#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l1o n MET 4 N 0.00 0.00 0.00 -0.67 2.81 -1.26 -0.77 117.12 117.23 1l1o n MET 4 Ca 0.00 0.24 0.00 0.00 -1.81 0.00 0.00 57.70 56.13 1l1o n MET 4 Cb 0.00 -0.50 0.00 0.00 -0.71 0.00 0.00 33.22 32.01 1l1o n MET 4 CO 0.00 0.00 0.00 -1.33 1.51 0.00 0.00 175.97 176.15 1l1o n MET 5 N -0.71 0.00 -0.00 0.03 2.81 -1.26 0.31 117.12 118.30 1l1o n MET 5 Ca 0.00 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.93 1l1o n MET 5 Cb 0.00 -1.59 0.00 0.00 -0.71 0.00 0.00 33.22 30.92 1l1o n MET 5 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1l1o n ASP 6 N -0.77 1.79 -4.65 7.83 8.00 0.05 -5.01 116.55 123.78 1l1o n ASP 6 Ca 0.00 -1.93 -0.27 0.00 0.71 0.00 0.00 54.79 53.30 1l1o n ASP 6 Cb 0.09 -0.02 -0.08 0.00 -0.02 0.00 0.00 41.12 41.10 1l1o n ASP 6 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1l1o s LEU 7 N -0.96 3.28 0.09 0.64 1.43 0.15 -4.92 118.68 118.39 1l1o s LEU 7 Ca 0.01 -0.40 -0.31 0.00 -1.03 0.00 0.00 54.13 52.40 1l1o s LEU 7 Cb 0.01 -1.94 -0.07 0.00 0.03 0.00 0.00 46.19 44.22 1l1o s LEU 7 CO 0.00 0.10 1.28 -2.84 0.23 0.00 0.00 176.35 175.12 1l1o s PRO 8 N -2.88 4.39 -0.22 1.29 0.02 -1.26 -4.99 135.00 131.34 1l1o s PRO 8 Ca 0.27 1.91 -0.06 0.00 0.02 0.00 0.00 61.00 63.14 1l1o s PRO 8 Cb -0.09 -3.30 -0.02 0.00 0.02 0.00 0.00 34.50 31.11 1l1o s PRO 8 CO 0.18 -0.32 0.02 1.03 -0.33 0.00 0.00 177.00 177.58 1l1o s ARG 9 N 0.98 3.61 0.20 5.54 0.52 -1.26 -4.76 118.95 123.78 1l1o s ARG 9 Ca 0.61 -0.51 -0.30 0.00 -0.52 0.00 0.00 55.73 55.01 1l1o s ARG 9 Cb -0.33 -3.16 -0.08 0.00 0.52 0.00 0.00 34.95 31.90 1l1o s ARG 9 CO 0.30 -0.07 1.01 -1.12 0.02 0.00 0.00 175.30 175.44 1l1o s SER 10 N 1.25 7.45 -0.31 0.23 0.01 -0.82 -4.62 113.70 116.88 1l1o s SER 10 Ca 0.04 2.01 -0.26 0.00 1.31 0.00 0.00 55.95 59.04 1l1o s SER 10 Cb -0.15 -2.61 0.01 0.00 0.21 0.00 0.00 66.02 63.49 1l1o s SER 10 CO 0.02 -0.04 0.94 -0.13 0.41 0.00 0.00 173.24 174.43 1l1o s ARG 11 N -0.75 4.01 0.23 12.44 0.52 -1.26 -0.02 118.95 134.12 1l1o s ARG 11 Ca 0.45 0.84 0.01 0.00 -0.52 0.00 0.00 55.73 56.51 1l1o s ARG 11 Cb -0.27 -3.73 -0.05 0.00 0.52 0.00 0.00 34.95 31.41 1l1o s ARG 11 CO 0.34 -0.79 0.06 0.96 0.02 0.00 0.00 175.30 175.89 1l1o s ILE 12 N 3.31 0.58 0.39 1.52 -4.36 -0.96 -4.92 121.20 116.77 1l1o s ILE 12 Ca 0.39 -1.99 0.08 0.00 -0.26 0.00 0.00 60.65 58.86 1l1o s ILE 12 Cb -0.13 -2.45 -0.06 0.00 1.25 0.00 0.00 42.46 41.07 1l1o s ILE 12 CO 0.14 -0.17 0.08 0.54 0.24 0.00 0.00 174.94 175.77 1l1o s ASN 13 N -3.26 4.18 0.23 4.36 2.20 -1.26 -4.41 114.94 116.99 1l1o s ASN 13 Ca 0.33 -1.14 -0.14 0.00 -0.94 0.00 0.00 52.86 50.97 1l1o s ASN 13 Cb 0.07 -0.47 0.29 0.00 -2.00 0.00 0.00 41.25 39.14 1l1o s ASN 13 CO 0.10 -0.42 1.58 0.00 -2.94 0.00 0.00 177.10 175.42 1l1o h ALA 14 N 1.65 0.36 0.00 3.54 0.00 -1.87 0.29 119.26 123.23 1l1o h ALA 14 Ca -0.43 0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1l1o h ALA 14 Cb 1.25 0.73 0.00 0.00 0.00 0.00 0.00 17.79 19.76 1l1o h ALA 14 CO 0.72 -0.49 0.00 0.41 0.00 0.00 0.00 179.25 179.89 1l1o n GLY 15 N -1.51 -0.15 0.06 0.00 0.00 -1.26 -1.53 105.19 100.80 1l1o n GLY 15 Ca 0.10 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.06 1l1o n GLY 15 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1l1o n MET 16 N -0.36 1.92 -0.13 1.61 2.81 0.10 -4.69 117.12 118.39 1l1o n MET 16 Ca 0.00 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 1l1o n MET 16 Cb 0.01 -1.29 0.02 0.00 -0.71 0.00 0.00 33.22 31.26 1l1o n MET 16 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1l1o n LEU 17 N -2.48 -0.20 -0.19 4.03 4.77 -0.58 0.17 117.00 122.52 1l1o n LEU 17 Ca -0.19 0.60 0.21 0.00 -0.03 0.00 0.00 56.01 56.59 1l1o n LEU 17 Cb 0.85 -0.15 0.58 0.00 -2.33 0.00 0.00 43.42 42.38 1l1o n LEU 17 CO 0.22 -0.54 1.23 0.00 -1.33 0.00 0.00 177.39 176.97 1l1o h ALA 18 N 0.52 2.38 -0.02 -1.18 0.00 -1.84 -0.13 119.26 119.00 1l1o h ALA 18 Ca 0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1l1o h ALA 18 Cb 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1l1o h ALA 18 CO -0.34 -0.63 -0.01 1.04 0.00 0.00 0.00 179.25 179.30 1l1o n GLN 19 N -4.43 1.71 -1.14 0.00 3.00 0.44 -3.93 117.38 113.03 1l1o n GLN 19 Ca 0.17 -1.07 -0.04 0.00 -0.01 0.00 0.00 57.00 56.05 1l1o n GLN 19 Cb 0.72 -1.48 0.14 0.00 0.00 0.00 0.00 30.24 29.62 1l1o n GLN 19 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1l1o n PHE 20 N 0.29 0.91 -1.79 1.08 3.01 -0.07 -5.01 117.46 115.89 1l1o n PHE 20 Ca 0.18 -1.70 -0.42 0.00 1.01 0.00 0.00 57.45 56.51 1l1o n PHE 20 Cb 0.39 -0.27 -0.03 0.00 -0.01 0.00 0.00 39.48 39.55 1l1o n PHE 20 CO 0.00 0.00 0.00 0.96 1.01 0.00 0.00 176.76 178.73 1l1o s ILE 21 N -3.56 3.22 0.00 4.37 -5.25 -1.18 -1.46 121.20 117.33 1l1o s ILE 21 Ca 0.42 0.26 0.00 0.00 -0.99 0.00 0.00 60.65 60.34 1l1o s ILE 21 Cb 0.38 -3.18 0.00 0.00 2.95 0.00 0.00 42.46 42.61 1l1o s ILE 21 CO -0.04 -0.04 0.00 -0.67 -1.79 0.00 0.00 174.94 172.40 1l1o n ASP 22 N 7.92 -0.63 -4.95 4.36 2.03 0.69 -4.99 116.55 120.98 1l1o n ASP 22 Ca 0.20 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.29 1l1o n ASP 22 Cb 0.42 -0.10 -0.01 0.00 -0.72 0.00 0.00 41.12 40.71 1l1o n ASP 22 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1l1o s LYS 23 N -0.07 3.33 -0.15 -0.67 -0.14 -0.54 -4.65 119.74 116.85 1l1o s LYS 23 Ca 0.00 -0.52 -0.20 0.00 -1.36 0.00 0.00 55.97 53.89 1l1o s LYS 23 Cb 0.00 -2.69 -0.03 0.00 -1.68 0.00 0.00 37.83 33.43 1l1o s LYS 23 CO 0.00 0.08 0.59 -1.25 -0.76 0.00 0.00 175.35 174.01 1l1o s PRO 24 N -4.31 4.29 0.28 -1.68 0.04 -1.26 -1.01 135.00 131.35 1l1o s PRO 24 Ca 0.42 0.60 0.02 0.00 0.04 0.00 0.00 61.00 62.08 1l1o s PRO 24 Cb -0.10 -3.51 -0.04 0.00 0.04 0.00 0.00 34.50 30.89 1l1o s PRO 24 CO 0.35 -0.07 0.13 0.14 0.04 0.00 0.00 177.00 177.59 1l1o s VAL 25 N 1.33 0.39 -0.13 -0.36 -7.23 0.88 -1.95 120.40 113.33 1l1o s VAL 25 Ca 0.29 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.45 1l1o s VAL 25 Cb -0.16 -2.56 0.03 0.00 0.56 0.00 0.00 36.38 34.25 1l1o s VAL 25 CO 0.12 0.00 -0.04 0.00 -0.31 0.00 0.00 175.10 174.86 1l1o s PHE 27 N 1.74 3.02 -0.08 0.00 5.36 0.14 -2.26 117.98 125.91 1l1o s PHE 27 Ca 0.03 -1.70 -0.04 0.00 -0.96 0.00 0.00 56.93 54.26 1l1o s PHE 27 Cb -0.14 -2.00 -0.04 0.00 -0.34 0.00 0.00 43.02 40.50 1l1o s PHE 27 CO -0.07 -0.77 0.11 0.08 -1.46 0.00 0.00 175.22 173.11 1l1o s VAL 28 N 1.28 5.15 -0.05 3.12 1.01 -1.26 -0.65 120.40 129.00 1l1o s VAL 28 Ca -0.00 -0.04 -0.18 0.00 0.00 0.00 0.00 61.98 61.77 1l1o s VAL 28 Cb -0.16 -3.28 0.06 0.00 0.00 0.00 0.00 36.38 33.00 1l1o s VAL 28 CO -0.07 0.53 0.80 0.61 0.00 0.00 0.00 175.10 176.97 1l1o n GLY 29 N 1.71 0.23 3.88 4.51 0.00 -0.58 -4.64 105.19 110.30 1l1o n GLY 29 Ca -0.17 -0.93 -0.35 0.00 0.00 0.00 0.00 46.02 44.57 1l1o n GLY 29 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1l1o s ARG 30 N -2.00 3.40 -0.53 1.61 3.52 0.95 0.02 118.95 125.92 1l1o s ARG 30 Ca 0.19 -0.25 -0.28 0.00 -0.13 0.00 0.00 55.73 55.26 1l1o s ARG 30 Cb -0.00 -3.11 0.02 0.00 -1.56 0.00 0.00 34.95 30.30 1l1o s ARG 30 CO -0.02 0.72 1.30 -1.17 -0.81 0.00 0.00 175.30 175.32 1l1o s LEU 31 N -1.51 3.48 0.00 -0.88 2.96 -0.22 -0.39 118.68 122.11 1l1o s LEU 31 Ca 0.21 0.33 0.00 0.00 -0.22 0.00 0.00 54.13 54.46 1l1o s LEU 31 Cb -0.12 -3.24 0.00 0.00 0.50 0.00 0.00 46.19 43.33 1l1o s LEU 31 CO 0.12 -1.53 0.00 -0.62 -1.32 0.00 0.00 176.35 173.00 1l1o n GLU 32 N 8.38 0.00 -3.55 1.98 -0.58 -0.34 -4.65 120.64 121.88 1l1o n GLU 32 Ca 0.12 0.00 -0.33 0.00 -0.42 0.00 0.00 57.16 56.53 1l1o n GLU 32 Cb 0.49 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.31 1l1o n GLU 32 