#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nvl n ILE 5 N 0.00 3.80 -0.86 -1.33 -5.35 -1.26 -4.44 119.36 109.91 2nvl n ILE 5 Ca 0.00 -0.39 -0.30 0.00 -0.27 0.00 0.00 62.75 61.79 2nvl n ILE 5 Cb 0.00 -1.36 0.25 0.00 -1.74 0.00 0.00 39.64 36.79 2nvl n ILE 5 CO 0.00 0.00 0.00 -2.84 -1.76 0.00 0.00 176.55 171.95 2nvl s PRO 6 N -3.61 -1.53 0.07 6.28 0.02 -1.26 -4.95 135.00 130.03 2nvl s PRO 6 Ca 0.79 0.10 0.08 0.00 0.02 0.00 0.00 61.00 61.99 2nvl s PRO 6 Cb -0.35 -1.55 -0.03 0.00 0.02 0.00 0.00 34.50 32.60 2nvl s PRO 6 CO 0.45 -3.95 -0.22 -0.51 -0.33 0.00 0.00 177.00 172.44 2nvl s LEU 7 N -7.17 2.23 0.11 -5.54 1.43 -1.26 -5.09 118.68 103.40 2nvl s LEU 7 Ca 0.70 -0.61 -0.35 0.00 -1.03 0.00 0.00 54.13 52.84 2nvl s LEU 7 Cb -0.13 -0.98 -0.15 0.00 0.03 0.00 0.00 46.19 44.97 2nvl s LEU 7 CO 0.57 0.13 1.54 -0.38 0.23 0.00 0.00 176.35 178.44 2nvl n ILE 8 N 1.48 0.05 0.00 -0.59 5.41 -1.26 -1.45 119.36 123.00 2nvl n ILE 8 Ca -0.18 -0.01 0.00 0.00 1.00 0.00 0.00 62.75 63.56 2nvl n ILE 8 Cb 0.53 -1.35 0.00 0.00 -0.71 0.00 0.00 39.64 38.11 2nvl n ILE 8 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2nvl n GLY 9 N 3.25 2.38 3.84 7.39 0.00 -0.47 -5.04 105.19 116.54 2nvl n GLY 9 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2nvl n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nvl s GLU 10 N -0.96 4.09 0.44 1.61 2.02 -0.53 -4.83 118.70 120.55 2nvl s GLU 10 Ca 0.00 0.70 -0.25 0.00 0.02 0.00 0.00 54.97 55.44 2nvl s GLU 10 Cb 0.00 -2.71 -0.08 0.00 0.10 0.00 0.00 34.13 31.43 2nvl s GLU 10 CO 0.00 0.32 1.39 0.50 0.02 0.00 0.00 175.26 177.49 2nvl s ARG 11 N -2.39 3.74 0.36 1.61 3.52 -1.26 -2.04 118.95 122.49 2nvl s ARG 11 Ca 0.46 2.34 -0.28 0.00 -0.13 0.00 0.00 55.73 58.12 2nvl s ARG 11 Cb -0.14 -2.66 -0.10 0.00 -1.56 0.00 0.00 34.95 30.49 2nvl s ARG 11 CO 0.19 -0.75 1.38 0.12 -0.81 0.00 0.00 175.30 175.44 2nvl s PHE 12 N -1.23 2.81 0.19 5.12 5.36 0.21 -4.80 117.98 125.65 2nvl s PHE 12 Ca 0.60 1.31 -0.31 0.00 -0.96 0.00 0.00 56.93 57.57 2nvl s PHE 12 Cb -0.42 -3.83 -0.10 0.00 -0.34 0.00 0.00 43.02 38.33 2nvl s PHE 12 CO 0.54 -2.39 1.55 -2.14 -1.46 0.00 0.00 175.22 171.32 2nvl s PRO 13 N -2.00 4.21 -0.14 10.12 0.02 -1.26 -4.50 135.00 141.46 2nvl s PRO 13 Ca 0.52 2.38 -0.36 0.00 0.02 0.00 0.00 61.00 63.56 2nvl s PRO 13 Cb -0.42 -3.13 -0.13 0.00 0.02 0.00 0.00 34.50 30.84 2nvl s PRO 13 CO 0.57 -0.58 1.85 -1.91 -0.33 0.00 0.00 177.00 176.60 2nvl n GLU 14 N 3.49 1.90 -3.59 5.54 4.07 -1.26 -4.28 120.64 126.51 2nvl n GLU 14 Ca 0.12 0.70 -0.13 0.00 -0.06 0.00 0.00 57.16 57.79 2nvl n GLU 14 Cb 0.39 -2.50 -0.06 0.00 -0.06 0.00 0.00 31.44 29.20 2nvl n GLU 14 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2nvl s MET 15 N 3.94 0.76 -0.17 5.31 0.23 -0.59 -5.01 119.30 123.77 2nvl s MET 15 Ca 0.94 0.53 -0.15 0.00 -1.03 0.00 0.00 55.69 55.99 2nvl s MET 15 Cb -0.80 0.36 -0.04 0.00 -1.53 0.00 0.00 34.83 32.82 2nvl s MET 15 CO 0.56 -0.17 0.33 -1.21 -2.03 0.00 0.00 175.02 172.50 2nvl s GLU 16 N -0.36 4.24 0.17 3.16 0.41 -1.26 -0.08 118.70 124.97 2nvl s GLU 16 Ca -0.02 0.14 0.10 0.00 -0.41 0.00 0.00 54.97 54.77 2nvl s GLU 16 Cb -0.03 -3.46 -0.04 0.00 -1.78 0.00 0.00 34.13 28.82 2nvl s GLU 16 CO 0.02 0.16 -0.22 0.14 -0.49 0.00 0.00 175.26 174.86 2nvl s VAL 17 N 0.70 2.09 -0.21 2.63 -7.23 0.13 -4.99 120.40 113.52 2nvl s VAL 17 Ca 0.18 -1.90 -0.10 0.00 -1.81 0.00 0.00 61.98 58.35 2nvl s VAL 17 Cb -0.14 -1.95 -0.05 0.00 0.56 0.00 0.00 36.38 34.81 2nvl s VAL 17 CO 0.05 -0.15 0.13 -0.89 -0.31 0.00 0.00 175.10 173.93 2nvl s THR 18 N -1.65 5.26 0.30 5.32 2.01 -1.26 -1.05 115.64 124.57 2nvl s THR 18 Ca 0.17 0.14 0.05 0.00 0.31 0.00 0.00 61.69 62.35 2nvl s THR 18 Cb -0.08 -3.42 -0.06 0.00 0.01 0.00 0.00 72.50 68.95 2nvl s THR 18 CO 0.08 0.40 0.02 0.42 -0.69 0.00 0.00 174.62 174.85 2nvl s THR 19 N 0.66 1.31 -2.00 -0.82 -4.23 0.93 -0.57 115.64 110.92 2nvl s THR 19 Ca 0.07 -2.03 0.15 0.00 -1.18 0.00 0.00 61.69 58.69 2nvl s THR 19 Cb -0.12 -2.66 0.42 0.00 1.34 0.00 0.00 72.50 71.47 2nvl s THR 19 CO 0.01 -0.11 1.32 -0.90 -0.54 0.00 0.00 174.62 174.40 2nvl n ASP 20 N -0.64 0.00 -0.26 3.99 5.75 -0.89 -0.77 116.55 123.74 2nvl n ASP 20 Ca -0.03 -0.76 0.08 0.00 -0.01 0.00 0.00 54.79 54.06 2nvl n ASP 20 Cb 0.65 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.72 2nvl n ASP 20 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2nvl n HIS 21 N -0.88 0.00 0.00 2.11 8.25 -1.26 -4.99 115.22 118.45 2nvl n HIS 21 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2nvl n HIS 21 Cb 0.05 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.16 2nvl n HIS 21 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2nvl n GLY 22 N 1.22 0.68 3.75 -1.41 0.00 0.05 -5.05 105.19 104.42 2nvl n GLY 22 Ca 0.06 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.59 2nvl n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nvl s VAL 23 N -1.24 4.79 0.12 1.61 1.01 -1.26 -0.05 120.40 125.38 2nvl s VAL 23 Ca 0.00 1.52 -0.04 0.00 0.00 0.00 0.00 61.98 63.46 2nvl s VAL 23 Cb 0.00 -4.06 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 2nvl s VAL 23 CO 0.00 0.37 0.11 0.27 0.00 0.00 0.00 175.10 175.85 2nvl s ILE 24 N -0.05 0.12 -0.18 2.22 -4.36 -0.21 -4.95 121.20 113.78 2nvl s ILE 24 Ca 0.36 -1.68 -0.03 0.00 -0.26 0.00 0.00 60.65 59.05 2nvl s ILE 24 Cb -0.20 -1.81 -0.01 0.00 1.25 0.00 0.00 42.46 41.69 2nvl s ILE 24 CO 0.21 -0.55 -0.07 -0.75 0.24 0.00 0.00 174.94 174.02 2nvl s LYS 25 N -3.98 3.45 0.01 0.37 2.47 -1.26 -0.69 119.74 120.11 2nvl s LYS 25 Ca 0.17 -0.62 0.02 0.00 -1.56 0.00 0.00 55.97 53.98 2nvl s LYS 25 Cb 0.06 -2.88 -0.04 0.00 -1.46 0.00 0.00 37.83 33.52 2nvl s LYS 25 CO -0.03 0.02 0.00 -0.51 0.16 0.00 0.00 175.35 175.00 2nvl s LEU 26 N 0.89 3.52 0.00 5.43 1.43 0.89 -0.61 118.68 130.23 2nvl s LEU 26 Ca -0.01 -0.03 0.19 0.00 -1.03 0.00 0.00 54.13 53.25 2nvl s LEU 26 Cb -0.15 -2.06 1.05 0.00 0.03 0.00 0.00 46.19 45.07 2nvl s LEU 26 CO 0.01 0.26 1.69 -0.81 0.23 0.00 0.00 176.35 177.73 2nvl n PRO 27 N 1.25 1.11 -0.28 1.29 -0.04 -1.26 -1.54 135.00 135.52 2nvl n PRO 27 Ca -0.14 -0.16 -0.00 0.00 -0.04 0.00 0.00 63.50 63.16 2nvl n PRO 27 Cb 0.53 -1.30 0.12 0.00 -0.04 0.00 0.00 33.50 32.80 2nvl n PRO 27 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2nvl h ASP 28 N 0.33 0.76 -1.04 3.54 5.19 -1.89 -2.02 116.42 121.30 2nvl h ASP 28 Ca 0.00 0.02 0.29 0.00 -0.62 0.00 0.00 57.03 56.72 2nvl h ASP 28 Cb 0.07 -0.14 -0.05 0.00 0.18 0.00 0.00 39.33 39.39 2nvl h ASP 28 CO 0.00 0.49 0.73 -0.74 -3.12 0.00 0.00 179.24 176.60 2nvl h HIS 29 N 0.90 0.15 0.00 4.55 2.76 -1.22 -0.21 115.15 122.09 2nvl h HIS 29 Ca 0.34 0.01 -0.38 0.00 -2.20 0.00 0.00 60.37 58.14 2nvl h HIS 29 Cb 0.15 -0.04 -0.07 0.00 1.55 0.00 0.00 27.41 29.00 2nvl h HIS 29 CO -0.04 0.02 -2.44 0.66 -1.30 0.00 0.00 177.93 174.83 2nvl n TYR 30 N -4.31 0.06 -0.18 5.26 4.02 -0.87 -4.06 117.16 117.08 2nvl n TYR 30 Ca 0.23 0.01 -0.02 0.00 -0.01 0.00 0.00 57.90 58.11 2nvl n TYR 30 Cb 1.05 -1.01 0.07 0.00 -0.02 0.00 0.00 39.34 39.43 2nvl n TYR 30 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2nvl h VAL 31 N 0.00 0.86 -0.68 -0.72 2.07 -0.87 -0.77 116.25 116.14 2nvl h VAL 31 Ca -0.56 -0.15 0.16 0.00 0.82 0.00 0.00 66.70 66.96 2nvl h VAL 31 Cb 1.98 0.39 -0.04 0.00 -1.52 0.00 0.00 31.29 32.10 2nvl h VAL 31 CO -0.06 0.08 0.47 0.28 0.02 0.00 0.00 177.57 178.36 2nvl h SER 32 N 0.44 0.23 -0.25 0.57 0.02 -1.23 -0.29 113.55 113.03 2nvl h SER 32 Ca 0.26 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2nvl h SER 32 Cb 0.25 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.76 2nvl h SER 32 CO -0.23 0.12 0.00 0.00 -1.14 0.00 0.00 176.83 175.58 2nvl n GLN 33 N -4.43 2.13 -2.20 3.45 6.02 -0.64 -4.95 117.38 116.75 2nvl n GLN 33 Ca 0.13 -1.70 -0.16 0.00 -0.01 0.00 0.00 57.00 55.26 2nvl n GLN 33 Cb 0.58 -1.46 -0.02 0.00 1.02 0.00 0.00 30.24 30.37 2nvl n GLN 33 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nvl n GLY 34 N 1.32 -0.04 3.60 1.08 0.00 -0.12 -5.01 105.19 106.01 2nvl n GLY 34 Ca 0.17 -0.21 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 2nvl n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nvl s LYS 35 N -4.62 2.57 0.63 1.61 -0.14 -0.39 -4.84 119.74 114.56 2nvl s LYS 35 Ca 0.00 -0.71 -0.11 0.00 -1.36 0.00 0.00 55.97 53.79 2nvl s LYS 35 Cb 0.00 -2.51 -0.04 0.00 -1.68 0.00 0.00 37.83 33.60 2nvl s LYS 35 CO 0.00 0.61 1.03 -1.58 -0.76 0.00 0.00 175.35 174.65 2nvl s TRP 36 N -0.99 3.55 -0.01 3.18 0.52 -0.95 -3.94 118.94 120.31 2nvl s TRP 36 Ca 0.17 1.31 -0.04 0.00 0.02 0.00 0.00 56.10 57.56 2nvl s TRP 36 Cb -0.11 -2.74 -0.00 0.00 -1.15 0.00 0.00 33.47 29.46 2nvl s TRP 36 CO 0.07 -0.75 0.09 -0.59 0.02 0.00 0.00 176.95 175.79 2nvl s PHE 37 N -3.14 0.03 -0.26 -1.98 -0.12 -0.39 -0.86 117.98 111.27 2nvl s PHE 37 Ca 0.56 -0.07 -0.05 0.00 -0.05 0.00 0.00 56.93 57.32 2nvl s PHE 37 Cb -0.11 -0.05 0.00 0.00 -0.63 0.00 0.00 43.02 42.23 2nvl s PHE 37 CO 0.53 -0.19 0.01 0.08 -0.05 0.00 0.00 175.22 175.60 2nvl s VAL 38 N -0.90 3.54 -0.27 -2.49 1.01 0.04 -0.98 120.40 120.35 2nvl s VAL 38 Ca -0.10 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.11 2nvl s VAL 38 Cb -0.06 -2.74 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 2nvl s VAL 38 CO 0.01 0.24 0.20 -0.22 0.00 0.00 0.00 175.10 175.33 2nvl s LEU 39 N 1.46 4.04 -0.05 3.92 0.20 -0.18 -1.09 118.68 126.98 2nvl s LEU 39 Ca 0.03 0.04 0.05 0.00 0.69 0.00 0.00 54.13 54.95 2nvl s LEU 39 Cb -0.16 -2.14 -0.01 0.00 -0.43 0.00 0.00 46.19 43.45 2nvl s LEU 39 CO -0.01 -0.04 -0.21 0.72 -0.29 0.00 0.00 176.35 176.52 2nvl s PHE 40 N 1.63 2.09 0.27 5.38 -0.12 -0.86 -0.35 117.98 126.02 2nvl s PHE 40 Ca 0.08 -0.63 0.09 0.00 -0.05 0.00 0.00 56.93 56.41 2nvl s PHE 40 Cb -0.15 -1.39 -0.04 0.00 -0.63 0.00 0.00 43.02 40.80 2nvl s PHE 40 CO 0.10 -0.21 0.07 -1.54 -0.05 0.00 0.00 175.22 173.58 2nvl s SER 41 N -0.02 4.85 -0.03 1.98 1.04 0.13 -1.86 113.70 119.80 2nvl s SER 41 Ca -0.05 -0.54 -0.01 0.00 0.48 0.00 0.00 55.95 55.83 2nvl s SER 41 Cb -0.13 -1.00 0.02 0.00 0.10 0.00 0.00 66.02 65.01 2nvl s SER 41 CO 0.03 -0.03 0.06 -1.00 0.98 0.00 0.00 173.24 173.29 2nvl s HIS 42 N -2.27 -0.05 0.17 5.02 3.76 0.10 -4.16 115.29 117.85 2nvl s HIS 42 Ca 0.32 0.21 -0.15 0.00 -0.15 0.00 0.00 55.06 55.30 2nvl s HIS 42 Cb -0.07 -0.09 0.09 0.00 1.11 0.00 0.00 32.58 33.62 2nvl s HIS 42 CO 0.22 -0.08 1.78 -1.35 -0.85 0.00 0.00 174.74 174.46 2nvl h PRO 43 N 6.74 0.44 -2.70 8.40 0.11 -1.80 -3.30 132.00 139.88 2nvl h PRO 43 Ca -0.36 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.74 2nvl h PRO 43 Cb 1.16 -0.10 -0.14 0.00 0.11 0.00 0.00 31.00 32.04 2nvl h PRO 43 CO 0.47 0.29 0.28 0.00 -0.21 0.00 0.00 178.00 178.83 2nvl s ALA 44 N -6.14 -1.68 0.74 -0.75 0.00 -1.26 -4.03 121.76 108.63 2nvl s ALA 44 Ca -0.13 0.72 -0.11 0.00 0.00 0.00 0.00 51.96 52.44 2nvl s ALA 44 Cb 0.13 0.66 0.03 0.00 0.00 0.00 0.00 23.12 23.93 2nvl s ALA 44 CO 0.73 -0.70 1.08 -0.51 0.00 0.00 0.00 175.76 176.35 2nvl s ASP 45 N -2.50 4.94 -1.43 0.00 1.11 -1.26 -3.86 116.67 113.66 2nvl s ASP 45 Ca 0.01 1.71 -0.09 0.00 0.18 0.00 0.00 52.55 54.35 2nvl s ASP 45 Cb -0.01 -2.50 0.05 0.00 1.07 0.00 0.00 42.92 41.53 2nvl s ASP 45 CO -0.10 -1.74 1.00 0.49 1.18 0.00 0.00 175.17 176.01 2nvl n PHE 46 N -3.33 -2.41 -4.93 4.23 3.01 -1.26 -5.00 117.46 107.77 2nvl n PHE 46 Ca 0.08 0.93 -0.32 0.00 1.01 0.00 0.00 57.45 59.16 2nvl n PHE 46 Cb 0.53 -4.43 -0.14 0.00 -0.01 0.00 0.00 39.48 35.44 2nvl n PHE 46 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 2nvl s THR 47 N -3.37 2.77 0.03 4.37 -4.23 -1.25 -5.09 115.64 108.87 2nvl s THR 47 Ca 0.50 -0.92 -0.29 0.00 -1.18 0.00 0.00 61.69 59.79 2nvl s THR 47 Cb -0.24 -2.08 -0.17 0.00 1.34 0.00 0.00 72.50 71.35 2nvl s THR 47 CO 0.79 0.53 1.29 1.55 -0.54 0.00 0.00 174.62 178.24 2nvl h PRO 48 N 5.17 -0.87 0.00 3.99 0.13 -1.94 -2.02 132.00 136.46 2nvl h PRO 48 Ca -0.46 0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2nvl h PRO 48 Cb 1.15 0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2nvl h PRO 48 CO 0.49 -0.55 0.00 0.28 -0.23 0.00 0.00 178.00 177.99 2nvl n VAL 49 N -5.41 0.00 0.00 1.56 0.31 -1.26 -1.74 118.33 111.79 2nvl n VAL 49 Ca -0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 2nvl n VAL 49 Cb 0.38 -0.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.28 2nvl n VAL 49 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2nvl n THR 51 N 0.22 0.00 -0.18 2.52 -1.04 -0.76 -1.59 114.28 113.45 2nvl n THR 51 Ca 0.00 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.08 2nvl n THR 51 Cb 0.00 0.00 0.36 0.00 -1.82 0.00 0.00 70.33 68.87 2nvl n THR 51 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 2nvl h THR 52 N 0.00 1.01 -0.37 12.58 1.35 -1.63 -1.68 112.91 124.17 2nvl h THR 52 Ca 0.00 -0.25 -0.16 0.00 -0.55 0.00 0.00 66.41 65.45 2nvl h THR 52 Cb 0.00 0.21 -0.01 0.00 -1.73 0.00 0.00 68.15 66.62 2nvl h THR 52 CO 0.00 0.13 -0.40 -0.33 -0.25 0.00 0.00 175.52 174.67 2nvl h GLU 53 N 0.73 0.90 -0.01 4.72 5.08 -1.57 -1.15 114.58 123.29 2nvl h GLU 53 Ca 0.31 -0.48 0.02 0.00 -1.00 0.00 0.00 59.36 58.21 2nvl h GLU 53 Cb 0.29 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2nvl h GLU 53 CO -0.11 1.13 -0.11 0.74 -1.00 0.00 0.00 179.01 179.67 2nvl h PHE 54 N 0.73 -0.27 -0.66 4.33 -1.00 -1.70 -1.49 116.94 116.89 2nvl h PHE 54 Ca 0.06 0.01 0.05 0.00 2.81 0.00 0.00 57.97 60.89 2nvl h PHE 54 Cb 0.99 0.12 -0.05 0.00 3.61 0.00 0.00 35.95 40.63 2nvl h PHE 54 CO 0.06 -0.16 0.38 0.28 -1.61 0.00 0.00 178.31 177.26 2nvl h VAL 55 N -0.18 1.01 -0.62 -0.55 2.07 -1.28 0.30 116.25 116.99 2nvl h VAL 55 Ca 0.04 -0.25 -0.06 0.00 0.82 0.00 0.00 66.70 67.26 2nvl h VAL 55 Cb 0.23 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 2nvl h VAL 55 CO -0.12 0.13 0.15 -1.28 0.02 0.00 0.00 177.57 176.48 2nvl h SER 56 N 0.72 0.94 -0.41 0.57 0.87 -0.92 0.24 113.55 115.56 2nvl h SER 56 Ca 0.28 -0.23 -0.06 0.00 -1.23 0.00 0.00 61.79 60.56 2nvl h SER 56 Cb 0.13 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 2nvl h SER 56 CO -0.15 0.93 0.04 -0.26 -0.53 0.00 0.00 176.83 176.85 2nvl h PHE 57 N 0.91 0.75 -0.94 2.24 -1.00 -1.18 -3.10 116.94 114.62 2nvl h PHE 57 Ca 0.20 -0.11 0.05 0.00 2.81 0.00 0.00 57.97 60.91 2nvl h PHE 57 Cb 0.35 -0.20 -0.06 0.00 3.61 0.00 0.00 35.95 39.65 2nvl h PHE 57 CO 0.03 0.74 0.61 0.00 -1.61 0.00 0.00 178.31 178.07 2nvl h ALA 58 N 0.91 1.28 0.00 2.45 0.00 0.29 -2.22 119.26 121.97 2nvl h ALA 58 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2nvl h ALA 58 Cb 0.42 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2nvl h ALA 58 CO 0.01 0.43 0.00 -0.09 0.00 0.00 0.00 179.25 179.61 2nvl h ARG 59 N 1.14 0.00 -0.03 0.00 9.65 -0.90 -2.75 114.38 121.48 2nvl h ARG 59 Ca 0.39 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.27 2nvl h ARG 59 Cb 0.08 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 2nvl h ARG 59 CO -0.15 0.00 0.00 0.54 2.80 0.00 0.00 179.97 183.16 2nvl n ARG 60 N -2.60 2.13 -0.17 0.20 1.74 -0.86 -4.75 116.66 112.36 2nvl n ARG 60 Ca 0.01 -2.14 -0.02 0.00 -0.77 0.00 0.00 57.85 54.92 2nvl n ARG 60 Cb 0.22 -1.31 0.06 0.00 -1.02 0.00 0.00 32.46 30.41 2nvl n ARG 60 CO 0.00 0.00 0.00 -0.92 -1.52 0.00 0.00 177.63 175.19 2nvl h TYR 61 N 0.20 -0.07 -0.72 -1.55 3.20 -1.17 -1.74 116.97 115.13 2nvl h TYR 61 Ca 0.00 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 2nvl h TYR 61 Cb 0.82 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 39.17 2nvl h TYR 61 CO 0.04 -0.14 0.29 0.93 -1.64 0.00 0.00 178.16 177.65 2nvl h GLU 62 N 0.10 1.08 -0.78 1.82 3.07 -1.85 -0.39 114.58 117.62 2nvl h GLU 62 Ca 0.26 -0.19 0.07 0.00 -0.50 0.00 0.00 59.36 59.00 2nvl h GLU 62 Cb 0.40 -0.18 -0.06 0.00 -0.84 0.00 0.00 28.75 28.07 2nvl h GLU 62 CO -0.45 0.88 0.45 -0.44 -1.40 0.00 0.00 179.01 178.06 2nvl h ASP 63 N 1.03 0.68 -0.15 1.42 3.32 -1.79 0.32 116.42 121.25 2nvl h ASP 63 Ca 0.24 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.31 2nvl h ASP 63 Cb 0.20 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2nvl h ASP 63 CO -0.02 0.42 0.05 -0.26 -1.72 0.00 0.00 179.24 177.70 2nvl h PHE 64 N 0.80 0.25 -0.81 4.55 -1.00 -0.91 -2.91 116.94 116.91 2nvl h PHE 64 Ca 0.36 -0.03 0.08 0.00 2.81 0.00 0.00 57.97 61.19 2nvl h PHE 64 Cb 0.25 -0.07 -0.07 0.00 3.61 0.00 0.00 35.95 39.67 2nvl h PHE 64 CO -0.06 0.36 0.47 1.96 -1.61 0.00 0.00 178.31 179.43 2nvl h GLN 65 N 0.06 0.79 -0.63 1.51 1.08 -0.36 -1.05 115.11 116.52 2nvl h GLN 65 Ca 0.05 -0.05 0.10 0.00 -1.45 0.00 0.00 58.65 57.30 2nvl h GLN 65 Cb 0.23 -0.18 -0.04 0.00 -0.05 0.00 0.00 27.48 27.44 2nvl h GLN 65 CO -0.00 0.52 0.42 -0.09 -0.95 0.00 0.00 178.83 178.73 2nvl h ARG 66 N 0.82 0.43 -0.02 1.46 9.65 -0.29 -0.47 114.38 125.96 2nvl h ARG 66 Ca 0.38 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.23 2nvl h ARG 66 Cb 0.29 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 28.77 2nvl h ARG 66 CO -0.22 0.29 -0.08 1.28 2.80 0.00 0.00 179.97 184.04 2nvl n LEU 67 N -4.47 1.60 -1.49 3.80 4.77 -0.68 -4.95 117.00 115.58 2nvl n LEU 67 Ca 0.10 -0.52 -0.06 0.00 -0.03 0.00 0.00 56.01 55.51 2nvl n LEU 67 Cb 0.37 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.46 2nvl n LEU 67 CO 0.34 0.27 0.05 0.61 -1.33 0.00 0.00 177.39 177.33 2nvl n GLY 68 N 1.24 0.40 3.05 -0.72 0.00 -0.18 -4.91 105.19 104.07 2nvl n GLY 68 Ca 0.16 -0.38 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 2nvl n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nvl s VAL 69 N -3.09 1.51 0.18 1.61 1.01 -0.67 -2.24 120.40 118.71 2nvl s VAL 69 Ca 0.09 -0.64 -0.04 0.00 0.00 0.00 0.00 61.98 61.40 2nvl s VAL 69 Cb -0.04 -1.39 -0.05 0.00 0.00 0.00 0.00 36.38 34.90 2nvl s VAL 69 CO 0.20 0.44 0.41 -1.81 0.00 0.00 0.00 175.10 174.34 2nvl s ASP 70 N 1.10 6.45 -0.11 3.32 1.01 -0.04 -3.91 116.67 124.49 2nvl s ASP 70 Ca -0.04 0.55 -0.01 0.00 0.71 0.00 0.00 52.55 53.76 2nvl s ASP 70 Cb -0.14 -2.07 -0.03 0.00 1.01 0.00 0.00 42.92 41.69 2nvl s ASP 70 CO -0.04 -0.01 -0.07 -0.76 0.21 0.00 0.00 175.17 174.50 2nvl s LEU 71 N -2.99 3.10 -0.02 1.23 1.43 -1.26 -0.78 118.68 119.38 2nvl s LEU 71 Ca 0.41 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.38 2nvl s LEU 71 Cb -0.12 -1.71 0.03 0.00 0.03 0.00 0.00 46.19 44.42 2nvl s LEU 71 CO 0.27 0.25 0.02 -0.51 0.23 0.00 0.00 176.35 176.60 2nvl s ILE 72 N -0.11 0.04 0.69 -0.59 2.07 -0.25 -4.22 121.20 118.83 2nvl s ILE 72 Ca 0.01 0.16 -0.01 0.00 -1.41 0.00 0.00 60.65 59.40 2nvl s ILE 72 Cb -0.13 -0.16 0.10 0.00 0.13 0.00 0.00 42.46 42.40 2nvl s ILE 72 CO 0.03 0.11 0.95 -0.83 -1.91 0.00 0.00 174.94 173.29 2nvl s GLY 73 N 1.05 1.77 -0.22 1.50 0.00 -0.60 -2.04 107.32 108.79 2nvl s GLY 73 Ca -0.09 -1.58 -0.10 0.00 0.00 0.00 0.00 44.72 42.95 2nvl s GLY 73 CO -0.02 -1.08 0.50 -2.27 0.00 0.00 0.00 173.10 170.23 2nvl s LEU 74 N -5.08 -0.55 -0.00 0.66 1.98 -0.78 -0.17 118.68 114.75 2nvl s LEU 74 Ca 0.64 1.13 -0.04 0.00 -2.89 0.00 0.00 54.13 52.97 2nvl s LEU 74 Cb -0.07 1.68 -0.00 0.00 0.66 0.00 0.00 46.19 48.46 2nvl s LEU 74 CO 0.43 -0.22 0.07 -0.55 -1.89 0.00 0.00 176.35 174.20 2nvl s SER 75 N 1.95 0.05 -1.28 3.68 0.15 -1.01 0.02 113.70 117.26 2nvl s SER 75 Ca -0.07 -0.16 -0.19 0.00 0.70 0.00 0.00 55.95 56.23 2nvl s SER 75 Cb -0.09 0.17 0.04 0.00 -1.71 0.00 0.00 66.02 64.43 2nvl s SER 75 CO -0.15 -0.24 1.78 0.52 1.20 0.00 0.00 173.24 176.35 2nvl n VAL 76 N 2.01 3.60 -3.53 4.45 0.31 -1.24 -2.38 118.33 121.56 2nvl n VAL 76 Ca -0.20 -3.74 -0.09 0.00 -0.01 0.00 0.00 64.34 60.31 2nvl n VAL 76 Cb 0.57 -2.33 -0.03 0.00 -0.91 0.00 0.00 33.84 31.14 2nvl n VAL 76 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2nvl s ASP 77 N 4.56 -0.36 0.90 4.52 -0.00 -1.26 -4.79 116.67 120.24 2nvl s ASP 77 Ca 0.56 0.13 -0.12 0.00 -0.00 0.00 0.00 52.55 53.12 2nvl s ASP 77 Cb 0.04 0.35 0.13 0.00 -0.00 0.00 0.00 42.92 43.43 2nvl s ASP 77 CO 0.09 -0.51 1.11 -0.94 -0.00 0.00 0.00 175.17 174.91 2nvl s SER 78 N -2.05 3.58 0.40 0.27 1.04 -1.26 -3.49 113.70 112.19 2nvl s SER 78 Ca 0.03 1.17 0.10 0.00 0.48 0.00 0.00 55.95 57.74 2nvl s SER 78 Cb -0.01 -1.83 0.82 0.00 0.10 0.00 0.00 66.02 65.10 2nvl s SER 78 CO -0.05 -2.53 1.93 1.62 0.98 0.00 0.00 173.24 175.19 2nvl h VAL 79 N -1.48 1.17 -0.50 5.02 3.04 -1.95 -1.79 116.25 119.76 2nvl h VAL 79 Ca -0.50 -0.74 -0.07 0.00 -1.01 0.00 0.00 66.70 64.37 2nvl h VAL 79 Cb 1.31 1.21 -0.02 0.00 -2.01 0.00 0.00 31.29 31.78 2nvl h VAL 79 CO 0.59 0.23 0.03 -0.26 -1.01 0.00 0.00 177.57 177.15 2nvl h PHE 80 N 0.20 0.94 -0.29 3.17 -1.00 -1.99 -1.02 116.94 116.95 2nvl h PHE 80 Ca 0.04 -0.15 -0.05 0.00 2.81 0.00 0.00 57.97 60.62 2nvl h PHE 80 Cb 0.35 -0.25 -0.01 0.00 3.61 0.00 0.00 35.95 39.66 2nvl h PHE 80 CO 0.00 0.87 -0.01 0.77 -1.61 0.00 0.00 178.31 178.34 2nvl h SER 81 N 0.74 0.51 -0.47 2.17 0.02 -1.87 -2.20 113.55 112.45 2nvl h SER 81 Ca 0.15 -0.31 0.09 0.00 -0.84 0.00 0.00 61.79 60.87 2nvl h SER 81 Cb 0.48 -0.14 -0.10 0.00 0.14 0.00 0.00 62.40 62.79 2nvl h SER 81 CO 0.02 0.70 -0.32 0.45 -1.14 0.00 0.00 176.83 176.54 2nvl h HIS 82 N 0.30 -0.87 -0.79 3.45 3.86 -1.08 -0.12 115.15 119.91 2nvl h HIS 82 Ca 0.08 0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.33 2nvl h HIS 82 Cb 0.44 0.45 -0.04 0.00 1.06 0.00 0.00 27.41 29.33 2nvl h HIS 82 CO 0.04 -0.37 0.40 0.82 0.86 0.00 0.00 177.93 179.67 2nvl h ILE 83 N -0.21 1.24 -0.21 2.45 2.04 -1.18 -1.78 117.51 119.87 2nvl h ILE 83 Ca 0.20 -0.65 -0.10 0.00 1.00 0.00 0.00 64.86 65.31 2nvl h ILE 83 Cb 0.53 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 2nvl h ILE 83 CO -0.58 0.28 -0.30 0.11 0.00 0.00 0.00 178.15 177.66 2nvl h LYS 84 N 1.11 0.41 -0.02 2.37 1.79 -0.94 -2.05 116.57 119.24 2nvl h LYS 84 Ca 0.27 -0.16 -0.01 0.00 -2.18 0.00 0.00 60.65 58.57 2nvl h LYS 84 Cb 0.08 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2nvl h LYS 84 CO -0.04 0.67 -0.03 2.35 -1.08 0.00 0.00 179.45 181.31 2nvl h TRP 85 N 0.35 0.07 -0.85 -1.35 7.01 -0.76 -0.72 115.95 119.69 2nvl h TRP 85 Ca 0.05 -0.02 0.05 0.00 2.11 0.00 0.00 58.89 61.07 2nvl h TRP 85 Cb 0.71 -0.01 -0.06 0.00 -2.10 0.00 0.00 29.16 27.70 2nvl h TRP 85 CO 0.02 0.61 0.53 0.87 -2.79 0.00 0.00 178.44 177.68 2nvl h LYS 86 N -0.49 0.97 -0.64 2.65 1.57 -1.34 -1.18 116.57 118.11 2nvl h LYS 86 Ca 0.00 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2nvl h LYS 86 Cb 0.60 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.66 2nvl h LYS 86 CO 0.01 0.64 0.41 1.49 -0.57 0.00 0.00 179.45 181.43 2nvl h GLU 87 N 1.00 0.80 -0.56 3.15 4.81 -1.34 -1.48 114.58 120.95 2nvl h GLU 87 Ca 0.36 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.52 2nvl h GLU 87 Cb 0.11 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 2nvl h GLU 87 CO -0.15 0.53 0.28 2.35 -0.73 0.00 0.00 179.01 181.29 2nvl h TRP 88 N 0.82 0.79 -0.34 0.92 7.01 -0.49 -1.93 115.95 122.74 2nvl h TRP 88 Ca 0.24 -0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.19 2nvl h TRP 88 Cb -0.04 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 26.75 2nvl h TRP 88 CO -0.04 0.60 0.13 0.82 -2.79 0.00 0.00 178.44 177.16 2nvl h ILE 89 N 0.75 1.19 -0.40 2.65 2.04 -1.03 0.27 117.51 122.98 2nvl h ILE 89 Ca 0.19 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 2nvl h ILE 89 Cb 0.10 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 2nvl h ILE 89 CO -0.03 0.20 0.16 -0.08 0.00 0.00 0.00 178.15 178.41 2nvl h GLU 90 N 0.39 0.56 0.13 2.37 4.81 -1.18 -1.19 114.58 120.48 2nvl h GLU 90 Ca 0.11 -0.07 -0.18 0.00 -0.13 0.00 0.00 59.36 59.09 2nvl h GLU 90 Cb 0.19 -0.11 0.02 0.00 0.63 0.00 0.00 28.75 29.49 2nvl h GLU 90 CO -0.01 0.46 -0.79 -0.09 -0.73 0.00 0.00 179.01 177.85 2nvl h ARG 91 N 0.56 0.30 0.00 1.92 2.43 -1.09 -2.65 114.38 115.85 2nvl h ARG 91 Ca 0.14 -0.50 -0.24 0.00 -0.81 0.00 0.00 59.98 58.57 2nvl h ARG 91 Cb 0.11 0.18 -0.04 0.00 -0.42 0.00 0.00 29.97 29.80 2nvl h ARG 91 CO -0.01 1.23 -1.87 0.72 -1.51 0.00 0.00 179.97 178.53 2nvl n HIS 92 N -4.14 0.55 -0.03 2.20 8.25 0.06 -4.43 115.22 117.68 2nvl n HIS 92 Ca -0.14 0.19 0.06 0.00 -0.26 0.00 0.00 57.72 57.58 2nvl n HIS 92 Cb 0.81 -1.01 -0.16 0.00 1.12 0.00 0.00 29.99 30.75 2nvl n HIS 92 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2nvl n ILE 93 N -2.80 0.28 -1.64 1.59 5.41 -0.47 -4.82 119.36 116.91 2nvl n ILE 93 Ca -0.18 -0.56 -0.03 0.00 1.00 0.00 0.00 62.75 62.98 2nvl n ILE 93 Cb 0.96 -0.09 -0.01 0.00 -0.71 0.00 0.00 39.64 39.80 2nvl n ILE 93 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2nvl n GLY 94 N 1.40 0.41 3.05 7.39 0.00 -1.00 -4.86 105.19 111.58 2nvl n GLY 94 Ca -0.10 -0.83 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 2nvl n GLY 94 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nvl s VAL 95 N -2.15 1.56 0.18 1.61 1.01 -1.24 -4.99 120.40 116.37 2nvl s VAL 95 Ca 0.00 -0.66 -0.20 0.00 0.00 0.00 0.00 61.98 61.11 2nvl s VAL 95 Cb 0.00 -1.43 -0.08 0.00 0.00 0.00 0.00 36.38 34.87 2nvl s VAL 95 CO 0.00 0.45 0.70 -0.60 0.00 0.00 0.00 175.10 175.65 2nvl s ARG 96 N 1.13 4.29 -0.47 2.72 3.52 -1.26 -3.05 118.95 125.84 2nvl s ARG 96 Ca -0.03 0.88 -0.15 0.00 -0.13 0.00 0.00 55.73 56.31 2nvl s ARG 96 Cb -0.14 -3.03 0.08 0.00 -1.56 0.00 0.00 34.95 30.29 2nvl s ARG 96 CO -0.04 0.49 0.39 0.42 -0.81 0.00 0.00 175.30 175.74 2nvl s ILE 97 N -1.36 5.12 -0.66 4.11 -1.09 -1.26 -4.94 121.20 121.12 2nvl s ILE 97 Ca 0.38 -1.12 0.25 0.00 -2.23 0.00 0.00 60.65 57.93 2nvl s ILE 97 Cb -0.19 -4.07 0.18 0.00 -1.58 0.00 0.00 42.46 36.80 2nvl s ILE 97 CO 0.22 -0.58 1.54 1.55 -1.23 0.00 0.00 174.94 176.43 2nvl h PRO 98 N 8.72 0.00 -6.32 2.79 0.13 -1.95 -3.47 132.00 131.89 2nvl h PRO 98 Ca -0.28 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.39 2nvl h PRO 98 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 2nvl h PRO 98 CO 0.87 0.00 -0.33 -0.59 -0.23 0.00 0.00 178.00 177.72 2nvl s PHE 99 N -3.15 3.42 0.50 1.56 -0.12 -1.26 -5.08 117.98 113.85 2nvl s PHE 99 Ca 0.08 0.08 -0.21 0.00 -0.05 0.00 0.00 56.93 56.83 2nvl s PHE 99 Cb 0.12 -1.74 -0.07 0.00 -0.63 0.00 0.00 43.02 40.70 2nvl s PHE 99 CO 0.66 0.27 1.12 -1.25 -0.05 0.00 0.00 175.22 175.97 2nvl s PRO 100 N -4.13 3.62 -0.19 1.99 0.04 -1.26 -4.90 135.00 130.17 2nvl s PRO 100 Ca 0.37 1.63 -0.01 0.00 0.04 0.00 0.00 61.00 63.04 2nvl s PRO 100 Cb -0.09 -2.20 0.01 0.00 0.04 0.00 0.00 34.50 32.26 2nvl s PRO 100 CO 0.32 -0.64 -0.14 0.42 0.04 0.00 0.00 177.00 177.00 2nvl s ILE 101 N -1.71 2.57 0.17 0.56 1.01 -1.26 -1.55 121.20 120.99 2nvl s ILE 101 Ca 0.68 -0.77 -0.32 0.00 0.00 0.00 0.00 60.65 60.24 2nvl s ILE 101 Cb -0.24 -2.11 -0.11 0.00 0.01 0.00 0.00 42.46 40.01 2nvl s ILE 101 CO 0.29 0.50 1.66 -0.63 0.00 0.00 0.00 174.94 176.76 2nvl s ILE 102 N 1.23 2.41 -0.37 2.92 1.01 0.76 -2.08 121.20 127.08 2nvl s ILE 102 Ca 0.03 0.24 -0.18 0.00 0.00 0.00 0.00 60.65 60.74 2nvl s ILE 102 Cb -0.14 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.18 2nvl s ILE 102 CO -0.07 0.02 0.48 0.00 0.00 0.00 0.00 174.94 175.37 2nvl s ALA 103 N 1.42 3.46 -0.44 9.38 0.00 0.26 -2.39 121.76 133.44 2nvl s ALA 103 Ca 0.73 -1.16 0.05 0.00 0.00 0.00 0.00 51.96 51.58 2nvl s ALA 103 Cb -0.46 -3.02 0.42 0.00 0.00 0.00 0.00 23.12 20.06 2nvl s ALA 103 CO 0.32 -1.32 1.13 -3.47 0.00 0.00 0.00 175.76 172.42 2nvl n ASP 104 N 5.70 4.77 -4.76 0.00 2.03 -1.00 -4.56 116.55 118.72 2nvl n ASP 104 Ca -0.06 -3.72 -0.38 0.00 0.52 0.00 0.00 54.79 51.15 2nvl n ASP 104 Cb 0.49 -0.47 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 2nvl n ASP 104 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2nvl s PRO 105 N -3.55 3.74 0.00 -0.67 0.04 -1.26 -0.56 135.00 132.75 2nvl s PRO 105 Ca 0.48 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.54 2nvl s PRO 105 Cb 0.40 -2.54 0.00 0.00 0.04 0.00 0.00 34.50 32.41 2nvl s PRO 105 CO -0.19 -0.64 0.00 1.04 0.04 0.00 0.00 177.00 177.25 2nvl n GLN 106 N -0.31 0.00 -2.19 4.56 1.13 -1.26 -4.43 117.38 114.88 2nvl n GLN 106 Ca 0.06 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.96 2nvl n GLN 106 Cb 0.46 -0.25 -0.02 0.00 0.11 0.00 0.00 30.24 30.54 2nvl n GLN 106 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2nvl n GLY 107 N -1.07 -0.02 0.11 1.08 0.00 0.28 -4.90 105.19 100.67 2nvl n GLY 107 Ca 0.00 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.70 2nvl n GLY 107 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2nvl h THR 108 N 0.00 1.09 -0.05 2.61 2.02 -1.77 -0.58 112.91 116.23 2nvl h THR 108 Ca -0.38 -0.24 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 2nvl h THR 108 Cb 1.25 0.91 -0.00 0.00 -1.74 0.00 0.00 68.15 68.57 2nvl h THR 108 CO 0.46 0.09 -0.04 0.58 0.37 0.00 0.00 175.52 176.97 2nvl h VAL 109 N 0.21 1.36 -0.71 3.16 2.07 -1.90 -2.13 116.25 118.31 2nvl h VAL 109 Ca 0.07 -1.15 0.15 0.00 0.82 0.00 0.00 66.70 66.59 2nvl h VAL 109 Cb 0.05 2.03 -0.11 0.00 -1.52 0.00 0.00 31.29 31.73 2nvl h VAL 109 CO -0.01 0.31 0.15 0.00 0.02 0.00 0.00 177.57 178.04 2nvl h ALA 110 N 0.56 0.89 0.13 1.67 0.00 -1.91 -0.90 119.26 119.71 2nvl h ALA 110 Ca 0.01 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 2nvl h ALA 110 Cb 0.53 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2nvl h ALA 110 CO 0.01 -0.34 -0.06 -0.09 0.00 0.00 0.00 179.25 178.76 2nvl h ARG 111 N 0.25 -0.17 -1.02 0.00 2.43 -0.97 0.42 114.38 115.31 2nvl h ARG 111 Ca 0.40 0.01 0.25 0.00 -0.81 0.00 0.00 59.98 59.83 2nvl h ARG 111 Cb 0.67 0.04 -0.11 0.00 -0.42 0.00 0.00 29.97 30.16 2nvl h ARG 111 CO -0.51 0.11 0.63 -0.09 -1.51 0.00 0.00 179.97 178.60 2nvl h ARG 112 N -0.46 0.49 -0.05 0.20 9.65 -0.97 -1.14 114.38 122.10 2nvl h ARG 112 Ca -0.02 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 2nvl h ARG 112 Cb 0.37 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.84 2nvl h ARG 112 CO 0.03 0.32 0.00 1.28 2.80 0.00 0.00 179.97 184.40 2nvl n LEU 113 N -4.74 1.50 -0.28 3.80 4.77 -0.38 -4.70 117.00 116.97 2nvl n LEU 113 Ca 0.26 -0.53 -0.04 0.00 -0.03 0.00 0.00 56.01 55.67 2nvl n LEU 113 Cb 0.79 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.85 2nvl n LEU 113 CO 0.22 0.27 -0.03 0.61 -1.33 0.00 0.00 177.39 177.12 2nvl n GLY 114 N 1.16 0.65 0.12 -0.72 0.00 -0.43 -4.10 105.19 101.86 2nvl n GLY 114 Ca 0.18 -0.44 0.08 0.00 0.00 0.00 0.00 46.02 45.84 2nvl n GLY 114 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2nvl n LEU 115 N -0.42 0.36 -4.38 0.99 4.77 0.14 -4.57 117.00 113.90 2nvl n LEU 115 Ca -0.04 -0.15 -0.45 0.00 -0.03 0.00 0.00 56.01 55.34 2nvl n LEU 115 Cb 0.18 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.20 2nvl n LEU 115 CO 0.06 0.08 0.45 -0.76 -1.33 0.00 0.00 177.39 175.88 2nvl s LEU 116 N -1.50 5.39 0.02 2.23 1.43 -1.23 -0.88 118.68 124.13 2nvl s LEU 116 Ca 0.26 -1.48 0.01 0.00 -1.03 0.00 0.00 54.13 51.89 2nvl s LEU 116 Cb 0.12 -2.31 -0.01 0.00 0.03 0.00 0.00 46.19 44.02 2nvl s LEU 116 CO 0.20 -1.11 -0.05 -1.38 0.23 0.00 0.00 176.35 174.24 2nvl s HIS 117 N 2.66 0.42 0.00 0.29 -3.43 -1.26 -4.97 115.29 109.01 2nvl s HIS 117 Ca 0.13 -0.32 0.00 0.00 -0.80 0.00 0.00 55.06 54.07 2nvl s HIS 117 Cb -0.23 -0.27 0.00 0.00 -1.43 0.00 0.00 32.58 30.66 2nvl s HIS 117 CO 0.05 -0.07 0.00 0.00 -2.00 0.00 0.00 174.74 172.72 2nvl n ALA 118 N 2.13 0.00 1.31 -1.38 0.00 -1.26 -1.33 120.51 119.98 2nvl n ALA 118 Ca -0.19 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.27 2nvl n ALA 118 Cb 0.56 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.06 2nvl n ALA 118 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2nvl n GLU 119 N 0.00 1.36 -2.91 0.00 1.02 -1.26 -5.23 120.64 113.62 2nvl n GLU 119 Ca 0.00 -0.40 -0.25 0.00 -0.02 0.00 0.00 57.16 56.49 2nvl n GLU 119 Cb 0.00 -1.28 0.01 0.00 -0.02 0.00 0.00 31.44 30.14 2nvl n GLU 119 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2nvl s SER 120 N -0.66 6.01 0.08 1.62 0.15 -0.44 -5.05 113.70 115.40 2nvl s SER 120 Ca 0.07 0.54 0.00 0.00 0.70 0.00 0.00 55.95 57.26 2nvl s SER 120 Cb 0.04 -1.84 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 2nvl s SER 120 CO 0.04 -0.63 0.00 1.41 1.20 0.00 0.00 173.24 175.26 2nvl n HIS 123 N -2.13 -1.41 -1.16 3.44 -0.00 -1.26 -5.08 115.22 107.62 2nvl n HIS 123 Ca 0.00 0.81 -0.38 0.00 -0.00 0.00 0.00 57.72 58.15 2nvl n HIS 123 Cb 0.57 -1.39 0.03 0.00 -0.00 0.00 0.00 29.99 29.19 2nvl n HIS 123 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 2nvl n THR 124 N 1.23 0.16 -0.69 1.59 -1.04 -1.26 -4.75 114.28 109.52 2nvl n THR 124 Ca 0.00 -0.49 -0.28 0.00 -2.04 0.00 0.00 64.05 61.24 2nvl n THR 124 Cb 0.00 -0.07 0.24 0.00 -1.82 0.00 0.00 70.33 68.68 2nvl n THR 124 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2nvl s VAL 125 N -1.99 2.01 -1.55 12.58 -7.23 -0.06 -4.13 120.40 120.03 2nvl s VAL 125 Ca 0.52 0.00 -0.09 0.00 -1.81 0.00 0.00 61.98 60.60 2nvl s VAL 125 Cb -0.37 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.36 2nvl s VAL 125 CO 0.71 -0.01 2.79 0.54 -0.31 0.00 0.00 175.10 178.82 2nvl n ARG 126 N -4.78 3.81 -2.92 4.82 1.74 -1.21 -4.23 116.66 113.88 2nvl n ARG 126 Ca 0.03 -2.49 -0.38 0.00 -0.77 0.00 0.00 57.85 54.24 2nvl n ARG 126 Cb 0.55 -2.81 -0.06 0.00 -1.02 0.00 0.00 32.46 29.12 2nvl n ARG 126 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2nvl