#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l8i s LEU 14 N 0.00 3.40 0.30 -4.53 1.43 -1.26 -4.63 118.68 113.39 1l8i s LEU 14 Ca 0.00 -0.14 0.06 0.00 -1.03 0.00 0.00 54.13 53.02 1l8i s LEU 14 Cb 0.00 -2.06 -0.02 0.00 0.03 0.00 0.00 46.19 44.14 1l8i s LEU 14 CO 0.00 0.22 0.41 -0.76 0.23 0.00 0.00 176.35 176.45 1l8i s LEU 15 N -1.96 4.04 0.23 1.79 2.01 -0.79 -5.05 118.68 118.95 1l8i s LEU 15 Ca 0.22 -0.14 -0.30 0.00 0.01 0.00 0.00 54.13 53.92 1l8i s LEU 15 Cb -0.12 -2.73 -0.09 0.00 0.01 0.00 0.00 46.19 43.27 1l8i s LEU 15 CO 0.14 -0.31 0.94 -0.47 1.01 0.00 0.00 176.35 177.66 1l8i s TYR 16 N -2.13 3.98 -0.28 0.29 6.14 -1.26 -4.68 117.35 119.42 1l8i s TYR 16 Ca 0.41 1.91 -0.21 0.00 0.64 0.00 0.00 57.07 59.82 1l8i s TYR 16 Cb -0.09 -2.98 0.09 0.00 0.42 0.00 0.00 41.96 39.40 1l8i s TYR 16 CO 0.30 0.44 0.81 -0.08 0.64 0.00 0.00 175.55 177.66 1l8i s THR 17 N -1.10 0.00 -1.68 4.34 -1.32 -1.26 -4.99 115.64 109.63 1l8i s THR 17 Ca 0.41 0.00 0.05 0.00 -1.21 0.00 0.00 61.69 60.94 1l8i s THR 17 Cb -0.26 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 69.84 1l8i s THR 17 CO 0.32 0.00 0.88 0.54 -2.21 0.00 0.00 174.62 174.14 1l8i n ARG 18 N 3.27 0.10 -2.00 7.08 1.74 -1.26 -4.57 116.66 121.02 1l8i n ARG 18 Ca -0.16 0.13 -0.43 0.00 -0.77 0.00 0.00 57.85 56.62 1l8i n ARG 18 Cb 0.57 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.48 1l8i n ARG 18 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1l8i s ASN 19 N -2.32 6.04 -1.36 0.55 3.84 -1.26 -4.90 114.94 115.53 1l8i s ASN 19 Ca 0.05 1.49 -0.07 0.00 0.21 0.00 0.00 52.86 54.55 1l8i s ASN 19 Cb 0.03 -2.53 0.09 0.00 -0.55 0.00 0.00 41.25 38.30 1l8i s ASN 19 CO 0.06 -1.55 2.41 -0.90 -2.79 0.00 0.00 177.10 174.33 1l8i n ASP 20 N 9.67 7.75 -4.65 -4.21 3.85 -1.26 -4.92 116.55 122.78 1l8i n ASP 20 Ca 0.22 -3.05 -0.35 0.00 -0.71 0.00 0.00 54.79 50.90 1l8i n ASP 20 Cb 0.46 -1.41 -0.09 0.00 -1.35 0.00 0.00 41.12 38.73 1l8i n ASP 20 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 1l8i s VAL 21 N -0.43 4.99 -0.26 2.12 1.01 -1.26 -5.02 120.40 121.55 1l8i s VAL 21 Ca 0.55 0.04 -0.42 0.00 0.00 0.00 0.00 61.98 62.14 1l8i s VAL 21 Cb 0.17 -3.27 -0.18 0.00 0.00 0.00 0.00 36.38 33.10 1l8i s VAL 21 CO -0.08 0.43 1.50 -1.54 0.00 0.00 0.00 175.10 175.41 1l8i n SER 22 N 3.71 1.35 -0.09 3.32 3.41 -1.26 -4.61 113.62 119.45 1l8i n SER 22 Ca -0.16 1.14 0.26 0.00 -0.26 0.00 0.00 58.87 59.85 1l8i n SER 22 Cb 0.52 -1.00 0.62 0.00 -0.26 0.00 0.00 64.21 64.08 1l8i n SER 22 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1l8i h ASP 23 N 5.16 0.00 -0.01 4.04 5.19 -1.97 0.64 116.42 129.47 1l8i h ASP 23 Ca -0.47 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 55.94 1l8i h ASP 23 Cb 1.36 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.87 1l8i h ASP 23 CO 0.88 0.00 -0.01 0.77 -3.12 0.00 0.00 179.24 177.76 1l8i h SER 24 N 0.00 0.02 0.59 6.45 4.64 -2.00 -1.42 113.55 121.84 1l8i h SER 24 Ca 0.37 -0.45 -0.04 0.00 -0.47 0.00 0.00 61.79 61.20 1l8i h SER 24 Cb 2.06 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 64.14 1l8i h SER 24 CO -0.00 0.47 -0.19 -0.08 -0.87 0.00 0.00 176.83 176.15 1l8i h GLU 25 N -0.42 0.00 0.30 4.77 4.57 -0.12 -1.30 114.58 122.38 1l8i h GLU 25 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1l8i h GLU 25 Cb 0.46 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.05 1l8i h GLU 25 CO 0.00 0.19 -0.14 0.87 -1.18 0.00 0.00 179.01 178.75 1l8i h LYS 26 N 0.00 -0.38 -0.98 1.92 1.57 -0.99 -2.19 116.57 115.51 1l8i h LYS 26 Ca -0.00 0.03 0.19 0.00 -1.87 0.00 0.00 60.65 58.99 1l8i h LYS 26 Cb 0.54 0.09 -0.11 0.00 0.08 0.00 0.00 32.23 32.83 1l8i h LYS 26 CO 0.03 -0.26 0.58 0.87 -0.57 0.00 0.00 179.45 180.10 1l8i h LYS 27 N -0.86 0.71 0.06 3.15 1.57 -1.24 0.33 116.57 120.30 1l8i h LYS 27 Ca -0.04 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1l8i h LYS 27 Cb 0.31 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1l8i h LYS 27 CO 0.07 0.47 -0.03 0.00 -0.57 0.00 0.00 179.45 179.39 1l8i h ALA 28 N 1.64 -0.08 -0.24 3.86 0.00 -1.31 -2.26 119.26 120.87 1l8i h ALA 28 Ca 0.57 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.36 1l8i h ALA 28 Cb 0.88 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1l8i h ALA 28 CO -0.39 -0.47 0.03 1.15 0.00 0.00 0.00 179.25 179.57 1l8i h THR 29 N -0.23 1.24 -0.64 0.00 2.02 -0.68 -1.68 112.91 112.94 1l8i h THR 29 Ca -0.01 -0.81 0.13 0.00 0.77 0.00 0.00 66.41 66.49 1l8i h THR 29 Cb 0.20 1.30 -0.04 0.00 -1.74 0.00 0.00 68.15 67.87 1l8i h THR 29 CO 0.01 0.26 0.43 0.58 0.37 0.00 0.00 175.52 177.17 1l8i h VAL 30 N 0.21 0.83 0.07 3.16 2.07 -0.37 0.24 116.25 122.45 1l8i h VAL 30 Ca 0.07 -0.11 -0.24 0.00 0.82 0.00 0.00 66.70 67.24 1l8i h VAL 30 Cb 0.35 0.47 0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1l8i h VAL 30 CO 0.01 0.06 -0.96 -0.08 0.02 0.00 0.00 177.57 176.61 1l8i h GLU 31 N 0.33 0.53 -0.59 1.57 4.22 -1.16 -2.52 114.58 116.96 1l8i h GLU 31 Ca 0.30 -0.66 -0.00 0.00 0.08 0.00 0.00 59.36 59.08 1l8i h GLU 31 Cb 0.75 0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.18 1l8i h GLU 31 CO -0.08 1.27 0.36 1.25 -2.18 0.00 0.00 179.01 179.64 1l8i h LEU 32 N 0.09 0.71 0.43 1.64 5.85 -0.08 -2.16 115.31 121.78 1l8i h LEU 32 Ca -0.14 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1l8i h LEU 32 Cb 1.67 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 42.52 