#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nvl s ILE 5 N 0.00 3.95 0.96 2.46 -4.36 -1.26 -4.34 121.20 118.60 2nvl s ILE 5 Ca 0.00 0.63 -0.12 0.00 -0.26 0.00 0.00 60.65 60.90 2nvl s ILE 5 Cb 0.00 -3.48 0.16 0.00 1.25 0.00 0.00 42.46 40.39 2nvl s ILE 5 CO 0.00 -0.83 1.09 -2.84 0.24 0.00 0.00 174.94 172.60 2nvl s PRO 6 N -5.15 0.76 0.04 0.37 0.02 -1.26 -5.01 135.00 124.76 2nvl s PRO 6 Ca 0.58 0.69 0.05 0.00 0.02 0.00 0.00 61.00 62.34 2nvl s PRO 6 Cb -0.13 -1.76 -0.02 0.00 0.02 0.00 0.00 34.50 32.61 2nvl s PRO 6 CO 0.54 -2.55 -0.14 -0.51 -0.33 0.00 0.00 177.00 174.01 2nvl s LEU 7 N -6.39 2.16 0.11 -5.54 1.43 -1.26 -5.09 118.68 104.10 2nvl s LEU 7 Ca 0.65 -0.45 -0.36 0.00 -1.03 0.00 0.00 54.13 52.94 2nvl s LEU 7 Cb -0.19 -0.63 -0.16 0.00 0.03 0.00 0.00 46.19 45.25 2nvl s LEU 7 CO 0.58 0.05 1.35 -0.38 0.23 0.00 0.00 176.35 178.17 2nvl n ILE 8 N 1.94 0.11 0.00 -0.59 5.41 -1.26 -1.26 119.36 123.70 2nvl n ILE 8 Ca -0.18 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.55 2nvl n ILE 8 Cb 0.55 -0.92 0.00 0.00 -0.71 0.00 0.00 39.64 38.56 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 2.57 1.35 3.86 7.39 0.00 0.12 -5.03 105.19 115.45 2nvl n GLY 9 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2nvl n GLY 9 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2nvl s GLU 10 N -0.64 3.88 0.29 1.61 2.12 -0.39 -4.79 118.70 120.78 2nvl s GLU 10 Ca 0.00 0.37 -0.30 0.00 0.36 0.00 0.00 54.97 55.40 2nvl s GLU 10 Cb 0.00 -2.78 -0.12 0.00 0.26 0.00 0.00 34.13 31.49 2nvl s GLU 10 CO 0.00 0.39 1.50 -2.13 -0.54 0.00 0.00 175.26 174.49 2nvl n ARG 11 N 0.30 2.47 -1.80 4.30 0.63 -1.26 0.11 116.66 121.41 2nvl n ARG 11 Ca -0.02 0.88 -0.42 0.00 -0.92 0.00 0.00 57.85 57.36 2nvl n ARG 11 Cb 0.52 -2.60 -0.03 0.00 0.45 0.00 0.00 32.46 30.80 2nvl n ARG 11 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 2nvl s PHE 12 N -0.25 2.94 0.20 -0.14 5.36 0.12 -4.81 117.98 121.40 2nvl s PHE 12 Ca 0.63 0.47 -0.32 0.00 -0.96 0.00 0.00 56.93 56.74 2nvl s PHE 12 Cb -0.54 -4.07 -0.12 0.00 -0.34 0.00 0.00 43.02 37.95 2nvl s PHE 12 CO 0.52 -3.98 1.71 -0.35 -1.46 0.00 0.00 175.22 171.66 2nvl n PRO 13 N 3.83 2.69 -1.66 10.12 -0.04 -1.26 -4.46 135.00 144.22 2nvl n PRO 13 Ca 0.15 0.97 -0.46 0.00 -0.04 0.00 0.00 63.50 64.12 2nvl n PRO 13 Cb 0.36 -2.81 -0.04 0.00 -0.04 0.00 0.00 33.50 30.98 2nvl n PRO 13 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2nvl n GLU 14 N 3.94 1.98 -3.61 0.54 4.07 -1.26 -4.53 120.64 121.77 2nvl n GLU 14 Ca 0.16 0.71 -0.08 0.00 -0.06 0.00 0.00 57.16 57.90 2nvl n GLU 14 Cb 0.34 -2.41 -0.05 0.00 -0.06 0.00 0.00 31.44 29.25 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 0.32 0.40 -0.04 5.31 0.23 -0.53 -5.01 119.30 119.99 2nvl s MET 15 Ca 0.75 0.15 -0.09 0.00 -1.03 0.00 0.00 55.69 55.47 2nvl s MET 15 Cb -0.70 0.19 -0.05 0.00 -1.53 0.00 0.00 34.83 32.74 2nvl s MET 15 CO 0.44 -0.11 0.26 -1.21 -2.03 0.00 0.00 175.02 172.36 2nvl s GLU 16 N -0.87 3.62 0.03 3.16 2.02 -1.26 0.23 118.70 125.63 2nvl s GLU 16 Ca 0.02 0.04 -0.03 0.00 0.02 0.00 0.00 54.97 55.02 2nvl s GLU 16 Cb -0.01 -3.15 -0.02 0.00 0.10 0.00 0.00 34.13 31.05 2nvl s GLU 16 CO -0.03 0.70 0.04 0.14 0.02 0.00 0.00 175.26 176.13 2nvl s VAL 17 N -1.15 0.13 -0.19 2.63 -7.23 -0.12 -4.97 120.40 109.50 2nvl s VAL 17 Ca 0.22 -1.05 -0.08 0.00 -1.81 0.00 0.00 61.98 59.27 2nvl s VAL 17 Cb -0.14 -0.66 -0.04 0.00 0.56 0.00 0.00 36.38 36.10 2nvl s VAL 17 CO 0.11 -0.58 0.07 -0.89 -0.31 0.00 0.00 175.10 173.50 2nvl s THR 18 N -2.14 4.86 0.33 5.32 2.01 -1.26 -1.28 115.64 123.48 2nvl s THR 18 Ca -0.09 -0.01 0.09 0.00 0.31 0.00 0.00 61.69 61.99 2nvl s THR 18 Cb -0.04 -3.20 -0.06 0.00 0.01 0.00 0.00 72.50 69.21 2nvl s THR 18 CO -0.03 0.46 -0.09 0.42 -0.69 0.00 0.00 174.62 174.69 2nvl s THR 19 N 0.39 2.12 -2.00 -0.82 -4.23 0.97 0.20 115.64 112.27 2nvl s THR 19 Ca 0.04 -2.19 0.02 0.00 -1.18 0.00 0.00 61.69 58.38 2nvl s THR 19 Cb -0.12 -2.59 0.07 0.00 1.34 0.00 0.00 72.50 71.19 2nvl s THR 19 CO -0.00 -0.23 0.47 -0.90 -0.54 0.00 0.00 174.62 173.42 2nvl n ASP 20 N -0.74 0.00 -0.27 3.99 5.68 -0.82 -1.28 116.55 123.10 2nvl n ASP 20 Ca -0.05 -0.19 0.04 0.00 -0.50 0.00 0.00 54.79 54.09 2nvl n ASP 20 Cb 0.63 0.00 0.02 0.00 -1.14 0.00 0.00 41.12 40.63 2nvl n ASP 20 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2nvl n HIS 21 N -0.78 0.00 0.00 2.11 8.25 -1.26 -4.99 115.22 118.55 2nvl n HIS 21 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2nvl n HIS 21 Cb 0.01 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.12 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 0.66 0.70 3.81 -1.41 0.00 -0.41 -5.08 105.19 103.46 2nvl n GLY 22 Ca 0.04 -2.16 -0.38 0.00 0.00 0.00 0.00 46.02 43.52 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 -0.87 4.67 0.06 1.61 1.01 -1.26 -0.02 120.40 125.59 2nvl s VAL 23 Ca 0.00 1.24 -0.18 0.00 0.00 0.00 0.00 61.98 63.04 2nvl s VAL 23 Cb 0.00 -3.90 0.04 0.00 0.00 0.00 0.00 36.38 32.51 2nvl s VAL 23 CO 0.00 0.44 0.42 0.27 0.00 0.00 0.00 175.10 176.23 2nvl s ILE 24 N -1.24 0.06 -0.20 2.22 -4.36 -0.41 -4.97 121.20 112.29 2nvl s ILE 24 Ca 0.34 -0.45 -0.11 0.00 -0.26 0.00 0.00 60.65 60.16 2nvl s ILE 24 Cb -0.19 -0.99 -0.05 0.00 1.25 0.00 0.00 42.46 42.48 2nvl s ILE 24 CO 0.21 -0.25 0.20 -0.75 0.24 0.00 0.00 174.94 174.58 2nvl s LYS 25 N -2.72 4.17 -0.06 0.37 2.47 -1.26 -0.94 119.74 121.78 2nvl s LYS 25 Ca -0.04 -0.13 -0.01 0.00 -1.56 0.00 0.00 55.97 54.23 2nvl s LYS 25 Cb -0.00 -3.46 -0.03 0.00 -1.46 0.00 0.00 37.83 32.87 2nvl s LYS 25 CO -0.04 0.19 0.02 -0.51 0.16 0.00 0.00 175.35 175.18 2nvl s LEU 26 N 0.65 3.67 0.00 5.43 1.43 0.14 -0.47 118.68 129.53 2nvl s LEU 26 Ca 0.11 0.13 0.27 0.00 -1.03 0.00 0.00 54.13 53.61 2nvl s LEU 26 Cb -0.12 -1.95 1.24 0.00 0.03 0.00 0.00 46.19 45.38 2nvl s LEU 26 CO 0.02 0.34 1.84 -0.81 0.23 0.00 0.00 176.35 177.97 2nvl n PRO 27 N 1.81 1.43 -0.31 1.29 -0.04 -1.26 -1.45 135.00 136.47 2nvl n PRO 27 Ca -0.17 -0.63 0.14 0.00 -0.04 0.00 0.00 63.50 62.80 2nvl n PRO 27 Cb 0.53 -1.45 0.32 0.00 -0.04 0.00 0.00 33.50 32.86 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 1.45 0.35 -0.45 3.54 5.19 -1.92 -1.30 116.42 123.27 2nvl h ASP 28 Ca 0.00 0.16 0.07 0.00 -0.62 0.00 0.00 57.03 56.64 2nvl h ASP 28 Cb 0.31 0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.93 2nvl h ASP 28 CO 0.00 -0.01 0.31 -0.74 -3.12 0.00 0.00 179.24 175.68 2nvl h HIS 29 N 0.40 0.31 0.04 4.55 2.76 -1.13 -2.01 115.15 120.07 2nvl h HIS 29 Ca 0.57 0.01 -0.37 0.00 -2.20 0.00 0.00 60.37 58.38 2nvl h HIS 29 Cb 1.10 -0.10 -0.05 0.00 1.55 0.00 0.00 27.41 29.92 2nvl h HIS 29 CO -0.13 0.16 -2.18 0.66 -1.30 0.00 0.00 177.93 175.15 2nvl n TYR 30 N -4.47 0.56 -0.20 5.26 4.02 -0.57 -4.00 117.16 117.77 2nvl n TYR 30 Ca 0.06 0.15 0.01 0.00 -0.01 0.00 0.00 57.90 58.11 2nvl n TYR 30 Cb 0.30 -1.07 0.10 0.00 -0.02 0.00 0.00 39.34 38.65 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 -0.24 0.52 -0.37 -0.72 2.07 -1.32 -0.49 116.25 115.69 2nvl h VAL 31 Ca -0.52 -0.04 0.11 0.00 0.82 0.00 0.00 66.70 67.07 2nvl h VAL 31 Cb 1.83 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 2nvl h VAL 31 CO -0.09 0.02 0.32 0.28 0.02 0.00 0.00 177.57 178.12 2nvl h SER 32 N 0.13 0.00 -0.16 0.57 0.02 -1.55 -0.43 113.55 112.13 2nvl h SER 32 Ca 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 2nvl h SER 32 Cb 0.50 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.04 2nvl h SER 32 CO -0.51 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.18 2nvl n GLN 33 N -4.07 2.24 -1.10 3.45 6.02 -0.63 -4.94 117.38 118.34 2nvl n GLN 33 Ca 0.06 -1.83 -0.04 0.00 -0.01 0.00 0.00 57.00 55.19 2nvl n GLN 33 Cb 0.50 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 30.27 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 1.36 0.66 3.85 1.08 0.00 -0.17 -5.00 105.19 106.96 2nvl n GLY 34 Ca 0.17 -0.58 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 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 -1.85 3.30 0.61 1.61 -0.14 -0.29 -4.80 119.74 118.18 2nvl s LYS 35 Ca 0.00 -0.34 -0.11 0.00 -1.36 0.00 0.00 55.97 54.16 2nvl s LYS 35 Cb 0.00 -3.02 -0.04 0.00 -1.68 0.00 0.00 37.83 33.09 2nvl s LYS 35 CO 0.00 