#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b4o n ASN 9 N 0.00 4.74 -4.86 1.62 5.15 -1.26 -4.81 115.26 115.85 3b4o n ASN 9 Ca 0.00 -2.95 -0.22 0.00 -0.60 0.00 0.00 54.58 50.81 3b4o n ASN 9 Cb 0.00 -1.63 -0.04 0.00 -0.53 0.00 0.00 39.78 37.59 3b4o n ASN 9 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 3b4o s THR 10 N 2.52 4.52 0.51 -0.44 -4.23 -1.26 -4.99 115.64 112.27 3b4o s THR 10 Ca 0.46 -1.32 0.25 0.00 -1.18 0.00 0.00 61.69 59.91 3b4o s THR 10 Cb 0.06 -3.47 0.30 0.00 1.34 0.00 0.00 72.50 70.74 3b4o s THR 10 CO 0.00 -0.33 2.15 0.77 -0.54 0.00 0.00 174.62 176.67 3b4o h SER 11 N 1.40 0.00 0.09 3.99 4.64 -1.98 -0.00 113.55 121.70 3b4o h SER 11 Ca -0.49 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3b4o h SER 11 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3b4o h SER 11 CO 0.60 0.07 -0.04 -0.33 -0.87 0.00 0.00 176.83 176.25 3b4o h GLU 12 N 0.00 -0.12 -0.75 4.77 4.39 -1.97 -0.96 114.58 119.94 3b4o h GLU 12 Ca -0.00 0.01 0.10 0.00 0.34 0.00 0.00 59.36 59.81 3b4o h GLU 12 Cb 0.15 0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 28.76 3b4o h GLU 12 CO 0.01 0.35 0.39 -0.91 -1.16 0.00 0.00 179.01 177.69 3b4o h ASN 13 N -0.67 0.52 -0.26 1.42 2.35 -1.81 -1.32 115.58 115.81 3b4o h ASN 13 Ca -0.01 0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.76 3b4o h ASN 13 Cb 0.53 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.85 3b4o h ASN 13 CO 0.02 0.29 0.04 0.03 -1.65 0.00 0.00 177.43 176.16 3b4o h ARG 14 N 0.65 0.53 -0.36 0.81 3.08 -1.02 -1.91 114.38 116.16 3b4o h ARG 14 Ca 0.37 -0.10 -0.08 0.00 0.07 0.00 0.00 59.98 60.25 3b4o h ARG 14 Cb 0.39 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 3b4o h ARG 14 CO -0.27 0.52 -0.07 0.00 -1.07 0.00 0.00 179.97 179.08 3b4o h ALA 15 N 1.54 0.49 -0.30 0.04 0.00 -0.16 -1.47 119.26 119.41 3b4o h ALA 15 Ca 0.12 -0.30 0.05 0.00 0.00 0.00 0.00 54.91 54.78 3b4o h ALA 15 Cb 0.27 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 3b4o h ALA 15 CO 0.00 0.33 0.02 1.96 0.00 0.00 0.00 179.25 181.57 3b4o h GLN 16 N 0.48 0.12 -0.44 0.00 4.20 -0.96 0.07 115.11 118.57 3b4o h GLN 16 Ca 0.09 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.80 3b4o h GLN 16 Cb 0.58 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 3b4o h GLN 16 CO 0.03 0.08 0.28 0.28 -0.67 0.00 0.00 178.83 178.83 3b4o h VAL 17 N 0.12 1.12 -0.29 -0.54 2.07 -1.30 0.06 116.25 117.50 3b4o h VAL 17 Ca 0.14 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 3b4o h VAL 17 Cb 0.17 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 3b4o h VAL 17 CO -0.22 0.12 0.15 0.00 0.02 0.00 0.00 177.57 177.64 3b4o h ALA 18 N 1.15 0.37 -0.04 1.67 0.00 -1.01 -0.26 119.26 121.14 3b4o h ALA 18 Ca 0.16 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3b4o h ALA 18 Cb -0.05 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 3b4o h ALA 18 CO -0.03 -0.08 -0.16 0.00 0.00 0.00 0.00 179.25 178.98 3b4o h ALA 19 N 1.01 -0.16 -1.00 0.00 0.00 -0.72 -2.21 119.26 116.18 3b4o h ALA 19 Ca 0.10 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.05 3b4o h ALA 19 Cb 0.10 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 3b4o h ALA 19 CO -0.01 -0.64 0.66 -0.09 0.00 0.00 0.00 179.25 179.17 3b4o h ARG 20 N -0.24 1.27 -0.34 0.00 2.43 -0.86 -0.94 114.38 115.71 3b4o h ARG 20 Ca 0.06 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 3b4o h ARG 20 Cb 0.33 -0.29 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 3b4o h ARG 20 CO -0.18 0.84 -0.18 0.37 -1.51 0.00 0.00 179.97 179.31 3b4o h GLN 21 N 1.30 0.62 -0.03 0.20 4.15 -0.80 -0.72 115.11 119.85 3b4o h GLN 21 Ca 0.38 -0.22 -0.05 0.00 0.77 0.00 0.00 58.65 59.53 3b4o h GLN 21 Cb -0.07 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.58 3b4o h GLN 21 CO -0.10 0.77 -0.18 1.25 -1.93 0.00 0.00 178.83 178.63 3b4o h HIS 22 N 0.56 0.24 -0.51 3.99 2.76 -0.91 -2.84 115.15 118.44 3b4o h HIS 22 Ca 0.09 -0.11 0.05 0.00 -2.20 0.00 0.00 60.37 58.20 3b4o h HIS 22 Cb 0.63 -0.03 -0.04 0.00 1.55 0.00 0.00 27.41 29.51 3b4o h HIS 22 CO 0.03 0.84 0.25 -0.91 -1.30 0.00 0.00 177.93 176.84 3b4o h ASN 23 N -0.43 0.35 -0.96 3.26 2.35 -1.17 -2.55 115.58 116.43 3b4o h ASN 23 Ca -0.02 0.03 0.14 0.00 -0.55 0.00 0.00 56.30 55.91 3b4o h ASN 23 Cb 0.87 -0.03 -0.09 0.00 0.05 0.00 0.00 38.32 39.11 3b4o h ASN 23 CO 0.04 0.24 0.57 -0.09 -1.65 0.00 0.00 177.43 176.55 3b4o h ARG 24 N 0.49 0.81 -0.33 0.81 2.43 -1.14 -0.81 114.38 116.63 3b4o h ARG 24 Ca 0.22 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.30 3b4o h ARG 24 Cb 0.14 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 3b4o h ARG 24 CO -0.16 0.54 0.00 0.87 -1.51 0.00 0.00 179.97 179.71 3b4o h LYS 25 N 0.84 0.51 -0.35 0.20 1.79 -1.23 -1.15 116.57 117.18 3b4o h LYS 25 Ca 0.51 -0.11 -0.16 0.00 -2.18 0.00 0.00 60.65 58.71 3b4o h LYS 25 Cb 0.63 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.20 3b4o h LYS 25 CO -0.32 0.54 -0.41 0.82 -1.08 0.00 0.00 179.45 179.00 3b4o h ILE 26 N 0.49 1.28 -0.25 1.86 1.08 -0.95 -1.51 117.51 119.51 3b4o h ILE 26 Ca 0.11 -1.59 -0.00 0.00 -0.39 0.00 0.00 64.86 62.99 3b4o h ILE 26 Cb 0.32 1.47 -0.01 0.00 -3.07 0.00 0.00 36.82 35.52 3b4o h ILE 26 CO 0.01 0.53 0.15 0.58 -0.69 0.00 0.00 178.15 178.73 3b4o h VAL 27 N 0.70 1.09 -0.94 1.67 2.07 -0.94 -0.97 116.25 