#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l8h s LEU 14 N 0.00 2.09 0.39 -4.53 1.02 -1.26 -4.76 118.68 111.63 1l8h s LEU 14 Ca 0.00 -0.22 -0.02 0.00 0.02 0.00 0.00 54.13 53.91 1l8h s LEU 14 Cb 0.00 -0.07 -0.04 0.00 0.02 0.00 0.00 46.19 46.11 1l8h s LEU 14 CO 0.00 -0.08 0.64 -0.76 0.02 0.00 0.00 176.35 176.16 1l8h s LEU 15 N -0.60 3.88 0.14 1.79 2.01 -0.92 -5.06 118.68 119.93 1l8h s LEU 15 Ca -0.05 0.65 -0.30 0.00 0.01 0.00 0.00 54.13 54.45 1l8h s LEU 15 Cb -0.04 -3.55 -0.07 0.00 0.01 0.00 0.00 46.19 42.55 1l8h s LEU 15 CO -0.00 -0.39 0.95 -0.47 1.01 0.00 0.00 176.35 177.45 1l8h s TYR 16 N -2.45 3.86 -0.23 0.29 6.04 -1.26 -4.62 117.35 118.98 1l8h s TYR 16 Ca 0.43 1.82 -0.19 0.00 0.04 0.00 0.00 57.07 59.17 1l8h s TYR 16 Cb -0.10 -3.03 0.06 0.00 -1.04 0.00 0.00 41.96 37.86 1l8h s TYR 16 CO 0.39 0.28 0.60 -0.08 -1.54 0.00 0.00 175.55 175.19 1l8h s THR 17 N -0.33 -0.00 -2.00 4.34 -1.32 -1.26 -4.99 115.64 110.08 1l8h s THR 17 Ca 0.45 0.01 0.09 0.00 -1.21 0.00 0.00 61.69 61.03 1l8h s THR 17 Cb -0.24 -0.84 0.25 0.00 -1.51 0.00 0.00 72.50 70.15 1l8h s THR 17 CO 0.30 0.00 0.94 0.54 -2.21 0.00 0.00 174.62 174.20 1l8h n ARG 18 N 3.14 0.31 -1.74 7.08 1.74 -1.26 -4.64 116.66 121.29 1l8h n ARG 18 Ca -0.16 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.51 1l8h n ARG 18 Cb 0.56 -1.43 -0.03 0.00 -1.02 0.00 0.00 32.46 30.54 1l8h n ARG 18 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1l8h s ASN 19 N -1.96 5.33 0.00 0.55 3.84 -1.26 -4.85 114.94 116.60 1l8h s ASN 19 Ca 0.13 1.41 0.00 0.00 0.21 0.00 0.00 52.86 54.61 1l8h s ASN 19 Cb 0.06 -2.51 0.00 0.00 -0.55 0.00 0.00 41.25 38.25 1l8h s ASN 19 CO 0.10 -2.13 1.32 -0.90 -2.79 0.00 0.00 177.10 172.70 1l8h n ASP 20 N 12.32 3.56 -4.77 -4.21 5.75 -1.26 -4.84 116.55 123.10 1l8h n ASP 20 Ca 0.28 -1.92 -0.36 0.00 -0.01 0.00 0.00 54.79 52.78 1l8h n ASP 20 Cb 0.48 -0.74 -0.08 0.00 -1.03 0.00 0.00 41.12 39.75 1l8h n ASP 20 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 1l8h s VAL 21 N 0.59 5.08 0.12 2.12 -7.23 -1.26 -5.04 120.40 114.78 1l8h s VAL 21 Ca 0.00 0.05 -0.34 0.00 -1.81 0.00 0.00 61.98 59.88 1l8h s VAL 21 Cb 0.00 -3.22 -0.18 0.00 0.56 0.00 0.00 36.38 33.54 1l8h s VAL 21 CO 0.00 0.57 0.93 -1.54 -0.31 0.00 0.00 175.10 174.75 1l8h n SER 22 N 2.49 0.05 0.27 4.85 3.41 -1.26 -4.64 113.62 118.79 1l8h n SER 22 Ca -0.19 1.15 0.17 0.00 -0.26 0.00 0.00 58.87 59.74 1l8h n SER 22 Cb 0.54 -1.03 0.94 0.00 -0.26 0.00 0.00 64.21 64.40 1l8h n SER 22 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1l8h h ASP 23 N 2.50 0.00 0.69 4.04 5.19 -1.96 0.34 116.42 127.22 1l8h h ASP 23 Ca -0.41 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 55.96 1l8h h ASP 23 Cb 1.40 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.92 1l8h h ASP 23 CO 0.64 0.00 -0.33 -1.28 -3.12 0.00 0.00 179.24 175.15 1l8h h SER 24 N 0.00 -0.79 -0.46 6.45 0.87 -1.99 -0.73 113.55 116.90 1l8h h SER 24 Ca 0.03 0.03 -0.13 0.00 -1.23 0.00 0.00 61.79 60.50 1l8h h SER 24 Cb 0.25 0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1l8h h SER 24 CO -0.00 -0.54 -0.21 -0.33 -0.53 0.00 0.00 176.83 175.22 1l8h h GLU 25 N -0.98 0.95 -0.08 2.24 5.08 -1.73 0.66 114.58 120.71 1l8h h GLU 25 Ca -0.10 -0.41 0.03 0.00 -1.00 0.00 0.00 59.36 57.88 1l8h h GLU 25 Cb 0.72 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 29.87 1l8h h GLU 25 CO 0.16 1.07 -0.54 0.87 -1.00 0.00 0.00 179.01 179.57 1l8h h LYS 26 N 0.80 -0.59 -0.17 2.33 1.57 -0.39 1.58 116.57 121.69 1l8h h LYS 26 Ca 0.10 0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.98 1l8h h LYS 26 Cb 0.78 0.14 -0.07 0.00 0.08 0.00 0.00 32.23 33.16 1l8h h LYS 26 CO 0.06 -0.40 -0.32 0.87 -0.57 0.00 0.00 179.45 179.09 1l8h h LYS 27 N -0.62 -0.36 -0.12 3.15 1.57 -1.04 -0.69 116.57 118.47 1l8h h LYS 27 Ca 0.03 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.88 1l8h h LYS 27 Cb 0.70 0.08 -0.06 0.00 0.08 0.00 0.00 32.23 33.03 1l8h h LYS 27 CO -0.41 -0.24 -0.26 0.00 -0.57 0.00 0.00 179.45 177.98 1l8h h ALA 28 N 0.47 -0.26 0.42 3.86 0.00 0.16 -2.86 119.26 121.05 1l8h h ALA 28 Ca 0.11 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1l8h h ALA 28 Cb 0.54 0.49 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1l8h h ALA 28 CO -0.38 -0.72 -0.23 1.15 0.00 0.00 0.00 179.25 179.06 1l8h h THR 29 N -0.33 0.52 -1.01 0.00 2.02 0.26 -2.26 112.91 112.10 1l8h h THR 29 Ca 0.10 0.00 0.29 0.00 0.77 0.00 0.00 66.41 67.57 1l8h h THR 29 Cb 0.48 0.52 -0.04 0.00 -1.74 0.00 0.00 68.15 67.36 1l8h h THR 29 CO -0.31 0.00 0.87 0.58 0.37 0.00 0.00 175.52 177.03 1l8h h VAL 30 N -0.61 0.28 0.03 3.16 2.07 -1.00 0.45 116.25 120.61 1l8h h VAL 30 Ca -0.05 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.47 1l8h h VAL 30 Cb 0.49 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 1l8h h VAL 30 CO 0.07 0.00 -0.01 -0.33 0.02 0.00 0.00 177.57 177.31 1l8h h GLU 31 N 0.00 -0.03 -0.31 1.57 4.39 -1.19 -1.25 114.58 117.75 1l8h h GLU 31 Ca 0.48 0.00 0.02 0.00 0.34 0.00 0.00 59.36 60.20 1l8h h GLU 31 Cb 2.22 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 30.85 1l8h h GLU 31 CO -0.01 0.62 0.16 1.25 -1.16 0.00 0.00 179.01 179.88 1l8h h LEU 32 N -0.73 0.25 0.82 1.33 5.85 0.04 -1.67 115.31 121.19 1l8h h LEU 32 Ca -0.00 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 1l8h h LEU 32 Cb 0.67 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.66 