1.97 0.04 -1.26 -4.94 135.00 128.38 1ee1 s PRO 99 Ca 0.32 1.18 -0.11 0.00 0.04 0.00 0.00 61.00 62.42 1ee1 s PRO 99 Cb -0.07 -1.95 0.20 0.00 0.04 0.00 0.00 34.50 32.71 1ee1 s PRO 99 CO 0.79 -1.31 1.79 -0.44 0.04 0.00 0.00 177.00 177.88 1ee1 h ASP 100 N -0.54 0.43 -4.13 6.66 3.32 -1.91 -3.43 116.42 116.82 1ee1 h ASP 100 Ca -0.45 0.03 -0.32 0.00 0.02 0.00 0.00 57.03 56.32 1ee1 h ASP 100 Cb 1.23 -0.05 -0.27 0.00 0.22 0.00 0.00 39.33 40.47 1ee1 h ASP 100 CO 0.54 0.29 -0.75 -0.54 -1.72 0.00 0.00 179.24 177.06 1ee1 s LYS 101 N -6.11 0.47 -0.24 3.56 1.02 -0.96 -5.02 119.74 112.46 1ee1 s LYS 101 Ca -0.13 -0.34 0.02 0.00 0.02 0.00 0.00 55.97 55.54 1ee1 s LYS 101 Cb 0.15 -0.40 0.05 0.00 -0.52 0.00 0.00 37.83 37.12 1ee1 s LYS 101 CO 0.75 0.10 -0.10 -1.12 -0.92 0.00 0.00 175.35 174.06 1ee1 s SER 102 N -0.51 4.02 0.41 2.83 0.01 -1.26 -1.18 113.70 118.03 1ee1 s SER 102 Ca -0.01 -1.20 0.07 0.00 1.31 0.00 0.00 55.95 56.12 1ee1 s SER 102 Cb -0.04 -1.38 -0.05 0.00 0.21 0.00 0.00 66.02 64.76 1ee1 s SER 102 CO -0.00 -0.18 0.20 0.26 0.41 0.00 0.00 173.24 173.93 1ee1 s TRP 103 N 1.25 2.62 -0.00 2.43 0.52 0.49 -4.99 118.94 121.25 1ee1 s TRP 103 Ca -0.06 -0.57 -0.01 0.00 0.02 0.00 0.00 56.10 55.48 1ee1 s TRP 103 Cb -0.19 -1.98 -0.00 0.00 -1.15 0.00 0.00 33.47 30.16 1ee1 s TRP 103 CO -0.06 0.15 0.03 0.21 0.02 0.00 0.00 176.95 177.30 1ee1 s LYS 104 N -3.93 0.14 -0.19 4.98 2.20 -1.26 -0.44 119.74 121.24 1ee1 s LYS 104 Ca 0.42 -0.15 -0.04 0.00 -0.36 0.00 0.00 55.97 55.84 1ee1 s LYS 104 Cb 0.03 0.05 0.10 0.00 -1.51 0.00 0.00 37.83 36.50 1ee1 s LYS 104 CO 0.23 -0.02 0.28 0.12 -0.36 0.00 0.00 175.35 175.60 1ee1 s PHE 105 N -0.44 -0.47 -0.28 4.03 5.36 0.15 -4.90 117.98 121.43 1ee1 s PHE 105 Ca -0.05 0.61 -0.27 0.00 -0.96 0.00 0.00 56.93 56.27 1ee1 s PHE 105 Cb -0.03 -0.16 0.01 0.00 -0.34 0.00 0.00 43.02 42.49 1ee1 s PHE 105 CO -0.00 -0.56 0.94 0.34 -1.46 0.00 0.00 175.22 174.47 1ee1 s ASP 106 N 2.42 6.88 0.00 6.13 -1.08 -1.26 -3.75 116.67 126.01 1ee1 s ASP 106 Ca 0.07 1.03 0.29 0.00 -0.52 0.00 0.00 52.55 53.42 1ee1 s ASP 106 Cb -0.15 -2.48 1.31 0.00 -1.46 0.00 0.00 42.92 40.14 1ee1 s ASP 106 CO -0.12 -0.68 1.90 2.30 0.52 0.00 0.00 175.17 179.09 1ee1 n ILE 107 N 5.51 0.00 -0.16 4.11 -5.35 -0.39 -4.45 119.36 118.64 1ee1 n ILE 107 Ca 0.08 -0.10 -0.03 0.00 -0.27 0.00 0.00 62.75 62.43 1ee1 n ILE 107 Cb 0.47 -0.02 0.06 0.00 -1.74 0.00 0.00 39.64 38.41 1ee1 n ILE 107 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1ee1 h LYS 108 N 0.90 0.36 -0.24 6.28 3.64 -1.90 -1.60 116.57 124.01 1ee1 h LYS 108 Ca 0.00 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 1ee1 h LYS 108 Cb 0.32 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1ee1 h LYS 108 CO 0.00 0.24 -0.27 0.66 -2.27 0.00 0.00 179.45 177.80 1ee1 h SER 109 N 0.37 0.47 -0.08 4.20 4.64 -1.98 0.89 113.55 122.06 1ee1 h SER 109 Ca 0.23 -0.16 -0.02 0.00 -0.47 0.00 0.00 61.79 61.37 1ee1 h SER 109 Cb 0.23 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1ee1 h SER 109 CO -0.23 0.73 -0.04 0.74 -0.87 0.00 0.00 176.83 177.16 1ee1 h THR 110 N 0.41 1.33 -0.55 2.95 2.02 -1.78 -0.98 112.91 116.30 1ee1 h THR 110 Ca 0.06 -1.07 -0.05 0.00 0.77 0.00 0.00 66.41 66.12 1ee1 h THR 110 Cb 0.69 1.87 -0.03 0.00 -1.74 0.00 0.00 68.15 68.94 1ee1 h THR 110 CO 0.05 0.30 0.13 0.58 0.37 0.00 0.00 175.52 176.95 1ee1 h VAL 111 N -0.20 1.23 -0.44 3.16 2.07 -1.08 -1.42 116.25 119.57 1ee1 h VAL 111 Ca 0.02 -0.83 -0.14 0.00 0.82 0.00 0.00 66.70 66.57 1ee1 h VAL 111 Cb 0.49 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1ee1 h VAL 111 CO 0.01 0.31 -0.29 0.28 0.02 0.00 0.00 177.57 177.90 1ee1 h SER 112 N 0.81 1.00 -0.56 0.57 0.02 -0.78 -0.06 113.55 114.56 1ee1 h SER 112 Ca 0.18 -0.41 -0.03 0.00 -0.84 0.00 0.00 61.79 60.69 1ee1 h SER 112 Cb 0.30 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 1ee1 h SER 112 CO -0.00 1.21 0.23 0.00 -1.14 0.00 0.00 176.83 177.13 1ee1 h ALA 113 N 0.85 0.72 0.58 3.77 0.00 -0.87 -1.04 119.26 123.26 1ee1 h ALA 113 Ca 0.09 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1ee1 h ALA 113 Cb 0.87 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.45 1ee1 h ALA 113 CO 0.08 0.32 -0.28 0.35 0.00 0.00 0.00 179.25 179.72 1ee1 h PHE 114 N 0.76 -0.72 -0.61 0.00 3.57 -1.07 -1.23 116.94 117.63 1ee1 h PHE 114 Ca 0.19 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.74 1ee1 h PHE 114 Cb 0.18 0.24 -0.06 0.00 2.79 0.00 0.00 35.95 39.10 1ee1 h PHE 114 CO 0.00 -0.42 0.29 0.77 -2.23 0.00 0.00 178.31 176.73 1ee1 h SER 115 N -0.85 0.38 -0.36 0.41 0.02 -0.94 0.13 113.55 112.35 1ee1 h SER 115 Ca -0.08 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1ee1 h SER 115 Cb 0.62 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.13 1ee1 h SER 115 CO 0.13 0.24 0.22 0.44 -1.14 0.00 0.00 176.83 176.72 1ee1 h ASP 116 N 0.53 0.43 -0.63 3.07 3.32 -1.14 -1.15 116.42 120.86 1ee1 h ASP 116 Ca 0.29 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.27 1ee1 h ASP 116 Cb 0.26 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 1ee1 h ASP 116 CO -0.23 0.35 0.31 -0.61 -1.72 0.00 0.00 179.24 177.34 1ee1 h GLN 117 N 0.47 0.93 0.03 3.56 5.75 -0.61 -0.70 115.11 124.54 1ee1 h GLN 117 Ca 0.13 -0.12 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1ee1 h GLN 117 Cb -0.00 -0.17 0.00 0.00 1.07 0.00 0.00 27.48 28.37 1ee1 h GLN 117 CO -0.02 0.72 -0.01 -0.92 -2.65 0.00 0.00 178.83 175.94 1ee1 h TYR 118 N 0.92 -0.03 -0.90 3.99 3.20 -0.16 0.12 116.97 124.11 1ee1 h TYR 118 Ca 0.23 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 1ee1 h TYR 118 Cb 0.11 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.34 1ee1 h TYR 118 CO 0.01 0.04 0.52 0.37 -1.64 0.00 0.00 178.16 177.46 1ee1 h GLN 119 N -0.10 1.24 -0.64 1.82 4.15 -0.91 -1.14 115.11 119.53 1ee1 h GLN 119 Ca -0.00 -0.13 -0.09 0.00 0.77 0.00 0.00 58.65 59.20 1ee1 h GLN 119 Cb 0.09 -0.25 -0.02 0.00 0.21 0.00 0.00 27.48 27.51 1ee1 h GLN 119 CO 0.01 0.89 0.07 0.37 -1.93 0.00 0.00 178.83 178.24 1ee1 h GLN 120 N 1.26 1.09 0.04 1.69 4.15 -0.80 0.20 115.11 122.74 