#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l1o h MET 4 N 0.00 0.00 0.00 -0.67 2.86 -2.00 -3.36 114.93 111.76 1l1o h MET 4 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1l1o h MET 4 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1l1o h MET 4 CO 0.00 0.00 0.00 -0.12 1.06 0.00 0.00 176.91 177.85 1l1o n MET 5 N -2.32 0.02 -0.35 1.72 0.00 -1.26 -1.88 117.12 113.04 1l1o n MET 5 Ca 0.02 0.44 0.08 0.00 0.00 0.00 0.00 57.70 58.24 1l1o n MET 5 Cb 0.48 -1.55 0.22 0.00 0.00 0.00 0.00 33.22 32.37 1l1o n MET 5 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1l1o n ASP 6 N -1.58 3.56 -4.45 6.12 8.00 -1.26 -4.98 116.55 121.95 1l1o n ASP 6 Ca 0.01 -2.70 -0.22 0.00 0.71 0.00 0.00 54.79 52.59 1l1o n ASP 6 Cb 0.06 -0.44 -0.11 0.00 -0.02 0.00 0.00 41.12 40.61 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 -2.26 2.33 0.52 0.64 1.43 -0.79 -5.12 118.68 115.44 1l1o s LEU 7 Ca 0.36 -1.31 -0.20 0.00 -1.03 0.00 0.00 54.13 51.95 1l1o s LEU 7 Cb 0.27 -0.49 -0.07 0.00 0.03 0.00 0.00 46.19 45.93 1l1o s LEU 7 CO 0.11 -0.51 1.11 -2.84 0.23 0.00 0.00 176.35 174.44 1l1o s PRO 8 N -3.83 3.49 -0.28 1.29 0.02 -1.26 -5.01 135.00 129.43 1l1o s PRO 8 Ca 0.34 1.56 -0.03 0.00 0.02 0.00 0.00 61.00 62.90 1l1o s PRO 8 Cb 0.07 -2.05 0.09 0.00 0.02 0.00 0.00 34.50 32.63 1l1o s PRO 8 CO 0.14 -0.73 0.10 1.03 -0.33 0.00 0.00 177.00 177.22 1l1o s ARG 9 N -3.23 0.44 0.19 5.54 0.52 -1.26 -4.73 118.95 116.42 1l1o s ARG 9 Ca 0.71 -0.70 -0.31 0.00 -0.52 0.00 0.00 55.73 54.91 1l1o s ARG 9 Cb -0.22 -1.64 -0.10 0.00 0.52 0.00 0.00 34.95 33.51 1l1o s ARG 9 CO 0.26 -0.94 1.48 -1.12 0.02 0.00 0.00 175.30 175.00 1l1o s SER 10 N 1.89 6.66 0.06 0.23 0.01 -1.14 -4.24 113.70 117.17 1l1o s SER 10 Ca 0.08 2.58 -0.30 0.00 1.31 0.00 0.00 55.95 59.62 1l1o s SER 10 Cb -0.17 -2.60 -0.05 0.00 0.21 0.00 0.00 66.02 63.41 1l1o s SER 10 CO -0.27 -0.74 1.03 -0.13 0.41 0.00 0.00 173.24 173.54 1l1o s ARG 11 N 0.50 4.57 0.27 12.44 0.52 -1.26 -0.90 118.95 135.10 1l1o s ARG 11 Ca 0.64 1.53 -0.06 0.00 -0.52 0.00 0.00 55.73 57.32 1l1o s ARG 11 Cb -0.42 -3.40 -0.01 0.00 0.52 0.00 0.00 34.95 31.65 1l1o s ARG 11 CO 0.36 -0.01 0.39 0.96 0.02 0.00 0.00 175.30 177.02 1l1o s ILE 12 N 0.61 0.00 0.40 1.52 -4.36 -0.82 -4.96 121.20 113.60 1l1o s ILE 12 Ca 0.52 -1.63 0.04 0.00 -0.26 0.00 0.00 60.65 59.32 1l1o s ILE 12 Cb -0.24 -2.42 -0.05 0.00 1.25 0.00 0.00 42.46 41.00 1l1o s ILE 12 CO 0.30 0.00 0.05 0.54 0.24 0.00 0.00 174.94 176.06 1l1o s ASN 13 N -3.13 3.18 0.27 4.36 6.03 -1.26 -4.01 114.94 120.39 1l1o s ASN 13 Ca 0.30 -1.49 -0.00 0.00 -1.03 0.00 0.00 52.86 50.63 1l1o s ASN 13 Cb 0.01 0.08 0.60 0.00 -3.03 0.00 0.00 41.25 38.92 1l1o s ASN 13 CO 0.14 -0.69 1.71 0.00 -2.03 0.00 0.00 177.10 176.23 1l1o h ALA 14 N 1.81 1.25 -1.11 3.54 0.00 -1.90 -1.64 119.26 121.21 1l1o h ALA 14 Ca -0.41 0.14 0.32 0.00 0.00 0.00 0.00 54.91 54.97 1l1o h ALA 14 Cb 1.26 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 1l1o h ALA 14 CO 0.71 -0.28 0.91 0.78 0.00 0.00 0.00 179.25 181.37 1l1o h GLY 15 N 0.41 0.00 0.59 0.00 0.00 -1.95 -1.86 103.07 100.26 1l1o h GLY 15 Ca 0.49 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.69 1l1o h GLY 15 CO -0.48 0.00 -1.64 1.03 0.00 0.00 0.00 176.54 175.45 1l1o n MET 16 N -3.89 0.64 -0.23 4.80 2.81 -0.62 -4.60 117.12 116.03 1l1o n MET 16 Ca 0.24 0.07 0.23 0.00 -1.81 0.00 0.00 57.70 56.43 1l1o n MET 16 Cb 1.27 -1.70 0.42 0.00 -0.71 0.00 0.00 33.22 32.51 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 -2.68 0.24 0.11 4.03 4.77 -0.70 0.24 117.00 123.02 1l1o n LEU 17 Ca -0.10 1.17 0.13 0.00 -0.03 0.00 0.00 56.01 57.17 1l1o n LEU 17 Cb 0.77 -0.57 0.33 0.00 -2.33 0.00 0.00 43.42 41.63 1l1o n LEU 17 CO 0.43 -1.31 0.77 0.00 -1.33 0.00 0.00 177.39 175.95 1l1o h ALA 18 N 1.41 0.92 -0.01 -1.18 0.00 -1.81 -2.85 119.26 115.73 1l1o h ALA 18 Ca 0.61 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.52 1l1o h ALA 18 Cb 1.