1l8h h LEU 32 CO 0.01 0.19 -0.39 -0.07 -0.34 0.00 0.00 178.44 177.83 1l8h h LEU 33 N 0.34 -0.93 -2.04 2.25 4.07 -0.65 -2.63 115.31 115.72 1l8h h LEU 33 Ca 0.13 0.02 0.11 0.00 0.08 0.00 0.00 57.88 58.22 1l8h h LEU 33 Cb 0.03 0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 1l8h h LEU 33 CO -0.08 -0.61 0.38 0.78 -1.08 0.00 0.00 178.44 177.83 1l8h h ASN 34 N -1.19 0.00 0.14 -0.43 2.35 -1.21 0.75 115.58 116.00 1l8h h ASN 34 Ca -0.11 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 1l8h h ASN 34 Cb 0.85 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.22 1l8h h ASN 34 CO 0.18 0.00 -0.07 -0.09 -1.65 0.00 0.00 177.43 175.81 1l8h h ARG 35 N 0.00 -0.18 -0.10 0.81 2.43 -0.95 -2.68 114.38 113.71 1l8h h ARG 35 Ca 0.18 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1l8h h ARG 35 Cb 0.94 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1l8h h ARG 35 CO -0.00 0.06 0.06 1.96 -1.51 0.00 0.00 179.97 180.54 1l8h h GLN 36 N -0.40 0.13 -0.62 0.20 1.08 -0.62 -2.58 115.11 112.30 1l8h h GLN 36 Ca -0.02 -0.01 0.12 0.00 -1.45 0.00 0.00 58.65 57.29 1l8h h GLN 36 Cb 0.32 -0.03 -0.12 0.00 -0.05 0.00 0.00 27.48 27.61 1l8h h GLN 36 CO 0.03 0.14 -0.19 0.28 -0.95 0.00 0.00 178.83 178.14 1l8h h VAL 37 N 0.09 0.33 0.13 -0.54 2.07 -1.16 0.40 116.25 117.57 1l8h h VAL 37 Ca 0.03 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.57 1l8h h VAL 37 Cb 0.05 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 30.10 1l8h h VAL 37 CO -0.01 0.00 -0.40 0.40 0.02 0.00 0.00 177.57 177.58 1l8h h ILE 38 N -0.04 0.18 -0.40 4.57 1.08 -1.27 0.15 117.51 121.78 1l8h h ILE 38 Ca 0.29 0.00 0.08 0.00 -0.39 0.00 0.00 64.86 64.84 1l8h h ILE 38 Cb 0.48 0.18 -0.07 0.00 -3.07 0.00 0.00 36.82 34.35 1l8h h ILE 38 CO -0.65 0.00 -0.03 -0.61 -0.69 0.00 0.00 178.15 176.17 1l8h h GLN 39 N -0.64 0.07 0.11 2.37 4.15 -0.78 -1.54 115.11 118.84 1l8h h GLN 39 Ca 0.02 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.43 1l8h h GLN 39 Cb 0.67 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.34 1l8h h GLN 39 CO -0.23 0.05 -0.05 0.74 -1.93 0.00 0.00 178.83 177.40 1l8h h PHE 40 N 0.07 -0.14 -0.53 3.99 -1.00 0.08 -1.02 116.94 118.39 1l8h h PHE 40 Ca 0.20 -0.00 0.11 0.00 2.81 0.00 0.00 57.97 61.08 1l8h h PHE 40 Cb 0.29 0.05 -0.10 0.00 3.61 0.00 0.00 35.95 39.80 1l8h h PHE 40 CO -0.30 0.06 -0.11 0.82 -1.61 0.00 0.00 178.31 177.18 1l8h h ILE 41 N -0.32 0.49 0.42 -0.55 2.04 -0.41 0.26 117.51 119.44 1l8h h ILE 41 Ca -0.02 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.82 1l8h h ILE 41 Cb 0.26 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1l8h h ILE 41 CO 0.03 0.00 -0.20 -0.78 0.00 0.00 0.00 178.15 177.20 1l8h h ASP 42 N 0.02 -0.48 -1.09 1.72 3.58 -1.15 -2.23 116.42 116.79 1l8h h ASP 42 Ca 0.26 -0.01 0.30 0.00 0.42 0.00 0.00 57.03 58.00 1l8h h ASP 42 Cb 0.39 0.12 -0.08 0.00 1.72 0.00 0.00 39.33 41.49 1l8h h ASP 42 CO -0.53 -0.31 0.74 0.25 -2.88 0.00 0.00 179.24 176.51 1l8h h LEU 43 N -0.61 0.26 -0.17 2.28 5.85 -0.17 0.10 115.31 122.85 1l8h h LEU 43 Ca -0.06 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.63 1l8h h LEU 43 Cb 0.46 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 1l8h h LEU 43 CO 0.09 0.04 -0.21 0.77 -0.34 0.00 0.00 178.44 178.80 1l8h h SER 44 N 0.23 0.48 -0.12 1.25 4.64 -0.40 -1.57 113.55 118.07 1l8h h SER 44 Ca 0.59 -0.50 -0.05 0.00 -0.47 0.00 0.00 61.79 61.35 1l8h h SER 44 Cb 1.82 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.76 1l8h h SER 44 CO -0.19 0.89 -0.08 -0.07 -0.87 0.00 0.00 176.83 176.51 1l8h h LEU 45 N 0.09 0.39 -0.33 5.97 4.07 -0.49 -1.93 115.31 123.09 1l8h h LEU 45 Ca 0.02 -0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.90 1l8h h LEU 45 Cb 0.77 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 42.39 1l8h h LEU 45 CO 0.05 0.52 0.22 0.40 -1.08 0.00 0.00 178.44 178.54 1l8h h ILE 46 N 0.39 1.09 -0.29 1.22 1.08 -0.88 -0.31 117.51 119.81 1l8h h ILE 46 Ca 0.08 -0.17 0.01 0.00 -0.39 0.00 0.00 64.86 64.39 1l8h h ILE 46 Cb 0.39 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 34.73 1l8h h ILE 46 CO 0.02 0.09 0.17 0.74 -0.69 0.00 0.00 178.15 178.48 1l8h h THR 47 N 0.44 1.04 -1.00 -0.27 2.02 -0.60 -0.53 112.91 114.01 1l8h h THR 47 Ca 0.12 -0.12 0.02 0.00 0.77 0.00 0.00 66.41 67.20 1l8h h THR 47 Cb -0.04 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 66.97 1l8h h THR 47 CO -0.03 0.06 0.66 0.11 0.37 0.00 0.00 175.52 176.70 1l8h h LYS 48 N 0.35 1.28 0.33 6.66 1.79 -1.01 0.43 116.57 126.40 1l8h h LYS 48 Ca 0.11 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1l8h h LYS 48 Cb -0.01 -0.29 -0.02 0.00 -1.58 0.00 0.00 32.23 30.33 1l8h h LYS 48 CO -0.05 0.85 -0.34 0.37 -1.08 0.00 0.00 179.45 179.20 1l8h h GLN 49 N 1.32 -0.67 0.22 3.15 5.75 -0.21 0.52 115.11 125.19 1l8h h GLN 49 Ca 0.38 0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.93 1l8h h GLN 49 Cb -0.09 0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.60 1l8h h GLN 49 CO -0.10 -0.45 -0.19 0.00 -2.65 0.00 0.00 178.83 175.45 1l8h h ALA 50 N -0.19 -0.40 -0.76 3.38 0.00 -0.65 -2.63 119.26 118.00 1l8h h ALA 50 Ca -0.02 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.90 1l8h h ALA 50 Cb 0.63 0.25 -0.09 0.00 0.00 0.00 0.00 17.79 18.59 1l8h h ALA 50 CO -0.07 -0.75 -0.45 1.58 0.00 0.00 0.00 179.25 179.56 1l8h n HIS 51 N -5.31 -0.34 0.03 0.00 -0.00 0.15 -2.50 