0.69 1.01 -1.58 -0.76 0.00 0.00 175.35 174.71 2nvl s TRP 36 N -1.21 3.62 0.04 3.18 0.52 -0.91 -3.91 118.94 120.28 2nvl s TRP 36 Ca 0.23 1.26 -0.05 0.00 0.02 0.00 0.00 56.10 57.56 2nvl s TRP 36 Cb -0.12 -2.69 -0.02 0.00 -1.15 0.00 0.00 33.47 29.49 2nvl s TRP 36 CO 0.14 -0.65 0.07 -0.59 0.02 0.00 0.00 176.95 175.94 2nvl s PHE 37 N -3.14 0.26 -0.30 -1.98 -0.12 -0.42 -0.37 117.98 111.90 2nvl s PHE 37 Ca 0.55 -0.62 -0.06 0.00 -0.05 0.00 0.00 56.93 56.75 2nvl s PHE 37 Cb -0.11 -0.18 0.02 0.00 -0.63 0.00 0.00 43.02 42.12 2nvl s PHE 37 CO 0.53 -0.37 0.06 0.08 -0.05 0.00 0.00 175.22 175.47 2nvl s VAL 38 N -2.90 3.70 -0.28 -2.49 1.01 0.06 -0.57 120.40 118.93 2nvl s VAL 38 Ca -0.02 -0.92 -0.17 0.00 0.00 0.00 0.00 61.98 60.86 2nvl s VAL 38 Cb 0.01 -2.98 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 2nvl s VAL 38 CO -0.06 -0.00 0.48 -0.22 0.00 0.00 0.00 175.10 175.30 2nvl s LEU 39 N 1.43 4.11 -0.07 3.92 0.20 -0.12 -1.46 118.68 126.69 2nvl s LEU 39 Ca 0.00 0.34 0.05 0.00 0.69 0.00 0.00 54.13 55.22 2nvl s LEU 39 Cb -0.18 -2.58 -0.01 0.00 -0.43 0.00 0.00 46.19 42.99 2nvl s LEU 39 CO 0.01 -0.30 -0.24 0.72 -0.29 0.00 0.00 176.35 176.26 2nvl s PHE 40 N 2.26 2.38 0.22 5.38 -0.12 -0.53 -0.87 117.98 126.70 2nvl s PHE 40 Ca 0.19 -0.77 0.06 0.00 -0.05 0.00 0.00 56.93 56.36 2nvl s PHE 40 Cb -0.16 -1.57 -0.04 0.00 -0.63 0.00 0.00 43.02 40.63 2nvl s PHE 40 CO 0.10 -0.26 0.17 -1.54 -0.05 0.00 0.00 175.22 173.64 2nvl s SER 41 N -0.01 5.48 -0.03 1.98 1.04 -0.15 -1.05 113.70 120.95 2nvl s SER 41 Ca -0.07 -0.22 -0.02 0.00 0.48 0.00 0.00 55.95 56.11 2nvl s SER 41 Cb -0.15 -1.39 0.02 0.00 0.10 0.00 0.00 66.02 64.60 2nvl s SER 41 CO 0.05 0.00 0.07 -1.00 0.98 0.00 0.00 173.24 173.34 2nvl s HIS 42 N -2.01 -0.07 0.24 5.02 3.76 0.97 -4.16 115.29 119.06 2nvl s HIS 42 Ca 0.32 0.22 -0.07 0.00 -0.15 0.00 0.00 55.06 55.39 2nvl s HIS 42 Cb -0.09 -0.06 0.26 0.00 1.11 0.00 0.00 32.58 33.80 2nvl s HIS 42 CO 0.24 -0.07 1.91 -1.35 -0.85 0.00 0.00 174.74 174.62 2nvl h PRO 43 N 6.57 1.21 -1.89 8.40 0.11 -1.81 -3.35 132.00 141.24 2nvl h PRO 43 Ca -0.33 -0.07 0.10 0.00 0.11 0.00 0.00 66.00 65.80 2nvl h PRO 43 Cb 1.17 -0.27 -0.19 0.00 0.11 0.00 0.00 31.00 31.82 2nvl h PRO 43 CO 0.46 0.80 0.52 0.00 -0.21 0.00 0.00 178.00 179.58 2nvl s ALA 44 N -6.11 -1.88 0.70 -0.75 0.00 -1.26 -4.14 121.76 108.31 2nvl s ALA 44 Ca -0.13 1.33 -0.14 0.00 0.00 0.00 0.00 51.96 53.01 2nvl s ALA 44 Cb 0.18 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.16 2nvl s ALA 44 CO 0.81 -0.49 1.13 -0.51 0.00 0.00 0.00 175.76 176.70 2nvl s ASP 45 N -1.77 4.71 -1.28 0.00 1.11 -1.26 -4.00 116.67 114.18 2nvl s ASP 45 Ca 0.01 2.07 -0.05 0.00 0.18 0.00 0.00 52.55 54.76 2nvl s ASP 45 Cb -0.01 -2.56 0.01 0.00 1.07 0.00 0.00 42.92 41.43 2nvl s ASP 45 CO -0.03 -1.90 1.10 0.49 1.18 0.00 0.00 175.17 176.01 2nvl n PHE 46 N -2.70 -2.58 -4.71 4.23 3.01 -1.26 -5.01 117.46 108.43 2nvl n PHE 46 Ca 0.11 0.98 -0.23 0.00 1.01 0.00 0.00 57.45 59.32 2nvl n PHE 46 Cb 0.52 -5.04 -0.15 0.00 -0.01 0.00 0.00 39.48 34.79 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 -3.33 1.20 0.02 4.37 -4.23 -1.26 -5.10 115.64 107.31 2nvl s THR 47 Ca 0.34 -0.65 -0.25 0.00 -1.18 0.00 0.00 61.69 59.95 2nvl s THR 47 Cb -0.15 -1.00 -0.18 0.00 1.34 0.00 0.00 72.50 72.51 2nvl s THR 47 CO 0.73 0.34 1.44 1.55 -0.54 0.00 0.00 174.62 178.14 2nvl h PRO 48 N 5.76 -0.01 -1.17 3.99 0.13 -1.95 -1.06 132.00 137.70 2nvl h PRO 48 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2nvl h PRO 48 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2nvl h PRO 48 CO 0.49 0.30 0.00 0.28 -0.23 0.00 0.00 178.00 178.83 2nvl n VAL 49 N -4.95 0.03 0.00 1.56 0.31 -1.26 -1.53 118.33 112.49 2nvl n VAL 49 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 2nvl n VAL 49 Cb 0.17 -0.32 0.00 0.00 -0.91 0.00 0.00 33.84 32.78 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 0.77 0.00 0.01 2.52 -1.04 -0.40 -1.53 114.28 114.61 2nvl n THR 51 Ca 0.00 0.00 -0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2nvl n THR 51 Cb 0.02 0.00 0.29 0.00 -1.82 0.00 0.00 70.33 68.82 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 1.20 -0.10 12.58 1.35 -1.55 -2.08 112.91 124.32 2nvl h THR 52 Ca 0.00 -0.83 -0.02 0.00 -0.55 0.00 0.00 66.41 65.01 2nvl h THR 52 Cb 0.00 0.99 -0.00 0.00 -1.73 0.00 0.00 68.15 67.41 2nvl h THR 52 CO 0.00 0.28 -0.02 -0.33 -0.25 0.00 0.00 175.52 175.20 2nvl h GLU 53 N 0.48 0.18 -0.94 4.72 5.08 -1.56 -1.54 114.58 121.01 2nvl h GLU 53 Ca 0.10 -0.07 0.04 0.00 -1.00 0.00 0.00 59.36 58.43 2nvl h GLU 53 Cb 0.36 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 2nvl h GLU 53 CO 0.01 0.49 0.61 0.74 -1.00 0.00 0.00 179.01 179.86 2nvl h PHE 54 N -0.13 1.14 -0.53 4.33 -1.00 -1.80 0.64 116.94 119.58 2nvl h PHE 54 Ca 0.03 0.03 -0.11 0.00 2.81 0.00 0.00 57.97 60.73 2nvl h PHE 54 Cb 0.41 -0.38 -0.02 0.00 3.61 0.00 0.00 35.95 39.58 2nvl h PHE 54 CO 0.05 0.64 -0.09 0.28 -1.61 0.00 0.00 178.31 177.57 2nvl h VAL 55 N 1.16 1.27 -0.31 -0.55 2.07 -1.35 -0.80 116.25 117.74 2nvl h VAL 55 Ca 0.38 -1.23 -0.18 0.00 0.82 0.00 0.00 66.70 66.49 2nvl h VAL 55 Cb 0.04 0.95 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2nvl h VAL 55 CO -0.13 0.43 -0.50 -1.28 0.02 0.00 0.00 177.57 176.11 2nvl h SER 56 N 0.88 0.98 -0.49 0.57 0.87 -0.18 -1.66 113.55 114.51 2nvl h SER 56 Ca 0.14 -0.52 -0.01 0.00 -1.23 0.00 0.00 61.79 60.17 2nvl h SER 56 Cb 0.64 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 2nvl h SER 56 CO 0.04 1.31 0.26 -0.26 -0.53 0.00 0.00 176.83 177.65 2nvl h PHE 57 N 0.68 0.69 -0.79 2.24 -1.00 -0.91 -2.77 116.94 115.09 2nvl h PHE 57 Ca 0.02 -0.02 0.07 0.00 2.81 0.00 0.00 57.97 60.85 2nvl h PHE 57 Cb 1.11 -0.22 -0.06 0.00 3.61 0.00 0.00 35.95 40.39 2nvl h PHE 57 CO 0.07 0.53 0.46 0.00 -1.61 0.00 0.00 178.31 177.76 2nvl h ALA 58 N 1.10 1.09 -0.23 2.45 0.00 -0.94 -1.37 119.26 121.35 2nvl h ALA 58 Ca 0.17 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.11 2nvl h ALA 58 Cb 0.08 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2nvl h ALA 58 CO -0.03 0.14 0.16 0.00 0.00 0.00 0.00 179.25 179.53 2nvl h ARG 59 N 0.82 0.27 -0.53 0.00 -0.00 -1.15 -2.61 114.38 111.18 2nvl h ARG 59 Ca 0.36 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.82 2nvl h ARG 59 Cb 0.24 -0.06 0.00 0.00 0.00 0.00 0.00 29.97 30.15 2nvl h ARG 59 CO -0.20 0.18 0.00 0.54 0.00 0.00 0.00 179.97 180.49 2nvl n ARG 60 N -4.50 2.59 -0.18 0.04 1.74 -0.59 -4.65 116.66 111.10 2nvl n ARG 60 Ca 0.01 -2.43 -0.01 0.00 -0.77 0.00 0.00 57.85 54.65 2nvl n ARG 60 Cb 0.10 -1.54 0.09 0.00 -1.02 0.00 0.00 32.46 30.09 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 4.41 0.20 -0.55 -1.55 3.20 -0.95 -1.16 116.97 120.57 2nvl h TYR 61 Ca 0.00 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.84 2nvl h TYR 61 Cb 0.99 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.23 2nvl h TYR 61 CO 0.35 -0.01 0.07 0.93 -1.64 0.00 0.00 178.16 177.86 2nvl h GLU 62 N 0.26 0.88 -0.83 1.82 3.07 -1.83 0.46 114.58 118.42 2nvl h GLU 62 Ca 0.28 -0.22 -0.00 0.00 -0.50 0.00 0.00 59.36 58.92 2nvl h GLU 62 Cb 0.39 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 28.15 2nvl h GLU 62 CO -0.36 0.84 0.51 -0.44 -1.40 0.00 0.00 179.01 178.16 2nvl h ASP 63 N 0.84 0.99 -0.05 1.42 3.32 -1.58 -0.97 116.42 120.39 2nvl h ASP 63 Ca 0.17 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 2nvl h ASP 63 Cb 0.40 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 2nvl h ASP 63 CO 0.01 0.75 -0.06 -0.26 -1.72 0.00 0.00 179.24 177.97 2nvl h PHE 64 N 1.14 0.16 -0.45 4.55 -1.00 -0.53 -2.92 116.94 117.90 2nvl h PHE 64 Ca 0.30 -0.05 0.08 0.00 2.81 0.00 0.00 57.97 61.11 2nvl h PHE 64 Cb -0.06 -0.03 -0.07 0.00 3.61 0.00 0.00 35.95 39.40 2nvl h PHE 64 CO 0.00 0.60 0.04 1.96 -1.61 0.00 0.00 178.31 179.30 2nvl h GLN 65 N -0.33 0.16 -0.29 1.51 1.08 -0.85 -0.17 115.11 116.22 2nvl h GLN 65 Ca 0.01 -0.01 0.08 0.00 -1.45 0.00 0.00 58.65 57.28 2nvl h GLN 65 Cb 0.57 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 2nvl h GLN 65 CO 0.01 0.10 0.22 0.00 -0.95 0.00 0.00 178.83 178.22 2nvl h ARG 66 N 0.16 0.00 -0.06 1.46 3.08 -1.20 0.33 114.38 118.16 2nvl h ARG 66 