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1l1o s LYS 33 N 0.33 3.73 -0.44 3.49 1.02 -1.24 -4.93 119.74 121.71 1l1o s LYS 33 Ca 0.00 0.12 0.06 0.00 0.02 0.00 0.00 55.97 56.17 1l1o s LYS 33 Cb 0.00 -2.83 0.20 0.00 -0.52 0.00 0.00 37.83 34.68 1l1o s LYS 33 CO 0.00 0.45 0.43 1.51 -0.92 0.00 0.00 175.35 176.82 1l1o n ILE 34 N 0.27 -0.64 -0.10 2.17 3.06 -1.26 0.13 119.36 122.99 1l1o n ILE 34 Ca -0.03 -3.82 -0.03 0.00 -2.50 0.00 0.00 62.75 56.36 1l1o n ILE 34 Cb 0.52 -1.82 -0.00 0.00 0.54 0.00 0.00 39.64 38.88 1l1o n ILE 34 CO 0.00 0.00 0.00 1.57 -2.50 0.00 0.00 176.55 175.62 1l1o n HIS 35 N 2.19 -0.12 0.23 9.51 -0.00 -0.84 -4.71 115.22 121.47 1l1o n HIS 35 Ca 0.26 0.05 0.08 0.00 -0.00 0.00 0.00 57.72 58.12 1l1o n HIS 35 Cb 0.48 -0.13 0.53 0.00 -0.00 0.00 0.00 29.99 30.87 1l1o n HIS 35 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1l1o h PRO 36 N 0.04 0.00 0.00 1.57 0.13 -2.01 -0.61 132.00 131.12 1l1o h PRO 36 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1l1o h PRO 36 Cb 0.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.24 1l1o h PRO 36 CO 0.04 0.24 0.00 1.79 -0.23 0.00 0.00 178.00 179.83 1l1o h THR 37 N 0.00 0.00 0.00 1.56 1.35 -1.92 -3.45 112.91 110.45 1l1o h THR 37 Ca -0.00 -0.37 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1l1o h THR 37 Cb 0.53 1.23 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 1l1o h THR 37 CO 0.03 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 1l1o n GLY 38 N 0.02 2.45 0.11 5.82 0.00 -0.24 -4.72 105.19 108.64 1l1o n GLY 38 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 1l1o n GLY 38 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1l1o n LYS 39 N -2.00 0.23 -3.92 1.61 2.85 -1.26 -1.84 118.16 113.82 1l1o n LYS 39 Ca 0.00 0.26 -0.10 0.00 -1.05 0.00 0.00 58.31 57.42 1l1o n LYS 39 Cb 0.00 -1.81 -0.11 0.00 -0.65 0.00 0.00 35.03 32.46 1l1o n LYS 39 CO 0.00 0.00 0.00 1.41 -0.05 0.00 0.00 177.40 178.76 1l1o s MET 40 N -3.15 0.32 0.14 -1.58 0.00 -1.26 -0.00 119.30 113.76 1l1o s MET 40 Ca 0.09 -0.42 -0.11 0.00 0.00 0.00 0.00 55.69 55.25 1l1o s MET 40 Cb 0.12 0.12 0.01 0.00 0.00 0.00 0.00 34.83 35.08 1l1o s MET 40 CO 0.54 -0.06 0.30 -0.59 0.00 0.00 0.00 175.02 175.21 1l1o s PHE 41 N -1.16 0.15 -0.09 4.11 -0.12 -0.12 -1.99 117.98 118.76 1l1o s PHE 41 Ca -0.13 -0.52 0.02 0.00 -0.05 0.00 0.00 56.93 56.26 1l1o s PHE 41 Cb -0.08 0.05 -0.02 0.00 -0.63 0.00 0.00 43.02 42.35 1l1o s PHE 41 CO -0.00 -0.68 -0.16 0.42 -0.05 0.00 0.00 175.22 174.75 1l1o s ILE 42 N -3.89 2.84 -0.05 -4.49 1.01 0.34 0.18 121.20 117.14 1l1o s ILE 42 Ca 0.10 -0.77 0.05 0.00 0.00 0.00 0.00 60.65 60.03 1l1o s ILE 42 Cb 0.03 -2.14 -0.01 0.00 0.01 0.00 0.00 42.46 40.36 1l1o s ILE 42 CO -0.06 0.56 -0.22 -0.76 0.00 0.00 0.00 174.94 174.46 1l1o s LEU 43 N -0.14 2.01 -0.17 2.97 1.43 -0.90 -1.19 118.68 122.69 1l1o s LEU 43 Ca -0.02 -0.44 -0.10 0.00 -1.03 0.00 0.00 54.13 52.54 1l1o s LEU 43 Cb -0.14 -1.20 -0.05 0.00 0.03 0.00 0.00 46.19 44.83 1l1o s LEU 43 CO 0.04 0.21 0.17 -0.94 0.23 0.00 0.00 176.35 176.06 1l1o s SER 44 N -0.10 6.31 0.79 2.29 1.04 0.47 -1.16 113.70 123.34 1l1o s SER 44 Ca -0.03 0.36 0.00 0.00 0.48 0.00 0.00 55.95 56.76 1l1o s SER 44 Cb -0.13 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 63.89 1l1o s SER 44 CO 0.03 0.22 0.00 -0.90 0.98 0.00 0.00 173.24 173.57 1l1o n ASP 45 N 3.14 -0.02 0.00 7.02 3.85 0.35 -0.03 116.55 130.86 1l1o n ASP 45 Ca -0.16 -0.78 0.15 0.00 -0.71 0.00 0.00 54.79 53.29 1l1o n ASP 45 Cb 0.53 0.00 0.87 0.00 -1.35 0.00 0.00 41.12 41.16 1l1o n ASP 45 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1l1o n GLY 46 N 4.94 -1.04 0.92 6.12 0.00 -1.26 -2.52 105.19 112.35 1l1o n GLY 46 Ca 0.00 -0.18 0.07 0.00 0.00 0.00 0.00 46.02 45.92 1l1o n GLY 46 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1l1o