115.22 107.25 1l8h n HIS 51 Ca -0.08 0.95 -0.12 0.00 -0.00 0.00 0.00 57.72 58.47 1l8h n HIS 51 Cb 0.22 -0.56 -0.07 0.00 -0.00 0.00 0.00 29.99 29.59 1l8h n HIS 51 CO 0.00 0.00 0.00 -1.49 -0.00 0.00 0.00 176.34 174.85 1l8h h TRP 52 N 0.00 -0.02 -1.74 1.57 6.55 -0.77 -3.32 115.95 118.23 1l8h h TRP 52 Ca 0.12 0.00 -0.70 0.00 0.95 0.00 0.00 58.89 59.26 1l8h h TRP 52 Cb 0.31 0.01 -0.24 0.00 -0.86 0.00 0.00 29.16 28.39 1l8h h TRP 52 CO -0.97 -0.01 0.96 0.09 -1.05 0.00 0.00 178.44 177.45 1l8h n ASN 53 N -5.10 7.26 -4.05 -3.49 3.02 -1.00 -4.94 115.26 106.96 1l8h n ASN 53 Ca -0.07 -3.62 -0.24 0.00 -0.03 0.00 0.00 54.58 50.63 1l8h n ASN 53 Cb 0.04 -1.14 -0.16 0.00 -0.61 0.00 0.00 39.78 37.91 1l8h n ASN 53 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1l8h s MET 54 N -3.33 1.51 0.25 3.52 0.23 -1.19 -4.52 119.30 115.78 1l8h s MET 54 Ca 0.52 -0.44 0.04 0.00 -1.03 0.00 0.00 55.69 54.78 1l8h s MET 54 Cb 0.38 -1.31 -0.05 0.00 -1.53 0.00 0.00 34.83 32.32 1l8h s MET 54 CO -0.32 0.11 -0.00 1.03 -2.03 0.00 0.00 175.02 173.82 1l8h s ARG 55 N 0.35 1.40 0.00 3.16 0.52 -0.46 -4.92 118.95 119.01 1l8h s ARG 55 Ca -0.08 -1.72 0.00 0.00 -0.52 0.00 0.00 55.73 53.41 1l8h s ARG 55 Cb -0.13 -0.70 0.00 0.00 0.52 0.00 0.00 34.95 34.64 1l8h s ARG 55 CO 0.02 -0.09 0.00 0.41 0.02 0.00 0.00 175.30 175.66 1l8h n GLY 56 N -0.47 0.53 3.78 -3.53 0.00 -1.26 -0.86 105.19 103.38 1l8h n GLY 56 Ca -0.05 -2.18 -0.38 0.00 0.00 0.00 0.00 46.02 43.42 1l8h n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l8h s ALA 57 N -1.88 3.32 -1.69 4.61 0.00 -1.26 -3.64 121.76 121.22 1l8h s ALA 57 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 51.96 52.38 1l8h s ALA 57 Cb 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 20.06 1l8h s ALA 57 CO 0.00 0.24 0.00 -1.71 0.00 0.00 0.00 175.76 174.29 1l8h n ASN 58 N 0.92 -5.23 0.31 0.00 5.15 -1.26 -4.83 115.26 110.33 1l8h n ASN 58 Ca -0.01 0.17 -0.14 0.00 -0.60 0.00 0.00 54.58 54.00 1l8h n ASN 58 Cb 0.50 -4.30 -0.07 0.00 -0.53 0.00 0.00 39.78 35.37 1l8h n ASN 58 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 1l8h h PHE 59 N 0.00 -0.94 -0.41 1.20 3.04 -1.93 -2.64 116.94 115.26 1l8h h PHE 59 Ca -0.41 -0.01 0.09 0.00 3.98 0.00 0.00 57.97 61.62 1l8h h PHE 59 Cb 1.26 0.33 -0.09 0.00 2.56 0.00 0.00 35.95 40.02 1l8h h PHE 59 CO 0.49 -0.52 -0.20 0.97 -2.02 0.00 0.00 178.31 177.03 1l8h h ILE 60 N -0.86 0.41 -0.17 1.41 6.09 -1.91 1.51 117.51 123.98 1l8h h ILE 60 Ca -0.08 0.00 0.05 0.00 -1.37 0.00 0.00 64.86 63.46 1l8h h ILE 60 Cb 0.69 0.41 -0.05 0.00 0.47 0.00 0.00 36.82 38.33 1l8h h ILE 60 CO 0.08 0.00 -0.18 0.00 -3.07 0.00 0.00 178.15 174.98 1l8h h ALA 61 N 1.15 -0.08 -0.27 0.18 0.00 -1.98 -0.39 119.26 117.87 1l8h h ALA 61 Ca 0.20 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.04 1l8h h ALA 61 Cb 0.43 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1l8h h ALA 61 CO -0.49 -0.62 -0.33 0.28 0.00 0.00 0.00 179.25 178.09 1l8h h VAL 62 N -0.20 1.31 -0.61 0.00 2.07 -1.04 0.74 116.25 118.51 1l8h h VAL 62 Ca 0.11 -1.52 0.13 0.00 0.82 0.00 0.00 66.70 66.24 1l8h h VAL 62 Cb 0.37 1.65 -0.10 0.00 -1.52 0.00 0.00 31.29 31.69 1l8h h VAL 62 CO -0.29 0.48 -0.01 -0.74 0.02 0.00 0.00 177.57 177.03 1l8h h HIS 63 N 0.43 -0.07 -0.02 1.57 6.17 0.25 0.50 115.15 123.99 1l8h h HIS 63 Ca 0.03 0.05 -0.02 0.00 0.71 0.00 0.00 60.37 61.14 1l8h h HIS 63 Cb 0.91 0.13 0.00 0.00 2.52 0.00 0.00 27.41 30.97 1l8h h HIS 63 CO 0.08 -0.17 -0.07 0.93 0.71 0.00 0.00 177.93 179.40 1l8h h GLU 64 N 0.10 0.07 -0.88 5.26 5.08 -1.01 -3.20 114.58 120.00 1l8h h GLU 64 Ca 0.32 -0.06 0.23 0.00 -1.00 0.00 0.00 59.36 58.85 1l8h h GLU 64 Cb 0.51 0.01 -0.14 0.00 0.50 0.00 0.00 28.75 29.64 1l8h h GLU 64 CO -0.53 0.72 0.30 1.98 -1.00 0.00 0.00 179.01 180.47 1l8h h MET 65 N -0.55 0.26 -0.25 2.33 4.05 -0.17 0.16 114.93 120.75 1l8h h MET 65 Ca -0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1l8h h MET 65 Cb 0.73 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.46 1l8h h MET 65 CO 0.01 0.17 0.16 -0.07 0.23 0.00 0.00 176.91 177.41 1l8h h LEU 66 N 0.27 0.30 -1.48 3.39 4.07 -0.98 -1.88 115.31 118.99 1l8h h LEU 66 Ca 0.56 -0.03 0.17 0.00 0.08 0.00 0.00 57.88 58.66 1l8h h LEU 66 Cb 1.12 -0.07 -0.06 0.00 1.08 0.00 0.00 40.66 42.73 1l8h h LEU 66 CO -0.61 0.24 0.56 -0.78 -1.08 0.00 0.00 178.44 176.77 1l8h h ASP 67 N 0.33 0.46 -0.25 -0.43 1.82 -0.71 0.12 116.42 117.75 1l8h h ASP 67 Ca 0.09 0.04 -0.01 0.00 -0.39 0.00 0.00 57.03 56.76 1l8h h ASP 67 Cb -0.01 -0.05 -0.01 0.00 0.68 0.00 0.00 39.33 39.94 1l8h h ASP 67 CO -0.02 0.21 0.13 1.23 -1.61 0.00 0.00 179.24 179.18 1l8h h GLY 68 N 0.47 0.38 0.83 -0.78 0.00 -0.65 -2.89 103.07 100.44 1l8h h GLY 68 Ca 0.44 -0.18 0.01 0.00 0.00 0.00 0.00 47.33 47.60 1l8h h GLY 68 CO -0.17 0.17 -0.12 0.74 0.00 0.00 0.00 176.54 177.16 1l8h h PHE 69 N 0.29 -0.31 -0.98 5.60 0.04 -0.52 -2.60 116.94 118.45 1l8h h PHE 69 Ca 0.09 0.00 0.23 0.00 2.80 0.00 0.00 57.97 61.09 1l8h h PHE 69 Cb 0.08 0.12 -0.18 0.00 2.20 0.00 0.00 35.95 38.17 1l8h h PHE 69 CO -0.03 -0.18 -0.12 -0.09 -0.60 0.00 0.00 178.31 177.28 1l8h h ARG 70 N -0.26 0.00 -0.56 1.51 2.43 -1.13 0.76 114.38 117.13 1l8h h ARG 70 Ca 0.01 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1l8h h ARG 70 Cb 0.25 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.78 1l8h h ARG 70 CO -0.04 0.00 0.35 1.15 -1.51 0.00 0.00 179.97 179.92 