118.92 3b4o h VAL 27 Ca 0.05 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.42 3b4o h VAL 27 Cb 1.01 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 31.49 3b4o h VAL 27 CO 0.10 0.08 0.61 -0.33 0.02 0.00 0.00 177.57 178.05 3b4o h GLU 28 N 0.31 1.11 -0.26 1.57 4.39 -1.14 -1.24 114.58 119.33 3b4o h GLU 28 Ca 0.09 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.69 3b4o h GLU 28 Cb 0.00 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.39 3b4o h GLU 28 CO -0.02 0.74 0.04 1.96 -1.16 0.00 0.00 179.01 180.57 3b4o h GLN 29 N 1.15 0.42 -0.25 2.33 4.20 -0.83 -2.13 115.11 120.00 3b4o h GLN 29 Ca 0.39 -0.11 0.06 0.00 0.06 0.00 0.00 58.65 59.05 3b4o h GLN 29 Cb 0.07 -0.05 -0.07 0.00 0.30 0.00 0.00 27.48 27.73 3b4o h GLN 29 CO -0.14 0.55 -0.18 -0.92 -0.67 0.00 0.00 178.83 177.46 3b4o h TYR 30 N 0.24 -0.46 0.00 2.96 3.20 -0.91 -1.18 116.97 120.82 3b4o h TYR 30 Ca 0.08 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 3b4o h TYR 30 Cb 0.33 0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.83 3b4o h TYR 30 CO 0.02 -0.25 -0.08 0.52 -1.64 0.00 0.00 178.16 176.72 3b4o h MET 31 N -0.17 0.00 -0.18 1.82 2.86 -1.08 -2.61 114.93 115.57 3b4o h MET 31 Ca 0.14 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.78 3b4o h MET 31 Cb 0.38 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.04 3b4o h MET 31 CO -0.35 0.08 0.00 0.72 1.06 0.00 0.00 176.91 178.42 3b4o n HIS 32 N -3.33 0.21 -2.39 -0.22 8.25 -0.82 -4.59 115.22 112.34 3b4o n HIS 32 Ca -0.01 -0.11 -0.42 0.00 -0.26 0.00 0.00 57.72 56.92 3b4o n HIS 32 Cb 0.27 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.35 3b4o n HIS 32 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3b4o s THR 33 N -1.79 4.14 0.14 1.59 2.01 -0.48 -4.99 115.64 116.27 3b4o s THR 33 Ca 0.33 1.45 0.00 0.00 0.31 0.00 0.00 61.69 63.78 3b4o s THR 33 Cb 0.21 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.75 3b4o s THR 33 CO 0.31 -0.05 0.03 -0.13 -0.69 0.00 0.00 174.62 174.09 3b4o s ARG 34 N 2.75 0.99 4.39 4.92 0.52 -1.26 -4.82 118.95 126.44 3b4o s ARG 34 Ca 0.58 -1.47 0.00 0.00 -0.52 0.00 0.00 55.73 54.32 3b4o s ARG 34 Cb -0.25 0.03 0.00 0.00 0.52 0.00 0.00 34.95 35.25 3b4o s ARG 34 CO 0.21 -0.20 0.00 0.41 0.02 0.00 0.00 175.30 175.74 3b4o n GLY 35 N -0.15 2.66 0.29 -3.53 0.00 -1.26 -2.39 105.19 100.81 3b4o n GLY 35 Ca -0.06 -0.26 0.18 0.00 0.00 0.00 0.00 46.02 45.88 3b4o n GLY 35 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3b4o h GLU 36 N 0.00 0.00 0.00 1.61 4.39 -1.99 -0.77 114.58 117.82 3b4o h GLU 36 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3b4o h GLU 36 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3b4o h GLU 36 CO 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.85 3b4o h ALA 37 N 2.00 1.00 0.00 3.43 0.00 -1.88 -2.53 119.26 121.28 3b4o h ALA 37 Ca -0.00 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3b4o h ALA 37 Cb 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3b4o h ALA 37 CO 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 179.25 178.96 3b4o h ARG 38 N 0.00 0.00 0.00 0.00 3.08 -1.22 -2.13 114.38 114.11 3b4o h ARG 38 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3b4o h ARG 38 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3b4o h ARG 38 CO 0.00 0.30 0.03 -0.07 -1.07 0.00 0.00 179.97 179.15 3b4o h LEU 39 N 0.00 0.00 -2.95 3.04 3.38 -1.64 -2.88 115.31 114.26 3b4o h LEU 39 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3b4o h LEU 39 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 3b4o h LEU 39 CO 0.04 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.86 3b4o n LYS 40 N -3.03 2.86 0.24 1.13 5.02 -0.81 -4.72 118.16 118.85 3b4o n LYS 40 Ca -0.03 -2.02 0.08 0.00 -2.02 0.00 0.00 58.31 54.32 3b4o n LYS 40 Cb 0.09 -1.27 0.59 0.00 -0.02 0.00 0.00 35.03 34.42 3b4o n LYS 40 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3b4o h ARG 41 N 1.46 0.00 0.00 1.97 2.43 -1.46 -2.15 114.38 116.63 3b4o h ARG 41 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3b4o h ARG 41 Cb 0.76 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 3b4o h ARG 41 CO 0.02 0.15 0.00 1.12 -1.51 0.00 0.00 179.97 179.76 3b4o h HIS 42 N 0.00 0.00 0.00 2.20 2.07 -1.84 -2.19 115.15 115.38 3b4o h HIS 42 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3b4o h HIS 42 Cb 0.30 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.28 3b4o h HIS 42 CO 0.00 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.14 3b4o n LEU 43 N -2.48 0.00 -0.07 6.12 4.77 -0.81 -2.29 117.00 122.25 3b4o n LEU 43 Ca -0.01 0.50 0.14 0.00 -0.03 0.00 0.00 56.01 56.61 3b4o n LEU 43 Cb 0.10 -0.50 0.61 0.00 -2.33 0.00 0.00 43.42 41.30 3b4o n LEU 43 CO 0.15 -0.12 0.87 0.18 -1.33 0.00 0.00 177.39 177.14 3b4o n LEU 44 N -1.50 0.32 -4.95 2.23 4.77 -0.83 -4.89 117.00 112.15 3b4o n LEU 44 Ca 0.05 0.13 -0.23 0.00 -0.03 0.00 0.00 56.01 55.93 3b4o n LEU 44 Cb 0.26 -0.25 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 3b4o n LEU 44 CO 0.20 0.06 -0.07 -0.36 -1.33 0.00 0.00 177.39 175.90 3b4o s PHE 45 N -2.62 3.45 1.00 -1.77 0.08 -0.97 -0.30 117.98 116.86 3b4o s PHE 45 Ca 0.25 0.02 -0.11 0.00 0.12 0.00 0.00 56.93 57.21 3b4o s PHE 45 Cb 0.20 -1.60 0.19 0.00 -0.57 0.00 0.00 43.02 41.24 3b4o s PHE 45 CO 0.50 0.47 1.09 0.95 -0.10 