#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 0.44 0.73 2.46 -4.36 -1.26 -3.83 121.20 115.38 2nvl s ILE 5 Ca 0.00 -2.00 -0.11 0.00 -0.26 0.00 0.00 60.65 58.28 2nvl s ILE 5 Cb 0.00 -2.46 0.03 0.00 1.25 0.00 0.00 42.46 41.28 2nvl s ILE 5 CO 0.00 0.00 1.07 -2.84 0.24 0.00 0.00 174.94 173.41 2nvl s PRO 6 N -3.73 2.66 0.05 0.37 0.02 -1.26 -4.94 135.00 128.17 2nvl s PRO 6 Ca 0.32 0.79 0.05 0.00 0.02 0.00 0.00 61.00 62.17 2nvl s PRO 6 Cb 0.04 -1.97 -0.04 0.00 0.02 0.00 0.00 34.50 32.55 2nvl s PRO 6 CO 0.18 -1.25 -0.05 -0.51 -0.33 0.00 0.00 177.00 175.03 2nvl s LEU 7 N -5.59 3.23 0.29 -5.54 1.43 -1.26 -5.08 118.68 106.16 2nvl s LEU 7 Ca 0.59 -0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 53.19 2nvl s LEU 7 Cb -0.14 -1.93 -0.13 0.00 0.03 0.00 0.00 46.19 44.01 2nvl s LEU 7 CO 0.54 0.23 1.19 -0.38 0.23 0.00 0.00 176.35 178.16 2nvl n ILE 8 N 1.06 1.74 0.00 -0.59 5.41 -1.26 -1.56 119.36 124.16 2nvl n ILE 8 Ca -0.14 -0.44 0.00 0.00 1.00 0.00 0.00 62.75 63.18 2nvl n ILE 8 Cb 0.52 -1.27 0.00 0.00 -0.71 0.00 0.00 39.64 38.18 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 1.27 2.96 3.78 7.39 0.00 0.33 -5.00 105.19 115.92 2nvl n GLY 9 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.22 2.80 0.18 1.61 2.02 -0.60 -4.77 118.70 119.73 2nvl s GLU 10 Ca 0.00 1.32 -0.30 0.00 0.02 0.00 0.00 54.97 56.01 2nvl s GLU 10 Cb 0.00 -1.95 -0.08 0.00 0.10 0.00 0.00 34.13 32.20 2nvl s GLU 10 CO 0.00 -1.24 1.04 0.50 0.02 0.00 0.00 175.26 175.58 2nvl s ARG 11 N -4.23 4.67 0.10 1.61 3.52 -1.26 -0.89 118.95 122.46 2nvl s ARG 11 Ca 0.65 1.62 -0.36 0.00 -0.13 0.00 0.00 55.73 57.52 2nvl s ARG 11 Cb -0.19 -3.29 -0.17 0.00 -1.56 0.00 0.00 34.95 29.74 2nvl s ARG 11 CO 0.43 0.19 1.25 0.34 -0.81 0.00 0.00 175.30 176.70 2nvl n PHE 12 N 2.22 1.31 -1.76 5.12 7.35 0.68 -4.82 117.46 127.56 2nvl n PHE 12 Ca 0.01 0.71 -0.42 0.00 -0.76 0.00 0.00 57.45 56.99 2nvl n PHE 12 Cb 0.47 -2.28 -0.03 0.00 0.35 0.00 0.00 39.48 37.99 2nvl n PHE 12 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 2nvl s PRO 13 N 0.19 4.13 0.25 -7.13 0.02 -1.26 -4.48 135.00 126.72 2nvl s PRO 13 Ca 0.82 2.58 -0.31 0.00 0.02 0.00 0.00 61.00 64.11 2nvl s PRO 13 Cb -0.97 -3.07 -0.11 0.00 0.02 0.00 0.00 34.50 30.37 2nvl s PRO 13 CO 0.50 -0.71 1.62 -2.00 -0.33 0.00 0.00 177.00 176.07 2nvl s GLU 14 N 0.75 4.14 -0.21 5.54 2.56 -1.26 -4.46 118.70 125.77 2nvl s GLU 14 Ca 0.71 2.54 -0.28 0.00 0.00 0.00 0.00 54.97 57.95 2nvl s GLU 14 Cb -0.49 -3.06 0.13 0.00 2.00 0.00 0.00 34.13 32.72 2nvl s GLU 14 CO 0.36 -0.65 1.03 0.00 -0.56 0.00 0.00 175.26 175.45 2nvl s MET 15 N 0.13 0.53 -0.02 4.30 0.23 -0.86 -5.01 119.30 118.59 2nvl s MET 15 Ca 0.67 0.29 -0.18 0.00 -1.03 0.00 0.00 55.69 55.43 2nvl s MET 15 Cb -0.47 0.25 -0.05 0.00 -1.53 0.00 0.00 34.83 33.03 2nvl s MET 15 CO 0.42 -0.13 0.51 -1.21 -2.03 0.00 0.00 175.02 172.57 2nvl s GLU 16 N -0.62 4.21 0.04 3.16 2.02 -1.26 -1.18 118.70 125.06 2nvl s GLU 16 Ca 0.00 0.58 0.04 0.00 0.02 0.00 0.00 54.97 55.62 2nvl s GLU 16 Cb -0.02 -3.32 -0.02 0.00 0.10 0.00 0.00 34.13 30.87 2nvl s GLU 16 CO -0.02 0.44 -0.13 0.14 0.02 0.00 0.00 175.26 175.71 2nvl s VAL 17 N -0.35 1.03 -0.23 2.63 -7.23 0.13 -4.98 120.40 111.39 2nvl s VAL 17 Ca 0.27 -0.98 -0.20 0.00 -1.81 0.00 0.00 61.98 59.27 2nvl s VAL 17 Cb -0.17 -0.94 -0.02 0.00 0.56 0.00 0.00 36.38 35.80 2nvl s VAL 17 CO 0.15 -0.03 0.59 -0.89 -0.31 0.00 0.00 175.10 174.60 2nvl s THR 18 N -0.87 5.03 0.47 5.32 2.01 -1.26 -1.43 115.64 124.91 2nvl s THR 18 Ca 0.00 1.06 0.06 0.00 0.31 0.00 0.00 61.69 63.13 2nvl s THR 18 Cb -0.08 -3.90 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 2nvl s THR 18 CO 0.01 0.09 0.28 0.42 -0.69 0.00 0.00 174.62 174.73 2nvl s THR 19 N 2.14 2.01 -2.00 -0.82 -4.23 -0.04 -0.42 115.64 112.28 2nvl s THR 19 Ca 0.25 -1.59 0.01 0.00 -1.18 0.00 0.00 61.69 59.19 2nvl s THR 19 Cb -0.16 -2.60 0.04 0.00 1.34 0.00 0.00 72.50 71.12 2nvl s THR 19 CO 0.09 0.00 1.04 -0.90 -0.54 0.00 0.00 174.62 174.31 2nvl n ASP 20 N -1.49 0.19 -0.04 3.99 5.75 -0.95 -2.40 116.55 121.61 2nvl n ASP 20 Ca -0.02 -1.99 0.04 0.00 -0.01 0.00 0.00 54.79 52.81 2nvl n ASP 20 Cb 0.64 -0.02 -0.04 0.00 -1.03 0.00 0.00 41.12 40.67 2nvl n ASP 20 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2nvl n HIS 21 N -0.40 0.00 0.00 2.11 8.25 -1.26 -4.97 115.22 118.95 2nvl n HIS 21 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2nvl n HIS 21 Cb 0.03 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.14 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 1.12 1.01 3.75 -1.41 0.00 -1.01 -5.07 105.19 103.58 2nvl n GLY 22 Ca 0.02 -2.08 -0.40 0.00 0.00 0.00 0.00 46.02 43.56 2nvl n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nvl s VAL 23 N -1.02 4.68 0.08 1.61 1.01 -1.26 -0.86 120.40 124.65 2nvl s VAL 23 Ca 0.00 1.61 -0.03 0.00 0.00 0.00 0.00 61.98 63.56 2nvl s VAL 23 Cb 0.00 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 2nvl s VAL 23 CO 0.00 0.40 0.06 0.27 0.00 0.00 0.00 175.10 175.82 2nvl s ILE 24 N -0.25 0.17 -0.16 2.22 -4.36 -0.52 -4.97 121.20 113.32 2nvl s ILE 24 Ca 0.38 -1.65 -0.05 0.00 -0.26 0.00 0.00 60.65 59.06 2nvl s ILE 24 Cb -0.21 -1.59 -0.03 0.00 1.25 0.00 0.00 42.46 41.88 2nvl s ILE 24 CO 0.23 -0.77 0.02 -0.75 0.24 0.00 0.00 174.94 173.90 2nvl s LYS 25 N -3.93 3.77 -0.01 0.37 2.47 -1.26 -0.69 119.74 120.45 2nvl s LYS 25 Ca 0.10 -0.41 0.08 0.00 -1.56 0.00 0.00 55.97 54.18 2nvl s LYS 25 Cb 0.07 -3.06 -0.02 0.00 -1.46 0.00 0.00 37.83 33.36 2nvl s LYS 25 CO -0.07 0.31 -0.26 -0.51 0.16 0.00 0.00 175.35 174.97 2nvl s LEU 26 N 0.23 2.07 0.00 5.43 1.43 -0.32 -0.03 118.68 127.48 2nvl s LEU 26 Ca 0.01 -0.48 0.30 0.00 -1.03 0.00 0.00 54.13 52.93 2nvl s LEU 26 Cb -0.13 -1.34 1.53 0.00 0.03 0.00 0.00 46.19 46.28 2nvl s LEU 26 CO 0.01 0.31 2.05 -0.81 0.23 0.00 0.00 176.35 178.15 2nvl n PRO 27 N 2.37 0.54 -0.31 1.29 -0.04 -1.26 -2.03 135.00 135.56 2nvl n PRO 27 Ca -0.16 -0.04 0.10 0.00 -0.04 0.00 0.00 63.50 63.36 2nvl n PRO 27 Cb 0.51 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.69 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 0.09 -0.44 -0.97 3.54 5.19 -1.93 0.22 116.42 122.11 2nvl h ASP 28 Ca 0.00 0.24 0.24 0.00 -0.62 0.00 0.00 57.03 56.89 2nvl h ASP 28 Cb 0.26 0.43 -0.07 0.00 0.18 0.00 0.00 39.33 40.13 2nvl h ASP 28 CO 0.00 -0.27 0.65 -0.74 -3.12 0.00 0.00 179.24 175.76 2nvl h HIS 29 N 0.06 0.44 0.04 4.55 2.76 -0.81 -1.30 115.15 120.89 2nvl h HIS 29 Ca 0.50 0.01 -0.38 0.00 -2.20 0.00 0.00 60.37 58.31 2nvl h HIS 29 Cb 0.96 -0.13 -0.05 0.00 1.55 0.00 0.00 27.41 29.73 2nvl h HIS 29 CO -0.48 0.08 -2.32 0.66 -1.30 0.00 0.00 177.93 174.57 2nvl n TYR 30 N -4.48 0.39 0.05 5.26 4.02 0.66 -4.08 117.16 118.98 2nvl n TYR 30 Ca 0.21 0.09 -0.11 0.00 -0.01 0.00 0.00 57.90 58.08 2nvl n TYR 30 Cb 0.84 -1.05 -0.04 0.00 -0.02 0.00 0.00 39.34 39.07 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 0.02 0.42 0.00 -0.72 2.07 -1.07 0.74 116.25 117.71 2nvl h VAL 31 Ca -0.53 0.00 0.00 0.00 0.82 0.00 0.00 66.70 66.99 2nvl h VAL 31 Cb 1.96 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 32.15 2nvl h VAL 31 CO -0.03 0.00 0.01 -1.54 0.02 0.00 0.00 177.57 176.03 2nvl n SER 32 N -5.37 0.13 -0.73 0.57 3.41 -0.51 0.28 113.62 111.40 2nvl n SER 32 Ca -0.04 0.56 0.07 0.00 -0.26 0.00 0.00 58.87 59.20 2nvl n SER 32 Cb 0.28 -0.57 0.14 0.00 -0.26 0.00 0.00 64.21 63.80 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 -1.67 1.97 -3.22 4.33 6.02 -0.36 -4.97 117.38 119.48 2nvl n GLN 33 Ca -0.00 -1.83 -0.19 0.00 -0.01 0.00 0.00 57.00 54.97 2nvl n GLN 33 Cb 0.01 -1.33 0.05 0.00 1.02 0.00 0.00 30.24 30.00 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 0.86 -0.28 3.43 1.08 0.00 0.14 -5.00 105.19 105.43 2nvl n GLY 34 Ca 0.12 0.04 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -5.87 2.30 0.65 1.61 -0.14 0.11 -4.88 119.74 113.52 2nvl s LYS 35 Ca 0.40 -0.82 -0.11 0.00 -1.36 0.00 0.00 55.97 54.08 2nvl s LYS 35 Cb -0.18 -2.25 -0.02 0.00 -1.68 0.00 0.00 37.83 33.70 2nvl s LYS 35 CO 0.50 0.59 1.04 -1.58 -0.76 0.00 0.00 