1ee1 h GLN 120 Ca 0.32 -0.31 -0.23 0.00 0.77 0.00 0.00 58.65 59.20 1ee1 h GLN 120 Cb -0.01 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 1ee1 h GLN 120 CO -0.06 1.02 -1.06 0.93 -1.93 0.00 0.00 178.83 177.74 1ee1 h GLU 121 N 1.00 0.10 0.00 1.69 4.39 -0.45 -3.38 114.58 117.93 1ee1 h GLU 121 Ca 0.19 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1ee1 h GLU 121 Cb 0.48 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 1ee1 h GLU 121 CO 0.02 1.06 -1.14 0.25 -1.16 0.00 0.00 179.01 178.04 1ee1 n THR 122 N -3.44 0.00 -0.19 1.13 -2.24 -0.46 -4.98 114.28 104.10 1ee1 n THR 122 Ca -0.03 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 1ee1 n THR 122 Cb 0.95 0.46 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 1ee1 n THR 122 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ee1 n GLY 123 N 1.94 1.91 3.81 3.38 0.00 0.71 -5.00 105.19 111.93 1ee1 n GLY 123 Ca -0.01 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1ee1 n GLY 123 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ee1 s ASP 124 N -3.38 5.62 -0.14 1.61 1.01 -1.25 -4.99 116.67 115.15 1ee1 s ASP 124 Ca 0.00 -0.09 -0.06 0.00 0.71 0.00 0.00 52.55 53.11 1ee1 s ASP 124 Cb 0.00 -1.50 -0.04 0.00 1.01 0.00 0.00 42.92 42.39 1ee1 s ASP 124 CO 0.00 0.07 0.08 -1.58 0.21 0.00 0.00 175.17 173.96 1ee1 s GLN 125 N -3.08 3.55 0.36 8.23 0.74 -1.26 -3.12 119.66 125.08 1ee1 s GLN 125 Ca 0.31 -0.26 -0.28 0.00 0.05 0.00 0.00 55.36 55.18 1ee1 s GLN 125 Cb -0.10 -3.12 -0.11 0.00 1.10 0.00 0.00 33.01 30.77 1ee1 s GLN 125 CO 0.24 0.58 1.49 -0.51 -0.55 0.00 0.00 175.29 176.54 1ee1 s LEU 126 N -0.48 4.33 0.66 3.68 1.43 -1.26 -4.98 118.68 122.06 1ee1 s LEU 126 Ca 0.11 3.02 -0.12 0.00 -1.03 0.00 0.00 54.13 56.10 1ee1 s LEU 126 Cb -0.12 -3.66 -0.01 0.00 0.03 0.00 0.00 46.19 42.43 1ee1 s LEU 126 CO 0.02 -0.86 1.05 0.42 0.23 0.00 0.00 176.35 177.21 1ee1 s THR 127 N -0.98 4.06 0.23 5.49 -4.23 -1.26 -4.80 115.64 114.15 1ee1 s THR 127 Ca 0.54 0.74 -0.06 0.00 -1.18 0.00 0.00 61.69 61.73 1ee1 s THR 127 Cb -0.46 -3.44 0.19 0.00 1.34 0.00 0.00 72.50 70.13 1ee1 s THR 127 CO 0.61 -0.80 1.80 -0.78 -0.54 0.00 0.00 174.62 174.90 1ee1 h ASP 128 N -0.38 0.58 -0.33 3.99 3.58 -1.99 0.50 116.42 122.38 1ee1 h ASP 128 Ca -0.45 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.04 1ee1 h ASP 128 Cb 1.21 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 42.19 1ee1 h ASP 128 CO 0.57 0.34 0.16 0.15 -2.88 0.00 0.00 179.24 177.59 1ee1 h PHE 129 N 0.71 0.46 -0.21 0.28 3.57 -1.93 -1.12 116.94 118.70 1ee1 h PHE 129 Ca 0.37 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.74 1ee1 h PHE 129 Cb 0.35 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1ee1 h PHE 129 CO -0.08 0.40 -0.35 -0.91 -2.23 0.00 0.00 178.31 175.13 1ee1 h ASN 130 N 0.40 0.46 0.17 0.41 2.35 -1.73 -2.34 115.58 115.30 1ee1 h ASN 130 Ca 0.11 -0.18 -0.09 0.00 -0.55 0.00 0.00 56.30 55.59 1ee1 h ASN 130 Cb 0.10 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1ee1 h ASN 130 CO -0.02 0.78 -0.33 0.50 -1.65 0.00 0.00 177.43 176.72 1ee1 h LYS 131 N 0.38 0.25 -0.82 0.81 3.64 -0.75 -2.01 116.57 118.08 1ee1 h LYS 131 Ca 0.04 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1ee1 h LYS 131 Cb 0.80 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.57 1ee1 h LYS 131 CO 0.06 0.56 0.45 0.78 -2.27 0.00 0.00 179.45 179.03 1ee1 h GLY 132 N 1.09 1.22 2.00 5.01 0.00 -0.67 -1.16 103.07 110.56 1ee1 h GLY 132 Ca 0.03 -0.55 -0.11 0.00 0.00 0.00 0.00 47.33 46.70 1ee1 h GLY 132 CO 0.05 0.53 -0.54 3.43 0.00 0.00 0.00 176.54 180.01 1ee1 h ASN 133 N 1.15 0.00 -0.37 0.19 2.35 -1.09 -2.21 115.58 115.60 1ee1 h ASN 133 Ca 0.29 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.94 1ee1 h ASN 133 Cb 0.03 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 1ee1 h ASN 133 CO -0.05 0.54 -0.13 0.58 -1.65 0.00 0.00 177.43 176.73 1ee1 h VAL 134 N 0.00 1.26 -0.08 2.81 2.07 -0.59 -1.43 116.25 120.29 1ee1 h VAL 134 Ca -0.01 -1.22 -0.00 0.00 0.82 0.00 0.00 66.70 66.29 1ee1 h VAL 134 Cb 1.07 1.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1ee1 h VAL 134 CO 0.07 0.42 0.03 0.11 0.02 0.00 0.00 177.57 178.22 1ee1 h LYS 135 N 0.73 0.12 -0.88 1.57 1.57 -0.88 0.19 116.57 118.99 1ee1 h LYS 135 Ca 0.12 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1ee1 h LYS 135 Cb 0.63 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 32.88 1ee1 h LYS 135 CO 0.04 0.23 0.55 0.00 -0.57 0.00 0.00 179.45 179.71 1ee1 h ALA 136 N 0.88 1.12 0.00 3.86 0.00 -1.28 -0.79 119.26 123.05 1ee1 h ALA 136 Ca 0.03 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1ee1 h ALA 136 Cb 0.16 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1ee1 h ALA 136 CO -0.00 0.56 -0.53 0.00 0.00 0.00 0.00 179.25 179.28 1ee1 h ARG 137 N 1.21 0.00 -0.09 0.00 3.08 -1.03 -2.68 114.38 114.87 1ee1 h ARG 137 Ca 0.32 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.22 1ee1 h ARG 137 Cb -0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 1ee1 h ARG 137 CO -0.06 0.53 -0.59 1.15 -1.07 0.00 0.00 179.97 179.93 1ee1 h THR 138 N 0.00 1.37 -0.25 2.04 2.02 -0.03 -2.20 112.91 115.87 1ee1 h THR 138 Ca -0.01 -1.93 -0.09 0.00 0.77 0.00 0.00 66.41 65.15 1ee1 h THR 138 Cb 1.03 1.95 -0.01 0.00 -1.74 0.00 0.00 68.15 69.38 1ee1 h THR 138 CO 0.07 0.58 -0.25 0.03 0.37 0.00 0.00 175.52 176.31 1ee1 h ARG 139 N 0.22 0.47 -0.53 6.66 3.08 -0.89 -1.20 114.38 122.19 1ee1 h ARG 139 Ca -0.00 -0.17 -0.07 0.00 0.07 0.00 0.00 59.98 59.80 1ee1 h ARG 139 Cb 1.10 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 1ee1 h ARG 139 CO 0.09 0.68 0.04 1.98 -1.07 0.00 0.00 179.97 181.70 1ee1 h MET 140 N 0.41 0.90 -0.46 0.04 4.05 -1.17 -1.74 114.93 116.96 1ee1 h MET 140 Ca 0.06 -0.27 -0.01 0.00 -0.28 0.00 0.00 59.70 59.21 1ee1 h MET 140 Cb 0.66 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.35 1ee1 h MET 140 CO 0.05 0.91 0.26 0.82 0.23 0.00 0.00 176.91 179.18 1ee1 h ILE 141 N 0.78 1.16 -0.83 1.77 2.04 -1.00 -0.57 117.51 120.86 1ee1 h ILE 141 Ca 0.15 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1ee1 