n GLU 47 N -1.08 3.04 0.00 1.61 1.02 -1.26 -4.45 120.64 119.52 1l1o n GLU 47 Ca 0.21 -2.45 0.00 0.00 -0.02 0.00 0.00 57.16 54.90 1l1o n GLU 47 Cb 0.14 -1.55 0.00 0.00 -0.02 0.00 0.00 31.44 30.01 1l1o n GLU 47 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1l1o n GLY 48 N 0.42 2.84 3.74 0.62 0.00 -1.05 -5.02 105.19 106.75 1l1o n GLY 48 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 1l1o n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1l1o s LYS 49 N -0.05 2.59 0.07 1.61 1.02 -1.26 -4.55 119.74 119.17 1l1o s LYS 49 Ca 0.00 1.69 0.06 0.00 0.02 0.00 0.00 55.97 57.74 1l1o s LYS 49 Cb 0.00 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.38 1l1o s LYS 49 CO 0.00 -1.47 -0.08 -0.80 -0.92 0.00 0.00 175.35 172.07 1l1o s ASN 50 N -2.01 4.51 -0.02 2.83 0.02 -1.26 0.13 114.94 119.15 1l1o s ASN 50 Ca 0.74 -0.29 0.04 0.00 -1.02 0.00 0.00 52.86 52.33 1l1o s ASN 50 Cb -0.27 -0.94 -0.01 0.00 0.02 0.00 0.00 41.25 40.05 1l1o s ASN 50 CO 0.40 0.21 -0.14 -0.83 0.02 0.00 0.00 177.10 176.76 1l1o s GLY 51 N -1.95 0.73 -0.24 0.66 0.00 -0.31 -4.81 107.32 101.40 1l1o s GLY 51 Ca 0.20 -0.60 -0.15 0.00 0.00 0.00 0.00 44.72 44.18 1l1o s GLY 51 CO 0.12 -0.42 0.37 -1.59 0.00 0.00 0.00 173.10 171.57 1l1o s THR 52 N -0.19 5.20 -0.21 0.90 2.01 -1.26 -2.11 115.64 119.98 1l1o s THR 52 Ca 0.02 0.59 -0.08 0.00 0.31 0.00 0.00 61.69 62.53 1l1o s THR 52 Cb -0.07 -3.69 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 1l1o s THR 52 CO 0.00 0.20 0.09 -0.63 -0.69 0.00 0.00 174.62 173.60 1l1o s ILE 53 N 1.73 4.90 -0.16 1.82 -1.09 0.13 -0.54 121.20 127.98 1l1o s ILE 53 Ca 0.16 0.01 -0.03 0.00 -2.23 0.00 0.00 60.65 58.56 1l1o s ILE 53 Cb -0.15 -3.24 -0.02 0.00 -1.58 0.00 0.00 42.46 37.46 1l1o s ILE 53 CO 0.09 0.41 -0.05 -1.61 -1.23 0.00 0.00 174.94 172.55 1l1o s GLU 54 N 0.75 3.57 0.06 2.79 2.02 0.23 -0.95 118.70 127.17 1l1o s GLU 54 Ca 0.05 -0.56 -0.09 0.00 0.02 0.00 0.00 54.97 54.38 1l1o s GLU 54 Cb -0.13 -2.89 -0.06 0.00 0.10 0.00 0.00 34.13 31.15 1l1o s GLU 54 CO 0.02 0.15 0.37 -0.51 0.02 0.00 0.00 175.26 175.31 1l1o s LEU 55 N 0.58 4.36 0.26 1.80 1.02 1.00 0.38 118.68 128.08 1l1o s LEU 55 Ca -0.04 0.75 0.19 0.00 0.02 0.00 0.00 54.13 55.06 1l1o s LEU 55 Cb -0.15 -2.90 0.08 0.00 0.02 0.00 0.00 46.19 43.24 1l1o s LEU 55 CO 0.03 0.19 1.26 0.24 0.02 0.00 0.00 176.35 178.09 1l1o h MET 56 N 3.80 0.00 -3.85 1.70 2.86 -1.85 -3.44 114.93 114.16 1l1o h MET 56 Ca -0.49 0.00 -0.45 0.00 -2.06 0.00 0.00 59.70 56.69 1l1o h MET 56 Cb 1.19 0.00 -0.37 0.00 0.06 0.00 0.00 31.60 32.48 1l1o h MET 56 CO 0.66 0.21 -0.78 -1.21 1.06 0.00 0.00 176.91 176.85 1l1o s GLU 57 N -3.12 0.83 0.19 1.72 2.02 -1.26 -5.13 118.70 113.96 1l1o s GLU 57 Ca 0.02 0.01 -0.29 0.00 0.02 0.00 0.00 54.97 54.74 1l1o s GLU 57 Cb 0.08 -1.10 -0.17 0.00 0.10 0.00 0.00 34.13 33.04 1l1o s GLU 57 CO 0.75 -0.28 0.55 -0.35 0.02 0.00 0.00 175.26 175.95 1l1o n PRO 58 N 5.01 0.00 -1.14 0.39 -0.04 -1.26 -4.74 135.00 133.22 1l1o n PRO 58 Ca -0.10 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.96 1l1o n PRO 58 Cb 0.50 -1.02 -0.03 0.00 -0.04 0.00 0.00 33.50 32.91 1l1o n PRO 58 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1l1o n LEU 59 N 1.96 -0.77 -0.07 1.53 4.77 -0.77 -4.85 117.00 118.80 1l1o n LEU 59 Ca 0.18 0.91 0.11 0.00 -0.03 0.00 0.00 56.01 57.18 1l1o n LEU 59 Cb 0.24 -0.75 0.04 0.00 -2.33 0.00 0.00 43.42 40.61 1l1o n LEU 59 CO 0.56 -2.19 0.19 -0.67 -1.33 0.00 0.00 177.39 173.95 1l1o n ASP 60 N 1.51 0.97 -3.10 -1.43 -0.08 -1.26 -4.99 116.55 108.16 1l1o n ASP 60 Ca 0.15 -0.82 -0.11 0.00 -1.51 0.00 0.00 54.79 52.50 1l1o n ASP 60 Cb 0.17 0.66 -0.00 0.00 2.34 0.00 0.00 41.12 44.28 1l1o n ASP 60 CO 0.00 0.00 0.00 -1.83 0.12 0.00 0.00 177.20 175.49 1l1o s GLU 61 N -2.91 2.09 -0.07 -0.67 -1.05 -1.26 -5.13 118.70 109.70 1l1o