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.42 1l1o h ALA 18 CO -0.54 0.00 -0.15 1.04 0.00 0.00 0.00 179.25 179.60 1l1o n GLN 19 N -2.33 1.42 -0.64 0.00 3.00 0.67 -4.10 117.38 115.40 1l1o n GLN 19 Ca 0.05 -0.95 0.03 0.00 -0.01 0.00 0.00 57.00 56.11 1l1o n GLN 19 Cb 0.44 -1.48 0.20 0.00 0.00 0.00 0.00 30.24 29.41 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 0.04 0.39 -1.78 1.08 3.01 -0.93 -5.01 117.46 114.26 1l1o n PHE 20 Ca 0.15 -1.50 -0.42 0.00 1.01 0.00 0.00 57.45 56.68 1l1o n PHE 20 Cb 0.40 -0.33 -0.03 0.00 -0.01 0.00 0.00 39.48 39.51 1l1o n PHE 20 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1l1o s ILE 21 N -3.22 2.18 0.00 4.37 1.01 -1.22 -0.98 121.20 123.34 1l1o s ILE 21 Ca 0.40 0.13 0.00 0.00 0.00 0.00 0.00 60.65 61.18 1l1o s ILE 21 Cb 0.38 -3.09 0.00 0.00 0.01 0.00 0.00 42.46 39.76 1l1o s ILE 21 CO -0.04 0.01 0.00 -0.67 0.00 0.00 0.00 174.94 174.24 1l1o n ASP 22 N 3.93 -3.66 -4.73 3.58 2.03 0.83 -4.95 116.55 113.58 1l1o n ASP 22 Ca 0.15 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 55.13 1l1o n ASP 22 Cb 0.36 -1.23 -0.08 0.00 -0.72 0.00 0.00 41.12 39.45 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 -0.49 2.92 -0.03 -0.67 1.02 -0.16 -4.74 119.74 117.60 1l1o s LYS 23 Ca 0.00 -0.55 -0.30 0.00 0.02 0.00 0.00 55.97 55.14 1l1o s LYS 23 Cb 0.00 -2.76 -0.04 0.00 -0.52 0.00 0.00 37.83 34.51 1l1o s LYS 23 CO 0.00 0.63 1.21 -1.25 -0.92 0.00 0.00 175.35 175.02 1l1o s PRO 24 N -1.67 4.37 0.37 -1.68 0.04 -1.26 -0.92 135.00 134.25 1l1o s PRO 24 Ca 0.21 1.71 0.04 0.00 0.04 0.00 0.00 61.00 63.00 1l1o s PRO 24 Cb -0.12 -3.52 -0.03 0.00 0.04 0.00 0.00 34.50 30.87 1l1o s PRO 24 CO 0.12 -0.41 0.15 0.14 0.04 0.00 0.00 177.00 177.03 1l1o s VAL 25 N 1.99 0.52 -0.26 -0.36 -7.23 0.35 -2.90 120.40 112.51 1l1o s VAL 25 Ca 0.57 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.72 1l1o s VAL 25 Cb -0.26 -2.43 0.08 0.00 0.56 0.00 0.00 36.38 34.34 1l1o s VAL 25 CO 0.24 0.00 0.08 0.00 -0.31 0.00 0.00 175.10 175.10 1l1o s PHE 27 N 1.78 3.24 -0.12 0.00 5.36 0.78 -1.94 117.98 127.08 1l1o s PHE 27 Ca 0.05 0.04 0.03 0.00 -0.96 0.00 0.00 56.93 56.09 1l1o s PHE 27 Cb -0.17 -2.21 0.00 0.00 -0.34 0.00 0.00 43.02 40.30 1l1o s PHE 27 CO -0.20 -0.01 -0.22 0.08 -1.46 0.00 0.00 175.22 173.41 1l1o s VAL 28 N 1.02 2.19 0.29 3.12 1.01 -1.26 -0.40 120.40 126.38 1l1o s VAL 28 Ca 0.06 -0.96 -0.19 0.00 0.00 0.00 0.00 61.98 60.89 1l1o s VAL 28 Cb -0.14 -1.86 0.06 0.00 0.00 0.00 0.00 36.38 34.44 1l1o s VAL 28 CO 0.04 0.55 0.87 -0.83 0.00 0.00 0.00 175.10 175.73 1l1o s GLY 29 N 0.48 0.19 -0.08 4.51 0.00 -0.62 -4.52 107.32 107.27 1l1o s GLY 29 Ca -0.15 -0.50 -0.15 0.00 0.00 0.00 0.00 44.72 43.92 1l1o s GLY 29 CO 0.06 0.58 0.38 -1.60 0.00 0.00 0.00 173.10 172.52 1l1o s ARG 30 N -2.52 4.11 0.14 2.90 3.52 -0.37 -0.26 118.95 126.47 1l1o s ARG 30 Ca 0.17 0.30 -0.31 0.00 -0.13 0.00 0.00 55.73 55.76 1l1o s ARG 30 Cb -0.04 -3.34 -0.09 0.00 -1.56 0.00 0.00 34.95 29.92 1l1o s ARG 30 CO 0.08 0.42 1.44 -1.17 -0.81 0.00 0.00 175.30 175.26 1l1o s LEU 31 N -0.16 4.37 0.03 -0.88 2.96 -0.66 -0.63 118.68 123.71 1l1o s LEU 31 Ca 0.22 2.43 -0.04 0.00 -0.22 0.00 0.00 54.13 56.53 1l1o s LEU 31 Cb -0.15 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 42.94 1l1o s LEU 31 CO 0.09 -0.70 -0.07 1.21 -1.32 0.00 0.00 176.35 175.56 1l1o n GLU 32 N 3.83 0.11 -3.81 1.98 4.07 -1.03 -4.54 120.64 121.25 1l1o n GLU 32 Ca 0.12 0.04 -0.13 0.00 -0.06 0.00 0.00 57.16 57.13 1l1o n GLU 32 Cb 0.41 -0.69 -0.14 0.00 -0.06 0.00 0.00 31.44 30.96 1l1o n GLU 32 