1l8h h THR 71 N 0.00 1.16 -0.62 0.20 2.02 -1.27 -1.34 112.91 113.07 1l8h h THR 71 Ca 0.53 -0.34 -0.09 0.00 0.77 0.00 0.00 66.41 67.28 1l8h h THR 71 Cb 0.95 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1l8h h THR 71 CO -0.97 0.16 0.03 0.00 0.37 0.00 0.00 175.52 175.11 1l8h h ALA 72 N 1.18 0.83 0.38 6.16 0.00 0.50 -2.39 119.26 125.92 1l8h h ALA 72 Ca 0.20 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1l8h h ALA 72 Cb -0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1l8h h ALA 72 CO -0.04 0.65 -0.37 -0.07 0.00 0.00 0.00 179.25 179.42 1l8h h LEU 73 N 0.98 -1.00 -0.60 0.00 4.07 0.04 -2.34 115.31 116.45 1l8h h LEU 73 Ca 0.18 0.08 0.12 0.00 0.08 0.00 0.00 57.88 58.35 1l8h h LEU 73 Cb 0.53 0.33 -0.10 0.00 1.08 0.00 0.00 40.66 42.50 1l8h h LEU 73 CO 0.03 -0.52 -0.02 0.40 -1.08 0.00 0.00 178.44 177.25 1l8h h ILE 74 N -0.77 0.49 0.23 1.22 1.08 -1.11 0.54 117.51 119.20 1l8h h ILE 74 Ca -0.03 -0.03 -0.00 0.00 -0.39 0.00 0.00 64.86 64.40 1l8h h ILE 74 Cb 0.69 0.38 -0.02 0.00 -3.07 0.00 0.00 36.82 34.80 1l8h h ILE 74 CO -0.06 0.02 -0.37 0.00 -0.69 0.00 0.00 178.15 177.05 1l8h h HIS 76 N -0.64 -1.12 -0.74 0.00 3.86 -1.07 -0.32 115.15 115.11 1l8h h HIS 76 Ca -0.03 0.03 0.07 0.00 -1.16 0.00 0.00 60.37 59.28 1l8h h HIS 76 Cb 0.59 0.49 -0.09 0.00 1.06 0.00 0.00 27.41 29.46 1l8h h HIS 76 CO -0.30 -0.49 -0.44 -0.11 0.86 0.00 0.00 177.93 177.45 1l8h n LEU 77 N -5.45 -0.79 -0.25 2.43 0.00 0.15 0.41 117.00 113.50 1l8h n LEU 77 Ca -0.06 1.38 -0.02 0.00 0.00 0.00 0.00 56.01 57.30 1l8h n LEU 77 Cb 0.37 -0.20 0.17 0.00 0.00 0.00 0.00 43.42 43.76 1l8h n LEU 77 CO 0.18 -1.10 1.16 0.00 0.00 0.00 0.00 177.39 177.63 1l8h h ALA 78 N 0.32 1.29 -0.82 1.96 0.00 -0.16 -0.87 119.26 120.96 1l8h h ALA 78 Ca 0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1l8h h ALA 78 Cb 0.30 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1l8h h ALA 78 CO -0.70 0.58 0.51 1.15 0.00 0.00 0.00 179.25 180.80 1l8h h THR 79 N 1.09 1.23 0.09 0.00 2.02 0.17 0.28 112.91 117.79 1l8h h THR 79 Ca 0.28 -0.47 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 1l8h h THR 79 Cb 0.02 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.48 1l8h h THR 79 CO -0.05 0.23 -0.04 0.24 0.37 0.00 0.00 175.52 176.27 1l8h h MET 80 N 1.13 -0.11 -0.55 6.66 2.86 -0.19 -1.44 114.93 123.29 1l8h h MET 80 Ca 0.30 0.01 0.11 0.00 -2.06 0.00 0.00 59.70 58.05 1l8h h MET 80 Cb -0.07 0.03 -0.11 0.00 0.06 0.00 0.00 31.60 31.51 1l8h h MET 80 CO -0.06 0.18 -0.24 0.00 1.06 0.00 0.00 176.91 177.85 1l8h h ALA 81 N 0.47 0.13 -0.83 6.32 0.00 -0.55 0.13 119.26 124.93 1l8h h ALA 81 Ca -0.01 0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1l8h h ALA 81 Cb 0.35 0.61 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 1l8h h ALA 81 CO 0.02 -0.57 0.51 0.93 0.00 0.00 0.00 179.25 180.14 1l8h h GLU 82 N -0.11 1.13 -0.43 0.00 5.08 -0.36 -2.21 114.58 117.68 1l8h h GLU 82 Ca 0.25 -0.10 0.04 0.00 -1.00 0.00 0.00 59.36 58.55 1l8h h GLU 82 Cb 0.50 -0.24 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 1l8h h GLU 82 CO -0.62 0.78 0.19 -0.09 -1.00 0.00 0.00 179.01 178.27 1l8h h ARG 83 N 1.15 0.37 0.62 2.33 9.65 0.33 -0.48 114.38 128.34 1l8h h ARG 83 Ca 0.30 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 59.14 1l8h h ARG 83 Cb -0.06 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 28.43 1l8h h ARG 83 CO -0.06 0.24 -0.45 0.00 2.80 0.00 0.00 179.97 182.51 1l8h h ALA 84 N 1.25 -1.09 -0.95 2.80 0.00 -0.68 -2.46 119.26 118.14 1l8h h ALA 84 Ca 0.19 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 55.12 1l8h h ALA 84 Cb 0.14 0.59 -0.12 0.00 0.00 0.00 0.00 17.79 18.40 1l8h h ALA 84 CO -0.16 -1.14 0.52 0.28 0.00 0.00 0.00 179.25 178.75 1l8h h VAL 85 N -1.03 0.57 -0.13 0.00 2.07 -1.09 0.24 116.25 116.87 1l8h h VAL 85 Ca -0.08 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 1l8h h VAL 85 Cb 0.86 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1l8h h VAL 85 CO 0.03 0.10 -0.03 1.56 0.02 0.00 0.00 177.57 179.25 1l8h h GLN 86 N 0.57 0.19 -0.36 1.57 4.20 -0.67 -1.15 115.11 119.46 1l8h h GLN 86 Ca 0.59 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.27 1l8h h GLN 86 Cb 1.05 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.79 1l8h h GLN 86 CO -0.46 0.24 0.00 1.28 -0.67 0.00 0.00 178.83 179.22 1l8h n LEU 87 N -4.39 1.54 0.00 1.46 4.77 0.75 -4.86 117.00 116.28 1l8h n LEU 87 Ca -0.01 -0.77 0.00 0.00 -0.03 0.00 0.00 56.01 55.20 1l8h n LEU 87 Cb 0.18 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1l8h n LEU 87 CO 0.36 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1l8h n GLY 88 N 0.76 0.92 1.54 -0.72 0.00 -0.43 -4.79 105.19 102.47 1l8h n GLY 88 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 1l8h n GLY 88 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l8h n GLY 89 N -2.00 -1.97 2.78 -0.02 0.00 -0.74 -2.16 105.19 101.08 1l8h n GLY 89 Ca 0.00 -1.57 -0.28 0.00 0.00 0.00 0.00 46.02 44.16 1l8h n GLY 89 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l8h s VAL 90 N -2.02 0.79 0.08 1.61 1.01 -1.26 -4.24 120.40 116.38 1l8h s VAL 90 Ca 0.31 -0.77 -0.31 0.00 0.00 0.00 0.00 61.98 61.20 1l8h s VAL 90 Cb -0.02 -1.26 -0.09 0.00 0.00 0.00 0.00 36.38 35.01 1l8h s VAL 90 CO 0.23 -0.21 1.68 0.00 0.00 0.00 0.00 175.10 176.79 1l8h s ALA 91 N 1.73 3.70 -0.27 5.51 0.00 -1.26 -4.97 121.76 126.19 1l8h s ALA 91 