s GLY 127 N 1.89 2.87 -0.11 -0.13 0.00 -1.26 -2.94 107.32 107.65 2nvl s GLY 127 Ca 0.65 0.41 0.03 0.00 0.00 0.00 0.00 44.72 45.80 2nvl s GLY 127 CO -0.07 0.88 -0.20 0.14 0.00 0.00 0.00 173.10 173.85 2nvl s VAL 128 N -1.32 1.83 -0.16 1.40 1.01 -0.03 -0.69 120.40 122.43 2nvl s VAL 128 Ca 0.41 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 2nvl s VAL 128 Cb -0.21 -1.61 -0.01 0.00 0.00 0.00 0.00 36.38 34.55 2nvl s VAL 128 CO 0.26 0.51 -0.13 -0.36 0.00 0.00 0.00 175.10 175.38 2nvl s PHE 129 N 0.60 2.83 -0.30 5.22 0.40 0.53 -1.32 117.98 125.95 2nvl s PHE 129 Ca -0.14 -0.91 -0.09 0.00 -0.60 0.00 0.00 56.93 55.19 2nvl s PHE 129 Cb -0.17 -1.92 -0.01 0.00 0.51 0.00 0.00 43.02 41.44 2nvl s PHE 129 CO 0.04 -0.41 0.14 0.42 0.70 0.00 0.00 175.22 176.10 2nvl s ILE 130 N 0.80 4.58 -0.11 0.64 1.01 -0.32 -1.02 121.20 126.79 2nvl s ILE 130 Ca -0.05 -0.34 0.03 0.00 0.00 0.00 0.00 60.65 60.29 2nvl s ILE 130 Cb -0.15 -3.29 0.01 0.00 0.01 0.00 0.00 42.46 39.04 2nvl s ILE 130 CO 0.01 0.13 -0.20 -0.69 0.00 0.00 0.00 174.94 174.18 2nvl s VAL 131 N 1.62 1.84 0.99 2.92 1.01 -0.15 -0.22 120.40 128.41 2nvl s VAL 131 Ca 0.05 -0.87 -0.17 0.00 0.00 0.00 0.00 61.98 60.99 2nvl s VAL 131 Cb -0.17 -1.62 0.23 0.00 0.00 0.00 0.00 36.38 34.82 2nvl s VAL 131 CO 0.06 0.51 1.24 -0.90 0.00 0.00 0.00 175.10 176.01 2nvl n ASP 132 N 3.82 -0.28 0.00 3.32 5.68 0.01 -1.26 116.55 127.84 2nvl n ASP 132 Ca -0.20 -1.41 0.12 0.00 -0.50 0.00 0.00 54.79 52.81 2nvl n ASP 132 Cb 0.52 -0.98 0.72 0.00 -1.14 0.00 0.00 41.12 40.25 2nvl n ASP 132 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2nvl n ALA 133 N -4.00 2.40 0.80 2.12 0.00 -1.25 -1.78 120.51 118.80 2nvl n ALA 133 Ca -0.21 -0.15 0.09 0.00 0.00 0.00 0.00 53.44 53.18 2nvl n ALA 133 Cb 0.56 -1.40 0.05 0.00 0.00 0.00 0.00 19.45 18.66 2nvl n ALA 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2nvl n ARG 134 N -1.02 1.62 -0.57 0.00 1.74 -1.26 -4.56 116.66 112.62 2nvl n ARG 134 Ca 0.18 -1.38 0.00 0.00 -0.77 0.00 0.00 57.85 55.89 2nvl n ARG 134 Cb 0.09 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 2nvl n ARG 134 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nvl n GLY 135 N 1.13 0.68 3.66 -0.13 0.00 -0.73 -4.98 105.19 104.82 2nvl n GLY 135 Ca 0.10 -0.38 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 2nvl n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nvl s VAL 136 N -2.00 5.29 0.12 1.61 1.01 -1.26 0.64 120.40 125.81 2nvl s VAL 136 Ca 0.00 0.15 -0.32 0.00 0.00 0.00 0.00 61.98 61.81 2nvl s VAL 136 Cb 0.00 -3.46 -0.12 0.00 0.00 0.00 0.00 36.38 32.81 2nvl s VAL 136 CO 0.00 0.36 1.77 -0.38 0.00 0.00 0.00 175.10 176.85 2nvl n ILE 137 N 4.21 0.24 -0.01 2.22 5.41 -0.87 -0.81 119.36 129.76 2nvl n ILE 137 Ca -0.15 -0.04 0.04 0.00 1.00 0.00 0.00 62.75 63.59 2nvl n ILE 137 Cb 0.52 -1.95 -0.07 0.00 -0.71 0.00 0.00 39.64 37.43 2nvl n ILE 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2nvl n ARG 138 N 4.97 0.38 -3.60 0.38 5.12 0.69 -1.36 116.66 123.24 2nvl n ARG 138 Ca 0.18 -0.08 -0.11 0.00 -1.93 0.00 0.00 57.85 55.92 2nvl n ARG 138 Cb 0.34 -1.21 -0.06 0.00 -1.16 0.00 0.00 32.46 30.37 2nvl n ARG 138 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2nvl s THR 139 N -2.59 0.00 -0.01 0.55 2.01 -1.23 -4.92 115.64 109.45 2nvl s THR 139 Ca -0.03 0.00 0.01 0.00 0.31 0.00 0.00 61.69 61.97 2nvl s THR 139 Cb 0.05 -1.00 0.00 0.00 0.01 0.00 0.00 72.50 71.57 2nvl s THR 139 CO 0.36 0.00 -0.02 -0.04 -0.69 0.00 0.00 174.62 174.23 2nvl s MET 140 N -0.53 0.21 -0.04 4.92 -1.94 -1.26 -1.17 119.30 119.49 2nvl s MET 140 Ca -0.00 -0.06 0.01 0.00 -1.71 0.00 0.00 55.69 53.93 2nvl s MET 140 Cb -0.02 -0.24 0.02 0.00 2.01 0.00 0.00 34.83 36.59 2nvl s MET 140 CO -0.01 0.02 -0.06 -0.51 -0.01 0.00 0.00 175.02 174.45 2nvl s LEU 141 N 0.14 1.45 -0.34 -0.03 1.43 -0.43 -4.95 118.68 115.95 2nvl s LEU 141 Ca -0.01 -0.15 0.04 0.00 -1.03 0.00 0.00 54.13 52.97 2nvl s LEU 141 Cb -0.03 -0.49 0.10 0.00 0.03 0.00 0.00 46.19 45.80 2nvl s LEU 141 CO -0.00 -0.03 0.05 -0.31 0.23 0.00 0.00 176.35 176.29 2nvl s TYR 142 N 0.76 3.59 0.03 0.29 1.51 -1.26 -0.85 117.35 121.41 2nvl s TYR 142 Ca -0.11 -2.89 -0.05 0.00 -1.01 0.00 0.00 57.07 53.01 2nvl s TYR 142 Cb -0.14 -2.81 -0.05 0.00 -0.11 0.00 0.00 41.96 38.85 2nvl s TYR 142 CO 0.01 -0.94 0.27 0.71 -1.11 0.00 0.00 175.55 174.49 2nvl s TYR 143 N 0.96 3.55 0.82 2.71 1.51 -1.15 -5.01 117.35 120.75 2nvl s TYR 143 Ca 0.11 0.52 -0.12 0.00 -1.01 0.00 0.00 57.07 56.57 2nvl s TYR 143 Cb -0.19 -1.96 0.08 0.00 -0.11 0.00 0.00 41.96 39.79 2nvl s TYR 143 CO -0.09 0.58 1.15 -1.25 -1.11 0.00 0.00 175.55 174.83 2nvl s PRO 144 N -1.99 1.89 0.50 -1.71 0.04 -1.26 -3.35 135.00 129.12 2nvl s PRO 144 Ca 0.30 0.28 0.29 0.00 0.04 0.00 0.00 61.00 61.91 2nvl s PRO 144 Cb -0.13 -1.93 1.19 0.00 0.04 0.00 0.00 34.50 33.67 2nvl s PRO 144 CO 0.19 -1.68 1.93 1.98 0.04 0.00 0.00 177.00 179.46 2nvl h MET 145 N -1.12 0.00 0.00 4.56 4.05 -1.97 -1.94 114.93 118.50 2nvl h MET 145 Ca -0.47 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.95 2nvl h MET 145 Cb 1.31 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.11 2nvl h MET 145 CO 0.64 0.12 0.00 1.05 0.23 0.00 0.00 176.91 178.95 2nvl h GLU 146 N 0.00 0.00 -5.02 0.39 9.09 -2.03 -3.45 114.58 113.55 2nvl h GLU 146 Ca -0.00 0.00 -0.67 0.00 0.05 0.00 0.00 59.36 58.74 2nvl h GLU 146 Cb 0.59 0.00 -0.33 0.00 -1.65 0.00 0.00 28.75 27.36 2nvl h GLU 146 CO 0.02 0.00 -0.82 -1.17 0.05 0.00 0.00 179.01 177.09 2nvl s LEU 147 N -5.13 2.44 0.53 3.06 0.20 -0.73 -5.06 118.68 113.98 2nvl s LEU 147 Ca 0.04 -0.65 -0.20 0.00 0.69 0.00 0.00 54.13 54.01 2nvl s LEU 147 Cb 0.09 -1.55 -0.07 0.00 -0.43 0.00 0.00 46.19 44.23 2nvl s LEU 147 CO 0.48 -0.02 1.10 -0.83 -0.29 0.00 0.00 176.35 176.79 2nvl s GLY 148 N 1.32 2.60 0.69 7.98 0.00 -1.26 -4.51 107.32 114.14 2nvl s GLY 148 Ca 0.04 0.76 -0.11 0.00 0.00 0.00 0.00 44.72 45.41 2nvl s GLY 148 CO -0.10 1.10 1.07 0.50 0.00 0.00 0.00 173.10 175.67 2nvl s ARG 149 N -3.27 2.89 -0.66 2.90 0.52 -1.26 -5.01 118.95 115.06 2nvl s ARG 149 Ca 0.71 0.41 -0.08 0.00 -0.52 0.00 0.00 55.73 56.25 2nvl s ARG 149 Cb -0.22 -2.06 0.17 0.00 0.52 0.00 0.00 34.95 33.37 2nvl s ARG 149 CO 0.25 -0.98 0.53 -1.17 0.02 0.00 0.00 175.30 173.95 2nvl s LEU 150 N -5.30 5.86 0.45 2.53 2.96 -1.26 -4.98 118.68 118.94 2nvl s LEU 150 Ca 0.57 -2.58 0.11 0.00 -0.22 0.00 0.00 54.13 52.02 2nvl s LEU 150 Cb -0.11 -2.01 1.03 0.00 0.50 0.00 0.00 46.19 45.60 2nvl s LEU 150 CO 0.51 -0.51 2.08 0.58 -1.32 0.00 0.00 176.35 177.68 2nvl h VAL 151 N 5.32 1.03 -0.55 1.68 2.07 -1.95 -2.32 116.25 121.53 2nvl h VAL 151 Ca -0.02 -0.12 0.06 0.00 0.82 0.00 0.00 66.70 67.44 2nvl h VAL 151 Cb 1.01 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2nvl h VAL 151 CO 0.76 0.06 0.37 0.44 0.02 0.00 0.00 177.57 179.23 2nvl h ASP 152 N 0.35 0.45 -0.51 0.57 3.32 -1.93 -1.35 116.42 117.31 2nvl h ASP 152 Ca 0.12 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.20 2nvl h ASP 152 Cb 0.07 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 2nvl h ASP 152 CO -0.03 0.29 0.34 -0.08 -1.72 0.00 0.00 179.24 178.05 2nvl h GLU 153 N 0.51 0.59 -0.02 3.56 4.57 -1.75 -1.62 114.58 120.42 2nvl h GLU 153 Ca 0.24 -0.04 -0.21 0.00 -1.18 0.00 0.00 59.36 58.18 2nvl h GLU 153 Cb 0.29 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2nvl h GLU 153 CO -0.07 0.39 -0.87 0.82 -1.18 0.00 0.00 179.01 178.10 2nvl h ILE 154 N 0.61 1.42 -0.43 2.32 2.04 -1.36 -1.63 117.51 120.48 2nvl h ILE 154 Ca 0.20 -2.42 -0.02 0.00 1.00 0.00 0.00 64.86 63.62 2nvl h ILE 154 Cb 0.06 2.