1l8i h LEU 32 CO 0.19 0.55 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.57 1l8i h LEU 33 N 0.80 -0.48 -1.87 2.25 3.38 -0.69 -2.85 115.31 115.85 1l8i h LEU 33 Ca 0.21 -0.11 0.30 0.00 0.09 0.00 0.00 57.88 58.38 1l8i h LEU 33 Cb -0.02 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 1l8i h LEU 33 CO -0.04 -0.12 0.76 0.78 0.09 0.00 0.00 178.44 179.90 1l8i h ASN 34 N -0.89 0.09 -0.30 -0.43 2.35 -1.42 0.50 115.58 115.48 1l8i h ASN 34 Ca -0.06 0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1l8i h ASN 34 Cb 0.56 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 1l8i h ASN 34 CO 0.10 0.02 0.14 -0.09 -1.65 0.00 0.00 177.43 175.94 1l8i h ARG 35 N 0.08 0.44 -0.36 0.81 2.43 -1.16 -2.54 114.38 114.10 1l8i h ARG 35 Ca 0.53 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 59.53 1l8i h ARG 35 Cb 1.95 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 31.41 1l8i h ARG 35 CO -0.06 0.43 -0.15 1.96 -1.51 0.00 0.00 179.97 180.64 1l8i h GLN 36 N 0.35 0.73 -0.60 0.20 1.08 0.04 -2.77 115.11 114.14 1l8i h GLN 36 Ca 0.10 -0.31 0.12 0.00 -1.45 0.00 0.00 58.65 57.11 1l8i h GLN 36 Cb 0.15 -0.03 -0.09 0.00 -0.05 0.00 0.00 27.48 27.46 1l8i h GLN 36 CO -0.01 0.92 0.11 0.28 -0.95 0.00 0.00 178.83 179.17 1l8i h VAL 37 N 0.52 0.61 0.32 -0.54 2.07 -0.90 0.51 116.25 118.85 1l8i h VAL 37 Ca 0.08 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1l8i h VAL 37 Cb 0.68 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1l8i h VAL 37 CO 0.05 0.04 -0.15 0.40 0.02 0.00 0.00 177.57 177.93 1l8i h ILE 38 N 0.23 0.69 -0.79 4.57 2.04 -1.41 0.23 117.51 123.07 1l8i h ILE 38 Ca 0.32 -0.06 0.12 0.00 1.00 0.00 0.00 64.86 66.24 1l8i h ILE 38 Cb 0.48 0.72 -0.08 0.00 -0.74 0.00 0.00 36.82 37.20 1l8i h ILE 38 CO -0.42 0.01 0.40 -0.61 0.00 0.00 0.00 178.15 177.53 1l8i h GLN 39 N -0.46 0.61 0.05 2.37 4.15 -0.94 -1.66 115.11 119.23 1l8i h GLN 39 Ca -0.04 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.34 1l8i h GLN 39 Cb 0.35 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.91 1l8i h GLN 39 CO 0.07 0.40 -0.02 0.74 -1.93 0.00 0.00 178.83 178.09 1l8i h PHE 40 N 0.63 -0.06 -0.79 3.99 -1.00 0.25 -1.53 116.94 118.43 1l8i h PHE 40 Ca 0.41 -0.00 0.16 0.00 2.81 0.00 0.00 57.97 61.35 1l8i h PHE 40 Cb 0.50 0.02 -0.10 0.00 3.61 0.00 0.00 35.95 39.98 1l8i h PHE 40 CO -0.10 0.50 0.31 0.82 -1.61 0.00 0.00 178.31 178.23 1l8i h ILE 41 N -0.68 0.61 -0.32 -0.55 2.04 -0.35 -0.27 117.51 117.98 1l8i h ILE 41 Ca -0.01 -0.15 -0.09 0.00 1.00 0.00 0.00 64.86 65.61 1l8i h ILE 41 Cb 0.59 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1l8i h ILE 41 CO 0.01 0.08 -0.16 -0.78 0.00 0.00 0.00 178.15 177.30 1l8i h ASP 42 N 0.42 0.70 -0.87 1.72 3.58 -1.33 -2.30 116.42 118.35 1l8i h ASP 42 Ca 0.45 -0.41 0.08 0.00 0.42 0.00 0.00 57.03 57.57 1l8i h ASP 42 Cb 0.72 -0.19 -0.06 0.00 1.72 0.00 0.00 39.33 41.52 1l8i h ASP 42 CO -0.44 0.95 0.57 0.25 -2.88 0.00 0.00 179.24 177.69 1l8i h LEU 43 N 0.45 0.82 -0.25 2.28 6.46 -0.07 -0.57 115.31 124.42 1l8i h LEU 43 Ca 0.07 0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.78 1l8i h LEU 43 Cb 0.69 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.46 1l8i h LEU 43 CO 0.05 0.50 -0.11 0.77 -0.62 0.00 0.00 178.44 179.03 1l8i h SER 44 N 0.91 0.52 -0.73 1.25 4.64 -0.90 -0.58 113.55 118.66 1l8i h SER 44 Ca 0.39 -0.40 0.05 0.00 -0.47 0.00 0.00 61.79 61.36 1l8i h SER 44 Cb 0.32 -0.14 -0.05 0.00 -0.31 0.00 0.00 62.40 62.21 1l8i h SER 44 CO -0.16 0.81 0.43 -0.07 -0.87 0.00 0.00 176.83 176.97 1l8i h LEU 45 N 0.24 0.67 -0.88 5.97 3.38 -0.78 -1.42 115.31 122.48 1l8i h LEU 45 Ca 0.06 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1l8i h LEU 45 Cb 0.60 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1l8i h LEU 45 CO 0.03 0.44 0.34 0.40 0.09 0.00 0.00 178.44 179.74 1l8i h ILE 46 N 0.80 1.25 -0.59 1.22 2.04 -0.96 -1.72 117.51 119.56 1l8i h ILE 46 Ca 0.32 -0.76 0.03 0.00 1.00 0.00 0.00 64.86 65.44 1l8i h ILE 46 Cb 0.14 0.28 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 1l8i h ILE 46 CO -0.16 0.32 0.35 0.74 0.00 0.00 0.00 178.15 179.40 1l8i h THR 47 N 1.14 1.06 -0.39 -0.27 2.02 -0.05 -1.31 112.91 115.11 1l8i h THR 47 Ca 0.27 -0.24 -0.09 0.00 0.77 0.00 0.00 66.41 67.12 1l8i h THR 47 Cb 0.17 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 1l8i h THR 47 CO -0.03 0.13 -0.14 0.11 0.37 0.00 0.00 175.52 175.96 1l8i h LYS 48 N 0.70 0.70 0.22 6.66 1.79 -1.04 -0.97 116.57 124.63 1l8i h LYS 48 Ca 0.24 -0.24 0.01 0.00 -2.18 0.00 0.00 60.65 58.48 1l8i h LYS 48 Cb 0.03 -0.06 -0.04 0.00 -1.58 0.00 0.00 32.23 30.59 1l8i h LYS 48 CO -0.10 0.81 -0.39 1.96 -1.08 0.00 0.00 179.45 180.64 1l8i h GLN 49 N 0.64 -0.67 0.21 3.15 1.08 -0.36 0.03 115.11 119.18 1l8i h GLN 49 Ca 0.11 0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.35 1l8i h GLN 49 Cb 0.60 0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 28.16 1l8i h GLN 49 CO 0.04 -0.45 -0.19 0.00 -0.95 0.00 0.00 178.83 177.28 1l8i h ALA 50 N -0.23 -0.39 -0.93 3.87 0.00 -1.20 -2.57 119.26 117.81 1l8i h ALA 50 Ca 0.00 -0.06 0.12 0.00 0.00 0.00 0.00 54.91 54.97 1l8i h ALA 50 Cb 0.68 0.27 -0.13 0.00 0.00 0.00 0.00 17.79 18.60 1l8i h ALA 50 CO -0.17 -0.74 -0.48 1.25 0.00 0.00 0.00 179.25 179.10 1l8i h HIS 51 N -0.42 -1.48 0.09 0.00 -0.00 -0.89 -2.16 115.15 110.30 1l8i h HIS 51 Ca -0.00 0.11 -0.00 0.00 -0.00 0.00 0.00 60.37 