Ca -0.02 1.26 -0.07 0.00 0.00 0.00 0.00 51.96 53.13 1l8h s ALA 91 Cb -0.18 -3.71 -0.01 0.00 0.00 0.00 0.00 23.12 19.23 1l8h s ALA 91 CO -0.09 -1.12 0.08 -0.51 0.00 0.00 0.00 175.76 174.13 1l8h s LEU 92 N 2.62 3.67 -0.11 0.00 1.43 -1.26 -4.94 118.68 120.09 1l8h s LEU 92 Ca 0.75 -0.45 0.18 0.00 -1.03 0.00 0.00 54.13 53.57 1l8h s LEU 92 Cb -0.41 -1.91 0.35 0.00 0.03 0.00 0.00 46.19 44.25 1l8h s LEU 92 CO 0.33 -0.12 1.17 0.61 0.23 0.00 0.00 176.35 178.57 1l8h n GLY 93 N 4.91 1.22 3.89 -3.19 0.00 -1.26 -4.51 105.19 106.24 1l8h n GLY 93 Ca -0.15 -0.61 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 1l8h n GLY 93 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1l8h s THR 94 N -0.88 4.90 0.18 2.61 -4.23 -1.26 -4.94 115.64 112.02 1l8h s THR 94 Ca 0.21 0.38 -0.19 0.00 -1.18 0.00 0.00 61.69 60.91 1l8h s THR 94 Cb 0.29 -3.70 0.13 0.00 1.34 0.00 0.00 72.50 70.56 1l8h s THR 94 CO -0.09 -0.33 1.61 0.74 -0.54 0.00 0.00 174.62 176.00 1l8h h THR 95 N 1.43 0.29 -0.23 3.99 2.02 -1.99 -0.67 112.91 117.74 1l8h h THR 95 Ca -0.47 0.00 0.05 0.00 0.77 0.00 0.00 66.41 66.75 1l8h h THR 95 Cb 1.18 0.29 -0.07 0.00 -1.74 0.00 0.00 68.15 67.81 1l8h h THR 95 CO 0.66 0.00 -0.47 0.06 0.37 0.00 0.00 175.52 176.13 1l8h h GLN 96 N -0.14 -0.45 -0.87 6.66 -0.00 -1.98 0.35 115.11 118.68 1l8h h GLN 96 Ca 0.22 0.03 0.10 0.00 -0.00 0.00 0.00 58.65 59.00 1l8h h GLN 96 Cb 0.50 0.10 -0.08 0.00 -0.00 0.00 0.00 27.48 28.01 1l8h h GLN 96 CO -0.58 -0.30 0.51 0.28 -0.00 0.00 0.00 178.83 178.74 1l8h h VAL 97 N -0.47 0.92 0.39 1.86 2.07 -1.76 0.08 116.25 119.34 1l8h h VAL 97 Ca 0.08 -0.29 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1l8h h VAL 97 Cb 0.63 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1l8h h VAL 97 CO -0.48 0.16 -0.19 0.40 0.02 0.00 0.00 177.57 177.48 1l8h h ILE 98 N 0.85 0.00 -1.10 4.57 1.08 -0.04 0.20 117.51 123.07 1l8h h ILE 98 Ca 0.42 -0.08 0.32 0.00 -0.39 0.00 0.00 64.86 65.13 1l8h h ILE 98 Cb 0.38 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.09 1l8h h ILE 98 CO -0.25 0.00 0.86 -1.13 -0.69 0.00 0.00 178.15 176.94 1l8h h ASN 99 N -0.61 0.00 0.00 1.72 -0.73 -0.18 0.37 115.58 116.15 1l8h h ASN 99 Ca -0.05 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.12 1l8h h ASN 99 Cb 0.40 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.99 1l8h h ASN 99 CO 0.09 0.00 0.00 -0.24 -0.37 0.00 0.00 177.43 176.91 1l8h n SER 100 N -4.00 0.00 -0.21 1.15 2.88 0.00 -4.41 113.62 109.04 1l8h n SER 100 Ca 0.24 0.53 0.12 0.00 -1.33 0.00 0.00 58.87 58.43 1l8h n SER 100 Cb 1.22 -0.43 0.61 0.00 -0.75 0.00 0.00 64.21 64.86 1l8h n SER 100 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1l8h n LYS 101 N -1.80 1.28 -1.66 -1.46 5.02 0.04 -4.92 118.16 114.65 1l8h n LYS 101 Ca 0.00 -0.41 -0.42 0.00 -2.02 0.00 0.00 58.31 55.46 1l8h n LYS 101 Cb 0.00 -1.40 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 1l8h n LYS 101 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1l8h n THR 102 N -0.43 0.77 1.39 -0.18 5.66 0.13 -4.86 114.28 116.75 1l8h n THR 102 Ca 0.18 -0.14 0.01 0.00 -3.05 0.00 0.00 64.05 61.05 1l8h n THR 102 Cb 0.18 -2.31 0.04 0.00 -1.55 0.00 0.00 70.33 66.70 1l8h n THR 102 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1l8h n PRO 103 N 7.50 1.31 -4.54 1.09 -0.04 -1.26 -4.82 135.00 134.24 1l8h n PRO 103 Ca 0.20 -0.35 -0.34 0.00 -0.04 0.00 0.00 63.50 62.97 1l8h n PRO 103 Cb 0.41 -1.25 -0.12 0.00 -0.04 0.00 0.00 33.50 32.49 1l8h n PRO 103 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1l8h s LEU 104 N -0.78 3.11 0.83 1.53 1.43 -1.26 -5.06 118.68 118.48 1l8h s LEU 104 Ca 0.06 -0.15 -0.14 0.00 -1.03 0.00 0.00 54.13 52.87 1l8h s LEU 104 Cb 0.04 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.56 1l8h s LEU 104 CO 0.03 0.21 0.66 1.17 0.23 0.00 0.00 176.35 178.66 1l8h n LYS 105 N 3.24 0.03 -2.33 1.70 4.81 -1.26 -4.90 118.16 119.45 1l8h n LYS 105 Ca -0.18 0.07 -0.36 0.00 -0.87 0.00 0.00 58.31 56.97 1l8h n LYS 105 Cb 0.53 -2.00 -0.02 0.00 0.02 0.00 0.00 35.03 33.56 1l8h n LYS 105 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1l8h s SER 106 N -1.86 6.22 0.03 3.14 0.15 -1.26 -4.99 113.70 115.13 1l8h s SER 106 Ca 0.64 2.21 -0.24 0.00 0.70 0.00 0.00 55.95 59.26 1l8h s SER 106 Cb -0.28 -2.59 -0.05 0.00 -1.71 0.00 0.00 66.02 61.38 1l8h s SER 106 CO 0.60 -0.87 0.71 -0.47 1.20 0.00 0.00 173.24 174.41 1l8h s TYR 107 N -1.64 3.71 -0.22 3.44 6.14 -1.26 -4.99 117.35 122.53 1l8h s TYR 107 Ca 0.64 1.38 -0.36 0.00 0.64 0.00 0.00 57.07 59.37 1l8h s TYR 107 Cb -0.26 -2.76 -0.13 0.00 0.42 0.00 0.00 41.96 39.24 1l8h s TYR 107 CO 0.31 0.29 1.93 -2.30 0.64 0.00 0.00 175.55 176.41 1l8h n PRO 108 N 2.83 1.56 -0.80 4.97 -0.02 -1.26 -4.88 135.00 137.40 1l8h n PRO 108 Ca -0.04 0.54 -0.08 0.00 -2.02 0.00 0.00 63.50 61.91 1l8h n PRO 108 Cb 0.50 -2.44 0.21 0.00 -0.02 0.00 0.00 33.50 31.75 1l8h n PRO 108 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1l8h n LEU 109 N 7.21 5.22 0.00 2.45 4.32 -1.26 -4.19 117.00 130.74 1l8h n LEU 109 Ca 0.29 -2.72 0.00 0.00 -0.02 0.00 0.00 56.01 53.56 1l8h n LEU 109 Cb 0.23 -0.70 0.00 0.00 -1.62 0.00 0.00 43.42 41.33 1l8h n LEU 109 CO 0.76 0.74 -0.05 -0.90 -1.22 0.00 0.00 177.39 176.72 1l8h n ASP 110 N -0.19 0.49 -4.80 -1.43 5.68 -1.26 -5.10 116.55 109.94 1l8h n ASP 110 Ca 0.34 -0.11 -0.31 0.00 -0.50 0.00 0.00 54.79 54.21 1l8h n ASP 110 Cb 1.19 