#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ngj h PRO -2 N 0.00 0.00 0.00 1.61 0.13 -2.10 -3.49 132.00 128.15 3ngj h PRO -2 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3ngj h PRO -2 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3ngj h PRO -2 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 3ngj n GLY -1 N 0.67 -0.30 3.81 1.56 0.00 -1.26 -4.86 105.19 104.82 3ngj n GLY -1 Ca 0.03 -1.05 -0.32 0.00 0.00 0.00 0.00 46.02 44.67 3ngj n GLY -1 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ngj s SER 0 N -4.00 5.93 0.16 1.61 0.01 -1.26 -4.96 113.70 111.19 3ngj s SER 0 Ca 0.00 1.73 -0.34 0.00 1.31 0.00 0.00 55.95 58.65 3ngj s SER 0 Cb 0.00 -2.52 -0.15 0.00 0.21 0.00 0.00 66.02 63.56 3ngj s SER 0 CO 0.00 -1.07 1.43 0.80 0.41 0.00 0.00 173.24 174.82 3ngj n MET 1 N -2.07 1.74 -4.50 12.44 1.56 -1.26 -4.98 117.12 120.06 3ngj n MET 1 Ca 0.08 0.63 -0.24 0.00 -0.27 0.00 0.00 57.70 57.89 3ngj n MET 1 Cb 0.53 -2.31 -0.09 0.00 2.15 0.00 0.00 33.22 33.50 3ngj n MET 1 CO 0.00 0.00 0.00 0.16 -0.73 0.00 0.00 175.97 175.40 3ngj s ASP 2 N 0.58 2.64 0.13 6.12 1.47 -1.26 -4.85 116.67 121.50 3ngj s ASP 2 Ca 0.78 -1.58 -0.19 0.00 1.18 0.00 0.00 52.55 52.73 3ngj s ASP 2 Cb -0.77 0.34 -0.05 0.00 -0.34 0.00 0.00 42.92 42.10 3ngj s ASP 2 CO 0.44 -0.84 1.78 0.11 0.68 0.00 0.00 175.17 177.34 3ngj h LYS 3 N 1.89 0.28 -0.76 2.11 1.57 -1.93 0.75 116.57 120.47 3ngj h LYS 3 Ca -0.37 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.37 3ngj h LYS 3 Cb 1.27 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 33.48 3ngj h LYS 3 CO 0.61 0.18 0.38 0.00 -0.57 0.00 0.00 179.45 180.05 3ngj h ALA 4 N 1.10 1.24 -0.00 3.86 0.00 -1.97 -0.48 119.26 123.00 3ngj h ALA 4 Ca 0.09 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3ngj h ALA 4 Cb -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.48 3ngj h ALA 4 CO -0.04 0.59 -0.15 1.15 0.00 0.00 0.00 179.25 180.81 3ngj h THR 5 N 1.07 1.58 -0.26 0.00 2.02 -1.93 -3.30 112.91 112.10 3ngj h THR 5 Ca 0.26 -1.91 -0.10 0.00 0.77 0.00 0.00 66.41 65.44 3ngj h THR 5 Cb 0.08 2.82 -0.01 0.00 -1.74 0.00 0.00 68.15 69.30 3ngj h THR 5 CO -0.04 0.51 -0.25 0.25 0.37 0.00 0.00 175.52 176.36 3ngj h LEU 6 N -0.62 0.50 -1.33 2.58 5.85 -0.66 -2.83 115.31 118.80 3ngj h LEU 6 Ca -0.02 -0.17 0.16 0.00 0.84 0.00 0.00 57.88 58.69 3ngj h LEU 6 Cb 0.92 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.74 3ngj h LEU 6 CO 0.03 0.75 0.57 0.00 -0.34 0.00 0.00 178.44 179.45 3ngj h ALA 7 N 1.29 1.90 0.00 1.25 0.00 -1.16 -0.46 119.26 122.09 3ngj h ALA 7 Ca 0.06 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3ngj h ALA 7 Cb 0.67 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3ngj h ALA 7 CO 0.05 -0.16 0.00 1.63 0.00 0.00 0.00 179.25 180.77 3ngj n LYS 8 N -4.56 0.15 0.17 0.00 4.76 -1.07 -1.45 118.16 116.16 3ngj n LYS 8 Ca 0.18 0.14 0.12 0.00 -2.87 0.00 0.00 58.31 55.87 3ngj n LYS 8 Cb 0.52 -1.50 0.12 0.00 -1.84 0.00 0.00 35.03 32.33 3ngj n LYS 8 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 