60.47 1l8i h HIS 51 Cb 0.39 0.77 0.00 0.00 -0.00 0.00 0.00 27.41 28.57 1l8i h HIS 51 CO -0.14 -0.39 -0.04 -1.49 -0.00 0.00 0.00 177.93 175.86 1l8i h TRP 52 N -0.04 -0.12 -0.19 5.26 6.55 -0.88 -3.32 115.95 123.22 1l8i h TRP 52 Ca 0.24 -0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.08 1l8i h TRP 52 Cb 0.51 0.04 0.00 0.00 -0.86 0.00 0.00 29.16 28.85 1l8i h TRP 52 CO -0.92 0.10 0.00 0.09 -1.05 0.00 0.00 178.44 176.66 1l8i n ASN 53 N -5.05 1.78 -4.94 -3.49 3.02 -0.92 -4.95 115.26 100.71 1l8i n ASN 53 Ca -0.08 -2.14 -0.24 0.00 -0.03 0.00 0.00 54.58 52.08 1l8i n ASN 53 Cb 0.15 -0.36 -0.02 0.00 -0.61 0.00 0.00 39.78 38.95 1l8i n ASN 53 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l8i s MET 54 N -1.61 3.50 0.10 3.52 0.23 -0.86 -4.52 119.30 119.66 1l8i s MET 54 Ca 0.15 -0.36 -0.19 0.00 -1.03 0.00 0.00 55.69 54.26 1l8i s MET 54 Cb 0.10 -2.71 0.04 0.00 -1.53 0.00 0.00 34.83 30.73 1l8i s MET 54 CO 0.07 0.23 0.46 1.03 -2.03 0.00 0.00 175.02 174.77 1l8i s ARG 55 N -4.07 1.07 0.00 3.16 0.52 -0.60 -4.93 118.95 114.10 1l8i s ARG 55 Ca 0.39 -0.52 0.00 0.00 -0.52 0.00 0.00 55.73 55.08 1l8i s ARG 55 Cb -0.10 0.48 0.00 0.00 0.52 0.00 0.00 34.95 35.85 1l8i s ARG 55 CO 0.34 -0.42 0.00 0.41 0.02 0.00 0.00 175.30 175.65 1l8i n GLY 56 N -0.01 -0.24 3.64 -3.53 0.00 -1.26 -0.13 105.19 103.66 1l8i n GLY 56 Ca -0.17 -2.26 -0.42 0.00 0.00 0.00 0.00 46.02 43.17 1l8i n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l8i n ALA 57 N -0.70 0.59 -1.81 4.61 0.00 -1.26 -1.93 120.51 120.00 1l8i n ALA 57 Ca 0.00 0.28 -0.19 0.00 0.00 0.00 0.00 53.44 53.53 1l8i n ALA 57 Cb 0.00 -2.15 -0.06 0.00 0.00 0.00 0.00 19.45 17.25 1l8i n ALA 57 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1l8i n ASN 58 N 0.55 -5.28 0.00 0.00 4.05 -1.26 -4.78 115.26 108.54 1l8i n ASN 58 Ca 0.08 0.30 0.00 0.00 0.45 0.00 0.00 54.58 55.41 1l8i n ASN 58 Cb 0.38 -4.38 0.00 0.00 1.23 0.00 0.00 39.78 37.01 1l8i n ASN 58 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 177.26 174.54 1l8i n PHE 59 N -2.99 0.00 -0.22 1.20 -0.00 -0.81 -2.54 117.46 112.10 1l8i n PHE 59 Ca -0.20 0.00 -0.08 0.00 -0.00 0.00 0.00 57.45 57.18 1l8i n PHE 59 Cb 0.63 -0.40 -0.03 0.00 -0.00 0.00 0.00 39.48 39.68 1l8i n PHE 59 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.76 177.73 1l8i h ILE 60 N 0.00 0.10 -0.39 -2.13 6.09 -1.92 0.38 117.51 119.64 1l8i h ILE 60 Ca 0.00 0.00 0.08 0.00 -1.37 0.00 0.00 64.86 63.57 1l8i h ILE 60 Cb 0.00 0.10 -0.07 0.00 0.47 0.00 0.00 36.82 37.32 1l8i h ILE 60 CO 0.00 0.00 -0.06 0.00 -3.07 0.00 0.00 178.15 175.02 1l8i h ALA 61 N 0.72 0.29 -0.21 0.18 0.00 -1.99 0.40 119.26 118.65 1l8i h ALA 61 Ca 0.20 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 1l8i h ALA 61 Cb 0.56 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1l8i h ALA 61 CO -0.70 -0.44 0.01 0.28 0.00 0.00 0.00 179.25 178.41 1l8i h VAL 62 N 0.03 1.24 -0.43 0.00 2.07 -1.04 0.57 116.25 118.69 1l8i h VAL 62 Ca 0.19 -0.82 0.09 0.00 0.82 0.00 0.00 66.70 66.98 1l8i h VAL 62 Cb 0.28 1.38 -0.09 0.00 -1.52 0.00 0.00 31.29 31.33 1l8i h VAL 62 CO -0.37 0.25 -0.22 -0.74 0.02 0.00 0.00 177.57 176.51 1l8i h HIS 63 N 0.14 -0.56 -0.50 1.57 6.17 0.28 0.66 115.15 122.90 1l8i h HIS 63 Ca 0.06 0.05 -0.11 0.00 0.71 0.00 0.00 60.37 61.08 1l8i h HIS 63 Cb 0.36 0.31 -0.02 0.00 2.52 0.00 0.00 27.41 30.59 1l8i h HIS 63 CO 0.03 -0.30 -0.10 0.93 0.71 0.00 0.00 177.93 179.19 1l8i h GLU 64 N -0.13 0.95 -0.80 5.26 5.08 -0.86 -2.99 114.58 121.08 1l8i h GLU 64 Ca 0.21 -0.36 0.10 0.00 -1.00 0.00 0.00 59.36 58.31 1l8i h GLU 64 Cb 0.46 -0.06 -0.07 0.00 0.50 0.00 0.00 28.75 29.58 1l8i h GLU 64 CO -0.52 1.02 0.44 1.98 -1.00 0.00 0.00 179.01 180.93 1l8i h MET 65 N 0.81 0.72 -0.82 2.33 4.05 0.75 -1.57 114.93 121.20 1l8i h MET 65 Ca 0.13 -0.04 0.03 0.00 -0.28 0.00 0.00 59.70 59.53 1l8i h MET 65 Cb 0.66 -0.16 -0.04 0.00 -0.80 0.00 0.00 31.60 31.25 1l8i h MET 65 CO 0.05 0.47 0.54 -0.07 0.23 0.00 0.00 176.91 178.13 1l8i h LEU 66 N 0.74 0.89 -0.58 3.39 -0.00 -0.80 -1.33 115.31 117.62 1l8i h LEU 66 Ca 0.39 -0.01 0.03 0.00 -0.00 0.00 0.00 57.88 58.29 1l8i h LEU 66 Cb 0.38 -0.21 -0.04 0.00 -0.00 0.00 0.00 40.66 40.79 1l8i h LEU 66 CO -0.26 0.62 0.35 0.44 -0.00 0.00 0.00 178.44 179.59 1l8i h ASP 67 N 1.04 0.55 -0.55 -0.43 3.32 -1.27 -1.75 116.42 117.33 1l8i h ASP 67 Ca 0.32 0.01 0.11 0.00 0.02 0.00 0.00 57.03 57.49 1l8i h ASP 67 Cb -0.01 -0.11 -0.10 0.00 0.22 0.00 0.00 39.33 39.33 1l8i h ASP 67 CO -0.09 0.38 -0.09 1.23 -1.72 0.00 0.00 179.24 178.96 1l8i h GLY 68 N 0.68 0.47 0.99 2.75 0.00 -1.00 -1.83 103.07 105.13 1l8i h GLY 68 Ca 0.24 0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1l8i h GLY 68 CO -0.11 -0.20 0.14 0.74 0.00 0.00 0.00 176.54 177.11 1l8i h PHE 69 N 0.04 0.27 -0.71 5.60 0.04 -1.19 -2.50 116.94 118.50 1l8i h PHE 69 Ca 0.27 0.00 0.16 0.00 2.80 0.00 0.00 57.97 61.20 1l8i h PHE 69 Cb 0.43 -0.09 -0.11 0.00 2.20 0.00 0.00 35.95 38.37 1l8i h PHE 69 CO -0.41 0.18 0.11 -0.09 -0.60 0.00 0.00 178.31 177.50 1l8i h ARG 70 N 0.29 0.20 0.00 1.51 2.43 -0.53 0.24 114.38 118.52 1l8i h ARG 70 Ca 0.08 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1l8i h ARG 70 Cb -0.02 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1l8i h ARG 70 CO -0.02 0.13 -0.08 1.15 -1.51 0.00 0.00 179.97 179.64 1l8i h THR 71 N 0.21 0.79 -0.70 0.20 2.02 -0.98 -1.20 112.91 113.25 1l8i h THR 71 Ca 