0.31 0.07 0.00 -1.14 0.00 0.00 41.12 41.55 1l8h n ASP 110 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 1l8h s ILE 111 N -0.41 3.64 0.00 2.12 -4.36 -1.26 -5.00 121.20 115.93 1l8h s ILE 111 Ca 0.00 0.53 0.00 0.00 -0.26 0.00 0.00 60.65 60.92 1l8h s ILE 111 Cb 0.00 -3.18 0.00 0.00 1.25 0.00 0.00 42.46 40.53 1l8h s ILE 111 CO 0.00 -0.69 0.00 1.41 0.24 0.00 0.00 174.94 175.90 1l8h n HIS 112 N -3.32 -0.06 -1.71 1.37 8.25 -1.26 -4.90 115.22 113.58 1l8h n HIS 112 Ca 0.08 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.11 1l8h n HIS 112 Cb 0.54 0.18 -0.02 0.00 1.12 0.00 0.00 29.99 31.81 1l8h n HIS 112 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1l8h n ASN 113 N -1.86 3.45 -0.09 0.41 2.85 -1.26 -1.35 115.26 117.40 1l8h n ASN 113 Ca 0.00 1.14 -0.03 0.00 -0.11 0.00 0.00 54.58 55.58 1l8h n ASN 113 Cb 0.00 -1.53 -0.02 0.00 1.24 0.00 0.00 39.78 39.47 1l8h n ASN 113 CO 0.00 0.00 0.00 0.58 -2.11 0.00 0.00 177.26 175.73 1l8h h VAL 114 N 3.28 0.00 -0.94 3.44 2.07 -1.32 -1.26 116.25 121.51 1l8h h VAL 114 Ca -0.46 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.27 1l8h h VAL 114 Cb 1.24 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 30.84 1l8h h VAL 114 CO 0.79 0.00 -0.13 1.56 0.02 0.00 0.00 177.57 179.81 1l8h h GLN 115 N -0.02 0.01 -0.14 1.57 1.08 -1.88 0.17 115.11 115.90 1l8h h GLN 115 Ca 0.04 -0.00 0.05 0.00 -1.45 0.00 0.00 58.65 57.28 1l8h h GLN 115 Cb 0.11 -0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.48 1l8h h GLN 115 CO -0.22 0.01 -0.25 -0.44 -0.95 0.00 0.00 178.83 176.98 1l8h h ASP 116 N 0.01 -0.78 -0.15 1.46 3.45 -1.61 -0.57 116.42 118.23 1l8h h ASP 116 Ca 0.50 0.13 0.03 0.00 0.43 0.00 0.00 57.03 58.12 1l8h h ASP 116 Cb 0.87 0.35 -0.03 0.00 -0.56 0.00 0.00 39.33 39.95 1l8h h ASP 116 CO -0.93 -0.30 -0.07 0.45 -1.57 0.00 0.00 179.24 176.82 1l8h h HIS 117 N -0.31 -0.16 -0.52 4.55 3.86 -0.32 0.51 115.15 122.75 1l8h h HIS 117 Ca 0.10 0.02 0.10 0.00 -1.16 0.00 0.00 60.37 59.43 1l8h h HIS 117 Cb 0.47 0.10 -0.10 0.00 1.06 0.00 0.00 27.41 28.93 1l8h h HIS 117 CO -0.35 -0.11 -0.18 -0.07 0.86 0.00 0.00 177.93 178.07 1l8h h LEU 118 N -0.05 -0.64 0.21 2.43 4.07 -0.44 0.89 115.31 121.78 1l8h h LEU 118 Ca 0.08 0.17 0.01 0.00 0.08 0.00 0.00 57.88 58.22 1l8h h LEU 118 Cb 0.18 0.38 -0.03 0.00 1.08 0.00 0.00 40.66 42.27 1l8h h LEU 118 CO -0.18 -0.22 -0.32 0.11 -1.08 0.00 0.00 178.44 176.75 1l8h h LYS 119 N -0.06 -0.58 -0.52 1.13 1.57 -0.32 1.66 116.57 119.45 1l8h h LYS 119 Ca 0.25 0.04 0.08 0.00 -1.87 0.00 0.00 60.65 59.14 1l8h h LYS 119 Cb 0.44 0.13 -0.06 0.00 0.08 0.00 0.00 32.23 32.82 1l8h h LYS 119 CO -0.57 -0.39 0.18 0.93 -0.57 0.00 0.00 179.45 179.03 1l8h h GLU 120 N -0.61 0.34 -0.28 3.15 4.39 0.38 -1.05 114.58 120.91 1l8h h GLU 120 Ca 0.01 -0.02 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 1l8h h GLU 120 Cb 0.60 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 1l8h h GLU 120 CO -0.13 0.23 0.08 -0.07 -1.16 0.00 0.00 179.01 177.95 1l8h h LEU 121 N 0.36 0.43 -0.70 1.33 3.38 0.13 -2.70 115.31 117.54 1l8h h LEU 121 Ca 0.26 -0.22 0.15 0.00 0.09 0.00 0.00 57.88 58.15 1l8h h LEU 121 Cb 0.29 -0.11 -0.11 0.00 0.09 0.00 0.00 40.66 40.82 1l8h h LEU 121 CO -0.27 0.54 0.09 0.00 0.09 0.00 0.00 178.44 178.89 1l8h h ALA 122 N 0.90 0.81 0.82 1.53 0.00 0.32 0.28 119.26 123.92 1l8h h ALA 122 Ca 0.09 0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 1l8h h ALA 122 Cb 0.27 0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1l8h h ALA 122 CO -0.00 -0.37 -0.39 -0.44 0.00 0.00 0.00 179.25 178.04 1l8h h ASP 123 N 0.19 -0.93 -0.79 0.00 3.45 -1.01 0.18 116.42 117.51 1l8h h ASP 123 Ca 0.38 0.02 0.05 0.00 0.43 0.00 0.00 57.03 57.92 1l8h h ASP 123 Cb 0.65 0.24 -0.06 0.00 -0.56 0.00 0.00 39.33 39.60 1l8h h ASP 123 CO -0.54 -0.64 0.49 0.03 -1.57 0.00 0.00 179.24 177.01 1l8h h ARG 124 N -1.15 0.88 -0.36 3.56 2.47 -1.10 -0.27 114.38 118.42 1l8h h ARG 124 Ca -0.11 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.55 1l8h h ARG 124 Cb 0.85 -0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 28.96 1l8h h ARG 124 CO 0.19 0.58 0.20 1.88 0.56 0.00 0.00 179.97 183.37 1l8h h TYR 125 N 0.90 0.49 -0.32 3.04 -1.99 -0.42 -2.23 116.97 116.44 1l8h h TYR 125 Ca 0.34 -0.01 0.07 0.00 2.00 0.00 0.00 58.73 61.13 1l8h h TYR 125 Cb 0.13 -0.16 -0.07 0.00 2.00 0.00 0.00 36.73 38.64 1l8h h TYR 125 CO -0.04 0.38 -0.13 0.00 -0.00 0.00 0.00 178.16 178.37 1l8h h ALA 126 N 1.06 0.14 -0.18 3.88 0.00 0.14 1.19 119.26 125.48 1l8h h ALA 126 Ca 0.13 0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.21 1l8h h ALA 126 Cb 0.05 0.33 -0.07 0.00 0.00 0.00 0.00 17.79 18.10 1l8h h ALA 126 CO -0.02 -0.51 -0.39 0.82 0.00 0.00 0.00 179.25 179.15 1l8h h ILE 127 N -0.07 0.18 -0.48 0.00 1.08 -0.66 0.26 117.51 117.82 1l8h h ILE 127 Ca 0.16 0.00 -0.07 0.00 -0.39 0.00 0.00 64.86 64.56 1l8h h ILE 127 Cb 0.32 0.18 -0.02 0.00 -3.07 0.00 0.00 36.82 34.23 1l8h h ILE 127 CO -0.37 0.00 0.03 0.58 -0.69 0.00 0.00 178.15 177.70 1l8h h VAL 128 N -0.43 1.26 -0.55 1.67 2.07 -0.81 -0.96 116.25 118.50 1l8h h VAL 128 Ca 0.10 -1.01 0.05 0.00 0.82 0.00 0.00 66.70 66.66 1l8h h VAL 128 Cb 0.60 0.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 1l8h h VAL 128 CO -0.42 0.35 0.28 0.00 0.02 0.00 0.00 177.57 177.81 1l8h h ALA 129 N 0.94 0.71 0.04 1.67 0.00 0.21 -1.52 119.26 121.30 1l8h h ALA 129 Ca 0.14 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1l8h h ALA 129 Cb 0.