175.35 175.14 2nvl s TRP 36 N -0.76 3.36 0.02 3.18 0.52 0.32 -3.98 118.94 121.60 2nvl s TRP 36 Ca 0.12 1.36 0.01 0.00 0.02 0.00 0.00 56.10 57.61 2nvl s TRP 36 Cb -0.10 -2.81 -0.02 0.00 -1.15 0.00 0.00 33.47 29.39 2nvl s TRP 36 CO 0.01 -0.96 -0.05 -0.59 0.02 0.00 0.00 176.95 175.39 2nvl s PHE 37 N -3.08 0.43 -0.31 -1.98 -0.12 -0.02 0.21 117.98 113.12 2nvl s PHE 37 Ca 0.57 -0.41 -0.06 0.00 -0.05 0.00 0.00 56.93 56.98 2nvl s PHE 37 Cb -0.13 -0.27 0.02 0.00 -0.63 0.00 0.00 43.02 42.01 2nvl s PHE 37 CO 0.54 -0.10 0.08 0.08 -0.05 0.00 0.00 175.22 175.76 2nvl s VAL 38 N -1.11 3.82 -0.26 -2.49 1.01 0.50 -1.16 120.40 120.71 2nvl s VAL 38 Ca -0.10 -0.87 -0.18 0.00 0.00 0.00 0.00 61.98 60.83 2nvl s VAL 38 Cb -0.08 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.24 2nvl s VAL 38 CO -0.00 -0.00 0.54 -0.22 0.00 0.00 0.00 175.10 175.41 2nvl s LEU 39 N 1.45 4.06 -0.06 3.92 0.20 -0.59 -1.90 118.68 125.76 2nvl s LEU 39 Ca 0.01 0.55 0.03 0.00 0.69 0.00 0.00 54.13 55.41 2nvl s LEU 39 Cb -0.18 -2.70 0.00 0.00 -0.43 0.00 0.00 46.19 42.89 2nvl s LEU 39 CO 0.02 -0.31 -0.16 0.72 -0.29 0.00 0.00 176.35 176.33 2nvl s PHE 40 N 2.35 1.76 0.23 5.38 -0.12 -0.94 -0.78 117.98 125.86 2nvl s PHE 40 Ca 0.22 -0.62 0.06 0.00 -0.05 0.00 0.00 56.93 56.54 2nvl s PHE 40 Cb -0.16 -1.23 -0.04 0.00 -0.63 0.00 0.00 43.02 40.97 2nvl s PHE 40 CO 0.09 -0.27 0.20 -1.54 -0.05 0.00 0.00 175.22 173.65 2nvl s SER 41 N 0.38 5.60 -0.01 1.98 1.04 -0.31 -1.36 113.70 121.03 2nvl s SER 41 Ca -0.12 -0.19 -0.00 0.00 0.48 0.00 0.00 55.95 56.12 2nvl s SER 41 Cb -0.15 -1.46 0.01 0.00 0.10 0.00 0.00 66.02 64.53 2nvl s SER 41 CO 0.04 -0.01 0.02 -1.00 0.98 0.00 0.00 173.24 173.27 2nvl s HIS 42 N -2.02 0.01 0.34 5.02 3.76 0.11 -4.10 115.29 118.41 2nvl s HIS 42 Ca 0.32 0.08 0.18 0.00 -0.15 0.00 0.00 55.06 55.49 2nvl s HIS 42 Cb -0.09 -0.10 0.92 0.00 1.11 0.00 0.00 32.58 34.42 2nvl s HIS 42 CO 0.25 -0.04 1.88 -1.35 -0.85 0.00 0.00 174.74 174.62 2nvl h PRO 43 N 6.66 0.00 -1.53 8.40 0.11 -1.80 -3.31 132.00 140.53 2nvl h PRO 43 Ca -0.34 0.00 0.17 0.00 0.11 0.00 0.00 66.00 65.94 2nvl h PRO 43 Cb 1.17 0.00 -0.22 0.00 0.11 0.00 0.00 31.00 32.06 2nvl h PRO 43 CO 0.49 0.29 0.70 0.00 -0.21 0.00 0.00 178.00 179.27 2nvl s ALA 44 N -4.08 -1.99 0.60 -0.75 0.00 -1.26 -4.23 121.76 110.04 2nvl s ALA 44 Ca -0.02 1.58 -0.17 0.00 0.00 0.00 0.00 51.96 53.35 2nvl s ALA 44 Cb 0.13 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.65 2nvl s ALA 44 CO 0.68 -0.42 1.10 -0.51 0.00 0.00 0.00 175.76 176.61 2nvl s ASP 45 N -1.56 5.53 -1.02 0.00 1.11 -1.26 -3.95 116.67 115.52 2nvl s ASP 45 Ca 0.04 2.02 -0.04 0.00 0.18 0.00 0.00 52.55 54.75 2nvl s ASP 45 Cb -0.01 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.43 2nvl s ASP 45 CO -0.04 -1.34 0.87 0.49 1.18 0.00 0.00 175.17 176.33 2nvl n PHE 46 N -1.87 -2.03 -4.69 4.23 3.01 -1.26 -5.03 117.46 109.82 2nvl n PHE 46 Ca 0.10 0.78 -0.23 0.00 1.01 0.00 0.00 57.45 59.11 2nvl n PHE 46 Cb 0.52 -4.33 -0.15 0.00 -0.01 0.00 0.00 39.48 35.51 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 -3.27 1.18 0.06 4.37 -4.23 -1.25 -5.08 115.64 107.42 2nvl s THR 47 Ca 0.24 -0.65 -0.18 0.00 -1.18 0.00 0.00 61.69 59.93 2nvl s THR 47 Cb -0.11 -0.99 -0.13 0.00 1.34 0.00 0.00 72.50 72.62 2nvl s THR 47 CO 0.58 0.33 1.35 1.55 -0.54 0.00 0.00 174.62 177.89 2nvl h PRO 48 N 5.75 0.51 -0.80 3.99 0.13 -1.95 -1.92 132.00 137.71 2nvl h PRO 48 Ca -0.35 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 2nvl h PRO 48 Cb 1.16 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2nvl h PRO 48 CO 0.49 0.88 0.00 0.28 -0.23 0.00 0.00 178.00 179.42 2nvl n VAL 49 N -4.40 0.02 0.00 1.56 0.31 -1.26 -1.54 118.33 113.02 2nvl n VAL 49 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.27 2nvl n VAL 49 Cb 0.44 -0.22 0.00 0.00 -0.91 0.00 0.00 33.84 33.15 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 0.68 0.00 -0.25 2.52 -1.04 -0.72 -1.82 114.28 113.65 2nvl n THR 51 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 2nvl n THR 51 Cb 0.01 0.00 0.19 0.00 -1.82 0.00 0.00 70.33 68.71 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 1.22 -0.18 12.58 1.35 -1.57 -1.13 112.91 125.18 2nvl h THR 52 Ca 0.00 -0.52 -0.02 0.00 -0.55 0.00 0.00 66.41 65.33 2nvl h THR 52 Cb 0.00 0.15 -0.01 0.00 -1.73 0.00 0.00 68.15 66.56 2nvl h THR 52 CO 0.00 0.24 0.05 -0.33 -0.25 0.00 0.00 175.52 175.23 2nvl h GLU 53 N 1.07 0.28 -0.62 4.72 5.08 -1.63 0.44 114.58 123.93 2nvl h GLU 53 Ca 0.28 -0.06 0.10 0.00 -1.00 0.00 0.00 59.36 58.67 2nvl h GLU 53 Cb -0.01 -0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.12 2nvl h GLU 53 CO -0.05 0.41 0.22 0.74 -1.00 0.00 0.00 179.01 179.33 2nvl h PHE 54 N 0.10 0.38 -0.42 4.33 -1.00 -1.80 0.61 116.94 119.14 2nvl h PHE 54 Ca 0.06 0.03 -0.09 0.00 2.81 0.00 0.00 57.97 60.78 2nvl h PHE 54 Cb 0.25 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 39.72 2nvl h PHE 54 CO 0.01 0.08 -0.11 0.28 -1.61 0.00 0.00 178.31 176.95 2nvl h VAL 55 N 0.39 1.25 -0.24 -0.55 2.07 -1.09 -1.07 116.25 117.01 2nvl h VAL 55 Ca 0.32 -1.15 -0.06 0.00 0.82 0.00 0.00 66.70 66.62 2nvl h VAL 55 Cb 0.41 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2nvl h VAL 55 CO -0.33 0.39 -0.10 -1.28 0.02 0.00 0.00 177.57 176.28 2nvl h SER 56 N 0.68 0.50 -0.17 0.57 0.87 0.04 -1.88 113.55 114.16 2nvl h SER 56 Ca 0.12 -0.40 0.01 0.00 -1.23 0.00 0.00 61.79 60.29 2nvl h SER 56 Cb 0.58 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.38 2nvl h SER 56 CO 0.04 0.78 0.08 -0.26 -0.53 0.00 0.00 176.83 176.94 2nvl h PHE 57 N 0.21 0.14 -0.81 2.24 -1.00 -0.88 -2.88 116.94 113.96 2nvl h PHE 57 Ca 0.06 0.01 0.14 0.00 2.81 0.00 0.00 57.97 60.98 2nvl h PHE 57 Cb 0.59 -0.04 -0.09 0.00 3.61 0.00 0.00 35.95 40.02 2nvl h PHE 57 CO 0.06 0.08 0.40 0.00 -1.61 0.00 0.00 178.31 177.24 2nvl h ALA 58 N 1.09 1.19 -0.62 2.45 0.00 -1.13 -0.89 119.26 121.35 2nvl h ALA 58 Ca 0.07 0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.09 2nvl h ALA 58 Cb 0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2nvl h ALA 58 CO -0.05 -0.10 0.41 0.00 0.00 0.00 0.00 179.25 179.51 2nvl h ARG 59 N 0.59 0.74 -0.55 0.00 -0.00 -1.17 -2.72 114.38 111.27 2nvl h ARG 59 Ca 0.44 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.87 2nvl h ARG 59 Cb 0.60 -0.17 0.00 0.00 0.00 0.00 0.00 29.97 30.40 2nvl h ARG 59 CO -0.35 0.49 0.00 0.54 0.00 0.00 0.00 179.97 180.65 2nvl n ARG 60 N -4.46 4.39 0.25 0.04 1.74 -0.45 -4.64 116.66 113.54 2nvl n ARG 60 Ca 0.07 -3.06 -0.16 0.00 -0.77 0.00 0.00 57.85 53.94 2nvl n ARG 60 Cb 0.11 -2.12 -0.08 0.00 -1.02 0.00 0.00 32.46 29.34 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 3.74 -0.56 -0.82 -1.55 3.20 -0.94 0.20 116.97 120.25 2nvl h TYR 61 Ca 0.00 -0.01 0.14 0.00 3.14 0.00 0.00 58.73 62.00 2nvl h TYR 61 Cb 1.79 0.18 -0.09 0.00 1.54 0.00 0.00 36.73 40.15 2nvl h TYR 61 CO 0.94 -0.32 0.40 0.93 -1.64 0.00 0.00 178.16 178.48 2nvl h GLU 62 N -0.66 0.57 -0.42 1.82 5.08 -1.83 0.30 114.58 119.45 2nvl h GLU 62 Ca -0.06 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2nvl h GLU 62 Cb 0.49 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 2nvl h GLU 62 CO 0.10 0.38 0.25 -0.44 -1.00 0.00 0.00 179.01 178.30 2nvl h ASP 63 N 0.59 0.50 -0.18 1.42 5.19 -1.80 -1.67 116.42 120.48 2nvl h ASP 63 Ca 0.44 -0.06 -0.01 0.00 -0.62 0.00 0.00 57.03 56.78 2nvl h ASP 63 Cb 0.62 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.99 2nvl h ASP 63 CO -0.36 0.42 0.08 -0.26 -3.12 0.00 0.00 179.24 175.99 2nvl h PHE 64 N 0.55 0.26 -0.99 4.55 -1.00 -0.50 -3.13 116.94 116.68 2nvl h PHE 64 Ca 0.15 -0.02 0.09 0.00 2.81 0.00 0.00 57.97 61.01 2nvl h PHE 64 Cb 0.01 -0.08 -0.07 0.00 3.61 0.00 0.00 35.95 39.42 2nvl h PHE 64 CO -0.03 0.31 0.63 1.96 -1.61 0.00 0.00 178.31 179.57 2nvl h GLN 65 N 0.14 1.03 0.00 1.51 1.08 -0.87 -0.98 115.11 117.02 2nvl h GLN 65 Ca 0.06 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2nvl h GLN 65 Cb 0.15 -0.23 0.00 0.00 -0.05 0.00 0.00 27.48 27.35 2nvl h GLN 65 CO -0.01 0.68 0.00 -0.09 -0.95 0.00 0.00 178.83 178.47 