h ILE 141 Cb 0.47 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.09 1ee1 h ILE 141 CO 0.02 0.16 0.55 0.00 0.00 0.00 0.00 178.15 178.88 1ee1 h ALA 142 N 1.11 1.06 -0.34 1.87 0.00 -1.07 0.85 119.26 122.75 1ee1 h ALA 142 Ca 0.16 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.85 1ee1 h ALA 142 Cb 0.03 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.49 1ee1 h ALA 142 CO -0.03 0.45 -0.45 1.96 0.00 0.00 0.00 179.25 181.19 1ee1 h GLN 143 N 1.12 0.90 0.00 0.00 4.20 -0.90 -2.23 115.11 118.19 1ee1 h GLN 143 Ca 0.31 -0.51 -0.10 0.00 0.06 0.00 0.00 58.65 58.41 1ee1 h GLN 143 Cb -0.11 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1ee1 h GLN 143 CO -0.07 1.16 -0.45 1.88 -0.67 0.00 0.00 178.83 180.67 1ee1 h TYR 144 N 0.70 0.00 -0.22 2.96 -1.99 -0.86 0.66 116.97 118.22 1ee1 h TYR 144 Ca 0.04 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.73 1ee1 h TYR 144 Cb 1.05 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.77 1ee1 h TYR 144 CO 0.07 0.45 -0.03 0.00 -0.00 0.00 0.00 178.16 178.65 1ee1 h ALA 145 N 1.55 0.30 -0.33 3.88 0.00 -0.66 0.34 119.26 124.32 1ee1 h ALA 145 Ca -0.00 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 1ee1 h ALA 145 Cb 0.81 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1ee1 h ALA 145 CO 0.06 0.06 0.07 0.82 0.00 0.00 0.00 179.25 180.25 1ee1 h ILE 146 N 0.14 1.23 -0.75 0.00 2.04 -1.27 0.04 117.51 118.94 1ee1 h ILE 146 Ca 0.06 -0.78 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 1ee1 h ILE 146 Cb 0.47 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 1ee1 h ILE 146 CO 0.02 0.26 0.44 1.23 0.00 0.00 0.00 178.15 180.10 1ee1 h GLY 147 N 0.38 1.10 1.59 5.37 0.00 -0.72 -0.96 103.07 109.82 1ee1 h GLY 147 Ca 0.10 -0.47 -0.13 0.00 0.00 0.00 0.00 47.33 46.83 1ee1 h GLY 147 CO 0.00 0.46 -0.41 -1.33 0.00 0.00 0.00 176.54 175.26 1ee1 h GLY 148 N 1.03 0.50 1.35 4.60 0.00 -0.11 0.25 103.07 110.69 1ee1 h GLY 148 Ca 0.27 -0.49 -0.17 0.00 0.00 0.00 0.00 47.33 46.93 1ee1 h GLY 148 CO -0.05 0.45 -0.55 1.46 0.00 0.00 0.00 176.54 177.85 1ee1 h GLN 149 N 0.38 0.68 -0.02 4.80 1.08 -0.66 -3.33 115.11 118.05 1ee1 h GLN 149 Ca 0.03 -0.43 0.00 0.00 -1.45 0.00 0.00 58.65 56.80 1ee1 h GLN 149 Cb 0.88 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.36 1ee1 h GLN 149 CO 0.07 1.05 -0.21 0.39 -0.95 0.00 0.00 178.83 179.18 1ee1 n GLU 150 N -3.98 1.58 -2.65 1.46 -0.58 -0.39 -5.00 120.64 111.07 1ee1 n GLU 150 Ca -0.04 -1.15 -0.05 0.00 -0.42 0.00 0.00 57.16 55.50 1ee1 n GLU 150 Cb 0.61 -1.33 0.02 0.00 -0.57 0.00 0.00 31.44 30.17 1ee1 n GLU 150 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ee1 n GLY 151 N 1.13 0.53 3.52 0.62 0.00 0.70 -4.86 105.19 106.84 1ee1 n GLY 151 Ca 0.09 -0.50 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 1ee1 n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ee1 s LEU 152 N -2.30 2.76 0.11 0.99 1.43 -0.08 -1.21 118.68 120.39 1ee1 s LEU 152 Ca 0.11 -0.85 -0.08 0.00 -1.03 0.00 0.00 54.13 52.29 1ee1 s LEU 152 Cb -0.05 -1.33 -0.06 0.00 0.03 0.00 0.00 46.19 44.78 1ee1 s LEU 152 CO 0.14 0.05 0.40 -0.76 0.23 0.00 0.00 176.35 176.41 1ee1 s LEU 153 N -3.33 4.30 -0.24 1.79 1.43 0.21 -4.50 118.68 118.34 1ee1 s LEU 153 Ca 0.28 0.71 -0.17 0.00 -1.03 0.00 0.00 54.13 53.92 1ee1 s LEU 153 Cb -0.06 -3.16 -0.03 0.00 0.03 0.00 0.00 46.19 42.97 1ee1 s LEU 153 CO 0.15 0.11 0.48 -0.69 0.23 0.00 0.00 176.35 176.63 1ee1 s VAL 154 N -1.53 5.11 0.25 -1.59 1.01 -1.26 -1.03 120.40 121.36 1ee1 s VAL 154 Ca 0.37 0.82 -0.19 0.00 0.00 0.00 0.00 61.98 62.99 1ee1 s VAL 154 Cb -0.13 -3.80 -0.08 0.00 0.00 0.00 0.00 36.38 32.37 1ee1 s VAL 154 CO 0.21 0.14 0.74 -0.76 0.00 0.00 0.00 175.10 175.42 1ee1 s LEU 155 N 2.00 4.28 0.17 3.92 1.43 -0.86 0.19 118.68 129.81 1ee1 s LEU 155 Ca 0.21 1.40 0.08 0.00 -1.03 0.00 0.00 54.13 54.79 1ee1 s LEU 155 Cb -0.15 -3.72 -0.04 0.00 0.03 0.00 0.00 46.19 42.31 1ee1 s LEU 155 CO 0.09 -0.03 -0.07 -0.83 0.23 0.00 0.00 176.35 175.75 1ee1 s GLY 156 N -1.79 1.74 0.00 -3.19 0.00 -0.09 -4.81 107.32 99.17 1ee1 s GLY 156 Ca 0.46 -1.42 0.18 0.00 0.00 0.00 0.00 44.72 43.94 1ee1 s GLY 156 CO 0.20 -1.43 1.29 -1.30 0.00 0.00 0.00 173.10 171.86 1ee1 n THR 157 N 0.06 0.57 -1.68 0.90 -2.24 -1.26 -4.23 114.28 106.40 1ee1 n THR 157 Ca -0.11 -0.79 -0.44 0.00 -2.27 0.00 0.00 64.05 60.45 1ee1 n THR 157 Cb 0.55 0.88 -0.02 0.00 -2.10 0.00 0.00 70.33 69.64 1ee1 n THR 157 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1ee1 n ASP 158 N 1.15 2.75 -3.87 3.42 2.03 -1.26 -4.84 116.55 115.93 1ee1 n ASP 158 Ca 0.16 1.17 -0.15 0.00 0.52 0.00 0.00 54.79 56.49 1ee1 n ASP 158 Cb 0.51 -1.45 -0.09 0.00 -0.72 0.00 0.00 41.12 39.37 1ee1 n ASP 158 CO 0.00 0.00 0.00 -1.38 -1.92 0.00 0.00 177.20 173.90 1ee1 s HIS 159 N -0.53 1.34 0.26 -0.67 -3.43 -1.26 -3.55 115.29 107.45 1ee1 s HIS 159 Ca 0.62 -1.46 -0.03 0.00 -0.80 0.00 0.00 55.06 53.39 1ee1 s HIS 159 Cb -0.61 -0.57 0.37 0.00 -1.43 0.00 0.00 32.58 30.33 1ee1 s HIS 159 CO 0.55 -0.75 1.90 0.00 -2.00 0.00 0.00 174.74 174.44 1ee1 h ALA 160 N 2.42 1.37 0.00 -1.38 0.00 -1.52 -0.43 119.26 119.72 1ee1 h ALA 160 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ee1 h ALA 160 Cb 1.24 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1ee1 h ALA 160 CO 0.46 0.51 0.00 0.00 0.00 0.00 0.00 179.25 180.23 1ee1 h ALA 161 N 1.43 1.00 0.00 0.00 0.00 -1.89 -0.91 119.26 118.89 1ee1 h ALA 161 Ca 0.41 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.28 1ee1 h ALA 161 Cb 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1ee1 h ALA 161 CO -0.14 0.00 -1.60 -0.85 0.00 0.00 0.00 179.25 176.66 1ee1 n GLU 162 N -2.94 0.72 -0.01 0.00 0.28 -0.87 -4.41 120.64 113.41 1ee1 n GLU 162 Ca -0.01 -0.09 -0.11 0.00 -0.16 0.00 0.00 57.16 56.79 1ee1 n GLU 162 Cb 0.16 -1.29 0.03 0.00 1.43 0.00 0.00 31.44 31.77 1ee1 n GLU 162 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1ee1 h ALA 163 N 1.01 0.64 -0.06 -1.84 0.00 -0.78 -0.43 119.26 117.81 1ee1 h ALA 163 Ca -0.06 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 1ee1 h ALA 163 Cb 0.78 