s GLU 61 Ca 0.11 -1.52 -0.27 0.00 -0.15 0.00 0.00 54.97 53.14 1l1o s GLU 61 Cb 0.17 0.56 -0.02 0.00 -0.44 0.00 0.00 34.13 34.40 1l1o s GLU 61 CO 0.76 -0.94 0.88 -1.83 0.95 0.00 0.00 175.26 175.08 1l1o s GLU 62 N -2.67 4.45 0.08 -4.83 -1.05 -1.26 -5.05 118.70 108.37 1l1o s GLU 62 Ca 0.20 1.19 0.07 0.00 -0.15 0.00 0.00 54.97 56.28 1l1o s GLU 62 Cb -0.03 -3.50 -0.04 0.00 -0.44 0.00 0.00 34.13 30.12 1l1o s GLU 62 CO 0.14 -0.13 -0.12 0.42 0.95 0.00 0.00 175.26 176.53 1l1o s ILE 63 N 1.38 3.26 0.04 1.83 1.01 -1.26 -5.13 121.20 122.33 1l1o s ILE 63 Ca 0.45 -1.22 -0.28 0.00 0.00 0.00 0.00 60.65 59.60 1l1o s ILE 63 Cb -0.19 -2.49 0.10 0.00 0.01 0.00 0.00 42.46 39.89 1l1o s ILE 63 CO 0.20 0.18 1.07 -0.94 0.00 0.00 0.00 174.94 175.45 1l1o s SER 64 N -1.98 -0.17 0.17 3.58 1.04 -1.26 -5.06 113.70 110.02 1l1o s SER 64 Ca 0.19 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.42 1l1o s SER 64 Cb -0.11 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.35 1l1o s SER 64 CO 0.11 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.34 1l1o n GLY 65 N -0.39 0.75 3.77 7.32 0.00 -1.26 -4.77 105.19 110.61 1l1o n GLY 65 Ca -0.06 -0.85 -0.38 0.00 0.00 0.00 0.00 46.02 44.73 1l1o n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1l1o s ILE 66 N 0.00 4.98 -0.01 -0.61 -1.09 -1.26 -1.06 121.20 122.14 1l1o s ILE 66 Ca 0.00 1.09 0.03 0.00 -2.23 0.00 0.00 60.65 59.54 1l1o s ILE 66 Cb 0.00 -3.86 -0.00 0.00 -1.58 0.00 0.00 42.46 37.02 1l1o s ILE 66 CO 0.00 0.45 -0.10 -0.69 -1.23 0.00 0.00 174.94 173.37 1l1o s VAL 67 N -0.29 0.78 -0.27 2.92 1.01 0.10 -2.40 120.40 122.25 1l1o s VAL 67 Ca 0.28 -0.40 -0.08 0.00 0.00 0.00 0.00 61.98 61.78 1l1o s VAL 67 Cb -0.17 -0.67 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 1l1o s VAL 67 CO 0.15 0.23 0.10 -0.70 0.00 0.00 0.00 175.10 174.88 1l1o s GLU 68 N -0.06 3.56 -0.09 2.72 2.12 0.66 -1.52 118.70 126.09 1l1o s GLU 68 Ca 0.01 -0.55 0.02 0.00 0.36 0.00 0.00 54.97 54.81 1l1o s GLU 68 Cb -0.06 -3.41 -0.02 0.00 0.26 0.00 0.00 34.13 30.90 1l1o s GLU 68 CO -0.00 -0.26 -0.14 0.08 -0.54 0.00 0.00 175.26 174.39 1l1o s VAL 69 N 1.62 3.01 -0.05 3.70 1.01 0.17 0.23 120.40 130.09 1l1o s VAL 69 Ca 0.06 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.37 1l1o s VAL 69 Cb -0.16 -2.22 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 1l1o s VAL 69 CO 0.05 0.56 -0.15 -0.69 0.00 0.00 0.00 175.10 174.86 1l1o s VAL 70 N -0.18 2.96 -0.42 2.92 1.01 0.29 0.24 120.40 127.23 1l1o s VAL 70 Ca -0.00 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1l1o s VAL 70 Cb -0.13 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.09 1l1o s VAL 70 CO 0.03 0.59 0.00 0.61 0.00 0.00 0.00 175.10 176.33 1l1o n GLY 71 N 2.39 -1.25 3.55 4.51 0.00 -0.62 -0.35 105.19 113.42 1l1o n GLY 71 Ca -0.17 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.69 1l1o n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1l1o s ARG 72 N -0.32 2.13 -0.27 1.61 3.52 -0.79 -0.08 118.95 124.74 1l1o s ARG 72 Ca 0.00 -1.00 -0.22 0.00 -0.13 0.00 0.00 55.73 54.38 1l1o s ARG 72 Cb 0.00 -2.29 -0.01 0.00 -1.56 0.00 0.00 34.95 31.09 1l1o s ARG 72 CO 0.00 0.52 0.73 0.08 -0.81 0.00 0.00 175.30 175.82 1l1o s VAL 73 N -1.13 4.88 1.18 7.11 1.01 -0.18 -1.48 120.40 131.79 1l1o s VAL 73 Ca 0.19 1.22 -0.19 0.00 0.00 0.00 0.00 61.98 63.20 1l1o s VAL 73 Cb -0.11 -4.05 0.28 0.00 0.00 0.00 0.00 36.38 32.50 1l1o s VAL 73 CO 0.11 -0.11 1.15 0.42 0.00 0.00 0.00 175.10 176.67 1l1o s THR 74 N 2.74 1.64 0.17 3.92 -4.23 0.16 -0.23 115.64 119.82 1l1o s THR 74 Ca 0.30 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.84 1l1o s THR 74 Cb -0.15 -2.57 -0.14 0.00 1.34 0.00 0.00 72.50 70.98 1l1o s THR 74 CO 0.10 0.00 1.39 0.00 -0.54 0.00 0.00 174.62 175.57 1l1o h ALA 75 N -2.48 0.55 -0.22 3.99 0.00 -1.97 -2.99 119.26 