2nvl h ARG 66 N 1.06 0.00 -0.47 1.46 2.43 -1.25 -0.09 114.38 117.52 2nvl h ARG 66 Ca 0.46 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.63 2nvl h ARG 66 Cb 0.34 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2nvl h ARG 66 CO -0.21 0.00 0.00 1.28 -1.51 0.00 0.00 179.97 179.53 2nvl n LEU 67 N -2.61 3.41 -0.99 3.80 4.77 -0.71 -4.96 117.00 119.71 2nvl n LEU 67 Ca -0.00 -1.74 -0.07 0.00 -0.03 0.00 0.00 56.01 54.17 2nvl n LEU 67 Cb 0.16 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 40.95 2nvl n LEU 67 CO 0.19 0.80 -0.03 0.61 -1.33 0.00 0.00 177.39 177.63 2nvl n GLY 68 N 1.28 0.25 3.31 -0.72 0.00 -0.05 -4.88 105.19 104.37 2nvl n GLY 68 Ca 0.18 -0.54 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.60 3.11 0.25 1.61 1.01 -0.45 -0.52 120.40 122.80 2nvl s VAL 69 Ca 0.06 -0.60 -0.06 0.00 0.00 0.00 0.00 61.98 61.39 2nvl s VAL 69 Cb -0.03 -2.37 -0.06 0.00 0.00 0.00 0.00 36.38 33.92 2nvl s VAL 69 CO 0.08 0.47 0.52 -1.81 0.00 0.00 0.00 175.10 174.36 2nvl s ASP 70 N 1.07 6.49 0.03 3.32 1.01 0.13 -3.47 116.67 125.25 2nvl s ASP 70 Ca 0.00 0.73 0.06 0.00 0.71 0.00 0.00 52.55 54.05 2nvl s ASP 70 Cb -0.15 -2.15 -0.03 0.00 1.01 0.00 0.00 42.92 41.60 2nvl s ASP 70 CO -0.02 -0.12 -0.17 -0.76 0.21 0.00 0.00 175.17 174.32 2nvl s LEU 71 N -3.22 2.67 -0.16 1.23 1.43 -1.26 -0.37 118.68 119.00 2nvl s LEU 71 Ca 0.44 -0.37 -0.07 0.00 -1.03 0.00 0.00 54.13 53.10 2nvl s LEU 71 Cb -0.11 -1.56 0.07 0.00 0.03 0.00 0.00 46.19 44.62 2nvl s LEU 71 CO 0.27 0.27 0.37 -0.51 0.23 0.00 0.00 176.35 176.98 2nvl s ILE 72 N -0.91 -0.27 0.70 -0.59 2.07 -0.80 -4.11 121.20 117.30 2nvl s ILE 72 Ca 0.15 0.15 -0.05 0.00 -1.41 0.00 0.00 60.65 59.48 2nvl s ILE 72 Cb -0.11 -0.57 0.08 0.00 0.13 0.00 0.00 42.46 41.99 2nvl s ILE 72 CO 0.05 0.06 1.00 -0.83 -1.91 0.00 0.00 174.94 173.31 2nvl s GLY 73 N 1.90 1.73 -0.13 1.50 0.00 -0.09 -2.22 107.32 110.01 2nvl s GLY 73 Ca -0.06 -1.15 -0.05 0.00 0.00 0.00 0.00 44.72 43.46 2nvl s GLY 73 CO -0.12 -0.70 0.28 -2.27 0.00 0.00 0.00 173.10 170.29 2nvl s LEU 74 N -5.21 -0.06 0.02 0.66 1.98 -0.46 0.10 118.68 115.71 2nvl s LEU 74 Ca 0.62 0.62 -0.04 0.00 -2.89 0.00 0.00 54.13 52.44 2nvl s LEU 74 Cb -0.09 0.81 -0.01 0.00 0.66 0.00 0.00 46.19 47.56 2nvl s LEU 74 CO 0.44 -0.21 0.07 -0.55 -1.89 0.00 0.00 176.35 174.21 2nvl s SER 75 N 1.94 0.14 -1.31 3.68 0.15 -0.99 0.10 113.70 117.41 2nvl s SER 75 Ca -0.04 -0.39 -0.08 0.00 0.70 0.00 0.00 55.95 56.14 2nvl s SER 75 Cb -0.11 0.18 0.14 0.00 -1.71 0.00 0.00 66.02 64.51 2nvl s SER 75 CO -0.09 -0.38 2.10 0.52 1.20 0.00 0.00 173.24 176.58 2nvl n VAL 76 N 1.32 4.66 -3.63 4.45 0.31 -1.24 -1.93 118.33 122.27 2nvl n VAL 76 Ca -0.22 -4.30 -0.13 0.00 -0.01 0.00 0.00 64.34 59.68 2nvl n VAL 76 Cb 0.56 -2.27 -0.06 0.00 -0.91 0.00 0.00 33.84 31.16 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 0.73 -0.34 1.00 4.52 -0.00 -1.26 -4.79 116.67 116.53 2nvl s ASP 77 Ca 0.46 0.07 -0.12 0.00 -0.00 0.00 0.00 52.55 52.95 2nvl s ASP 77 Cb 0.13 0.45 0.19 0.00 -0.00 0.00 0.00 42.92 43.69 2nvl s ASP 77 CO -0.03 -0.68 1.09 -0.94 -0.00 0.00 0.00 175.17 174.61 2nvl s SER 78 N -1.98 2.60 0.41 0.27 1.04 -1.26 -3.48 113.70 111.29 2nvl s SER 78 Ca -0.05 1.18 0.13 0.00 0.48 0.00 0.00 55.95 57.69 2nvl s SER 78 Cb -0.01 -1.85 0.85 0.00 0.10 0.00 0.00 66.02 65.11 2nvl s SER 78 CO -0.02 -3.15 1.91 1.62 0.98 0.00 0.00 173.24 174.58 2nvl h VAL 79 N -1.90 1.19 -0.18 5.02 3.04 -1.95 -2.10 116.25 119.37 2nvl h VAL 79 Ca -0.55 -0.92 -0.19 0.00 -1.01 0.00 0.00 66.70 64.03 2nvl h VAL 79 Cb 1.33 1.47 0.00 0.00 -2.01 0.00 0.00 31.29 32.08 2nvl h VAL 79 CO 0.58 0.27 -0.65 -0.26 -1.01 0.00 0.00 177.57 176.50 2nvl h PHE 80 N 0.03 0.87 -0.34 3.17 -1.00 -2.00 -1.87 116.94 115.81 2nvl h PHE 80 Ca 0.00 -0.35 -0.13 0.00 2.81 0.00 0.00 57.97 60.31 2nvl h PHE 80 Cb 0.47 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.87 2nvl h PHE 80 CO 0.00 1.14 -0.30 0.77 -1.61 0.00 0.00 178.31 178.31 2nvl h SER 81 N 0.49 0.74 -0.21 2.17 0.02 -1.84 -2.59 113.55 112.33 2nvl h SER 81 Ca -0.01 -0.29 0.01 0.00 -0.84 0.00 0.00 61.79 60.65 2nvl h SER 81 Cb 1.24 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.55 2nvl h SER 81 CO 0.13 0.99 0.11 0.45 -1.14 0.00 0.00 176.83 177.38 2nvl h HIS 82 N 0.61 0.21 -0.49 3.45 3.86 -1.08 0.72 115.15 122.43 2nvl h HIS 82 Ca 0.07 0.01 -0.08 0.00 -1.16 0.00 0.00 60.37 59.21 2nvl h HIS 82 Cb 0.81 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 29.20 2nvl h HIS 82 CO 0.04 0.13 -0.01 0.82 0.86 0.00 0.00 177.93 179.76 2nvl h ILE 83 N 0.24 1.25 -0.52 2.45 2.04 -1.31 -1.54 117.51 120.12 2nvl h ILE 83 Ca 0.08 -1.05 -0.04 0.00 1.00 0.00 0.00 64.86 64.86 2nvl h ILE 83 Cb 0.01 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 2nvl h ILE 83 CO -0.05 0.37 0.18 0.11 0.00 0.00 0.00 178.15 178.76 2nvl h LYS 84 N 0.77 0.80 0.17 2.37 1.79 -1.04 -1.61 116.57 119.82 2nvl h LYS 84 Ca 0.15 -0.16 -0.01 0.00 -2.18 0.00 0.00 60.65 58.45 2nvl h LYS 84 Cb 0.48 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 2nvl h LYS 84 CO 0.02 0.73 -0.08 2.35 -1.08 0.00 0.00 179.45 181.39 2nvl h TRP 85 N 0.71 -0.21 -0.97 -1.35 7.01 -0.81 -1.16 115.95 119.17 2nvl h TRP 85 Ca 0.17 -0.01 0.08 0.00 2.11 0.00 0.00 58.89 61.24 2nvl h TRP 85 Cb 0.25 0.07 -0.07 0.00 -2.10 0.00 0.00 29.16 27.31 2nvl h TRP 85 CO 0.01 -0.11 0.61 0.87 -2.79 0.00 0.00 178.44 177.04 2nvl h LYS 86 N -0.26 1.05 -0.77 2.65 1.57 -1.23 -0.35 116.57 119.23 2nvl h LYS 86 Ca -0.02 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 2nvl h LYS 86 Cb 0.20 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 2nvl h LYS 86 CO 0.04 0.69 0.36 1.49 -0.57 0.00 0.00 179.45 181.46 2nvl h GLU 87 N 1.08 1.11 -0.17 3.15 4.81 -1.13 -1.59 114.58 121.84 2nvl h GLU 87 Ca 0.44 -0.17 -0.03 0.00 -0.13 0.00 0.00 59.36 59.47 2nvl h GLU 87 Cb 0.25 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2nvl h GLU 87 CO -0.20 0.87 -0.01 2.35 -0.73 0.00 0.00 179.01 181.29 2nvl h TRP 88 N 1.09 0.33 -0.41 0.92 7.01 -0.50 -0.56 115.95 123.83 2nvl h TRP 88 Ca 0.26 -0.06 0.08 0.00 2.11 0.00 0.00 58.89 61.28 2nvl h TRP 88 Cb 0.13 -0.09 -0.08 0.00 -2.10 0.00 0.00 29.16 27.03 2nvl h TRP 88 CO 0.01 0.53 -0.10 0.82 -2.79 0.00 0.00 178.44 176.91 2nvl h ILE 89 N 0.04 0.59 -0.53 2.65 2.04 -0.88 -0.73 117.51 120.68 2nvl h ILE 89 Ca 0.05 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.82 2nvl h ILE 89 Cb 0.41 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2nvl h ILE 89 CO 0.01 0.00 -0.01 -0.08 0.00 0.00 0.00 178.15 178.07 2nvl h GLU 90 N -0.00 0.95 -0.26 2.37 4.81 -1.16 -0.70 114.58 120.59 2nvl h GLU 90 Ca 0.19 -0.31 -0.13 0.00 -0.13 0.00 0.00 59.36 58.99 2nvl h GLU 90 Cb 0.30 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 2nvl h GLU 90 CO -0.42 0.97 -0.34 -0.09 -0.73 0.00 0.00 179.01 178.40 2nvl h ARG 91 N 0.83 0.69 0.00 1.92 2.43 -0.79 -1.04 114.38 118.41 2nvl h ARG 91 Ca 0.15 -0.39 -0.24 0.00 -0.81 0.00 0.00 59.98 58.68 2nvl h ARG 91 Cb 0.55 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.08 2nvl h ARG 91 CO 0.03 1.01 -1.90 0.72 -1.51 0.00 0.00 179.97 178.32 2nvl n HIS 92 N -4.24 0.50 -0.04 2.20 8.25 -0.31 -4.34 115.22 117.25 2nvl n HIS 92 Ca -0.04 0.17 0.05 0.00 -0.26 0.00 0.00 57.72 57.64 2nvl n HIS 92 Cb 0.50 -1.00 -0.16 0.00 1.12 0.00 0.00 29.99 30.45 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 -2.79 0.40 -0.88 1.59 5.41 -0.28 -4.69 119.36 118.11 2nvl n ILE 93 Ca -0.19 -0.59 0.00 0.00 1.00 0.00 0.00 62.75 62.97 2nvl n ILE 93 Cb 0.96 -0.13 0.00 0.00 -0.71 0.00 0.00 39.64 39.76 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 1.43 0.56 3.35 7.39 0.00 -0.40 -4.81 105.19 112.70 2nvl n GLY 94 Ca -0.12 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 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 2.91 -0.01 1.61 1.01 -1.25 -4.97 120.40 117.70 2nvl s VAL 95 Ca 0.00 -0.71 -0.19 0.00 0.00 0.00 0.00 61.98 61.08 2nvl s VAL 95 Cb 0.00 -2.21 -0.05 0.00 0.00 0.00 0.00 36.38 34.11 2nvl s VAL 95 CO 0.00 0.53 0.54 -0.60 0.00 0.00 0.00 175.10 175.57 2nvl s ARG 