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1l1o s LYS 33 N -2.17 0.10 -0.16 5.31 1.02 -1.25 -5.01 119.74 117.59 1l1o s LYS 33 Ca -0.06 0.21 -0.00 0.00 0.02 0.00 0.00 55.97 56.13 1l1o s LYS 33 Cb 0.01 -0.03 -0.01 0.00 -0.52 0.00 0.00 37.83 37.29 1l1o s LYS 33 CO 0.09 -0.07 -0.13 -1.50 -0.92 0.00 0.00 175.35 172.82 1l1o s ILE 34 N 0.44 2.87 0.81 2.17 2.07 -1.26 -0.88 121.20 127.42 1l1o s ILE 34 Ca -0.03 -0.70 -0.16 0.00 -1.41 0.00 0.00 60.65 58.34 1l1o s ILE 34 Cb -0.05 -2.22 -0.10 0.00 0.13 0.00 0.00 42.46 40.22 1l1o s ILE 34 CO -0.02 0.51 -0.15 1.57 -1.91 0.00 0.00 174.94 174.93 1l1o n HIS 35 N 4.02 -3.09 0.15 3.50 -0.00 -0.25 -4.84 115.22 114.72 1l1o n HIS 35 Ca -0.19 0.21 -0.14 0.00 -0.00 0.00 0.00 57.72 57.60 1l1o n HIS 35 Cb 0.52 -1.66 -0.08 0.00 -0.00 0.00 0.00 29.99 28.77 1l1o n HIS 35 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1l1o h PRO 36 N -0.70 -0.33 -1.21 1.57 0.11 -1.99 -2.14 132.00 127.31 1l1o h PRO 36 Ca -0.44 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.70 1l1o h PRO 36 Cb 1.34 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.53 1l1o h PRO 36 CO 0.34 -0.15 0.00 0.25 -0.21 0.00 0.00 178.00 178.23 1l1o n THR 37 N -5.19 0.38 -2.68 -1.15 -2.24 -1.26 -4.82 114.28 97.32 1l1o n THR 37 Ca -0.10 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.65 1l1o n THR 37 Cb 0.19 -0.62 -0.01 0.00 -2.10 0.00 0.00 70.33 67.79 1l1o n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1l1o n GLY 38 N 0.60 -0.01 0.00 3.38 0.00 -0.81 -4.63 105.19 103.72 1l1o n GLY 38 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -1.38 0.23 -3.30 1.61 -0.00 -1.26 -1.51 118.16 112.54 1l1o n LYS 39 Ca -0.04 -0.33 -0.09 0.00 -0.00 0.00 0.00 58.31 57.85 1l1o n LYS 39 Cb 0.08 -0.82 -0.06 0.00 -0.00 0.00 0.00 35.03 34.24 1l1o n LYS 39 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.40 178.81 1l1o s MET 40 N -0.13 0.49 0.42 -1.58 0.00 -1.26 -0.28 119.30 116.96 1l1o s MET 40 Ca 0.00 -0.03 0.07 0.00 0.00 0.00 0.00 55.69 55.73 1l1o s MET 40 Cb 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 34.83 34.50 1l1o s MET 40 CO 0.00 -1.07 0.34 -0.59 0.00 0.00 0.00 175.02 173.70 1l1o s PHE 41 N 2.34 2.63 0.14 4.11 -0.12 -0.83 -1.09 117.98 125.15 1l1o s PHE 41 Ca 0.11 -0.53 0.08 0.00 -0.05 0.00 0.00 56.93 56.54 1l1o s PHE 41 Cb -0.12 -2.12 -0.04 0.00 -0.63 0.00 0.00 43.02 40.11 1l1o s PHE 41 CO -0.24 -0.08 -0.17 0.96 -0.05 0.00 0.00 175.22 175.63 1l1o s ILE 42 N -2.52 1.63 0.02 -4.49 -4.36 -0.06 -1.13 121.20 110.30 1l1o s ILE 42 Ca 0.46 -1.77 0.04 0.00 -0.26 0.00 0.00 60.65 59.12 1l1o s ILE 42 Cb -0.02 -1.67 -0.02 0.00 1.25 0.00 0.00 42.46 42.01 1l1o s ILE 42 CO 0.26 -0.29 -0.11 -0.76 0.24 0.00 0.00 174.94 174.28 1l1o s LEU 43 N -2.43 2.11 -0.27 0.37 1.43 0.26 -2.45 118.68 117.70 1l1o s LEU 43 Ca 0.11 -0.33 -0.09 0.00 -1.03 0.00 0.00 54.13 52.79 1l1o s LEU 43 Cb -0.06 -0.49 -0.04 0.00 0.03 0.00 0.00 46.19 45.63 1l1o s LEU 43 CO 0.05 0.04 0.13 -0.94 0.23 0.00 0.00 176.35 175.87 1l1o s SER 44 N -0.76 5.58 0.79 2.29 1.04 0.20 0.15 113.70 122.99 1l1o s SER 44 Ca 0.01 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.28 1l1o s SER 44 Cb -0.06 -2.02 0.00 0.00 0.10 0.00 0.00 66.02 64.04 1l1o s SER 44 CO 0.00 -0.06 0.00 -0.90 0.98 0.00 0.00 173.24 173.26 1l1o n ASP 45 N 4.99 -0.99 -0.02 7.02 3.85 0.06 -1.24 116.55 130.23 1l1o n ASP 45 Ca -0.15 -0.29 0.15 0.00 -0.71 0.00 0.00 54.79 53.79 1l1o n ASP 45 Cb 0.51 0.00 0.76 0.00 -1.35 0.00 0.00 41.12 41.04 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 1.86 -1.21 0.29 6.12 0.00 -1.26 -2.94 105.19 108.05 1l1o n GLY 46 Ca 0.00 -0.17 0.03 0.00 0.00 0.00 0.00 46.02 45.88 1l1o n GLY 46 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1l1o n GLU 