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.48 2nvl h ILE 154 CO -0.05 0.72 0.17 -0.07 0.00 0.00 0.00 178.15 178.92 2nvl h LEU 155 N 0.21 0.59 -0.98 1.44 3.38 -1.28 -2.35 115.31 116.33 2nvl h LEU 155 Ca -0.06 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.72 2nvl h LEU 155 Cb 1.49 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 42.05 2nvl h LEU 155 CO 0.15 0.60 0.43 -0.09 0.09 0.00 0.00 178.44 179.62 2nvl h ARG 156 N 0.55 1.15 0.06 1.13 2.43 -1.06 -1.51 114.38 117.13 2nvl h ARG 156 Ca 0.14 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2nvl h ARG 156 Cb 0.19 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2nvl h ARG 156 CO -0.01 0.86 -0.03 0.82 -1.51 0.00 0.00 179.97 180.10 2nvl h ILE 157 N 1.15 0.98 -0.18 1.20 2.04 -1.08 0.11 117.51 121.73 2nvl h ILE 157 Ca 0.29 -0.14 -0.16 0.00 1.00 0.00 0.00 64.86 65.85 2nvl h ILE 157 Cb 0.06 1.07 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 2nvl h ILE 157 CO -0.04 0.03 -0.55 -0.37 0.00 0.00 0.00 178.15 177.22 2nvl h VAL 158 N -0.14 1.33 0.27 1.67 -1.51 -1.23 0.95 116.25 117.60 2nvl h VAL 158 Ca -0.01 -1.80 -0.01 0.00 -1.23 0.00 0.00 66.70 63.65 2nvl h VAL 158 Cb 0.12 1.78 -0.00 0.00 -2.13 0.00 0.00 31.29 31.06 2nvl h VAL 158 CO 0.01 0.56 -0.16 0.50 -1.23 0.00 0.00 177.57 177.25 2nvl h LYS 159 N 0.40 -0.40 -0.12 5.19 1.63 -1.21 0.53 116.57 122.60 2nvl h LYS 159 Ca 0.01 0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 59.75 2nvl h LYS 159 Cb 1.08 0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 32.79 2nvl h LYS 159 CO 0.10 -0.27 -0.30 0.00 -3.45 0.00 0.00 179.45 175.53 2nvl h ALA 160 N 0.30 1.29 -0.23 5.00 0.00 -0.84 -1.62 119.26 123.15 2nvl h ALA 160 Ca -0.03 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.41 2nvl h ALA 160 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2nvl h ALA 160 CO 0.03 0.49 -0.45 1.25 0.00 0.00 0.00 179.25 180.57 2nvl h LEU 161 N 0.19 0.62 -0.39 0.00 5.85 -0.47 0.11 115.31 121.23 2nvl h LEU 161 Ca 0.03 -0.29 -0.17 0.00 0.84 0.00 0.00 57.88 58.28 2nvl h LEU 161 Cb 0.63 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.48 2nvl h LEU 161 CO 0.05 0.98 -0.47 0.11 -0.34 0.00 0.00 178.44 178.77 2nvl h LYS 162 N 0.47 0.85 0.27 1.25 1.57 -0.36 -1.65 116.57 118.97 2nvl h LYS 162 Ca 0.03 -0.49 -0.01 0.00 -1.87 0.00 0.00 60.65 58.30 2nvl h LYS 162 Cb 0.97 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.32 2nvl h LYS 162 CO 0.09 1.13 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.90 2nvl h LEU 163 N 0.67 -0.31 -0.83 2.94 3.38 -1.14 -1.73 115.31 118.30 2nvl h LEU 163 Ca 0.04 -0.05 0.12 0.00 0.09 0.00 0.00 57.88 58.08 2nvl h LEU 163 Cb 1.06 0.08 -0.08 0.00 0.09 0.00 0.00 40.66 41.81 2nvl h LEU 163 CO 0.11 -0.15 0.44 1.23 0.09 0.00 0.00 178.44 180.16 2nvl h GLY 164 N -0.45 1.31 0.88 0.83 0.00 -0.75 -0.87 103.07 104.02 2nvl h GLY 164 Ca -0.04 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 2nvl h GLY 164 CO 0.06 0.03 0.06 -0.55 0.00 0.00 0.00 176.54 176.15 2nvl h ASP 165 N 0.68 0.40 0.74 0.19 3.32 -1.17 0.82 116.42 121.40 2nvl h ASP 165 Ca 0.43 -0.23 -0.25 0.00 0.02 0.00 0.00 57.03 56.99 2nvl h ASP 165 Cb 0.52 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.95 2nvl h ASP 165 CO -0.31 0.53 -1.25 0.77 -1.72 0.00 0.00 179.24 177.25 2nvl h SER 166 N 0.25 0.17 0.24 6.45 4.64 -0.97 -3.07 113.55 121.27 2nvl h SER 166 Ca 0.08 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 2nvl h SER 166 Cb 0.28 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2nvl h SER 166 CO 0.00 1.17 -0.25 0.18 -0.87 0.00 0.00 176.83 177.06 2nvl n LEU 167 N -3.37 0.99 -3.54 5.97 4.32 -0.36 -4.96 117.00 116.05 2nvl n LEU 167 Ca -0.07 -0.25 -0.21 0.00 -0.02 0.00 0.00 56.01 55.46 2nvl n LEU 167 Cb 0.99 -0.13 0.05 0.00 -1.62 0.00 0.00 43.42 42.72 2nvl n LEU 167 CO 0.49 0.19 -0.02 1.17 -1.22 0.00 0.00 177.39 178.00 2nvl n LYS 168 N -0.66 -3.73 -4.17 3.23 0.00 -0.33 -5.02 118.16 107.47 2nvl n LYS 168 Ca 0.12 0.69 -0.11 0.00 0.00 0.00 0.00 58.31 59.01 2nvl n LYS 168 Cb 0.34 -5.24 -0.10 0.00 0.00 0.00 0.00 35.03 30.04 2nvl n LYS 168 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2nvl s ARG 169 N -5.48 0.89 0.19 1.64 1.81 0.14 -4.64 118.95 113.50 2nvl s ARG 169 Ca 0.21 -1.39 0.06 0.00 -1.72 0.00 0.00 55.73 52.90 2nvl s ARG 169 Cb -0.05 -0.07 -0.04 0.00 -0.45 0.00 0.00 34.95 34.34 2nvl s ARG 169 CO 0.79 -0.11 0.13 0.00 -0.68 0.00 0.00 175.30 175.44 2nvl s ALA 170 N -3.76 3.52 -0.19 2.13 0.00 0.80 -4.32 121.76 119.95 2nvl s ALA 170 Ca 0.16 -1.30 -0.02 0.00 0.00 0.00 0.00 51.96 50.81 2nvl s ALA 170 Cb 0.06 -1.29 -0.01 0.00 0.00 0.00 0.00 23.12 21.89 2nvl s ALA 170 CO -0.02 0.43 -0.09 0.08 0.00 0.00 0.00 175.76 176.16 2nvl s VAL 171 N -1.87 3.12 0.90 0.00 1.01 -1.26 -0.01 120.40 122.29 2nvl s VAL 171 Ca 0.31 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.58 2nvl s VAL 171 Cb -0.09 -2.37 0.13 0.00 0.00 0.00 0.00 36.38 34.04 2nvl s VAL 171 CO 0.23 0.47 1.09 -2.16 0.00 0.00 0.00 175.10 174.74 2nvl s PRO 172 N 1.08 1.23 0.22 2.72 0.04 -1.26 -4.95 135.00 134.08 2nvl s PRO 172 Ca 0.00 0.96 -0.32 0.00 0.04 0.00 0.00 61.00 61.69 2nvl s PRO 172 Cb -0.15 -1.79 -0.14 0.00 0.04 0.00 0.00 34.50 32.46 2nvl s PRO 172 CO -0.02 -2.30 1.42 0.00 0.04 0.00 0.00 177.00 176.14 2nvl n ALA 173 N -3.94 1.03 -1.17 8.56 0.00 -1.26 -2.40 120.51 121.34 2nvl n ALA 173 Ca 0.08 0.42 -0.06 0.00 0.00 0.00 0.00 53.44 53.88 2nvl n ALA 173 Cb 0.54 -2.27 -0.02 0.00 0.00 0.00 0.00 19.45 17.70 2nvl n ALA 173 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2nvl n ASP 174 N 2.34 -4.67 -4.71 0.00 8.00 -1.26 -4.11 116.55 112.15 2nvl n ASP 174 Ca 0.13 0.14 -0.42 0.00 0.71 0.00 0.00 54.79 55.34 2nvl n ASP 174 Cb 0.31 -2.68 -0.01 0.00 -0.02 0.00 0.00 41.12 38.72 2nvl n ASP 174 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 2nvl n TRP 175 N -2.51 2.38 0.39 1.24 -0.00 -1.01 -0.04 117.44 117.89 2nvl n TRP 175 Ca -0.06 0.53 0.03 0.00 -0.00 0.00 0.00 57.50 58.00 2nvl n TRP 175 Cb 0.35 -2.44 0.16 0.00 -0.00 0.00 0.00 31.31 29.39 2nvl n TRP 175 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2nvl n PRO 176 N 0.68 2.42 -1.97 5.87 -0.04 -1.26 -4.94 135.00 135.76 2nvl n PRO 176 Ca 0.05 -1.25 -0.33 0.00 -0.04 0.00 0.00 63.50 61.93 2nvl n PRO 176 Cb 0.36 -1.70 0.03 0.00 -0.04 0.00 0.00 33.50 32.15 2nvl n PRO 176 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2nvl n ASN 177 N 0.28 6.38 -4.74 3.54 3.02 0.95 -3.19 115.26 121.50 2nvl n ASN 177 Ca 0.11 -3.78 -0.41 0.00 -0.03 0.00 0.00 54.58 50.47 2nvl n ASN 177 Cb 0.56 -0.77 -0.04 0.00 -0.61 0.00 0.00 39.78 38.93 2nvl n ASN 177 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2nvl s ASN 178 N -2.31 7.17 0.51 6.41 3.84 0.20 -4.86 114.94 125.89 2nvl s ASN 178 Ca 0.53 2.22 0.27 0.00 0.21 0.00 0.00 52.86 56.10 2nvl s ASN 178 Cb 0.44 -2.61 1.39 0.00 -0.55 0.00 0.00 41.25 39.92 2nvl s ASN 178 CO -0.20 -0.28 2.04 -0.33 -2.79 0.00 0.00 177.10 175.54 2nvl h GLU 179 N 4.78 0.00 0.00 0.43 5.08 -1.87 0.21 114.58 123.22 2nvl h GLU 179 Ca -0.45 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.82 2nvl h GLU 179 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2nvl h GLU 179 CO 0.72 0.13 -0.71 0.82 -1.00 0.00 0.00 179.01 178.97 2nvl h ILE 180 N 0.00 0.50 -0.15 3.13 2.04 -1.94 -3.42 117.51 117.67 2nvl h ILE 180 Ca -0.00 -1.57 0.00 0.00 1.00 0.00 0.00 64.86 64.29 2nvl h ILE 180 Cb 0.38 1.14 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2nvl h ILE 180 CO 0.02 0.17 0.00 2.30 0.00 0.00 0.00 178.15 180.64 2nvl n ILE 181 N -4.56 0.88 0.00 -0.67 -5.35 -1.25 -5.09 119.36 103.32 2nvl n ILE 181 Ca -0.16 -0.94 0.00 0.00 -0.27 0.00 0.00 62.75 61.38 2nvl n ILE 181 Cb 0.42 0.58 0.00 0.00 -1.74 0.00 0.00 39.64 38.89 2nvl n ILE 181 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2nvl n GLY 182 N 0.03 1.52 0.84 3.28 0.00 0.74 -0.84 105.19 110.77 2nvl n GLY 182 Ca 0.05 0.26 0.09 0.00 0.00 0.00 0.00 46.02 46.43 2nvl n GLY 182 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2nvl n GLU 183 N 0.76 1.93 -0.78 1.61 0.28 -1.19 -0.63 120.64 122.62 2nvl n GLU 183 Ca 0.00 -1.84 -0.32 0.00 -0.16 0.00 0.00 57.16 54.84 2nvl n GLU 183 Cb 0.00 -1.39 0.16 0.00 1.43 0.00 0.00 31.44 31.64 2nvl n GLU 183 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2nvl n GLY 184 N 1.11 -0.37 3.23 -1.84 0.00 -0.02 -4.84 105.19 102.46 2nvl n GLY 184 Ca 0.13 -0.66 -0.25 0.00 0.00 0.00 0.00 46.02 45.24 2nvl n GLY 184 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2nvl s LEU 185 N -6.13 2.15 -0.07 0.99 1.43 0.33 -4.63 118.68 112.75 2nvl s LEU 185 Ca 0.68 -0.48 -0.18 0.00 -1.03 0.00 0.00 54.13 53.12 2nvl s LEU 185 Cb -0.24 -0.93 -0.05 0.00 0.03 0.00 0.00 46.19 45.00 2nvl s LEU 185 CO 0.57 0.16 0.48 -0.63 0.23 0.00 0.00 176.35 177.15 2nvl s ILE 186 N -0.75 5.09 -0.04 -0.59 1.01 0.98 -2.17 121.20 124.73 2nvl s ILE 186 Ca 0.07 0.97 -0.30 0.00 0.00 0.00 0.00 60.65 61.39 2nvl s