0.00 0.00 175.22 178.13 3b4o s THR 46 N -1.90 2.23 0.24 0.64 -4.23 -0.59 -4.72 115.64 107.31 3b4o s THR 46 Ca 0.34 0.07 -0.07 0.00 -1.18 0.00 0.00 61.69 60.86 3b4o s THR 46 Cb -0.10 -2.24 0.22 0.00 1.34 0.00 0.00 72.50 71.73 3b4o s THR 46 CO 0.29 -0.10 1.89 -0.08 -0.54 0.00 0.00 174.62 176.08 3b4o h GLU 47 N -2.07 1.11 -0.64 3.99 4.57 -1.95 -1.95 114.58 117.63 3b4o h GLU 47 Ca -0.52 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 57.59 3b4o h GLU 47 Cb 1.30 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 29.64 3b4o h GLU 47 CO 0.48 0.73 0.00 -0.40 -1.18 0.00 0.00 179.01 178.65 3b4o n ASP 48 N -4.51 4.43 -4.75 1.04 3.85 -1.26 -1.10 116.55 114.25 3b4o n ASP 48 Ca 0.11 -2.51 -0.39 0.00 -0.71 0.00 0.00 54.79 51.29 3b4o n ASP 48 Cb 0.07 -0.58 0.04 0.00 -1.35 0.00 0.00 41.12 39.31 3b4o n ASP 48 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 3b4o s GLY 49 N -0.77 2.90 -0.00 6.12 0.00 -0.73 -4.36 107.32 110.47 3b4o s GLY 49 Ca 0.45 1.36 0.08 0.00 0.00 0.00 0.00 44.72 46.61 3b4o s GLY 49 CO 0.19 1.89 -0.25 0.14 0.00 0.00 0.00 173.10 175.07 3b4o s VAL 50 N -1.28 1.96 0.10 1.40 1.01 -0.23 0.23 120.40 123.58 3b4o s VAL 50 Ca 0.71 -1.13 -0.01 0.00 0.00 0.00 0.00 61.98 61.56 3b4o s VAL 50 Cb -0.41 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 3b4o s VAL 50 CO 0.49 0.49 0.03 -0.83 0.00 0.00 0.00 175.10 175.28 3b4o s GLY 51 N -0.75 0.79 0.00 4.51 0.00 -0.90 -0.29 107.32 110.68 3b4o s GLY 51 Ca 0.10 -1.36 0.00 0.00 0.00 0.00 0.00 44.72 43.45 3b4o s GLY 51 CO -0.00 -1.33 0.00 0.61 0.00 0.00 0.00 173.10 172.37 3b4o n GLY 52 N -0.03 0.58 3.64 0.20 0.00 -1.12 -0.55 105.19 107.91 3b4o n GLY 52 Ca -0.08 -1.77 -0.38 0.00 0.00 0.00 0.00 46.02 43.78 3b4o n GLY 52 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3b4o s LEU 53 N 0.00 4.09 0.00 0.99 2.96 -0.96 -1.72 118.68 124.03 3b4o s LEU 53 Ca 0.00 0.22 0.21 0.00 -0.22 0.00 0.00 54.13 54.33 3b4o s LEU 53 Cb 0.00 -2.27 0.11 0.00 0.50 0.00 0.00 46.19 44.53 3b4o s LEU 53 CO 0.00 -0.05 1.11 0.79 -1.32 0.00 0.00 176.35 176.88 3b4o n TRP 54 N 4.73 0.00 -3.89 5.38 8.01 0.44 -1.30 117.44 130.80 3b4o n TRP 54 Ca -0.12 0.00 -0.30 0.00 -1.31 0.00 0.00 57.50 55.77 3b4o n TRP 54 Cb 0.51 0.00 -0.14 0.00 -2.01 0.00 0.00 31.31 29.67 3b4o n TRP 54 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.69 177.63 3b4o s THR 55 N -1.91 1.94 0.33 -0.99 -4.23 -1.25 -4.63 115.64 104.89 3b4o s THR 55 Ca 0.22 -2.44 0.08 0.00 -1.18 0.00 0.00 61.69 58.37 3b4o s THR 55 Cb 0.17 -2.40 -0.06 0.00 1.34 0.00 0.00 72.50 71.55 3b4o s THR 55 CO 0.34 -0.71 -0.07 0.42 -0.54 0.00 0.00 174.62 174.05 3b4o s THR 56 N 0.65 2.00 0.27 3.99 -4.23 -1.26 -4.66 115.64 112.39 3b4o s THR 56 Ca 0.13 -2.16 0.26 0.00 -1.18 0.00 0.00 61.69 58.74 3b4o s THR 56 Cb -0.21 -2.60 0.26 0.00 1.34 0.00 0.00 72.50 71.29 3b4o s THR 56 CO -0.08 -0.22 1.94 -2.24 -0.54 0.00 0.00 174.62 173.49 3b4o h ASP 57 N 2.10 0.00 1.09 3.99 3.04 -1.96 -2.37 116.42 122.31 3b4o h ASP 57 Ca -0.41 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.38 3b4o h ASP 57 Cb 1.24 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.53 3b4o h ASP 57 CO 0.70 0.18 0.00 0.77 -2.04 0.00 0.00 179.24 178.84 3b4o h SER 58 N 0.00 0.00 0.00 4.15 4.64 -2.02 -3.46 113.55 116.86 3b4o h SER 58 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3b4o h SER 58 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3b4o h SER 58 CO 0.02 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 3b4o n GLY 59 N 0.50 1.25 3.82 -0.77 0.00 -0.89 -5.02 105.19 104.08 3b4o n GLY 59 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3b4o n GLY 59 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3b4o s GLN 60 N -0.16 3.06 0.42 1.61 -1.52 -1.26 -4.91 119.66 116.90 3b4o s GLN 60 Ca 0.00 -0.59 -0.25 0.00 -1.95 0.00 0.00 55.36 52.58 3b4o s GLN 60 Cb 0.00 -2.83 -0.08 0.00 -0.22 0.00 0.00 33.01 29.87 3b4o s GLN 60 CO 0.00 0.59 1.19 -2.14 -0.25 0.00 0.00 175.29 174.69 3b4o s PRO 61 N -2.31 3.94 -1.06 2.91 0.02 -1.26 -4.38 135.00 132.86 3b4o s PRO 61 Ca 0.30 1.88 -0.17 0.00 0.02 0.00 0.00 61.00 63.04 3b4o s PRO 61 Cb -0.12 -2.61 0.15 0.00 0.02 0.00 0.00 34.50 31.93 3b4o s PRO 61 CO 0.22 -0.43 1.27 0.42 -0.33 0.00 0.00 177.00 178.16 3b4o s ILE 62 N -1.42 4.84 -0.11 2.83 1.01 -0.42 -5.01 121.20 122.93 3b4o s ILE 62 Ca 0.59 -2.02 -0.13 0.00 0.00 0.00 0.00 60.65 59.08 3b4o s ILE 62 Cb -0.32 -4.85 -0.05 0.00 0.01 0.00 0.00 42.46 37.26 3b4o s ILE 62 CO 0.39 -1.57 0.31 0.00 0.00 0.00 0.00 174.94 174.07 3b4o s ALA 63 N 2.27 3.66 -0.28 9.38 0.00 -1.26 -2.26 121.76 133.27 3b4o s ALA 63 Ca 0.38 -0.41 -0.01 0.00 0.00 0.00 0.00 51.96 51.91 3b4o s ALA 63 Cb -0.04 -2.33 0.04 0.00 0.00 0.00 0.00 23.12 20.79 3b4o s ALA 63 CO -0.05 0.28 -0.03 0.42 0.00 0.00 0.00 175.76 176.38 3b4o s ILE 64 N -0.19 2.88 -0.34 0.00 1.01 0.29 -4.99 121.20 119.87 3b4o s ILE 64 Ca 0.19 -1.26 -0.11 0.00 0.00 0.00 0.00 60.65 59.47 3b4o s ILE 64 Cb -0.14 -2.58 0.00 0.00 0.01 0.00 0.00 42.46 39.75 3b4o s ILE 64 CO 0.07 0.02 0.19 -0.13 0.00 0.00 0.00 174.94 175.09 3b4o s ARG 65 N 1.27 3.20 0.00 2.79 0.52 -1.26 -2.11 118.95 123.35 3b4o s ARG 65 Ca -0.03 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.35 3b4o s ARG 65 Cb -0.18 -3.66 0.00 0.00 0.52 0.00 0.00 34.95 31.62 3b4o s ARG 65 CO -0.03 -0.51 0.00 0.41 0.02 0.00 0.00 175.30 175.19 3b4o n GLY 66 N 5.01 2.82 0.22 -3.53 0.00 0.13 -4.57 105.19 105.29 3b4o n GLY 66 Ca -0.13 -1.62 -0.00 0.00 0.00 0.00 0.00 46.02 44.27 3b4o n GLY 66 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3b4o h ARG 67 N 0.00 0.07 -0.36 1.61 2.43 -1.25 0.02 114.38 116.91 3b4o h ARG 67 Ca 0.00 -0.00 -0.12 0.00 -0.81 0.00 0.00 59.98 59.04 3b4o h ARG 67 Cb 0.00 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 3b4o h ARG 67 CO 0.00 0.05 -0.27 0.93 -1.51 0.00 0.00 179.97 179.17 3b4o h GLU 68 N 0.07 0.74 -0.57 0.20 4.39 -1.90 -0.99 114.58 116.53 3b4o h GLU 68 Ca 0.29 -0.32 -0.09 0.00 0.34 0.00 0.00 59.36 59.59 3b4o h GLU 68 Cb 0.46 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.07 3b4o h GLU 68 CO -0.53 0.93 0.01 0.87 -1.16 0.00 0.00 179.01 179.13 3b4o h LYS 69 N 0.64 0.97 -0.72 2.33 1.79 -1.68 -2.15 116.57 117.75 3b4o h LYS 69 Ca 0.08 -0.29 0.02 0.00 -2.18 0.00 0.00 60.65 58.28 3b4o h LYS 69 Cb 0.79 -0.10 -0.04 0.00 -1.58 0.00 0.00 32.23 31.29 3b4o h LYS 69 CO 0.06 0.95 0.47 -0.07 -1.08 0.00 0.00 179.45 179.78 3b4o h LEU 70 N 0.90 0.78 -1.05 2.94 3.38 -0.55 -2.27 115.31 119.44 3b4o h LEU 70 Ca 0.17 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.14 3b4o h LEU 70 Cb 0.51 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.03 3b4o h LEU 70 CO 0.02 0.55 0.64 1.23 0.09 0.00 0.00 178.44 180.98 3b4o h GLY 71 N 0.93 1.36 1.05 0.83 0.00 -0.70 -2.67 103.07 103.87 3b4o h GLY 71 Ca 0.28 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 47.05 3b4o h GLY 71 CO -0.09 0.49 0.27 0.83 0.00 0.00 0.00 176.54 178.04 3b4o h GLU 72 N 1.30 1.16 -0.48 4.80 5.08 -1.03 -2.85 114.58 122.56 3b4o h GLU 72 Ca 0.36 -0.23 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 3b4o h GLU 72 Cb -0.14 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 28.91 3b4o h GLU 72 CO -0.08 0.96 0.14 1.25 -1.00 0.00 0.00 179.01 180.29 3b4o h HIS 73 N 1.11 0.71 -0.97 4.33 2.76 -1.12 -2.37 115.15 119.61 3b4o h HIS 73 Ca 0.25 -0.05 0.19 0.00 -2.20 0.00 0.00 60.37 58.56 3b4o h HIS 73 Cb 0.27 -0.22 -0.09 0.00 1.55 0.00 0.00 27.41 28.92 3b4o h HIS 73 CO 0.02 0.59 0.61 0.00 -1.30 0.00 0.00 177.93 177.86 3b4o h ALA 74 N 1.47 1.90 -0.22 5.26 0.00 -1.23 0.78 119.26 127.22 3b4o h ALA 74 Ca 0.16 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3b4o h ALA 74 Cb 0.22 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3b4o h ALA 74 CO -0.01 -0.23 0.05 0.28 0.00 0.00 0.00 179.25 179.34 3b4o h VAL 75 N 0.62 1.21 -0.58 0.00 2.07 -1.45 -1.06 116.25 117.06 3b4o h VAL 75 Ca 0.53 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 3b4o h VAL 75 Cb 1.00 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 3b4o h VAL 75 CO -0.28 0.21 0.27 -0.25 0.02 0.00 0.00 177.57 177.53 3b4o h TRP 76 N 0.17 0.85 -0.20 1.57 7.01 -1.12 -2.57 115.95 121.67 3b4o h TRP 76 Ca 0.07 -0.05 0.02 0.00 2.11 0.00 0.00 58.89 61.04 3b4o h TRP 76 Cb 0.27 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 27.05 3b4o h TRP 76 CO 0.01 0.66 0.08 1.03 -2.79 0.00 0.00 178.44 177.43 3b4o h SER 77 N 0.79 0.10 -0.42 2.65 0.87 0.76 -1.64 113.55 116.66 3b4o h SER 77 Ca 0.20 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.74 3b4o h SER 77 Cb 0.14 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.08 3b4o h SER 77 CO -0.02 0.09 0.16 0.25 -0.53 0.00 0.00 176.83 176.77 3b4o h LEU 78 N 0.18 0.63 -0.23 2.23 5.85 -1.09 0.20 115.31 123.08 3b4o h LEU 78 Ca 0.08 -0.08 -0.21 0.00 0.84 0.00 0.00 57.88 58.51 3b4o h LEU 78 Cb 0.04 -0.16 0.01 0.00 0.37 0.00 0.00 40.66 40.92 3b4o h LEU 78 CO -0.08 0.60 -0.75 0.06 -0.34 0.00 0.00 178.44 177.93 3b4o h GLN 79 N 0.68 0.71 0.00 1.25 3.07 -1.13 -3.14 115.11 116.54 3b4o h GLN 79 Ca 0.16 -0.57 -0.18 0.00 0.09 0.00 0.00 58.65 58.15 3b4o h GLN 79 Cb 0.19 0.12 -0.03 0.00 0.08 0.00 0.00 27.48 27.84 3b4o h GLN 79 CO -0.01 1.18 -1.02 0.00 0.09 0.00 0.00 178.83 179.07 3b4o n PHE 81 N -3.17 2.61 0.03 0.00 3.01 0.67 -0.70 117.46 119.92 3b4o n PHE 81 Ca -0.04 -4.04 0.04 0.00 1.01 0.00 0.00 57.45 54.42 3b4o n PHE 81 Cb 0.87 -0.48 0.44 0.00 -0.01 0.00 0.00 39.48 40.29 3b4o n PHE 81 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 3b4o h PRO 82 N 4.54 0.46 0.00 -1.08 0.13 -1.70 -3.12 132.00 131.23 3b4o h PRO 82 Ca 0.17 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 65.25 3b4o h PRO 82 Cb 0.73 -0.10 -0.04 0.00 0.13 0.00 0.00 31.00 31.72 3b4o h PRO 82 CO 0.72 0.34 -0.51 -0.40 -0.23 0.00 0.00 178.00 177.92 3b4o n ASP 83 N -4.46 1.67 -4.74 1.44 5.68 -1.26 -4.87 116.55 110.01 3b4o n ASP 83 Ca 0.02 -3.58 -0.42 0.00 -0.50 0.00 0.00 54.79 50.31 3b4o n ASP 83 Cb 0.09 -0.49 -0.01 0.00 -1.14 0.00 0.00 41.12 39.56 3b4o n ASP 83 CO 0.00 0.00 0.00 1.87 -1.33 0.00 0.00 177.20 177.74 3b4o n TRP 84 N -0.96 2.84 -4.51 2.11 -0.00 -1.18 -4.79 117.44 110.95 3b4o n TRP 84 Ca 0.17 0.28 -0.21 0.00 -0.00 0.00 0.00 57.50 57.74 3b4o n TRP 84 Cb 0.74 -2.59 -0.15 0.00 -0.00 0.00 0.00 31.31 29.31 3b4o n TRP 84 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 177.69 177.83 3b4o s VAL 85 N -0.11 1.02 0.07 5.87 -7.23 -0.86 -4.73 120.40 114.42 3b4o s VAL 85 Ca 0.63 -0.65 -0.18 0.00 -1.81 0.00 0.00 61.98 59.97 3b4o s VAL 85 Cb -0.50 -0.87 -0.07 0.00 0.56 0.00 0.00 36.38 35.51 3b4o s VAL 85 CO 0.50 0.21 