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 2nvl h ARG 66 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 2nvl h ARG 66 CO -0.34 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 179.84 2nvl n LEU 67 N -4.35 0.66 -1.47 3.04 4.77 -0.18 -4.90 117.00 114.57 2nvl n LEU 67 Ca 0.04 -0.27 -0.08 0.00 -0.03 0.00 0.00 56.01 55.67 2nvl n LEU 67 Cb 0.38 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.46 2nvl n LEU 67 CO 0.34 0.14 0.06 0.61 -1.33 0.00 0.00 177.39 177.22 2nvl n GLY 68 N 0.93 0.40 2.87 -0.72 0.00 0.12 -4.93 105.19 103.85 2nvl n GLY 68 Ca 0.15 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 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 -3.02 0.64 0.23 1.61 1.01 -0.58 -2.13 120.40 118.15 2nvl s VAL 69 Ca 0.18 -0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.00 2nvl s VAL 69 Cb -0.08 -0.70 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 2nvl s VAL 69 CO 0.22 0.28 0.49 -1.81 0.00 0.00 0.00 175.10 174.27 2nvl s ASP 70 N 1.43 6.47 -0.04 3.32 1.01 0.50 -3.49 116.67 125.87 2nvl s ASP 70 Ca -0.02 0.66 0.01 0.00 0.71 0.00 0.00 52.55 53.91 2nvl s ASP 70 Cb -0.13 -2.12 -0.03 0.00 1.01 0.00 0.00 42.92 41.64 2nvl s ASP 70 CO -0.03 -0.09 -0.04 -0.76 0.21 0.00 0.00 175.17 174.45 2nvl s LEU 71 N -3.20 3.30 -0.10 1.23 1.43 -1.26 -0.76 118.68 119.32 2nvl s LEU 71 Ca 0.43 -0.03 -0.05 0.00 -1.03 0.00 0.00 54.13 53.45 2nvl s LEU 71 Cb -0.11 -1.81 0.05 0.00 0.03 0.00 0.00 46.19 44.35 2nvl s LEU 71 CO 0.27 0.33 0.24 -0.51 0.23 0.00 0.00 176.35 176.91 2nvl s ILE 72 N -0.93 -0.04 0.60 -0.59 2.07 -0.54 -4.11 121.20 117.67 2nvl s ILE 72 Ca 0.15 0.14 0.04 0.00 -1.41 0.00 0.00 60.65 59.58 2nvl s ILE 72 Cb -0.11 -0.37 0.08 0.00 0.13 0.00 0.00 42.46 42.18 2nvl s ILE 72 CO 0.05 0.06 0.82 -0.83 -1.91 0.00 0.00 174.94 173.13 2nvl s GLY 73 N 1.22 1.79 -0.15 1.50 0.00 -0.61 -1.46 107.32 109.61 2nvl s GLY 73 Ca -0.09 -1.76 -0.10 0.00 0.00 0.00 0.00 44.72 42.77 2nvl s GLY 73 CO -0.08 -1.34 0.37 -2.27 0.00 0.00 0.00 173.10 169.78 2nvl s LEU 74 N -4.80 0.24 0.02 0.66 1.98 -0.21 -0.20 118.68 116.37 2nvl s LEU 74 Ca 0.61 0.78 -0.12 0.00 -2.89 0.00 0.00 54.13 52.51 2nvl s LEU 74 Cb -0.07 1.22 0.01 0.00 0.66 0.00 0.00 46.19 48.01 2nvl s LEU 74 CO 0.40 -0.16 0.26 -0.55 -1.89 0.00 0.00 176.35 174.40 2nvl s SER 75 N 0.93 -0.08 -1.15 3.68 0.15 -0.96 -0.02 113.70 116.25 2nvl s SER 75 Ca -0.06 -0.16 -0.12 0.00 0.70 0.00 0.00 55.95 56.31 2nvl s SER 75 Cb -0.07 0.31 0.21 0.00 -1.71 0.00 0.00 66.02 64.76 2nvl s SER 75 CO -0.07 -0.52 1.28 -0.69 1.20 0.00 0.00 173.24 174.44 2nvl s VAL 76 N -2.04 5.40 -0.07 4.45 1.01 -1.26 -1.62 120.40 126.27 2nvl s VAL 76 Ca -0.09 -2.87 -0.30 0.00 0.00 0.00 0.00 61.98 58.72 2nvl s VAL 76 Cb -0.03 -4.78 0.10 0.00 0.00 0.00 0.00 36.38 31.67 2nvl s VAL 76 CO -0.01 -1.44 0.86 -1.81 0.00 0.00 0.00 175.10 172.71 2nvl s ASP 77 N 2.29 -0.46 1.00 3.32 -0.00 -1.26 -4.78 116.67 116.78 2nvl s ASP 77 Ca 0.37 0.37 -0.12 0.00 -0.00 0.00 0.00 52.55 53.17 2nvl s ASP 77 Cb -0.06 0.40 0.19 0.00 -0.00 0.00 0.00 42.92 43.46 2nvl s ASP 77 CO -0.04 -0.52 1.08 -0.94 -0.00 0.00 0.00 175.17 174.75 2nvl s SER 78 N -1.56 2.48 0.39 0.27 1.04 -1.26 -3.49 113.70 111.56 2nvl s SER 78 Ca -0.02 1.42 0.16 0.00 0.48 0.00 0.00 55.95 57.99 2nvl s SER 78 Cb -0.00 -2.11 0.80 0.00 0.10 0.00 0.00 66.02 64.81 2nvl s SER 78 CO 0.00 -3.26 1.83 1.62 0.98 0.00 0.00 173.24 174.42 2nvl h VAL 79 N -1.98 1.09 -0.36 5.02 3.04 -1.96 -2.58 116.25 118.52 2nvl h VAL 79 Ca -0.54 -1.28 -0.16 0.00 -1.01 0.00 0.00 66.70 63.71 2nvl h VAL 79 Cb 1.31 1.72 -0.00 0.00 -2.01 0.00 0.00 31.29 32.31 2nvl h VAL 79 CO 0.54 0.34 -0.42 -0.26 -1.01 0.00 0.00 177.57 176.76 2nvl h PHE 80 N 0.00 1.10 -0.35 3.17 -1.00 -2.00 -1.99 116.94 115.87 2nvl h PHE 80 Ca -0.00 -0.34 0.02 0.00 2.81 0.00 0.00 57.97 60.46 2nvl h PHE 80 Cb 0.69 -0.23 -0.03 0.00 3.61 0.00 0.00 35.95 40.00 2nvl h PHE 80 CO 0.00 1.17 0.18 0.77 -1.61 0.00 0.00 178.31 178.82 2nvl h SER 81 N 0.73 0.27 -0.51 2.17 0.02 -1.88 -1.99 113.55 112.35 2nvl h SER 81 Ca 0.05 0.01 0.10 0.00 -0.84 0.00 0.00 61.79 61.12 2nvl h SER 81 Cb 1.02 -0.04 -0.09 0.00 0.14 0.00 0.00 62.40 63.43 2nvl h SER 81 CO 0.10 0.20 -0.01 0.45 -1.14 0.00 0.00 176.83 176.42 2nvl h HIS 82 N 0.37 -0.06 -0.25 3.45 3.86 -1.24 0.31 115.15 121.58 2nvl h HIS 82 Ca 0.14 0.04 -0.08 0.00 -1.16 0.00 0.00 60.37 59.31 2nvl h HIS 82 Cb 0.05 0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 2nvl h HIS 82 CO -0.09 -0.13 -0.15 0.82 0.86 0.00 0.00 177.93 179.24 2nvl h ILE 83 N 0.10 1.30 -0.85 2.45 2.04 -1.30 -0.76 117.51 120.50 2nvl h ILE 83 Ca 0.26 -1.25 0.08 0.00 1.00 0.00 0.00 64.86 64.95 2nvl h ILE 83 Cb 0.40 1.57 -0.07 0.00 -0.74 0.00 0.00 36.82 37.98 2nvl h ILE 83 CO -0.44 0.39 0.51 0.11 0.00 0.00 0.00 178.15 178.72 2nvl h LYS 84 N 0.27 0.87 -0.16 2.37 1.79 -1.01 -1.09 116.57 119.60 2nvl h LYS 84 Ca 0.05 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 2nvl h LYS 84 Cb 0.66 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 2nvl h LYS 84 CO 0.04 0.57 -0.02 2.35 -1.08 0.00 0.00 179.45 181.32 2nvl h TRP 85 N 0.89 0.34 -0.84 -1.35 7.01 -0.70 0.43 115.95 121.73 2nvl h TRP 85 Ca 0.39 -0.07 0.06 0.00 2.11 0.00 0.00 58.89 61.39 2nvl h TRP 85 Cb 0.26 -0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 27.18 2nvl h TRP 85 CO -0.04 0.55 0.52 0.87 -2.79 0.00 0.00 178.44 177.55 2nvl h LYS 86 N 0.03 0.92 -0.31 2.65 1.57 -1.03 -1.11 116.57 119.29 2nvl h LYS 86 Ca 0.04 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.63 2nvl h LYS 86 Cb 0.43 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 2nvl h LYS 86 CO 0.01 0.61 -0.36 1.49 -0.57 0.00 0.00 179.45 180.63 2nvl h GLU 87 N 0.95 0.70 -0.05 3.15 4.81 -1.05 -1.47 114.58 121.62 2nvl h GLU 87 Ca 0.37 -0.35 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2nvl h GLU 87 Cb 0.18 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 2nvl h GLU 87 CO -0.18 0.96 -0.01 2.35 -0.73 0.00 0.00 179.01 181.40 2nvl h TRP 88 N 0.59 -0.02 0.10 0.92 7.01 -0.37 0.09 115.95 124.26 2nvl h TRP 88 Ca 0.06 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.06 2nvl h TRP 88 Cb 0.89 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.96 2nvl h TRP 88 CO 0.04 -0.02 -0.08 0.82 -2.79 0.00 0.00 178.44 176.42 2nvl h ILE 89 N -0.00 0.83 -0.93 2.65 2.04 -0.90 0.24 117.51 121.44 2nvl h ILE 89 Ca 0.02 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.92 2nvl h ILE 89 Cb 0.03 0.83 -0.06 0.00 -0.74 0.00 0.00 36.82 36.89 2nvl h ILE 89 CO -0.05 0.00 0.61 -0.08 0.00 0.00 0.00 178.15 178.63 2nvl h GLU 90 N -0.18 1.11 0.03 2.37 4.81 -1.20 0.41 114.58 121.93 2nvl h GLU 90 Ca -0.00 -0.07 -0.23 0.00 -0.13 0.00 0.00 59.36 58.93 2nvl h GLU 90 Cb 0.16 -0.25 0.02 0.00 0.63 0.00 0.00 28.75 29.31 2nvl h GLU 90 CO -0.01 0.74 -0.92 -0.09 -0.73 0.00 0.00 179.01 178.00 2nvl h ARG 91 N 1.15 0.57 0.00 1.92 2.43 -0.48 -2.72 114.38 117.26 2nvl h ARG 91 Ca 0.38 -0.65 -0.21 0.00 -0.81 0.00 0.00 59.98 58.68 2nvl h ARG 91 Cb 0.05 0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 29.76 2nvl h ARG 91 CO -0.12 1.26 -1.52 0.72 -1.51 0.00 0.00 179.97 178.80 2nvl n HIS 92 N -3.98 0.98 -0.01 2.20 8.25 0.79 -4.38 115.22 119.07 2nvl n HIS 92 Ca -0.11 0.34 0.07 0.00 -0.26 0.00 0.00 57.72 57.75 2nvl n HIS 92 Cb 0.83 -1.12 -0.11 0.00 1.12 0.00 0.00 29.99 30.70 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 -2.94 0.03 -1.06 1.59 5.41 0.14 -4.60 119.36 117.94 2nvl n ILE 93 Ca -0.12 -0.34 -0.02 0.00 1.00 0.00 0.00 62.75 63.26 2nvl n ILE 93 Cb 0.91 0.14 -0.01 0.00 -0.71 0.00 0.00 39.64 39.97 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 1.69 0.54 3.32 7.39 0.00 -1.02 -4.81 105.19 112.30 2nvl n GLY 94 Ca -0.03 -0.86 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.06 3.05 0.05 1.61 1.01 -1.25 -4.97 120.40 117.84 2nvl s VAL 95 Ca 0.00 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 61.05 2nvl s VAL 95 Cb 0.00 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 2nvl s VAL 95 CO 0.00 0.49 1.01 -0.60 0.00 0.00 0.00 175.10 176.00 2nvl s ARG 96 N 0.86 4.59 -0.52 2.72 3.00 -1.26 -3.09 118.95 125.25 2nvl s ARG 96 Ca -0.03 1.49 -0.18 0.00 -1.00 0.00 0.00 55.73 56.00 