96 N 0.39 4.25 -0.48 2.72 3.52 -1.26 -3.43 118.95 124.65 2nvl s ARG 96 Ca -0.11 0.64 -0.16 0.00 -0.13 0.00 0.00 55.73 55.96 2nvl s ARG 96 Cb -0.16 -3.33 0.07 0.00 -1.56 0.00 0.00 34.95 29.97 2nvl s ARG 96 CO 0.06 0.41 0.46 0.42 -0.81 0.00 0.00 175.30 175.84 2nvl s ILE 97 N -0.29 5.14 -0.74 4.11 -1.09 -1.26 -4.90 121.20 122.16 2nvl s ILE 97 Ca 0.29 -0.94 0.25 0.00 -2.23 0.00 0.00 60.65 58.03 2nvl s ILE 97 Cb -0.18 -4.18 0.14 0.00 -1.58 0.00 0.00 42.46 36.67 2nvl s ILE 97 CO 0.16 -0.65 1.54 -0.81 -1.23 0.00 0.00 174.94 173.95 2nvl n PRO 98 N 5.45 0.22 -3.71 2.79 -0.04 -1.26 -4.93 135.00 133.53 2nvl n PRO 98 Ca -0.11 0.11 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 2nvl n PRO 98 Cb 0.44 -1.69 -0.01 0.00 -0.04 0.00 0.00 33.50 32.20 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 -3.11 3.26 0.73 0.54 -0.12 -1.26 -5.08 117.98 112.93 2nvl s PHE 99 Ca 0.09 -0.13 -0.11 0.00 -0.05 0.00 0.00 56.93 56.73 2nvl s PHE 99 Cb 0.14 -1.79 0.03 0.00 -0.63 0.00 0.00 43.02 40.77 2nvl s PHE 99 CO 0.66 0.20 1.07 -1.25 -0.05 0.00 0.00 175.22 175.85 2nvl s PRO 100 N -4.08 2.66 -0.11 1.99 0.04 -1.26 -4.87 135.00 129.37 2nvl s PRO 100 Ca 0.40 0.78 0.00 0.00 0.04 0.00 0.00 61.00 62.22 2nvl s PRO 100 Cb -0.09 -1.97 0.02 0.00 0.04 0.00 0.00 34.50 32.50 2nvl s PRO 100 CO 0.30 -1.25 -0.11 0.42 0.04 0.00 0.00 177.00 176.40 2nvl s ILE 101 N -3.12 1.20 0.19 0.56 1.01 -1.26 -0.91 121.20 118.87 2nvl s ILE 101 Ca 0.59 -0.43 -0.32 0.00 0.00 0.00 0.00 60.65 60.49 2nvl s ILE 101 Cb -0.14 -1.16 -0.12 0.00 0.01 0.00 0.00 42.46 41.05 2nvl s ILE 101 CO 0.54 0.39 1.73 -0.38 0.00 0.00 0.00 174.94 177.23 2nvl n ILE 102 N 4.62 0.06 -3.32 2.92 5.41 0.11 -2.23 119.36 126.94 2nvl n ILE 102 Ca -0.16 -0.01 -0.41 0.00 1.00 0.00 0.00 62.75 63.17 2nvl n ILE 102 Cb 0.50 -1.98 -0.09 0.00 -0.71 0.00 0.00 39.64 37.37 2nvl n ILE 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2nvl s ALA 103 N 1.41 3.48 -0.50 -1.39 0.00 0.44 -2.35 121.76 122.86 2nvl s ALA 103 Ca 0.76 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 51.66 2nvl s ALA 103 Cb -0.51 -2.93 0.37 0.00 0.00 0.00 0.00 23.12 20.04 2nvl s ALA 103 CO 0.33 -1.18 0.95 -3.47 0.00 0.00 0.00 175.76 172.39 2nvl n ASP 104 N 5.58 3.73 -4.77 0.00 2.03 -0.81 -4.59 116.55 117.71 2nvl n ASP 104 Ca -0.07 -3.52 -0.39 0.00 0.52 0.00 0.00 54.79 51.33 2nvl n ASP 104 Cb 0.49 -0.55 -0.02 0.00 -0.72 0.00 0.00 41.12 40.33 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 -3.29 4.12 0.00 -0.67 0.04 -1.26 -1.46 135.00 132.48 2nvl s PRO 105 Ca 0.46 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.48 2nvl s PRO 105 Cb 0.33 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 32.07 2nvl s PRO 105 CO -0.13 -0.30 0.00 1.04 0.04 0.00 0.00 177.00 177.65 2nvl n GLN 106 N 0.29 0.00 -2.98 4.56 6.02 -1.26 -4.47 117.38 119.55 2nvl n GLN 106 Ca 0.03 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.80 2nvl n GLN 106 Cb 0.45 -0.20 0.02 0.00 1.02 0.00 0.00 30.24 31.53 2nvl n GLN 106 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nvl n GLY 107 N -1.73 -0.52 0.14 1.08 0.00 -0.53 -4.93 105.19 98.70 2nvl n GLY 107 Ca 0.00 0.11 -0.08 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.15 0.98 0.04 2.61 2.02 -1.78 -0.18 112.91 115.46 2nvl h THR 108 Ca -0.51 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 66.57 2nvl h THR 108 Cb 1.35 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 68.42 2nvl h THR 108 CO 0.56 0.05 -0.02 0.58 0.37 0.00 0.00 175.52 177.07 2nvl h VAL 109 N 0.30 1.18 -0.57 3.16 2.07 -1.91 -2.00 116.25 118.47 2nvl h VAL 109 Ca 0.12 -0.70 0.11 0.00 0.82 0.00 0.00 66.70 67.05 2nvl h VAL 109 Cb 0.04 1.64 -0.09 0.00 -1.52 0.00 0.00 31.29 31.37 2nvl h VAL 109 CO -0.09 0.18 0.07 0.00 0.02 0.00 0.00 177.57 177.75 2nvl h ALA 110 N 0.58 0.62 -0.46 1.67 0.00 -1.90 -1.66 119.26 118.11 2nvl h ALA 110 Ca -0.01 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2nvl h ALA 110 Cb 0.33 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2nvl h ALA 110 CO 0.01 -0.35 0.25 -0.09 0.00 0.00 0.00 179.25 179.07 2nvl h ARG 111 N 0.19 0.65 -0.58 0.00 2.43 -1.00 0.32 114.38 116.38 2nvl h ARG 111 Ca 0.30 -0.08 0.04 0.00 -0.81 0.00 0.00 59.98 59.43 2nvl h ARG 111 Cb 0.45 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.85 2nvl h ARG 111 CO -0.43 0.52 0.38 -0.09 -1.51 0.00 0.00 179.97 178.85 2nvl h ARG 112 N 0.61 0.62 -0.48 0.20 9.65 -0.54 -0.94 114.38 123.50 2nvl h ARG 112 Ca 0.16 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 59.00 2nvl h ARG 112 Cb 0.07 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.51 2nvl h ARG 112 CO -0.02 0.41 0.00 1.28 2.80 0.00 0.00 179.97 184.44 2nvl n LEU 113 N -4.47 2.63 -3.77 3.80 4.77 -0.82 -4.67 117.00 114.46 2nvl n LEU 113 Ca 0.07 -1.30 -0.29 0.00 -0.03 0.00 0.00 56.01 54.46 2nvl n LEU 113 Cb 0.17 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 2nvl n LEU 113 CO 0.35 0.65 0.03 0.61 -1.33 0.00 0.00 177.39 177.69 2nvl n GLY 114 N 1.29 -0.48 0.66 -0.72 0.00 -0.36 -4.32 105.19 101.25 2nvl n GLY 114 Ca 0.17 0.14 0.09 0.00 0.00 0.00 0.00 46.02 46.42 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 -4.28 1.94 -4.46 0.99 4.77 0.11 -4.82 117.00 111.24 2nvl n LEU 115 Ca 0.03 -0.88 -0.36 0.00 -0.03 0.00 0.00 56.01 54.77 2nvl n LEU 115 Cb 0.53 -0.18 -0.12 0.00 -2.33 0.00 0.00 43.42 41.32 2nvl n LEU 115 CO 0.69 0.44 -0.29 -0.76 -1.33 0.00 0.00 177.39 176.14 2nvl s LEU 116 N -1.33 3.42 0.00 2.23 1.43 -1.25 -2.10 118.68 121.08 2nvl s LEU 116 Ca 0.30 -0.18 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 2nvl s LEU 116 Cb 0.16 -1.90 0.00 0.00 0.03 0.00 0.00 46.19 44.48 2nvl s LEU 116 CO 0.23 0.02 0.00 -1.84 0.23 0.00 0.00 176.35 174.99 2nvl n GLU 119 N 4.58 0.00 -0.04 1.70 0.28 -1.26 -4.95 120.64 120.95 2nvl n GLU 119 Ca -0.16 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 56.83 2nvl n GLU 119 Cb 0.52 0.00 -0.00 0.00 1.43 0.00 0.00 31.44 33.38 2nvl n GLU 119 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 177.13 177.74 2nvl h SER 120 N 0.00 0.00 0.00 -1.84 0.02 -1.96 -3.46 113.55 106.32 2nvl h SER 120 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2nvl h SER 120 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2nvl h SER 120 CO 0.00 0.41 0.00 0.00 -1.14 0.00 0.00 176.83 176.10 2nvl n ALA 121 N -2.69 0.00 -0.12 3.77 0.00 -1.26 -0.44 120.51 119.76 2nvl n ALA 121 Ca -0.01 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.26 2nvl n ALA 121 Cb 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.36 2nvl n ALA 121 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2nvl n THR 122 N 0.00 1.42 -5.08 0.00 5.66 -1.26 -4.99 114.28 110.03 2nvl n THR 122 Ca 0.00 -0.54 -0.32 0.00 -3.05 0.00 0.00 64.05 60.14 2nvl n THR 122 Cb 0.00 -1.39 -0.15 0.00 -1.55 0.00 0.00 70.33 67.24 2nvl n THR 122 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 2nvl s HIS 123 N -2.50 2.57 -0.10 1.09 4.02 0.41 -5.00 115.29 115.78 2nvl s HIS 123 Ca -0.33 -0.50 -0.30 0.00 1.02 0.00 0.00 55.06 54.95 2nvl s HIS 123 Cb 0.09 -1.63 -0.03 0.00 -1.02 0.00 0.00 32.58 29.98 2nvl s HIS 123 CO 0.57 -0.07 1.36 -0.08 1.02 0.00 0.00 174.74 177.55 2nvl s THR 124 N -0.32 4.02 0.77 1.30 -1.32 -1.26 -4.38 115.64 114.46 2nvl s THR 124 Ca 0.02 1.29 -0.17 0.00 -1.21 0.00 0.00 61.69 61.62 2nvl s THR 124 Cb -0.13 -3.83 -0.09 0.00 -1.51 0.00 0.00 72.50 66.94 2nvl s THR 124 CO 0.02 -0.08 -0.07 1.33 -2.21 0.00 0.00 174.62 173.62 2nvl n VAL 125 N 5.17 0.57 -2.52 5.08 0.24 -0.89 -2.88 118.33 123.09 2nvl n VAL 125 Ca 0.14 -0.43 -0.40 0.00 -2.04 0.00 0.00 64.34 61.61 2nvl n VAL 125 Cb 0.44 -0.30 -0.03 0.00 -1.47 0.00 0.00 33.84 32.48 2nvl n VAL 125 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2nvl s ARG 126 N -2.16 3.54 0.06 7.34 1.70 -1.23 -4.39 118.95 123.82 2nvl s ARG 126 Ca 0.54 -1.13 -0.02 0.00 -0.47 0.00 0.00 55.73 54.65 2nvl s ARG 126 Cb -0.32 -5.35 -0.04 0.00 -0.57 0.00 0.00 34.95 28.66 2nvl s ARG 126 CO 0.69 -2.31 0.25 0.20 -1.08 0.00 0.00 175.30 173.05 2nvl s GLY 127 N 5.15 2.21 -0.04 3.88 0.00 -1.26 -1.70 107.32 115.56 2nvl s GLY 127 Ca 0.48 -0.73 -0.01 0.00 0.00 0.00 0.00 44.72 44.47 2nvl s GLY 127 CO -0.08 -0.66 0.02 0.14 0.00 0.00 0.00 173.10 172.52 2nvl s VAL 128 N -1.49 0.14 -0.21 1.40 1.01 0.16 -1.16 120.40 120.25 2nvl s VAL 128 Ca 0.34 0.19 -0.02 0.00 0.00 0.00 0.00 61.98 62.49 2nvl s VAL 128 Cb -0.13 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 35.97 2nvl s VAL 128 CO 0.24 0.18 -0.10 -0.36 0.00 0.00 0.00 175.10 175.05 2nvl s PHE 129 N 1.51 2.91 -0.33 5.22 0.40 0.04 -1.10 117.98 126.64 2nvl s PHE 129 Ca -0.03 -1.30 -0.14 0.00 -0.60 0.00 0.00 56.93 54.87 2nvl s PHE 129 Cb -0.13 -2.03 -0.02 0.00 0.51 0.00 0.00 43.02 41.35 2nvl s PHE 129 CO -0.03 -0.67 0.28 0.42 0.70 0.00 0.00 175.22 175.92 2nvl s ILE 130 N 1.39 5.25 -0.12 0.64 1.01 -0.86 -1.54 121.20 126.96 2nvl s ILE 130 Ca 0.05 -0.08 0.03 0.00 0.00 0.00 0.00 60.65 60.65 2nvl s ILE 130 Cb -0.14 -3.74 0.01 0.00 0.01 0.00 0.00 42.46 38.60 2nvl s ILE 130 CO -0.07 -0.01 -0.22 -0.69 0.00 0.00 0.00 174.94 173.95 2nvl s VAL 131 N 1.83 1.97 0.90 2.92 1.01 -0.31 0.00 120.40 128.72 2nvl s VAL 131 Ca 0.08 -0.94 -0.14 0.00 0.00 0.00 0.00 61.98 60.98 2nvl s VAL 131 Cb -0.17 -1.73 0.16 0.00 0.00 0.00 0.00 36.38 34.64 2nvl s VAL 131 CO 0.11 0.53 1.25 1.51 0.00 0.00 0.00 175.10 178.51 2nvl s ASP 132 N 0.64 3.61 0.00 3.32 1.47 -0.69 -0.84 116.67 124.18 2nvl s ASP 132 Ca -0.12 0.37 0.08 0.00 1.18 0.00 0.00 52.55 54.06 2nvl s ASP 132 Cb -0.16 -0.57 0.45 0.00 -0.34 0.00 0.00 42.92 42.29 2nvl s ASP 132 CO 0.03 -2.42 0.98 0.00 0.68 0.00 0.00 175.17 174.43 2nvl n ALA 133 N -3.56 1.72 0.63 2.11 0.00 -1.26 -0.42 120.51 119.73 2nvl n ALA 133 Ca 0.13 -0.05 0.07 0.00 0.00 0.00 0.00 53.44 53.60 2nvl n ALA 133 Cb 0.60 -1.13 0.05 0.00 0.00 0.00 0.00 19.45 18.98 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 -1.08 1.20 -0.43 0.00 1.74 -1.26 -4.53 116.66 112.30 2nvl n ARG 134 Ca 0.05 -1.30 0.00 0.00 -0.77 0.00 0.00 57.85 55.83 2nvl n ARG 134 Cb 0.04 -1.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 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 0.88 0.76 3.51 -0.13 0.00 0.44 -4.96 105.19 105.69 2nvl n GLY 135 Ca 0.08 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 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 4.27 -0.10 1.61 1.01 -1.24 0.25 120.40 124.20 2nvl s VAL 136 Ca 0.00 -0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 2nvl s VAL 136 Cb 0.00 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 33.39 2nvl s VAL 136 CO 0.00 0.43 1.74 -0.63 0.00 0.00 0.00 175.10 176.64 2nvl s ILE 137 N 0.83 3.47 -0.11 2.22 1.01 -0.07 -1.71 121.20 126.85 2nvl s ILE 137 Ca 0.02 0.56 0.15 0.00 0.00 0.00 0.00 60.65 61.38 2nvl s ILE 137 Cb -0.14 -3.41 -0.23 0.00 0.01 0.00 0.00 42.46 38.69 2nvl s ILE 137 CO 0.02 -0.11 0.38 0.54 0.00 0.00 0.00 174.94 175.77 2nvl n ARG 138 N 7.48 0.66 -3.55 2.79 5.12 0.10 -0.51 116.66 128.75 2nvl n ARG 138 Ca 0.19 -0.12 -0.17 0.00 -1.93 0.00 0.00 57.85 55.82 2nvl n ARG 138 Cb 0.43 -1.35 -0.06 0.00 -1.16 0.00 0.00 32.46 30.32 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 -2.99 0.01 -0.08 0.55 2.01 -1.19 -4.90 115.64 109.05 2nvl s THR 139 Ca -0.04 -0.07 -0.03 0.00 0.31 0.00 0.00 61.69 61.86 2nvl s THR 139 Cb 0.10 -0.95 0.04 0.00 0.01 0.00 0.00 72.50 71.71 2nvl s THR 139 CO 0.64 -0.04 0.15 -0.04 -0.69 0.00 0.00 174.62 174.64 2nvl s MET 140 N -1.27 0.05 -0.12 4.92 -1.94 -1.26 -2.03 119.30 117.64 2nvl s MET 140 Ca -0.11 0.49 0.01 0.00 -1.71 0.00 0.00 55.69 54.36 2nvl s MET 140 Cb -0.01 -0.25 -0.01 0.00 2.01 0.00 0.00 34.83 36.57 2nvl s MET 140 CO 0.09 -0.26 -0.15 -0.51 -0.01 0.00 0.00 175.02 174.18 2nvl s LEU 141 N 1.89 2.63 -0.41 -0.03 1.43 -0.25 -4.96 118.68 118.99 2nvl s LEU 141 Ca -0.01 -0.35 0.03 0.00 -1.03 0.00 0.00 54.13 52.77 2nvl s LEU 141 Cb -0.12 -1.58 0.11 0.00 0.03 0.00 0.00 46.19 44.63 2nvl s LEU 141 CO -0.06 0.17 0.14 -0.31 0.23 0.00 0.00 176.35 176.53 2nvl s TYR 142 N 0.30 3.14 0.43 0.29 1.51 -1.26 -0.66 117.35 121.10 2nvl s TYR 142 Ca -0.11 -2.86 -0.16 0.00 -1.01 0.00 0.00 57.07 52.93 2nvl s TYR 142 Cb -0.16 -2.64 -0.09 0.00 -0.11 0.00 0.00 41.96 38.96 2nvl s TYR 142 CO 0.06 -0.85 0.88 0.71 -1.11 0.00 0.00 175.55 175.23 2nvl s TYR 143 N 0.53 3.40 0.72 2.71 1.51 -0.69 -5.00 117.35 120.54 2nvl s TYR 143 Ca 0.14 1.35 -0.11 0.00 -1.01 0.00 0.00 57.07 57.44 2nvl s TYR 143 Cb -0.22 -2.67 0.02 0.00 -0.11 0.00 0.00 41.96 38.98 2nvl s TYR 143 CO -0.06 -0.15 1.09 -1.25 -1.11 0.00 0.00 175.55 174.06 2nvl s PRO 144 N -3.57 2.73 0.51 -1.71 0.04 -1.26 -3.48 135.00 128.25 2nvl s PRO 144 Ca 0.57 0.60 0.29 0.00 0.04 0.00 0.00 61.00 62.49 2nvl s PRO 144 Cb -0.10 -1.99 1.40 0.00 0.04 0.00 0.00 34.50 33.85 2nvl s PRO 144 CO 0.24 -1.16 1.88 0.52 0.04 0.00 0.00 177.00 178.52 2nvl h MET 145 N -0.75 0.08 -0.00 4.56 2.86 -1.95 -1.81 114.93 117.92 2nvl h MET 145 Ca -0.45 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 2nvl h MET 145 Cb 1.25 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.89 2nvl h MET 145 CO 0.62 0.05 -0.22 -0.85 1.06 0.00 0.00 176.91 177.57 2nvl n GLU 146 N -4.33 0.56 -4.13 1.72 0.00 -1.26 -4.79 120.64 108.41 2nvl n GLU 146 Ca 0.19 -0.26 -0.32 0.00 0.00 0.00 0.00 57.16 56.77 2nvl n GLU 146 Cb 0.91 -1.49 -0.16 0.00 0.00 0.00 0.00 31.44 30.69 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 -2.62 1.97 0.43 -1.84 0.20 -0.68 -5.09 118.68 111.05 2nvl s LEU 147 Ca 0.23 -0.59 -0.23 0.00 0.69 0.00 0.00 54.13 54.24 2nvl s LEU 147 Cb 0.19 -1.37 -0.09 0.00 -0.43 0.00 0.00 46.19 44.50 2nvl s LEU 147 CO 0.54 -0.01 1.06 -0.83 -0.29 0.00 0.00 176.35 176.81 2nvl s GLY 148 N 1.31 2.66 0.65 7.98 0.00 -1.26 -4.41 107.32 114.25 2nvl s GLY 148 Ca 0.04 0.69 -0.17 0.00 0.00 0.00 0.00 44.72 45.28 2nvl s GLY 148 CO -0.11 1.09 1.20 0.50 0.00 0.00 0.00 173.10 175.77 2nvl s ARG 149 N -2.77 2.67 -0.51 2.90 0.52 -1.26 -5.00 118.95 115.50 2nvl s ARG 149 Ca 0.62 1.75 -0.17 0.00 -0.52 0.00 0.00 55.73 57.41 2nvl s ARG 149 Cb -0.21 -1.90 0.08 0.00 0.52 0.00 0.00 34.95 33.45 2nvl s ARG 149 CO 0.26 -1.43 0.50 -1.17 0.02 0.00 0.00 175.30 173.48 2nvl s LEU 150 N -4.54 5.57 0.27 2.53 2.96 -1.26 -4.94 118.68 119.26 2nvl s LEU 150 Ca 0.75 -1.34 0.13 0.00 -0.22 0.00 0.00 54.13 53.45 2nvl s LEU 150 Cb -0.29 -2.26 0.23 0.00 0.50 0.00 0.00 46.19 44.38 2nvl s LEU 150 CO 0.38 -0.80 1.52 0.58 -1.32 0.00 0.00 176.35 176.71 2nvl h VAL 151 N 5.83 1.18 0.00 1.68 2.07 -1.96 -2.41 116.25 122.63 2nvl h VAL 151 Ca -0.29 -2.29 -0.02 0.00 0.82 0.00 0.00 66.70 64.93 2nvl h VAL 151 Cb 1.10 2.33 -0.00 0.00 -1.52 0.00 0.00 31.29 33.20 2nvl h VAL 151 CO 0.96 0.59 -0.08 0.44 0.02 0.00 0.00 177.57 179.50 2nvl h ASP 152 N 0.00 0.00 0.36 0.57 3.32 -1.92 -2.17 116.42 116.57 2nvl h ASP 152 Ca -0.01 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.86 2nvl h ASP 152 Cb 1.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 2nvl h ASP 152 CO 0.08 0.08 -0.75 -0.08 -1.72 0.00 0.00 179.24 176.85 2nvl h GLU 153 N 0.00 0.32 -0.49 3.56 4.57 -1.78 -2.31 114.58 118.45 2nvl h GLU 153 Ca -0.00 -0.28 -0.05 0.00 -1.18 0.00 0.00 59.36 57.85 2nvl h GLU 153 Cb 0.28 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.91 2nvl h GLU 153 CO 0.01 0.93 0.11 0.82 -1.18 0.00 0.00 179.01 179.70 2nvl h ILE 154 N 0.21 1.24 -0.60 2.32 2.04 -1.45 -1.47 117.51 119.80 2nvl h ILE 154 Ca -0.03 -0.85 0.08 0.00 1.00 0.00 0.00 64.86 65.06 2nvl h ILE 154 Cb 1.33 0.86 -0.07 0.00 -0.74 0.00 0.00 36.82 38.20 2nvl h ILE 154 CO 0.12 0.31 0.25 -0.07 0.00 0.00 0.00 178.15 178.76 2nvl h LEU 155 N 0.66 0.28 -0.48 1.44 3.38 -1.52 -1.79 115.31 117.29 2nvl h LEU 155 Ca 0.15 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 2nvl h LEU 155 Cb 0.34 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2nvl h LEU 155 CO 0.00 0.17 0.16 -0.09 0.09 0.00 0.00 178.44 178.78 2nvl h ARG 156 N 0.45 0.73 0.28 1.13 2.43 -1.22 -0.62 114.38 117.55 2nvl h ARG 156 Ca 0.30 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2nvl h ARG 156 Cb 0.33 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.73 2nvl h ARG 