3ngj h TYR 9 N 0.00 0.00 -3.51 2.13 0.05 -1.19 -3.41 116.97 111.05 3ngj h TYR 9 Ca 0.00 0.00 -0.61 0.00 0.05 0.00 0.00 58.73 58.17 3ngj h TYR 9 Cb 0.25 0.00 -0.11 0.00 1.01 0.00 0.00 36.73 37.88 3ngj h TYR 9 CO 0.00 0.00 -0.03 0.42 -1.05 0.00 0.00 178.16 177.50 3ngj s ILE 10 N -3.26 5.09 -0.49 -2.88 1.01 -0.53 0.08 121.20 120.22 3ngj s ILE 10 Ca 0.05 0.92 -0.18 0.00 0.00 0.00 0.00 60.65 61.44 3ngj s ILE 10 Cb 0.07 -3.84 0.06 0.00 0.01 0.00 0.00 42.46 38.77 3ngj s ILE 10 CO 0.71 0.14 0.53 -1.81 0.00 0.00 0.00 174.94 174.51 3ngj s ASP 11 N 1.30 6.19 -0.39 3.58 1.11 -0.13 -1.44 116.67 126.90 3ngj s ASP 11 Ca 0.23 -1.06 -0.26 0.00 0.18 0.00 0.00 52.55 51.63 3ngj s ASP 11 Cb -0.15 -2.25 0.02 0.00 1.07 0.00 0.00 42.92 41.61 3ngj s ASP 11 CO 0.09 -0.79 0.95 -2.28 1.18 0.00 0.00 175.17 174.33 3ngj s HIS 12 N 2.24 3.03 -0.07 4.23 2.46 0.05 -2.56 115.29 124.67 3ngj s HIS 12 Ca 0.11 0.73 0.04 0.00 0.47 0.00 0.00 55.06 56.41 3ngj s HIS 12 Cb -0.21 -3.77 -0.02 0.00 -0.13 0.00 0.00 32.58 28.45 3ngj s HIS 12 CO 0.10 -0.91 -0.19 0.99 -2.47 0.00 0.00 174.74 172.26 3ngj s THR 13 N 3.62 2.61 -0.17 0.89 2.01 -0.37 -0.88 115.64 123.35 3ngj s THR 13 Ca 0.39 -0.87 -0.04 0.00 0.31 0.00 0.00 61.69 61.49 3ngj s THR 13 Cb -0.11 -2.01 0.08 0.00 0.01 0.00 0.00 72.50 70.47 3ngj s THR 13 CO 0.21 0.57 0.23 -0.22 -0.69 0.00 0.00 174.62 174.71 3ngj s LEU 14 N -0.26 -0.16 0.00 4.42 2.96 -0.46 -4.18 118.68 121.00 3ngj s LEU 14 Ca 0.00 0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.95 3ngj s LEU 14 Cb -0.13 0.46 0.00 0.00 0.50 0.00 0.00 46.19 47.02 3ngj s LEU 14 CO 0.03 -0.30 0.43 0.18 -1.32 0.00 0.00 176.35 175.37 3ngj n LEU 15 N 5.33 0.70 -4.72 -0.68 4.77 -1.26 -4.16 117.00 116.97 3ngj n LEU 15 Ca -0.05 -0.70 -0.40 0.00 -0.03 0.00 0.00 56.01 54.83 3ngj n LEU 15 Cb 0.50 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.61 3ngj n LEU 15 CO 0.06 0.17 0.92 0.29 -1.33 0.00 0.00 177.39 177.51 3ngj n LYS 16 N -0.09 1.83 0.13 3.23 4.76 -1.26 -4.87 118.16 121.89 3ngj n LYS 16 Ca 0.00 0.66 0.05 0.00 -2.87 0.00 0.00 58.31 56.15 3ngj n LYS 16 Cb 0.20 -2.48 0.50 0.00 -1.84 0.00 0.00 35.03 31.42 3ngj n LYS 16 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3ngj h ALA 17 N 1.77 1.78 -0.61 7.82 0.00 -2.05 -1.64 119.26 126.33 3ngj h ALA 17 Ca -0.49 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.31 3ngj h ALA 17 Cb 1.30 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 3ngj h ALA 17 CO 0.58 0.18 0.06 -0.40 0.00 0.00 0.00 179.25 179.68 3ngj n ASP 18 N -4.45 5.52 -4.78 0.00 5.75 -1.26 -4.99 116.55 112.34 3ngj n ASP 18 Ca -0.00 -3.01 -0.41 0.00 -0.01 0.00 0.00 54.79 51.36 3ngj n ASP 18 Cb 0.12 -0.70 -0.00 0.00 -1.03 0.00 0.00 41.12 39.51 3ngj n ASP 18 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ngj n ALA 19 N 0.42 2.43 -2.74 2.12 0.00 -0.62 -5.00 120.51 117.11 3ngj n ALA 19 Ca 0.31 0.34 -0.21 0.00 0.00 0.00 0.00 53.44 53.88 3ngj n ALA 19 Cb 1.25 -2.43 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 