0.54 0.26 -0.31 0.00 0.00 175.10 176.30 3b4o s TRP 86 N -0.44 3.78 0.19 2.82 0.52 -1.26 -2.15 118.94 122.40 3b4o s TRP 86 Ca 0.04 1.22 -0.02 0.00 0.02 0.00 0.00 56.10 57.36 3b4o s TRP 86 Cb -0.06 -2.46 -0.04 0.00 -1.15 0.00 0.00 33.47 29.77 3b4o s TRP 86 CO -0.00 0.59 0.14 0.95 0.02 0.00 0.00 176.95 178.65 3b4o s THR 87 N -1.13 0.02 -1.39 2.01 -4.23 0.84 -4.89 115.64 106.87 3b4o s THR 87 Ca 0.29 -1.94 -0.03 0.00 -1.18 0.00 0.00 61.69 58.83 3b4o s THR 87 Cb -0.19 -2.40 0.02 0.00 1.34 0.00 0.00 72.50 71.28 3b4o s THR 87 CO 0.18 -0.08 0.67 0.47 -0.54 0.00 0.00 174.62 175.32 3b4o n ASP 88 N -0.25 -1.62 -4.66 3.99 8.00 -1.26 -0.70 116.55 120.05 3b4o n ASP 88 Ca 0.00 -0.87 -0.43 0.00 0.71 0.00 0.00 54.79 54.20 3b4o n ASP 88 Cb 0.65 -3.71 -0.02 0.00 -0.02 0.00 0.00 41.12 38.02 3b4o n ASP 88 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3b4o s ILE 89 N -3.67 4.52 -0.19 0.53 1.01 -1.26 -4.17 121.20 117.98 3b4o s ILE 89 Ca 0.14 1.84 0.01 0.00 0.00 0.00 0.00 60.65 62.64 3b4o s ILE 89 Cb -0.07 -4.19 0.03 0.00 0.01 0.00 0.00 42.46 38.24 3b4o s ILE 89 CO 0.84 -0.14 -0.18 -1.10 0.00 0.00 0.00 174.94 174.35 3b4o s GLN 90 N 3.19 2.81 -0.12 2.79 -0.21 0.24 -5.01 119.66 123.34 3b4o s GLN 90 Ca 0.49 -0.87 -0.16 0.00 0.02 0.00 0.00 55.36 54.84 3b4o s GLN 90 Cb -0.18 -2.56 -0.04 0.00 1.00 0.00 0.00 33.01 31.23 3b4o s GLN 90 CO 0.11 -0.26 0.40 0.42 -2.12 0.00 0.00 175.29 173.83 3b4o s ILE 91 N 1.29 5.22 -0.26 1.08 1.01 -1.26 -1.72 121.20 126.56 3b4o s ILE 91 Ca 0.03 0.79 -0.03 0.00 0.00 0.00 0.00 60.65 61.44 3b4o s ILE 91 Cb -0.14 -3.73 0.02 0.00 0.01 0.00 0.00 42.46 38.62 3b4o s ILE 91 CO -0.12 0.38 -0.03 -0.36 0.00 0.00 0.00 174.94 174.81 3b4o s PHE 92 N 0.40 3.09 0.66 3.97 0.40 0.84 -5.02 117.98 122.32 3b4o s PHE 92 Ca 0.22 -1.43 -0.14 0.00 -0.60 0.00 0.00 56.93 54.98 3b4o s PHE 92 Cb -0.14 -2.10 -0.00 0.00 0.51 0.00 0.00 43.02 41.28 3b4o s PHE 92 CO 0.08 -0.70 1.08 -1.21 0.70 0.00 0.00 175.22 175.17 3b4o s GLU 93 N 1.36 2.94 0.40 0.44 2.02 -1.26 -1.68 118.70 122.92 3b4o s GLU 93 Ca 0.01 1.20 0.02 0.00 0.02 0.00 0.00 54.97 56.21 3b4o s GLU 93 Cb -0.17 -1.98 -0.01 0.00 0.10 0.00 0.00 34.13 32.07 3b4o s GLU 93 CO -0.03 -1.11 0.06 0.25 0.02 0.00 0.00 175.26 174.45 3b4o n THR 94 N -2.58 0.00 0.28 3.63 -2.24 -1.18 -4.88 114.28 107.31 3b4o n THR 94 Ca 0.09 -2.08 0.16 0.00 -2.27 0.00 0.00 64.05 59.95 3b4o n THR 94 Cb 0.53 0.57 0.78 0.00 -2.10 0.00 0.00 70.33 70.11 3b4o n THR 94 CO 0.00 0.00 0.00 0.06 -0.57 0.00 0.00 175.07 174.56 3b4o h GLN 95 N 0.00 0.00 -5.03 -0.78 -0.00 -1.98 -3.38 115.11 103.93 3b4o h GLN 95 Ca -0.32 0.00 -0.67 0.00 -0.00 0.00 0.00 58.65 57.66 3b4o h GLN 95 Cb 1.08 0.00 -0.17 0.00 -0.00 0.00 0.00 27.48 28.39 3b4o h GLN 95 CO 0.53 0.00 -0.17 0.34 -0.00 0.00 0.00 178.83 179.53 3b4o s ASP 96 N -4.69 6.23 0.61 0.06 -1.08 -1.26 -4.96 116.67 111.57 3b4o s ASP 96 Ca -0.01 -0.32 0.41 0.00 -0.52 0.00 0.00 52.55 52.10 3b4o s ASP 96 Cb 0.09 -2.23 2.17 0.00 -1.46 0.00 0.00 42.92 41.49 3b4o s ASP 96 CO 0.36 -0.48 2.24 -0.65 0.52 0.00 0.00 175.17 177.16 3b4o h PRO 97 N 8.57 0.00 -0.64 4.34 0.11 -1.91 -1.44 132.00 141.03 3b4o h PRO 97 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3b4o h PRO 97 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3b4o h PRO 97 CO 0.76 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.64 3b4o n ASN 98 N -2.96 4.42 -3.65 -2.05 3.02 -1.26 -4.23 115.26 108.55 3b4o n ASN 98 Ca -0.02 -2.55 -0.15 0.00 -0.03 0.00 0.00 54.58 51.83 3b4o n ASN 98 Cb 0.09 -0.58 -0.14 0.00 -0.61 0.00 0.00 39.78 38.53 3b4o n ASN 98 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3b4o s TRP 99 N -2.09 -0.30 0.16 3.10 -0.11 -0.54 -0.60 118.94 118.55 3b4o s TRP 99 Ca 0.43 0.75 0.09 0.00 1.22 0.00 0.00 56.10 58.60 3b4o s TRP 99 Cb 0.30 -0.16 -0.04 0.00 -1.50 0.00 0.00 33.47 32.07 3b4o s TRP 99 CO 0.17 -0.34 -0.21 -0.06 -4.62 0.00 0.00 176.95 171.90 3b4o s PHE 100 N 2.36 1.97 0.07 5.86 0.40 -0.44 -3.10 117.98 125.10 3b4o s PHE 100 Ca 0.03 -0.42 0.09 0.00 -0.60 0.00 0.00 56.93 56.03 3b4o s PHE 100 Cb -0.12 -1.00 -0.03 0.00 0.51 0.00 0.00 43.02 42.37 3b4o s PHE 100 CO -0.08 0.35 -0.25 -1.58 0.70 0.00 0.00 175.22 174.37 3b4o s TRP 101 N -1.72 2.21 -0.07 0.36 0.52 -0.67 -0.97 118.94 118.60 3b4o s TRP 101 Ca 0.15 -0.40 0.03 0.00 0.02 0.00 0.00 56.10 55.91 3b4o s TRP 101 Cb -0.07 -1.29 0.00 0.00 -1.15 0.00 0.00 33.47 30.96 3b4o s TRP 101 CO 0.07 0.18 -0.17 0.08 0.02 0.00 0.00 176.95 177.13 3b4o s VAL 102 N -0.88 1.48 -0.16 4.03 1.01 0.23 -0.11 120.40 126.00 3b4o s VAL 102 Ca 0.11 -0.70 -0.05 0.00 0.00 0.00 0.00 61.98 61.34 3b4o s VAL 102 Cb -0.10 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 3b4o s VAL 102 CO 0.03 0.43 0.03 -0.70 0.00 0.00 0.00 175.10 174.89 3b4o s GLU 103 N 0.38 3.71 0.36 2.72 2.12 -0.70 -0.41 118.70 126.88 3b4o s GLU 103 Ca -0.12 -0.39 -0.16 0.00 0.36 0.00 0.00 54.97 54.66 3b4o s GLU 103 Cb -0.15 -3.06 0.05 0.00 0.26 0.00 0.00 34.13 31.22 3b4o s GLU 103 CO 0.05 0.37 0.76 0.00 -0.54 0.00 0.00 175.26 175.89 3b4o s ARG 105 N -2.64 2.18 0.00 0.00 1.81 0.12 -1.29 118.95 119.13 3b4o s ARG 105 Ca 0.16 -1.57 -0.01 0.00 -1.72 0.00 0.00 55.73 52.59 3b4o s ARG 105 Cb -0.05 -2.06 -0.01 0.00 -0.45 0.00 0.00 34.95 32.39 3b4o s ARG 105 CO 0.11 0.26 0.02 0.20 -0.68 0.00 0.00 