156 CO -0.27 0.68 -0.48 0.82 -1.51 0.00 0.00 179.97 179.21 2nvl h ILE 157 N 0.63 0.06 -0.16 1.20 2.04 -1.16 -0.73 117.51 119.40 2nvl h ILE 157 Ca 0.16 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.92 2nvl h ILE 157 Cb 0.25 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 2nvl h ILE 157 CO -0.01 0.00 -0.34 -0.37 0.00 0.00 0.00 178.15 177.44 2nvl h VAL 158 N -0.82 1.28 0.39 1.67 -1.51 -1.18 0.12 116.25 116.19 2nvl h VAL 158 Ca -0.02 -1.37 -0.02 0.00 -1.23 0.00 0.00 66.70 64.06 2nvl h VAL 158 Cb 0.78 1.53 0.00 0.00 -2.13 0.00 0.00 31.29 31.48 2nvl h VAL 158 CO -0.18 0.42 -0.19 0.50 -1.23 0.00 0.00 177.57 176.89 2nvl h LYS 159 N 0.28 -0.50 -0.72 5.19 1.63 -0.95 -1.62 116.57 119.89 2nvl h LYS 159 Ca 0.03 0.03 0.11 0.00 -0.85 0.00 0.00 60.65 59.98 2nvl h LYS 159 Cb 0.73 0.11 -0.08 0.00 -0.60 0.00 0.00 32.23 32.40 2nvl h LYS 159 CO 0.06 -0.27 0.34 0.00 -3.45 0.00 0.00 179.45 176.13 2nvl h ALA 160 N -0.06 1.00 0.11 5.00 0.00 -1.02 -1.73 119.26 122.56 2nvl h ALA 160 Ca -0.05 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2nvl h ALA 160 Cb 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2nvl h ALA 160 CO 0.09 -0.09 -0.05 1.25 0.00 0.00 0.00 179.25 180.44 2nvl h LEU 161 N 0.56 -0.13 -0.67 0.00 5.85 -0.63 0.66 115.31 120.95 2nvl h LEU 161 Ca 0.37 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 59.03 2nvl h LEU 161 Cb 0.44 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.44 2nvl h LEU 161 CO -0.30 0.04 0.36 0.11 -0.34 0.00 0.00 178.44 178.31 2nvl h LYS 162 N -0.29 0.63 -0.38 1.25 1.57 -1.23 0.01 116.57 118.13 2nvl h LYS 162 Ca -0.02 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2nvl h LYS 162 Cb 0.24 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2nvl h LYS 162 CO 0.03 0.42 -0.06 -0.07 -0.57 0.00 0.00 179.45 179.20 2nvl h LEU 163 N 0.65 0.60 -0.28 2.94 3.38 -1.14 -0.98 115.31 120.48 2nvl h LEU 163 Ca 0.30 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 2nvl h LEU 163 Cb 0.22 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2nvl h LEU 163 CO -0.20 0.71 -0.11 1.23 0.09 0.00 0.00 178.44 180.16 2nvl h GLY 164 N 0.93 0.63 1.02 0.83 0.00 -0.28 0.29 103.07 106.48 2nvl h GLY 164 Ca 0.11 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.88 2nvl h GLY 164 CO 0.02 0.50 0.47 -0.55 0.00 0.00 0.00 176.54 176.98 2nvl h ASP 165 N 0.33 1.06 0.56 0.19 5.19 -0.97 -1.56 116.42 121.21 2nvl h ASP 165 Ca 0.07 -0.10 -0.28 0.00 -0.62 0.00 0.00 57.03 56.09 2nvl h ASP 165 Cb 0.61 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 39.83 2nvl h ASP 165 CO 0.04 0.85 -1.52 0.77 -3.12 0.00 0.00 179.24 176.25 2nvl h SER 166 N 1.18 0.16 -0.02 6.45 4.64 -1.18 -3.34 113.55 121.44 2nvl h SER 166 Ca 0.30 -0.26 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2nvl h SER 166 Cb 0.03 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2nvl h SER 166 CO -0.05 1.22 0.00 0.18 -0.87 0.00 0.00 176.83 177.31 2nvl n LEU 167 N -3.28 1.44 -3.69 5.97 4.32 0.09 -4.93 117.00 116.91 2nvl n LEU 167 Ca -0.14 -0.49 -0.27 0.00 -0.02 0.00 0.00 56.01 55.09 2nvl n LEU 167 Cb 1.02 -0.01 0.03 0.00 -1.62 0.00 0.00 43.42 42.85 2nvl n LEU 167 CO 0.47 0.24 -0.09 1.17 -1.22 0.00 0.00 177.39 177.97 2nvl n LYS 168 N 0.13 -2.29 -4.12 3.23 0.00 -0.86 -5.01 118.16 109.23 2nvl n LYS 168 Ca 0.19 0.51 -0.10 0.00 0.00 0.00 0.00 58.31 58.92 2nvl n LYS 168 Cb 0.34 -4.53 -0.10 0.00 0.00 0.00 0.00 35.03 30.74 2nvl n LYS 168 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2nvl s ARG 169 N -5.93 0.70 0.20 1.64 1.81 -0.64 -4.60 118.95 112.13 2nvl s ARG 169 Ca 0.32 -1.18 0.05 0.00 -1.72 0.00 0.00 55.73 53.20 2nvl s ARG 169 Cb -0.10 -0.08 -0.04 0.00 -0.45 0.00 0.00 34.95 34.28 2nvl s ARG 169 CO 0.85 -0.04 0.21 0.00 -0.68 0.00 0.00 175.30 175.64 2nvl s ALA 170 N -3.26 3.68 -0.19 2.13 0.00 0.14 -4.47 121.76 119.79 2nvl s ALA 170 Ca 0.06 -1.26 -0.01 0.00 0.00 0.00 0.00 51.96 50.75 2nvl s ALA 170 Cb 0.03 -1.46 0.01 0.00 0.00 0.00 0.00 23.12 21.70 2nvl s ALA 170 CO -0.05 0.39 -0.14 0.08 0.00 0.00 0.00 175.76 176.04 2nvl s VAL 171 N -1.91 2.61 0.68 0.00 1.01 -1.26 -0.45 120.40 121.08 2nvl s VAL 171 Ca 0.33 -0.76 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 2nvl s VAL 171 Cb -0.09 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.16 2nvl s VAL 171 CO 0.25 0.49 1.16 -2.16 0.00 0.00 0.00 175.10 174.85 2nvl s PRO 172 N 1.29 2.53 0.17 2.72 0.04 -1.26 -4.96 135.00 135.52 2nvl s PRO 172 Ca 0.04 1.60 -0.32 0.00 0.04 0.00 0.00 61.00 62.36 2nvl s PRO 172 Cb -0.14 -1.90 -0.16 0.00 0.04 0.00 0.00 34.50 32.34 2nvl s PRO 172 CO -0.08 -1.50 1.04 0.00 0.04 0.00 0.00 177.00 176.50 2nvl n ALA 173 N -2.44 -1.29 -0.89 8.56 0.00 -1.26 -2.02 120.51 121.17 2nvl n ALA 173 Ca 0.12 0.46 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2nvl n ALA 173 Cb 0.51 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 18.02 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 -2.36 -4.53 0.00 8.00 -1.26 -4.09 116.55 114.16 2nvl n ASP 174 Ca 0.15 0.00 -0.46 0.00 0.71 0.00 0.00 54.79 55.19 2nvl n ASP 174 Cb 0.24 -1.58 -0.02 0.00 -0.02 0.00 0.00 41.12 39.73 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 -2.28 0.79 0.26 1.24 -0.00 -0.85 -0.54 117.44 116.05 2nvl n TRP 175 Ca 0.00 0.78 0.03 0.00 -0.00 0.00 0.00 57.50 58.31 2nvl n TRP 175 Cb 0.13 -2.17 0.17 0.00 -0.00 0.00 0.00 31.31 29.43 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 0.98 2.59 -1.73 5.87 -0.04 -1.26 -4.92 135.00 136.49 2nvl n PRO 176 Ca 0.13 -1.33 -0.21 0.00 -0.04 0.00 0.00 63.50 62.05 2nvl n PRO 176 Cb 0.28 -1.78 0.06 0.00 -0.04 0.00 0.00 33.50 32.02 2nvl n PRO 176 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2nvl n ASN 177 N 0.28 4.77 -4.75 3.54 3.02 0.30 -2.43 115.26 119.99 2nvl n ASN 177 Ca 0.12 -3.77 -0.41 0.00 -0.03 0.00 0.00 54.58 50.48 2nvl n ASN 177 Cb 0.62 -0.45 -0.02 0.00 -0.61 0.00 0.00 39.78 39.33 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 -3.31 6.55 0.56 6.41 3.84 -0.60 -4.85 114.94 123.53 2nvl s ASN 178 Ca 0.51 2.77 0.25 0.00 0.21 0.00 0.00 52.86 56.60 2nvl s ASN 178 Cb 0.42 -2.63 1.51 0.00 -0.55 0.00 0.00 41.25 40.00 2nvl s ASN 178 CO 0.02 -0.77 2.11 -0.33 -2.79 0.00 0.00 177.10 175.34 2nvl h GLU 179 N 4.88 0.00 0.01 0.43 3.07 -1.88 -1.16 114.58 119.93 2nvl h GLU 179 Ca -0.46 0.00 -0.26 0.00 -0.50 0.00 0.00 59.36 58.14 2nvl h GLU 179 Cb 1.22 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 29.09 2nvl h GLU 179 CO 0.78 0.00 -1.41 -0.89 -1.40 0.00 0.00 179.01 176.08 2nvl n ILE 180 N -4.14 1.56 -0.95 3.13 5.41 -1.26 -4.68 119.36 118.43 2nvl n ILE 180 Ca 0.02 -0.11 0.04 0.00 1.00 0.00 0.00 62.75 63.70 2nvl n ILE 180 Cb 0.29 -2.00 0.06 0.00 -0.71 0.00 0.00 39.64 37.28 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 -4.33 1.05 0.00 1.39 -5.35 -1.25 -5.09 119.36 105.78 2nvl n ILE 181 Ca -0.34 -1.20 0.00 0.00 -0.27 0.00 0.00 62.75 60.94 2nvl n ILE 181 Cb 0.73 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.89 2nvl n ILE 181 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2nvl n GLY 182 N -0.73 3.49 0.59 3.28 0.00 -0.44 0.16 105.19 111.54 2nvl n GLY 182 Ca 0.07 0.24 0.06 0.00 0.00 0.00 0.00 46.02 46.38 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 12.39 1.74 -1.18 1.61 0.28 -1.02 -1.56 120.64 132.90 2nvl n GLU 183 Ca 0.00 -1.15 -0.33 0.00 -0.16 0.00 0.00 57.16 55.52 2nvl n GLU 183 Cb 0.00 -1.27 0.12 0.00 1.43 0.00 0.00 31.44 31.72 2nvl n GLU 183 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2nvl s GLY 184 N -1.08 2.13 0.03 -1.84 0.00 0.12 -4.86 107.32 101.83 2nvl s GLY 184 Ca 0.23 0.78 0.06 0.00 0.00 0.00 0.00 44.72 45.80 2nvl s GLY 184 CO 0.16 1.19 -0.18 1.08 0.00 0.00 0.00 173.10 175.36 2nvl s LEU 185 N -5.65 2.15 -0.08 0.66 1.43 0.06 -4.55 118.68 112.70 2nvl s LEU 185 Ca 0.72 -0.47 -0.17 0.00 -1.03 0.00 0.00 54.13 53.18 2nvl s LEU 185 Cb -0.27 -0.82 -0.05 0.00 0.03 0.00 0.00 46.19 45.08 2nvl s LEU 185 CO 0.50 0.12 0.45 -0.63 0.23 0.00 0.00 176.35 177.02 2nvl s ILE 186 N -0.76 5.13 -0.04 -0.59 1.01 0.40 -1.23 121.20 125.12 