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1ee1 h ALA 163 CO 0.00 0.69 -0.08 -0.24 0.00 0.00 0.00 179.25 179.63 1ee1 h VAL 164 N 0.46 1.09 -0.02 0.00 3.04 -1.38 -2.38 116.25 117.05 1ee1 h VAL 164 Ca 0.01 -0.41 0.00 0.00 -1.01 0.00 0.00 66.70 65.29 1ee1 h VAL 164 Cb 1.12 1.14 0.00 0.00 -2.01 0.00 0.00 31.29 31.54 1ee1 h VAL 164 CO 0.11 0.12 -0.06 0.35 -1.01 0.00 0.00 177.57 177.08 1ee1 n THR 165 N -4.40 0.00 -2.54 3.17 -2.24 -1.18 -3.62 114.28 103.47 1ee1 n THR 165 Ca -0.02 -0.47 -0.20 0.00 -2.27 0.00 0.00 64.05 61.09 1ee1 n THR 165 Cb 0.18 1.41 -0.00 0.00 -2.10 0.00 0.00 70.33 69.82 1ee1 n THR 165 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ee1 n GLY 166 N 1.20 -0.50 2.47 3.38 0.00 -0.72 -4.85 105.19 106.17 1ee1 n GLY 166 Ca 0.12 0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1ee1 n GLY 166 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1ee1 n PHE 167 N -4.05 2.76 -3.45 1.61 7.35 -0.25 -4.79 117.46 116.65 1ee1 n PHE 167 Ca -0.21 -3.02 -0.11 0.00 -0.76 0.00 0.00 57.45 53.35 1ee1 n PHE 167 Cb 0.67 -2.42 -0.02 0.00 0.35 0.00 0.00 39.48 38.06 1ee1 n PHE 167 CO 0.00 0.00 0.00 -0.59 -0.76 0.00 0.00 176.76 175.41 1ee1 s PHE 168 N 2.02 -0.49 -0.15 -5.13 -0.12 -1.26 -4.95 117.98 107.90 1ee1 s PHE 168 Ca 0.61 0.29 -0.23 0.00 -0.05 0.00 0.00 56.93 57.55 1ee1 s PHE 168 Cb 0.17 0.56 -0.02 0.00 -0.63 0.00 0.00 43.02 43.09 1ee1 s PHE 168 CO -0.07 -0.80 0.73 0.99 -0.05 0.00 0.00 175.22 176.02 1ee1 s THR 169 N -3.63 4.97 -0.06 -4.49 2.01 -1.26 -4.93 115.64 108.26 1ee1 s THR 169 Ca 0.02 1.44 -0.31 0.00 0.31 0.00 0.00 61.69 63.15 1ee1 s THR 169 Cb -0.01 -4.05 -0.09 0.00 0.01 0.00 0.00 72.50 68.36 1ee1 s THR 169 CO -0.12 0.12 2.00 1.17 -0.69 0.00 0.00 174.62 177.10 1ee1 n LYS 170 N 4.73 2.44 -1.21 4.92 4.81 -1.26 -0.84 118.16 131.75 1ee1 n LYS 170 Ca 0.01 0.86 -0.07 0.00 -0.87 0.00 0.00 58.31 58.24 1ee1 n LYS 170 Cb 0.50 -2.91 -0.03 0.00 0.02 0.00 0.00 35.03 32.60 1ee1 n LYS 170 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1ee1 n TYR 171 N 8.05 0.00 0.00 5.64 0.53 -1.26 -4.91 117.16 125.21 1ee1 n TYR 171 Ca 0.23 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 57.11 1ee1 n TYR 171 Cb 0.37 -1.75 0.00 0.00 -1.03 0.00 0.00 39.34 36.93 1ee1 n TYR 171 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1ee1 n GLY 172 N -1.27 0.77 0.16 2.72 0.00 -0.02 -4.53 105.19 103.02 1ee1 n GLY 172 Ca -0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.08 1ee1 n GLY 172 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1ee1 h ASP 173 N 0.00 0.00 1.19 1.61 -0.00 -1.68 -0.54 116.42 116.99 1ee1 h ASP 173 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 1ee1 h ASP 173 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 1ee1 h ASP 173 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.85 1ee1 n GLY 174 N -0.09 -1.55 3.53 7.15 0.00 -0.88 -4.63 105.19 108.72 1ee1 n GLY 174 Ca 0.02 -0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1ee1 n GLY 174 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ee1 s GLY 175 N -3.40 1.56 0.26 -0.02 0.00 -0.21 -4.69 107.32 100.82 1ee1 s GLY 175 Ca 0.10 -1.11 -0.12 0.00 0.00 0.00 0.00 44.72 43.60 1ee1 s GLY 175 CO 0.53 1.83 0.48 0.00 0.00 0.00 0.00 173.10 175.94 1ee1 s ALA 176 N 3.41 -0.13 -0.16 3.20 0.00 -1.26 -4.88 121.76 121.94 1ee1 s ALA 176 Ca 0.29 -0.96 -0.03 0.00 0.00 0.00 0.00 51.96 51.26 1ee1 s ALA 176 Cb -0.13 1.07 -0.24 0.00 0.00 0.00 0.00 23.12 23.83 1ee1 s ALA 176 CO 0.21 -0.85 0.21 -0.25 0.00 0.00 0.00 175.76 175.09 1ee1 n ASP 177 N -0.52 2.00 -3.83 0.00 8.00 0.13 -4.95 116.55 117.38 1ee1 n ASP 177 Ca -0.01 0.12 -0.11 0.00 0.71 0.00 0.00 54.79 55.49 1ee1 n ASP 177 Cb 0.62 -0.68 -0.09 0.00 -0.02 0.00 0.00 41.12 40.95 1ee1 n ASP 177 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 1ee1 s LEU 178 N -6.84 1.27 -0.34 0.64 0.05 -1.11 -5.02 118.68 107.34 1ee1 s LEU 178 Ca -0.25 -0.20 0.03 0.00 0.05 0.00 0.00 54.13 53.76 1ee1 s LEU 178 Cb 0.07 0.97 0.10 0.00 -2.05 0.00 0.00 46.19 45.29 1ee1 s LEU 178 CO 0.73 -0.48 0.07 -0.76 -0.55 0.00 0.00 176.35 175.36 1ee1 s LEU 179 N -1.69 4.14 0.46 1.48 1.43 -1.26 -0.91 118.68 122.33 1ee1 s LEU 179 Ca -0.10 -2.07 0.26 0.00 -1.03 0.00 0.00 54.13 51.19 1ee1 s LEU 179 Cb -0.04 -1.44 0.96 0.00 0.03 0.00 0.00 46.19 45.69 1ee1 s LEU 179 CO -0.00 -0.38 1.84 1.55 0.23 0.00 0.00 176.35 179.58 1ee1 h PRO 180 N 7.68 0.00 -0.37 1.29 0.13 -1.89 -3.25 132.00 135.60 1ee1 h PRO 180 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1ee1 h PRO 180 Cb 1.01 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1ee1 h PRO 180 CO 0.51 0.17 0.00 1.28 -0.23 0.00 0.00 178.00 179.73 1ee1 n LEU 181 N -3.29 2.54 -4.63 1.56 4.77 -1.26 -4.89 117.00 111.79 1ee1 n LEU 181 Ca 0.01 -1.16 -0.47 0.00 -0.03 0.00 0.00 56.01 54.35 1ee1 n LEU 181 Cb 0.42 -0.24 -0.04 0.00 -2.33 0.00 0.00 43.42 41.23 1ee1 n LEU 181 CO 0.32 0.58 0.97 0.41 -1.33 0.00 0.00 177.39 178.34 1ee1 n THR 182 N 0.88 0.52 0.00 -5.08 -1.04 -1.23 -2.14 114.28 106.20 1ee1 n THR 182 Ca 0.17 -0.13 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1ee1 n THR 182 Cb 0.44 -1.22 0.00 0.00 -1.82 0.00 0.00 70.33 67.73 1ee1 n THR 182 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ee1 n GLY 183 N 2.50 2.13 3.74 3.41 0.00 -1.19 -4.89 105.19 110.89 1ee1 n GLY 183 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1ee1 n GLY 183 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ee1 s LEU 184 N 0.00 4.48 0.84 0.99 1.43 -0.91 -4.07 118.68 121.44 1ee1 s LEU 184 Ca 0.00 1.59 -0.11 0.00 -1.03 0.00 0.00 54.13 54.58 1ee1 s LEU 184 Cb 0.00 -3.37 0.13 0.00 0.03 0.00 0.00 46.19 42.98 1ee1 s LEU 184 CO 0.00 0.00 1.18 0.42 0.23 0.00 0.00 176.35 178.19 1ee1 s THR 185 N -0.14 2.07 0.14 5.49 -4.23 -1.26 -1.63 115.64 116.09 1ee1 s THR 185 Ca 0.41 -0.11 -0.14 0.00 -1.18 0.00 0.00 61.69 60.67 1ee1 s THR 185 Cb -0.22 -2.96 0.01 0.00 1.34 0.00 0.00 72.50 70.68 1ee1 s THR 185 CO 0.26 0.00 1.64 0.50 -0.54 0.00 0.00 174.62 176.48 1ee1 h LYS 186 N -1.13 0.74 -0.01 3.99 1.63 -1.95 -1.45 116.57 