#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 1.35 0.59 2.46 -4.36 -1.26 -3.80 121.20 116.18 2nvl s ILE 5 Ca 0.00 -2.03 -0.18 0.00 -0.26 0.00 0.00 60.65 58.18 2nvl s ILE 5 Cb 0.00 -2.69 -0.03 0.00 1.25 0.00 0.00 42.46 40.99 2nvl s ILE 5 CO 0.00 -0.10 1.12 -2.84 0.24 0.00 0.00 174.94 173.36 2nvl s PRO 6 N -3.83 3.12 0.14 0.37 0.02 -1.26 -5.02 135.00 128.54 2nvl s PRO 6 Ca 0.34 1.53 0.10 0.00 0.02 0.00 0.00 61.00 63.00 2nvl s PRO 6 Cb 0.07 -1.98 -0.04 0.00 0.02 0.00 0.00 34.50 32.57 2nvl s PRO 6 CO 0.14 -1.02 -0.23 -0.51 -0.33 0.00 0.00 177.00 175.06 2nvl s LEU 7 N -4.22 2.49 0.20 -5.54 1.43 -1.26 -5.06 118.68 106.72 2nvl s LEU 7 Ca 0.71 -0.71 -0.33 0.00 -1.03 0.00 0.00 54.13 52.77 2nvl s LEU 7 Cb -0.23 -1.33 -0.13 0.00 0.03 0.00 0.00 46.19 44.53 2nvl s LEU 7 CO 0.33 0.16 1.57 -0.38 0.23 0.00 0.00 176.35 178.26 2nvl n ILE 8 N 0.70 0.32 0.00 -0.59 5.41 -1.26 -1.07 119.36 122.87 2nvl n ILE 8 Ca -0.16 -0.08 0.00 0.00 1.00 0.00 0.00 62.75 63.51 2nvl n ILE 8 Cb 0.54 -1.66 0.00 0.00 -0.71 0.00 0.00 39.64 37.81 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 3.10 1.20 3.85 7.39 0.00 0.26 -5.03 105.19 115.96 2nvl n GLY 9 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.99 3.98 0.14 1.61 2.02 -0.24 -4.83 118.70 120.39 2nvl s GLU 10 Ca 0.00 0.83 -0.31 0.00 0.02 0.00 0.00 54.97 55.51 2nvl s GLU 10 Cb 0.00 -2.26 -0.08 0.00 0.10 0.00 0.00 34.13 31.89 2nvl s GLU 10 CO 0.00 -0.09 1.34 0.50 0.02 0.00 0.00 175.26 177.03 2nvl s ARG 11 N -3.63 4.36 0.14 1.61 3.52 -1.26 -1.50 118.95 122.19 2nvl s ARG 11 Ca 0.57 2.02 -0.34 0.00 -0.13 0.00 0.00 55.73 57.85 2nvl s ARG 11 Cb -0.10 -3.24 -0.14 0.00 -1.56 0.00 0.00 34.95 29.91 2nvl s ARG 11 CO 0.25 -0.35 1.58 0.34 -0.81 0.00 0.00 175.30 176.30 2nvl n PHE 12 N 3.51 2.22 -1.63 5.12 7.35 0.54 -4.80 117.46 129.77 2nvl n PHE 12 Ca 0.09 0.28 -0.50 0.00 -0.76 0.00 0.00 57.45 56.56 2nvl n PHE 12 Cb 0.43 -2.53 -0.05 0.00 0.35 0.00 0.00 39.48 37.67 2nvl n PHE 12 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2nvl n PRO 13 N 3.51 1.55 -1.71 -7.13 -0.02 -1.26 -4.44 135.00 125.50 2nvl n PRO 13 Ca 0.17 0.56 -0.43 0.00 -2.02 0.00 0.00 63.50 61.78 2nvl n PRO 13 Cb 0.28 -2.26 -0.03 0.00 -0.02 0.00 0.00 33.50 31.47 2nvl n PRO 13 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2nvl n GLU 14 N 3.21 2.63 -3.62 -0.52 4.07 -1.26 -4.36 120.64 120.78 2nvl n GLU 14 Ca 0.19 0.95 -0.06 0.00 -0.06 0.00 0.00 57.16 58.17 2nvl n GLU 14 Cb 0.23 -2.77 -0.06 0.00 -0.06 0.00 0.00 31.44 28.78 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 1.03 0.30 -0.19 5.31 0.23 -0.33 -5.00 119.30 120.67 2nvl s MET 15 Ca 0.75 0.17 -0.10 0.00 -1.03 0.00 0.00 55.69 55.48 2nvl s MET 15 Cb -0.54 0.14 -0.05 0.00 -1.53 0.00 0.00 34.83 32.85 2nvl s MET 15 CO 0.34 -0.07 0.16 -1.21 -2.03 0.00 0.00 175.02 172.20 2nvl s GLU 16 N -0.59 4.13 0.05 3.16 2.02 -1.26 -0.70 118.70 125.51 2nvl s GLU 16 Ca 0.04 -0.16 0.07 0.00 0.02 0.00 0.00 54.97 54.94 2nvl s GLU 16 Cb -0.02 -3.40 -0.03 0.00 0.10 0.00 0.00 34.13 30.78 2nvl s GLU 16 CO -0.06 0.34 -0.19 0.14 0.02 0.00 0.00 175.26 175.50 2nvl s VAL 17 N 0.25 1.53 -0.15 2.63 -7.23 0.97 -4.98 120.40 113.42 2nvl s VAL 17 Ca 0.10 -1.21 -0.17 0.00 -1.81 0.00 0.00 61.98 58.89 2nvl s VAL 17 Cb -0.11 -1.35 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 2nvl s VAL 17 CO -0.01 0.10 0.46 -0.89 -0.31 0.00 0.00 175.10 174.46 2nvl s THR 18 N -0.88 5.18 0.28 5.32 2.01 -1.26 0.48 115.64 126.77 2nvl s THR 18 Ca 0.06 0.88 0.04 0.00 0.31 0.00 0.00 61.69 62.97 2nvl s THR 18 Cb -0.09 -3.79 -0.06 0.00 0.01 0.00 0.00 72.50 68.57 2nvl s THR 18 CO 0.02 0.29 0.03 0.42 -0.69 0.00 0.00 174.62 174.69 2nvl s THR 19 N 0.93 1.11 -2.00 -0.82 -4.23 0.69 -0.65 115.64 110.67 2nvl s THR 19 Ca 0.24 -2.02 0.15 0.00 -1.18 0.00 0.00 61.69 58.88 2nvl s THR 19 Cb -0.15 -2.61 0.44 0.00 1.34 0.00 0.00 72.50 71.52 2nvl s THR 19 CO 0.09 -0.13 1.34 -0.90 -0.54 0.00 0.00 174.62 174.48 2nvl n ASP 20 N -0.57 0.00 -0.53 3.99 5.68 -0.81 -0.00 116.55 124.31 2nvl n ASP 20 Ca -0.03 -0.52 0.09 0.00 -0.50 0.00 0.00 54.79 53.83 2nvl n ASP 20 Cb 0.65 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.66 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 -0.98 0.00 0.00 2.11 8.25 -1.26 -4.99 115.22 118.35 2nvl n HIS 21 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 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 1.15 0.78 3.69 -1.41 0.00 1.00 -5.05 105.19 105.35 2nvl n GLY 22 Ca 0.09 -2.27 -0.40 0.00 0.00 0.00 0.00 46.02 43.43 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 -0.86 4.99 0.12 1.61 1.01 -1.26 -0.22 120.40 125.80 2nvl s VAL 23 Ca 0.00 1.45 0.04 0.00 0.00 0.00 0.00 61.98 63.47 2nvl s VAL 23 Cb 0.00 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 2nvl s VAL 23 CO 0.00 0.15 -0.09 0.27 0.00 0.00 0.00 175.10 175.43 2nvl s ILE 24 N 1.43 1.01 -0.18 2.22 -4.36 0.18 -4.95 121.20 116.54 2nvl s ILE 24 Ca 0.36 -1.93 -0.08 0.00 -0.26 0.00 0.00 60.65 58.74 2nvl s ILE 24 Cb -0.17 -1.69 -0.04 0.00 1.25 0.00 0.00 42.46 41.80 2nvl s ILE 24 CO 0.15 -0.73 0.08 -0.75 0.24 0.00 0.00 174.94 173.93 2nvl s LYS 25 N -3.54 4.02 0.03 0.37 2.47 -1.26 -0.02 119.74 121.82 2nvl s LYS 25 Ca 0.13 -0.30 0.08 0.00 -1.56 0.00 0.00 55.97 54.32 2nvl s LYS 25 Cb 0.02 -3.27 -0.03 0.00 -1.46 0.00 0.00 37.83 33.08 2nvl s LYS 25 CO -0.01 0.30 -0.22 -0.51 0.16 0.00 0.00 175.35 175.07 2nvl s LEU 26 N 0.31 2.40 0.00 5.43 1.43 0.12 -1.32 118.68 127.04 2nvl s LEU 26 Ca 0.05 -0.49 0.18 0.00 -1.03 0.00 0.00 54.13 52.85 2nvl s LEU 26 Cb -0.12 -1.41 1.00 0.00 0.03 0.00 0.00 46.19 45.69 2nvl s LEU 26 CO -0.01 0.27 1.66 -0.81 0.23 0.00 0.00 176.35 177.69 2nvl n PRO 27 N 1.74 1.15 -0.05 1.29 -0.04 -1.26 -1.18 135.00 136.64 2nvl n PRO 27 Ca -0.17 -0.22 -0.09 0.00 -0.04 0.00 0.00 63.50 62.98 2nvl n PRO 27 Cb 0.52 -1.30 -0.03 0.00 -0.04 0.00 0.00 33.50 32.65 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 0.44 0.15 -0.99 3.54 3.32 -1.93 -1.38 116.42 119.58 2nvl h ASP 28 Ca 0.00 0.01 0.37 0.00 0.02 0.00 0.00 57.03 57.43 2nvl h ASP 28 Cb 0.10 -0.02 -0.18 0.00 0.22 0.00 0.00 39.33 39.45 2nvl h ASP 28 CO 0.00 0.12 0.41 -0.74 -1.72 0.00 0.00 179.24 177.31 2nvl h HIS 29 N 0.22 0.62 0.12 4.55 2.76 -1.57 0.35 115.15 122.19 2nvl h HIS 29 Ca 0.09 0.05 -0.33 0.00 -2.20 0.00 0.00 60.37 57.98 2nvl h HIS 29 Cb 0.03 -0.10 -0.01 0.00 1.55 0.00 0.00 27.41 28.87 2nvl h HIS 29 CO -0.10 -0.43 -1.74 1.88 -1.30 0.00 0.00 177.93 176.25 2nvl h TYR 30 N 0.05 0.46 -0.53 5.26 -1.99 -1.61 -3.35 116.97 115.26 2nvl h TYR 30 Ca 0.77 -0.33 0.07 0.00 2.00 0.00 0.00 58.73 61.23 2nvl h TYR 30 Cb 1.90 -0.02 -0.06 0.00 2.00 0.00 0.00 36.73 40.56 2nvl h TYR 30 CO -0.14 1.68 0.21 0.28 -0.00 0.00 0.00 178.16 180.20 2nvl h VAL 31 N -0.14 0.85 0.00 -2.88 2.07 -0.55 -1.27 116.25 114.33 2nvl h VAL 31 Ca -0.38 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.01 2nvl h VAL 31 Cb 1.90 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 2nvl h VAL 31 CO 0.06 0.07 0.00 -1.54 0.02 0.00 0.00 177.57 176.18 2nvl n SER 32 N -4.97 0.39 -0.76 0.57 3.41 0.12 -0.88 113.62 111.50 2nvl n SER 32 Ca 0.06 0.66 0.10 0.00 -0.26 0.00 0.00 58.87 59.43 2nvl n SER 32 Cb 0.20 -0.72 0.07 0.00 -0.26 0.00 0.00 64.21 63.50 2nvl n SER 32 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nvl n GLN 33 N -2.01 1.74 -1.64 4.33 6.02 -0.53 -4.96 117.38 120.33 2nvl n GLN 33 Ca -0.00 -1.60 -0.09 0.00 -0.01 0.00 0.00 57.00 55.30 2nvl n GLN 33 Cb 0.06 -1.38 -0.02 0.00 1.02 0.00 0.00 30.24 29.91 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 1.14 0.61 3.84 1.08 0.00 -0.05 -5.03 105.19 106.78 2nvl n GLY 34 Ca 0.11 -0.59 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 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 -3.45 3.17 0.65 1.61 -0.14 -0.88 -4.81 119.74 115.89 2nvl s LYS 35 Ca 0.00 -0.54 -0.08 0.00 -1.36 0.00 0.00 55.97 53.99 2nvl s LYS 35 Cb 0.00 -2.90 0.01 0.00 -1.68 0.00 0.00 37.83 33.27 2nvl s LYS 35 CO 0.00 0.60 1.00 -1.58 -0.76 0.00 0.00 175.35 174.61 2nvl s TRP 36 N -1.41 3.26 -0.07 3.18 0.52 -0.38 -3.93 118.94 120.11 2nvl s TRP 36 Ca 0.31 0.81 -0.09 0.00 0.02 