175.30 175.21 3b4o s GLY 106 N -3.69 0.08 0.02 -3.53 0.00 -0.64 -0.11 107.32 99.44 3b4o s GLY 106 Ca 0.33 -0.17 -0.12 0.00 0.00 0.00 0.00 44.72 44.76 3b4o s GLY 106 CO 0.20 -0.21 0.25 1.85 0.00 0.00 0.00 173.10 175.19 3b4o s GLU 107 N -0.64 0.69 0.00 2.90 2.12 -0.92 -1.32 118.70 121.53 3b4o s GLU 107 Ca -0.07 -0.42 0.00 0.00 0.36 0.00 0.00 54.97 54.83 3b4o s GLU 107 Cb -0.04 0.30 0.00 0.00 0.26 0.00 0.00 34.13 34.64 3b4o s GLU 107 CO -0.00 -0.20 0.00 0.41 -0.54 0.00 0.00 175.26 174.93 3b4o n GLY 108 N 0.95 1.92 3.77 -1.50 0.00 -0.44 -2.04 105.19 107.84 3b4o n GLY 108 Ca -0.20 -1.01 -0.39 0.00 0.00 0.00 0.00 46.02 44.42 3b4o n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b4o s ALA 109 N -2.00 3.19 -0.11 4.61 0.00 -1.26 -0.82 121.76 125.37 3b4o s ALA 109 Ca 0.00 1.24 0.01 0.00 0.00 0.00 0.00 51.96 53.21 3b4o s ALA 109 Cb 0.00 -3.49 -0.02 0.00 0.00 0.00 0.00 23.12 19.61 3b4o s ALA 109 CO 0.00 -0.89 -0.14 -1.50 0.00 0.00 0.00 175.76 173.23 3b4o s ILE 110 N -1.29 3.04 -0.45 0.00 2.07 -0.35 -4.17 121.20 120.05 3b4o s ILE 110 Ca 0.59 -0.69 0.05 0.00 -1.41 0.00 0.00 60.65 59.20 3b4o s ILE 110 Cb -0.38 -2.25 0.19 0.00 0.13 0.00 0.00 42.46 40.15 3b4o s ILE 110 CO 0.48 0.54 0.41 0.52 -1.91 0.00 0.00 174.94 174.99 3b4o n VAL 111 N 3.17 -0.62 -3.84 4.00 0.31 0.12 -1.16 118.33 120.30 3b4o n VAL 111 Ca -0.18 -3.79 -0.35 0.00 -0.01 0.00 0.00 64.34 60.01 3b4o n VAL 111 Cb 0.53 -1.80 -0.08 0.00 -0.91 0.00 0.00 33.84 31.58 3b4o n VAL 111 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3b4o s PHE 112 N -0.49 3.38 0.20 3.52 2.99 -1.26 -4.40 117.98 121.93 3b4o s PHE 112 Ca 0.33 0.28 -0.32 0.00 0.00 0.00 0.00 56.93 57.22 3b4o s PHE 112 Cb 0.06 -2.10 -0.11 0.00 0.00 0.00 0.00 43.02 40.87 3b4o s PHE 112 CO -0.17 0.32 1.67 -2.14 -0.00 0.00 0.00 175.22 174.90 3b4o s PRO 113 N 0.15 4.15 0.00 0.24 0.02 -1.26 -2.50 135.00 135.79 3b4o s PRO 113 Ca 0.08 2.54 0.00 0.00 0.02 0.00 0.00 61.00 63.64 3b4o s PRO 113 Cb -0.11 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.31 3b4o s PRO 113 CO -0.01 -0.70 0.00 0.41 -0.33 0.00 0.00 177.00 176.37 3b4o n GLY 114 N 3.75 1.53 3.23 0.52 0.00 -1.26 -5.07 105.19 107.90 3b4o n GLY 114 Ca 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.00 3b4o n GLY 114 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3b4o s TYR 115 N -2.11 1.31 0.54 1.61 1.51 -1.04 -5.12 117.35 114.04 3b4o s TYR 115 Ca 0.00 -0.60 -0.22 0.00 -1.01 0.00 0.00 57.07 55.24 3b4o s TYR 115 Cb 0.00 -0.69 -0.05 0.00 -0.11 0.00 0.00 41.96 41.11 3b4o s TYR 115 CO 0.00 0.11 1.34 -2.14 -1.11 0.00 0.00 175.55 173.75 3b4o s PRO 116 N -2.83 3.21 0.32 -1.71 0.02 -1.26 -4.64 135.00 128.12 3b4o s PRO 116 Ca 0.09 2.20 -0.29 0.00 0.02 0.00 0.00 61.00 63.02 3b4o s PRO 116 Cb -0.04 -2.28 -0.12 0.00 0.02 0.00 0.00 34.50 32.08 3b4o s PRO 116 CO 0.02 -1.12 1.33 -2.13 -0.33 0.00 0.00 177.00 174.77 3b4o n ARG 117 N -0.95 2.15 -4.26 5.54 0.63 -1.26 -4.82 116.66 113.69 3b4o n ARG 117 Ca 0.10 0.76 -0.16 0.00 -0.92 0.00 0.00 57.85 57.62 3b4o n ARG 117 Cb 0.45 -2.37 -0.09 0.00 0.45 0.00 0.00 32.46 30.90 3b4o n ARG 117 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 3b4o s GLY 118 N -0.15 1.91 -0.20 5.14 0.00 -0.31 -5.00 107.32 108.72 3b4o s GLY 118 Ca 0.58 -1.87 -0.05 0.00 0.00 0.00 0.00 44.72 43.39 3b4o s GLY 118 CO 0.59 -1.46 -0.00 1.62 0.00 0.00 0.00 173.10 173.85 3b4o s GLN 119 N -3.81 3.60 -0.17 2.90 2.00 -1.26 -1.22 119.66 121.71 3b4o s GLN 119 Ca 0.39 -0.53 -0.03 0.00 -2.00 0.00 0.00 55.36 53.20 3b4o s GLN 119 Cb 0.05 -3.08 -0.02 0.00 0.80 0.00 0.00 33.01 30.76 3b4o s GLN 119 CO 0.19 -0.00 -0.07 -0.47 -0.50 0.00 0.00 175.29 174.44 3b4o s TYR 120 N 1.04 2.93 0.07 1.67 5.04 -0.00 -4.59 117.35 123.50 3b4o s TYR 120 Ca 0.02 -0.64 0.07 0.00 -2.44 0.00 0.00 57.07 54.08 3b4o s TYR 120 Cb -0.14 -1.97 -0.03 0.00 0.35 0.00 0.00 41.96 40.16 3b4o s TYR 120 CO 0.02 -0.28 -0.20 1.03 -1.34 0.00 0.00 175.55 174.78 3b4o s ARG 121 N 0.76 1.23 0.25 4.97 0.52 -1.26 -1.33 118.95 124.09 3b4o s ARG 121 Ca -0.03 -1.02 -0.17 0.00 -0.52 0.00 0.00 55.73 53.98 3b4o s ARG 121 Cb -0.15 -1.40 0.01 0.00 0.52 0.00 0.00 34.95 33.93 3b4o s ARG 121 CO 0.02 0.34 0.60 1.21 0.02 0.00 0.00 175.30 177.49 3b4o s ASN 122 N -1.50 -0.20 -0.17 0.23 3.04 -0.43 -4.73 114.94 111.17 3b4o s ASN 122 Ca 0.06 -0.69 -0.06 0.00 0.04 0.00 0.00 52.86 52.22 3b4o s ASN 122 Cb -0.09 0.65 -0.03 0.00 -1.54 0.00 0.00 41.25 40.23 3b4o s ASN 122 CO 0.03 -1.22 0.01 -2.28 -3.04 0.00 0.00 177.10 170.61 3b4o s HIS 123 N -3.94 3.14 0.04 0.43 5.65 -1.26 -1.62 115.29 117.72 3b4o s HIS 123 Ca 0.15 -0.12 0.08 0.00 0.25 0.00 0.00 55.06 55.42 3b4o s HIS 123 Cb -0.03 -2.02 -0.03 0.00 -1.18 0.00 0.00 32.58 29.32 3b4o s HIS 123 CO 0.06 0.06 -0.23 -0.06 -0.65 0.00 0.00 174.74 173.92 3b4o s PHE 124 N 0.38 2.00 -0.10 3.88 0.40 -0.41 -4.18 117.98 119.95 3b4o s PHE 124 Ca -0.00 -0.39 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 3b4o s PHE 124 Cb -0.13 -1.20 -0.01 0.00 0.51 0.00 0.00 43.02 42.18 3b4o s PHE 124 CO 0.02 0.09 -0.17 -0.51 0.70 0.00 0.00 175.22 175.34 3b4o s LEU 125 N -1.11 2.51 -0.03 -0.37 1.43 0.13 -1.53 118.68 119.71 3b4o s LEU 125 Ca 0.09 -0.38 0.07 0.00 -1.03 0.00 0.00 54.13 52.88 3b4o s LEU 125 Cb -0.09 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 3b4o