2nvl s ARG 96 Cb -0.15 -3.41 0.07 0.00 0.00 0.00 0.00 34.95 31.46 2nvl s ARG 96 CO 0.00 0.01 0.61 0.42 0.00 0.00 0.00 175.30 176.34 2nvl s ILE 97 N 0.65 4.92 -0.64 4.11 -1.09 -1.26 -4.93 121.20 122.95 2nvl s ILE 97 Ca 0.51 -0.73 0.25 0.00 -2.23 0.00 0.00 60.65 58.45 2nvl s ILE 97 Cb -0.23 -4.32 0.17 0.00 -1.58 0.00 0.00 42.46 36.50 2nvl s ILE 97 CO 0.29 -0.85 1.53 1.55 -1.23 0.00 0.00 174.94 176.23 2nvl h PRO 98 N 9.00 0.00 -6.47 2.79 0.13 -1.95 -3.47 132.00 132.03 2nvl h PRO 98 Ca -0.28 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.34 2nvl h PRO 98 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 2nvl h PRO 98 CO 0.99 0.00 -0.17 -0.59 -0.23 0.00 0.00 178.00 178.00 2nvl s PHE 99 N -3.15 3.48 0.66 1.56 -0.12 -1.26 -5.05 117.98 114.11 2nvl s PHE 99 Ca 0.08 0.56 -0.16 0.00 -0.05 0.00 0.00 56.93 57.36 2nvl s PHE 99 Cb 0.12 -2.04 0.00 0.00 -0.63 0.00 0.00 43.02 40.47 2nvl s PHE 99 CO 0.67 0.18 1.14 -1.25 -0.05 0.00 0.00 175.22 175.91 2nvl s PRO 100 N -3.68 2.68 -0.13 1.99 0.04 -1.26 -4.88 135.00 129.77 2nvl s PRO 100 Ca 0.43 1.53 0.03 0.00 0.04 0.00 0.00 61.00 63.03 2nvl s PRO 100 Cb -0.11 -1.92 0.01 0.00 0.04 0.00 0.00 34.50 32.52 2nvl s PRO 100 CO 0.31 -1.37 -0.22 0.42 0.04 0.00 0.00 177.00 176.18 2nvl s ILE 101 N -2.15 2.08 0.24 0.56 1.01 -1.26 -1.58 121.20 120.10 2nvl s ILE 101 Ca 0.70 -0.98 -0.30 0.00 0.00 0.00 0.00 60.65 60.07 2nvl s ILE 101 Cb -0.24 -1.82 -0.10 0.00 0.01 0.00 0.00 42.46 40.31 2nvl s ILE 101 CO 0.41 0.55 1.47 -0.63 0.00 0.00 0.00 174.94 176.74 2nvl s ILE 102 N 0.70 2.63 -0.34 2.92 1.01 0.72 -1.95 121.20 126.89 2nvl s ILE 102 Ca -0.10 0.51 -0.16 0.00 0.00 0.00 0.00 60.65 60.90 2nvl s ILE 102 Cb -0.16 -3.33 -0.01 0.00 0.01 0.00 0.00 42.46 38.97 2nvl s ILE 102 CO 0.01 0.07 0.42 0.00 0.00 0.00 0.00 174.94 175.44 2nvl s ALA 103 N 0.20 3.49 -0.48 9.38 0.00 0.13 -2.27 121.76 132.21 2nvl s ALA 103 Ca 0.61 -1.12 0.07 0.00 0.00 0.00 0.00 51.96 51.52 2nvl s ALA 103 Cb -0.42 -2.88 0.39 0.00 0.00 0.00 0.00 23.12 20.20 2nvl s ALA 103 CO 0.41 -1.10 1.00 -3.47 0.00 0.00 0.00 175.76 172.61 2nvl n ASP 104 N 5.51 4.04 -4.76 0.00 2.03 -0.64 -4.56 116.55 118.16 2nvl n ASP 104 Ca -0.07 -3.56 -0.36 0.00 0.52 0.00 0.00 54.79 51.31 2nvl n ASP 104 Cb 0.49 -0.52 0.02 0.00 -0.72 0.00 0.00 41.12 40.39 2nvl n ASP 104 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 2nvl s PRO 105 N -3.39 3.22 0.00 -0.67 0.02 -1.26 -0.14 135.00 132.78 2nvl s PRO 105 Ca 0.46 1.78 0.00 0.00 0.02 0.00 0.00 61.00 63.26 2nvl s PRO 105 Cb 0.35 -2.05 0.00 0.00 0.02 0.00 0.00 34.50 32.82 2nvl s PRO 105 CO -0.14 -0.99 0.00 1.04 -0.33 0.00 0.00 177.00 176.57 2nvl n GLN 106 N -1.29 0.00 -2.01 5.54 1.13 -1.26 -4.36 117.38 115.13 2nvl n GLN 106 Ca 0.12 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 55.03 2nvl n GLN 106 Cb 0.49 -0.90 -0.03 0.00 0.11 0.00 0.00 30.24 29.91 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 -2.00 0.28 0.16 1.08 0.00 0.80 -4.90 105.19 100.61 2nvl n GLY 107 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 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 0.68 -0.50 2.61 2.02 -1.78 -1.11 112.91 114.83 2nvl h THR 108 Ca -0.32 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 66.81 2nvl h THR 108 Cb 1.12 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.14 2nvl h THR 108 CO 0.42 0.01 0.20 0.58 0.37 0.00 0.00 175.52 177.09 2nvl h VAL 109 N 0.04 1.21 -0.94 3.16 2.07 -1.90 -1.94 116.25 117.96 2nvl h VAL 109 Ca 0.18 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 67.04 2nvl h VAL 109 Cb 0.26 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 2nvl h VAL 109 CO -0.34 0.25 0.62 0.00 0.02 0.00 0.00 177.57 178.12 2nvl h ALA 110 N 1.04 1.19 -0.24 1.67 0.00 -1.87 -1.01 119.26 120.05 2nvl h ALA 110 Ca 0.17 -0.07 -0.20 0.00 0.00 0.00 0.00 54.91 54.80 2nvl h ALA 110 Cb 0.20 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2nvl h ALA 110 CO -0.01 0.60 -0.64 0.00 0.00 0.00 0.00 179.25 179.20 2nvl h ARG 111 N 1.28 0.86 -0.76 0.00 3.08 -1.08 0.93 114.38 118.69 2nvl h ARG 111 Ca 0.34 -0.60 0.03 0.00 0.07 0.00 0.00 59.98 59.82 2nvl h ARG 111 Cb -0.13 0.09 -0.04 0.00 0.08 0.00 0.00 29.97 29.96 2nvl h ARG 111 CO -0.07 1.22 0.49 -0.09 -1.07 0.00 0.00 179.97 180.45 2nvl h ARG 112 N 0.63 0.94 -0.03 0.04 9.65 -1.00 -1.10 114.38 123.51 2nvl h ARG 112 Ca -0.01 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 58.81 2nvl h ARG 112 Cb 1.25 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 29.62 2nvl h ARG 112 CO 0.14 0.62 0.00 1.28 2.80 0.00 0.00 179.97 184.81 2nvl n LEU 113 N -4.60 0.58 -2.88 3.80 4.77 -0.41 -4.63 117.00 113.63 2nvl n LEU 113 Ca 0.08 -0.22 -0.20 0.00 -0.03 0.00 0.00 56.01 55.64 2nvl n LEU 113 Cb 0.07 -0.02 0.05 0.00 -2.33 0.00 0.00 43.42 41.19 2nvl n LEU 113 CO 0.34 0.11 0.09 0.61 -1.33 0.00 0.00 177.39 177.20 2nvl n GLY 114 N 0.99 -0.37 0.67 -0.72 0.00 -0.42 -4.42 105.19 100.93 2nvl n GLY 114 Ca 0.19 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.40 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 -3.91 2.08 -4.49 0.99 4.77 0.31 -4.64 117.00 112.10 2nvl n LEU 115 Ca -0.06 -0.76 -0.42 0.00 -0.03 0.00 0.00 56.01 54.74 2nvl n LEU 115 Cb 0.59 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.60 2nvl n LEU 115 CO 0.47 0.38 1.08 -0.76 -1.33 0.00 0.00 177.39 177.23 2nvl s LEU 116 N -1.85 4.20 0.00 2.23 1.43 -1.25 -1.72 118.68 121.71 2nvl s LEU 116 Ca 0.35 -1.39 0.06 0.00 -1.03 0.00 0.00 54.13 52.11 2nvl s LEU 116 Cb 0.20 -2.47 0.09 0.00 0.03 0.00 0.00 46.19 44.04 2nvl s LEU 116 CO 0.31 -1.39 0.70 1.41 0.23 0.00 0.00 176.35 177.61 2nvl n HIS 117 N 7.88 -2.60 -0.18 0.29 8.25 -1.26 -4.80 115.22 122.79 2nvl n HIS 117 Ca 0.16 -1.64 -0.08 0.00 -0.26 0.00 0.00 57.72 55.90 2nvl n HIS 117 Cb 0.49 -0.49 0.05 0.00 1.12 0.00 0.00 29.99 31.15 2nvl n HIS 117 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2nvl h ALA 118 N -0.04 0.86 0.00 -1.41 0.00 -1.99 -1.73 119.26 114.96 2nvl h ALA 118 Ca -0.23 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 2nvl h ALA 118 Cb 1.01 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 2nvl h ALA 118 CO 0.31 0.66 -0.10 1.05 0.00 0.00 0.00 179.25 181.16 2nvl h GLU 119 N 0.91 0.00 0.00 0.00 4.11 -1.96 -3.41 114.58 114.23 2nvl h GLU 119 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.59 2nvl h GLU 119 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2nvl h GLU 119 CO 0.04 0.10 0.00 0.43 0.07 0.00 0.00 179.01 179.65 2nvl n SER 120 N -3.96 0.00 0.00 3.06 7.64 -0.65 -4.88 113.62 114.83 2nvl n SER 120 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2nvl n SER 120 Cb 0.19 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 2nvl n SER 120 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2nvl n ALA 121 N -3.00 0.00 -0.01 -0.43 0.00 -1.23 -4.47 120.51 111.37 2nvl n ALA 121 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2nvl n ALA 121 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 2nvl n ALA 121 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2nvl n THR 122 N 0.00 0.07 -3.98 0.00 -1.04 -1.26 -4.97 114.28 103.10 2nvl n THR 122 Ca 0.00 -0.03 -0.34 0.00 -2.04 0.00 0.00 64.05 61.64 2nvl n THR 122 Cb 0.00 -0.55 -0.15 0.00 -1.82 0.00 0.00 70.33 67.82 2nvl n THR 122 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 2nvl s HIS 123 N -2.02 2.91 -0.12 -1.42 4.02 -1.26 -4.98 115.29 112.41 2nvl s HIS 123 Ca -0.02 -1.20 -0.11 0.00 1.02 0.00 0.00 55.06 54.76 2nvl s HIS 123 Cb 0.00 -2.04 -0.05 0.00 -1.02 0.00 0.00 32.58 29.47 2nvl s HIS 123 CO 0.03 -0.64 0.48 2.41 1.02 0.00 0.00 174.74 178.03 2nvl n THR 124 N 4.73 0.00 -0.81 1.30 -1.04 -1.26 -4.27 114.28 112.94 2nvl n THR 124 Ca -0.19 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.55 2nvl n THR 124 Cb 0.50 -0.12 0.02 0.00 -1.82 0.00 0.00 70.33 68.91 2nvl n THR 124 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 2nvl n VAL 125 N 1.40 0.00 -3.06 12.58 3.14 -0.70 -3.32 118.33 128.37 2nvl n VAL 125 Ca 0.12 -0.35 -0.45 0.00 -2.96 0.00 0.00 64.34 60.70 2nvl n VAL 125 Cb -0.01 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 32.76 2nvl n VAL 125 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2nvl