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1l8h h ALA 129 CO 0.02 -0.06 -0.02 -0.91 0.00 0.00 0.00 179.25 178.28 1l8h h ASN 130 N 0.54 -0.05 -0.44 0.00 2.35 -0.34 -2.50 115.58 115.13 1l8h h ASN 130 Ca 0.24 -0.43 0.07 0.00 -0.55 0.00 0.00 56.30 55.63 1l8h h ASN 130 Cb 0.15 0.01 -0.06 0.00 0.05 0.00 0.00 38.32 38.47 1l8h h ASN 130 CO -0.17 0.42 0.10 -0.78 -1.65 0.00 0.00 177.43 175.36 1l8h h ASP 131 N -0.53 0.04 -0.55 5.81 -0.00 -1.05 -2.00 116.42 118.14 1l8h h ASP 131 Ca -0.01 0.07 -0.07 0.00 -0.00 0.00 0.00 57.03 57.03 1l8h h ASP 131 Cb 0.48 0.09 -0.02 0.00 -0.00 0.00 0.00 39.33 39.88 1l8h h ASP 131 CO 0.01 0.06 0.09 1.62 -0.00 0.00 0.00 179.24 181.01 1l8h h VAL 132 N 0.24 1.25 -0.76 2.25 3.04 -1.35 0.12 116.25 121.05 1l8h h VAL 132 Ca 0.21 -0.97 0.11 0.00 -1.01 0.00 0.00 66.70 65.04 1l8h h VAL 132 Cb 0.26 0.81 -0.05 0.00 -2.01 0.00 0.00 31.29 30.30 1l8h h VAL 132 CO -0.27 0.35 0.50 -0.09 -1.01 0.00 0.00 177.57 177.05 1l8h h ARG 133 N 0.81 0.60 0.02 4.17 2.43 -0.95 -1.49 114.38 119.97 1l8h h ARG 133 Ca 0.17 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.16 1l8h h ARG 133 Cb 0.42 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1l8h h ARG 133 CO 0.01 0.39 -0.57 0.87 -1.51 0.00 0.00 179.97 179.17 1l8h h LYS 134 N 0.61 0.34 -1.03 0.20 6.56 -0.95 -3.26 116.57 119.05 1l8h h LYS 134 Ca 0.36 -0.40 0.30 0.00 -1.06 0.00 0.00 60.65 59.84 1l8h h LYS 134 Cb 0.55 0.12 -0.04 0.00 -0.57 0.00 0.00 32.23 32.29 1l8h h LYS 134 CO -0.13 1.10 0.83 0.00 -2.06 0.00 0.00 179.45 179.19 1l8h h ALA 135 N 0.26 2.91 -0.11 3.86 0.00 0.07 0.96 119.26 127.22 1l8h h ALA 135 Ca -0.08 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.83 1l8h h ALA 135 Cb 1.32 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 1l8h h ALA 135 CO 0.11 -1.36 0.11 0.82 0.00 0.00 0.00 179.25 178.93 1l8h h ILE 136 N 0.00 0.58 0.24 0.00 2.04 -1.50 -1.37 117.51 117.50 1l8h h ILE 136 Ca 0.49 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.34 1l8h h ILE 136 Cb 2.15 0.91 0.00 0.00 -0.74 0.00 0.00 36.82 39.15 1l8h h ILE 136 CO -0.01 0.00 -0.12 1.23 0.00 0.00 0.00 178.15 179.26 1l8h h GLY 137 N 0.00 -0.34 1.62 5.37 0.00 0.77 -3.21 103.07 107.28 1l8h h GLY 137 Ca 0.05 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1l8h h GLY 137 CO -0.00 -0.12 0.14 1.18 0.00 0.00 0.00 176.54 177.74 1l8h n GLU 138 N -4.99 0.11 -1.87 4.80 1.02 -0.89 -4.53 120.64 114.29 1l8h n GLU 138 Ca -0.06 0.60 -0.39 0.00 -0.02 0.00 0.00 57.16 57.29 1l8h n GLU 138 Cb 0.20 -2.01 -0.03 0.00 -0.02 0.00 0.00 31.44 29.58 1l8h n GLU 138 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1l8h s ALA 139 N -3.43 2.21 -0.06 0.62 0.00 -0.57 -4.84 121.76 115.70 1l8h s ALA 139 Ca -0.02 -0.18 -0.26 0.00 0.00 0.00 0.00 51.96 51.51 1l8h s ALA 139 Cb 0.05 -4.24 -0.21 0.00 0.00 0.00 0.00 23.12 18.72 1l8h s ALA 139 CO 0.16 -3.70 1.06 0.87 0.00 0.00 0.00 175.76 174.14 1l8h h LYS 140 N 15.77 -0.04 -6.29 0.00 1.57 -1.89 -3.44 116.57 122.24 1l8h h LYS 140 Ca -0.28 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 57.95 1l8h h LYS 140 Cb 1.20 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 1l8h h LYS 140 CO 1.14 0.56 0.86 0.34 -0.57 0.00 0.00 179.45 181.79 1l8h s ASP 141 N -5.78 6.88 0.14 0.86 3.68 -1.26 -4.95 116.67 116.23 1l8h s ASP 141 Ca -0.16 1.98 -0.26 0.00 2.13 0.00 0.00 52.55 56.23 1l8h s ASP 141 Cb 0.00 -2.55 -0.02 0.00 -1.45 0.00 0.00 42.92 38.90 1l8h s ASP 141 CO 0.64 -0.73 1.60 0.44 0.13 0.00 0.00 175.17 177.25 1l8h h ASP 142 N 8.10 -1.06 -0.03 -0.34 3.32 -1.99 0.74 116.42 125.16 1l8h h ASP 142 Ca -0.35 0.15 0.03 0.00 0.02 0.00 0.00 57.03 56.89 1l8h h ASP 142 Cb 1.16 0.45 -0.06 0.00 0.22 0.00 0.00 39.33 41.10 1l8h h ASP 142 CO 0.92 -0.37 -0.46 0.44 -1.72 0.00 0.00 179.24 178.05 1l8h h ASP 143 N -0.41 -1.40 -0.92 6.45 3.45 -1.98 0.13 116.42 121.73 1l8h h ASP 143 Ca 0.09 0.17 0.20 0.00 0.43 0.00 0.00 57.03 57.92 1l8h h ASP 143 Cb 0.56 0.55 -0.07 0.00 -0.56 0.00 0.00 39.33 39.81 1l8h h ASP 143 CO -0.37 -0.47 0.60 0.74 -1.57 0.00 0.00 179.24 178.17 1l8h h THR 144 N -0.59 0.70 0.24 0.35 2.02 -1.87 0.64 112.91 114.40 1l8h h THR 144 Ca 0.04 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 1l8h h THR 144 Cb 0.67 0.15 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 1l8h h THR 144 CO -0.35 0.09 -0.12 0.00 0.37 0.00 0.00 175.52 175.52 1l8h h ALA 145 N 1.61 -0.33 -0.10 6.16 0.00 0.11 -2.46 119.26 124.26 1l8h h ALA 145 Ca 0.49 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.29 1l8h h ALA 145 Cb 1.08 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.93 1l8h h ALA 145 CO -0.22 -0.57 -0.44 0.22 0.00 0.00 0.00 179.25 178.23 1l8h h ASP 146 N -0.54 -1.38 -0.92 0.00 1.82 0.86 0.25 116.42 116.50 1l8h h ASP 146 Ca -0.03 0.18 0.26 0.00 -0.39 0.00 0.00 57.03 57.04 1l8h h ASP 146 Cb 0.40 0.55 -0.15 0.00 0.68 0.00 0.00 39.33 40.81 1l8h h ASP 146 CO 0.05 -0.45 0.28 0.40 -1.61 0.00 0.00 179.24 177.92 1l8h h ILE 147 N -0.53 0.26 -0.19 2.25 2.04 -0.90 0.32 117.51 120.76 1l8h h ILE 147 Ca 0.06 -0.07 -0.20 0.00 1.00 0.00 0.00 64.86 65.65 1l8h h ILE 147 Cb 0.65 0.05 0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1l8h h ILE 147 CO -0.39 0.04 -0.67 -0.07 0.00 0.00 0.00 178.15 177.06 1l8h h LEU 148 N 0.19 0.93 -0.52 1.44 3.38 -0.65 -1.59 115.31 118.49 1l8h