ILE 186 Cb -0.08 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.54 2nvl s ILE 186 CO 0.01 0.41 1.15 -0.69 0.00 0.00 0.00 174.94 175.82 2nvl s VAL 187 N 0.05 4.35 0.31 2.92 1.01 0.13 -0.14 120.40 129.03 2nvl s VAL 187 Ca 0.26 1.67 -0.30 0.00 0.00 0.00 0.00 61.98 63.61 2nvl s VAL 187 Cb -0.16 -4.07 -0.12 0.00 0.00 0.00 0.00 36.38 32.03 2nvl s VAL 187 CO 0.12 0.03 1.55 -2.65 0.00 0.00 0.00 175.10 174.15 2nvl n PRO 188 N 4.90 2.64 -1.97 2.72 -0.02 -1.26 -4.57 135.00 137.44 2nvl n PRO 188 Ca 0.10 0.94 -0.40 0.00 -2.02 0.00 0.00 63.50 62.12 2nvl n PRO 188 Cb 0.47 -2.69 -0.00 0.00 -0.02 0.00 0.00 33.50 31.26 2nvl n PRO 188 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2nvl s PRO 189 N -0.94 3.94 0.34 0.52 0.04 -1.26 -4.98 135.00 132.66 2nvl s PRO 189 Ca 0.61 2.26 -0.28 0.00 0.04 0.00 0.00 61.00 63.63 2nvl s PRO 189 Cb -0.50 -2.77 -0.12 0.00 0.04 0.00 0.00 34.50 31.15 2nvl s PRO 189 CO 0.53 -0.55 1.40 -2.30 0.04 0.00 0.00 177.00 176.11 2nvl n PRO 190 N 0.13 2.37 -0.11 0.56 -0.02 -1.26 -4.95 135.00 131.72 2nvl n PRO 190 Ca 0.03 0.83 0.08 0.00 -2.02 0.00 0.00 63.50 62.43 2nvl n PRO 190 Cb 0.43 -2.50 0.14 0.00 -0.02 0.00 0.00 33.50 31.55 2nvl n PRO 190 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2nvl n THR 191 N 0.68 0.41 -4.32 3.45 -2.24 -1.26 -4.87 114.28 106.13 2nvl n THR 191 Ca 0.04 -0.70 -0.17 0.00 -2.27 0.00 0.00 64.05 60.95 2nvl n THR 191 Cb 0.37 1.00 -0.10 0.00 -2.10 0.00 0.00 70.33 69.50 2nvl n THR 191 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2nvl s THR 192 N -1.24 1.53 0.24 4.28 -4.23 -1.26 -5.04 115.64 109.93 2nvl s THR 192 Ca 0.26 -2.15 -0.03 0.00 -1.18 0.00 0.00 61.69 58.59 2nvl s THR 192 Cb 0.16 -2.04 0.09 0.00 1.34 0.00 0.00 72.50 72.06 2nvl s THR 192 CO 0.22 -0.60 1.72 -0.33 -0.54 0.00 0.00 174.62 175.09 2nvl h GLU 193 N 2.60 0.81 -0.34 3.99 5.08 -1.99 -1.05 114.58 123.67 2nvl h GLU 193 Ca -0.38 -0.24 -0.10 0.00 -1.00 0.00 0.00 59.36 57.65 2nvl h GLU 193 Cb 1.21 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2nvl h GLU 193 CO 0.63 0.84 -0.16 -0.44 -1.00 0.00 0.00 179.01 178.88 2nvl h ASP 194 N 0.75 0.74 -0.63 1.42 3.45 -1.99 -1.82 116.42 118.33 2nvl h ASP 194 Ca 0.14 -0.40 -0.01 0.00 0.43 0.00 0.00 57.03 57.19 2nvl h ASP 194 Cb 0.52 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 39.05 2nvl h ASP 194 CO 0.03 0.98 0.37 1.56 -1.57 0.00 0.00 179.24 180.61 2nvl h GLN 195 N 0.49 0.86 -0.87 3.56 4.20 -1.94 -1.22 115.11 120.19 2nvl h GLN 195 Ca 0.08 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2nvl h GLN 195 Cb 0.70 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 28.26 2nvl h GLN 195 CO 0.05 0.62 0.50 0.00 -0.67 0.00 0.00 178.83 179.34 2nvl h ALA 196 N 1.19 1.11 -0.29 3.87 0.00 -1.09 -1.16 119.26 122.90 2nvl h ALA 196 Ca 0.23 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2nvl h ALA 196 Cb -0.01 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.42 2nvl h ALA 196 CO -0.04 0.59 -0.16 -0.09 0.00 0.00 0.00 179.25 179.55 2nvl h ARG 197 N 1.20 0.61 0.33 0.00 2.43 -1.10 -2.51 114.38 115.35 2nvl h ARG 197 Ca 0.31 -0.28 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 2nvl h ARG 197 Cb -0.02 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2nvl h ARG 197 CO -0.05 0.86 -0.16 0.00 -1.51 0.00 0.00 179.97 179.10 2nvl h ALA 198 N 0.74 -0.45 -0.58 2.80 0.00 -1.08 -2.48 119.26 118.21 2nvl h ALA 198 Ca 0.06 -0.14 0.09 0.00 0.00 0.00 0.00 54.91 54.92 2nvl h ALA 198 Cb 0.69 0.17 -0.11 0.00 0.00 0.00 0.00 17.79 18.54 2nvl h ALA 198 CO 0.05 -0.68 -0.41 -0.09 0.00 0.00 0.00 179.25 178.11 2nvl h ARG 199 N -0.60 -0.21 -0.19 0.00 9.65 -1.27 0.14 114.38 121.91 2nvl h ARG 199 Ca -0.05 0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.90 2nvl h ARG 199 Cb 0.44 0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.05 2nvl h ARG 199 CO 0.08 -0.14 0.16 0.52 2.80 0.00 0.00 179.97 183.39 2nvl h MET 200 N -0.22 0.00 0.11 0.20 2.86 -1.41 -2.92 114.93 113.56 2nvl h MET 200 Ca 0.19 0.00 -0.33 0.00 -2.06 0.00 0.00 59.70 57.50 2nvl h MET 200 Cb 0.56 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 2nvl h MET 200 CO -0.69 0.00 -1.72 0.93 1.06 0.00 0.00 176.91 176.50 2nvl h GLU 201 N 0.00 0.24 -0.85 1.72 5.08 -0.45 -3.32 114.58 117.00 2nvl h GLU 201 Ca 0.09 -0.41 0.22 0.00 -1.00 0.00 0.00 59.36 58.26 2nvl h GLU 201 Cb 0.41 0.15 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 2nvl h GLU 201 CO -0.00 1.08 0.59 0.66 -1.00 0.00 0.00 179.01 180.34 2nvl h SER 202 N 0.07 0.19 -1.29 1.42 4.64 -0.63 -3.45 113.55 114.49 2nvl h SER 202 Ca -0.31 0.02 -0.32 0.00 -0.47 0.00 0.00 61.79 60.71 2nvl h SER 202 Cb 2.03 -0.01 -0.12 0.00 -0.31 0.00 0.00 62.40 63.98 2nvl h SER 202 CO 0.13 0.07 -0.29 0.61 -0.87 0.00 0.00 176.83 176.48 2nvl n GLY 203 N -1.61 1.46 0.12 -0.77 0.00 -1.22 -4.84 105.19 98.32 2nvl n GLY 203 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 2nvl n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nvl n GLN 204 N -2.05 1.16 -3.99 1.61 10.64 -1.26 -4.88 117.38 118.61 2nvl n GLN 204 Ca -0.16 -0.23 -0.10 0.00 -1.83 0.00 0.00 57.00 54.68 2nvl n GLN 204 Cb 0.52 -1.41 -0.11 0.00 -0.86 0.00 0.00 30.24 28.37 2nvl n GLN 204 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2nvl s TYR 205 N -1.98 0.30 0.47 2.61 4.12 -1.26 -5.02 117.35 116.58 2nvl s TYR 205 Ca 0.38 -0.46 -0.23 0.00 0.02 0.00 0.00 57.07 56.77 2nvl s TYR 205 Cb 0.18 -0.21 -0.07 0.00 -1.52 0.00 0.00 41.96 40.34 2nvl s TYR 205 CO 0.30 -0.15 1.24 1.03 0.02 0.00 0.00 175.55 177.98 2nvl s ARG 206 N -1.29 3.67 -0.01 -0.62 0.52 -1.01 -4.90 118.95 115.31 2nvl s ARG 206 Ca -0.13 1.96 -0.28 0.00 -0.52 0.00 0.00 55.73 56.76 2nvl s ARG 206 Cb -0.09 -2.45 0.07 0.00 0.52 0.00 0.00 34.95 32.99 2nvl s ARG 206 CO -0.01 -0.68 0.63 -1.54 0.02 0.00 0.00 175.30 173.73 2nvl s SER 207 N -1.13 -0.60 -0.02 0.23 1.04 -1.26 -1.48 113.70 110.48 2nvl s SER 207 Ca 0.64 0.53 0.12 0.00 0.48 0.00 0.00 55.95 57.71 2nvl s SER 207 Cb -0.33 0.53 -0.18 0.00 0.10 0.00 0.00 66.02 66.14 2nvl s SER 207 CO 0.41 -0.66 0.25 0.18 0.98 0.00 0.00 173.24 174.40 2nvl n LEU 208 N 0.71 0.00 -3.63 2.42 7.99 -0.01 -4.99 117.00 119.48 2nvl n LEU 208 Ca -0.19 0.00 -0.00 0.00 -0.01 0.00 0.00 56.01 55.81 2nvl n LEU 208 Cb 0.58 0.00 -0.01 0.00 -0.11 0.00 0.00 43.42 43.89 2nvl n LEU 208 CO 0.22 0.00 1.00 -0.62 -1.51 0.00 0.00 177.39 176.48 2nvl s ASP 209 N -3.34 -0.09 0.63 -1.43 2.15 -1.23 -4.97 116.67 108.39 2nvl s ASP 209 Ca -0.04 -0.15 0.37 0.00 0.43 0.00 0.00 52.55 53.16 2nvl s ASP 209 Cb 0.07 0.21 2.12 0.00 -0.30 0.00 0.00 42.92 45.02 2nvl s ASP 209 CO 0.48 -0.38 2.31 4.11 -0.17 0.00 0.00 175.17 181.53 2nvl h TRP 210 N 2.00 0.00 -0.00 -5.34 5.08 -1.97 0.72 115.95 116.44 2nvl h TRP 210 Ca -0.26 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.71 2nvl h TRP 210 Cb 1.20 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.36 2nvl h TRP 210 CO 0.32 0.00 -0.73 -2.67 -1.28 0.00 0.00 178.44 174.08 2nvl n TRP 211 N -3.47 0.00 -3.57 0.12 4.27 -1.26 -4.45 117.44 109.07 2nvl n TRP 211 Ca -0.03 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.31 2nvl n TRP 211 Cb 0.08 -0.10 -0.10 0.00 -1.36 0.00 0.00 31.31 29.83 2nvl n TRP 211 CO 0.00 0.00 0.00 0.34 -2.29 0.00 0.00 177.69 175.74 2nvl n PHE 212 N -1.34 2.10 -4.77 -2.67 -0.00 0.24 -4.50 117.46 106.52 2nvl n PHE 212 Ca 0.05 -3.98 -0.33 0.00 -0.00 0.00 0.00 57.45 53.19 2nvl n PHE 212 Cb 0.34 -0.40 -0.13 0.00 -0.00 0.00 0.00 39.48 39.29 2nvl n PHE 212 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2nvl s TRP 214 N -0.18 0.36 0.00 0.00 -2.14 -0.55 0.21 118.94 116.64 2nvl s TRP 214 Ca 0.01 -0.82 0.00 0.00 2.66 0.00 0.00 56.10 57.94 2nvl s TRP 214 Cb -0.13 -0.26 0.00 0.00 -3.10 0.00 0.00 33.47 29.98 2nvl s TRP 214 CO 0.03 -0.40 0.00 -0.40 -2.66 0.00 0.00 176.95 173.52 2nvl n ASP 215 N 0.28 0.50 -3.55 -2.66 5.68 -0.92 -2.39 116.55 113.48 2nvl n ASP 215 Ca -0.16 -0.89 -0.27 0.00 -0.50 0.00 0.00 54.79 52.97 2nvl n ASP 215 Cb 0.61 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.49 2nvl n ASP 215 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2nvl n THR 216 N 0.00 1.35 1.09 2.12 -2.24 -1.26 -0.51 114.28 114.83 2nvl n THR 216 Ca 0.00 -4.76 0.12 0.00 -2.27 0.00 0.00 64.05 57.14 2nvl n THR 216 Cb 0.00 -2.07 0.25 0.00 -2.10 0.00 0.00 70.33 66.42 2nvl n THR 216 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2nvl n PRO 217 N 1.51 0.38 -2.23 -0.78 -0.04 -1.26 -4.92 135.00 127.66 2nvl n PRO 217 Ca 0.25 -0.24 -0.41 0.00 -0.04 0.00 0.00 63.50 63.06 2nvl n PRO 217 Cb 0.41 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.35 2nvl n PRO 217 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nvl s ALA 218 N -2.78 3.51 0.60 0.55 0.00 -1.26 -5.00 121.76 117.38 2nvl s ALA 218 Ca 0.16 1.10 -0.19 0.00 0.00 0.00 0.00 51.96 53.03 2nvl s ALA 218 Cb 0.18 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.80 2nvl s ALA 218 CO 0.64 -0.52 1.29 -1.54 0.00 0.00 0.00 175.76 175.63 2nvl s SER 219 N 0.22 5.01 0.35 0.00 1.04 -1.26 -4.78 113.70 114.28 2nvl s SER 219 Ca 0.55 2.59 0.15 0.00 0.48 0.00 0.00 55.95 59.73 2nvl s SER 219 Cb -0.36 -2.62 1.08 0.00 0.10 0.00 0.00 66.02 64.22 2nvl s SER 219 CO 0.39 -1.73 1.69 -0.09 0.98 0.00 0.00 173.24 174.47 2nvl h ARG 220 N 0.96 0.36 -0.12 4.02 2.43 -1.98 -0.65 114.38 119.40 2nvl h ARG 220 Ca -0.51 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 58.64 2nvl h ARG 220 Cb 1.31 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.78 2nvl h ARG 220 CO 0.55 0.24 0.05 -0.44 -1.51 0.00 0.00 179.97 178.85 2nvl h ASP 221 N 0.37 0.16 -0.57 -3.80 3.32 -1.99 -0.65 116.42 113.26 2nvl h ASP 221 Ca 0.71 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 57.60 2nvl h ASP 221 Cb 1.64 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 41.12 2nvl h ASP 221 CO -0.53 0.27 0.34 0.44 -1.72 0.00 0.00 179.24 178.04 2nvl h ASP 222 N 0.04 0.70 0.47 6.45 3.32 -1.71 0.56 116.42 126.25 2nvl h ASP 222 Ca 0.04 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 2nvl h ASP 222 Cb 0.16 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2nvl h ASP 222 CO -0.00 0.56 -0.36 0.58 -1.72 0.00 0.00 179.24 178.30 2nvl h VAL 223 N 0.77 0.26 -0.87 -1.35 2.07 -1.04 -1.68 116.25 114.42 2nvl h VAL 223 Ca 0.20 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.72 2nvl h VAL 223 Cb 0.00 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 2nvl h VAL 223 CO -0.04 0.00 0.51 -0.33 0.02 0.00 0.00 177.57 177.74 2nvl h GLU 224 N -0.82 1.18 -0.05 1.57 5.08 -1.07 -2.00 114.58 118.49 2nvl h GLU 224 Ca -0.05 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2nvl h GLU 224 Cb 0.70 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2nvl h GLU 224 CO 0.00 0.83 0.01 1.49 -1.00 0.00 0.00 179.01 180.35 2nvl h GLU 225 N 1.20 0.04 -0.70 2.33 4.81 -0.83 -0.52 114.58 120.91 2nvl h GLU 225 Ca 0.31 -0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.63 2nvl h GLU 225 Cb -0.04 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.27 2nvl h GLU 225 CO -0.06 0.02 0.34 0.00 -0.73 0.00 0.00 179.01 178.59 2nvl h ALA 226 N 1.03 0.95 -0.29 2.92 0.00 -1.01 -2.68 119.26 120.18 2nvl h ALA 226 Ca 0.02 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2nvl h ALA 226 Cb 0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2nvl h ALA 226 CO -0.02 -0.05 -0.30 -0.09 0.00 0.00 0.00 179.25 178.79 2nvl h ARG 227 N 0.59 0.60 -0.92 0.00 2.43 -1.26 -3.05 114.38 112.78 2nvl h ARG 227 Ca 0.34 -0.26 0.12 0.00 -0.81 0.00 0.00 59.98 59.38 2nvl h ARG 227 Cb 0.35 -0.02 -0.08 0.00 -0.42 0.00 0.00 29.97 29.80 2nvl h ARG 227 CO -0.26 0.83 0.54 -0.09 -1.51 0.00 0.00 179.97 179.47 2nvl h ARG 228 N 0.52 0.81 -0.16 0.20 2.43 -0.74 0.25 114.38 117.68 2nvl h ARG 228 Ca 0.06 -0.05 0.05 0.00 -0.81 0.00 0.00 59.98 59.23 2nvl h ARG 228 Cb 0.77 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.09 2nvl h ARG 228 CO 0.06 0.54 -0.18 1.88 -1.51 0.00 0.00 179.97 180.76 2nvl h TYR 229 N 0.83 -0.45 -0.42 2.20 0.99 -1.42 0.33 116.97 119.03 2nvl h TYR 229 Ca 0.47 0.03 -0.09 0.00 2.00 0.00 0.00 58.73 61.13 2nvl h TYR 229 Cb 0.52 0.23 -0.02 0.00 1.00 0.00 0.00 36.73 38.46 2nvl h TYR 229 CO -0.04 -0.25 -0.11 -0.07 -0.00 0.00 0.00 178.16 177.69 2nvl h LEU 230 N -0.21 0.73 -0.83 3.88 3.38 -1.58 -1.87 115.31 118.81 2nvl h LEU 230 Ca 0.11 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 2nvl h LEU 230 Cb 0.37 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2nvl h LEU 230 CO -0.28 0.86 0.29 -0.09 0.09 0.00 0.00 178.44 179.31 2nvl h ARG 231 N 0.67 1.15 -0.45 1.13 2.43 -0.35 -0.58 114.38 118.37 2nvl h ARG 231 Ca 0.12 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 58.99 2nvl h ARG 231 Cb 0.57 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2nvl h ARG 231 CO 0.04 0.94 -0.04 -0.09 -1.51 0.00 0.00 179.97 179.31 2nvl h ARG 232 N 1.12 0.77 -0.64 0.20 2.43 -0.70 -2.57 114.38 114.98 2nvl h ARG 232 Ca 0.25 -0.22 -0.07 0.00 -0.81 0.00 0.00 59.98 59.13 2nvl h ARG 232 Cb 0.24 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.68 2nvl h ARG 232 CO -0.02 0.81 0.11 0.00 -1.51 0.00 0.00 179.97 179.36 2nvl h ALA 233 N 1.24 0.85 0.00 2.80 0.00 -0.90 -3.04 119.26 120.21 2nvl h ALA 233 Ca 0.13 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2nvl h ALA 233 Cb 0.49 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2nvl h ALA 233 CO 0.03 0.61 0.00 0.00 0.00 0.00 0.00 179.25 179.88 2nvl h ALA 234 N 1.04 1.00 -3.01 0.00 0.00 -0.71 -3.46 119.26 114.13 2nvl h ALA 234 Ca 0.20 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.44 2nvl h ALA 234 Cb 0.42 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.12 2nvl h ALA 234 CO 0.01 0.00 -0.55 -1.83 0.00 0.00 0.00 179.25 176.88 2nvl s GLU 235 N -3.34 3.18 0.03 0.00 -1.05 -1.13 -5.05 118.70 111.34 2nvl s GLU 235 Ca 0.04 -0.37 -0.31 0.00 -0.15 0.00 0.00 54.97 54.18 2nvl s GLU 235 Cb 0.09 -2.95 -0.10 0.00 -0.44 0.00 0.00 34.13 30.73 2nvl s GLU 235 CO 0.42 0.69 1.92 1.17 0.95 0.00 0.00 175.26 180.42 2nvl n LYS 236 N 1.52 2.71 -1.85 -4.83 4.81 -1.26 -4.95 118.16 114.31 2nvl n LYS 236 Ca -0.15 0.99 -0.41 0.00 -0.87 0.00 0.00 58.31 57.87 2nvl n LYS 236 Cb 0.53 -2.91 -0.01 0.00 0.02 0.00 0.00 35.03 32.66 2nvl n LYS 236 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2nvl s PRO 237 N 3.97 4.16 0.17 1.64 0.04 -1.26 -4.96 135.00 138.76 2nvl s PRO 237 Ca 0.88 2.50 -0.30 0.00 0.04 0.00 0.00 61.00 64.12 2nvl s PRO 237 Cb -0.50 -3.01 -0.08 0.00 0.04 0.00 0.00 34.50 30.95 2nvl s PRO 237 CO 0.43 -0.51 1.15 0.00 0.04 0.00 0.00 177.00 178.11 2nvl s ALA 238 N -0.65 3.40 -0.05 8.56 0.00 -1.26 -4.76 121.76 127.01 2nvl s ALA 238 Ca 0.56 0.87 -0.04 0.00 0.00 0.00 0.00 51.96 53.36 2nvl s ALA 238 Cb -0.46 -3.39 0.02 0.00 0.00 0.00 0.00 23.12 19.29 2nvl s ALA 238 CO 0.55 -0.31 0.08 1.17 0.00 0.00 0.00 175.76 177.25 2nvl n LYS 239 N 2.62 -4.55 -3.36 0.00 4.81 -1.26 -4.99 118.16 111.42 2nvl n LYS 239 Ca 0.04 3.39 -0.33 0.00 -0.87 0.00 0.00 58.31 60.54 2nvl n LYS 239 Cb 0.46 -4.47 -0.06 0.00 0.02 0.00 0.00 35.03 30.98 2nvl n LYS 239 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2nvl s LEU 240 N -0.56 4.19 0.36 3.14 1.43 -1.26 -4.99 118.68 120.98 2nvl s LEU 240 Ca -0.09 1.01 0.13 0.00 -1.03 0.00 0.00 54.13 54.14 2nvl s LEU 240 Cb 0.01 -3.66 0.69 0.00 0.03 0.00 0.00 46.19 43.25 2nvl s LEU 240 CO 0.24 -0.06 1.81 -0.07 0.23 0.00 0.00 176.35 178.50 2nvl h LEU 241 N 2.70 0.00 -1.39 1.79 3.38 -1.95 -2.22 115.31 117.62 2nvl h LEU 241 Ca -0.47 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.43 2nvl h LEU 241 Cb 1.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2nvl h LEU 241 CO 0.68 0.39 -0.31 0.10 0.09 0.00 0.00 178.44 179.40 2nvl h TYR 242 N 0.00 0.00 0.12 1.13 -0.00 -1.94 0.95 116.97 117.24 2nvl h TYR 242 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.72 2nvl h TYR 242 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.43 2nvl h TYR 242 CO 0.00 0.31 -0.06 0.93 -0.00 0.00 0.00 178.16 179.34 2nvl h GLU 243 N 0.00 -0.16 -1.57 0.10 5.08 -1.90 -3.19 114.58 112.93 2nvl h GLU 243 Ca -0.00 0.01 0.50 0.00 -1.00 0.00 0.00 59.36 58.87 2nvl h GLU 243 Cb 0.54 0.04 -0.11 0.00 0.50 0.00 0.00 28.75 29.72 2nvl h GLU 243 CO 0.04 -0.11 1.07 0.39 -1.00 0.00 0.00 179.01 179.40 2nvl n GLU 244 N -2.75 -0.02 0.00 2.33 1.02 -0.86 -5.09 120.64 115.27 2nvl n GLU 244 Ca -0.02 1.16 0.11 0.00 -0.02 0.00 0.00 57.16 58.39 2nvl n GLU 244 Cb 0.06 -2.42 0.68 0.00 -0.02 0.00 0.00 31.44 29.74 2nvl n GLU 244 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31