0.00 0.00 56.10 57.15 2nvl s TRP 36 Cb -0.13 -2.92 0.02 0.00 -1.15 0.00 0.00 33.47 29.30 2nvl s TRP 36 CO 0.23 -1.02 0.24 -0.59 0.02 0.00 0.00 176.95 175.83 2nvl s PHE 37 N -3.18 -0.22 -0.24 -1.98 -0.12 0.32 -0.64 117.98 111.93 2nvl s PHE 37 Ca 0.56 0.53 -0.06 0.00 -0.05 0.00 0.00 56.93 57.91 2nvl s PHE 37 Cb -0.11 0.08 -0.02 0.00 -0.63 0.00 0.00 43.02 42.34 2nvl s PHE 37 CO 0.48 -0.18 0.02 0.08 -0.05 0.00 0.00 175.22 175.57 2nvl s VAL 38 N -0.22 3.89 -0.21 -2.49 1.01 -0.38 -0.77 120.40 121.23 2nvl s VAL 38 Ca -0.03 -0.35 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 2nvl s VAL 38 Cb -0.03 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 2nvl s VAL 38 CO 0.01 0.35 0.10 -0.22 0.00 0.00 0.00 175.10 175.34 2nvl s LEU 39 N 1.55 3.87 -0.03 3.92 0.20 -0.19 -1.96 118.68 126.04 2nvl s LEU 39 Ca 0.06 0.05 0.04 0.00 0.69 0.00 0.00 54.13 54.97 2nvl s LEU 39 Cb -0.15 -2.01 -0.01 0.00 -0.43 0.00 0.00 46.19 43.59 2nvl s LEU 39 CO 0.01 0.10 -0.15 0.72 -0.29 0.00 0.00 176.35 176.74 2nvl s PHE 40 N 0.82 1.44 0.20 5.38 -0.12 -0.90 -0.60 117.98 124.21 2nvl s PHE 40 Ca 0.05 -0.36 0.08 0.00 -0.05 0.00 0.00 56.93 56.66 2nvl s PHE 40 Cb -0.13 -0.97 -0.04 0.00 -0.63 0.00 0.00 43.02 41.25 2nvl s PHE 40 CO 0.02 -0.10 -0.01 -1.54 -0.05 0.00 0.00 175.22 173.54 2nvl s SER 41 N -0.08 4.64 -0.00 1.98 1.04 -0.00 -1.25 113.70 120.04 2nvl s SER 41 Ca -0.00 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 55.95 2nvl s SER 41 Cb -0.09 -0.93 -0.00 0.00 0.10 0.00 0.00 66.02 65.10 2nvl s SER 41 CO 0.01 0.07 -0.01 -1.00 0.98 0.00 0.00 173.24 173.28 2nvl s HIS 42 N -1.89 0.09 0.27 5.02 3.76 0.92 -3.76 115.29 119.70 2nvl s HIS 42 Ca 0.28 -0.01 0.01 0.00 -0.15 0.00 0.00 55.06 55.19 2nvl s HIS 42 Cb -0.08 -0.06 0.39 0.00 1.11 0.00 0.00 32.58 33.93 2nvl s HIS 42 CO 0.18 -0.00 1.73 -1.35 -0.85 0.00 0.00 174.74 174.45 2nvl h PRO 43 N 6.15 0.57 -1.57 8.40 0.11 -1.81 -3.34 132.00 140.51 2nvl h PRO 43 Ca -0.25 -0.20 0.08 0.00 0.11 0.00 0.00 66.00 65.74 2nvl h PRO 43 Cb 1.20 -0.04 -0.23 0.00 0.11 0.00 0.00 31.00 32.04 2nvl h PRO 43 CO 0.51 0.73 0.53 0.00 -0.21 0.00 0.00 178.00 179.56 2nvl s ALA 44 N -4.62 -1.93 0.76 -0.75 0.00 -1.26 -4.12 121.76 109.83 2nvl s ALA 44 Ca -0.08 1.61 -0.14 0.00 0.00 0.00 0.00 51.96 53.35 2nvl s ALA 44 Cb 0.14 -0.77 0.05 0.00 0.00 0.00 0.00 23.12 22.55 2nvl s ALA 44 CO 0.80 -0.30 1.18 -0.51 0.00 0.00 0.00 175.76 176.93 2nvl s ASP 45 N -0.99 4.07 -1.35 0.00 1.11 -1.26 -3.95 116.67 114.30 2nvl s ASP 45 Ca -0.01 2.27 -0.07 0.00 0.18 0.00 0.00 52.55 54.92 2nvl s ASP 45 Cb -0.01 -2.58 0.02 0.00 1.07 0.00 0.00 42.92 41.43 2nvl s ASP 45 CO 0.01 -2.34 1.02 0.49 1.18 0.00 0.00 175.17 175.53 2nvl n PHE 46 N -2.99 -2.44 -4.72 4.23 3.01 -1.26 -5.01 117.46 108.28 2nvl n PHE 46 Ca 0.13 0.95 -0.27 0.00 1.01 0.00 0.00 57.45 59.26 2nvl n PHE 46 Cb 0.51 -4.70 -0.14 0.00 -0.01 0.00 0.00 39.48 35.13 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 -3.38 1.81 0.03 4.37 -4.23 -1.25 -5.09 115.64 107.89 2nvl s THR 47 Ca 0.37 -1.26 -0.21 0.00 -1.18 0.00 0.00 61.69 59.42 2nvl s THR 47 Cb -0.17 -1.57 -0.16 0.00 1.34 0.00 0.00 72.50 71.94 2nvl s THR 47 CO 0.77 0.26 1.29 1.55 -0.54 0.00 0.00 174.62 177.94 2nvl h PRO 48 N 4.85 0.33 -0.87 3.99 0.13 -1.95 -1.72 132.00 136.77 2nvl h PRO 48 Ca -0.44 -0.20 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 2nvl h PRO 48 Cb 1.15 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2nvl h PRO 48 CO 0.44 0.78 0.00 0.28 -0.23 0.00 0.00 178.00 179.27 2nvl n VAL 49 N -4.53 0.02 0.00 1.56 0.31 -1.26 -1.61 118.33 112.81 2nvl n VAL 49 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.26 2nvl n VAL 49 Cb 0.40 -0.24 0.00 0.00 -0.91 0.00 0.00 33.84 33.09 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 0.69 0.00 -0.20 2.52 -1.04 -0.65 -1.79 114.28 113.82 2nvl n THR 51 Ca 0.00 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.99 2nvl n THR 51 Cb 0.02 0.00 0.08 0.00 -1.82 0.00 0.00 70.33 68.61 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 0.92 -0.59 12.58 1.35 -1.58 -1.44 112.91 124.16 2nvl h THR 52 Ca 0.00 -0.19 0.04 0.00 -0.55 0.00 0.00 66.41 65.71 2nvl h THR 52 Cb 0.00 0.32 -0.04 0.00 -1.73 0.00 0.00 68.15 66.70 2nvl h THR 52 CO 0.00 0.10 0.34 -0.33 -0.25 0.00 0.00 175.52 175.38 2nvl h GLU 53 N 0.55 0.63 -0.12 4.72 5.08 -1.63 0.94 114.58 124.75 2nvl h GLU 53 Ca 0.27 -0.04 0.03 0.00 -1.00 0.00 0.00 59.36 58.62 2nvl h GLU 53 Cb 0.20 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2nvl h GLU 53 CO -0.20 0.42 -0.03 0.74 -1.00 0.00 0.00 179.01 178.94 2nvl h PHE 54 N 0.65 -0.07 -0.77 4.33 -1.00 -1.79 0.21 116.94 118.49 2nvl h PHE 54 Ca 0.25 0.01 -0.03 0.00 2.81 0.00 0.00 57.97 61.02 2nvl h PHE 54 Cb 0.10 0.05 -0.04 0.00 3.61 0.00 0.00 35.95 39.67 2nvl h PHE 54 CO -0.07 -0.06 0.38 0.28 -1.61 0.00 0.00 178.31 177.23 2nvl h VAL 55 N -0.00 1.24 -0.43 -0.55 2.07 -1.02 -0.52 116.25 117.04 2nvl h VAL 55 Ca 0.06 -0.66 -0.10 0.00 0.82 0.00 0.00 66.70 66.82 2nvl h VAL 55 Cb 0.09 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 2nvl h VAL 55 CO -0.13 0.28 -0.14 -1.28 0.02 0.00 0.00 177.57 176.33 2nvl h SER 56 N 1.10 0.87 -0.27 0.57 0.87 -0.42 -1.51 113.55 114.74 2nvl h SER 56 Ca 0.27 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 2nvl h SER 56 Cb 0.09 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 2nvl h SER 56 CO -0.04 1.04 0.18 -0.26 -0.53 0.00 0.00 176.83 177.23 2nvl h PHE 57 N 0.68 0.34 -0.63 2.24 -1.00 -0.63 -2.91 116.94 115.04 2nvl h PHE 57 Ca 0.10 0.01 0.01 0.00 2.81 0.00 0.00 57.97 60.90 2nvl h PHE 57 Cb 0.68 -0.12 -0.03 0.00 3.61 0.00 0.00 35.95 40.10 2nvl h PHE 57 CO 0.05 0.22 0.42 0.00 -1.61 0.00 0.00 178.31 177.39 2nvl h ALA 58 N 1.09 1.58 -0.13 2.45 0.00 -0.93 -1.29 119.26 122.03 2nvl h ALA 58 Ca 0.10 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 2nvl h ALA 58 Cb -0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2nvl h ALA 58 CO -0.02 0.38 -0.17 -0.09 0.00 0.00 0.00 179.25 179.34 2nvl h ARG 59 N 0.82 0.22 -0.63 0.00 9.65 -1.12 -2.52 114.38 120.81 2nvl h ARG 59 Ca 0.24 -0.06 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 2nvl h ARG 59 Cb -0.05 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.50 2nvl h ARG 59 CO -0.06 0.40 0.00 0.54 2.80 0.00 0.00 179.97 183.65 2nvl n ARG 60 N -4.24 3.40 -0.04 0.20 1.74 -0.78 -4.65 116.66 112.29 2nvl n ARG 60 Ca -0.01 -2.77 -0.08 0.00 -0.77 0.00 0.00 57.85 54.22 2nvl n ARG 60 Cb 0.30 -1.76 -0.02 0.00 -1.02 0.00 0.00 32.46 29.95 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 3.86 -0.18 -0.74 -1.55 3.20 -0.80 -1.29 116.97 119.47 2nvl h TYR 61 Ca 0.00 0.02 0.08 0.00 3.14 0.00 0.00 58.73 61.97 2nvl h TYR 61 Cb 1.29 0.11 -0.06 0.00 1.54 0.00 0.00 36.73 39.60 2nvl h TYR 61 CO 0.65 -0.13 0.41 1.49 -1.64 0.00 0.00 178.16 178.95 2nvl h GLU 62 N -0.04 0.71 -0.74 1.82 4.57 -1.82 -1.08 114.58 117.99 2nvl h GLU 62 Ca 0.11 -0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.27 2nvl h GLU 62 Cb 0.20 -0.16 -0.04 0.00 -0.16 0.00 0.00 28.75 28.59 2nvl h GLU 62 CO -0.24 0.47 0.47 -0.44 -1.18 0.00 0.00 179.01 178.09 2nvl h ASP 63 N 0.73 0.79 -0.36 1.04 3.32 -1.78 -0.96 116.42 119.19 2nvl h ASP 63 Ca 0.35 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.37 2nvl h ASP 63 Cb 0.28 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 2nvl h ASP 63 CO -0.22 0.56 0.13 -0.26 -1.72 0.00 0.00 179.24 177.73 2nvl h PHE 64 N 0.94 0.56 -0.73 4.55 -1.00 -0.57 -3.08 116.94 117.62 2nvl h PHE 64 Ca 0.29 -0.05 0.02 0.00 2.81 0.00 0.00 57.97 61.04 2nvl h PHE 64 Cb -0.03 -0.17 -0.04 0.00 3.61 0.00 0.00 35.95 39.33 2nvl h PHE 64 CO -0.03 0.53 0.47 1.96 -1.61 0.00 0.00 178.31 179.63 2nvl h GLN 65 N 0.43 0.91 0.00 1.51 1.08 -0.80 -1.17 115.11 117.07 2nvl h GLN 65 Ca 0.12 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 2nvl h GLN 65 Cb 0.22 -0.21 -0.00 0.00 -0.05 0.00 0.00 27.48 27.44 2nvl h GLN 65 CO -0.01 0.60 -0.05 0.00 -0.95 0.00 0.00 178.83 178.43 2nvl h ARG 66 N 0.94 0.00 0.00 1.46 3.08 -1.16 -1.45 114.38 117.24 2nvl h ARG 66 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 2nvl h ARG 66 