0.40 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.56 1l8i h THR 71 Cb 0.68 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 1l8i h THR 71 CO -0.54 0.00 0.36 0.00 0.37 0.00 0.00 175.52 175.71 1l8i h ALA 72 N 0.84 0.90 -0.24 6.16 0.00 -1.00 -2.09 119.26 123.83 1l8i h ALA 72 Ca 0.03 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1l8i h ALA 72 Cb 0.19 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1l8i h ALA 72 CO -0.08 0.45 -0.02 -0.07 0.00 0.00 0.00 179.25 179.52 1l8i h LEU 73 N 0.97 -0.14 -1.08 0.00 4.07 -0.23 -0.96 115.31 117.93 1l8i h LEU 73 Ca 0.24 0.06 -0.03 0.00 0.08 0.00 0.00 57.88 58.23 1l8i h LEU 73 Cb 0.09 0.11 -0.03 0.00 1.08 0.00 0.00 40.66 41.91 1l8i h LEU 73 CO -0.03 -0.04 0.25 0.40 -1.08 0.00 0.00 178.44 177.94 1l8i h ILE 74 N 0.05 1.22 0.54 1.22 2.04 -0.95 0.61 117.51 122.23 1l8i h ILE 74 Ca 0.11 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.27 1l8i h ILE 74 Cb 0.16 0.47 0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1l8i h ILE 74 CO -0.21 0.27 -0.26 0.00 0.00 0.00 0.00 178.15 177.95 1l8i h HIS 76 N -0.75 -0.68 -0.47 0.00 3.86 -1.05 -0.98 115.15 115.08 1l8i h HIS 76 Ca -0.07 0.01 0.04 0.00 -1.16 0.00 0.00 60.37 59.19 1l8i h HIS 76 Cb 0.57 0.27 -0.06 0.00 1.06 0.00 0.00 27.41 29.25 1l8i h HIS 76 CO -0.03 -0.37 -0.33 1.25 0.86 0.00 0.00 177.93 179.31 1l8i h LEU 77 N -0.53 -1.18 -1.18 2.43 6.46 -0.79 0.91 115.31 121.43 1l8i h LEU 77 Ca 0.00 0.17 0.07 0.00 -0.12 0.00 0.00 57.88 58.00 1l8i h LEU 77 Cb 0.50 0.51 -0.06 0.00 -0.73 0.00 0.00 40.66 40.88 1l8i h LEU 77 CO -0.08 -0.16 0.57 0.00 -0.62 0.00 0.00 178.44 178.16 1l8i h ALA 78 N -0.28 1.55 -0.68 1.25 0.00 -0.90 -1.16 119.26 119.04 1l8i h ALA 78 Ca 0.08 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.00 1l8i h ALA 78 Cb 0.26 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 1l8i h ALA 78 CO -0.48 0.31 0.41 1.15 0.00 0.00 0.00 179.25 180.65 1l8i h THR 79 N 0.98 1.05 -0.18 0.00 2.02 0.50 0.78 112.91 118.06 1l8i h THR 79 Ca 0.38 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 67.26 1l8i h THR 79 Cb 0.23 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 1l8i h THR 79 CO -0.14 0.14 -0.02 0.24 0.37 0.00 0.00 175.52 176.11 1l8i h MET 80 N 0.79 0.32 -0.78 6.66 2.86 0.06 -2.09 114.93 122.75 1l8i h MET 80 Ca 0.28 -0.11 0.05 0.00 -2.06 0.00 0.00 59.70 57.86 1l8i h MET 80 Cb 0.08 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.66 1l8i h MET 80 CO -0.13 0.56 0.48 0.00 1.06 0.00 0.00 176.91 178.88 1l8i h ALA 81 N 0.75 1.04 -0.71 6.32 0.00 -0.91 -1.49 119.26 124.27 1l8i h ALA 81 Ca 0.05 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1l8i h ALA 81 Cb 0.43 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 1l8i h ALA 81 CO 0.01 0.25 0.47 0.93 0.00 0.00 0.00 179.25 180.91 1l8i h GLU 82 N 0.91 0.93 -0.86 0.00 5.08 -0.68 -1.68 114.58 118.29 1l8i h GLU 82 Ca 0.33 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.61 1l8i h GLU 82 Cb 0.09 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.09 1l8i h GLU 82 CO -0.14 0.62 0.45 -0.09 -1.00 0.00 0.00 179.01 178.85 1l8i h ARG 83 N 0.96 1.20 -0.09 2.33 9.65 -0.65 0.77 114.38 128.55 1l8i h ARG 83 Ca 0.26 -0.15 -0.00 0.00 -1.10 0.00 0.00 59.98 58.99 1l8i h ARG 83 Cb -0.11 -0.23 -0.00 0.00 -1.39 0.00 0.00 29.97 28.23 1l8i h ARG 83 CO -0.06 0.89 0.05 0.00 2.80 0.00 0.00 179.97 183.65 1l8i h ALA 84 N 1.29 0.12 -0.27 2.80 0.00 -0.79 -2.11 119.26 120.30 1l8i h ALA 84 Ca 0.30 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 1l8i h ALA 84 Cb 0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1l8i h ALA 84 CO -0.05 -0.33 -0.04 0.28 0.00 0.00 0.00 179.25 179.12 1l8i h VAL 85 N 0.04 1.18 -0.35 0.00 2.07 -0.93 -1.38 116.25 116.88 1l8i h VAL 85 Ca 0.03 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 1l8i h VAL 85 Cb 0.10 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1l8i h VAL 85 CO -0.00 0.25 0.04 1.56 0.02 0.00 0.00 177.57 179.43 1l8i h GLN 86 N 0.39 0.52 -0.21 1.57 4.20 -0.42 -1.43 115.11 119.74 1l8i h GLN 86 Ca 0.09 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1l8i h GLN 86 Cb 0.32 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.02 1l8i h GLN 86 CO 0.01 0.52 0.00 1.28 -0.67 0.00 0.00 178.83 179.98 1l8i n LEU 87 N -4.31 0.91 0.00 1.46 4.77 -0.81 -4.87 117.00 114.15 1l8i n LEU 87 Ca 0.02 -0.45 0.00 0.00 -0.03 0.00 0.00 56.01 55.54 1l8i n LEU 87 Cb 0.22 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1l8i n LEU 87 CO 0.38 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1l8i n GLY 88 N 0.70 0.71 0.00 -0.72 0.00 -0.54 -4.83 105.19 100.51 1l8i n GLY 88 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1l8i n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l8i n GLY 89 N -2.04 -0.63 2.84 -0.02 0.00 -0.59 -1.88 105.19 102.86 1l8i n GLY 89 Ca 0.00 -1.72 -0.29 0.00 0.00 0.00 0.00 46.02 44.02 1l8i n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l8i s VAL 90 N -0.45 0.98 0.14 1.61 1.01 -1.26 -4.44 120.40 117.98 1l8i s VAL 90 Ca 0.00 -0.78 -0.31 0.00 0.00 0.00 0.00 61.98 60.89 1l8i s VAL 90 Cb 0.00 -1.33 -0.10 0.00 0.00 0.00 0.00 36.38 34.95 1l8i s VAL 90 CO 0.00 -0.09 1.59 0.00 0.00 0.00 0.00 175.10 176.59 1l8i s ALA 91 N 1.66 3.75 -0.29 5.51 0.00 -1.26 -4.97 121.76 126.16 1l8i s ALA 91 Ca -0.02 1.33 -0.05 0.00 0.00 0.00 0.00 51.96 53.21 1l8i s ALA 91 Cb -0.17 -3.64 