118.39 1ee1 h LYS 186 Ca -0.44 -0.18 -0.13 0.00 -0.85 0.00 0.00 60.65 59.05 1ee1 h LYS 186 Cb 1.28 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.80 1ee1 h LYS 186 CO 0.52 0.74 -0.59 0.07 -3.45 0.00 0.00 179.45 176.74 1ee1 h ARG 187 N 0.62 0.05 -0.28 1.90 0.11 -1.94 -1.96 114.38 112.87 1ee1 h ARG 187 Ca 0.14 -0.03 -0.13 0.00 0.10 0.00 0.00 59.98 60.06 1ee1 h ARG 187 Cb 0.34 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.41 1ee1 h ARG 187 CO 0.00 0.62 -0.35 1.96 0.10 0.00 0.00 179.97 182.30 1ee1 h GLN 188 N 0.03 0.61 -0.53 0.08 4.20 -1.90 -1.02 115.11 116.59 1ee1 h GLN 188 Ca -0.01 -0.29 -0.03 0.00 0.06 0.00 0.00 58.65 58.38 1ee1 h GLN 188 Cb 1.04 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.80 1ee1 h GLN 188 CO 0.08 0.88 0.20 0.78 -0.67 0.00 0.00 178.83 180.10 1ee1 h GLY 189 N 1.02 0.86 1.01 3.46 0.00 -0.98 -1.19 103.07 107.24 1ee1 h GLY 189 Ca 0.05 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 46.90 1ee1 h GLY 189 CO 0.07 0.45 0.44 -0.09 0.00 0.00 0.00 176.54 177.41 1ee1 h ARG 190 N 0.72 1.02 -0.91 4.80 2.43 -1.23 -1.34 114.38 119.87 1ee1 h ARG 190 Ca 0.17 -0.10 0.02 0.00 -0.81 0.00 0.00 59.98 59.26 1ee1 h ARG 190 Cb 0.22 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 29.51 1ee1 h ARG 190 CO -0.01 0.73 0.60 1.15 -1.51 0.00 0.00 179.97 180.93 1ee1 h THR 191 N 1.02 1.21 -0.40 0.20 2.02 -0.56 -0.54 112.91 115.86 1ee1 h THR 191 Ca 0.27 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 66.97 1ee1 h THR 191 Cb -0.01 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.28 1ee1 h THR 191 CO -0.05 0.22 0.02 -0.07 0.37 0.00 0.00 175.52 176.01 1ee1 h LEU 192 N 1.21 0.68 -1.11 2.58 4.07 -0.56 -1.64 115.31 120.54 1ee1 h LEU 192 Ca 0.34 -0.29 -0.03 0.00 0.08 0.00 0.00 57.88 57.98 1ee1 h LEU 192 Cb -0.10 -0.18 -0.03 0.00 1.08 0.00 0.00 40.66 41.43 1ee1 h LEU 192 CO -0.08 0.80 0.27 -0.07 -1.08 0.00 0.00 178.44 178.27 1ee1 h LEU 193 N 0.53 0.82 -0.48 1.67 3.38 -0.71 -0.03 115.31 120.49 1ee1 h LEU 193 Ca 0.12 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1ee1 h LEU 193 Cb 0.44 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1ee1 h LEU 193 CO 0.02 0.72 0.07 0.11 0.09 0.00 0.00 178.44 179.44 1ee1 h LYS 194 N 0.89 0.80 -0.88 1.13 1.57 -0.97 -0.65 116.57 118.46 1ee1 h LYS 194 Ca 0.21 -0.22 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1ee1 h LYS 194 Cb 0.15 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.32 1ee1 h LYS 194 CO -0.02 0.81 0.58 0.93 -0.57 0.00 0.00 179.45 181.18 1ee1 h GLU 195 N 0.66 1.15 0.00 3.15 4.39 -0.58 -1.87 114.58 121.48 1ee1 h GLU 195 Ca 0.14 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.77 1ee1 h GLU 195 Cb 0.40 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1ee1 h GLU 195 CO 0.01 0.76 0.00 1.28 -1.16 0.00 0.00 179.01 179.90 1ee1 n LEU 196 N -4.41 0.00 0.00 1.33 4.77 -0.09 -4.91 117.00 113.69 1ee1 n LEU 196 Ca 0.10 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 1ee1 n LEU 196 Cb 0.03 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 1ee1 n LEU 196 CO 0.36 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1ee1 n GLY 197 N 0.88 0.51 3.77 -0.72 0.00 -0.70 -5.05 105.19 103.88 1ee1 n GLY 197 Ca 0.06 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.89 1ee1 n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ee1 s ALA 198 N -2.00 2.92 0.25 4.61 0.00 -0.32 -4.97 121.76 122.26 1ee1 s ALA 198 Ca 0.00 0.85 -0.31 0.00 0.00 0.00 0.00 51.96 52.51 1ee1 s ALA 198 Cb 0.00 -3.35 -0.11 0.00 0.00 0.00 0.00 23.12 19.66 1ee1 s ALA 198 CO 0.00 -0.59 1.60 -2.14 0.00 0.00 0.00 175.76 174.63 1ee1 s PRO 199 N -2.84 4.15 0.49 0.00 0.02 -1.26 -4.83 135.00 130.73 1ee1 s PRO 199 Ca 0.65 2.53 0.21 0.00 0.02 0.00 0.00 61.00 64.41 1ee1 s PRO 199 Cb -0.26 -3.06 1.26 0.00 0.02 0.00 0.00 34.50 32.46 1ee1 s PRO 199 CO 0.31 -0.63 1.98 1.05 -0.33 0.00 0.00 177.00 179.38 1ee1 h GLU 200 N 5.52 0.15 -0.98 5.54 4.11 -1.98 -1.98 114.58 124.96 1ee1 h GLU 200 Ca -0.45 -0.01 0.14 0.00 0.07 0.00 0.00 59.36 59.11 1ee1 h GLU 200 Cb 1.21 -0.03 -0.09 0.00 0.50 0.00 0.00 28.75 30.34 1ee1 h GLU 200 CO 0.84 0.10 0.61 -0.09 0.07 0.00 0.00 179.01 180.55 1ee1 h ARG 201 N 0.15 0.83 0.00 1.06 9.65 -1.98 0.19 114.38 124.29 1ee1 h ARG 201 Ca 0.27 -0.05 -0.05 0.00 -1.10 0.00 0.00 59.98 59.05 1ee1 h ARG 201 Cb 0.87 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 29.25 1ee1 h ARG 201 CO -0.04 0.55 -0.26 -0.07 2.80 0.00 0.00 179.97 182.95 1ee1 h LEU 202 N 0.86 0.00 -0.33 3.80 3.38 -1.69 -2.66 115.31 118.67 1ee1 h LEU 202 Ca 0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.47 1ee1 h LEU 202 Cb 0.66 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1ee1 h LEU 202 CO -0.27 0.26 -0.41 0.00 0.09 0.00 0.00 178.44 178.10 1ee1 n TYR 203 N -3.88 0.00 0.06 1.13 0.18 -0.65 -3.27 117.16 110.74 1ee1 n TYR 203 Ca -0.02 0.00 0.04 0.00 1.88 0.00 0.00 57.90 59.80 1ee1 n TYR 203 Cb 0.34 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 39.25 1ee1 n TYR 203 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1ee1 h LEU 204 N 0.55 0.00-10.27 -3.48 3.38 -0.51 -3.48 115.31 101.51 1ee1 h LEU 204 Ca 0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1ee1 h LEU 204 Cb 0.32 0.00 0.17 0.00 0.09 0.00 0.00 40.66 41.25 1ee1 h LEU 204 CO 0.00 0.40 0.28 -1.59 0.09 0.00 0.00 178.44 177.62 1ee1 s LYS 205 N -3.05 1.52 0.02 1.13 -2.85 -1.02 -4.96 119.74 110.52 1ee1 s LYS 205 Ca -0.02 1.49 -0.30 0.00 -1.00 0.00 0.00 55.97 56.14 1ee1 s LYS 205 Cb 0.09 -1.79 -0.04 0.00 -2.06 0.00 0.00 37.83 34.03 1ee1 s LYS 205 CO 0.80 -2.25 1.11 -1.21 0.10 0.00 0.00 175.35 173.90 1ee1 s GLU 206 N -4.59 4.47 0.29 1.78 0.41 -1.26 -4.98 118.70 114.82 1ee1 s GLU 206 Ca 0.67 1.61 -0.30 0.00 -0.41 0.00 0.00 54.97 56.54 1ee1 s GLU 206 Cb -0.22 -3.42 -0.11 0.00 -1.78 0.00 0.00 34.13 28.60 1ee1 s GLU 206 CO 0.55 -0.20 1.57 -2.14 -0.49 0.00 0.00 175.26 174.55 1ee1 s PRO 207 N 1.20 4.14 -0.02 0.39 0.02 -1.26 -4.92 135.00 134.54 1ee1 s PRO 207 Ca 0.55 2.54 -0.10 0.00 0.02 0.00 0.00 61.00 64.01 1ee1 s PRO 207 Cb -0.25 -3.03 0.01 0.00 0.02 0.00 0.00 34.50 31.25 1ee1 s PRO 207 CO 0.28 -0.60 0.22 -0.08 -0.33 0.00 0.00 177.00 176.49 1ee1 s THR 208 N -0.05 0.06 -0.03 0.99 -1.32 -1.26 -1.17 115.64 112.85 1ee1 s THR 208 Ca 0.62 -0.50 -0.06 0.00 -1.21 0.00 0.00 61.69 60.55 1ee1 s THR 208 Cb -0.47 -0.49 -0.29 0.00 -1.51 0.00 0.00 72.50 69.74 1ee1 s THR 208 CO 0.48 -0.27 0.71 0.00 -2.21 0.00 0.00 174.62 173.33 1ee1 h ALA 209 N 4.35 0.27 -6.09 11.08 0.00 -1.94 -3.48 119.26 123.44 1ee1 h ALA 209 Ca -0.30 -1.17 -0.42 0.00 0.00 0.00 0.00 54.91 53.02 1ee1 h ALA 209 Cb 1.19 0.41 0.05 0.00 0.00 0.00 0.00 17.79 19.44 1ee1 h ALA 209 CO 0.39 1.13 -0.82 -3.47 0.00 0.00 0.00 179.25 176.49 1ee1 n ASP 210 N -3.49 -1.73 -0.08 0.00 2.03 -1.26 -4.93 116.55 107.08 1ee1 n ASP 210 Ca -0.22 -0.80 0.08 0.00 0.52 0.00 0.00 54.79 54.37 1ee1 n ASP 210 Cb 1.06 -4.10 -0.07 0.00 -0.72 0.00 0.00 41.12 37.29 1ee1 n ASP 210 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1ee1 n LEU 211 N -4.33 0.94 -4.86 -2.67 4.77 -1.26 -4.74 117.00 104.85 1ee1 n LEU 211 Ca -0.25 -0.56 -0.37 0.00 -0.03 0.00 0.00 56.01 54.80 1ee1 n LEU 211 Cb 0.66 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.69 1ee1 n LEU 211 CO 0.69 0.21 -0.13 -0.76 -1.33 0.00 0.00 177.39 176.07 1ee1 s LEU 212 N -2.59 4.38 0.11 2.23 1.43 -1.26 -4.08 118.68 118.90 1ee1 s LEU 212 Ca 0.08 0.52 -0.06 0.00 -1.03 0.00 0.00 54.13 53.64 1ee1 s LEU 212 Cb 0.12 -2.15 -0.17 0.00 0.03 0.00 0.00 46.19 44.02 1ee1 s LEU 212 CO 0.59 0.37 1.24 0.44 0.23 0.00 0.00 176.35 179.22 1ee1 h ASP 213 N 5.12 0.55 -0.20 2.29 3.32 -1.94 -2.80 116.42 122.77 1ee1 h ASP 213 Ca -0.53 -0.48 -0.20 0.00 0.02 0.00 0.00 57.03 55.84 1ee1 h ASP 213 Cb 1.22 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.60 1ee1 h ASP 213 CO 0.60 1.31 -0.63 -0.08 -1.72 0.00 0.00 179.24 178.72 1ee1 h GLU 214 N 0.19 0.81 -2.21 3.56 4.81 -1.95 -3.37 114.58 116.43 1ee1 h GLU 214 Ca -0.11 -0.57 -0.59 0.00 -0.13 0.00 0.00 59.36 57.97 1ee1 h GLU 214 Cb 1.72 0.09 -0.41 0.00 0.63 0.00 0.00 28.75 30.79 1ee1 h GLU 214 CO 0.18 1.19 -0.82 1.63 -0.73 0.00 0.00 179.01 180.46 1ee1 n LYS 215 N -3.97 1.57 -1.97 1.92 5.02 -1.24 -5.11 118.16 114.37 1ee1 n LYS 215 Ca -0.05 -3.97 -0.37 0.00 -2.02 0.00 0.00 58.31 51.90 1ee1 n LYS 215 Cb 0.67 -1.80 0.03 0.00 -0.02 0.00 0.00 35.03 33.91 1ee1 n LYS 215 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ee1 s PRO 216 N -1.68 3.17 -1.67 1.97 0.04 -1.05 -2.94 135.00 132.84 1ee1 s PRO 216 Ca 0.36 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.37 1ee1 s PRO 216 Cb 0.13 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.54 1ee1 s PRO 216 CO -0.08 -1.08 0.00 1.04 0.04 0.00 0.00 177.00 176.92 1ee1 n GLN 217 N -1.18 -1.23 -1.90 4.56 1.13 -1.26 -4.94 117.38 112.56 1ee1 n GLN 217 Ca 0.11 1.00 -0.42 0.00 -1.94 0.00 0.00 57.00 55.75 1ee1 n GLN 217 Cb 0.48 -5.29 -0.03 0.00 0.11 0.00 0.00 30.24 25.51 1ee1 n GLN 217 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1ee1 s GLN 218 N -3.89 4.20 0.49 -1.09 0.74 -1.15 -4.92 119.66 114.03 1ee1 s GLN 218 Ca 0.00 2.38 -0.22 0.00 0.05 0.00 0.00 55.36 57.57 1ee1 s GLN 218 Cb 0.00 -3.40 -0.07 0.00 1.10 0.00 0.00 33.01 30.65 1ee1 s GLN 218 CO 0.00 -0.69 1.19 -1.54 -0.55 0.00 0.00 175.29 173.70 1ee1 s SER 219 N 1.87 5.95 0.16 6.67 1.04 -1.26 -4.04 113.70 124.09 1ee1 s SER 219 Ca 0.73 2.36 -0.16 0.00 0.48 0.00 0.00 55.95 59.36 1ee1 s SER 219 Cb -0.42 -2.60 0.06 0.00 0.10 0.00 0.00 66.02 63.15 1ee1 s SER 219 CO 0.32 -1.07 1.75 0.44 0.98 0.00 0.00 173.24 175.66 1ee1 h ASP 220 N 1.82 0.12 -0.69 7.02 3.32 -1.50 -1.54 116.42 124.97 1ee1 h ASP 220 Ca -0.50 0.04 0.12 0.00 0.02 0.00 0.00 57.03 56.72 1ee1 h ASP 220 Cb 1.26 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.80 1ee1 h ASP 220 CO 0.59 0.10 0.46 -0.33 -1.72 0.00 0.00 179.24 178.34 1ee1 h GLU 221 N 0.26 0.41 0.00 3.56 5.08 -1.82 0.15 114.58 122.22 1ee1 h GLU 221 Ca 0.16 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1ee1 h GLU 221 Cb 0.15 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1ee1 h GLU 221 CO -0.18 0.27 -0.00 1.15 -1.00 0.00 0.00 179.01 179.25 1ee1 h THR 222 N 0.42 1.03 -0.19 1.13 2.02 -1.62 0.11 112.91 115.81 1ee1 h THR 222 Ca 0.33 -0.10 -0.19 0.00 0.77 0.00 0.00 66.41 67.21 1ee1 h THR 222 Cb 0.70 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 1ee1 h THR 222 CO -0.10 0.03 -0.64 -0.08 0.37 0.00 0.00 175.52 175.10 1ee1 h GLU 223 N -0.05 0.69 -0.01 6.66 4.81 -1.01 -3.36 114.58 122.31 1ee1 h GLU 223 Ca -0.00 -0.49 -0.21 0.00 -0.13 0.00 0.00 59.36 58.53 1ee1 h GLU 223 Cb 0.05 0.08 0.02 0.00 0.63 0.00 0.00 28.75 29.52 1ee1 h GLU 223 CO 0.00 1.11 -0.82 -0.07 -0.73 0.00 0.00 179.01 178.50 1ee1 h LEU 224 N 0.51 0.74 0.00 1.64 3.38 -0.64 -3.48 115.31 117.46 1ee1 h LEU 224 Ca -0.01 -0.74 0.00 0.00 0.09 0.00 0.00 57.88 57.22 1ee1 h LEU 224 Cb 1.23 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1ee1 h LEU 224 CO 0.13 1.38 0.00 0.61 0.09 0.00 0.00 178.44 180.65 1ee1 n GLY 225 N 1.04 0.66 3.01 0.83 0.00 0.37 -5.02 105.19 106.08 1ee1 n GLY 225 Ca -0.10 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.80 1ee1 n GLY 225 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ee1 s ILE 226 N -2.24 0.32 0.44 -0.61 1.01 -1.26 -5.10 121.20 113.77 1ee1 s ILE 226 Ca 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 60.65 59.71 1ee1 s ILE 226 Cb 0.00 -0.41 -0.04 0.00 0.01 0.00 0.00 42.46 42.02 1ee1 s ILE 226 CO 0.00 -0.38 0.73 -0.94 0.00 0.00 0.00 174.94 174.35 1ee1 s SER 227 N -1.36 6.28 0.50 3.58 1.04 -1.26 -4.59 113.70 117.90 1ee1 s SER 227 Ca -0.11 0.83 0.24 0.00 0.48 0.00 0.00 55.95 57.39 1ee1 s SER 227 Cb -0.09 -2.20 1.32 0.00 0.10 0.00 0.00 66.02 65.15 1ee1 s SER 227 CO -0.00 -0.50 2.04 1.88 0.98 0.00 0.00 173.24 177.64 1ee1 h TYR 228 N 0.42 0.00 -0.21 5.02 -1.99 -1.99 -1.83 116.97 116.39 1ee1 h TYR 228 Ca -0.48 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.11 1ee1 h TYR 228 Cb 1.21 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.93 1ee1 h TYR 228 CO 0.57 0.15 -0.48 -0.44 -0.00 0.00 0.00 