h LEU 148 Ca 0.60 -0.60 0.06 0.00 0.09 0.00 0.00 57.88 58.03 1l8h h LEU 148 Cb 1.28 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.70 1l8h h LEU 148 CO -0.68 1.37 0.23 0.74 0.09 0.00 0.00 178.44 180.18 1l8h h THR 149 N 0.54 0.89 -0.22 0.22 2.02 0.28 0.98 112.91 117.62 1l8h h THR 149 Ca -0.03 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 1l8h h THR 149 Cb 1.30 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 1l8h h THR 149 CO 0.14 0.08 0.12 0.00 0.37 0.00 0.00 175.52 176.23 1l8h h ALA 150 N 1.31 0.29 0.13 6.16 0.00 -0.89 0.94 119.26 127.20 1l8h h ALA 150 Ca 0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1l8h h ALA 150 Cb 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1l8h h ALA 150 CO -0.21 -0.18 -0.06 0.00 0.00 0.00 0.00 179.25 178.80 1l8h h ALA 151 N 1.01 -0.18 -0.22 0.00 0.00 -0.57 -3.00 119.26 116.30 1l8h h ALA 151 Ca 0.08 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1l8h h ALA 151 Cb 0.07 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.85 1l8h h ALA 151 CO -0.01 -0.56 -0.45 1.03 0.00 0.00 0.00 179.25 179.26 1l8h h SER 152 N -0.26 -1.44 -0.95 0.00 0.87 0.12 -1.63 113.55 110.26 1l8h h SER 152 Ca -0.02 0.19 0.26 0.00 -1.23 0.00 0.00 61.79 61.00 1l8h h SER 152 Cb 0.20 0.59 -0.18 0.00 -0.44 0.00 0.00 62.40 62.58 1l8h h SER 152 CO 0.03 -0.42 0.02 -1.14 -0.53 0.00 0.00 176.83 174.79 1l8h n ARG 153 N -5.43 -0.08 0.09 2.24 3.00 0.31 -0.78 116.66 116.02 1l8h n ARG 153 Ca -0.03 1.42 -0.12 0.00 -0.00 0.00 0.00 57.85 59.12 1l8h n ARG 153 Cb 0.36 -2.26 -0.08 0.00 0.00 0.00 0.00 32.46 30.48 1l8h n ARG 153 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.63 177.19 1l8h h ASP 154 N 0.00 -0.22 -0.69 6.15 3.45 -1.21 -2.86 116.42 121.04 1l8h h ASP 154 Ca 0.58 -0.29 0.14 0.00 0.43 0.00 0.00 57.03 57.89 1l8h h ASP 154 Cb 1.19 0.06 -0.13 0.00 -0.56 0.00 0.00 39.33 39.89 1l8h h ASP 154 CO -0.89 0.23 -0.11 -0.07 -1.57 0.00 0.00 179.24 176.82 1l8h h LEU 155 N -0.74 -0.52 -0.34 1.55 -0.00 -0.21 0.34 115.31 115.39 1l8h h LEU 155 Ca -0.03 0.20 0.02 0.00 -0.00 0.00 0.00 57.88 58.06 1l8h h LEU 155 Cb 0.50 0.38 -0.02 0.00 -0.00 0.00 0.00 40.66 41.52 1l8h h LEU 155 CO 0.04 -0.20 0.19 0.44 -0.00 0.00 0.00 178.44 178.91 1l8h h ASP 156 N 0.03 0.30 -0.79 -0.43 3.45 -1.15 0.69 116.42 118.53 1l8h h ASP 156 Ca 0.34 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.81 1l8h h ASP 156 Cb 0.55 -0.05 -0.04 0.00 -0.56 0.00 0.00 39.33 39.23 1l8h h ASP 156 CO -0.67 0.22 0.51 0.50 -1.57 0.00 0.00 179.24 178.22 1l8h h LYS 157 N 0.39 1.05 0.23 3.56 3.64 -0.82 -1.00 116.57 123.62 1l8h h LYS 157 Ca 0.14 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1l8h h LYS 157 Cb 0.02 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.61 1l8h h LYS 157 CO -0.07 0.71 -0.11 0.74 -2.27 0.00 0.00 179.45 178.45 1l8h h PHE 158 N 1.07 -0.28 -0.51 1.91 0.05 0.17 -0.51 116.94 118.83 1l8h h PHE 158 Ca 0.29 -0.01 0.10 0.00 3.82 0.00 0.00 57.97 62.17 1l8h h PHE 158 Cb -0.09 0.09 -0.10 0.00 2.00 0.00 0.00 35.95 37.85 1l8h h PHE 158 CO -0.01 -0.10 -0.16 1.25 -0.18 0.00 0.00 178.31 179.11 1l8h h LEU 159 N -0.41 -0.59 -0.46 1.54 5.85 -0.67 0.34 115.31 120.91 1l8h h LEU 159 Ca -0.03 0.17 0.09 0.00 0.84 0.00 0.00 57.88 58.95 1l8h h LEU 159 Cb 0.31 0.36 -0.09 0.00 0.37 0.00 0.00 40.66 41.62 1l8h h LEU 159 CO 0.05 -0.20 -0.11 -0.25 -0.34 0.00 0.00 178.44 177.59 1l8h h TRP 160 N -0.04 -0.23 -0.83 1.25 7.01 -0.80 0.38 115.95 122.70 1l8h h TRP 160 Ca 0.24 0.04 -0.04 0.00 2.11 0.00 0.00 58.89 61.25 1l8h h TRP 160 Cb 0.42 0.17 -0.04 0.00 -2.10 0.00 0.00 29.16 27.61 1l8h h TRP 160 CO -0.46 -0.19 0.36 0.74 -2.79 0.00 0.00 178.44 176.10 1l8h h PHE 161 N 0.01 1.22 0.05 2.65 -1.00 0.82 0.32 116.94 121.01 1l8h h PHE 161 Ca 0.22 -0.08 -0.00 0.00 2.81 0.00 0.00 57.97 60.92 1l8h h PHE 161 Cb 0.33 -0.37 0.00 0.00 3.61 0.00 0.00 35.95 39.52 1l8h h PHE 161 CO -0.39 0.90 -0.02 0.82 -1.61 0.00 0.00 178.31 178.01 1l8h h ILE 162 N 1.19 1.14 0.53 -0.55 2.04 0.68 -2.98 117.51 119.56 1l8h h ILE 162 Ca 0.28 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 1l8h h ILE 162 Cb 0.17 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1l8h h ILE 162 CO -0.03 0.16 -0.47 -0.33 0.00 0.00 0.00 178.15 177.48 1l8h h GLU 163 N -0.35 -0.95 0.00 2.37 5.08 -0.07 -2.50 114.58 118.16 1l8h h GLU 163 Ca -0.01 0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1l8h h GLU 163 Cb 0.31 0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1l8h h GLU 163 CO 0.01 -0.64 0.49 0.77 -1.00 0.00 0.00 179.01 178.65 1l8h h SER 164 N -0.99 0.00 0.29 1.42 0.02 -0.37 0.79 113.55 114.71 1l8h h SER 164 Ca -0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1l8h h SER 164 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 1l8h h SER 164 CO -0.03 0.00 -0.89 0.59 -1.14 0.00 0.00 176.83 175.36 1l8h n ASN 165 N -2.15 0.69 -4.68 3.07 3.02 -0.94 -4.83 115.26 109.44 1l8h n ASN 165 Ca -0.01 -0.49 -0.43 0.00 -0.03 0.00 0.00 54.58 53.63 1l8h n ASN 165 Cb 0.51 0.73 -0.02 0.00 -0.61 0.00 0.00 39.78 40.39 1l8h n ASN 165 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1l8h s ILE 166 N -3.08 4.67 -2.25 2.41 1.01 0.27 -4.99 121.20 119.25 1l8h s ILE 166 Ca 0.07 1.97 0.30 0.00 0.00 0.00 0.00 60.65 62.99 1l8h s ILE 166 Cb 0.16 -4.27 0.73 0.00 0.01 0.00 0.00 42.46 39.09 1l8h s ILE 166 CO 0.80 -0.06 1.99 -1.84 0.00 0.00 0.00 174.94 175.82