0.02 0.00 0.00 0.00 0.00 23.12 19.33 1l8i s ALA 91 CO -0.07 -0.86 0.05 -0.51 0.00 0.00 0.00 175.76 174.37 1l8i s LEU 92 N 1.51 3.75 0.00 0.00 1.43 -1.26 -4.93 118.68 119.18 1l8i s LEU 92 Ca 0.71 -0.82 0.08 0.00 -1.03 0.00 0.00 54.13 53.08 1l8i s LEU 92 Cb -0.43 -1.82 0.13 0.00 0.03 0.00 0.00 46.19 44.11 1l8i s LEU 92 CO 0.31 -0.19 0.99 0.61 0.23 0.00 0.00 176.35 178.30 1l8i n GLY 93 N 4.80 0.72 3.83 -3.19 0.00 -1.26 -4.52 105.19 105.58 1l8i n GLY 93 Ca -0.15 -0.27 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 1l8i n GLY 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1l8i s THR 94 N 0.00 4.50 0.35 2.61 -4.23 -1.26 -4.91 115.64 112.70 1l8i s THR 94 Ca 0.11 1.27 0.06 0.00 -1.18 0.00 0.00 61.69 61.94 1l8i s THR 94 Cb 0.12 -3.65 0.30 0.00 1.34 0.00 0.00 72.50 70.62 1l8i s THR 94 CO -0.05 -0.43 1.91 0.00 -0.54 0.00 0.00 174.62 175.51 1l8i h THR 95 N 1.55 0.95 0.21 3.99 1.03 -1.99 -1.39 112.91 117.26 1l8i h THR 95 Ca -0.48 -0.27 -0.00 0.00 -0.01 0.00 0.00 66.41 65.65 1l8i h THR 95 Cb 1.18 0.10 -0.01 0.00 -1.07 0.00 0.00 68.15 68.35 1l8i h THR 95 CO 0.62 0.14 -0.16 1.56 -0.01 0.00 0.00 175.52 177.67 1l8i h GLN 96 N 0.78 -0.37 -0.46 0.00 1.08 -2.00 -0.48 115.11 113.66 1l8i h GLN 96 Ca 0.38 0.03 0.01 0.00 -1.45 0.00 0.00 58.65 57.62 1l8i h GLN 96 Cb 0.45 0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.93 1l8i h GLN 96 CO -0.15 -0.25 0.30 0.28 -0.95 0.00 0.00 178.83 178.06 1l8i h VAL 97 N -0.38 1.10 0.77 -0.54 2.07 -1.81 -3.14 116.25 114.32 1l8i h VAL 97 Ca -0.01 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.27 1l8i h VAL 97 Cb 0.34 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1l8i h VAL 97 CO -0.01 0.11 -0.46 0.40 0.02 0.00 0.00 177.57 177.63 1l8i h ILE 98 N 0.61 0.07 -1.51 4.57 1.08 -1.07 -2.66 117.51 118.59 1l8i h ILE 98 Ca 0.17 0.00 0.44 0.00 -0.39 0.00 0.00 64.86 65.09 1l8i h ILE 98 Cb -0.05 0.07 -0.08 0.00 -3.07 0.00 0.00 36.82 33.69 1l8i h ILE 98 CO -0.05 0.00 1.06 -1.13 -0.69 0.00 0.00 178.15 177.34 1l8i h ASN 99 N -1.15 0.08 0.00 1.72 -1.24 -1.05 0.19 115.58 114.12 1l8i h ASN 99 Ca -0.10 0.03 0.00 0.00 0.71 0.00 0.00 56.30 56.94 1l8i h ASN 99 Cb 0.92 0.02 0.00 0.00 0.73 0.00 0.00 38.32 40.00 1l8i h ASN 99 CO 0.11 -0.03 0.00 -1.54 -1.29 0.00 0.00 177.43 174.68 1l8i n SER 100 N -4.21 0.00 0.34 1.15 3.41 -1.16 -4.56 113.62 108.58 1l8i n SER 100 Ca 0.35 0.28 0.23 0.00 -0.26 0.00 0.00 58.87 59.46 1l8i n SER 100 Cb 1.56 -0.46 1.22 0.00 -0.26 0.00 0.00 64.21 66.26 1l8i n SER 100 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1l8i h LYS 101 N 0.00 0.00 -6.36 4.33 1.79 -1.34 -3.45 116.57 111.54 1l8i h LYS 101 Ca 0.00 0.00 -0.63 0.00 -2.18 0.00 0.00 60.65 57.84 1l8i h LYS 101 Cb 0.00 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 30.69 1l8i h LYS 101 CO 0.00 0.00 0.80 -2.37 -1.08 0.00 0.00 179.45 176.80 1l8i n THR 102 N -3.09 0.17 0.81 -0.16 5.66 0.65 -4.83 114.28 113.49 1l8i n THR 102 Ca -0.03 -0.03 0.04 0.00 -3.05 0.00 0.00 64.05 60.98 1l8i n THR 102 Cb 0.07 -1.42 0.14 0.00 -1.55 0.00 0.00 70.33 67.57 1l8i n THR 102 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1l8i n PRO 103 N 4.18 1.95 -3.73 1.09 -0.04 -1.26 -4.82 135.00 132.37 1l8i n PRO 103 Ca 0.20 -1.08 -0.37 0.00 -0.04 0.00 0.00 63.50 62.20 1l8i n PRO 103 Cb 0.25 -1.42 -0.12 0.00 -0.04 0.00 0.00 33.50 32.17 1l8i n PRO 103 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1l8i s LEU 104 N -1.02 3.79 0.38 1.53 1.43 -1.26 -5.07 118.68 118.47 1l8i s LEU 104 Ca 0.20 -0.50 -0.26 0.00 -1.03 0.00 0.00 54.13 52.53 1l8i s LEU 104 Cb 0.12 -1.93 -0.11 0.00 0.03 0.00 0.00 46.19 44.30 1l8i s LEU 104 CO 0.11 -0.14 1.15 1.17 0.23 0.00 0.00 176.35 178.86 1l8i n LYS 105 N 4.92 1.71 -1.47 1.70 0.00 -1.26 -4.82 118.16 118.94 1l8i n LYS 105 Ca -0.15 0.61 -0.46 0.00 0.00 0.00 0.00 58.31 58.31 1l8i n LYS 105 Cb 0.49 -2.18 -0.02 0.00 0.00 0.00 0.00 35.03 33.33 1l8i n LYS 105 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1l8i n SER 106 N 0.60 -0.43 -4.75 3.14 2.88 -1.26 -4.91 113.62 108.88 1l8i n SER 106 Ca 0.07 1.10 -0.39 0.00 -1.33 0.00 0.00 58.87 58.32 1l8i n SER 106 Cb 0.37 -1.08 -0.05 0.00 -0.75 0.00 0.00 64.21 62.70 1l8i n SER 106 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 1l8i s TYR 107 N -1.13 3.72 0.19 0.66 6.14 -1.26 -5.01 117.35 120.67 1l8i s TYR 107 Ca 0.62 1.38 -0.32 0.00 0.64 0.00 0.00 57.07 59.39 1l8i s TYR 107 Cb -0.79 -2.74 -0.11 0.00 0.42 0.00 0.00 41.96 38.74 1l8i s TYR 107 CO 0.58 0.31 1.66 -1.25 0.64 0.00 0.00 175.55 177.49 1l8i s PRO 108 N -0.14 4.16 -0.19 4.97 0.04 -1.26 -4.89 135.00 137.69 1l8i s PRO 108 Ca 0.36 2.52 0.16 0.00 0.04 0.00 0.00 61.00 64.07 1l8i s PRO 108 Cb -0.20 -3.10 0.79 0.00 0.04 0.00 0.00 34.50 32.03 1l8i s PRO 108 CO 0.21 -0.70 1.71 1.28 0.04 0.00 0.00 177.00 179.54 1l8i n LEU 109 N 3.95 5.36 -0.00 -3.56 4.77 -1.26 -4.37 117.00 121.90 1l8i n LEU 109 Ca 0.15 -2.74 0.01 0.00 -0.03 0.00 0.00 56.01 53.39 1l8i n LEU 109 Cb 0.36 -0.65 -0.01 0.00 -2.33 0.00 0.00 43.42 40.80 1l8i n LEU 109 CO 0.63 0.71 -0.03 -0.90 -1.33 0.00 0.00 177.39 176.47 1l8i n ASP 110 N 0.82 0.30 -4.91 -1.43 5.75 -1.26 -5.06 116.55 110.76 1l8i n ASP 110 Ca 0.27 -0.50 -0.28 0.00 -0.01 0.00 0.00 54.79 54.28 1l8i n ASP 110 Cb 1.08 1.00 0.05 0.00 -1.03 0.00 0.00 41.12 42.22 1l8i n ASP 110 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1l8i s ILE 111 N -1.16 3.03 0.07 2.12 -4.36 -1.26 -5.03 121.20 114.61 1l8i s ILE 111 Ca 0.00 0.05 0.00 0.00 -0.26 0.00 0.00 60.65 60.44 1l8i s ILE 111 Cb 0.01 -3.28 0.00 0.00 1.25 0.00 0.00 42.46 40.44 1l8i s ILE 111 CO 0.05 -0.32 0.00 1.41 0.24 0.00 0.00 174.94 176.32 1l8i n HIS 112 N -2.87 -1.04 -1.67 1.37 8.25 -1.26 -4.87 115.22 113.12 1l8i n HIS 112 Ca 0.06 0.15 -0.55 0.00 -0.26 0.00 0.00 57.72 57.12 1l8i n HIS 112 Cb 0.59 0.67 -0.07 0.00 1.12 0.00 0.00 29.99 32.30 1l8i n HIS 112 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1l8i n ASN 113 N -2.71 2.28 -0.29 0.41 5.15 -1.25 -1.56 115.26 117.30 1l8i n ASN 113 Ca 0.00 1.08 0.21 0.00 -0.60 0.00 0.00 54.58 55.27 1l8i n ASN 113 Cb 0.00 -1.18 0.40 0.00 -0.53 0.00 0.00 39.78 38.47 1l8i n ASN 113 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 1l8i n VAL 114 N 4.03 -0.37 -0.21 3.44 0.31 0.82 0.41 118.33 126.76 1l8i n VAL 114 Ca 0.24 1.83 -0.05 0.00 -0.01 0.00 0.00 64.34 66.35 1l8i n VAL 114 Cb 0.16 -2.84 0.12 0.00 -0.91 0.00 0.00 33.84 30.38 1l8i n VAL 114 CO 0.00 0.00 0.00 1.56 -1.32 0.00 0.00 176.83 177.07 1l8i h GLN 115 N 0.00 1.02 -0.13 5.55 1.08 -1.86 0.64 115.11 121.41 1l8i h GLN 115 Ca 0.65 -0.20 -0.03 0.00 -1.45 0.00 0.00 58.65 57.62 1l8i h GLN 115 Cb 1.58 -0.16 -0.00 0.00 -0.05 0.00 0.00 27.48 28.85 1l8i h GLN 115 CO -0.74 0.87 -0.03 -0.44 -0.95 0.00 0.00 178.83 177.54 1l8i h ASP 116 N 0.99 0.25 -0.57 1.46 3.45 -0.38 -1.43 116.42 120.18 1l8i h ASP 116 Ca 0.22 -0.37 0.02 0.00 0.43 0.00 0.00 57.03 57.33 1l8i h ASP 116 Cb 0.27 -0.07 -0.03 0.00 -0.56 0.00 0.00 39.33 38.94 1l8i h ASP 116 CO -0.01 0.56 0.36 0.45 -1.57 0.00 0.00 179.24 179.03 1l8i h HIS 117 N -0.07 0.67 -0.15 4.55 3.86 -1.33 0.60 115.15 123.29 1l8i h HIS 117 Ca 0.03 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.31 1l8i h HIS 117 Cb 0.45 -0.22 -0.06 0.00 1.06 0.00 0.00 27.41 28.65 1l8i h HIS 117 CO 0.05 0.39 -0.21 1.25 0.86 0.00 0.00 177.93 180.28 1l8i h LEU 118 N 0.71 -0.65 0.01 2.43 5.85 -0.73 0.33 115.31 123.26 1l8i h LEU 118 Ca 0.22 0.11 0.01 0.00 0.84 0.00 0.00 57.88 59.07 1l8i h LEU 118 Cb -0.01 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1l8i h LEU 118 CO -0.08 -0.26 -0.07 0.11 -0.34 0.00 0.00 178.44 177.80 1l8i h LYS 119 N -0.26 -0.12 -0.58 1.25 1.57 -0.45 0.74 116.57 118.73 1l8i h LYS 119 Ca 0.11 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.93 1l8i h LYS 119 Cb 0.41 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 1l8i h LYS 119 CO -0.30 -0.08 0.33 1.49 -0.57 0.00 0.00 179.45 180.32 1l8i h GLU 120 N -0.13 0.62 -0.22 3.15 4.57 -0.57 -2.30 114.58 119.70 1l8i h GLU 120 Ca 0.03 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 1l8i h GLU 120 Cb 0.16 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.60 1l8i h GLU 120 CO -0.07 0.41 0.10 -0.07 -1.18 0.00 0.00 179.01 178.20 1l8i h LEU 121 N 0.64 0.29 -0.86 1.64 3.38 -0.05 -2.79 115.31 117.56 1l8i h LEU 121 Ca 0.24 -0.13 0.19 0.00 0.09 0.00 0.00 57.88 58.27 1l8i h LEU 121 Cb 0.09 -0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.65 1l8i h LEU 121 CO -0.13 0.35 0.38 0.00 0.09 0.00 0.00 178.44 179.12 1l8i h ALA 122 N 0.96 1.32 0.37 1.53 0.00 -0.43 0.29 119.26 123.30 1l8i h ALA 122 Ca 0.08 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1l8i h ALA 122 Cb 0.13 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1l8i h ALA 122 CO -0.01 -0.26 -0.18 -0.44 0.00 0.00 0.00 179.25 178.37 1l8i h ASP 123 N 0.46 -0.42 -0.59 0.00 3.45 -1.23 -0.92 116.42 117.18 1l8i h ASP 123 Ca 0.51 -0.09 0.03 0.00 0.43 0.00 0.00 57.03 57.90 1l8i h ASP 123 Cb 0.88 0.11 -0.04 0.00 -0.56 0.00 0.00 39.33 39.72 1l8i h ASP 123 CO -0.47 -0.16 0.36 0.03 -1.57 0.00 0.00 179.24 177.43 1l8i h ARG 124 N -0.69 0.68 -0.60 3.56 2.47 -1.08 -2.00 114.38 116.72 1l8i h ARG 124 Ca -0.05 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.62 1l8i h ARG 124 Cb 0.49 -0.15 -0.03 0.00 -1.65 0.00 0.00 29.97 28.62 1l8i h ARG 124 CO 0.08 0.45 0.35 1.88 0.56 0.00 0.00 179.97 183.30 1l8i h TYR 125 N 0.70 0.80 -0.96 3.04 -1.99 -0.44 -2.52 116.97 115.60 1l8i h TYR 125 Ca 0.24 -0.01 0.11 0.00 2.00 0.00 0.00 58.73 61.07 1l8i h TYR 125 Cb 0.02 -0.26 -0.08 0.00 2.00 0.00 0.00 36.73 38.42 1l8i h TYR 125 CO -0.06 0.56 0.61 0.00 -0.00 0.00 0.00 178.16 179.27 1l8i h ALA 126 N 1.17 1.58 0.63 3.88 0.00 -0.52 1.04 119.26 127.04 1l8i h ALA 126 Ca 0.21 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1l8i h ALA 126 Cb 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.59 1l8i h ALA 126 CO -0.04 0.21 -0.30 0.82 0.00 0.00 0.00 179.25 179.94 1l8i h ILE 127 N 0.95 0.36 -0.32 0.00 2.04 -0.96 0.15 117.51 119.73 1l8i h ILE 127 Ca 0.46 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 66.23 1l8i h ILE 127 Cb 0.45 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1l8i h ILE 127 CO -0.22 0.01 0.12 0.58 0.00 0.00 0.00 178.15 178.64 1l8i h VAL 128 N -0.90 1.19 -0.01 1.67 2.07 -1.17 0.05 116.25 119.15 1l8i h VAL 128 Ca -0.09 -0.60 0.03 0.00 0.82 0.00 0.00 66.70 66.87 1l8i h VAL 128 Cb 0.67 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 31.38 1l8i h VAL 128 CO 0.14 0.20 -0.34 0.00 0.02 0.00 0.00 177.57 177.60 1l8i h ALA 129 N 0.96 -0.50 -0.30 1.67 0.00 0.12 -0.83 119.26 120.38 1l8i h ALA 129 Ca 0.10 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1l8i h ALA 129 Cb 0.21 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 