116.15 1l1o h ALA 75 Ca -0.44 -0.72 -0.12 0.00 0.00 0.00 0.00 54.91 53.64 1l1o h ALA 75 Cb 1.28 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 1l1o h ALA 75 CO 0.33 0.91 0.15 1.63 0.00 0.00 0.00 179.25 182.27 1l1o n LYS 76 N -3.66 1.28 -3.66 0.00 5.02 -1.26 -4.85 118.16 111.03 1l1o n LYS 76 Ca -0.03 -0.66 -0.26 0.00 -2.02 0.00 0.00 58.31 55.34 1l1o n LYS 76 Cb 0.79 -1.26 -0.03 0.00 -0.02 0.00 0.00 35.03 34.51 1l1o n LYS 76 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1l1o n ALA 77 N 0.25 -1.12 -2.41 7.82 0.00 -1.13 -4.95 120.51 118.98 1l1o n ALA 77 Ca 0.13 -0.05 -0.26 0.00 0.00 0.00 0.00 53.44 53.26 1l1o n ALA 77 Cb 0.73 -2.18 -0.02 0.00 0.00 0.00 0.00 19.45 17.98 1l1o n ALA 77 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1l1o s THR 78 N -2.85 1.77 -0.23 0.00 -4.23 -1.26 -4.74 115.64 104.10 1l1o s THR 78 Ca 0.49 -1.53 -0.00 0.00 -1.18 0.00 0.00 61.69 59.47 1l1o s THR 78 Cb -0.28 -2.31 0.03 0.00 1.34 0.00 0.00 72.50 71.28 1l1o s THR 78 CO 0.61 0.00 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.95 1l1o s ILE 79 N -2.74 2.55 -0.37 2.99 1.01 0.30 -0.66 121.20 124.27 1l1o s ILE 79 Ca 0.34 -1.09 -0.28 0.00 0.00 0.00 0.00 60.65 59.63 1l1o s ILE 79 Cb -0.01 -2.27 0.02 0.00 0.01 0.00 0.00 42.46 40.21 1l1o s ILE 79 CO 0.21 0.26 1.02 -0.22 0.00 0.00 0.00 174.94 176.21 1l1o s LEU 80 N 1.28 3.91 -0.13 2.97 2.96 -0.55 0.74 118.68 129.85 1l1o s LEU 80 Ca 0.00 0.72 -0.26 0.00 -0.22 0.00 0.00 54.13 54.37 1l1o s LEU 80 Cb -0.16 -3.41 -0.02 0.00 0.50 0.00 0.00 46.19 43.10 1l1o s LEU 80 CO -0.07 -0.94 0.87 0.00 -1.32 0.00 0.00 176.35 174.89 1l1o h THR 82 N 5.09 0.88 -2.08 0.00 2.02 -1.01 -3.41 112.91 114.40 1l1o h THR 82 Ca -0.32 -2.59 0.09 0.00 0.77 0.00 0.00 66.41 64.36 1l1o h THR 82 Cb 1.15 2.60 -0.18 0.00 -1.74 0.00 0.00 68.15 69.98 1l1o h THR 82 CO 0.83 0.79 0.48 -0.94 0.37 0.00 0.00 175.52 177.04 1l1o s SER 83 N -6.85 -0.39 0.08 4.18 1.04 -1.08 -5.02 113.70 105.66 1l1o s SER 83 Ca -0.14 0.16 -0.00 0.00 0.48 0.00 0.00 55.95 56.45 1l1o s SER 83 Cb 0.07 0.38 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 1l1o s SER 83 CO 0.82 -0.55 -0.02 -0.72 0.98 0.00 0.00 173.24 173.75 1l1o s TYR 84 N -2.45 0.71 0.01 5.02 -0.85 -1.26 -0.55 117.35 117.99 1l1o s TYR 84 Ca 0.02 -1.07 -0.01 0.00 -0.52 0.00 0.00 57.07 55.49 1l1o s TYR 84 Cb -0.01 -0.46 -0.01 0.00 0.38 0.00 0.00 41.96 41.86 1l1o s TYR 84 CO -0.05 -0.35 -0.01 0.08 -1.52 0.00 0.00 175.55 173.70 1l1o s VAL 85 N -3.87 0.09 -0.25 -3.49 1.01 0.14 -4.94 120.40 109.09 1l1o s VAL 85 Ca 0.13 -0.76 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 1l1o s VAL 85 Cb 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 36.38 36.20 1l1o s VAL 85 CO -0.06 -0.41 0.03 -1.10 0.00 0.00 0.00 175.10 173.56 1l1o s GLN 86 N -1.24 3.42 0.31 2.72 -0.21 -1.26 -0.24 119.66 123.17 1l1o s GLN 86 Ca -0.14 -0.62 -0.29 0.00 0.02 0.00 0.00 55.36 54.34 1l1o s GLN 86 Cb -0.08 -3.22 -0.13 0.00 1.00 0.00 0.00 33.01 30.58 1l1o s GLN 86 CO -0.01 -0.25 1.28 1.19 -2.12 0.00 0.00 175.29 175.38 1l1o n PHE 87 N 4.86 2.13 -2.67 0.91 3.01 -1.01 -4.94 117.46 119.75 1l1o n PHE 87 Ca -0.17 0.55 -0.43 0.00 1.01 0.00 0.00 57.45 58.41 1l1o n PHE 87 Cb 0.50 -2.40 -0.02 0.00 -0.01 0.00 0.00 39.48 37.55 1l1o n PHE 87 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1l1o s LYS 88 N -1.54 4.10 -0.03 -1.08 3.01 -1.26 -4.77 119.74 118.18 1l1o s LYS 88 Ca 0.58 1.09 0.01 0.00 -1.01 0.00 0.00 55.97 56.65 1l1o s LYS 88 Cb -0.60 -3.71 -0.02 0.00 -1.01 0.00 0.00 37.83 32.48 1l1o s LYS 88 CO 0.59 -0.82 -0.01 0.39 0.51 0.00 0.00 175.35 176.02 1l1o n GLU 89 N 6.68 1.41 -0.04 1.68 1.02 -1.26 -4.80 120.64 125.32 1l1o n GLU 89 Ca 0.11 0.01 0.04 0.00 -0.02 0.00 0.00 57.16 57.30 1l1o n GLU 89 Cb 0.47 -1.06 0.05 0.00 -0.02 0.00 0.00 31.44 30.89 1l1o n GLU 