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.00 2nvl h ARG 66 CO -0.08 0.05 -0.35 1.28 -1.07 0.00 0.00 179.97 179.79 2nvl n LEU 67 N -3.21 0.56 -0.59 3.04 4.77 -0.79 -4.97 117.00 115.80 2nvl n LEU 67 Ca -0.00 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2nvl n LEU 67 Cb 0.27 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2nvl n LEU 67 CO 0.27 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 2nvl n GLY 68 N 1.40 0.80 2.94 -0.72 0.00 -0.55 -4.92 105.19 104.14 2nvl n GLY 68 Ca 0.05 -0.56 -0.25 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.87 0.97 0.21 1.61 1.01 -0.51 -1.25 120.40 119.57 2nvl s VAL 69 Ca 0.00 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.70 2nvl s VAL 69 Cb 0.00 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.39 2nvl s VAL 69 CO 0.00 0.34 0.35 -1.81 0.00 0.00 0.00 175.10 173.98 2nvl s ASP 70 N 1.27 6.33 0.09 3.32 1.01 0.19 -3.53 116.67 125.37 2nvl s ASP 70 Ca -0.04 0.16 0.09 0.00 0.71 0.00 0.00 52.55 53.48 2nvl s ASP 70 Cb -0.14 -1.90 -0.04 0.00 1.01 0.00 0.00 42.92 41.85 2nvl s ASP 70 CO -0.03 -0.04 -0.22 -0.76 0.21 0.00 0.00 175.17 174.34 2nvl s LEU 71 N -3.66 2.50 -0.22 1.23 1.43 -1.26 -1.24 118.68 117.45 2nvl s LEU 71 Ca 0.35 -0.59 -0.09 0.00 -1.03 0.00 0.00 54.13 52.77 2nvl s LEU 71 Cb -0.10 -1.41 0.09 0.00 0.03 0.00 0.00 46.19 44.80 2nvl s LEU 71 CO 0.29 0.21 0.49 -0.51 0.23 0.00 0.00 176.35 177.06 2nvl s ILE 72 N -1.03 -0.57 0.80 -0.59 2.07 -0.83 -4.27 121.20 116.78 2nvl s ILE 72 Ca 0.15 0.10 -0.08 0.00 -1.41 0.00 0.00 60.65 59.42 2nvl s ILE 72 Cb -0.10 -0.76 0.13 0.00 0.13 0.00 0.00 42.46 41.86 2nvl s ILE 72 CO 0.07 0.04 1.11 -0.83 -1.91 0.00 0.00 174.94 173.42 2nvl s GLY 73 N 2.39 1.74 -0.23 1.50 0.00 -0.04 -2.11 107.32 110.57 2nvl s GLY 73 Ca -0.05 -1.29 -0.10 0.00 0.00 0.00 0.00 44.72 43.28 2nvl s GLY 73 CO -0.15 -0.71 0.54 -2.27 0.00 0.00 0.00 173.10 170.51 2nvl s LEU 74 N -5.43 -0.70 0.03 0.66 1.98 -0.38 -1.18 118.68 113.67 2nvl s LEU 74 Ca 0.67 1.23 0.00 0.00 -2.89 0.00 0.00 54.13 53.14 2nvl s LEU 74 Cb -0.07 1.83 -0.03 0.00 0.66 0.00 0.00 46.19 48.59 2nvl s LEU 74 CO 0.47 -0.22 -0.04 -0.55 -1.89 0.00 0.00 176.35 174.12 2nvl s SER 75 N 2.14 0.42 -1.29 3.68 0.15 -1.05 -0.06 113.70 117.69 2nvl s SER 75 Ca -0.07 -0.62 -0.10 0.00 0.70 0.00 0.00 55.95 55.86 2nvl s SER 75 Cb -0.09 0.11 0.16 0.00 -1.71 0.00 0.00 66.02 64.48 2nvl s SER 75 CO -0.16 -0.35 1.85 0.52 1.20 0.00 0.00 173.24 176.30 2nvl n VAL 76 N 1.23 4.28 -3.70 4.45 0.31 -1.25 -1.76 118.33 121.88 2nvl n VAL 76 Ca -0.21 -4.34 -0.10 0.00 -0.01 0.00 0.00 64.34 59.68 2nvl n VAL 76 Cb 0.56 -2.38 -0.04 0.00 -0.91 0.00 0.00 33.84 31.07 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 1.24 -0.25 0.81 4.52 -0.00 -1.26 -4.80 116.67 116.93 2nvl s ASP 77 Ca 0.40 -0.43 -0.11 0.00 -0.00 0.00 0.00 52.55 52.41 2nvl s ASP 77 Cb 0.09 0.54 0.08 0.00 -0.00 0.00 0.00 42.92 43.62 2nvl s ASP 77 CO -0.00 -0.98 1.09 -0.94 -0.00 0.00 0.00 175.17 174.34 2nvl s SER 78 N -2.85 4.32 0.26 0.27 1.04 -1.26 -3.04 113.70 112.45 2nvl s SER 78 Ca 0.07 1.36 -0.04 0.00 0.48 0.00 0.00 55.95 57.82 2nvl s SER 78 Cb 0.00 -2.09 0.31 0.00 0.10 0.00 0.00 66.02 64.34 2nvl s SER 78 CO -0.06 -2.08 1.89 1.62 0.98 0.00 0.00 173.24 175.59 2nvl h VAL 79 N -1.17 1.24 -0.49 5.02 3.04 -1.94 -1.62 116.25 120.33 2nvl h VAL 79 Ca -0.47 -0.58 0.05 0.00 -1.01 0.00 0.00 66.70 64.69 2nvl h VAL 79 Cb 1.27 0.10 -0.05 0.00 -2.01 0.00 0.00 31.29 30.60 2nvl h VAL 79 CO 0.58 0.26 0.23 -0.26 -1.01 0.00 0.00 177.57 177.37 2nvl h PHE 80 N 1.16 0.41 -0.72 3.17 -1.00 -2.00 -0.03 116.94 117.94 2nvl h PHE 80 Ca 0.30 0.02 -0.05 0.00 2.81 0.00 0.00 57.97 61.04 2nvl h PHE 80 Cb 0.01 -0.11 -0.03 0.00 3.61 0.00 0.00 35.95 39.42 2nvl h PHE 80 CO 0.01 0.19 0.24 0.77 -1.61 0.00 0.00 178.31 177.91 2nvl h SER 81 N 0.45 1.03 -0.52 2.17 0.02 -1.85 -1.92 113.55 112.94 2nvl h SER 81 Ca 0.22 -0.20 0.07 0.00 -0.84 0.00 0.00 61.79 61.03 2nvl h SER 81 Cb 0.15 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 62.37 2nvl h SER 81 CO -0.17 0.96 0.21 0.45 -1.14 0.00 0.00 176.83 177.13 2nvl h HIS 82 N 1.05 0.37 -0.28 3.45 3.86 -0.46 0.25 115.15 123.38 2nvl h HIS 82 Ca 0.23 0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.35 2nvl h HIS 82 Cb 0.28 -0.09 -0.00 0.00 1.06 0.00 0.00 27.41 28.66 2nvl h HIS 82 CO 0.02 0.13 -0.28 0.82 0.86 0.00 0.00 177.93 179.49 2nvl h ILE 83 N 0.40 1.30 -0.93 2.45 2.04 -0.79 -0.46 117.51 121.53 2nvl h ILE 83 Ca 0.25 -1.44 -0.01 0.00 1.00 0.00 0.00 64.86 64.65 2nvl h ILE 83 Cb 0.24 1.59 -0.04 0.00 -0.74 0.00 0.00 36.82 37.86 2nvl h ILE 83 CO -0.23 0.46 0.53 0.11 0.00 0.00 0.00 178.15 179.02 2nvl h LYS 84 N 0.43 1.28 -0.11 2.37 1.79 -1.09 -0.12 116.57 121.13 2nvl h LYS 84 Ca 0.05 -0.13 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 2nvl h LYS 84 Cb 0.84 -0.26 -0.00 0.00 -1.58 0.00 0.00 32.23 31.23 2nvl h LYS 84 CO 0.07 0.91 0.03 2.35 -1.08 0.00 0.00 179.45 181.73 2nvl h TRP 85 N 1.29 0.18 -1.00 -1.35 7.01 -0.27 -0.45 115.95 121.36 2nvl h TRP 85 Ca 0.33 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.34 2nvl h TRP 85 Cb -0.01 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 26.94 2nvl h TRP 85 CO 0.01 0.34 0.66 0.87 -2.79 0.00 0.00 178.44 177.53 2nvl h LYS 86 N -0.03 1.25 -0.67 2.65 1.57 -0.82 -2.29 116.57 118.24 2nvl h LYS 86 Ca 0.03 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2nvl h LYS 86 Cb 0.25 -0.28 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 2nvl h LYS 86 CO 0.00 0.83 0.13 1.49 -0.57 0.00 0.00 179.45 181.33 2nvl h GLU 87 N 1.29 1.10 -0.12 3.15 4.81 -0.83 -2.07 114.58 121.91 2nvl h GLU 87 Ca 0.39 -0.28 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 2nvl h GLU 87 Cb -0.03 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.18 2nvl h GLU 87 CO -0.12 1.00 -0.06 2.35 -0.73 0.00 0.00 179.01 181.45 2nvl h TRP 88 N 1.02 -0.14 -0.38 0.92 7.01 -0.77 -1.29 115.95 122.32 2nvl h TRP 88 Ca 0.21 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.24 2nvl h TRP 88 Cb 0.41 0.08 -0.03 0.00 -2.10 0.00 0.00 29.16 27.53 2nvl h TRP 88 CO 0.03 -0.10 0.21 0.82 -2.79 0.00 0.00 178.44 176.62 2nvl h ILE 89 N -0.05 1.02 -0.45 2.65 2.04 -1.25 0.36 117.51 121.83 2nvl h ILE 89 Ca 0.07 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 2nvl h ILE 89 Cb 0.15 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 2nvl h ILE 89 CO -0.15 0.08 0.21 -0.08 0.00 0.00 0.00 178.15 178.21 2nvl h GLU 90 N 0.43 0.66 -0.18 2.37 4.81 -1.28 0.18 114.58 121.57 2nvl h GLU 90 Ca 0.15 -0.10 -0.19 0.00 -0.13 0.00 0.00 59.36 59.09 2nvl h GLU 90 Cb 0.03 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.30 2nvl h GLU 90 CO -0.08 0.57 -0.61 -0.09 -0.73 0.00 0.00 179.01 178.07 2nvl h ARG 91 N 0.59 0.74 0.00 1.92 2.43 -0.86 -1.99 114.38 117.21 2nvl h ARG 91 Ca 0.15 -0.55 0.00 0.00 -0.81 0.00 0.00 59.98 58.78 2nvl h ARG 91 Cb 0.14 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2nvl h ARG 91 CO -0.02 1.17 -0.95 0.72 -1.51 0.00 0.00 179.97 179.38 2nvl n HIS 92 N -4.06 0.55 0.03 2.20 8.25 0.12 -4.37 115.22 117.94 2nvl n HIS 92 Ca -0.07 0.16 0.01 0.00 -0.26 0.00 0.00 57.72 57.57 2nvl n HIS 92 Cb 0.66 -0.66 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 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 -2.23 0.00 -1.01 1.59 5.41 0.61 -4.76 119.36 118.97 2nvl n ILE 93 Ca 0.01 -0.15 -0.00 0.00 1.00 0.00 0.00 62.75 63.61 2nvl n ILE 93 Cb 0.48 0.56 -0.00 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 2.04 0.44 3.25 7.39 0.00 -0.75 -4.85 105.19 112.71 2nvl n GLY 94 Ca -0.00 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.00 2.50 -0.13 1.61 1.01 -1.24 -4.98 120.40 117.17 2nvl s VAL 95 Ca 0.00 -0.83 -0.25 0.00 0.00 0.00 0.00 61.98 60.90 2nvl s VAL 95 Cb 0.00 -2.03 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 2nvl s VAL 95 CO 0.00 0.53 0.78 -0.60 0.00 0.00 0.00 175.10 175.81 2nvl s ARG 96 N 0.74 4.35 -0.52 2.72 3.52 -1.26 -3.00 118.95 125.51 2nvl s ARG 96 Ca -0.07 0.96 -0.24 0.00 -0.13 0.00 0.00 55.73 56.25 2nvl s ARG 96 Cb -0.16 -3.53 0.04 0.00 -1.56 0.00 0.00 34.95 29.74 2nvl s ARG 96 CO 0.01 -0.18 