178.16 177.95 1ee1 h ASP 229 N 0.00 0.60 -0.08 3.88 3.45 -1.99 0.48 116.42 122.77 1ee1 h ASP 229 Ca -0.00 -0.30 -0.20 0.00 0.43 0.00 0.00 57.03 56.96 1ee1 h ASP 229 Cb 0.35 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.95 1ee1 h ASP 229 CO 0.02 0.99 -0.69 -0.33 -1.57 0.00 0.00 179.24 177.66 1ee1 h GLU 230 N 0.44 0.71 -0.39 3.56 5.08 -1.80 -1.61 114.58 120.57 1ee1 h GLU 230 Ca 0.02 -0.53 -0.01 0.00 -1.00 0.00 0.00 59.36 57.84 1ee1 h GLU 230 Cb 1.00 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1ee1 h GLU 230 CO 0.09 1.15 0.19 0.82 -1.00 0.00 0.00 179.01 180.26 1ee1 h ILE 231 N 0.51 1.17 -0.55 3.13 2.04 -1.19 -1.94 117.51 120.68 1ee1 h ILE 231 Ca -0.02 -0.49 -0.07 0.00 1.00 0.00 0.00 64.86 65.28 1ee1 h ILE 231 Cb 1.29 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 1ee1 h ILE 231 CO 0.14 0.18 0.07 0.44 0.00 0.00 0.00 178.15 178.98 1ee1 h ASP 232 N 0.49 0.90 -0.62 1.72 3.32 -0.84 -1.21 116.42 120.18 1ee1 h ASP 232 Ca 0.13 -0.27 0.04 0.00 0.02 0.00 0.00 57.03 56.95 1ee1 h ASP 232 Cb 0.12 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 1ee1 h ASP 232 CO -0.02 0.94 0.37 0.44 -1.72 0.00 0.00 179.24 179.25 1ee1 h ASP 233 N 0.82 0.58 0.25 6.45 3.45 -1.07 0.32 116.42 127.22 1ee1 h ASP 233 Ca 0.17 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.63 1ee1 h ASP 233 Cb 0.44 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 1ee1 h ASP 233 CO 0.01 0.39 -0.12 0.22 -1.57 0.00 0.00 179.24 178.18 1ee1 h TYR 234 N 0.71 -0.31 -0.44 4.55 3.20 -1.11 0.78 116.97 124.34 1ee1 h TYR 234 Ca 0.26 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.10 1ee1 h TYR 234 Cb 0.08 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 1ee1 h TYR 234 CO -0.06 -0.17 0.19 -0.07 -1.64 0.00 0.00 178.16 176.40 1ee1 h LEU 235 N -0.36 0.56 0.00 2.82 3.38 -0.78 -1.19 115.31 119.73 1ee1 h LEU 235 Ca -0.03 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1ee1 h LEU 235 Cb 0.28 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1ee1 h LEU 235 CO 0.06 0.50 0.00 -0.62 0.09 0.00 0.00 178.44 178.47 1ee1 n GLU 236 N -4.38 0.98 -0.86 1.13 1.02 0.11 -4.81 120.64 113.83 1ee1 n GLU 236 Ca 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1ee1 n GLU 236 Cb 0.14 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.15 1ee1 n GLU 236 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ee1 n GLY 237 N 0.88 0.51 3.79 0.62 0.00 -0.45 -4.53 105.19 106.02 1ee1 n GLY 237 Ca 0.20 -0.54 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 1ee1 n GLY 237 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ee1 s LYS 238 N -1.04 4.41 -0.07 1.61 1.02 0.23 -4.98 119.74 120.92 1ee1 s LYS 238 Ca 0.00 1.28 -0.30 0.00 0.02 0.00 0.00 55.97 56.97 1ee1 s LYS 238 Cb 0.00 -2.56 -0.04 0.00 -0.52 0.00 0.00 37.83 34.71 1ee1 s LYS 238 CO 0.00 0.13 1.47 -2.00 -0.92 0.00 0.00 175.35 174.03 1ee1 s GLU 239 N -2.49 4.22 0.42 1.68 2.12 -1.26 -4.48 118.70 118.91 1ee1 s GLU 239 Ca 0.55 1.98 0.07 0.00 0.36 0.00 0.00 54.97 57.93 1ee1 s GLU 239 Cb -0.16 -3.80 -0.05 0.00 0.26 0.00 0.00 34.13 30.38 1ee1 s GLU 239 CO 0.20 -0.73 0.17 0.14 -0.54 0.00 0.00 175.26 174.51 1ee1 s VAL 240 N 3.41 2.25 0.53 3.70 -7.23 -1.26 -5.03 120.40 116.77 1ee1 s VAL 240 Ca 0.65 -1.71 -0.21 0.00 -1.81 0.00 0.00 61.98 58.90 1ee1 s VAL 240 Cb -0.30 -2.96 -0.06 0.00 0.56 0.00 0.00 36.38 33.63 1ee1 s VAL 240 CO 0.24 0.00 1.20 -0.44 -0.31 0.00 0.00 175.10 175.79 1ee1 s SER 241 N -3.90 5.64 0.57 4.85 0.01 -1.26 -4.87 113.70 114.74 1ee1 s SER 241 Ca 0.40 2.37 0.26 0.00 1.31 0.00 0.00 55.95 60.29 1ee1 s SER 241 Cb 0.04 -2.60 1.59 0.00 0.21 0.00 0.00 66.02 65.26 1ee1 s SER 241 CO 0.22 -1.29 2.13 0.00 0.41 0.00 0.00 173.24 174.71 1ee1 h ALA 242 N 1.42 1.87 0.00 1.44 0.00 -1.99 -0.06 119.26 121.94 1ee1 h ALA 242 Ca -0.50 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.33 1ee1 h ALA 242 Cb 1.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1ee1 h ALA 242 CO 0.57 -0.23 -0.34 1.57 0.00 0.00 0.00 179.25 180.83 1ee1 h LYS 243 N 0.00 0.00 0.01 0.00 2.10 -1.99 -0.84 116.57 115.85 1ee1 h LYS 243 Ca 0.07 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.72 1ee1 h LYS 243 Cb 0.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 1ee1 h LYS 243 CO -0.00 0.34 -0.01 0.28 -2.00 0.00 0.00 179.45 178.06 1ee1 h VAL 244 N 0.00 1.51 -0.20 0.07 2.07 -1.37 -2.89 116.25 115.43 1ee1 h VAL 244 Ca -0.00 -1.97 0.05 0.00 0.82 0.00 0.00 66.70 65.59 1ee1 h VAL 244 Cb 0.64 2.77 -0.05 0.00 -1.52 0.00 0.00 31.29 33.13 1ee1 h VAL 244 CO 0.04 0.48 -0.14 0.28 0.02 0.00 0.00 177.57 178.25 1ee1 h SER 245 N -0.92 -0.47 -0.29 0.57 0.02 -1.47 -0.49 113.55 110.50 1ee1 h SER 245 Ca -0.00 0.10 0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1ee1 h SER 245 Cb 0.80 0.24 -0.04 0.00 0.14 0.00 0.00 62.40 63.54 1ee1 h SER 245 CO 0.00 -0.18 0.04 -0.08 -1.14 0.00 0.00 176.83 175.47 1ee1 h GLU 246 N -0.14 0.13 -0.01 3.45 4.81 -1.27 0.24 114.58 121.79 1ee1 h GLU 246 Ca 0.12 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1ee1 h GLU 246 Cb 0.32 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1ee1 h GLU 246 CO -0.29 0.09 0.00 0.00 -0.73 0.00 0.00 179.01 178.09 1ee1 h ALA 247 N 1.23 0.02 -0.64 2.92 0.00 -1.24 -2.58 119.26 118.97 1ee1 h ALA 247 Ca 0.14 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1ee1 h ALA 247 Cb 0.16 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1ee1 h ALA 247 CO -0.20 -0.39 0.06 -0.07 0.00 0.00 0.00 179.25 178.65 1ee1 h LEU 248 N -0.16 1.04 -1.02 0.00 3.38 -0.93 -1.88 115.31 115.75 1ee1 h LEU 248 Ca 0.00 -0.27 -0.10 0.00 0.09 0.00 0.00 57.88 57.61 1ee1 h LEU 248 Cb 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 1ee1 h LEU 248 CO -0.00 1.06 -0.39 -0.33 0.09 0.00 0.00 178.44 178.87 1ee1 h GLU 249 N 1.00 0.20 -0.11 1.13 5.08 -0.95 -0.00 114.58 120.93 1ee1 h GLU 249 Ca 0.19 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1ee1 h GLU 249 Cb 0.49 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ee1 h GLU 249 CO 0.02 0.56 -0.06 -0.22 -1.00 0.00 0.00 179.01 178.31 1ee1 h