47 N -1.21 1.38 0.00 1.61 0.28 -1.26 -4.25 120.64 117.19 1l1o n GLU 47 Ca 0.15 -1.32 0.00 0.00 -0.16 0.00 0.00 57.16 55.83 1l1o n GLU 47 Cb 0.23 -1.13 0.00 0.00 1.43 0.00 0.00 31.44 31.98 1l1o n GLU 47 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1l1o n GLY 48 N 0.19 3.14 3.56 -1.84 0.00 -1.15 -5.07 105.19 104.03 1l1o n GLY 48 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 1l1o n GLY 48 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1l1o n LYS 49 N -0.83 0.46 -4.66 1.61 5.02 -1.26 -4.55 118.16 113.94 1l1o n LYS 49 Ca 0.00 0.21 -0.33 0.00 -2.02 0.00 0.00 58.31 56.16 1l1o n LYS 49 Cb 0.00 -2.08 -0.12 0.00 -0.02 0.00 0.00 35.03 32.80 1l1o n LYS 49 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1l1o s ASN 50 N -1.56 4.42 -0.07 4.39 -0.87 -1.26 -0.76 114.94 119.22 1l1o s ASN 50 Ca 0.71 -0.15 0.01 0.00 -1.57 0.00 0.00 52.86 51.86 1l1o s ASN 50 Cb -0.35 -1.34 -0.03 0.00 -0.02 0.00 0.00 41.25 39.51 1l1o s ASN 50 CO 0.53 0.27 -0.08 -0.83 -2.57 0.00 0.00 177.10 174.42 1l1o s GLY 51 N -0.28 1.68 -0.37 0.66 0.00 0.40 -4.89 107.32 104.52 1l1o s GLY 51 Ca 0.03 -0.90 -0.10 0.00 0.00 0.00 0.00 44.72 43.75 1l1o s GLY 51 CO 0.03 -0.65 0.19 -1.59 0.00 0.00 0.00 173.10 171.07 1l1o s THR 52 N -0.75 4.41 -0.21 0.90 2.01 -1.26 -0.57 115.64 120.17 1l1o s THR 52 Ca 0.11 -0.93 -0.16 0.00 0.31 0.00 0.00 61.69 61.02 1l1o s THR 52 Cb -0.11 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 1l1o s THR 52 CO 0.01 -0.23 0.43 -0.63 -0.69 0.00 0.00 174.62 173.51 1l1o s ILE 53 N 1.52 5.17 -0.09 1.82 1.09 -0.28 -2.34 121.20 128.09 1l1o s ILE 53 Ca 0.01 0.77 0.00 0.00 -1.10 0.00 0.00 60.65 60.33 1l1o s ILE 53 Cb -0.19 -3.76 -0.03 0.00 -1.06 0.00 0.00 42.46 37.42 1l1o s ILE 53 CO 0.06 0.22 -0.07 -1.61 -0.10 0.00 0.00 174.94 173.44 1l1o s GLU 54 N 1.45 2.96 -0.12 2.79 2.02 0.26 -1.97 118.70 126.09 1l1o s GLU 54 Ca 0.20 -0.56 -0.02 0.00 0.02 0.00 0.00 54.97 54.62 1l1o s GLU 54 Cb -0.15 -2.65 -0.03 0.00 0.10 0.00 0.00 34.13 31.41 1l1o s GLU 54 CO 0.09 0.55 -0.05 -0.51 0.02 0.00 0.00 175.26 175.36 1l1o s LEU 55 N -0.50 3.21 0.58 1.80 1.02 0.62 -0.45 118.68 124.96 1l1o s LEU 55 Ca 0.07 -0.08 0.35 0.00 0.02 0.00 0.00 54.13 54.49 1l1o s LEU 55 Cb -0.12 -1.74 1.76 0.00 0.02 0.00 0.00 46.19 46.11 1l1o s LEU 55 CO 0.02 0.25 2.16 0.24 0.02 0.00 0.00 176.35 179.04 1l1o h MET 56 N 6.09 0.00 -3.78 1.70 2.86 -1.86 -3.44 114.93 116.50 1l1o h MET 56 Ca -0.38 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.08 1l1o h MET 56 Cb 1.19 0.00 -0.23 0.00 0.06 0.00 0.00 31.60 32.62 1l1o h MET 56 CO 0.58 0.05 -0.64 -1.21 1.06 0.00 0.00 176.91 176.74 1l1o s GLU 57 N -4.06 0.28 0.37 1.72 0.41 -1.26 -5.15 118.70 111.01 1l1o s GLU 57 Ca -0.03 -0.38 -0.27 0.00 -0.41 0.00 0.00 54.97 53.88 1l1o s GLU 57 Cb 0.12 0.11 -0.11 0.00 -1.78 0.00 0.00 34.13 32.46 1l1o s GLU 57 CO 0.52 -0.05 1.30 -0.35 -0.49 0.00 0.00 175.26 176.18 1l1o n PRO 58 N 1.96 2.11 -1.98 0.39 -0.04 -1.26 -4.83 135.00 131.35 1l1o n PRO 58 Ca -0.20 0.74 -0.42 0.00 -0.04 0.00 0.00 63.50 63.58 1l1o n PRO 58 Cb 0.56 -2.37 -0.03 0.00 -0.04 0.00 0.00 33.50 31.63 1l1o n PRO 58 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1l1o s LEU 59 N -1.30 4.38 0.00 1.53 1.43 -0.57 -5.01 118.68 119.14 1l1o s LEU 59 Ca 0.57 2.62 0.00 0.00 -1.03 0.00 0.00 54.13 56.28 1l1o s LEU 59 Cb -0.54 -3.61 0.00 0.00 0.03 0.00 0.00 46.19 42.07 1l1o s LEU 59 CO 0.61 -0.76 0.08 0.47 0.23 0.00 0.00 176.35 176.98 1l1o n ASP 60 N 3.26 0.00 -2.57 2.29 9.92 -1.26 -4.97 116.55 123.22 1l1o n ASP 60 Ca 0.11 0.08 -0.08 0.00 -0.53 0.00 0.00 54.79 54.36 1l1o n ASP 60 Cb 0.40 0.00 0.06 0.00 -0.64 0.00 0.00 41.12 40.93 1l1o n ASP 60 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 1l1o n GLU 61 N -0.48 -0.30 -3.27 -1.24 -0.00 -1.26 -5.04 120.64 109.04 1l1o n GLU 61 Ca 0.00 -0.62 -0.41 0.00 -0.00 0.00 0.00 57.16 56.13 1l1o n GLU 61 Cb 0.00 -0.38 -0.08 0.00 -0.00 0.00 0.00 31.44 30.98 1l1o n GLU 61 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 1l1o s GLU 62 N -3.78 3.53 0.92 3.44 2.02 -1.26 -5.07 118.70 118.50 1l1o s GLU 62 Ca 0.22 -0.29 -0.13 0.00 0.02 0.00 0.00 54.97 54.78 1l1o s GLU 62 Cb -0.01 -3.83 0.15 0.00 0.10 0.00 0.00 34.13 30.54 1l1o s GLU 62 CO 0.15 -0.66 1.18 0.42 0.02 0.00 0.00 175.26 176.36 1l1o s ILE 63 N 2.31 1.97 0.00 -1.63 1.01 -1.26 -5.04 121.20 118.55 1l1o s ILE 63 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.82 1l1o s ILE 63 Cb -0.16 -2.83 0.00 0.00 0.01 0.00 0.00 42.46 39.49 1l1o s ILE 63 CO 0.13 0.00 0.00 -1.54 0.00 0.00 0.00 174.94 173.53 1l1o n SER 64 N -3.74 0.00 -0.17 3.58 3.41 -1.26 -5.09 113.62 110.34 1l1o n SER 64 Ca 0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1l1o n SER 64 Cb 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 1l1o n SER 64 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1l1o n GLY 65 N -0.85 -1.25 3.72 5.00 0.00 -1.26 -4.71 105.19 105.83 1l1o n GLY 65 Ca 0.00 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.37 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 2.85 0.02 -0.61 -1.09 -1.26 -1.66 121.20 119.45 1l1o s ILE 66 Ca 0.00 0.62 0.03 0.00 -2.23 0.00 0.00 60.65 59.07 1l1o s ILE 66 Cb 0.00 -3.40 -0.02 0.00 -1.58 0.00 0.00 42.46 37.47 1l1o s ILE 66 CO 0.00 0.05 -0.11 -0.69 -1.23 0.00 0.00 174.94 172.97 1l1o s VAL 67 N 1.01 0.81 -0.19 2.92 1.01 0.64 -2.02 120.40 124.58 1l1o s VAL 67 Ca 0.67 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 1l1o s VAL 67 Cb -0.41 -0.74 -0.01 0.00 0.00 0.00 0.00 36.38 35.21 1l1o s VAL 67 CO 0.32 0.01 -0.08 -0.70 0.00 0.00 0.00 175.10 174.65 1l1o s GLU 68 N -0.83 3.38 0.05 2.72 2.12 -0.07 -1.58 118.70 124.48 1l1o s GLU 68 Ca 0.00 -0.64 0.06 0.00 0.36 0.00 0.00 54.97 54.75 1l1o s GLU 68 Cb -0.06 -2.87 -0.03 0.00 0.26 0.00 0.00 34.13 31.42 1l1o s GLU 68 CO 0.00 -0.05 -0.13 0.08 -0.54 0.00 0.00 175.26 174.62 1l1o s VAL 69 N 1.07 3.15 -0.00 3.70 1.01 0.46 -1.35 120.40 128.44 1l1o s VAL 69 Ca 0.01 -1.10 0.07 0.00 0.00 0.00 0.00 61.98 60.96 1l1o s VAL 69 Cb -0.15 -2.38 -0.02 0.00 0.00 0.00 0.00 36.38 33.84 1l1o s VAL 69 CO -0.01 0.30 -0.22 -0.69 0.00 0.00 0.00 175.10 174.48 1l1o s VAL 70 N -1.01 1.74 -0.97 2.92 1.01 -0.54 -0.15 120.40 123.39 1l1o s VAL 70 Ca 0.17 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.13 1l1o s VAL 70 Cb -0.11 -1.46 0.00 0.00 0.00 0.00 0.00 36.38 34.81 1l1o s VAL 70 CO 0.08 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1l1o n GLY 71 N 2.35 -1.31 3.40 4.51 0.00 0.16 -0.97 105.19 113.33 1l1o n GLY 71 Ca -0.16 -0.93 -0.33 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.77 3.14 0.19 1.61 3.52 -1.02 0.13 118.95 125.76 1l1o s ARG 72 Ca 0.00 -0.69 -0.32 0.00 -0.13 0.00 0.00 55.73 54.60 1l1o s ARG 72 Cb 0.00 -2.56 -0.11 0.00 -1.56 0.00 0.00 34.95 30.71 1l1o s ARG 72 CO 0.00 0.33 1.75 0.08 -0.81 0.00 0.00 175.30 176.64 1l1o s VAL 73 N 0.05 2.17 0.86 7.11 1.01 -0.10 -1.80 120.40 129.70 1l1o s VAL 73 Ca -0.05 0.04 -0.13 0.00 0.00 0.00 0.00 61.98 61.84 1l1o s VAL 73 Cb -0.14 -3.02 0.13 0.00 0.00 0.00 0.00 36.38 33.34 1l1o s VAL 73 CO 0.04 0.00 1.22 0.42 0.00 0.00 0.00 175.10 176.78 1l1o s THR 74 N 1.56 2.03 0.26 3.92 -4.23 0.72 -0.12 115.64 119.79 1l1o s THR 74 Ca 0.76 -0.06 0.19 0.00 -1.18 0.00 0.00 61.69 61.41 1l1o s THR 74 Cb -0.49 -2.98 0.15 0.00 1.34 0.00 0.00 72.50 70.53 1l1o s THR 74 CO 0.33 0.00 1.82 0.00 -0.54 0.00 0.00 174.62 176.23 1l1o h ALA 75 N -1.24 1.13 -0.50 3.99 0.00 -1.95 -2.41 119.26 118.28 1l1o h ALA 75 Ca -0.45 -0.30 -0.27 