0.90 0.42 -0.81 0.00 0.00 175.30 175.64 2nvl s ILE 97 N 1.62 4.46 -1.34 4.11 -1.09 -1.26 -4.90 121.20 122.80 2nvl s ILE 97 Ca 0.38 0.37 0.28 0.00 -2.23 0.00 0.00 60.65 59.45 2nvl s ILE 97 Cb -0.17 -4.48 0.30 0.00 -1.58 0.00 0.00 42.46 36.53 2nvl s ILE 97 CO 0.15 -0.99 1.78 -0.81 -1.23 0.00 0.00 174.94 173.85 2nvl n PRO 98 N 7.24 0.36 -4.14 2.79 -0.04 -1.26 -4.93 135.00 135.03 2nvl n PRO 98 Ca 0.02 -0.12 -0.24 0.00 -0.04 0.00 0.00 63.50 63.12 2nvl n PRO 98 Cb 0.48 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 2nvl n PRO 98 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2nvl s PHE 99 N -2.72 3.03 0.51 0.54 -0.12 -1.26 -5.09 117.98 112.87 2nvl s PHE 99 Ca 0.21 -0.09 -0.21 0.00 -0.05 0.00 0.00 56.93 56.79 2nvl s PHE 99 Cb 0.19 -1.42 -0.06 0.00 -0.63 0.00 0.00 43.02 41.10 2nvl s PHE 99 CO 0.54 0.53 1.15 -1.25 -0.05 0.00 0.00 175.22 176.14 2nvl s PRO 100 N -3.39 3.51 -0.14 1.99 0.04 -1.26 -4.87 135.00 130.88 2nvl s PRO 100 Ca 0.31 1.69 0.01 0.00 0.04 0.00 0.00 61.00 63.05 2nvl s PRO 100 Cb -0.09 -2.17 0.02 0.00 0.04 0.00 0.00 34.50 32.30 2nvl s PRO 100 CO 0.23 -0.74 -0.17 0.42 0.04 0.00 0.00 177.00 176.78 2nvl s ILE 101 N -1.67 1.75 0.10 0.56 1.01 -1.26 -0.86 121.20 120.84 2nvl s ILE 101 Ca 0.69 -0.77 -0.31 0.00 0.00 0.00 0.00 60.65 60.26 2nvl s ILE 101 Cb -0.26 -1.59 -0.09 0.00 0.01 0.00 0.00 42.46 40.53 2nvl s ILE 101 CO 0.30 0.49 1.62 -0.63 0.00 0.00 0.00 174.94 176.73 2nvl s ILE 102 N 1.13 2.90 -0.28 2.92 1.01 -0.32 -1.92 121.20 126.63 2nvl s ILE 102 Ca -0.02 0.48 -0.19 0.00 0.00 0.00 0.00 60.65 60.92 2nvl s ILE 102 Cb -0.14 -3.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.00 2nvl s ILE 102 CO -0.06 0.01 0.58 0.00 0.00 0.00 0.00 174.94 175.47 2nvl s ALA 103 N 2.12 3.56 -0.43 9.38 0.00 0.17 -2.53 121.76 134.03 2nvl s ALA 103 Ca 0.72 -0.62 0.09 0.00 0.00 0.00 0.00 51.96 52.16 2nvl s ALA 103 Cb -0.41 -3.01 0.40 0.00 0.00 0.00 0.00 23.12 20.11 2nvl s ALA 103 CO 0.32 -0.92 0.99 -3.47 0.00 0.00 0.00 175.76 172.68 2nvl n ASP 104 N 5.72 3.35 -4.76 0.00 2.03 -0.73 -4.61 116.55 117.55 2nvl n ASP 104 Ca -0.02 -3.37 -0.35 0.00 0.52 0.00 0.00 54.79 51.56 2nvl n ASP 104 Cb 0.49 -0.52 0.03 0.00 -0.72 0.00 0.00 41.12 40.40 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 -3.28 3.01 0.00 -0.67 0.04 -1.26 -1.41 135.00 131.44 2nvl s PRO 105 Ca 0.42 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.19 2nvl s PRO 105 Cb 0.38 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.98 2nvl s PRO 105 CO -0.11 -1.15 0.00 1.04 0.04 0.00 0.00 177.00 176.82 2nvl n GLN 106 N -1.64 0.00 -1.41 4.56 1.13 -1.26 -4.28 117.38 114.48 2nvl n GLN 106 Ca 0.13 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 55.06 2nvl n GLN 106 Cb 0.50 -1.09 -0.05 0.00 0.11 0.00 0.00 30.24 29.71 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 1.28 0.22 1.08 0.00 -0.50 -4.92 105.19 100.35 2nvl n GLY 107 Ca 0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 46.02 45.55 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 1.00 -0.05 2.61 2.02 -1.78 0.14 112.91 116.84 2nvl h THR 108 Ca -0.26 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 66.66 2nvl h THR 108 Cb 0.85 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 2nvl h THR 108 CO 0.38 0.11 -0.17 0.58 0.37 0.00 0.00 175.52 176.79 2nvl h VAL 109 N 0.60 1.44 -0.86 3.16 2.07 -1.91 -0.93 116.25 119.83 2nvl h VAL 109 Ca 0.24 -1.57 0.06 0.00 0.82 0.00 0.00 66.70 66.24 2nvl h VAL 109 Cb 0.10 2.34 -0.06 0.00 -1.52 0.00 0.00 31.29 32.14 2nvl h VAL 109 CO -0.14 0.44 0.53 0.00 0.02 0.00 0.00 177.57 178.43 2nvl h ALA 110 N 0.43 1.18 -0.54 1.67 0.00 -1.90 -1.36 119.26 118.74 2nvl h ALA 110 Ca -0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2nvl h ALA 110 Cb 0.80 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2nvl h ALA 110 CO 0.04 0.29 0.16 -0.09 0.00 0.00 0.00 179.25 179.65 2nvl h ARG 111 N 0.98 0.85 -0.72 0.00 2.43 -0.67 0.78 114.38 118.02 2nvl h ARG 111 Ca 0.37 -0.19 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 2nvl h ARG 111 Cb 0.16 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 29.55 2nvl h ARG 111 CO -0.17 0.78 0.44 -0.09 -1.51 0.00 0.00 179.97 179.42 2nvl h ARG 112 N 0.76 0.98 -0.55 0.20 9.65 -0.60 -2.66 114.38 122.15 2nvl h ARG 112 Ca 0.17 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.97 2nvl h ARG 112 Cb 0.29 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 28.66 2nvl h ARG 112 CO -0.00 0.68 0.00 1.28 2.80 0.00 0.00 179.97 184.73 2nvl n LEU 113 N -4.39 2.90 -1.92 3.80 4.77 -0.56 -4.70 117.00 116.89 2nvl n LEU 113 Ca 0.08 -1.46 -0.20 0.00 -0.03 0.00 0.00 56.01 54.40 2nvl n LEU 113 Cb 0.07 -0.40 -0.05 0.00 -2.33 0.00 0.00 43.42 40.71 2nvl n LEU 113 CO 0.37 0.56 -0.22 0.61 -1.33 0.00 0.00 177.39 177.38 2nvl n GLY 114 N 0.95 0.66 0.01 -0.72 0.00 -0.78 -4.55 105.19 100.76 2nvl n GLY 114 Ca 0.16 -0.05 0.15 0.00 0.00 0.00 0.00 46.02 46.27 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 -2.57 0.06 -4.56 0.99 4.77 0.26 -4.54 117.00 111.41 2nvl n LEU 115 Ca -0.22 0.23 -0.43 0.00 -0.03 0.00 0.00 56.01 55.56 2nvl n LEU 115 Cb 0.67 -0.25 -0.04 0.00 -2.33 0.00 0.00 43.42 41.47 2nvl n LEU 115 CO 0.29 0.01 0.77 -0.76 -1.33 0.00 0.00 177.39 176.37 2nvl s LEU 116 N -2.51 3.98 0.00 2.23 1.43 -1.25 -1.30 118.68 121.27 2nvl s LEU 116 Ca 0.30 0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.52 2nvl s LEU 116 Cb 0.20 -3.20 0.00 0.00 0.03 0.00 0.00 46.19 43.22 2nvl s LEU 116 CO 0.46 -1.08 0.00 1.41 0.23 0.00 0.00 176.35 177.37 2nvl n HIS 117 N 7.23 -0.81 0.05 0.29 8.25 -1.26 -4.92 115.22 124.06 2nvl n HIS 117 Ca 0.06 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.48 2nvl n HIS 117 Cb 0.48 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.50 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 0.06 0.56 -0.18 -1.41 0.00 -1.99 -3.07 119.26 113.24 2nvl h ALA 118 Ca 0.00 -0.95 -0.08 0.00 0.00 0.00 0.00 54.91 53.88 2nvl h ALA 118 Cb 0.00 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 2nvl h ALA 118 CO 0.00 1.17 0.10 -0.85 0.00 0.00 0.00 179.25 179.67 2nvl n GLU 119 N -3.19 1.39 0.00 0.00 0.28 -1.26 -4.77 120.64 113.09 2nvl n GLU 119 Ca -0.05 -0.60 0.00 0.00 -0.16 0.00 0.00 57.16 56.34 2nvl n GLU 119 Cb 0.91 -1.34 0.00 0.00 1.43 0.00 0.00 31.44 32.44 2nvl n GLU 119 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2nvl n SER 120 N 0.16 0.00 -0.42 -1.84 2.88 -1.16 -5.00 113.62 108.24 2nvl n SER 120 Ca 0.10 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 2nvl n SER 120 Cb 0.66 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.12 2nvl n SER 120 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2nvl n ALA 121 N -3.00 -1.92 -0.15 -1.46 0.00 -1.22 -4.53 120.51 108.24 2nvl n ALA 121 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2nvl n ALA 121 Cb 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 -1.72 0.00 -4.41 0.00 -1.04 -1.26 -4.61 114.28 101.24 2nvl n THR 122 Ca 0.00 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.68 2nvl n THR 122 Cb 0.46 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.81 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 0.00 2.77 0.09 -1.42 4.02 -1.26 -4.96 115.29 114.52 2nvl s HIS 123 Ca 0.00 -1.27 -0.36 0.00 1.02 0.00 0.00 55.06 54.46 2nvl s HIS 123 Cb 0.00 -1.90 -0.18 0.00 -1.02 0.00 0.00 32.58 29.48 2nvl s HIS 123 CO 0.00 -0.60 1.01 2.41 1.02 0.00 0.00 174.74 178.57 2nvl n THR 124 N 4.27 0.61 -0.72 1.30 -1.04 -1.26 -4.67 114.28 112.76 2nvl n THR 124 Ca -0.20 -0.15 -0.33 0.00 -2.04 0.00 0.00 64.05 61.33 2nvl n THR 124 Cb 0.51 -0.28 0.15 0.00 -1.82 0.00 0.00 70.33 68.89 2nvl n THR 124 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2nvl n VAL 125 N 1.30 0.00 -2.15 12.58 0.24 -0.42 -3.36 118.33 126.52 2nvl n VAL 125 Ca 0.18 -0.26 -0.43 0.00 -2.04 0.00 0.00 64.34 61.80 2nvl n VAL 125 Cb 0.16 -0.60 0.00 0.00 -1.47 0.00 0.00 33.84 31.93 2nvl n VAL 125 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2nvl n ARG 126 N -1.86 3.03 -3.62 7.34 0.63 -1.23 -4.21 116.66 116.74 2nvl n ARG 126 Ca 0.03 -2.95 -0.34 0.00 -0.92 0.00 0.00 57.85 53.67 2nvl