1l8i h ALA 129 CO -0.01 -0.85 0.07 -0.91 0.00 0.00 0.00 179.25 177.55 1l8i h ASN 130 N -0.49 0.47 0.06 0.00 -0.26 -0.60 -2.24 115.58 112.51 1l8i h ASN 130 Ca 0.06 -0.24 0.01 0.00 -0.56 0.00 0.00 56.30 55.57 1l8i h ASN 130 Cb 0.58 -0.12 -0.02 0.00 -1.06 0.00 0.00 38.32 37.69 1l8i h ASN 130 CO -0.28 0.59 -0.13 -0.78 -1.06 0.00 0.00 177.43 175.76 1l8i h ASP 131 N 0.33 -0.37 -0.61 5.81 -0.00 -0.81 -2.75 116.42 118.02 1l8i h ASP 131 Ca 0.09 0.05 -0.01 0.00 -0.00 0.00 0.00 57.03 57.16 1l8i h ASP 131 Cb 0.31 0.15 -0.03 0.00 -0.00 0.00 0.00 39.33 39.75 1l8i h ASP 131 CO 0.00 -0.19 0.33 1.62 -0.00 0.00 0.00 179.24 181.00 1l8i h VAL 132 N -0.25 1.19 -0.09 2.25 3.04 -1.14 -1.25 116.25 120.00 1l8i h VAL 132 Ca 0.03 -0.50 -0.02 0.00 -1.01 0.00 0.00 66.70 65.19 1l8i h VAL 132 Cb 0.28 0.36 -0.01 0.00 -2.01 0.00 0.00 31.29 29.91 1l8i h VAL 132 CO -0.09 0.22 -0.04 -0.09 -1.01 0.00 0.00 177.57 176.56 1l8i h ARG 133 N 0.88 0.13 0.03 4.17 2.43 -1.13 -2.44 114.38 118.45 1l8i h ARG 133 Ca 0.22 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.29 1l8i h ARG 133 Cb 0.04 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1l8i h ARG 133 CO -0.03 0.19 -0.36 0.87 -1.51 0.00 0.00 179.97 179.12 1l8i h LYS 134 N 0.13 0.19 -0.46 0.20 1.79 -1.09 -3.25 116.57 114.09 1l8i h LYS 134 Ca 0.03 -0.25 0.13 0.00 -2.18 0.00 0.00 60.65 58.39 1l8i h LYS 134 Cb 0.16 0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.88 1l8i h LYS 134 CO 0.01 1.03 0.66 0.00 -1.08 0.00 0.00 179.45 180.07 1l8i h ALA 135 N 0.17 2.18 0.63 3.86 0.00 -0.79 -1.61 119.26 123.70 1l8i h ALA 135 Ca -0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1l8i h ALA 135 Cb 1.18 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1l8i h ALA 135 CO 0.07 -0.90 -0.32 0.82 0.00 0.00 0.00 179.25 178.92 1l8i h ILE 136 N 0.00 0.34 0.00 0.00 2.04 -1.51 -1.57 117.51 116.81 1l8i h ILE 136 Ca 0.22 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.08 1l8i h ILE 136 Cb 1.54 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 1l8i h ILE 136 CO -0.00 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.76 1l8i n GLY 137 N -1.47 -1.13 0.10 5.37 0.00 -0.62 -2.20 105.19 105.25 1l8i n GLY 137 Ca -0.13 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 45.97 1l8i n GLY 137 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1l8i h GLU 138 N 0.00 0.00 -5.96 1.61 4.81 -1.34 -3.45 114.58 110.25 1l8i h GLU 138 Ca 0.00 0.00 -0.59 0.00 -0.13 0.00 0.00 59.36 58.64 1l8i h GLU 138 Cb 0.31 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.62 1l8i h GLU 138 CO 0.00 0.00 0.64 0.00 -0.73 0.00 0.00 179.01 178.92 1l8i s ALA 139 N -3.32 3.65 -0.14 2.92 0.00 -0.63 -4.94 121.76 119.30 1l8i s ALA 139 Ca 0.01 -0.01 0.15 0.00 0.00 0.00 0.00 51.96 52.11 1l8i s ALA 139 Cb 0.10 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.80 1l8i s ALA 139 CO 0.78 -1.04 1.30 0.87 0.00 0.00 0.00 175.76 177.66 1l8i h LYS 140 N 7.64 0.00 -6.41 0.00 1.57 -1.88 -3.44 116.57 114.05 1l8i h LYS 140 Ca -0.21 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.00 1l8i h LYS 140 Cb 1.08 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.32 1l8i h LYS 140 CO 0.93 0.47 0.88 0.34 -0.57 0.00 0.00 179.45 181.51 1l8i s ASP 141 N -6.31 6.83 0.19 0.86 3.68 -1.26 -4.94 116.67 115.72 1l8i s ASP 141 Ca 0.02 0.93 -0.22 0.00 2.13 0.00 0.00 52.55 55.42 1l8i s ASP 141 Cb 0.08 -2.54 0.12 0.00 -1.45 0.00 0.00 42.92 39.12 1l8i s ASP 141 CO 0.76 -0.99 1.57 0.44 0.13 0.00 0.00 175.17 177.08 1l8i h ASP 142 N 8.50 -1.42 -0.01 -0.34 3.32 -2.00 -0.53 116.42 123.93 1l8i h ASP 142 Ca -0.22 0.27 0.03 0.00 0.02 0.00 0.00 57.03 57.13 1l8i h ASP 142 Cb 1.06 0.69 -0.05 0.00 0.22 0.00 0.00 39.33 41.25 1l8i h ASP 142 CO 1.06 -0.31 -0.39 0.44 -1.72 0.00 0.00 179.24 178.32 1l8i h ASP 143 N -0.13 -1.18 -0.95 6.45 3.45 -1.98 -1.79 116.42 120.30 1l8i h ASP 143 Ca 0.24 0.15 0.11 0.00 0.43 0.00 0.00 57.03 57.96 1l8i h ASP 143 Cb 0.56 0.47 -0.07 0.00 -0.56 0.00 0.00 39.33 39.72 1l8i h ASP 143 CO -0.79 -0.43 0.61 0.74 -1.57 0.00 0.00 179.24 177.79 1l8i h THR 144 N -0.54 0.95 -0.56 0.35 2.02 -1.72 -0.47 112.91 112.93 1l8i h THR 144 Ca 0.05 -0.32 0.04 0.00 0.77 0.00 0.00 66.41 66.96 1l8i h THR 144 Cb 0.63 -0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 66.92 1l8i h THR 144 CO -0.31 0.17 0.31 0.00 0.37 0.00 0.00 175.52 176.07 1l8i h ALA 145 N 1.54 0.73 0.52 6.16 0.00 -0.38 -1.47 119.26 126.37 1l8i h ALA 145 Ca 0.45 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.35 1l8i h ALA 145 Cb 0.45 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1l8i h ALA 145 CO -0.21 -0.00 -0.32 0.22 0.00 0.00 0.00 179.25 178.94 1l8i h ASP 146 N 0.60 -0.80 -0.76 0.00 3.58 -0.32 0.29 116.42 119.02 1l8i h ASP 146 Ca 0.24 0.05 0.17 0.00 0.42 0.00 0.00 57.03 57.91 1l8i h ASP 146 Cb 0.11 0.24 -0.14 0.00 1.72 0.00 0.00 39.33 41.25 1l8i h ASP 146 CO -0.14 -0.50 -0.08 0.40 -2.88 0.00 0.00 179.24 176.04 1l8i h ILE 147 N -0.79 0.29 -0.35 2.25 2.04 -1.04 0.24 117.51 120.14 1l8i h ILE 147 Ca -0.06 -0.02 -0.08 0.00 1.00 0.00 0.00 64.86 65.70 1l8i h ILE 147 Cb 0.65 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1l8i h ILE 147 CO 0.06 0.01 -0.11 -0.07 0.00 0.00 0.00 178.15 178.04 1l8i h LEU 148 N 0.05 0.58 -0.18 1.44 3.38 -0.91 -1.91 115.31 117.76 1l8i h LEU 148 Ca 0.40 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.18 