0.00 0.00 0.00 0.00 54.91 53.90 1l1o h ALA 75 Cb 1.28 -0.05 -0.15 0.00 0.00 0.00 0.00 17.79 18.87 1l1o h ALA 75 CO 0.52 0.41 0.34 1.63 0.00 0.00 0.00 179.25 182.15 1l1o n LYS 76 N -3.67 1.65 -3.87 0.00 5.02 -1.26 -4.90 118.16 111.12 1l1o n LYS 76 Ca -0.01 -1.52 -0.31 0.00 -2.02 0.00 0.00 58.31 54.45 1l1o n LYS 76 Cb 0.44 -1.60 0.01 0.00 -0.02 0.00 0.00 35.03 33.86 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 -0.27 -1.22 -2.58 7.82 0.00 -0.91 -4.98 120.51 118.37 1l1o n ALA 77 Ca 0.30 0.12 -0.27 0.00 0.00 0.00 0.00 53.44 53.59 1l1o n ALA 77 Cb 1.04 -3.88 -0.10 0.00 0.00 0.00 0.00 19.45 16.52 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 -3.21 1.29 -0.24 0.00 -4.23 -1.26 -4.78 115.64 103.20 1l1o s THR 78 Ca 0.63 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 59.11 1l1o s THR 78 Cb -0.33 -2.61 0.01 0.00 1.34 0.00 0.00 72.50 70.91 1l1o s THR 78 CO 0.78 0.00 -0.03 -0.63 -0.54 0.00 0.00 174.62 174.20 1l1o s ILE 79 N -3.02 3.30 -0.67 2.99 1.01 -0.99 0.26 121.20 124.08 1l1o s ILE 79 Ca 0.26 -0.69 -0.26 0.00 0.00 0.00 0.00 60.65 59.96 1l1o s ILE 79 Cb 0.06 -2.58 0.04 0.00 0.01 0.00 0.00 42.46 39.99 1l1o s ILE 79 CO 0.13 0.30 1.17 -0.22 0.00 0.00 0.00 174.94 176.32 1l1o s LEU 80 N 1.43 3.54 -0.19 2.97 2.96 -0.74 -0.57 118.68 128.07 1l1o s LEU 80 Ca 0.04 -0.39 -0.29 0.00 -0.22 0.00 0.00 54.13 53.26 1l1o s LEU 80 Cb -0.15 -2.71 -0.02 0.00 0.50 0.00 0.00 46.19 43.80 1l1o s LEU 80 CO -0.03 -1.62 1.50 0.00 -1.32 0.00 0.00 176.35 174.88 1l1o n THR 82 N 5.98 0.77 -3.52 0.00 -2.24 -0.14 -4.52 114.28 110.62 1l1o n THR 82 Ca 0.17 -0.60 -0.11 0.00 -2.27 0.00 0.00 64.05 61.24 1l1o n THR 82 Cb 0.45 -0.44 -0.04 0.00 -2.10 0.00 0.00 70.33 68.20 1l1o n THR 82 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1l1o s SER 83 N -5.40 -0.43 0.01 3.42 1.04 -1.15 -5.02 113.70 106.17 1l1o s SER 83 Ca -0.03 0.23 -0.20 0.00 0.48 0.00 0.00 55.95 56.43 1l1o s SER 83 Cb 0.10 0.40 0.04 0.00 0.10 0.00 0.00 66.02 66.66 1l1o s SER 83 CO 0.81 -0.57 0.43 -0.72 0.98 0.00 0.00 173.24 174.18 1l1o s TYR 84 N -2.29 -0.32 0.06 5.02 -0.85 -1.26 -1.46 117.35 116.25 1l1o s TYR 84 Ca 0.00 0.40 0.02 0.00 -0.52 0.00 0.00 57.07 56.97 1l1o s TYR 84 Cb -0.01 0.22 -0.03 0.00 0.38 0.00 0.00 41.96 42.53 1l1o s TYR 84 CO -0.03 -0.53 -0.07 0.54 -1.52 0.00 0.00 175.55 173.93 1l1o s VAL 85 N -1.94 0.57 -0.25 -3.49 0.11 -0.46 -4.97 120.40 109.96 1l1o s VAL 85 Ca -0.09 -1.30 -0.08 0.00 -2.93 0.00 0.00 61.98 57.59 1l1o s VAL 85 Cb -0.02 -0.88 -0.03 0.00 -1.53 0.00 0.00 36.38 33.92 1l1o s VAL 85 CO 0.02 -0.51 0.09 -1.10 -3.33 0.00 0.00 175.10 170.27 1l1o s GLN 86 N -2.16 3.71 0.49 1.54 -0.21 -1.26 -0.89 119.66 120.88 1l1o s GLN 86 Ca -0.05 -0.45 -0.24 0.00 0.02 0.00 0.00 55.36 54.65 1l1o s GLN 86 Cb -0.06 -3.38 -0.07 0.00 1.00 0.00 0.00 33.01 30.50 1l1o s GLN 86 CO -0.01 -0.17 1.40 -0.06 -2.12 0.00 0.00 175.29 174.33 1l1o s PHE 87 N 1.60 2.39 -0.21 0.91 0.40 -0.86 -4.95 117.98 117.26 1l1o s PHE 87 Ca 0.06 1.30 -0.28 0.00 -0.60 0.00 0.00 56.93 57.41 1l1o s PHE 87 Cb -0.15 -3.88 0.00 0.00 0.51 0.00 0.00 43.02 39.50 1l1o s PHE 87 CO 0.05 -2.93 0.99 0.15 0.70 0.00 0.00 175.22 174.18 1l1o s LYS 88 N -2.62 4.28 0.00 0.44 3.01 -1.26 -4.80 119.74 118.79 1l1o s LYS 88 Ca 0.65 1.28 0.00 0.00 -1.01 0.00 0.00 55.97 56.89 1l1o s LYS 88 Cb -0.43 -3.62 0.00 0.00 -1.01 0.00 0.00 37.83 32.77 1l1o s LYS 88 CO 0.53 -0.55 0.47 0.39 0.51 0.00 0.00 175.35 176.71 1l1o n GLU 89 N 6.01 -0.35 0.00 1.68 1.02 -1.26 -4.76 120.64 122.97 1l1o n GLU 89 Ca 0.10 -0.53 0.00 0.00 -0.02 0.00 0.00 57.16 56.71 1l1o n GLU 89 Cb 0.47 -0.90 0.00 0.00 -0.02 0.00 0.00 31.44 30.99 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 -0.06 0.00 -0.05 1.62 5.68 -1.26 -2.11 116.55 