n ARG 126 Cb 0.59 -3.38 -0.05 0.00 0.45 0.00 0.00 32.46 30.07 2nvl n ARG 126 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2nvl s GLY 127 N 3.62 2.30 -0.06 5.14 0.00 -1.25 -1.91 107.32 115.17 2nvl s GLY 127 Ca 0.50 -0.45 0.01 0.00 0.00 0.00 0.00 44.72 44.78 2nvl s GLY 127 CO -0.01 -0.28 -0.07 0.14 0.00 0.00 0.00 173.10 172.89 2nvl s VAL 128 N -1.47 0.74 -0.18 1.40 1.01 0.21 -0.82 120.40 121.28 2nvl s VAL 128 Ca 0.35 -0.22 -0.00 0.00 0.00 0.00 0.00 61.98 62.11 2nvl s VAL 128 Cb -0.13 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.52 2nvl s VAL 128 CO 0.20 0.28 -0.16 -0.36 0.00 0.00 0.00 175.10 175.06 2nvl s PHE 129 N 1.01 2.82 -0.33 5.22 0.40 0.23 -1.18 117.98 126.15 2nvl s PHE 129 Ca -0.09 -1.40 -0.12 0.00 -0.60 0.00 0.00 56.93 54.72 2nvl s PHE 129 Cb -0.14 -1.96 -0.02 0.00 0.51 0.00 0.00 43.02 41.41 2nvl s PHE 129 CO -0.00 -0.70 0.23 0.42 0.70 0.00 0.00 175.22 175.87 2nvl s ILE 130 N 1.26 5.27 -0.10 0.64 1.01 -0.10 -1.02 121.20 128.15 2nvl s ILE 130 Ca 0.03 -0.14 0.04 0.00 0.00 0.00 0.00 60.65 60.58 2nvl s ILE 130 Cb -0.14 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.67 2nvl s ILE 130 CO -0.09 0.05 -0.23 -0.69 0.00 0.00 0.00 174.94 173.98 2nvl s VAL 131 N 1.73 1.99 0.87 2.92 1.01 0.05 -0.94 120.40 128.03 2nvl s VAL 131 Ca 0.06 -0.97 -0.13 0.00 0.00 0.00 0.00 61.98 60.94 2nvl s VAL 131 Cb -0.17 -1.73 0.14 0.00 0.00 0.00 0.00 36.38 34.62 2nvl s VAL 131 CO 0.11 0.54 1.23 1.51 0.00 0.00 0.00 175.10 178.49 2nvl s ASP 132 N 0.45 3.83 0.05 3.32 1.47 -0.56 -0.52 116.67 124.71 2nvl s ASP 132 Ca -0.17 0.46 0.09 0.00 1.18 0.00 0.00 52.55 54.12 2nvl s ASP 132 Cb -0.17 -0.74 0.42 0.00 -0.34 0.00 0.00 42.92 42.09 2nvl s ASP 132 CO 0.07 -2.29 1.30 0.00 0.68 0.00 0.00 175.17 174.92 2nvl n ALA 133 N -3.50 1.32 1.13 2.11 0.00 -1.25 -0.64 120.51 119.68 2nvl n ALA 133 Ca 0.12 0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.69 2nvl n ALA 133 Cb 0.60 -1.15 0.34 0.00 0.00 0.00 0.00 19.45 19.24 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 -1.63 1.96 -0.77 0.00 1.74 -1.26 -4.56 116.66 112.15 2nvl n ARG 134 Ca 0.01 -1.42 0.00 0.00 -0.77 0.00 0.00 57.85 55.67 2nvl n ARG 134 Cb 0.09 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.07 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 1.25 0.58 3.68 -0.13 0.00 0.19 -5.00 105.19 105.77 2nvl n GLY 135 Ca 0.17 -0.32 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 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 5.02 -0.07 1.61 1.01 -1.25 -0.34 120.40 124.38 2nvl s VAL 136 Ca 0.00 0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 2nvl s VAL 136 Cb 0.00 -3.27 -0.06 0.00 0.00 0.00 0.00 36.38 33.06 2nvl s VAL 136 CO 0.00 0.46 1.73 -0.63 0.00 0.00 0.00 175.10 176.66 2nvl s ILE 137 N 0.27 3.48 -0.03 2.22 1.01 -0.56 -1.50 121.20 126.09 2nvl s ILE 137 Ca 0.05 0.57 0.12 0.00 0.00 0.00 0.00 60.65 61.39 2nvl s ILE 137 Cb -0.12 -3.39 -0.18 0.00 0.01 0.00 0.00 42.46 38.78 2nvl s ILE 137 CO -0.00 -0.08 0.23 0.54 0.00 0.00 0.00 174.94 175.63 2nvl n ARG 138 N 7.35 0.54 -3.56 2.79 5.12 -0.12 -0.57 116.66 128.21 2nvl n ARG 138 Ca 0.18 -0.10 -0.15 0.00 -1.93 0.00 0.00 57.85 55.86 2nvl n ARG 138 Cb 0.43 -1.28 -0.06 0.00 -1.16 0.00 0.00 32.46 30.39 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 -2.76 0.00 -0.07 0.55 2.01 -1.21 -4.91 115.64 109.25 2nvl s THR 139 Ca -0.04 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 61.91 2nvl s THR 139 Cb 0.07 -1.00 0.03 0.00 0.01 0.00 0.00 72.50 71.61 2nvl s THR 139 CO 0.48 0.00 0.17 -0.04 -0.69 0.00 0.00 174.62 174.55 2nvl s MET 140 N -0.85 0.16 -0.04 4.92 -1.94 -1.25 -0.93 119.30 119.37 2nvl s MET 140 Ca -0.06 0.34 0.02 0.00 -1.71 0.00 0.00 55.69 54.29 2nvl s MET 140 Cb -0.01 -0.06 0.01 0.00 2.01 0.00 0.00 34.83 36.78 2nvl s MET 140 CO 0.05 -0.11 -0.08 -0.51 -0.01 0.00 0.00 175.02 174.37 2nvl s LEU 141 N 0.74 1.61 -0.34 -0.03 1.43 -0.32 -4.96 118.68 116.81 2nvl s LEU 141 Ca -0.05 -0.18 0.03 0.00 -1.03 0.00 0.00 54.13 52.90 2nvl s LEU 141 Cb -0.07 -0.54 0.10 0.00 0.03 0.00 0.00 46.19 45.71 2nvl s LEU 141 CO -0.04 0.02 0.07 -0.31 0.23 0.00 0.00 176.35 176.32 2nvl s TYR 142 N 0.51 3.26 0.35 0.29 1.51 -1.26 -0.62 117.35 121.39 2nvl s TYR 142 Ca -0.08 -2.72 -0.11 0.00 -1.01 0.00 0.00 57.07 53.15 2nvl s TYR 142 Cb -0.12 -2.64 -0.07 0.00 -0.11 0.00 0.00 41.96 39.02 2nvl s TYR 142 CO 0.01 -0.92 0.72 0.71 -1.11 0.00 0.00 175.55 174.95 2nvl s TYR 143 N 1.01 3.43 0.80 2.71 1.51 -0.80 -5.03 117.35 120.98 2nvl s TYR 143 Ca 0.11 1.05 -0.12 0.00 -1.01 0.00 0.00 57.07 57.10 2nvl s TYR 143 Cb -0.19 -2.43 0.07 0.00 -0.11 0.00 0.00 41.96 39.30 2nvl s TYR 143 CO -0.11 0.02 1.13 -1.25 -1.11 0.00 0.00 175.55 174.22 2nvl s PRO 144 N -3.44 2.09 0.48 -1.71 0.04 -1.26 -3.57 135.00 127.63 2nvl s PRO 144 Ca 0.51 0.38 0.24 0.00 0.04 0.00 0.00 61.00 62.17 2nvl s PRO 144 Cb -0.10 -1.94 1.21 0.00 0.04 0.00 0.00 34.50 33.70 2nvl s PRO 144 CO 0.26 -1.56 1.98 1.98 0.04 0.00 0.00 177.00 179.70 2nvl h MET 145 N -1.04 0.00 -0.00 4.56 1.85 -1.96 -2.76 114.93 115.58 2nvl h MET 145 Ca -0.47 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.62 2nvl h MET 145 Cb 1.29 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.32 2nvl h MET 145 CO 0.63 0.18 -0.09 -0.85 -0.40 0.00 0.00 176.91 176.38 2nvl n GLU 146 N -3.70 0.58 -3.86 0.39 0.00 -1.26 -4.79 120.64 108.00 2nvl n GLU 146 Ca -0.01 -0.16 -0.30 0.00 0.00 0.00 0.00 57.16 56.69 2nvl n GLU 146 Cb 0.30 -1.50 -0.16 0.00 0.00 0.00 0.00 31.44 30.09 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 -2.53 2.35 0.44 -1.84 0.20 -1.04 -5.08 118.68 111.18 2nvl s LEU 147 Ca 0.28 -1.25 -0.25 0.00 0.69 0.00 0.00 54.13 53.60 2nvl s LEU 147 Cb 0.20 -1.02 -0.08 0.00 -0.43 0.00 0.00 46.19 44.86 2nvl s LEU 147 CO 0.48 -0.29 1.32 -0.83 -0.29 0.00 0.00 176.35 176.74 2nvl s GLY 148 N 1.50 2.90 0.81 7.98 0.00 -1.26 -4.50 107.32 114.76 2nvl s GLY 148 Ca -0.01 1.26 -0.12 0.00 0.00 0.00 0.00 44.72 45.86 2nvl s GLY 148 CO -0.10 1.83 1.15 0.50 0.00 0.00 0.00 173.10 176.48 2nvl s ARG 149 N -2.41 1.75 -0.48 2.90 0.52 -1.26 -5.01 118.95 114.96 2nvl s ARG 149 Ca 0.60 1.50 -0.14 0.00 -0.52 0.00 0.00 55.73 57.17 2nvl s ARG 149 Cb -0.39 -1.81 0.09 0.00 0.52 0.00 0.00 34.95 33.36 2nvl s ARG 149 CO 0.49 -2.08 0.39 -1.17 0.02 0.00 0.00 175.30 172.95 2nvl s LEU 150 N -5.93 5.68 0.35 2.53 2.96 -1.26 -4.98 118.68 118.03 2nvl s LEU 150 Ca 0.67 -1.50 0.18 0.00 -0.22 0.00 0.00 54.13 53.26 2nvl s LEU 150 Cb -0.23 -2.15 0.52 0.00 0.50 0.00 0.00 46.19 44.84 2nvl s LEU 150 CO 0.53 -0.68 1.66 0.58 -1.32 0.00 0.00 176.35 177.12 2nvl h VAL 151 N 5.86 0.88 0.00 1.68 2.07 -1.96 -2.91 116.25 121.88 2nvl h VAL 151 Ca -0.27 -1.72 -0.08 0.00 0.82 0.00 0.00 66.70 65.45 2nvl h VAL 151 Cb 1.10 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.92 2nvl h VAL 151 CO 0.90 0.41 -0.38 0.44 0.02 0.00 0.00 177.57 178.96 2nvl h ASP 152 N 0.00 0.00 -0.83 0.57 3.32 -1.94 -2.24 116.42 115.30 2nvl h ASP 152 Ca -0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.06 2nvl h ASP 152 Cb 1.03 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.54 2nvl h ASP 152 CO 0.05 0.38 0.55 -0.08 -1.72 0.00 0.00 179.24 178.42 2nvl h GLU 153 N 0.00 1.07 -0.47 3.56 4.57 -1.85 -1.62 114.58 119.83 2nvl h GLU 153 Ca -0.00 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2nvl h GLU 153 Cb 0.80 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 29.13 2nvl h GLU 153 CO 0.05 0.71 0.31 0.82 -1.18 0.00 0.00 179.01 179.72 2nvl h ILE 154 N 1.10 1.13 -0.48 2.32 2.04 -1.51 0.22 117.51 122.34 2nvl h ILE 154 Ca 0.31 -0.24 -0.02 0.00 1.00 0.00 0.00 64.86 65.91 2nvl h ILE 154 Cb -0.08 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 2nvl h ILE 154 CO -0.08 0.12 0.21 -0.07 0.00 0.00 0.00 178.15 178.33 2nvl h LEU 155 N 0.64 0.65 -0.46 1.44 3.38 -1.39 -2.25 115.31 117.33 2nvl h LEU 155 Ca 0.17 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2nvl h LEU 155 Cb -0.07 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2nvl h LEU 155 CO -0.04 0.62 0.29 -0.09 0.09 0.00 0.00 178.44 179.32 2nvl h ARG 156 N 0.63 0.61 0.15 1.13 2.43 -1.06 0.12 114.38 118.39 