1l8i h LEU 148 Cb 0.67 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 1l8i h LEU 148 CO -0.72 0.73 0.01 0.74 0.09 0.00 0.00 178.44 179.29 1l8i h THR 149 N 0.55 1.25 -0.90 0.22 2.02 0.15 0.27 112.91 116.47 1l8i h THR 149 Ca 0.10 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 1l8i h THR 149 Cb 0.52 1.44 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 1l8i h THR 149 CO 0.03 0.25 0.54 0.00 0.37 0.00 0.00 175.52 176.71 1l8i h ALA 150 N 0.79 1.15 -0.11 6.16 0.00 -0.93 0.78 119.26 127.10 1l8i h ALA 150 Ca 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1l8i h ALA 150 Cb 0.37 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1l8i h ALA 150 CO 0.01 0.61 0.01 0.00 0.00 0.00 0.00 179.25 179.88 1l8i h ALA 151 N 1.29 0.15 -0.25 0.00 0.00 -1.07 -2.85 119.26 116.53 1l8i h ALA 151 Ca 0.32 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1l8i h ALA 151 Cb -0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1l8i h ALA 151 CO -0.06 -0.19 0.09 1.03 0.00 0.00 0.00 179.25 180.12 1l8i h SER 152 N -0.06 0.11 -0.90 0.00 0.87 -0.12 -1.36 113.55 112.09 1l8i h SER 152 Ca 0.03 0.02 0.23 0.00 -1.23 0.00 0.00 61.79 60.85 1l8i h SER 152 Cb 0.31 0.01 -0.13 0.00 -0.44 0.00 0.00 62.40 62.15 1l8i h SER 152 CO 0.00 0.10 0.39 -0.09 -0.53 0.00 0.00 176.83 176.69 1l8i h ARG 153 N 0.21 0.35 -0.05 2.24 2.43 -0.78 0.60 114.38 119.39 1l8i h ARG 153 Ca 0.11 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.23 1l8i h ARG 153 Cb 0.07 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1l8i h ARG 153 CO -0.10 0.23 -0.08 -0.44 -1.51 0.00 0.00 179.97 178.07 1l8i h ASP 154 N 0.36 0.15 -0.90 -3.80 3.45 -1.13 -3.10 116.42 111.45 1l8i h ASP 154 Ca 0.57 -0.54 0.03 0.00 0.43 0.00 0.00 57.03 57.52 1l8i h ASP 154 Cb 1.12 -0.04 -0.05 0.00 -0.56 0.00 0.00 39.33 39.80 1l8i h ASP 154 CO -0.55 0.66 0.59 -0.07 -1.57 0.00 0.00 179.24 178.30 1l8i h LEU 155 N -0.36 0.98 -1.50 1.55 4.07 -0.04 0.77 115.31 120.78 1l8i h LEU 155 Ca 0.00 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.90 1l8i h LEU 155 Cb 0.63 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 1l8i h LEU 155 CO 0.02 0.67 -0.25 0.44 -1.08 0.00 0.00 178.44 178.24 1l8i h ASP 156 N 1.13 0.00 -0.04 -0.43 3.45 -1.02 -0.16 116.42 119.35 1l8i h ASP 156 Ca 0.36 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.70 1l8i h ASP 156 Cb 0.01 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 38.79 1l8i h ASP 156 CO -0.11 0.25 -0.42 0.50 -1.57 0.00 0.00 179.24 177.89 1l8i h LYS 157 N 0.00 0.37 0.06 3.56 3.64 -1.02 -2.54 116.57 120.63 1l8i h LYS 157 Ca -0.00 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1l8i h LYS 157 Cb 0.51 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1l8i h LYS 157 CO 0.03 0.99 -0.06 0.74 -2.27 0.00 0.00 179.45 178.89 1l8i h PHE 158 N -0.14 -0.15 -0.51 1.91 0.05 -0.56 -0.49 116.94 117.05 1l8i h PHE 158 Ca -0.04 0.00 0.10 0.00 3.82 0.00 0.00 57.97 61.85 1l8i h PHE 158 Cb 1.11 0.06 -0.08 0.00 2.00 0.00 0.00 35.95 39.03 1l8i h PHE 158 CO 0.14 -0.09 0.02 1.25 -0.18 0.00 0.00 178.31 179.45 1l8i h LEU 159 N -0.13 -0.18 -0.57 1.54 5.85 -1.10 0.14 115.31 120.86 1l8i h LEU 159 Ca 0.00 0.12 0.05 0.00 0.84 0.00 0.00 57.88 58.89 1l8i h LEU 159 Cb 0.13 0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 1l8i h LEU 159 CO -0.02 -0.06 0.31 -0.25 -0.34 0.00 0.00 178.44 178.08 1l8i h TRP 160 N 0.14 0.56 -0.23 1.25 7.01 -0.99 0.11 115.95 123.79 1l8i h TRP 160 Ca 0.26 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.26 1l8i h TRP 160 Cb 0.38 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.26 1l8i h TRP 160 CO -0.30 0.28 0.09 0.74 -2.79 0.00 0.00 178.44 176.46 1l8i h PHE 161 N 0.59 0.35 0.55 2.65 0.05 0.33 0.33 116.94 121.78 1l8i h PHE 161 Ca 0.25 -0.03 -0.02 0.00 3.82 0.00 0.00 57.97 62.00 1l8i h PHE 161 Cb 0.14 -0.11 -0.01 0.00 2.00 0.00 0.00 35.95 37.97 1l8i h PHE 161 CO -0.09 0.39 -0.40 0.82 -0.18 0.00 0.00 178.31 178.85 1l8i h ILE 162 N 0.22 0.19 -0.87 -0.55 2.04 -0.38 -2.81 117.51 115.37 1l8i h ILE 162 Ca 0.08 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.09 1l8i h ILE 162 Cb 0.18 0.19 -0.10 0.00 -0.74 0.00 0.00 36.82 36.36 1l8i h ILE 162 CO -0.01 0.00 0.45 -0.33 0.00 0.00 0.00 178.15 178.26 1l8i h GLU 163 N -0.92 0.60 0.00 2.37 5.08 -0.71 -1.31 114.58 119.69 1l8i h GLU 163 Ca -0.06 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1l8i h GLU 163 Cb 0.77 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1l8i h GLU 163 CO 0.02 0.40 0.00 0.77 -1.00 0.00 0.00 179.01 179.20 1l8i h SER 164 N 0.62 0.00 0.45 1.42 0.02 -0.68 -1.93 113.55 113.45 1l8i h SER 164 Ca 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.43 1l8i h SER 164 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1l8i h SER 164 CO -0.37 0.00 -0.42 0.59 -1.14 0.00 0.00 176.83 175.49 1l8i n ASN 165 N -2.58 0.61 -4.69 3.07 4.13 -0.50 -4.83 115.26 110.47 1l8i n ASN 165 Ca 0.00 -0.39 -0.42 0.00 1.68 0.00 0.00 54.58 55.45 1l8i n ASN 165 Cb 0.17 0.19 -0.03 0.00 -1.54 0.00 0.00 39.78 38.58 1l8i n ASN 165 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1l8i s ILE 166 N -2.86 4.53 -2.00 2.41 1.01 -0.73 -5.01 121.20 118.55 1l8i s ILE 166 Ca 0.15 1.82 0.11 0.00 0.00 0.00 0.00 60.65 62.73 1l8i s ILE 166 Cb 0.18 -4.17 0.30 0.00 0.01 0.00 0.00 42.46 38.78 1l8i s ILE 166 CO 0.65 0.01 1.08 -0.62 0.00 0.00 0.00 174.94 176.06