2nvl s ILE 186 Ca 0.05 0.91 -0.30 0.00 0.00 0.00 0.00 60.65 61.31 2nvl s ILE 186 Cb -0.08 -3.78 -0.03 0.00 0.01 0.00 0.00 42.46 38.58 2nvl s ILE 186 CO 0.01 0.41 1.08 -0.69 0.00 0.00 0.00 174.94 175.75 2nvl s VAL 187 N 0.09 4.56 0.28 2.92 1.01 -0.72 0.25 120.40 128.80 2nvl s VAL 187 Ca 0.25 1.84 -0.30 0.00 0.00 0.00 0.00 61.98 63.77 2nvl s VAL 187 Cb -0.16 -4.18 -0.12 0.00 0.00 0.00 0.00 36.38 31.92 2nvl s VAL 187 CO 0.11 0.06 1.55 -2.65 0.00 0.00 0.00 175.10 174.17 2nvl n PRO 188 N 4.59 2.54 -1.46 2.72 -0.02 -1.26 -4.60 135.00 137.51 2nvl n PRO 188 Ca 0.09 0.90 -0.36 0.00 -2.02 0.00 0.00 63.50 62.11 2nvl n PRO 188 Cb 0.48 -2.65 0.09 0.00 -0.02 0.00 0.00 33.50 31.40 2nvl n PRO 188 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2nvl n PRO 189 N 2.07 0.68 -1.96 0.52 -0.04 -1.26 -4.95 135.00 130.06 2nvl n PRO 189 Ca 0.09 0.29 -0.35 0.00 -0.04 0.00 0.00 63.50 63.49 2nvl n PRO 189 Cb 0.36 -2.37 0.04 0.00 -0.04 0.00 0.00 33.50 31.48 2nvl n PRO 189 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 2nvl s PRO 190 N -3.47 2.92 -0.06 0.54 0.02 -1.26 -4.97 135.00 128.71 2nvl s PRO 190 Ca 0.77 1.76 0.09 0.00 0.02 0.00 0.00 61.00 63.64 2nvl s PRO 190 Cb -0.35 -1.93 0.14 0.00 0.02 0.00 0.00 34.50 32.38 2nvl s PRO 190 CO 0.46 -1.23 1.07 0.25 -0.33 0.00 0.00 177.00 177.23 2nvl n THR 191 N -1.74 1.43 -3.84 0.99 -2.24 -1.26 -4.93 114.28 102.70 2nvl n THR 191 Ca 0.13 -1.62 -0.11 0.00 -2.27 0.00 0.00 64.05 60.18 2nvl n THR 191 Cb 0.50 0.14 -0.09 0.00 -2.10 0.00 0.00 70.33 68.78 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 -1.92 0.10 0.18 4.28 -4.23 -1.26 -5.05 115.64 107.74 2nvl s THR 192 Ca 0.16 -0.83 -0.13 0.00 -1.18 0.00 0.00 61.69 59.70 2nvl s THR 192 Cb 0.14 -0.84 0.08 0.00 1.34 0.00 0.00 72.50 73.22 2nvl s THR 192 CO 0.01 -0.46 1.82 -0.33 -0.54 0.00 0.00 174.62 175.13 2nvl h GLU 193 N 3.57 0.64 -0.55 3.99 5.08 -1.98 0.88 114.58 126.21 2nvl h GLU 193 Ca -0.32 -0.04 0.11 0.00 -1.00 0.00 0.00 59.36 58.11 2nvl h GLU 193 Cb 1.19 -0.14 -0.10 0.00 0.50 0.00 0.00 28.75 30.19 2nvl h GLU 193 CO 0.47 0.42 -0.14 -0.44 -1.00 0.00 0.00 179.01 178.32 2nvl h ASP 194 N 0.66 -0.51 -0.66 1.42 5.19 -1.99 0.23 116.42 120.76 2nvl h ASP 194 Ca 0.21 0.16 -0.08 0.00 -0.62 0.00 0.00 57.03 56.70 2nvl h ASP 194 Cb -0.00 0.34 -0.03 0.00 0.18 0.00 0.00 39.33 39.82 2nvl h ASP 194 CO -0.08 -0.18 0.10 -0.61 -3.12 0.00 0.00 179.24 175.34 2nvl h GLN 195 N -0.00 1.10 -0.06 3.56 4.15 -1.80 -1.86 115.11 120.20 2nvl h GLN 195 Ca 0.26 -0.30 -0.00 0.00 0.77 0.00 0.00 58.65 59.38 2nvl h GLN 195 Cb 0.40 -0.13 -0.00 0.00 0.21 0.00 0.00 27.48 27.96 2nvl h GLN 195 CO -0.56 1.02 0.03 0.00 -1.93 0.00 0.00 178.83 177.38 2nvl h ALA 196 N 1.04 0.07 0.73 3.38 0.00 -0.42 -1.60 119.26 122.46 2nvl h ALA 196 Ca 0.20 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2nvl h ALA 196 Cb 0.45 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2nvl h ALA 196 CO 0.01 -0.40 -0.43 -0.09 0.00 0.00 0.00 179.25 178.35 2nvl h ARG 197 N 0.02 -1.04 -0.61 0.00 2.43 -0.83 -1.29 114.38 113.05 2nvl h ARG 197 Ca 0.02 0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.32 2nvl h ARG 197 Cb 0.06 0.24 -0.08 0.00 -0.42 0.00 0.00 29.97 29.77 2nvl h ARG 197 CO -0.00 -0.70 -0.42 0.00 -1.51 0.00 0.00 179.97 177.34 2nvl h ALA 198 N -0.89 -0.47 -0.80 2.80 0.00 -1.39 -0.53 119.26 117.97 2nvl h ALA 198 Ca -0.10 0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.03 2nvl h ALA 198 Cb 0.86 1.21 -0.10 0.00 0.00 0.00 0.00 17.79 19.76 2nvl h ALA 198 CO 0.11 -0.74 0.35 -0.09 0.00 0.00 0.00 179.25 178.88 2nvl h ARG 199 N -0.08 0.47 0.00 0.00 9.65 -1.24 0.43 114.38 123.62 2nvl h ARG 199 Ca 0.10 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.95 2nvl h ARG 199 Cb 0.33 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.81 2nvl h ARG 199 CO -0.62 0.31 0.00 -1.33 2.80 0.00 0.00 179.97 181.14 2nvl n MET 200 N -4.97 0.17 -0.02 0.20 2.81 -0.49 -3.43 117.12 111.39 2nvl n MET 200 Ca 0.16 0.47 0.06 0.00 -1.81 0.00 0.00 57.70 56.58 2nvl n MET 200 Cb 0.45 -1.87 -0.13 0.00 -0.71 0.00 0.00 33.22 30.96 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 -2.20 0.65 0.19 0.03 1.02 0.13 -4.21 120.64 116.25 2nvl n GLU 201 Ca 0.01 -0.14 0.03 0.00 -0.02 0.00 0.00 57.16 57.05 2nvl n GLU 201 Cb 0.18 -1.42 0.37 0.00 -0.02 0.00 0.00 31.44 30.55 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 0.00 -2.98 1.62 4.64 -1.03 -3.47 113.55 112.33 2nvl h SER 202 Ca -0.07 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.07 2nvl h SER 202 Cb 0.98 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.03 2nvl h SER 202 CO 0.00 0.38 -0.21 0.61 -0.87 0.00 0.00 176.83 176.74 2nvl n GLY 203 N -0.34 0.11 0.00 -0.77 0.00 -1.25 -4.88 105.19 98.07 2nvl n GLY 203 Ca -0.02 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 2nvl n GLY 203 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nvl n GLN 204 N -2.23 0.10 -4.37 1.61 10.64 -1.26 -4.86 117.38 117.01 2nvl n GLN 204 Ca -0.10 -0.00 -0.22 0.00 -1.83 0.00 0.00 57.00 54.85 2nvl n GLN 204 Cb 0.46 -1.50 -0.13 0.00 -0.86 0.00 0.00 30.24 28.21 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 -2.90 1.50 0.59 2.61 4.12 -1.26 -5.07 117.35 116.94 2nvl s TYR 205 Ca 0.17 -0.39 -0.20 0.00 0.02 0.00 0.00 57.07 56.67 2nvl s TYR 205 Cb 0.19 -0.86 -0.03 0.00 -1.52 0.00 0.00 41.96 39.73 2nvl s TYR 205 CO 0.52 0.09 1.30 0.54 0.02 0.00 0.00 175.55 178.02 2nvl n ARG 206 N 1.57 1.41 -3.45 -0.62 1.74 -1.13 -4.85 116.66 111.33 2nvl n ARG 206 Ca -0.19 0.53 -0.12 0.00 -0.77 0.00 0.00 57.85 57.30 2nvl n ARG 206 Cb 0.54 -2.52 -0.03 0.00 -1.02 0.00 0.00 32.46 29.43 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 -1.11 -0.56 -0.00 0.55 1.04 -1.26 -1.90 113.70 110.45 2nvl s SER 207 Ca 0.76 0.12 0.03 0.00 0.48 0.00 0.00 55.95 57.34 2nvl s SER 207 Cb -0.40 0.56 -0.04 0.00 0.10 0.00 0.00 66.02 66.23 2nvl s SER 207 CO 0.46 -0.86 0.06 0.18 0.98 0.00 0.00 173.24 174.06 2nvl n LEU 208 N -0.14 0.00 -3.64 2.42 4.32 -0.05 -5.00 117.00 114.91 2nvl n LEU 208 Ca -0.16 -0.01 -0.01 0.00 -0.02 0.00 0.00 56.01 55.80 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 0.14 0.00 0.95 -0.62 -1.22 0.00 0.00 177.39 176.64 2nvl s ASP 209 N -2.28 -0.12 0.61 -1.43 -1.08 -1.24 -4.97 116.67 106.17 2nvl s ASP 209 Ca -0.01 -0.17 0.33 0.00 -0.52 0.00 0.00 52.55 52.19 2nvl s ASP 209 Cb 0.02 0.25 1.96 0.00 -1.46 0.00 0.00 42.92 43.69 2nvl s ASP 209 CO 0.11 -0.45 2.27 4.11 0.52 0.00 0.00 175.17 181.73 2nvl h TRP 210 N 2.00 0.00 -0.15 -5.34 5.08 -1.97 -0.13 115.95 115.44 2nvl h TRP 210 Ca -0.25 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.72 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 0.00 0.00 -2.67 -1.28 0.00 0.00 178.44 174.82 2nvl n TRP 211 N -3.64 0.17 -3.56 0.12 4.27 -1.26 -4.36 117.44 109.18 2nvl n TRP 211 Ca -0.03 -0.09 -0.27 0.00 -3.89 0.00 0.00 57.50 53.22 2nvl n TRP 211 Cb 0.10 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 29.95 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 -1.83 1.93 0.27 -2.67 5.99 -0.06 -4.56 117.98 117.05 2nvl s PHE 212 Ca 0.34 -2.67 0.11 0.00 0.00 0.00 0.00 56.93 54.70 2nvl s PHE 212 Cb 0.21 -1.52 -0.05 0.00 0.00 0.00 0.00 43.02 41.66 2nvl s PHE 212 CO 0.31 -0.73 -0.11 0.00 -0.00 0.00 0.00 175.22 174.69 2nvl s TRP 214 N -2.36 -0.32 0.24 0.00 -2.14 -0.80 -1.75 118.94 111.80 2nvl s TRP 214 Ca 0.30 0.12 0.03 0.00 2.66 0.00 0.00 56.10 59.21 2nvl s TRP 214 Cb -0.06 0.57 -0.01 0.00 -3.10 0.00 0.00 33.47 30.87 2nvl s TRP 214 CO 0.17 -0.69 0.25 -0.40 -2.66 0.00 0.00 176.95 173.62 2nvl n ASP 215 N -0.33 -0.66 -3.41 -2.66 5.68 -0.37 -2.83 116.55 111.97 2nvl n ASP 215 Ca -0.09 -2.44 -0.27 0.00 -0.50 0.00 0.00 54.79 51.48 2nvl n ASP 215 Cb 0.62 1.39 -0.08 0.00 -1.14 0.00 0.00 41.12 41.91 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 -0.43 2.40 0.99 2.12 -2.24 -1.26 -0.76 114.28 115.10 2nvl n THR 216 Ca 0.04 -5.24 0.13 0.00 -2.27 0.00 0.00 64.05 56.71 2nvl n THR 216 Cb 0.41 -2.09 0.48 0.00 -2.10 0.00 0.00 70.33 67.03 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 