2nvl h ARG 156 Ca 0.16 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.30 2nvl h ARG 156 Cb 0.17 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.54 2nvl h ARG 156 CO -0.02 0.43 -0.40 0.82 -1.51 0.00 0.00 179.97 179.29 2nvl h ILE 157 N 0.61 0.18 -0.52 1.20 2.04 -0.80 -0.37 117.51 119.85 2nvl h ILE 157 Ca 0.17 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.97 2nvl h ILE 157 Cb -0.04 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.20 2nvl h ILE 157 CO -0.03 0.00 0.11 -0.37 0.00 0.00 0.00 178.15 177.85 2nvl h VAL 158 N -0.66 1.25 -0.40 1.67 -1.51 -1.30 0.89 116.25 116.19 2nvl h VAL 158 Ca 0.02 -0.90 0.02 0.00 -1.23 0.00 0.00 66.70 64.61 2nvl h VAL 158 Cb 0.67 0.83 -0.03 0.00 -2.13 0.00 0.00 31.29 30.64 2nvl h VAL 158 CO -0.22 0.32 0.23 0.50 -1.23 0.00 0.00 177.57 177.18 2nvl h LYS 159 N 0.73 0.46 -0.57 5.19 1.63 -0.90 -0.73 116.57 122.38 2nvl h LYS 159 Ca 0.16 -0.03 -0.11 0.00 -0.85 0.00 0.00 60.65 59.82 2nvl h LYS 159 Cb 0.37 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.87 2nvl h LYS 159 CO 0.01 0.30 -0.07 0.00 -3.45 0.00 0.00 179.45 176.24 2nvl h ALA 160 N 1.18 0.77 -0.16 5.00 0.00 -0.87 -1.75 119.26 123.43 2nvl h ALA 160 Ca 0.16 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 2nvl h ALA 160 Cb 0.02 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 2nvl h ALA 160 CO -0.08 0.66 -0.08 1.25 0.00 0.00 0.00 179.25 181.01 2nvl h LEU 161 N 0.94 0.35 -0.81 0.00 5.85 -0.58 -0.73 115.31 120.32 2nvl h LEU 161 Ca 0.15 -0.41 0.03 0.00 0.84 0.00 0.00 57.88 58.50 2nvl h LEU 161 Cb 0.64 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 2nvl h LEU 161 CO 0.04 0.68 0.52 0.11 -0.34 0.00 0.00 178.44 179.45 2nvl h LYS 162 N 0.02 0.97 -0.85 1.25 1.57 -1.13 -0.07 116.57 118.33 2nvl h LYS 162 Ca 0.04 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2nvl h LYS 162 Cb 0.55 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.60 2nvl h LYS 162 CO 0.02 0.64 0.45 -0.07 -0.57 0.00 0.00 179.45 179.93 2nvl h LEU 163 N 1.00 1.07 -0.39 2.94 3.38 -1.20 -2.37 115.31 119.73 2nvl h LEU 163 Ca 0.33 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 2nvl h LEU 163 Cb 0.02 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2nvl h LEU 163 CO -0.12 0.87 0.01 1.23 0.09 0.00 0.00 178.44 180.51 2nvl h GLY 164 N 1.21 0.74 0.97 0.83 0.00 -0.48 -0.78 103.07 105.56 2nvl h GLY 164 Ca 0.30 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 2nvl h GLY 164 CO -0.05 0.50 -0.12 -0.55 0.00 0.00 0.00 176.54 176.32 2nvl h ASP 165 N 0.52 -0.28 0.19 0.19 3.32 -1.01 0.80 116.42 120.14 2nvl h ASP 165 Ca 0.11 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.98 2nvl h ASP 165 Cb 0.46 0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 2nvl h ASP 165 CO 0.02 -0.17 -0.61 0.77 -1.72 0.00 0.00 179.24 177.52 2nvl h SER 166 N -0.37 0.48 0.18 6.45 4.64 -1.40 -2.86 113.55 120.66 2nvl h SER 166 Ca -0.03 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 2nvl h SER 166 Cb 0.28 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2nvl h SER 166 CO 0.06 0.97 -0.28 0.18 -0.87 0.00 0.00 176.83 176.89 2nvl n LEU 167 N -3.90 1.24 -3.52 5.97 4.32 -0.30 -4.96 117.00 115.84 2nvl n LEU 167 Ca -0.03 -0.37 -0.22 0.00 -0.02 0.00 0.00 56.01 55.37 2nvl n LEU 167 Cb 0.63 -0.09 0.05 0.00 -1.62 0.00 0.00 43.42 42.39 2nvl n LEU 167 CO 0.46 0.23 -0.02 0.29 -1.22 0.00 0.00 177.39 177.13 2nvl n LYS 168 N -0.48 -3.19 -4.01 3.23 5.02 0.07 -5.02 118.16 113.78 2nvl n LYS 168 Ca 0.12 0.68 -0.09 0.00 -2.02 0.00 0.00 58.31 56.99 2nvl n LYS 168 Cb 0.37 -5.16 -0.11 0.00 -0.02 0.00 0.00 35.03 30.11 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 -5.41 0.39 0.29 1.97 1.81 -0.00 -4.61 118.95 113.39 2nvl s ARG 169 Ca 0.28 -0.72 -0.04 0.00 -1.72 0.00 0.00 55.73 53.53 2nvl s ARG 169 Cb -0.07 0.07 -0.05 0.00 -0.45 0.00 0.00 34.95 34.45 2nvl s ARG 169 CO 0.79 -0.04 0.55 0.00 -0.68 0.00 0.00 175.30 175.92 2nvl s ALA 170 N -1.80 3.63 -0.14 2.13 0.00 0.66 -4.44 121.76 121.80 2nvl s ALA 170 Ca -0.12 -0.59 -0.00 0.00 0.00 0.00 0.00 51.96 51.24 2nvl s ALA 170 Cb -0.07 -2.28 -0.01 0.00 0.00 0.00 0.00 23.12 20.76 2nvl s ALA 170 CO -0.02 0.22 -0.13 0.08 0.00 0.00 0.00 175.76 175.92 2nvl s VAL 171 N -2.10 2.99 0.79 0.00 1.01 -1.26 -0.15 120.40 121.68 2nvl s VAL 171 Ca 0.43 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.63 2nvl s VAL 171 Cb -0.11 -2.27 0.06 0.00 0.00 0.00 0.00 36.38 34.07 2nvl s VAL 171 CO 0.31 0.51 1.10 -2.16 0.00 0.00 0.00 175.10 174.86 2nvl s PRO 172 N 0.55 2.15 0.24 2.72 0.04 -1.26 -4.97 135.00 134.47 2nvl s PRO 172 Ca -0.08 0.56 -0.31 0.00 0.04 0.00 0.00 61.00 61.21 2nvl s PRO 172 Cb -0.16 -1.93 -0.14 0.00 0.04 0.00 0.00 34.50 32.31 2nvl s PRO 172 CO 0.04 -1.55 1.27 0.00 0.04 0.00 0.00 177.00 176.80 2nvl n ALA 173 N -3.37 0.43 -1.04 8.56 0.00 -1.26 -2.24 120.51 121.58 2nvl n ALA 173 Ca 0.07 0.42 -0.01 0.00 0.00 0.00 0.00 53.44 53.91 2nvl n ALA 173 Cb 0.57 -2.17 -0.01 0.00 0.00 0.00 0.00 19.45 17.84 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 1.85 -4.92 -4.56 0.00 8.00 -1.26 -4.08 116.55 111.58 2nvl n ASP 174 Ca 0.12 0.04 -0.44 0.00 0.71 0.00 0.00 54.79 55.21 2nvl n ASP 174 Cb 0.30 -2.55 -0.01 0.00 -0.02 0.00 0.00 41.12 38.84 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 -2.38 0.90 1.47 1.24 -0.00 -0.95 -0.28 117.44 117.44 2nvl n TRP 175 Ca -0.01 0.70 0.02 0.00 -0.00 0.00 0.00 57.50 58.20 2nvl n TRP 175 Cb 0.34 -2.19 0.05 0.00 -0.00 0.00 0.00 31.31 29.51 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 0.65 1.31 -2.03 5.87 -0.04 -1.26 -4.90 135.00 134.60 2nvl n PRO 176 Ca 0.10 -0.40 -0.29 0.00 -0.04 0.00 0.00 63.50 62.87 2nvl n PRO 176 Cb 0.33 -1.19 0.03 0.00 -0.04 0.00 0.00 33.50 32.63 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 -0.13 5.68 -4.77 3.54 3.02 0.62 -2.79 115.26 120.43 2nvl n ASN 177 Ca 0.04 -3.76 -0.40 0.00 -0.03 0.00 0.00 54.58 50.43 2nvl n ASN 177 Cb 0.15 -0.58 -0.03 0.00 -0.61 0.00 0.00 39.78 38.71 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 -2.95 6.96 0.44 6.41 3.84 -0.65 -4.85 114.94 124.13 2nvl s ASN 178 Ca 0.53 2.35 0.12 0.00 0.21 0.00 0.00 52.86 56.07 2nvl s ASN 178 Cb 0.43 -2.63 0.97 0.00 -0.55 0.00 0.00 41.25 39.47 2nvl s ASN 178 CO -0.10 -0.37 2.01 -0.33 -2.79 0.00 0.00 177.10 175.52 2nvl h GLU 179 N 3.35 0.18 0.04 0.43 3.07 -1.87 0.13 114.58 119.91 2nvl h GLU 179 Ca -0.48 -0.03 -0.28 0.00 -0.50 0.00 0.00 59.36 58.08 2nvl h GLU 179 Cb 1.22 -0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 29.07 2nvl h GLU 179 CO 0.65 0.24 -1.50 0.82 -1.40 0.00 0.00 179.01 177.82 2nvl h ILE 180 N 0.17 0.83 0.00 3.13 2.04 -1.95 -3.42 117.51 118.31 2nvl h ILE 180 Ca 0.04 -2.24 0.00 0.00 1.00 0.00 0.00 64.86 63.66 2nvl h ILE 180 Cb 0.20 2.32 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 2nvl h ILE 180 CO 0.01 0.51 0.00 2.30 0.00 0.00 0.00 178.15 180.96 2nvl n ILE 181 N -4.12 0.33 0.00 -0.67 -5.35 -1.24 -5.09 119.36 103.22 2nvl n ILE 181 Ca -0.32 -0.54 0.00 0.00 -0.27 0.00 0.00 62.75 61.62 2nvl n ILE 181 Cb 0.80 0.97 0.00 0.00 -1.74 0.00 0.00 39.64 39.68 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 -0.17 3.28 0.48 3.28 0.00 0.45 -1.39 105.19 111.12 2nvl n GLY 182 Ca 0.00 0.23 0.09 0.00 0.00 0.00 0.00 46.02 46.34 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 9.01 1.62 -1.65 1.61 0.28 -1.12 -1.64 120.64 128.76 2nvl n GLU 183 Ca 0.00 -0.95 -0.41 0.00 -0.16 0.00 0.00 57.16 55.64 2nvl n GLU 183 Cb 0.00 -1.34 0.01 0.00 1.43 0.00 0.00 31.44 31.54 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 1.05 0.09 3.50 -1.84 0.00 -0.49 -4.84 105.19 102.66 2nvl n GLY 184 Ca 0.14 0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.98 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 -1.12 2.82 -0.01 0.99 1.43 -0.31 -4.59 118.68 117.89 2nvl s LEU 185 Ca 0.63 -0.21 -0.24 0.00 -1.03 0.00 0.00 54.13 53.29 2nvl s LEU 185 Cb -0.53 -1.60 -0.05 0.00 0.03 0.00 0.00 46.19 44.05 2nvl s LEU 185 CO 0.56 0.32 0.71 -0.63 0.23 0.00 0.00 176.35 177.55 2nvl s ILE 186 N -0.81 4.88 -0.08 -0.59 1.01 0.79 -1.77 121.20 124.64 2nvl s ILE 186 Ca 0.13 1.50 -0.30 0.00 