89 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1l1o n ASP 90 N -2.40 0.00 -0.10 1.62 5.68 -1.26 -0.06 116.55 120.03 1l1o n ASP 90 Ca -0.05 0.07 -0.18 0.00 -0.50 0.00 0.00 54.79 54.14 1l1o n ASP 90 Cb 0.56 -0.03 -0.08 0.00 -1.14 0.00 0.00 41.12 40.43 1l1o n ASP 90 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1l1o n SER 91 N -1.94 1.87 -3.77 -1.12 2.88 -1.26 -4.97 113.62 105.32 1l1o n SER 91 Ca 0.03 0.45 -0.23 0.00 -1.33 0.00 0.00 58.87 57.80 1l1o n SER 91 Cb 0.15 -0.89 -0.18 0.00 -0.75 0.00 0.00 64.21 62.54 1l1o n SER 91 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1l1o s HIS 92 N -2.41 0.65 0.28 0.66 3.76 0.91 -5.13 115.29 114.01 1l1o s HIS 92 Ca -0.27 -0.15 -0.30 0.00 -0.15 0.00 0.00 55.06 54.18 1l1o s HIS 92 Cb 0.06 -0.79 -0.12 0.00 1.11 0.00 0.00 32.58 32.84 1l1o s HIS 92 CO 0.46 -0.32 1.51 -0.35 -0.85 0.00 0.00 174.74 175.18 1l1o n PRO 93 N 5.15 2.44 -2.43 8.40 -0.04 -1.26 -4.69 135.00 142.57 1l1o n PRO 93 Ca -0.07 0.86 -0.42 0.00 -0.04 0.00 0.00 63.50 63.83 1l1o n PRO 93 Cb 0.50 -2.59 -0.03 0.00 -0.04 0.00 0.00 33.50 31.34 1l1o n PRO 93 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1l1o s PHE 94 N -0.15 3.29 -1.28 0.54 5.36 -1.26 -4.95 117.98 119.52 1l1o s PHE 94 Ca 0.64 1.23 -0.15 0.00 -0.96 0.00 0.00 56.93 57.69 1l1o s PHE 94 Cb -0.55 -3.44 0.12 0.00 -0.34 0.00 0.00 43.02 38.81 1l1o s PHE 94 CO 0.51 -1.37 1.70 -3.47 -1.46 0.00 0.00 175.22 171.12 1l1o n ASP 95 N 4.59 4.94 -0.35 6.13 -0.08 -1.26 -4.83 116.55 125.69 1l1o n ASP 95 Ca 0.10 -2.96 0.37 0.00 -1.51 0.00 0.00 54.79 50.79 1l1o n ASP 95 Cb 0.46 -1.64 0.75 0.00 2.34 0.00 0.00 41.12 43.03 1l1o n ASP 95 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 1l1o h LEU 96 N 10.64 0.00 0.05 -2.67 5.85 -1.96 -0.33 115.31 126.89 1l1o h LEU 96 Ca 0.41 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.85 1l1o h LEU 96 Cb 0.82 0.00 0.02 0.00 0.37 0.00 0.00 40.66 41.87 1l1o h LEU 96 CO 1.45 0.00 -1.18 1.23 -0.34 0.00 0.00 178.44 179.60 1l1o h GLY 97 N 0.00 0.59 1.07 3.75 0.00 -1.88 -2.62 103.07 103.98 1l1o h GLY 97 Ca 0.59 -1.22 -0.09 0.00 0.00 0.00 0.00 47.33 46.62 1l1o h GLY 97 CO -0.01 1.07 0.07 -2.00 0.00 0.00 0.00 176.54 175.67 1l1o h LEU 98 N 0.24 1.06 -0.29 3.11 5.85 -1.48 -2.08 115.31 121.72 1l1o h LEU 98 Ca -0.16 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.33 1l1o h LEU 98 Cb 1.85 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 42.52 1l1o h LEU 98 CO 0.22 1.07 -0.55 0.22 -0.34 0.00 0.00 178.44 179.06 1l1o h TYR 99 N 1.01 -1.65 -0.86 1.25 3.20 -1.11 -1.61 116.97 117.20 1l1o h TYR 99 Ca 0.19 0.07 0.13 0.00 3.14 0.00 0.00 58.73 62.27 1l1o h TYR 99 Cb 0.49 0.76 -0.07 0.00 1.54 0.00 0.00 36.73 39.45 1l1o h TYR 99 CO 0.04 -0.52 0.56 -0.97 -1.64 0.00 0.00 178.16 175.63 1l1o h ASN 100 N -0.48 0.63 -0.76 -2.11 -1.24 -1.12 0.26 115.58 110.76 1l1o h ASN 100 Ca 0.06 0.03 -0.03 0.00 0.71 0.00 0.00 56.30 57.07 1l1o h ASN 100 Cb 0.64 -0.09 -0.04 0.00 0.73 0.00 0.00 38.32 39.56 1l1o h ASN 100 CO -0.52 0.33 0.35 -0.08 -1.29 0.00 0.00 177.43 176.22 1l1o h GLU 101 N 0.68 1.12 -0.53 6.67 4.57 -0.64 -0.50 114.58 125.96 1l1o h GLU 101 Ca 0.43 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 58.38 1l1o h GLU 101 Cb 0.68 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 1l1o h GLU 101 CO -0.18 0.87 0.11 0.00 -1.18 0.00 0.00 179.01 178.62 1l1o h ALA 102 N 1.28 0.70 -0.56 2.92 0.00 0.24 -2.25 119.26 121.60 1l1o h ALA 102 Ca 0.26 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 54.99 1l1o h ALA 102 Cb 0.14 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 1l1o h ALA 102 CO -0.03 0.42 0.30 0.28 0.00 0.00 0.00 179.25 180.22 1l1o h VAL 103 N 0.75 0.97 -0.51 0.00 2.07 -0.52 0.31 116.25 119.32 1l1o h VAL 103 Ca 0.16 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1l1o