0.83 0.01 -2.69 -0.78 -0.04 -1.26 -4.91 135.00 126.15 2nvl n PRO 217 Ca 0.30 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.38 2nvl n PRO 217 Cb 0.41 -1.51 -0.06 0.00 -0.04 0.00 0.00 33.50 32.31 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 -3.00 3.26 0.74 0.55 0.00 -1.26 -5.01 121.76 117.04 2nvl s ALA 218 Ca 0.13 0.64 -0.15 0.00 0.00 0.00 0.00 51.96 52.57 2nvl s ALA 218 Cb 0.18 -3.23 0.04 0.00 0.00 0.00 0.00 23.12 20.12 2nvl s ALA 218 CO 0.59 0.08 1.24 -1.54 0.00 0.00 0.00 175.76 176.13 2nvl s SER 219 N -1.36 4.06 0.22 0.00 1.04 -1.26 -4.87 113.70 111.53 2nvl s SER 219 Ca 0.48 2.46 -0.09 0.00 0.48 0.00 0.00 55.95 59.28 2nvl s SER 219 Cb -0.23 -2.60 0.32 0.00 0.10 0.00 0.00 66.02 63.61 2nvl s SER 219 CO 0.29 -2.36 1.71 -0.09 0.98 0.00 0.00 173.24 173.78 2nvl h ARG 220 N -0.27 0.29 -0.65 4.02 2.43 -1.98 -1.99 114.38 116.24 2nvl h ARG 220 Ca -0.48 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 58.59 2nvl h ARG 220 Cb 1.31 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.77 2nvl h ARG 220 CO 0.49 0.20 0.09 -0.44 -1.51 0.00 0.00 179.97 178.80 2nvl h ASP 221 N 0.30 1.03 -1.00 -3.80 3.32 -1.99 -0.90 116.42 113.39 2nvl h ASP 221 Ca 0.33 -0.25 0.05 0.00 0.02 0.00 0.00 57.03 57.18 2nvl h ASP 221 Cb 0.49 -0.27 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 2nvl h ASP 221 CO -0.40 1.03 0.65 0.44 -1.72 0.00 0.00 179.24 179.24 2nvl h ASP 222 N 1.00 1.06 -0.17 6.45 3.32 -1.84 -0.30 116.42 125.94 2nvl h ASP 222 Ca 0.20 -0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.06 2nvl h ASP 222 Cb 0.45 -0.23 0.01 0.00 0.22 0.00 0.00 39.33 39.77 2nvl h ASP 222 CO 0.01 0.71 -0.61 0.58 -1.72 0.00 0.00 179.24 178.21 2nvl h VAL 223 N 1.22 1.30 -0.17 -1.35 2.07 -0.92 -2.69 116.25 115.72 2nvl h VAL 223 Ca 0.41 -1.84 -0.18 0.00 0.82 0.00 0.00 66.70 65.91 2nvl h VAL 223 Cb 0.07 1.95 -0.00 0.00 -1.52 0.00 0.00 31.29 31.79 2nvl h VAL 223 CO -0.14 0.58 -0.63 -0.33 0.02 0.00 0.00 177.57 177.06 2nvl h GLU 224 N 0.43 0.60 -0.52 1.57 5.08 -1.12 -0.93 114.58 119.69 2nvl h GLU 224 Ca -0.03 -0.42 0.00 0.00 -1.00 0.00 0.00 59.36 57.92 2nvl h GLU 224 Cb 1.24 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.53 2nvl h GLU 224 CO 0.13 1.04 0.34 1.49 -1.00 0.00 0.00 179.01 181.01 2nvl h GLU 225 N 0.44 0.69 -0.94 2.33 4.81 -1.10 0.11 114.58 120.92 2nvl h GLU 225 Ca -0.01 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2nvl h GLU 225 Cb 1.20 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 30.38 2nvl h GLU 225 CO 0.12 0.46 0.59 0.00 -0.73 0.00 0.00 179.01 179.45 2nvl h ALA 226 N 1.19 1.19 0.00 2.92 0.00 -1.40 -2.51 119.26 120.66 2nvl h ALA 226 Ca 0.19 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2nvl h ALA 226 Cb -0.08 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.33 2nvl h ALA 226 CO -0.04 0.62 -0.28 -0.09 0.00 0.00 0.00 179.25 179.46 2nvl h ARG 227 N 1.28 0.00 -0.00 0.00 2.43 -0.92 -2.99 114.38 114.18 2nvl h ARG 227 Ca 0.34 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.33 2nvl h ARG 227 Cb -0.10 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 2nvl h ARG 227 CO -0.07 0.28 -0.80 -0.09 -1.51 0.00 0.00 179.97 177.78 2nvl h ARG 228 N 0.00 0.10 -0.14 0.20 2.43 -0.35 -0.91 114.38 115.71 2nvl h ARG 228 Ca -0.00 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 2nvl h ARG 228 Cb 0.85 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 2nvl h ARG 228 CO 0.04 0.85 0.04 1.88 -1.51 0.00 0.00 179.97 181.26 2nvl h TYR 229 N 0.06 0.24 -0.54 2.20 0.99 -1.36 -2.02 116.97 116.53 2nvl h TYR 229 Ca -0.02 -0.03 -0.03 0.00 2.00 0.00 0.00 58.73 60.65 2nvl h TYR 229 Cb 1.41 -0.07 -0.02 0.00 1.00 0.00 0.00 36.73 39.05 2nvl h TYR 229 CO 0.01 0.37 0.22 -0.07 -0.00 0.00 0.00 178.16 178.69 2nvl h LEU 230 N 0.04 0.75 -0.58 3.88 3.38 -1.54 -1.59 115.31 119.65 2nvl h LEU 230 Ca 0.05 -0.17 0.08 0.00 0.09 0.00 0.00 57.88 57.92 2nvl h LEU 230 Cb 0.25 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 2nvl h LEU 230 CO -0.00 0.71 0.24 -0.09 0.09 0.00 0.00 178.44 179.39 2nvl h ARG 231 N 0.74 0.44 -0.46 1.13 2.43 -1.07 -1.57 114.38 116.01 2nvl h ARG 231 Ca 0.18 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.27 2nvl h ARG 231 Cb 0.19 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 2nvl h ARG 231 CO -0.02 0.29 0.06 -0.09 -1.51 0.00 0.00 179.97 178.71 2nvl h ARG 232 N 0.45 0.76 -0.71 0.20 2.43 -1.27 -1.12 114.38 115.12 2nvl h ARG 232 Ca 0.28 -0.21 0.14 0.00 -0.81 0.00 0.00 59.98 59.38 2nvl h ARG 232 Cb 0.29 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.70 2nvl h ARG 232 CO -0.25 0.79 0.48 0.00 -1.51 0.00 0.00 179.97 179.48 2nvl h ALA 233 N 0.95 2.12 0.00 2.80 0.00 -0.95 -2.90 119.26 121.28 2nvl h ALA 233 Ca 0.14 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2nvl h ALA 233 Cb 0.40 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 2nvl h ALA 233 CO 0.01 -0.31 -0.86 0.00 0.00 0.00 0.00 179.25 178.09 2nvl h ALA 234 N 1.66 0.60 -2.63 0.00 0.00 -0.48 -3.47 119.26 114.93 2nvl h ALA 234 Ca 0.35 -0.07 -0.53 0.00 0.00 0.00 0.00 54.91 54.66 2nvl h ALA 234 Cb 0.81 0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.64 2nvl h ALA 234 CO -0.10 0.08 0.67 -1.21 0.00 0.00 0.00 179.25 178.69 2nvl s GLU 235 N -3.30 4.37 0.04 0.00 8.01 -0.50 -4.99 118.70 122.33 2nvl s GLU 235 Ca 0.01 2.05 -0.32 0.00 0.01 0.00 0.00 54.97 56.72 2nvl s GLU 235 Cb 0.09 -3.21 -0.11 0.00 -4.31 0.00 0.00 34.13 26.59 2nvl s GLU 235 CO 0.77 -0.31 1.89 1.17 0.01 0.00 0.00 175.26 178.79 2nvl n LYS 236 N 3.06 2.64 -1.73 1.61 3.00 -1.26 -4.95 118.16 120.53 2nvl n LYS 236 Ca 0.08 0.96 -0.42 0.00 -0.00 0.00 0.00 58.31 58.93 2nvl n LYS 236 Cb 0.43 -2.86 -0.03 0.00 0.00 0.00 0.00 35.03 32.57 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 3.60 4.13 -0.48 1.64 0.04 -1.26 -4.94 135.00 137.73 2nvl s PRO 237 Ca 0.87 2.61 -0.28 0.00 0.04 0.00 0.00 61.00 64.24 2nvl s PRO 237 Cb -0.53 -3.19 -0.01 0.00 0.04 0.00 0.00 34.50 30.81 2nvl s PRO 237 CO 0.43 -0.77 1.68 0.00 0.04 0.00 0.00 177.00 178.37 2nvl s ALA 238 N 1.54 2.67 0.07 8.56 0.00 -1.26 -4.63 121.76 128.70 2nvl s ALA 238 Ca 0.76 -0.28 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2nvl s ALA 238 Cb -0.49 -4.11 0.00 0.00 0.00 0.00 0.00 23.12 18.52 2nvl s ALA 238 CO 0.33 -3.04 0.00 1.17 0.00 0.00 0.00 175.76 174.22 2nvl n LYS 239 N 8.65 -5.08 -1.47 0.00 4.81 -1.26 -5.02 118.16 118.80 2nvl n LYS 239 Ca 0.19 3.68 -0.32 0.00 -0.87 0.00 0.00 58.31 60.99 2nvl n LYS 239 Cb 0.49 -4.39 0.07 0.00 0.02 0.00 0.00 35.03 31.22 2nvl n LYS 239 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2nvl s LEU 240 N -0.55 3.16 0.15 3.14 1.43 -1.26 -5.00 118.68 119.74 2nvl s LEU 240 Ca 0.00 1.83 0.25 0.00 -1.03 0.00 0.00 54.13 55.18 2nvl s LEU 240 Cb 0.00 -4.52 0.62 0.00 0.03 0.00 0.00 46.19 42.32 2nvl s LEU 240 CO 0.00 -1.79 1.57 0.18 0.23 0.00 0.00 176.35 176.54 2nvl n LEU 241 N -3.12 0.70 0.25 1.79 4.77 -1.26 -3.07 117.00 117.06 2nvl n LEU 241 Ca 0.09 0.39 0.16 0.00 -0.03 0.00 0.00 56.01 56.62 2nvl n LEU 241 Cb 0.53 -0.27 0.59 0.00 -2.33 0.00 0.00 43.42 41.94 2nvl n LEU 241 CO 0.52 -0.10 0.95 0.10 -1.33 0.00 0.00 177.39 177.53 2nvl h TYR 242 N 0.00 0.00 0.11 -1.77 -0.00 -1.94 -3.07 116.97 110.29 2nvl h TYR 242 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.72 2nvl h TYR 242 Cb 0.72 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.45 2nvl h TYR 242 CO 0.00 0.00 -0.05 0.93 -0.00 0.00 0.00 178.16 179.04 2nvl h GLU 243 N 0.00 -0.14 -0.95 0.10 3.07 -1.95 -3.33 114.58 111.39 2nvl h GLU 243 Ca 0.00 0.01 0.20 0.00 -0.50 0.00 0.00 59.36 59.07 2nvl h GLU 243 Cb 0.56 0.03 -0.18 0.00 -0.84 0.00 0.00 28.75 28.32 2nvl h GLU 243 CO 0.00 0.35 -0.18 1.05 -1.40 0.00 0.00 179.01 178.83 2nvl h GLU 244 N -0.89 0.01 0.00 2.33 4.11 -1.52 -3.52 114.58 115.10 2nvl h GLU 244 Ca -0.01 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2nvl h GLU 244 Cb 0.55 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2nvl h GLU 244 CO 0.02 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.11