0.00 0.00 0.00 60.65 61.98 2nvl s ILE 186 Cb -0.11 -4.06 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 2nvl s ILE 186 CO 0.02 0.33 1.29 -0.69 0.00 0.00 0.00 174.94 175.89 2nvl s VAL 187 N 0.25 4.11 0.17 2.92 1.01 -0.04 -0.24 120.40 128.57 2nvl s VAL 187 Ca 0.37 1.41 -0.33 0.00 0.00 0.00 0.00 61.98 63.43 2nvl s VAL 187 Cb -0.19 -3.91 -0.15 0.00 0.00 0.00 0.00 36.38 32.13 2nvl s VAL 187 CO 0.20 -0.05 1.42 -2.65 0.00 0.00 0.00 175.10 174.02 2nvl n PRO 188 N 5.79 1.77 -1.80 2.72 -0.02 -1.26 -4.57 135.00 137.63 2nvl n PRO 188 Ca 0.13 0.64 -0.34 0.00 -2.02 0.00 0.00 63.50 61.90 2nvl n PRO 188 Cb 0.45 -2.30 0.05 0.00 -0.02 0.00 0.00 33.50 31.67 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 2.79 0.62 0.52 0.04 -1.26 -4.96 135.00 132.96 2nvl s PRO 189 Ca 0.76 1.52 -0.18 0.00 0.04 0.00 0.00 61.00 63.14 2nvl s PRO 189 Cb -0.75 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 31.83 2nvl s PRO 189 CO 0.45 -1.28 1.23 -2.14 0.04 0.00 0.00 177.00 175.31 2nvl s PRO 190 N -3.87 2.79 -0.04 0.56 0.02 -1.26 -4.94 135.00 128.26 2nvl s PRO 190 Ca 0.70 1.89 0.07 0.00 0.02 0.00 0.00 61.00 63.68 2nvl s PRO 190 Cb -0.23 -1.90 0.13 0.00 0.02 0.00 0.00 34.50 32.52 2nvl s PRO 190 CO 0.39 -1.36 1.08 0.25 -0.33 0.00 0.00 177.00 177.03 2nvl n THR 191 N -1.76 1.28 -3.89 0.99 -2.24 -1.26 -4.84 114.28 102.55 2nvl n THR 191 Ca 0.14 -1.36 -0.09 0.00 -2.27 0.00 0.00 64.05 60.47 2nvl n THR 191 Cb 0.49 0.28 -0.09 0.00 -2.10 0.00 0.00 70.33 68.92 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 -1.55 0.13 0.22 4.28 -4.23 -1.26 -5.05 115.64 108.18 2nvl s THR 192 Ca 0.12 -1.09 -0.08 0.00 -1.18 0.00 0.00 61.69 59.45 2nvl s THR 192 Cb 0.10 -1.05 0.18 0.00 1.34 0.00 0.00 72.50 73.07 2nvl s THR 192 CO 0.03 -0.60 1.71 -0.33 -0.54 0.00 0.00 174.62 174.88 2nvl h GLU 193 N 3.34 0.30 -0.64 3.99 5.08 -1.99 -0.16 114.58 124.50 2nvl h GLU 193 Ca -0.33 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 57.97 2nvl h GLU 193 Cb 1.19 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 2nvl h GLU 193 CO 0.52 0.20 0.22 -0.44 -1.00 0.00 0.00 179.01 178.51 2nvl h ASP 194 N 0.31 0.91 -0.22 1.42 3.32 -1.99 -1.75 116.42 118.42 2nvl h ASP 194 Ca 0.34 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 57.17 2nvl h ASP 194 Cb 0.50 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2nvl h ASP 194 CO -0.40 0.86 0.05 1.56 -1.72 0.00 0.00 179.24 179.59 2nvl h GLN 195 N 0.92 0.36 -0.82 3.56 4.20 -1.86 -2.47 115.11 119.00 2nvl h GLN 195 Ca 0.21 -0.09 0.19 0.00 0.06 0.00 0.00 58.65 59.02 2nvl h GLN 195 Cb 0.26 -0.05 -0.12 0.00 0.30 0.00 0.00 27.48 27.88 2nvl h GLN 195 CO -0.01 0.48 0.28 0.00 -0.67 0.00 0.00 178.83 178.91 2nvl h ALA 196 N 0.86 1.18 -0.14 3.87 0.00 -0.97 -0.69 119.26 123.37 2nvl h ALA 196 Ca 0.07 0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.09 2nvl h ALA 196 Cb 0.29 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2nvl h ALA 196 CO 0.00 -0.33 -0.12 -0.09 0.00 0.00 0.00 179.25 178.71 2nvl h ARG 197 N 0.34 0.32 -0.25 0.00 2.43 -1.18 -2.63 114.38 113.41 2nvl h ARG 197 Ca 0.48 -0.16 -0.04 0.00 -0.81 0.00 0.00 59.98 59.45 2nvl h ARG 197 Cb 0.86 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.41 2nvl h ARG 197 CO -0.52 0.70 0.02 0.00 -1.51 0.00 0.00 179.97 178.66 2nvl h ALA 198 N 0.62 0.34 -0.59 2.80 0.00 -1.33 -3.00 119.26 118.10 2nvl h ALA 198 Ca 0.02 -0.20 0.12 0.00 0.00 0.00 0.00 54.91 54.85 2nvl h ALA 198 Cb 0.63 -0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.22 2nvl h ALA 198 CO 0.03 0.05 -0.11 -0.09 0.00 0.00 0.00 179.25 179.12 2nvl h ARG 199 N 0.22 0.02 -0.04 0.00 9.65 -1.11 0.64 114.38 123.77 2nvl h ARG 199 Ca 0.07 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.95 2nvl h ARG 199 Cb 0.38 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.95 2nvl h ARG 199 CO 0.01 0.01 0.00 -1.33 2.80 0.00 0.00 179.97 181.46 2nvl n MET 200 N -5.38 0.56 0.00 0.20 2.81 -0.99 -2.89 117.12 111.43 2nvl n MET 200 Ca 0.07 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 2nvl n MET 200 Cb 0.32 -1.02 0.00 0.00 -0.71 0.00 0.00 33.22 31.81 2nvl n MET 200 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2nvl n GLU 201 N -0.45 1.90 -0.17 0.03 1.02 0.67 -4.41 120.64 119.22 2nvl n GLU 201 Ca 0.00 0.00 0.20 0.00 -0.02 0.00 0.00 57.16 57.34 2nvl n GLU 201 Cb 0.01 -0.71 0.57 0.00 -0.02 0.00 0.00 31.44 31.29 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 0.27 -2.45 1.62 4.64 0.25 -3.44 113.55 114.44 2nvl h SER 202 Ca 0.00 0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.29 2nvl h SER 202 Cb 0.37 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.41 2nvl h SER 202 CO 0.00 0.12 -0.05 0.61 -0.87 0.00 0.00 176.83 176.64 2nvl n GLY 203 N -1.57 0.10 0.04 -0.77 0.00 -1.19 -4.78 105.19 97.02 2nvl n GLY 203 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 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 -1.45 0.10 -4.27 1.61 10.64 -1.26 -4.87 117.38 117.88 2nvl n GLN 204 Ca -0.03 0.14 -0.20 0.00 -1.83 0.00 0.00 57.00 55.08 2nvl n GLN 204 Cb 0.17 -1.63 -0.12 0.00 -0.86 0.00 0.00 30.24 27.81 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 -3.06 1.57 0.49 2.61 1.51 -1.26 -5.07 117.35 114.15 2nvl s TYR 205 Ca 0.11 -0.49 -0.23 0.00 -1.01 0.00 0.00 57.07 55.45 2nvl s TYR 205 Cb 0.15 -0.83 -0.06 0.00 -0.11 0.00 0.00 41.96 41.11 2nvl s TYR 205 CO 0.50 0.20 1.27 1.03 -1.11 0.00 0.00 175.55 177.44 2nvl s ARG 206 N -2.43 3.49 -0.10 -0.62 0.52 -1.02 -4.87 118.95 113.92 2nvl s ARG 206 Ca 0.09 2.04 -0.21 0.00 -0.52 0.00 0.00 55.73 57.12 2nvl s ARG 206 Cb -0.07 -2.38 0.05 0.00 0.52 0.00 0.00 34.95 33.07 2nvl s ARG 206 CO 0.04 -0.85 0.51 -1.54 0.02 0.00 0.00 175.30 173.49 2nvl s SER 207 N -1.09 -0.48 -0.02 0.23 1.04 -1.26 -1.65 113.70 110.47 2nvl s SER 207 Ca 0.66 0.67 0.21 0.00 0.48 0.00 0.00 55.95 57.97 2nvl s SER 207 Cb -0.35 0.69 -0.31 0.00 0.10 0.00 0.00 66.02 66.14 2nvl s SER 207 CO 0.43 -0.40 0.51 0.18 0.98 0.00 0.00 173.24 174.95 2nvl n LEU 208 N 1.75 0.13 -3.61 2.42 4.32 -0.20 -5.01 117.00 116.81 2nvl n LEU 208 Ca -0.18 -0.07 -0.06 0.00 -0.02 0.00 0.00 56.01 55.69 2nvl n LEU 208 Cb 0.56 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.35 2nvl n LEU 208 CO 0.17 0.03 0.74 -0.62 -1.22 0.00 0.00 177.39 176.50 2nvl s ASP 209 N -4.22 -0.26 0.56 -1.43 -1.08 -1.21 -4.96 116.67 104.07 2nvl s ASP 209 Ca -0.06 -0.15 0.26 0.00 -0.52 0.00 0.00 52.55 52.09 2nvl s ASP 209 Cb 0.14 0.39 1.49 0.00 -1.46 0.00 0.00 42.92 43.48 2nvl s ASP 209 CO 0.87 -0.67 2.02 4.11 0.52 0.00 0.00 175.17 182.02 2nvl h TRP 210 N 2.00 0.00 -0.01 -5.34 5.08 -1.96 -0.88 115.95 114.84 2nvl h TRP 210 Ca -0.23 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.74 2nvl h TRP 210 Cb 1.23 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.39 2nvl h TRP 210 CO 0.31 0.00 -0.16 -2.67 -1.28 0.00 0.00 178.44 174.64 2nvl n TRP 211 N -4.08 0.00 -3.63 0.12 4.27 -1.26 -4.41 117.44 108.45 2nvl n TRP 211 Ca 0.06 0.00 -0.28 0.00 -3.89 0.00 0.00 57.50 53.39 2nvl n TRP 211 Cb 0.49 -0.09 -0.12 0.00 -1.36 0.00 0.00 31.31 30.23 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 -2.33 1.98 0.13 -2.67 5.99 -0.33 -4.63 117.98 116.11 2nvl s PHE 212 Ca 0.29 -2.56 0.11 0.00 0.00 0.00 0.00 56.93 54.77 2nvl s PHE 212 Cb 0.20 -1.68 -0.04 0.00 0.00 0.00 0.00 43.02 41.50 2nvl s PHE 212 CO 0.46 -0.74 -0.25 0.00 -0.00 0.00 0.00 175.22 174.69 2nvl s TRP 214 N -1.12 -0.01 0.00 0.00 -2.14 -0.66 -0.86 118.94 114.15 2nvl s TRP 214 Ca 0.15 -0.35 0.00 0.00 2.66 0.00 0.00 56.10 58.57 2nvl s TRP 214 Cb -0.10 0.32 0.00 0.00 -3.10 0.00 0.00 33.47 30.59 2nvl s TRP 214 CO 0.07 -0.91 0.00 -0.40 -2.66 0.00 0.00 176.95 173.06 2nvl n ASP 215 N -0.33 0.00 -3.40 -2.66 5.68 -0.73 -2.44 116.55 112.67 2nvl n ASP 215 Ca -0.09 -0.54 -0.26 0.00 -0.50 0.00 0.00 54.79 53.40 2nvl n ASP 215 Cb 0.62 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.52 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 0.25 1.08 2.12 -2.24 -1.26 -1.16 114.28 113.07 2nvl n THR 216 Ca 0.00 -4.28 0.12 0.00 -2.27 0.00 0.00 64.05 57.62 2nvl n THR 216 Cb 0.00 -1.95 0.22 0.00 -2.10 0.00 0.00 70.33 