LYS 250 N 0.17 0.23 -0.78 2.33 3.64 -1.24 -2.40 116.57 118.53 1ee1 h LYS 250 Ca 0.02 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1ee1 h LYS 250 Cb 0.76 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.54 1ee1 h LYS 250 CO 0.06 0.60 0.41 -0.09 -2.27 0.00 0.00 179.45 178.16 1ee1 h ARG 251 N -0.14 1.09 -0.39 1.90 9.65 -1.16 -2.49 114.38 122.84 1ee1 h ARG 251 Ca 0.02 -0.13 0.00 0.00 -1.10 0.00 0.00 59.98 58.77 1ee1 h ARG 251 Cb 0.53 -0.21 -0.02 0.00 -1.39 0.00 0.00 29.97 28.89 1ee1 h ARG 251 CO 0.02 0.82 0.26 -0.92 2.80 0.00 0.00 179.97 182.94 1ee1 h TYR 252 N 1.08 0.50 -0.52 2.20 3.20 -0.93 -2.48 116.97 120.02 1ee1 h TYR 252 Ca 0.27 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.09 1ee1 h TYR 252 Cb 0.05 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 1ee1 h TYR 252 CO 0.00 0.32 0.07 0.77 -1.64 0.00 0.00 178.16 177.68 1ee1 h SER 253 N 0.53 0.78 1.44 -2.11 0.02 -1.26 -2.85 113.55 110.09 1ee1 h SER 253 Ca 0.14 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1ee1 h SER 253 Cb -0.05 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.28 1ee1 h SER 253 CO -0.03 0.80 0.00 0.00 -1.14 0.00 0.00 176.83 176.46 1ee1 h MET 254 N 0.78 0.00 -0.40 3.45 -0.00 -1.19 -3.19 114.93 114.38 1ee1 h MET 254 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.86 1ee1 h MET 254 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.97 1ee1 h MET 254 CO 0.01 0.00 0.00 0.25 -0.00 0.00 0.00 176.91 177.17 1ee1 n THR 255 N -2.94 1.64 -0.05 -0.10 -2.24 -0.96 -4.57 114.28 105.06 1ee1 n THR 255 Ca 0.03 -1.34 0.11 0.00 -2.27 0.00 0.00 64.05 60.57 1ee1 n THR 255 Cb 0.40 0.16 0.50 0.00 -2.10 0.00 0.00 70.33 69.29 1ee1 n THR 255 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1ee1 h GLU 256 N 2.50 0.38 -0.03 -0.78 4.57 -1.50 -0.29 114.58 119.42 1ee1 h GLU 256 Ca 0.00 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1ee1 h GLU 256 Cb 1.15 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.66 1ee1 h GLU 256 CO 0.13 0.25 0.04 1.12 -1.18 0.00 0.00 179.01 179.37 1ee1 h HIS 257 N 0.39 0.00 0.00 0.92 2.07 -1.86 -0.40 115.15 116.27 1ee1 h HIS 257 Ca 0.24 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.76 1ee1 h HIS 257 Cb 0.44 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.42 1ee1 h HIS 257 CO -0.00 0.00 -0.05 0.87 -3.07 0.00 0.00 177.93 175.68 1ee1 h LYS 258 N 0.00 0.00 -0.44 5.12 1.57 -1.40 -3.23 116.57 118.19 1ee1 h LYS 258 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1ee1 h LYS 258 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1ee1 h LYS 258 CO -0.00 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.42 1ee1 n ARG 259 N -2.41 2.65 -4.32 3.15 1.74 -0.17 -4.98 116.66 112.32 1ee1 n ARG 259 Ca 0.05 -2.19 -0.17 0.00 -0.77 0.00 0.00 57.85 54.77 1ee1 n ARG 259 Cb 0.45 -1.37 -0.10 0.00 -1.02 0.00 0.00 32.46 30.42 1ee1 n ARG 259 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1ee1 s GLN 260 N -1.03 1.26 0.82 5.56 -1.52 -1.12 -5.11 119.66 118.52 1ee1 s GLN 260 Ca 0.31 -1.56 -0.11 0.00 -1.95 0.00 0.00 55.36 52.05 1ee1 s GLN 260 Cb 0.17 -0.96 0.09 0.00 -0.22 0.00 0.00 33.01 32.08 1ee1 s GLN 260 CO 0.22 0.13 1.09 0.08 -0.25 0.00 0.00 175.29 176.56 1ee1 s VAL 261 N -3.10 3.06 0.30 1.09 1.01 -1.26 -4.89 120.40 116.60 1ee1 s VAL 261 Ca 0.21 0.34 -0.27 0.00 0.00 0.00 0.00 61.98 62.27 1ee1 s VAL 261 Cb 0.01 -2.85 -0.14 0.00 0.00 0.00 0.00 36.38 33.40 1ee1 s VAL 261 CO 0.05 -0.45 0.88 -2.65 0.00 0.00 0.00 175.10 172.94 1ee1 n PRO 262 N -3.66 1.06 -2.33 2.72 -0.02 -1.26 -4.88 135.00 126.63 1ee1 n PRO 262 Ca 0.08 0.37 -0.39 0.00 -2.02 0.00 0.00 63.50 61.54 1ee1 n PRO 262 Cb 0.54 -1.69 -0.03 0.00 -0.02 0.00 0.00 33.50 32.30 1ee1 n PRO 262 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ee1 s ALA 263 N -1.11 3.30 0.29 3.55 0.00 -1.26 -5.06 121.76 121.47 1ee1 s ALA 263 Ca 0.60 0.99 0.03 0.00 0.00 0.00 0.00 51.96 53.59 1ee1 s ALA 263 Cb -0.71 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 18.97 1ee1 s ALA 263 CO 0.59 -0.41 0.05 -1.54 0.00 0.00 0.00 175.76 174.44 1ee1 s SER 264 N -0.94 2.04 0.06 0.00 1.04 -1.26 -5.02 113.70 109.61 1ee1 s SER 264 Ca 0.51 -1.34 0.17 0.00 0.48 0.00 0.00 55.95 55.77 1ee1 s SER 264 Cb -0.32 -0.02 0.71 0.00 0.10 0.00 0.00 66.02 66.48 1ee1 s SER 264 CO 0.42 -0.60 1.53 1.15 0.98 0.00 0.00 173.24 176.71 1ee1 n MET 265 N -0.58 0.05 -0.14 4.02 0.00 -1.26 -1.78 117.12 117.42 1ee1 n MET 265 Ca -0.02 0.29 0.10 0.00 0.00 0.00 0.00 57.70 58.07 1ee1 n MET 265 Cb 0.66 -1.59 0.29 0.00 0.00 0.00 0.00 33.22 32.58 1ee1 n MET 265 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 175.97 177.16 1ee1 n PHE 266 N -1.67 0.37 -3.86 3.17 3.01 -1.26 -4.87 117.46 112.35 1ee1 n PHE 266 Ca 0.03 -0.19 -0.36 0.00 1.01 0.00 0.00 57.45 57.94 1ee1 n PHE 266 Cb 0.19 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 39.59 1ee1 n PHE 266 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1ee1 s ASP 267 N -1.43 6.31 -0.12 4.37 -0.00 -0.74 -5.01 116.67 120.06 1ee1 s ASP 267 Ca 0.34 0.40 0.18 0.00 -0.00 0.00 0.00 52.55 53.47 1ee1 s ASP 267 Cb 0.19 -2.06 -0.27 0.00 -0.00 0.00 0.00 42.92 40.78 1ee1 s ASP 267 CO 0.27 0.35 0.23 0.47 -0.00 0.00 0.00 175.17 176.49 1ee1 n ASP 268 N 2.35 0.35 0.10 0.27 8.00 -1.26 -4.53 116.55 121.83 1ee1 n ASP 268 Ca -0.19 0.00 0.20 0.00 0.71 0.00 0.00 54.79 55.51 1ee1 n ASP 268 Cb 0.54 1.39 0.66 0.00 -0.02 0.00 0.00 41.12 43.69 1ee1 n ASP 268 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 1ee1 h TRP 269 N 0.00 0.00 0.00 1.24 5.08 -1.98 -1.03 115.95 119.27 1ee1 h TRP 269 Ca -0.29 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.68 1ee1 h TRP 269 Cb 1.62 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.78 1ee1 h TRP 269 CO 0.00 0.00 -0.91 -2.67 -1.28 0.00 0.00 178.44 173.58 1ee1 n TRP 270 N -3.38 0.32 1.20 0.12 4.27 -1.26 -5.08 117.44 113.62 1ee1 n TRP 270 Ca 0.08 0.09 0.10 0.00 -3.89 0.00 0.00 57.50 53.88 1ee1 n TRP 270 Cb 0.76 -0.47 0.57 0.00 -1.36 0.00 0.00 31.31 30.81 1ee1 n TRP 270 CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03