s ARG 126 N -1.01 3.87 0.32 1.45 1.70 -1.23 -4.43 118.95 119.61 2nvl s ARG 126 Ca 0.35 -2.39 0.03 0.00 -0.47 0.00 0.00 55.73 53.25 2nvl s ARG 126 Cb -0.26 -4.84 -0.03 0.00 -0.57 0.00 0.00 34.95 29.26 2nvl s ARG 126 CO 0.52 -1.62 0.48 0.20 -1.08 0.00 0.00 175.30 173.81 2nvl s GLY 127 N 2.77 1.33 -0.04 3.88 0.00 -1.26 -2.50 107.32 111.50 2nvl s GLY 127 Ca 0.34 -1.09 0.01 0.00 0.00 0.00 0.00 44.72 43.98 2nvl s GLY 127 CO -0.06 -1.04 -0.03 0.14 0.00 0.00 0.00 173.10 172.11 2nvl s VAL 128 N -2.20 0.42 -0.14 1.40 1.01 -0.18 -0.98 120.40 119.73 2nvl s VAL 128 Ca 0.39 -0.06 0.02 0.00 0.00 0.00 0.00 61.98 62.33 2nvl s VAL 128 Cb -0.09 -0.47 0.00 0.00 0.00 0.00 0.00 36.38 35.82 2nvl s VAL 128 CO 0.33 0.20 -0.20 -0.36 0.00 0.00 0.00 175.10 175.07 2nvl s PHE 129 N 0.93 2.70 -0.27 5.22 0.40 -0.05 -2.21 117.98 124.69 2nvl s PHE 129 Ca -0.11 -1.17 -0.10 0.00 -0.60 0.00 0.00 56.93 54.96 2nvl s PHE 129 Cb -0.14 -1.82 -0.04 0.00 0.51 0.00 0.00 43.02 41.52 2nvl s PHE 129 CO -0.00 -0.52 0.14 0.42 0.70 0.00 0.00 175.22 175.96 2nvl s ILE 130 N 0.72 4.89 -0.07 0.64 1.01 -0.76 -0.95 121.20 126.69 2nvl s ILE 130 Ca -0.08 0.01 0.05 0.00 0.00 0.00 0.00 60.65 60.62 2nvl s ILE 130 Cb -0.16 -3.33 -0.00 0.00 0.01 0.00 0.00 42.46 38.98 2nvl s ILE 130 CO 0.01 0.27 -0.21 -0.69 0.00 0.00 0.00 174.94 174.32 2nvl s VAL 131 N 1.70 1.81 0.87 2.92 1.01 0.26 -0.48 120.40 128.49 2nvl s VAL 131 Ca 0.07 -0.90 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 2nvl s VAL 131 Cb -0.16 -1.56 0.18 0.00 0.00 0.00 0.00 36.38 34.84 2nvl s VAL 131 CO 0.08 0.51 1.19 1.51 0.00 0.00 0.00 175.10 178.39 2nvl s ASP 132 N 0.16 3.58 0.00 3.32 1.47 0.19 -1.31 116.67 124.08 2nvl s ASP 132 Ca -0.11 -0.05 0.12 0.00 1.18 0.00 0.00 52.55 53.70 2nvl s ASP 132 Cb -0.15 -0.11 0.73 0.00 -0.34 0.00 0.00 42.92 43.05 2nvl s ASP 132 CO 0.05 -2.40 1.19 0.00 0.68 0.00 0.00 175.17 174.69 2nvl n ALA 133 N -3.39 2.16 0.96 2.11 0.00 -1.25 -0.98 120.51 120.12 2nvl n ALA 133 Ca 0.16 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.63 2nvl n ALA 133 Cb 0.60 -1.20 0.09 0.00 0.00 0.00 0.00 19.45 18.94 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 -0.82 2.11 -0.55 0.00 1.74 -1.26 -4.65 116.66 113.22 2nvl n ARG 134 Ca 0.09 -1.79 0.00 0.00 -0.77 0.00 0.00 57.85 55.38 2nvl n ARG 134 Cb 0.04 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 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 1.30 0.76 3.73 -0.13 0.00 -0.15 -4.98 105.19 105.72 2nvl n GLY 135 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.83 5.11 0.01 1.61 1.01 -1.25 0.13 120.40 124.18 2nvl s VAL 136 Ca 0.00 1.16 -0.30 0.00 0.00 0.00 0.00 61.98 62.84 2nvl s VAL 136 Cb 0.00 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 2nvl s VAL 136 CO 0.00 0.31 1.36 -0.63 0.00 0.00 0.00 175.10 176.14 2nvl s ILE 137 N 0.59 3.76 -0.08 2.22 1.01 0.12 -0.64 121.20 128.19 2nvl s ILE 137 Ca 0.31 1.17 0.06 0.00 0.00 0.00 0.00 60.65 62.18 2nvl s ILE 137 Cb -0.16 -3.75 -0.08 0.00 0.01 0.00 0.00 42.46 38.48 2nvl s ILE 137 CO 0.14 0.02 0.15 0.54 0.00 0.00 0.00 174.94 175.79 2nvl n ARG 138 N 5.07 1.53 -3.56 2.79 5.12 0.37 -0.70 116.66 127.27 2nvl n ARG 138 Ca 0.12 -0.04 -0.15 0.00 -1.93 0.00 0.00 57.85 55.86 2nvl n ARG 138 Cb 0.44 -1.03 -0.06 0.00 -1.16 0.00 0.00 32.46 30.65 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 -2.16 0.00 -0.02 0.55 2.01 -1.18 -4.91 115.64 109.94 2nvl s THR 139 Ca -0.01 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.99 2nvl s THR 139 Cb 0.04 -1.00 0.03 0.00 0.01 0.00 0.00 72.50 71.58 2nvl s THR 139 CO 0.23 0.00 0.03 -0.04 -0.69 0.00 0.00 174.62 174.15 2nvl s MET 140 N -0.78 0.01 -0.07 4.92 -1.94 -1.26 -1.82 119.30 118.36 2nvl s MET 140 Ca -0.06 0.17 0.04 0.00 -1.71 0.00 0.00 55.69 54.13 2nvl s MET 140 Cb -0.01 -0.28 -0.01 0.00 2.01 0.00 0.00 34.83 36.53 2nvl s MET 140 CO 0.05 -0.16 -0.20 -0.51 -0.01 0.00 0.00 175.02 174.19 2nvl s LEU 141 N 1.05 2.37 -0.33 -0.03 1.43 -0.94 -4.95 118.68 117.29 2nvl s LEU 141 Ca -0.09 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.64 2nvl s LEU 141 Cb -0.13 -1.47 0.10 0.00 0.03 0.00 0.00 46.19 44.72 2nvl s LEU 141 CO -0.03 0.25 0.06 -0.31 0.23 0.00 0.00 176.35 176.55 2nvl s TYR 142 N -0.18 3.21 0.17 0.29 1.51 -1.26 -1.01 117.35 120.09 2nvl s TYR 142 Ca -0.02 -2.65 -0.03 0.00 -1.01 0.00 0.00 57.07 53.36 2nvl s TYR 142 Cb -0.14 -2.58 -0.05 0.00 -0.11 0.00 0.00 41.96 39.09 2nvl s TYR 142 CO 0.03 -0.93 0.39 0.71 -1.11 0.00 0.00 175.55 174.65 2nvl s TYR 143 N 1.10 3.48 0.75 2.71 1.51 -1.04 -5.01 117.35 120.84 2nvl s TYR 143 Ca 0.10 0.47 -0.11 0.00 -1.01 0.00 0.00 57.07 56.52 2nvl s TYR 143 Cb -0.19 -1.95 0.04 0.00 -0.11 0.00 0.00 41.96 39.76 2nvl s TYR 143 CO -0.12 0.40 1.09 -1.25 -1.11 0.00 0.00 175.55 174.55 2nvl s PRO 144 N -2.98 2.45 0.48 -1.71 0.04 -1.26 -3.53 135.00 128.48 2nvl s PRO 144 Ca 0.40 1.15 0.19 0.00 0.04 0.00 0.00 61.00 62.78 2nvl s PRO 144 Cb -0.12 -1.92 1.21 0.00 0.04 0.00 0.00 34.50 33.72 2nvl s PRO 144 CO 0.27 -1.50 1.99 0.52 0.04 0.00 0.00 177.00 178.32 2nvl h MET 145 N -0.92 0.19 -0.01 4.56 2.86 -1.95 -2.26 114.93 117.40 2nvl h MET 145 Ca -0.44 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.19 2nvl h MET 145 Cb 1.23 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.84 2nvl h MET 145 CO 0.53 0.13 0.00 -0.85 1.06 0.00 0.00 176.91 177.77 2nvl n GLU 146 N -4.44 1.30 -3.82 1.72 0.00 -1.26 -4.77 120.64 109.37 2nvl n GLU 146 Ca 0.09 -0.44 -0.29 0.00 0.00 0.00 0.00 57.16 56.52 2nvl n GLU 146 Cb 0.47 -1.49 -0.16 0.00 0.00 0.00 0.00 31.44 30.27 2nvl n GLU 146 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 2nvl s LEU 147 N -1.99 1.98 0.56 -1.84 0.20 -0.85 -5.09 118.68 111.65 2nvl s LEU 147 Ca 0.43 -1.12 -0.21 0.00 0.69 0.00 0.00 54.13 53.93 2nvl s LEU 147 Cb 0.21 -0.89 -0.04 0.00 -0.43 0.00 0.00 46.19 45.04 2nvl s LEU 147 CO 0.35 -0.30 1.28 -0.83 -0.29 0.00 0.00 176.35 176.56 2nvl s GLY 148 N 1.61 2.83 0.89 7.98 0.00 -1.26 -4.52 107.32 114.85 2nvl s GLY 148 Ca -0.01 1.17 -0.11 0.00 0.00 0.00 0.00 44.72 45.76 2nvl s GLY 148 CO -0.10 1.63 1.09 0.50 0.00 0.00 0.00 173.10 176.23 2nvl s ARG 149 N -3.05 1.31 -0.43 2.90 0.52 -1.26 -5.03 118.95 113.91 2nvl s ARG 149 Ca 0.73 0.83 -0.05 0.00 -0.52 0.00 0.00 55.73 56.72 2nvl s ARG 149 Cb -0.35 -1.81 0.11 0.00 0.52 0.00 0.00 34.95 33.41 2nvl s ARG 149 CO 0.41 -2.21 0.25 -1.17 0.02 0.00 0.00 175.30 172.60 2nvl s LEU 150 N -6.20 5.34 0.27 2.53 2.96 -1.26 -5.00 118.68 117.32 2nvl s LEU 150 Ca 0.63 -1.91 0.07 0.00 -0.22 0.00 0.00 54.13 52.70 2nvl s LEU 150 Cb -0.18 -1.90 0.35 0.00 0.50 0.00 0.00 46.19 44.97 2nvl s LEU 150 CO 0.57 -0.58 1.62 0.58 -1.32 0.00 0.00 176.35 177.22 2nvl h VAL 151 N 6.26 1.38 -0.30 1.68 2.07 -1.95 -2.61 116.25 122.78 2nvl h VAL 151 Ca -0.17 -1.90 0.02 0.00 0.82 0.00 0.00 66.70 65.47 2nvl h VAL 151 Cb 1.06 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.79 2nvl h VAL 151 CO 0.75 0.55 0.20 0.44 0.02 0.00 0.00 177.57 179.54 2nvl h ASP 152 N 0.11 0.27 0.43 0.57 3.32 -1.94 -1.10 116.42 118.08 2nvl h ASP 152 Ca -0.00 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.98 2nvl h ASP 152 Cb 1.02 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 2nvl h ASP 152 CO 0.08 0.19 -0.30 -0.08 -1.72 0.00 0.00 179.24 177.41 2nvl h GLU 153 N 0.32 0.00 -0.00 3.56 4.57 -1.80 -0.56 114.58 120.66 2nvl h GLU 153 Ca 0.12 0.00 -0.22 0.00 -1.18 0.00 0.00 59.36 58.08 2nvl h GLU 153 Cb 0.10 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.69 2nvl h GLU 153 CO -0.03 0.30 -0.92 0.82 -1.18 0.00 0.00 179.01 178.01 2nvl h ILE 154 N 0.00 1.41 -0.27 2.32 1.08 -1.27 -1.53 117.51 119.26 2nvl h ILE 154 Ca -0.00 -2.46 -0.18 0.00 -0.39 0.00 0.00 64.86 61.83 2nvl h ILE 154 Cb 0.60 2.41 0.00 0.00 -3.07 0.00 0.00 36.82 36.76 2nvl h ILE 154 CO 0.04 0.73 -0.55 -0.07 -0.69 0.00 0.00 178.15 177.61 2nvl h LEU 155 N 0.22 0.95 -0.31 1.44 3.38 -1.29 -2.44 115.31 117.25 2nvl h LEU 155 Ca -0.07 -0.54 0.02 0.00 0.09 0.00 0.00 57.88 57.38 2nvl h LEU 155 Cb 1.55 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 42.00 2nvl h LEU 155 CO 0.16 1.32 0.16 -0.09 0.09 0.00 0.00 178.44 180.08 2nvl h ARG 156 N 0.62 0.33 -0.24 1.13 