s LEU 125 CO 0.02 0.21 -0.24 -1.00 0.23 0.00 0.00 176.35 175.56 3b4o s HIS 126 N 0.09 2.40 -0.13 0.29 3.76 0.45 -0.39 115.29 121.76 3b4o s HIS 126 Ca -0.08 -0.45 -0.05 0.00 -0.15 0.00 0.00 55.06 54.34 3b4o s HIS 126 Cb -0.15 -1.53 -0.04 0.00 1.11 0.00 0.00 32.58 31.97 3b4o s HIS 126 CO 0.05 -0.04 0.03 0.45 -0.85 0.00 0.00 174.74 174.39 3b4o s SER 127 N -0.55 5.47 -0.19 1.40 0.15 0.33 -0.60 113.70 119.70 3b4o s SER 127 Ca 0.08 0.13 -0.00 0.00 0.70 0.00 0.00 55.95 56.86 3b4o s SER 127 Cb -0.11 -1.75 0.05 0.00 -1.71 0.00 0.00 66.02 62.50 3b4o s SER 127 CO -0.00 0.29 -0.05 -0.36 1.20 0.00 0.00 173.24 174.32 3b4o s PHE 128 N -0.35 1.87 -0.11 3.44 0.08 -0.14 -1.58 117.98 121.19 3b4o s PHE 128 Ca 0.08 -1.28 -0.02 0.00 0.12 0.00 0.00 56.93 55.83 3b4o s PHE 128 Cb -0.12 -1.38 -0.03 0.00 -0.57 0.00 0.00 43.02 40.92 3b4o s PHE 128 CO 0.02 -0.67 -0.02 1.03 -0.10 0.00 0.00 175.22 175.48 3b4o s ARG 129 N 1.58 3.21 0.17 0.44 0.52 0.35 -1.33 118.95 123.89 3b4o s ARG 129 Ca -0.01 -0.45 0.08 0.00 -0.52 0.00 0.00 55.73 54.82 3b4o s ARG 129 Cb -0.16 -2.83 -0.04 0.00 0.52 0.00 0.00 34.95 32.44 3b4o s ARG 129 CO -0.07 0.54 -0.06 -0.06 0.02 0.00 0.00 175.30 175.67 3b4o s PHE 130 N -0.44 2.73 -0.17 -0.53 0.08 0.23 0.30 117.98 120.19 3b4o s PHE 130 Ca 0.08 -0.18 -0.11 0.00 0.12 0.00 0.00 56.93 56.83 3b4o s PHE 130 Cb -0.12 -1.33 0.05 0.00 -0.57 0.00 0.00 43.02 41.05 3b4o s PHE 130 CO 0.02 0.51 0.42 -2.00 -0.10 0.00 0.00 175.22 174.07 3b4o s GLU 131 N -2.84 0.44 -0.56 0.44 2.12 -0.23 -4.77 118.70 113.28 3b4o s GLU 131 Ca 0.26 0.71 -0.09 0.00 0.36 0.00 0.00 54.97 56.21 3b4o s GLU 131 Cb -0.09 0.08 0.01 0.00 0.26 0.00 0.00 34.13 34.40 3b4o s GLU 131 CO 0.17 -0.12 0.16 0.27 -0.54 0.00 0.00 175.26 175.20 3b4o n ASN 132 N 3.69 -0.82 0.00 -1.70 2.04 -1.26 -1.85 115.26 115.36 3b4o n ASN 132 Ca -0.19 -0.54 0.00 0.00 -0.44 0.00 0.00 54.58 53.41 3b4o n ASN 132 Cb 0.56 -0.66 0.00 0.00 -2.53 0.00 0.00 39.78 37.15 3b4o n ASN 132 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3b4o n GLY 133 N -1.52 0.43 3.44 4.83 0.00 -1.26 -5.00 105.19 106.12 3b4o n GLY 133 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 3b4o n GLY 133 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3b4o s LEU 134 N 0.00 2.55 -0.24 0.99 1.43 -0.77 -4.88 118.68 117.76 3b4o s LEU 134 Ca 0.00 -1.15 -0.29 0.00 -1.03 0.00 0.00 54.13 51.66 3b4o s LEU 134 Cb 0.00 -0.76 0.01 0.00 0.03 0.00 0.00 46.19 45.47 3b4o s LEU 134 CO 0.00 -0.25 1.11 -0.63 0.23 0.00 0.00 176.35 176.81 3b4o s ILE 135 N -2.88 4.53 -0.06 -0.59 1.01 0.59 -1.07 121.20 122.74 3b4o s ILE 135 Ca 0.29 1.83 0.11 0.00 0.00 0.00 0.00 60.65 62.87 3b4o s ILE 135 Cb 0.02 -4.26 -0.23 0.00 0.01 0.00 0.00 42.46 37.99 3b4o s ILE 135 CO 0.12 -0.25 0.59 1.17 0.00 0.00 0.00 174.94 176.57 3b4o n LYS 136 N 6.56 0.65 -3.62 2.79 3.00 0.15 -1.54 118.16 126.14 3b4o n LYS 136 Ca 0.13 0.28 -0.07 0.00 -0.00 0.00 0.00 58.31 58.64 3b4o n LYS 136 Cb 0.46 -1.77 -0.08 0.00 0.00 0.00 0.00 35.03 33.64 3b4o n LYS 136 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 3b4o s GLU 137 N -2.59 0.37 -0.08 1.64 2.12 -0.89 -1.07 118.70 118.20 3b4o s GLU 137 Ca -0.07 1.07 0.02 0.00 0.36 0.00 0.00 54.97 56.35 3b4o s GLU 137 Cb 0.08 0.37 -0.02 0.00 0.26 0.00 0.00 34.13 34.82 3b4o s GLU 137 CO 0.82 -0.28 -0.13 -1.14 -0.54 0.00 0.00 175.26 173.99 3b4o s GLN 138 N 2.66 2.88 -0.01 4.30 -0.44 0.60 -0.50 119.66 129.15 3b4o s GLN 138 Ca -0.01 -0.68 0.01 0.00 -2.50 0.00 0.00 55.36 52.18 3b4o s GLN 138 Cb -0.12 -2.50 0.01 0.00 -1.64 0.00 0.00 33.01 28.75 3b4o s GLN 138 CO -0.14 0.46 -0.02 1.03 0.50 0.00 0.00 175.29 177.12 3b4o s ARG 139 N -0.30 0.22 -0.11 1.67 0.52 -0.61 -2.78 118.95 117.57 3b4o s ARG 139 Ca 0.02 -0.04 0.01 0.00 -0.52 0.00 0.00 55.73 55.21 3b4o s ARG 139 Cb -0.13 -0.27 -0.01 0.00 0.52 0.00 0.00 34.95 35.06 3b4o s ARG 139 CO 0.03 0.00 -0.15 -2.00 0.02 0.00 0.00 175.30 173.19 3b4o s GLU 140 N 0.24 3.19 -0.17 3.54 2.12 -0.70 -0.52 118.70 126.40 3b4o s GLU 140 Ca -0.02 -0.72 0.01 0.00 0.36 0.00 0.00 54.97 54.59 3b4o s GLU 140 Cb -0.05 -2.53 0.02 0.00 0.26 0.00 0.00 34.13 31.84 3b4o s GLU 140 CO -0.01 0.27 -0.18 -0.06 -0.54 0.00 0.00 175.26 174.74 3b4o s PHE 141 N 0.19 2.60 0.17 5.30 0.40 0.48 -0.42 117.98 126.70 3b4o s PHE 141 Ca -0.09 -1.54 0.04 0.00 -0.60 0.00 0.00 56.93 54.74 3b4o s PHE 141 Cb -0.15 -1.82 -0.01 0.00 0.51 0.00 0.00 43.02 41.54 3b4o s PHE 141 CO 0.05 -0.77 0.13 0.00 0.70 0.00 0.00 175.22 175.33 3b4o n MET 142 N 4.66 0.29 -3.30 0.44 0.00 -1.26 -0.69 117.12 117.26 3b4o n MET 142 Ca -0.20 -1.67 -0.45 0.00 0.00 0.00 0.00 57.70 55.38 3b4o n MET 142 Cb 0.50 1.29 -0.06 0.00 0.00 0.00 0.00 33.22 34.95 3b4o n MET 142 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 3b4o s ASN 143 N -2.18 6.18 0.66 3.17 3.84 -1.26 -4.86 114.94 120.49 3b4o s ASN 143 Ca 0.18 -1.60 0.34 0.00 0.21 0.00 0.00 52.86 52.00 3b4o s ASN 143 Cb 0.01 -2.22 1.88 0.00 -0.55 0.00 0.00 41.25 40.37 3b4o s ASN 143 CO 0.13 -0.83 2.06 -0.65 -2.79 0.00 0.00 177.10 175.01 3b4o h PRO 144 N 8.89 0.00 -0.38 0.43 0.11 -1.95 -1.76 132.00 137.34 3b4o h PRO 144 Ca -0.29 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.76 3b4o h PRO 144 Cb 1.10 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 3b4o h PRO 144 CO 1.00 0.00 -0.01 0.00 -0.21 