120.38 1l1o n ASP 90 Ca 0.00 0.26 -0.11 0.00 -0.50 0.00 0.00 54.79 54.44 1l1o n ASP 90 Cb 0.08 -0.26 -0.04 0.00 -1.14 0.00 0.00 41.12 39.77 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 -1.24 0.90 -3.91 -1.12 2.88 -1.26 -5.05 113.62 104.82 1l1o n SER 91 Ca 0.00 0.11 -0.11 0.00 -1.33 0.00 0.00 58.87 57.55 1l1o n SER 91 Cb 0.18 -0.29 -0.12 0.00 -0.75 0.00 0.00 64.21 63.23 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 -2.19 0.10 -0.01 0.66 3.76 -0.89 -5.13 115.29 111.58 1l1o s HIS 92 Ca -0.14 -0.21 -0.30 0.00 -0.15 0.00 0.00 55.06 54.26 1l1o s HIS 92 Cb 0.05 -0.08 -0.04 0.00 1.11 0.00 0.00 32.58 33.62 1l1o s HIS 92 CO 0.18 -0.15 1.13 -1.25 -0.85 0.00 0.00 174.74 173.81 1l1o s PRO 93 N -0.89 4.43 -0.02 8.40 0.04 -1.26 -4.50 135.00 141.20 1l1o s PRO 93 Ca -0.10 1.61 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 1l1o s PRO 93 Cb -0.06 -3.47 -0.06 0.00 0.04 0.00 0.00 34.50 30.95 1l1o s PRO 93 CO -0.00 -0.29 1.67 0.12 0.04 0.00 0.00 177.00 178.54 1l1o s PHE 94 N 1.57 2.02 -0.96 0.56 5.36 -1.26 -4.91 117.98 120.36 1l1o s PHE 94 Ca 0.55 0.18 -0.24 0.00 -0.96 0.00 0.00 56.93 56.46 1l1o s PHE 94 Cb -0.25 -3.94 0.03 0.00 -0.34 0.00 0.00 43.02 38.52 1l1o s PHE 94 CO 0.25 -3.96 1.50 0.34 -1.46 0.00 0.00 175.22 171.90 1l1o s ASP 95 N 3.23 6.26 0.52 6.13 -1.08 -1.26 -4.86 116.67 125.61 1l1o s ASP 95 Ca 0.74 -1.19 0.23 0.00 -0.52 0.00 0.00 52.55 51.81 1l1o s ASP 95 Cb -0.35 -2.57 1.40 0.00 -1.46 0.00 0.00 42.92 39.94 1l1o s ASP 95 CO 0.31 -1.73 2.11 0.25 0.52 0.00 0.00 175.17 176.63 1l1o h LEU 96 N 13.55 0.00 -0.34 -1.34 5.85 -1.94 -1.26 115.31 129.83 1l1o h LEU 96 Ca 0.12 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.65 1l1o h LEU 96 Cb 1.02 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 1l1o h LEU 96 CO 1.38 0.09 -0.84 1.23 -0.34 0.00 0.00 178.44 179.96 1l1o h GLY 97 N 0.40 0.12 0.61 3.75 0.00 -1.89 -2.13 103.07 103.92 1l1o h GLY 97 Ca -0.00 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.08 1l1o h GLY 97 CO 0.01 0.18 -0.14 -2.00 0.00 0.00 0.00 176.54 174.60 1l1o h LEU 98 N 0.06 0.24 -0.84 3.11 5.85 -1.79 -1.68 115.31 120.26 1l1o h LEU 98 Ca -0.03 -0.56 0.20 0.00 0.84 0.00 0.00 57.88 58.33 1l1o h LEU 98 Cb 1.46 -0.07 -0.12 0.00 0.37 0.00 0.00 40.66 42.30 1l1o h LEU 98 CO 0.12 0.76 0.30 0.22 -0.34 0.00 0.00 178.44 179.50 1l1o h TYR 99 N -0.26 0.48 -0.83 1.25 3.20 -1.17 -0.03 116.97 119.61 1l1o h TYR 99 Ca 0.00 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 1l1o h TYR 99 Cb 0.72 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 38.87 1l1o h TYR 99 CO 0.11 -0.08 0.43 -0.97 -1.64 0.00 0.00 178.16 176.02 1l1o h ASN 100 N 0.34 1.05 -0.08 -2.11 -1.24 -1.10 -0.10 115.58 112.34 1l1o h ASN 100 Ca 0.51 -0.11 -0.06 0.00 0.71 0.00 0.00 56.30 57.35 1l1o h ASN 100 Cb 0.94 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.70 1l1o h ASN 100 CO -0.54 0.86 -0.10 -0.33 -1.29 0.00 0.00 177.43 176.03 1l1o h GLU 101 N 1.16 0.39 -0.05 6.67 4.39 -0.09 -2.15 114.58 124.89 1l1o h GLU 101 Ca 0.29 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.89 1l1o h GLU 101 Cb 0.06 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1l1o h GLU 101 CO -0.04 0.50 0.01 0.00 -1.16 0.00 0.00 179.01 178.31 1l1o h ALA 102 N 1.53 0.07 -0.93 3.43 0.00 -0.17 -0.35 119.26 122.83 1l1o h ALA 102 Ca 0.07 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 54.99 1l1o h ALA 102 Cb 0.41 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.10 1l1o h ALA 102 CO 0.02 -0.29 0.60 0.28 0.00 0.00 0.00 179.25 179.86 1l1o h VAL 103 N -0.16 0.83 0.00 0.00 2.07 -0.78 0.68 116.25 118.90 1l1o h VAL 103 Ca 0.02 -0.26 -0.20 0.00 0.82 0.00 0.00 66.70 67.08 1l1o h VAL 103 Cb 0.28 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1l1o