2.43 -1.08 -1.42 114.38 116.16 2nvl h ARG 156 Ca 0.01 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2nvl h ARG 156 Cb 1.16 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 30.58 2nvl h ARG 156 CO 0.12 0.22 -0.09 0.82 -1.51 0.00 0.00 179.97 179.53 2nvl h ILE 157 N 0.34 0.68 -0.33 1.20 2.04 -1.24 0.95 117.51 121.15 2nvl h ILE 157 Ca 0.13 0.00 -0.17 0.00 1.00 0.00 0.00 64.86 65.81 2nvl h ILE 157 Cb 0.03 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 36.79 2nvl h ILE 157 CO -0.08 0.00 -0.48 -0.37 0.00 0.00 0.00 178.15 177.23 2nvl h VAL 158 N -0.05 1.27 -0.36 1.67 -1.51 -1.36 0.70 116.25 116.61 2nvl h VAL 158 Ca 0.12 -1.65 0.06 0.00 -1.23 0.00 0.00 66.70 63.99 2nvl h VAL 158 Cb 0.24 1.52 -0.05 0.00 -2.13 0.00 0.00 31.29 30.87 2nvl h VAL 158 CO -0.28 0.55 0.06 0.50 -1.23 0.00 0.00 177.57 177.16 2nvl h LYS 159 N 0.71 0.17 -0.28 5.19 1.63 -1.11 -0.61 116.57 122.27 2nvl h LYS 159 Ca 0.04 -0.01 -0.17 0.00 -0.85 0.00 0.00 60.65 59.66 2nvl h LYS 159 Cb 1.08 -0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.66 2nvl h LYS 159 CO 0.11 0.11 -0.49 0.00 -3.45 0.00 0.00 179.45 175.73 2nvl h ALA 160 N 1.28 0.61 -0.67 5.00 0.00 -0.66 -1.95 119.26 122.87 2nvl h ALA 160 Ca 0.17 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 2nvl h ALA 160 Cb 0.21 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2nvl h ALA 160 CO -0.24 0.68 0.31 1.25 0.00 0.00 0.00 179.25 181.25 2nvl h LEU 161 N 0.60 0.88 -0.02 0.00 5.85 -0.64 0.19 115.31 122.16 2nvl h LEU 161 Ca 0.03 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2nvl h LEU 161 Cb 1.07 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.87 2nvl h LEU 161 CO 0.11 0.75 -0.03 0.11 -0.34 0.00 0.00 178.44 179.04 2nvl h LYS 162 N 0.96 0.06 -0.23 1.25 1.57 -0.95 0.10 116.57 119.33 2nvl h LYS 162 Ca 0.23 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 59.02 2nvl h LYS 162 Cb 0.12 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.40 2nvl h LYS 162 CO -0.03 0.57 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.32 2nvl h LEU 163 N -0.44 -0.17 -0.56 2.94 3.38 -1.24 -0.67 115.31 118.55 2nvl h LEU 163 Ca 0.00 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.08 2nvl h LEU 163 Cb 0.57 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.39 2nvl h LEU 163 CO 0.01 -0.06 0.29 1.23 0.09 0.00 0.00 178.44 180.00 2nvl h GLY 164 N 0.02 0.79 0.83 0.83 0.00 -0.62 0.22 103.07 105.14 2nvl h GLY 164 Ca 0.11 -0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.26 2nvl h GLY 164 CO -0.22 0.13 0.19 -0.55 0.00 0.00 0.00 176.54 176.09 2nvl h ASP 165 N 0.56 0.28 0.82 0.19 3.32 -0.60 -1.16 116.42 119.83 2nvl h ASP 165 Ca 0.24 0.02 -0.23 0.00 0.02 0.00 0.00 57.03 57.08 2nvl h ASP 165 Cb 0.14 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 2nvl h ASP 165 CO -0.16 0.20 -1.05 0.77 -1.72 0.00 0.00 179.24 177.28 2nvl h SER 166 N 0.38 0.17 0.12 6.45 4.64 -0.81 -3.25 113.55 121.25 2nvl h SER 166 Ca 0.16 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2nvl h SER 166 Cb 0.06 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2nvl h SER 166 CO -0.10 1.10 -0.09 0.18 -0.87 0.00 0.00 176.83 177.05 2nvl n LEU 167 N -3.46 1.07 -3.34 5.97 4.32 0.73 -4.96 117.00 117.35 2nvl n LEU 167 Ca -0.03 -0.31 -0.18 0.00 -0.02 0.00 0.00 56.01 55.47 2nvl n LEU 167 Cb 0.94 -0.06 0.06 0.00 -1.62 0.00 0.00 43.42 42.74 2nvl n LEU 167 CO 0.49 0.19 0.02 0.29 -1.22 0.00 0.00 177.39 177.16 2nvl n LYS 168 N -0.34 -1.97 -3.87 3.23 5.02 -0.80 -5.04 118.16 114.39 2nvl n LYS 168 Ca 0.17 0.81 -0.10 0.00 -2.02 0.00 0.00 58.31 57.17 2nvl n LYS 168 Cb 0.32 -5.44 -0.09 0.00 -0.02 0.00 0.00 35.03 29.80 2nvl n LYS 168 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2nvl s ARG 169 N -4.66 0.64 0.15 1.97 1.81 -0.51 -4.50 118.95 113.84 2nvl s ARG 169 Ca 0.44 -0.61 0.02 0.00 -1.72 0.00 0.00 55.73 53.86 2nvl s ARG 169 Cb -0.08 0.26 -0.04 0.00 -0.45 0.00 0.00 34.95 34.65 2nvl s ARG 169 CO 0.77 -0.17 0.28 0.00 -0.68 0.00 0.00 175.30 175.50 2nvl s ALA 170 N -2.37 3.97 -0.20 2.13 0.00 0.53 -4.48 121.76 121.34 2nvl s ALA 170 Ca -0.07 -1.03 -0.02 0.00 0.00 0.00 0.00 51.96 50.85 2nvl s ALA 170 Cb -0.02 -1.78 0.00 0.00 0.00 0.00 0.00 23.12 21.32 2nvl s ALA 170 CO -0.03 0.54 -0.12 0.08 0.00 0.00 0.00 175.76 176.23 2nvl s VAL 171 N -1.74 2.77 0.85 0.00 1.01 -1.26 -0.55 120.40 121.48 2nvl s VAL 171 Ca 0.35 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 61.52 2nvl s VAL 171 Cb -0.11 -2.22 0.10 0.00 0.00 0.00 0.00 36.38 34.15 2nvl s VAL 171 CO 0.28 0.48 1.10 -2.16 0.00 0.00 0.00 175.10 174.80 2nvl s PRO 172 N 1.34 1.60 0.33 2.72 0.04 -1.26 -4.94 135.00 134.83 2nvl s PRO 172 Ca 0.05 1.09 -0.26 0.00 0.04 0.00 0.00 61.00 61.91 2nvl s PRO 172 Cb -0.14 -1.83 -0.14 0.00 0.04 0.00 0.00 34.50 32.44 2nvl s PRO 172 CO -0.07 -2.08 0.85 0.00 0.04 0.00 0.00 177.00 175.75 2nvl n ALA 173 N -3.81 -0.76 -1.18 8.56 0.00 -1.26 -2.51 120.51 119.55 2nvl n ALA 173 Ca 0.08 0.33 -0.06 0.00 0.00 0.00 0.00 53.44 53.79 2nvl n ALA 173 Cb 0.54 -1.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.03 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 1.22 -5.09 -4.64 0.00 8.00 -1.26 -3.99 116.55 110.78 2nvl n ASP 174 Ca 0.11 0.16 -0.44 0.00 0.71 0.00 0.00 54.79 55.33 2nvl n ASP 174 Cb 0.34 -3.15 -0.01 0.00 -0.02 0.00 0.00 41.12 38.27 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 -2.37 1.78 1.05 1.24 -0.00 -1.04 -0.71 117.44 117.37 2nvl n TRP 175 Ca -0.06 0.61 0.02 0.00 -0.00 0.00 0.00 57.50 58.07 2nvl n TRP 175 Cb 0.43 -2.34 0.08 0.00 -0.00 0.00 0.00 31.31 29.48 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 0.87 1.60 -2.36 5.87 -0.04 -1.26 -4.92 135.00 134.76 2nvl n PRO 176 Ca 0.08 -0.61 -0.26 0.00 -0.04 0.00 0.00 63.50 62.67 2nvl n PRO 176 Cb 0.33 -1.40 0.01 0.00 -0.04 0.00 0.00 33.50 32.40 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 0.05 4.72 -4.76 3.54 3.02 0.11 -2.77 115.26 119.18 2nvl n ASN 177 Ca 0.06 -3.71 -0.41 0.00 -0.03 0.00 0.00 54.58 50.49 2nvl n ASN 177 Cb 0.29 -0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 39.00 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 -3.55 6.97 0.52 6.41 3.84 -0.79 -4.83 114.94 123.51 2nvl s ASN 178 Ca 0.49 2.48 0.31 0.00 0.21 0.00 0.00 52.86 56.34 2nvl s ASN 178 Cb 0.40 -2.63 1.23 0.00 -0.55 0.00 0.00 41.25 39.70 2nvl s ASN 178 CO -0.12 -0.40 1.94 -0.33 -2.79 0.00 0.00 177.10 175.40 2nvl h GLU 179 N 3.96 0.00 0.00 0.43 5.08 -1.89 0.69 114.58 122.85 2nvl h GLU 179 Ca -0.47 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.65 2nvl h GLU 179 Cb 1.22 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.43 2nvl h GLU 179 CO 0.68 0.05 -1.45 -0.89 -1.00 0.00 0.00 179.01 176.41 2nvl n ILE 180 N -3.17 1.51 -0.06 3.13 5.41 -1.26 -4.70 119.36 120.22 2nvl n ILE 180 Ca 0.01 -0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.69 2nvl n ILE 180 Cb 0.34 -2.07 0.00 0.00 -0.71 0.00 0.00 39.64 37.20 2nvl n ILE 180 CO 0.00 0.00 0.00 2.30 0.00 0.00 0.00 176.55 178.85 2nvl n ILE 181 N -4.42 0.74 0.00 1.39 -5.35 -1.22 -5.08 119.36 105.42 2nvl n ILE 181 Ca -0.33 -0.84 0.00 0.00 -0.27 0.00 0.00 62.75 61.31 2nvl n ILE 181 Cb 0.66 0.64 0.00 0.00 -1.74 0.00 0.00 39.64 39.20 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 -0.37 2.45 1.10 3.28 0.00 0.24 -1.60 105.19 110.28 2nvl n GLY 182 Ca 0.00 0.17 0.11 0.00 0.00 0.00 0.00 46.02 46.31 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 5.58 2.42 -1.51 1.61 0.28 -1.11 -1.89 120.64 126.02 2nvl n GLU 183 Ca 0.00 -2.16 -0.36 0.00 -0.16 0.00 0.00 57.16 54.48 2nvl n GLU 183 Cb 0.00 -1.50 0.09 0.00 1.43 0.00 0.00 31.44 31.46 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 1.47 0.36 3.46 -1.84 0.00 -0.63 -4.81 105.19 103.20 2nvl n GLY 184 Ca 0.20 -0.27 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 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 -4.82 2.62 -0.12 0.99 1.43 0.08 -4.55 118.68 114.30 2nvl s LEU 185 Ca 0.80 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 53.31 2nvl s LEU 185 Cb -0.35 -1.53 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 2nvl s LEU 185 CO 0.44 0.28 0.65 -0.63 0.23 0.00 0.00 176.35 177.32 2nvl s ILE 