0.00 0.00 178.00 178.78 3b4o h GLU 146 N 0.57 0.00 -0.21 0.00 4.39 -1.66 -1.65 114.58 116.03 3b4o h GLU 146 Ca 0.12 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.70 3b4o h GLU 146 Cb 0.37 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.02 3b4o h GLU 146 CO 0.01 0.45 -0.34 0.37 -1.16 0.00 0.00 179.01 178.35 3b4o h GLN 147 N 0.00 0.59 -0.10 2.33 4.15 -1.51 -2.84 115.11 117.74 3b4o h GLN 147 Ca -0.00 -0.36 0.04 0.00 0.77 0.00 0.00 58.65 59.10 3b4o h GLN 147 Cb 0.96 0.04 -0.06 0.00 0.21 0.00 0.00 27.48 28.63 3b4o h GLN 147 CO 0.06 0.97 -0.36 0.74 -1.93 0.00 0.00 178.83 178.31 3b4o h PHE 148 N 0.27 -1.01 -0.90 3.99 0.04 -1.12 -1.82 116.94 116.39 3b4o h PHE 148 Ca 0.02 0.04 0.22 0.00 2.80 0.00 0.00 57.97 61.05 3b4o h PHE 148 Cb 0.92 0.46 -0.12 0.00 2.20 0.00 0.00 35.95 39.41 3b4o h PHE 148 CO 0.09 -0.44 0.40 0.00 -0.60 0.00 0.00 178.31 177.76 3b4o h ARG 149 N -0.46 0.39 0.00 1.51 3.08 -1.32 -0.31 114.38 117.27 3b4o h ARG 149 Ca 0.08 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 3b4o h ARG 149 Cb 0.59 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 3b4o h ARG 149 CO -0.35 0.26 -0.16 0.66 -1.07 0.00 0.00 179.97 179.31 3b4o h SER 150 N 0.40 0.00 0.04 7.04 4.64 -1.09 -2.76 113.55 121.82 3b4o h SER 150 Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 3b4o h SER 150 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 3b4o h SER 150 CO -0.53 0.16 -0.37 0.18 -0.87 0.00 0.00 176.83 175.40 3b4o n LEU 151 N -3.40 1.90 0.00 5.97 4.77 -0.22 -4.33 117.00 121.69 3b4o n LEU 151 Ca -0.00 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 3b4o n LEU 151 Cb 0.36 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 3b4o n LEU 151 CO 0.31 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 3b4o n GLY 152 N 1.39 0.74 3.70 -0.72 0.00 -0.68 -4.57 105.19 105.05 3b4o n GLY 152 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3b4o n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3b4o s ILE 153 N -2.36 5.02 0.28 -0.61 1.01 -0.63 -4.98 121.20 118.93 3b4o s ILE 153 Ca 0.00 1.40 -0.30 0.00 0.00 0.00 0.00 60.65 61.76 3b4o s ILE 153 Cb 0.00 -4.03 -0.11 0.00 0.01 0.00 0.00 42.46 38.33 3b4o s ILE 153 CO 0.00 0.19 1.56 -0.70 0.00 0.00 0.00 174.94 175.99 3b4o s GLU 154 N 1.25 4.15 -0.12 2.79 2.12 -1.26 -3.99 118.70 123.64 3b4o s GLU 154 Ca 0.35 2.52 -0.21 0.00 0.36 0.00 0.00 54.97 57.99 3b4o s GLU 154 Cb -0.17 -3.04 -0.04 0.00 0.26 0.00 0.00 34.13 31.14 3b4o s GLU 154 CO 0.15 -0.58 0.60 0.08 -0.54 0.00 0.00 175.26 174.97 3b4o s VAL 155 N -0.03 5.09 0.36 3.70 1.01 -1.26 -4.99 120.40 124.28 3b4o s VAL 155 Ca 0.62 1.20 -0.28 0.00 0.00 0.00 0.00 61.98 63.52 3b4o s VAL 155 Cb -0.46 -3.94 -0.11 0.00 0.00 0.00 0.00 36.38 31.87 3b4o s VAL 155 CO 0.47 0.24 1.48 -2.65 0.00 0.00 0.00 175.10 174.64 3b4o n PRO 156 N 4.05 2.60 -4.65 2.72 -0.02 -1.26 -5.01 135.00 133.44 3b4o n PRO 156 Ca -0.03 0.92 -0.33 0.00 -2.02 0.00 0.00 63.50 62.03 3b4o n PRO 156 Cb 0.51 -2.63 -0.12 0.00 -0.02 0.00 0.00 33.50 31.23 3b4o n PRO 156 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3b4o s GLU 157 N -1.82 3.03 -0.24 -0.52 2.12 -1.26 -5.10 118.70 114.91 3b4o s GLU 157 Ca 0.55 -0.59 -0.12 0.00 0.36 0.00 0.00 54.97 55.18 3b4o s GLU 157 Cb -0.49 -2.64 -0.05 0.00 0.26 0.00 0.00 34.13 31.21 3b4o s GLU 157 CO 0.61 0.48 0.21 0.08 -0.54 0.00 0.00 175.26 176.11 3b4o s VAL 158 N -0.33 5.32 0.17 3.70 1.01 -1.26 -5.08 120.40 123.94 3b4o s VAL 158 Ca 0.04 0.28 -0.30 0.00 0.00 0.00 0.00 61.98 62.00 3b4o s VAL 158 Cb -0.13 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.63 3b4o s VAL 158 CO 0.02 0.31 1.23 -0.13 0.00 0.00 0.00 175.10 176.54 3b4o s ARG 159 N 1.23 4.45 -0.65 2.72 0.52 -1.26 -5.01 118.95 120.95 3b4o s ARG 159 Ca 0.10 1.92 0.05 0.00 -0.52 0.00 0.00 55.73 57.27 3b4o s ARG 159 Cb -0.14 -3.24 0.19 0.00 0.52 0.00 0.00 34.95 32.28 3b4o s ARG 159 CO 0.06 -0.16 0.52 0.54 0.02 0.00 0.00 175.30 176.28 3b4o n ARG 160 N 2.72 1.70 -2.50 3.54 1.74 -1.26 -5.10 116.66 117.50 3b4o n ARG 160 Ca 0.05 -4.31 -0.39 0.00 -0.77 0.00 0.00 57.85 52.44 3b4o n ARG 160 Cb 0.44 -2.16 -0.04 0.00 -1.02 0.00 0.00 32.46 29.68 3b4o n ARG 160 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3b4o s ASP 161 N -1.43 7.11 0.00 0.55 1.11 -1.26 -3.11 116.67 119.64 3b4o s ASP 161 Ca 0.29 2.19 0.00 0.00 0.18 0.00 0.00 52.55 55.21 3b4o s ASP 161 Cb 0.01 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 41.39 3b4o s ASP 161 CO -0.15 -0.25 0.00 0.61 1.18 0.00 0.00 175.17 176.56 3b4o n GLY 162 N 0.94 2.59 3.63 0.21 0.00 -1.26 -4.97 105.19 106.33 3b4o n GLY 162 Ca 0.01 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 3b4o n GLY 162 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3b4o n LEU 163 N 0.00 3.52 -4.45 0.99 7.94 -1.18 -4.87 117.00 118.95 3b4o n LEU 163 Ca 0.00 0.72 -0.44 0.00 -1.11 0.00 0.00 56.01 55.17 3b4o n LEU 163 Cb 0.00 -1.45 -0.01 0.00 0.53 0.00 0.00 43.42 42.49 3b4o n LEU 163 CO 0.00 -0.18 0.09 -2.65 -1.11 0.00 0.00 177.39 173.54 3b4o n PRO 164 N 7.59 0.50 0.00 1.96 -0.02 -1.26 -5.15 135.00 138.62 3b4o n PRO 164 Ca 0.25 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 3b4o n PRO 164 Cb 0.36 -1.36 0.00 0.00 -0.02 0.00 0.00 33.50 32.48 3b4o n PRO 164 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35