h VAL 103 CO 0.00 0.14 -0.88 0.11 0.02 0.00 0.00 177.57 176.96 1l1o h LYS 104 N 0.76 0.17 -0.42 1.57 1.57 -1.16 -2.86 116.57 116.20 1l1o h LYS 104 Ca 0.48 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 59.02 1l1o h LYS 104 Cb 0.71 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 1l1o h LYS 104 CO -0.24 0.94 0.06 0.82 -0.57 0.00 0.00 179.45 180.46 1l1o h ILE 105 N 0.09 1.25 -0.49 1.86 2.04 0.90 0.54 117.51 123.70 1l1o h ILE 105 Ca -0.04 -0.90 0.10 0.00 1.00 0.00 0.00 64.86 65.02 1l1o h ILE 105 Cb 1.51 1.02 -0.10 0.00 -0.74 0.00 0.00 36.82 38.51 1l1o h ILE 105 CO 0.13 0.31 -0.17 0.40 0.00 0.00 0.00 178.15 178.82 1l1o h ILE 106 N 0.55 0.42 -0.03 -0.67 2.04 0.32 -0.94 117.51 119.20 1l1o h ILE 106 Ca 0.13 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.86 1l1o h ILE 106 Cb 0.39 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1l1o h ILE 106 CO 0.01 0.00 -0.54 0.45 0.00 0.00 0.00 178.15 178.07 1l1o h HIS 107 N -0.06 0.11 0.00 1.37 3.86 -1.27 -2.58 115.15 116.57 1l1o h HIS 107 Ca 0.24 -0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.38 1l1o h HIS 107 Cb 0.42 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 28.87 1l1o h HIS 107 CO -0.46 0.61 -0.15 -0.44 0.86 0.00 0.00 177.93 178.35 1l1o h ASP 108 N 0.07 0.00 -2.13 2.45 3.32 -0.29 -3.35 116.42 116.49 1l1o h ASP 108 Ca -0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.50 1l1o h ASP 108 Cb 0.98 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 40.12 1l1o h ASP 108 CO 0.08 0.15 -0.91 0.49 -1.72 0.00 0.00 179.24 177.32 1l1o n PHE 109 N -3.27 1.92 0.32 4.55 3.01 -0.41 -4.93 117.46 118.64 1l1o n PHE 109 Ca 0.01 -3.89 0.20 0.00 1.01 0.00 0.00 57.45 54.77 1l1o n PHE 109 Cb 0.41 -0.45 1.09 0.00 -0.01 0.00 0.00 39.48 40.52 1l1o n PHE 109 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1l1o h PRO 110 N 3.28 0.00 0.00 -1.08 0.13 -1.64 -0.12 132.00 132.56 1l1o h PRO 110 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1l1o h PRO 110 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1l1o h PRO 110 CO 0.65 0.00 0.00 -0.56 -0.23 0.00 0.00 178.00 177.86 1l1o h GLN 111 N 0.00 0.00 -0.33 0.86 -0.00 -1.91 -2.56 115.11 111.16 1l1o h GLN 111 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 1l1o h GLN 111 Cb 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.56 1l1o h GLN 111 CO -0.00 0.00 0.00 1.19 -0.00 0.00 0.00 178.83 180.02 1l1o n PHE 112 N -2.40 0.44 -2.72 0.06 0.99 -0.07 -4.69 117.46 109.07 1l1o n PHE 112 Ca 0.01 -0.43 -0.04 0.00 -0.00 0.00 0.00 57.45 56.98 1l1o n PHE 112 Cb 0.20 -0.02 0.03 0.00 -1.00 0.00 0.00 39.48 38.69 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 0.61 -2.50 -2.03 1.38 9.36 -0.98 -5.11 117.16 117.89 1l1o n TYR 113 Ca 0.12 -1.11 -0.37 0.00 3.32 0.00 0.00 57.90 59.86 1l1o n TYR 113 Cb 0.42 1.33 0.02 0.00 -0.63 0.00 0.00 39.34 40.49 1l1o n TYR 113 CO 0.00 0.00 0.00 -2.14 0.22 0.00 0.00 176.86 174.94 1l1o s PRO 114 N 0.84 3.24 -0.23 2.98 0.02 -1.14 -4.63 135.00 136.09 1l1o s PRO 114 Ca 0.28 1.91 0.14 0.00 0.02 0.00 0.00 61.00 63.35 1l1o s PRO 114 Cb 0.08 -2.15 0.35 0.00 0.02 0.00 0.00 34.50 32.81 1l1o s PRO 114 CO -0.09 -1.01 1.31 1.28 -0.33 0.00 0.00 177.00 178.16 1l1o n LEU 115 N -1.13 -0.52 0.00 -5.54 4.77 -1.26 -5.12 117.00 108.20 1l1o n LEU 115 Ca 0.11 -2.83 0.00 0.00 -0.03 0.00 0.00 56.01 53.26 1l1o n LEU 115 Cb 0.48 0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 1l1o n LEU 115 CO 0.47 1.43 0.00 0.61 -1.33 0.00 0.00 177.39 178.57 1l1o n GLY 116 N -0.87 5.48 3.36 -0.72 0.00 -1.26 -4.79 105.19 106.39 1l1o n GLY 116 Ca -0.13 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 43.99 1l1o n GLY 116 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71