186 N -0.86 5.06 -0.01 -0.59 1.01 0.28 -1.52 121.20 124.58 2nvl s ILE 186 Ca 0.14 1.30 -0.30 0.00 0.00 0.00 0.00 60.65 61.78 2nvl s ILE 186 Cb -0.10 -3.98 -0.06 0.00 0.01 0.00 0.00 42.46 38.33 2nvl s ILE 186 CO 0.04 0.21 1.46 -0.69 0.00 0.00 0.00 174.94 175.96 2nvl s VAL 187 N 1.16 3.63 0.26 2.92 1.01 0.08 -0.35 120.40 129.11 2nvl s VAL 187 Ca 0.33 0.99 -0.31 0.00 0.00 0.00 0.00 61.98 62.99 2nvl s VAL 187 Cb -0.17 -3.63 -0.12 0.00 0.00 0.00 0.00 36.38 32.46 2nvl s VAL 187 CO 0.14 -0.02 1.55 -2.65 0.00 0.00 0.00 175.10 174.13 2nvl n PRO 188 N 5.67 2.48 -1.76 2.72 -0.02 -1.26 -4.60 135.00 138.23 2nvl n PRO 188 Ca 0.14 0.89 -0.38 0.00 -2.02 0.00 0.00 63.50 62.13 2nvl n PRO 188 Cb 0.43 -2.64 0.05 0.00 -0.02 0.00 0.00 33.50 31.33 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 -0.22 2.89 0.66 0.52 0.04 -1.26 -4.97 135.00 132.66 2nvl s PRO 189 Ca 0.67 2.17 -0.17 0.00 0.04 0.00 0.00 61.00 63.71 2nvl s PRO 189 Cb -0.55 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 31.91 2nvl s PRO 189 CO 0.47 -1.37 1.24 -2.14 0.04 0.00 0.00 177.00 175.24 2nvl s PRO 190 N -3.11 2.50 0.00 0.56 0.02 -1.26 -4.96 135.00 128.75 2nvl s PRO 190 Ca 0.76 1.89 0.06 0.00 0.02 0.00 0.00 61.00 63.73 2nvl s PRO 190 Cb -0.39 -1.86 0.11 0.00 0.02 0.00 0.00 34.50 32.37 2nvl s PRO 190 CO 0.45 -1.59 0.92 0.25 -0.33 0.00 0.00 177.00 176.70 2nvl n THR 191 N -2.13 0.54 -4.12 0.99 -2.24 -1.26 -4.91 114.28 101.16 2nvl n THR 191 Ca 0.14 -0.77 -0.10 0.00 -2.27 0.00 0.00 64.05 61.05 2nvl n THR 191 Cb 0.49 0.78 -0.10 0.00 -2.10 0.00 0.00 70.33 69.40 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 -0.76 0.52 0.25 4.28 -4.23 -1.26 -5.06 115.64 109.39 2nvl s THR 192 Ca 0.09 -1.67 -0.04 0.00 -1.18 0.00 0.00 61.69 58.90 2nvl s THR 192 Cb 0.06 -1.34 0.24 0.00 1.34 0.00 0.00 72.50 72.79 2nvl s THR 192 CO 0.08 -0.78 1.85 -0.33 -0.54 0.00 0.00 174.62 174.90 2nvl h GLU 193 N 3.42 0.96 -0.05 3.99 5.08 -1.99 -1.14 114.58 124.86 2nvl h GLU 193 Ca -0.35 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 57.95 2nvl h GLU 193 Cb 1.17 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 30.20 2nvl h GLU 193 CO 0.59 0.64 0.02 -0.44 -1.00 0.00 0.00 179.01 178.82 2nvl h ASP 194 N 0.99 0.06 -0.50 1.42 3.32 -1.98 -0.03 116.42 119.70 2nvl h ASP 194 Ca 0.41 -0.13 0.06 0.00 0.02 0.00 0.00 57.03 57.39 2nvl h ASP 194 Cb 0.24 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 39.73 2nvl h ASP 194 CO -0.20 0.17 0.22 1.56 -1.72 0.00 0.00 179.24 179.28 2nvl h GLN 195 N -0.06 0.42 -0.17 3.56 4.20 -1.93 0.15 115.11 121.28 2nvl h GLN 195 Ca 0.02 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 2nvl h GLN 195 Cb 0.13 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 2nvl h GLN 195 CO -0.00 0.28 0.10 0.00 -0.67 0.00 0.00 178.83 178.53 2nvl h ALA 196 N 1.30 0.22 0.21 3.87 0.00 -1.01 -0.32 119.26 123.52 2nvl h ALA 196 Ca 0.23 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.11 2nvl h ALA 196 Cb 0.19 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2nvl h ALA 196 CO -0.20 -0.26 -0.42 0.00 0.00 0.00 0.00 179.25 178.37 2nvl h ARG 197 N 0.18 -0.69 -0.95 0.00 3.08 -0.85 -2.80 114.38 112.36 2nvl h ARG 197 Ca 0.06 0.05 0.19 0.00 0.07 0.00 0.00 59.98 60.35 2nvl h ARG 197 Cb 0.05 0.16 -0.11 0.00 0.08 0.00 0.00 29.97 30.15 2nvl h ARG 197 CO -0.01 -0.46 0.54 0.00 -1.07 0.00 0.00 179.97 178.97 2nvl h ALA 198 N -0.28 1.56 -0.01 0.04 0.00 -0.59 0.12 119.26 120.09 2nvl h ALA 198 Ca 0.00 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2nvl h ALA 198 Cb 0.70 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.47 2nvl h ALA 198 CO -0.19 -0.13 0.01 -0.09 0.00 0.00 0.00 179.25 178.85 2nvl h ARG 199 N 0.66 0.01 0.62 0.00 9.65 -0.92 -0.23 114.38 124.17 2nvl h ARG 199 Ca 0.56 -0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 59.41 2nvl h ARG 199 Cb 0.90 -0.00 0.01 0.00 -1.39 0.00 0.00 29.97 29.49 2nvl h ARG 199 CO -0.41 0.06 -0.30 0.52 2.80 0.00 0.00 179.97 182.65 2nvl h MET 200 N -0.04 -0.80 -0.54 0.20 2.86 -1.25 -3.02 114.93 112.34 2nvl h MET 200 Ca 0.00 0.05 0.06 0.00 -2.06 0.00 0.00 59.70 57.76 2nvl h MET 200 Cb 0.05 0.18 -0.07 0.00 0.06 0.00 0.00 31.60 31.82 2nvl h MET 200 CO -0.00 -0.53 -0.27 0.39 1.06 0.00 0.00 176.91 177.56 2nvl n GLU 201 N -4.55 -0.19 -0.18 1.72 1.02 0.01 0.67 120.64 119.15 2nvl n GLU 201 Ca -0.10 0.82 0.19 0.00 -0.02 0.00 0.00 57.16 58.05 2nvl n GLU 201 Cb 0.33 -1.21 0.56 0.00 -0.02 0.00 0.00 31.44 31.10 2nvl n GLU 201 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2nvl h SER 202 N 0.00 0.30 -5.17 1.62 4.64 -1.04 -3.46 113.55 110.44 2nvl h SER 202 Ca 0.13 0.02 -0.24 0.00 -0.47 0.00 0.00 61.79 61.24 2nvl h SER 202 Cb 0.27 -0.03 -0.08 0.00 -0.31 0.00 0.00 62.40 62.25 2nvl h SER 202 CO -0.52 0.14 -0.34 0.61 -0.87 0.00 0.00 176.83 175.85 2nvl n GLY 203 N -1.56 -0.48 0.14 -0.77 0.00 0.21 -4.86 105.19 97.87 2nvl n GLY 203 Ca 0.16 0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.35 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 -3.10 1.19 -3.95 1.61 10.64 -1.26 -4.88 117.38 117.63 2nvl n GLN 204 Ca -0.02 -0.27 -0.10 0.00 -1.83 0.00 0.00 57.00 54.78 2nvl n GLN 204 Cb 0.53 -1.44 -0.10 0.00 -0.86 0.00 0.00 30.24 28.36 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 0.20 0.54 2.61 1.51 -1.26 -5.08 117.35 113.89 2nvl s TYR 205 Ca 0.40 -0.43 -0.21 0.00 -1.01 0.00 0.00 57.07 55.82 2nvl s TYR 205 Cb 0.19 -0.15 -0.06 0.00 -0.11 0.00 0.00 41.96 41.84 2nvl s TYR 205 CO 0.32 -0.24 1.22 0.54 -1.11 0.00 0.00 175.55 176.28 2nvl n ARG 206 N 1.45 1.47 -3.52 -0.62 1.74 -1.17 -4.89 116.66 111.12 2nvl n ARG 206 Ca -0.23 0.54 -0.10 0.00 -0.77 0.00 0.00 57.85 57.30 2nvl n ARG 206 Cb 0.56 -2.40 -0.02 0.00 -1.02 0.00 0.00 32.46 29.57 2nvl n ARG 206 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2nvl s SER 207 N -0.95 -0.44 -0.00 0.55 1.04 -1.26 -1.99 113.70 110.64 2nvl s SER 207 Ca 0.71 -0.10 0.04 0.00 0.48 0.00 0.00 55.95 57.08 2nvl s SER 207 Cb -0.44 0.54 -0.06 0.00 0.10 0.00 0.00 66.02 66.16 2nvl s SER 207 CO 0.50 -0.90 0.09 0.18 0.98 0.00 0.00 173.24 174.09 2nvl n LEU 208 N -0.35 0.01 -3.65 2.42 4.32 -0.29 -5.00 117.00 114.45 2nvl n LEU 208 Ca -0.12 -0.04 -0.01 0.00 -0.02 0.00 0.00 56.01 55.82 2nvl n LEU 208 Cb 0.63 0.00 -0.01 0.00 -1.62 0.00 0.00 43.42 42.42 2nvl n LEU 208 CO 0.12 0.00 0.93 -0.62 -1.22 0.00 0.00 177.39 176.60 2nvl s ASP 209 N -2.36 -0.12 0.55 -1.43 -1.08 -1.24 -4.97 116.67 106.03 2nvl s ASP 209 Ca -0.01 -0.20 0.29 0.00 -0.52 0.00 0.00 52.55 52.11 2nvl s ASP 209 Cb 0.02 0.27 1.62 0.00 -1.46 0.00 0.00 42.92 43.37 2nvl s ASP 209 CO 0.16 -0.50 2.15 4.11 0.52 0.00 0.00 175.17 181.61 2nvl h TRP 210 N 2.00 0.00 -0.17 -5.34 5.08 -1.97 -1.75 115.95 113.80 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 1.21 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.37 2nvl h TRP 210 CO 0.33 0.07 0.00 -2.67 -1.28 0.00 0.00 178.44 174.89 2nvl n TRP 211 N -3.71 0.20 -3.57 0.12 4.27 -1.26 -4.46 117.44 109.03 2nvl n TRP 211 Ca -0.02 -0.10 -0.28 0.00 -3.89 0.00 0.00 57.50 53.21 2nvl n TRP 211 Cb 0.17 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 30.01 2nvl n TRP 211 CO 0.00 0.00 0.00 0.12 -2.29 0.00 0.00 177.69 175.52 2nvl s PHE 212 N -1.80 1.72 0.09 -2.67 5.99 -0.66 -4.65 117.98 116.01 2nvl s PHE 212 Ca 0.34 -2.46 0.09 0.00 0.00 0.00 0.00 56.93 54.89 2nvl s PHE 212 Cb 0.21 -1.47 -0.03 0.00 0.00 0.00 0.00 43.02 41.72 2nvl s PHE 212 CO 0.30 -0.76 -0.23 0.00 -0.00 0.00 0.00 175.22 174.54 2nvl s TRP 214 N -1.03 0.21 0.00 0.00 -2.14 -0.84 -0.74 118.94 114.39 2nvl s TRP 214 Ca 0.09 -0.57 0.00 0.00 2.66 0.00 0.00 56.10 58.28 2nvl s TRP 214 Cb -0.10 0.20 0.00 0.00 -3.10 0.00 0.00 33.47 30.47 2nvl s TRP 214 CO 0.04 -0.90 0.00 -0.40 -2.66 0.00 0.00 176.95 173.03 2nvl n ASP 215 N -0.33 0.00 -3.27 -2.66 5.68 -0.58 -3.03 116.55 112.37 2nvl n ASP 215 Ca -0.06 -0.76 -0.25 0.00 -0.50 0.00 0.00 54.79 53.22 2nvl n ASP 215 Cb 0.62 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.53 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 1.19 1.34 2.12 -2.24 -1.26 -0.74 114.28 114.70 2nvl n THR 216 Ca 0.00 -4.80 0.13 0.00 -2.27 0.00 0.00 64.05 57.12 2nvl n THR 216 Cb 0.00 -1.84 0.43 0.00 -2.10 0.00 0.00 70.33 66.82 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 0.88 1.80 -2.55 -0.78 -0.04 -1.26 -4.86 135.00 128.19 2nvl n PRO 217 Ca 0.27 -1.17 -0.40 0.00 -0.04 0.00 0.00 63.50 62.15 2nvl n PRO 217 Cb 0.47 -1.46 -0.05 0.00 -0.04 0.00 0.00 33.50 32.42 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 -1.95 3.38 0.84 0.55 0.00 -1.26 -5.01 121.76 118.31 2nvl s ALA 218 Ca 0.36 0.82 -0.10 0.00 0.00 0.00 0.00 51.96 53.03 2nvl s ALA 218 Cb 0.20 -3.31 0.10 0.00 0.00 0.00 0.00 23.12 20.12 2nvl s ALA 218 CO 0.32 -0.09 1.12 -1.54 0.00 0.00 0.00 175.76 175.57 2nvl s SER 219 N -0.77 3.76 0.18 0.00 1.04 -1.26 -4.80 113.70 111.85 2nvl s SER 219 Ca 0.45 1.99 -0.15 0.00 0.48 0.00 0.00 55.95 58.72 2nvl s SER 219 Cb -0.30 -2.54 0.15 0.00 0.10 0.00 0.00 66.02 63.43 2nvl s SER 219 CO 0.38 -2.54 1.67 -0.09 0.98 0.00 0.00 173.24 173.64 2nvl h ARG 220 N -1.48 0.05 -0.35 4.02 2.43 -1.98 -1.42 114.38 115.65 2nvl h ARG 220 Ca -0.43 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.74 2nvl h ARG 220 Cb 1.25 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.77 2nvl h ARG 220 CO 0.47 0.03 0.22 -0.44 -1.51 0.00 0.00 179.97 178.74 2nvl h ASP 221 N 0.05 0.38 -0.30 -3.80 3.32 -1.98 0.43 116.42 114.51 2nvl h ASP 221 Ca 0.23 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.33 2nvl h ASP 221 Cb 0.35 -0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.76 2nvl h ASP 221 CO -0.44 0.28 -0.02 0.44 -1.72 0.00 0.00 179.24 177.78 2nvl h ASP 222 N 0.46 -0.16 -0.19 6.45 3.32 -1.90 0.33 116.42 124.73 2nvl h ASP 222 Ca 0.13 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 2nvl h ASP 222 Cb -0.04 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2nvl h ASP 222 CO -0.04 -0.04 0.11 0.58 -1.72 0.00 0.00 179.24 178.12 2nvl h VAL 223 N 0.07 1.10 -0.39 -1.35 2.07 -0.72 -2.39 116.25 114.64 2nvl h VAL 223 Ca 0.15 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 2nvl h VAL 223 Cb 0.20 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 2nvl h VAL 223 CO -0.26 0.09 -0.06 -0.33 0.02 0.00 0.00 177.57 177.03 2nvl h GLU 224 N 0.21 0.66 -0.82 1.57 5.08 -0.53 -1.39 114.58 119.35 2nvl h GLU 224 Ca 0.07 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2nvl h GLU 224 Cb 0.05 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 2nvl h GLU 224 CO -0.01 0.72 0.47 1.49 -1.00 0.00 0.00 179.01 180.68 2nvl h GLU 225 N 0.61 1.14 -0.07 2.33 4.81 -0.23 -1.50 114.58 121.68 2nvl h GLU 225 Ca 0.12 -0.12 -0.22 0.00 -0.13 0.00 0.00 59.36 59.01 2nvl h GLU 225 Cb 0.48 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2nvl h GLU 225 CO 0.02 0.82 -0.84 0.00 -0.73 0.00 0.00 179.01 178.29 2nvl h ALA 226 N 1.25 0.40 -0.27 2.92 0.00 -1.02 -2.60 119.26 119.95 2nvl h ALA 226 Ca 0.29 -0.65 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 2nvl h ALA 226 Cb -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 2nvl h ALA 226 CO -0.05 0.75 -0.05 -0.09 0.00 0.00 0.00 179.25 179.80 2nvl h ARG 227 N 0.35 0.43 -0.68 0.00 2.43 -1.14 -2.91 114.38 112.85 2nvl h ARG 227 Ca -0.06 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 58.94 2nvl h ARG 227 Cb 1.46 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.92 2nvl h ARG 227 CO 0.15 0.50 0.15 -0.09 -1.51 0.00 0.00 179.97 179.18 2nvl h ARG 228 N 0.41 1.11 -0.21 0.20 2.43 -0.91 -0.36 114.38 117.04 2nvl h ARG 228 Ca 0.09 -0.28 0.03 0.00 -0.81 0.00 0.00 59.98 59.01 2nvl h ARG 228 Cb 0.36 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 2nvl h ARG 228 CO 0.02 0.99 0.02 1.88 -1.51 0.00 0.00 179.97 181.37 2nvl h TYR 229 N 1.04 0.03 -0.62 2.20 0.99 -1.27 -0.02 116.97 119.32 2nvl h TYR 229 Ca 0.21 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.96 2nvl h TYR 229 Cb 0.39 0.02 -0.03 0.00 1.00 0.00 0.00 36.73 38.11 2nvl h TYR 229 CO 0.03 -0.00 0.39 -0.07 -0.00 0.00 0.00 178.16 178.51 2nvl h LEU 230 N 0.10 0.72 -0.48 3.88 3.38 -1.49 -1.54 115.31 119.88 2nvl h LEU 230 Ca 0.10 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.06 2nvl h LEU 230 Cb 0.11 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2nvl h LEU 230 CO -0.15 0.54 0.27 -0.09 0.09 0.00 0.00 178.44 179.10 2nvl h ARG 231 N 0.83 0.52 -0.70 1.13 2.43 -0.82 -1.09 114.38 116.68 2nvl h ARG 231 Ca 0.22 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.31 2nvl h ARG 231 Cb -0.07 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.33 2nvl h ARG 231 CO -0.05 0.34 0.23 -0.09 -1.51 0.00 0.00 179.97 178.90 2nvl h ARG 232 N 0.53 1.06 -0.48 0.20 2.43 -0.88 -1.84 114.38 115.41 2nvl h ARG 232 Ca 0.20 -0.21 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 2nvl h ARG 232 Cb 0.06 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 2nvl h ARG 232 CO -0.11 0.89 0.04 0.00 -1.51 0.00 0.00 179.97 179.29 2nvl h ALA 233 N 1.22 1.17 -0.01 2.80 0.00 -0.84 -3.25 119.26 120.37 2nvl h ALA 233 Ca 0.23 -0.24 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 2nvl h ALA 233 Cb 0.26 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2nvl h ALA 233 CO -0.01 0.55 -0.80 0.00 0.00 0.00 0.00 179.25 178.99 2nvl h ALA 234 N 1.31 0.65 -2.70 0.00 0.00 -0.82 -3.46 119.26 114.24 2nvl h ALA 234 Ca 0.15 -0.69 -0.56 0.00 0.00 0.00 0.00 54.91 53.81 2nvl h ALA 234 Cb 0.39 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 2nvl h ALA 234 CO 0.01 0.91 0.08 -1.21 0.00 0.00 0.00 179.25 179.04 2nvl s GLU 235 N -3.30 4.42 0.10 0.00 0.41 -0.73 -5.03 118.70 114.57 2nvl s GLU 235 Ca -0.02 0.89 -0.34 0.00 -0.41 0.00 0.00 54.97 55.09 2nvl s GLU 235 Cb 0.11 -3.40 -0.13 0.00 -1.78 0.00 0.00 34.13 28.93 2nvl s GLU 235 CO 0.81 0.19 1.66 1.17 -0.49 0.00 0.00 175.26 178.60 2nvl n LYS 236 N 3.28 2.17 -1.92 1.61 3.00 -1.26 -4.93 118.16 120.11 2nvl n LYS 236 Ca -0.03 0.79 -0.42 0.00 -0.00 0.00 0.00 58.31 58.65 2nvl n LYS 236 Cb 0.51 -2.58 -0.02 0.00 0.00 0.00 0.00 35.03 32.94 2nvl n LYS 236 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2nvl s PRO 237 N 1.76 4.21 -0.13 1.64 0.04 -1.26 -4.97 135.00 136.29 2nvl s PRO 237 Ca 0.82 2.40 -0.29 0.00 0.04 0.00 0.00 61.00 63.97 2nvl s PRO 237 Cb -0.68 -3.10 -0.04 0.00 0.04 0.00 0.00 34.50 30.72 2nvl s PRO 237 CO 0.41 -0.54 1.70 0.00 0.04 0.00 0.00 177.00 178.61 2nvl s ALA 238 N 0.40 3.40 0.00 8.56 0.00 -1.26 -4.60 121.76 128.25 2nvl s ALA 238 Ca 0.64 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.35 2nvl s ALA 238 Cb -0.44 -3.82 0.00 0.00 0.00 0.00 0.00 23.12 18.85 2nvl s ALA 238 CO 0.40 -1.75 0.00 1.17 0.00 0.00 0.00 175.76 175.58 2nvl n LYS 239 N 7.51 -0.11 -3.33 0.00 3.00 -1.26 -5.04 118.16 118.92 2nvl n LYS 239 Ca 0.19 0.57 -0.38 0.00 -0.00 0.00 0.00 58.31 58.69 2nvl n LYS 239 Cb 0.44 -0.53 -0.06 0.00 0.00 0.00 0.00 35.03 34.88 2nvl n LYS 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2nvl s LEU 240 N -0.01 4.48 0.54 3.14 1.43 -1.26 -5.00 118.68 121.99 2nvl s LEU 240 Ca 0.00 1.17 0.24 0.00 -1.03 0.00 0.00 54.13 54.51 2nvl s LEU 240 Cb 0.00 -2.91 1.48 0.00 0.03 0.00 0.00 46.19 44.79 2nvl s LEU 240 CO 0.00 0.25 2.15 -0.07 0.23 0.00 0.00 176.35 178.91 2nvl h LEU 241 N 4.37 0.00 -1.35 1.79 3.38 -1.96 -2.53 115.31 119.01 2nvl h LEU 241 Ca -0.50 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.41 2nvl h LEU 241 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2nvl h LEU 241 CO 0.63 0.06 -0.29 0.10 0.09 0.00 0.00 178.44 179.03 2nvl h TYR 242 N 0.00 0.00 0.00 1.13 -0.00 -1.94 0.95 116.97 117.11 2nvl h TYR 242 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2nvl h TYR 242 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.86 2nvl h TYR 242 CO 0.00 0.29 0.00 0.39 -0.00 0.00 0.00 178.16 178.84 2nvl n GLU 243 N -3.79 0.00 -0.25 0.10 1.02 -0.95 -3.02 120.64 113.75 2nvl n GLU 243 Ca -0.01 0.59 -0.06 0.00 -0.02 0.00 0.00 57.16 57.66 2nvl n GLU 243 Cb 0.39 -1.33 0.05 0.00 -0.02 0.00 0.00 31.44 30.52 2nvl n GLU 243 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 2nvl h GLU 244 N 0.00 1.00 0.00 3.49 9.09 -1.70 -3.53 114.58 122.93 2nvl h GLU 244 Ca 0.00 -0.13 0.00 0.00 0.05 0.00 0.00 59.36 59.28 2nvl h GLU 244 Cb 0.00 -0.19 0.00 0.00 -1.65 0.00 0.00 28.75 26.91 2nvl h GLU 244 CO 0.00 0.77 0.00 0.00 0.05 0.00 0.00 179.01 179.83