66.50 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 1.71 0.38 -2.41 -0.78 -0.04 -1.26 -4.93 135.00 127.67 2nvl n PRO 217 Ca 0.25 -0.25 -0.36 0.00 -0.04 0.00 0.00 63.50 63.10 2nvl n PRO 217 Cb 0.46 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.40 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 -2.79 2.95 0.72 0.55 0.00 -1.26 -5.03 121.76 116.90 2nvl s ALA 218 Ca 0.16 0.77 -0.11 0.00 0.00 0.00 0.00 51.96 52.77 2nvl s ALA 218 Cb 0.18 -3.31 0.02 0.00 0.00 0.00 0.00 23.12 20.01 2nvl s ALA 218 CO 0.65 -0.45 1.08 -1.54 0.00 0.00 0.00 175.76 175.50 2nvl s SER 219 N -1.62 5.04 0.33 0.00 1.04 -1.26 -4.87 113.70 112.36 2nvl s SER 219 Ca 0.64 1.74 0.03 0.00 0.48 0.00 0.00 55.95 58.84 2nvl s SER 219 Cb -0.23 -2.51 0.63 0.00 0.10 0.00 0.00 66.02 64.00 2nvl s SER 219 CO 0.28 -1.67 1.94 -0.09 0.98 0.00 0.00 173.24 174.67 2nvl h ARG 220 N -0.75 0.88 -0.39 4.02 2.43 -1.99 -1.92 114.38 116.66 2nvl h ARG 220 Ca -0.44 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 58.70 2nvl h ARG 220 Cb 1.22 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.54 2nvl h ARG 220 CO 0.54 0.58 0.21 -0.44 -1.51 0.00 0.00 179.97 179.35 2nvl h ASP 221 N 0.90 0.32 0.05 -3.80 3.32 -1.98 -0.04 116.42 115.19 2nvl h ASP 221 Ca 0.35 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.43 2nvl h ASP 221 Cb 0.21 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.67 2nvl h ASP 221 CO -0.12 0.23 -0.19 0.44 -1.72 0.00 0.00 179.24 177.88 2nvl h ASP 222 N 0.42 -0.53 -0.16 6.45 3.32 -1.79 0.13 116.42 124.26 2nvl h ASP 222 Ca 0.16 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 2nvl h ASP 222 Cb 0.04 0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2nvl h ASP 222 CO -0.10 -0.26 0.09 0.58 -1.72 0.00 0.00 179.24 177.84 2nvl h VAL 223 N -0.33 1.09 -0.09 -1.35 2.07 -1.26 -2.06 116.25 114.33 2nvl h VAL 223 Ca 0.04 -0.23 -0.13 0.00 0.82 0.00 0.00 66.70 67.20 2nvl h VAL 223 Cb 0.38 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 2nvl h VAL 223 CO -0.14 0.08 -0.52 -0.33 0.02 0.00 0.00 177.57 176.68 2nvl h GLU 224 N 0.17 0.24 -0.79 1.57 5.08 -0.99 0.02 114.58 119.88 2nvl h GLU 224 Ca 0.06 -0.14 0.02 0.00 -1.00 0.00 0.00 59.36 58.30 2nvl h GLU 224 Cb 0.05 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 2nvl h GLU 224 CO -0.01 0.71 0.51 1.49 -1.00 0.00 0.00 179.01 180.71 2nvl h GLU 225 N 0.19 0.98 -0.40 2.33 4.81 -0.55 -0.78 114.58 121.16 2nvl h GLU 225 Ca 0.00 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.11 2nvl h GLU 225 Cb 0.99 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 2nvl h GLU 225 CO 0.08 0.65 -0.01 0.00 -0.73 0.00 0.00 179.01 179.00 2nvl h ALA 226 N 1.31 0.54 -0.20 2.92 0.00 -0.64 -2.55 119.26 120.64 2nvl h ALA 226 Ca 0.30 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2nvl h ALA 226 Cb -0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2nvl h ALA 226 CO -0.09 0.33 -0.15 0.00 0.00 0.00 0.00 179.25 179.33 2nvl h ARG 227 N 0.54 0.34 -0.65 0.00 3.08 -0.89 -2.70 114.38 114.09 2nvl h ARG 227 Ca 0.11 -0.09 0.01 0.00 0.07 0.00 0.00 59.98 60.08 2nvl h ARG 227 Cb 0.50 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.48 2nvl h ARG 227 CO 0.02 0.49 0.43 0.00 -1.07 0.00 0.00 179.97 179.85 2nvl h ARG 228 N 0.32 0.86 -0.16 0.04 3.08 -0.73 -0.45 114.38 117.34 2nvl h ARG 228 Ca 0.06 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2nvl h ARG 228 Cb 0.46 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.31 2nvl h ARG 228 CO 0.03 0.57 0.04 1.88 -1.07 0.00 0.00 179.97 181.42 2nvl h TYR 229 N 0.89 0.26 -0.45 3.04 0.99 -1.24 -1.22 116.97 119.23 2nvl h TYR 229 Ca 0.24 -0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.90 2nvl h TYR 229 Cb -0.10 -0.07 -0.02 0.00 1.00 0.00 0.00 36.73 37.54 2nvl h TYR 229 CO -0.00 0.38 0.12 -0.07 -0.00 0.00 0.00 178.16 178.59 2nvl h LEU 230 N 0.06 0.67 -0.89 3.88 3.38 -1.51 -2.04 115.31 118.86 2nvl h LEU 230 Ca 0.05 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 57.85 2nvl h LEU 230 Cb 0.25 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 2nvl h LEU 230 CO -0.00 0.72 0.56 -0.09 0.09 0.00 0.00 178.44 179.72 2nvl h ARG 231 N 0.59 1.01 -0.38 1.13 9.65 -1.02 -0.76 114.38 124.61 2nvl h ARG 231 Ca 0.14 -0.06 -0.07 0.00 -1.10 0.00 0.00 59.98 58.89 2nvl h ARG 231 Cb 0.30 -0.23 -0.02 0.00 -1.39 0.00 0.00 29.97 28.63 2nvl h ARG 231 CO -0.00 0.67 -0.07 -0.09 2.80 0.00 0.00 179.97 183.27 2nvl h ARG 232 N 1.04 0.64 -0.34 0.20 2.43 -0.99 -2.32 114.38 115.04 2nvl h ARG 232 Ca 0.38 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 59.26 2nvl h ARG 232 Cb 0.13 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2nvl h ARG 232 CO -0.16 0.71 -0.24 0.00 -1.51 0.00 0.00 179.97 178.78 2nvl h ALA 233 N 1.33 0.95 0.00 2.80 0.00 -0.60 -3.23 119.26 120.52 2nvl h ALA 233 Ca 0.11 -0.36 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 2nvl h ALA 233 Cb 0.49 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 2nvl h ALA 233 CO 0.03 0.61 -0.63 0.00 0.00 0.00 0.00 179.25 179.26 2nvl h ALA 234 N 1.15 0.78 -2.72 0.00 0.00 -0.76 -3.46 119.26 114.25 2nvl h ALA 234 Ca 0.08 -0.57 -0.56 0.00 0.00 0.00 0.00 54.91 53.86 2nvl h ALA 234 Cb 0.72 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 2nvl h ALA 234 CO 0.06 0.78 0.04 -1.21 0.00 0.00 0.00 179.25 178.92 2nvl s GLU 235 N -3.29 4.36 0.11 0.00 0.41 -0.91 -5.04 118.70 114.33 2nvl s GLU 235 Ca 0.00 0.85 -0.31 0.00 -0.41 0.00 0.00 54.97 55.11 2nvl s GLU 235 Cb 0.11 -3.31 -0.08 0.00 -1.78 0.00 0.00 34.13 29.07 2nvl s GLU 235 CO 0.75 0.44 1.36 0.21 -0.49 0.00 0.00 175.26 177.53 2nvl s LYS 236 N -0.50 4.34 0.36 1.61 2.20 -1.26 -4.98 119.74 121.51 2nvl s LYS 236 Ca 0.33 2.03 -0.28 0.00 -0.36 0.00 0.00 55.97 57.68 2nvl s LYS 236 Cb -0.20 -3.26 -0.10 0.00 -1.51 0.00 0.00 37.83 32.76 2nvl s LYS 236 CO 0.20 -0.41 1.38 -1.25 -0.36 0.00 0.00 175.35 174.91 2nvl s PRO 237 N 1.08 4.21 0.27 4.03 0.04 -1.26 -4.98 135.00 138.39 2nvl s PRO 237 Ca 0.64 2.36 -0.30 0.00 0.04 0.00 0.00 61.00 63.74 2nvl s PRO 237 Cb -0.36 -3.00 -0.10 0.00 0.04 0.00 0.00 34.50 31.09 2nvl s PRO 237 CO 0.30 -0.36 1.37 0.00 0.04 0.00 0.00 177.00 178.35 2nvl s ALA 238 N -1.14 3.56 -0.02 8.56 0.00 -1.26 -4.68 121.76 126.78 2nvl s ALA 238 Ca 0.51 1.26 -0.02 0.00 0.00 0.00 0.00 51.96 53.71 2nvl s ALA 238 Cb -0.42 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.19 2nvl s ALA 238 CO 0.57 -0.67 0.04 1.17 0.00 0.00 0.00 175.76 176.87 2nvl n LYS 239 N 1.83 -3.41 -3.57 0.00 3.00 -1.26 -5.01 118.16 109.74 2nvl n LYS 239 Ca 0.04 2.66 -0.33 0.00 -0.00 0.00 0.00 58.31 60.68 2nvl n LYS 239 Cb 0.41 -3.43 -0.05 0.00 0.00 0.00 0.00 35.03 31.96 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 -0.41 4.29 0.36 3.14 1.43 -1.26 -5.01 118.68 121.21 2nvl s LEU 240 Ca -0.04 0.76 0.14 0.00 -1.03 0.00 0.00 54.13 53.95 2nvl s LEU 240 Cb 0.00 -3.22 0.68 0.00 0.03 0.00 0.00 46.19 43.68 2nvl s LEU 240 CO 0.12 0.09 1.78 -0.07 0.23 0.00 0.00 176.35 178.50 2nvl h LEU 241 N 3.22 0.00 -1.19 1.79 3.38 -1.96 -2.62 115.31 117.93 2nvl h LEU 241 Ca -0.48 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.53 2nvl h LEU 241 Cb 1.18 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 2nvl h LEU 241 CO 0.69 0.41 0.56 0.10 0.09 0.00 0.00 178.44 180.29 2nvl h TYR 242 N 0.00 1.01 0.53 1.13 -0.00 -1.95 -2.45 116.97 115.24 2nvl h TYR 242 Ca -0.00 0.03 -0.02 0.00 0.00 0.00 0.00 58.73 58.73 2nvl h TYR 242 Cb 0.76 -0.34 -0.01 0.00 0.00 0.00 0.00 36.73 37.14 2nvl h TYR 242 CO 0.00 0.58 -0.39 0.93 -0.00 0.00 0.00 178.16 179.28 2nvl h GLU 243 N 1.04 -0.87 -1.00 0.10 5.08 -1.89 -3.09 114.58 113.95 2nvl h GLU 243 Ca 0.34 0.06 0.27 0.00 -1.00 0.00 0.00 59.36 59.03 2nvl h GLU 243 Cb 0.06 0.20 -0.06 0.00 0.50 0.00 0.00 28.75 29.44 2nvl h GLU 243 CO -0.10 -0.58 0.69 0.93 -1.00 0.00 0.00 179.01 178.95 2nvl h GLU 244 N -0.90 0.15 0.00 2.33 5.08 -1.48 -3.52 114.58 116.25 2nvl h GLU 244 Ca -0.06 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2nvl h GLU 244 Cb 0.76 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.97 2nvl h GLU 244 CO 0.01 0.10 0.00 0.00 -1.00 0.00 0.00 179.01 178.13