h VAL 103 Cb 0.37 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1l1o h VAL 103 CO 0.01 0.10 0.30 0.11 0.02 0.00 0.00 177.57 178.11 1l1o h LYS 104 N 0.57 0.70 -0.62 1.57 1.57 -0.90 -2.15 116.57 117.31 1l1o h LYS 104 Ca 0.25 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.87 1l1o h LYS 104 Cb 0.14 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1l1o h LYS 104 CO -0.16 0.53 0.07 0.82 -0.57 0.00 0.00 179.45 180.14 1l1o h ILE 105 N 0.69 1.26 -0.29 1.86 2.04 -0.78 0.27 117.51 122.56 1l1o h ILE 105 Ca 0.18 -1.04 0.07 0.00 1.00 0.00 0.00 64.86 65.06 1l1o h ILE 105 Cb 0.01 0.70 -0.07 0.00 -0.74 0.00 0.00 36.82 36.73 1l1o h ILE 105 CO -0.03 0.39 -0.18 0.40 0.00 0.00 0.00 178.15 178.72 1l1o h ILE 106 N 0.96 0.49 0.00 -0.67 2.04 -0.18 0.27 117.51 120.41 1l1o h ILE 106 Ca 0.19 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.05 1l1o h ILE 106 Cb 0.46 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1l1o h ILE 106 CO 0.02 0.00 0.00 0.45 0.00 0.00 0.00 178.15 178.62 1l1o h HIS 107 N -0.15 0.00 0.00 1.37 3.86 -0.67 -2.80 115.15 116.76 1l1o h HIS 107 Ca 0.15 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.22 1l1o h HIS 107 Cb 0.39 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.84 1l1o h HIS 107 CO -0.37 0.00 -0.78 -0.44 0.86 0.00 0.00 177.93 177.20 1l1o h ASP 108 N 0.00 0.00 -1.34 2.45 3.32 0.61 -3.36 116.42 118.09 1l1o h ASP 108 Ca 0.00 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.47 1l1o h ASP 108 Cb 0.69 0.00 -0.42 0.00 0.22 0.00 0.00 39.33 39.81 1l1o h ASP 108 CO 0.00 0.63 -0.76 0.49 -1.72 0.00 0.00 179.24 177.89 1l1o n PHE 109 N -3.20 3.24 -0.31 4.55 3.01 0.84 -4.91 117.46 120.68 1l1o n PHE 109 Ca -0.01 -2.92 -0.04 0.00 1.01 0.00 0.00 57.45 55.49 1l1o n PHE 109 Cb 0.80 -0.14 -0.02 0.00 -0.01 0.00 0.00 39.48 40.12 1l1o n PHE 109 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1l1o n PRO 110 N -0.52 -0.25 0.30 -1.08 -0.04 -1.07 -0.11 135.00 132.22 1l1o n PRO 110 Ca 0.40 1.18 0.04 0.00 -0.04 0.00 0.00 63.50 65.07 1l1o n PRO 110 Cb 0.73 -1.74 0.20 0.00 -0.04 0.00 0.00 33.50 32.65 1l1o n PRO 110 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 1l1o h GLN 111 N 0.00 0.00 -0.21 0.54 -0.00 -1.91 0.76 115.11 114.29 1l1o h GLN 111 Ca 0.20 0.00 -0.16 0.00 -0.00 0.00 0.00 58.65 58.69 1l1o h GLN 111 Cb 0.40 0.00 -0.14 0.00 -0.00 0.00 0.00 27.48 27.73 1l1o h GLN 111 CO -0.75 0.00 -0.63 1.19 -0.00 0.00 0.00 178.83 178.65 1l1o n PHE 112 N -2.46 0.77 0.00 0.06 0.99 0.84 -4.64 117.46 113.02 1l1o n PHE 112 Ca -0.00 -1.66 0.00 0.00 -0.00 0.00 0.00 57.45 55.79 1l1o n PHE 112 Cb 0.79 -0.27 0.00 0.00 -1.00 0.00 0.00 39.48 39.00 1l1o n PHE 112 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.76 177.74 1l1o n TYR 113 N -0.92 0.00 -0.55 1.38 9.36 0.20 -5.08 117.16 121.55 1l1o n TYR 113 Ca 0.25 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 61.17 1l1o n TYR 113 Cb 0.79 0.00 0.22 0.00 -0.63 0.00 0.00 39.34 39.73 1l1o n TYR 113 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 1l1o n PRO 114 N 0.00 -1.99 -3.93 2.98 -0.04 -0.86 -4.79 135.00 126.37 1l1o n PRO 114 Ca 0.00 -0.55 -0.26 0.00 -0.04 0.00 0.00 63.50 62.65 1l1o n PRO 114 Cb 0.00 -2.07 -0.17 0.00 -0.04 0.00 0.00 33.50 31.22 1l1o n PRO 114 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1l1o s LEU 115 N -5.61 1.11 0.00 1.53 2.96 -1.26 -5.04 118.68 112.37 1l1o s LEU 115 Ca 0.65 -0.25 0.00 0.00 -0.22 0.00 0.00 54.13 54.31 1l1o s LEU 115 Cb -0.22 -0.75 0.00 0.00 0.50 0.00 0.00 46.19 45.72 1l1o s LEU 115 CO 0.65 -0.12 0.00 0.61 -1.32 0.00 0.00 176.35 176.17 1l1o n GLY 116 N 4.88 -1.39 0.00 7.98 0.00 -1.26 -5.05 105.19 110.35 1l1o n GLY 116 Ca -0.13 -1.57 0.03 0.00 0.00 0.00 0.00 46.02 44.35 1l1o n GLY 116 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71