3ngj n ALA 19 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3ngj s THR 20 N -1.08 4.49 0.24 0.00 -4.23 -1.26 -5.00 115.64 108.79 3ngj s THR 20 Ca 0.53 -1.17 -0.05 0.00 -1.18 0.00 0.00 61.69 59.82 3ngj s THR 20 Cb -0.47 -3.52 0.20 0.00 1.34 0.00 0.00 72.50 70.04 3ngj s THR 20 CO 0.63 -0.27 1.78 -0.08 -0.54 0.00 0.00 174.62 176.14 3ngj h GLU 21 N 1.21 0.61 -0.80 3.99 4.81 -1.99 -0.23 114.58 122.17 3ngj h GLU 21 Ca -0.48 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 58.68 3ngj h GLU 21 Cb 1.24 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 3ngj h GLU 21 CO 0.59 0.40 0.37 0.93 -0.73 0.00 0.00 179.01 180.57 3ngj h GLU 22 N 0.62 1.17 -0.40 1.92 3.07 -1.99 -0.02 114.58 118.96 3ngj h GLU 22 Ca 0.38 -0.18 -0.11 0.00 -0.50 0.00 0.00 59.36 58.95 3ngj h GLU 22 Cb 0.43 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 3ngj h GLU 22 CO -0.29 0.91 -0.20 1.96 -1.40 0.00 0.00 179.01 179.99 3ngj h GLN 23 N 1.14 0.77 -0.28 2.33 4.20 -1.66 -1.42 115.11 120.20 3ngj h GLN 23 Ca 0.27 -0.30 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 3ngj h GLN 23 Cb 0.14 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 3ngj h GLN 23 CO -0.03 0.91 -0.19 0.82 -0.67 0.00 0.00 178.83 179.67 3ngj h ILE 24 N 0.68 1.30 -0.80 2.54 1.08 -0.79 -0.82 117.51 120.69 3ngj h ILE 24 Ca 0.10 -1.32 0.03 0.00 -0.39 0.00 0.00 64.86 63.28 3ngj h ILE 24 Cb 0.71 1.55 -0.05 0.00 -3.07 0.00 0.00 36.82 35.97 3ngj h ILE 24 CO 0.05 0.42 0.52 0.03 -0.69 0.00 0.00 178.15 178.48 3ngj h ARG 25 N 0.35 0.99 -0.62 2.37 3.08 -0.94 -1.97 114.38 117.64 3ngj h ARG 25 Ca 0.05 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.98 3ngj h ARG 25 Cb 0.73 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.53 3ngj h ARG 25 CO 0.05 0.66 0.13 -0.22 -1.07 0.00 0.00 179.97 179.52 3ngj h LYS 26 N 1.02 0.98 -0.60 0.04 1.63 -1.00 -0.97 116.57 117.67 3ngj h LYS 26 Ca 0.31 -0.23 0.03 0.00 -0.85 0.00 0.00 60.65 59.92 3ngj h LYS 26 Cb -0.03 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.43 3ngj h LYS 26 CO -0.10 0.88 0.35 1.25 -3.45 0.00 0.00 179.45 178.39 3ngj h LEU 27 N 0.93 0.56 -0.25 5.20 5.85 -0.79 0.80 115.31 127.61 3ngj h LEU 27 Ca 0.20 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.86 3ngj h LEU 27 Cb 0.36 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 3ngj h LEU 27 CO 0.00 0.39 -0.08 0.00 -0.34 0.00 0.00 178.44 178.41 3ngj h SER 29 N 0.24 0.08 -0.29 0.00 0.87 -0.83 -1.07 113.55 112.55 3ngj h SER 29 Ca 0.06 0.04 0.04 0.00 -1.23 0.00 0.00 61.79 60.70 3ngj h SER 29 Cb 0.57 0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.52 3ngj h SER 29 CO 0.03 0.08 0.06 -0.33 -0.53 0.00 0.00 176.83 176.14 3ngj h GLU 30 N 0.21 0.16 -0.78 2.24 5.08 -0.71 -1.50 114.58 119.28 3ngj h GLU 30 Ca 0.14 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 3ngj h GLU 30 Cb 0.12 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 3ngj h GLU 30 CO -0.15 0.11 0.34 0.00 -1.00 0.00 0.00 179.01 178.30 3ngj h ALA 31 N 1.21 1.01 -0.64 3.43 0.00 -0.89 0.28 119.26 123.66 3ngj h ALA 31 Ca 0.13 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3ngj h ALA 31 Cb 0.14 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3ngj h ALA 31 CO -0.18 0.61 0.17 0.00 0.00 0.00 0.00 179.25 179.85 3ngj h ALA 32 N 1.17 0.84 -0.32 0.00 0.00 -1.02 0.70 119.26 120.63 3ngj h ALA 32 Ca 0.26 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3ngj h ALA 32 Cb 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3ngj h ALA 32 CO -0.03 0.54 0.02 1.49 0.00 0.00 0.00 179.25 181.27 3ngj h GLU 33 N 0.93 0.56 -0.00 0.00 4.81 -0.81 -3.24 114.58 116.82 3ngj h GLU 33 Ca 0.20 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3ngj h GLU 33 Cb 0.34 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.66 3ngj h GLU 33 CO -0.00 0.67 -0.29 0.66 -0.73 0.00 0.00 179.01 179.32 3ngj n TYR 34 N -4.56 0.00 -3.60 0.92 4.01 0.05 -4.95 117.16 109.03 3ngj n TYR 34 Ca -0.02 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.49 3ngj n TYR 34 Cb 0.25 -0.27 0.08 0.00 -0.31 0.00 0.00 39.34 39.08 3ngj n TYR 34 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3ngj n LYS 35 N -1.28 -7.50 -1.47 -0.72 5.02 0.20 -4.85 118.16 107.57 3ngj n LYS 35 Ca 0.08 0.81 -0.35 0.00 -2.02 0.00 0.00 58.31 56.84 3ngj n LYS 35 Cb 0.33 -5.84 0.09 0.00 -0.02 0.00 0.00 35.03 29.59 3ngj n LYS 35 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 3ngj s PHE 36 N -3.33 2.05 0.19 2.13 0.08 -0.99 -4.31 117.98 113.80 3ngj s PHE 36 Ca 0.47 1.59 -0.11 0.00 0.12 0.00 0.00 56.93 59.00 3ngj s PHE 36 Cb -0.21 -3.50 0.19 0.00 -0.57 0.00 0.00 43.02 38.93 3ngj s PHE 36 CO 0.74 -2.65 1.78 0.00 -0.10 0.00 0.00 175.22 174.99 3ngj h ALA 37 N -0.20 0.73 -2.81 5.36 0.00 -0.75 -3.41 119.26 118.18 3ngj h ALA 37 Ca -0.48 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 3ngj h ALA 37 Cb 1.30 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 18.92 3ngj h ALA 37 CO 0.50 -0.08 -0.05 -1.12 0.00 0.00 0.00 179.25 178.50 3ngj s SER 38 N -5.49 -0.22 0.04 0.00 0.01 -1.10 -1.23 113.70 105.71 3ngj s SER 38 Ca -0.13 -0.47 -0.00 0.00 1.31 0.00 0.00 55.95 56.65 3ngj s SER 38 Cb 0.15 0.53 -0.04 0.00 0.21 0.00 0.00 66.02 66.87 3ngj s SER 38 CO 0.74 -0.97 0.17 0.68 0.41 0.00 0.00 173.24 174.27 3ngj s VAL 39 N -3.86 5.17 -0.20 3.43 -7.23 -0.32 -0.77 120.40 116.62 3ngj s VAL 39 Ca 0.08 -0.40 0.01 0.00 -1.81 0.00 0.00 61.98 59.86 3ngj s VAL 39 Cb 0.00 -3.48 0.03 0.00 0.56 0.00 0.00 36.38 33.50 3ngj s VAL 39 CO -0.05 0.21 -0.15 0.00 -0.31 0.00 0.00 175.10 174.79 3ngj s VAL 41 N 1.30 0.45 0.73 0.00 -7.23 -0.88 -1.36 120.40 113.40 3ngj s VAL 41 Ca 0.00 -1.90 -0.13 0.00 -1.81 0.00 0.00 61.98 58.15 3ngj s VAL 41 Cb -0.15 -1.74 0.04 0.00 0.56 0.00 0.00 36.38 35.08 3ngj s VAL 41 CO -0.10 -0.80 1.12 0.20 -0.31 0.00 0.00 175.10 175.21 3ngj s ASN 42 N -3.02 4.59 0.45 4.85 0.01 -1.26 -3.59 114.94 116.97 3ngj s ASN 42 Ca 0.14 1.99 0.16 0.00 -0.71 0.00 0.00 52.86 54.43 3ngj s ASN 42 Cb 0.07 -2.55 1.09 0.00 0.41 0.00 0.00 41.25 40.27 3ngj s ASN 42 CO -0.04 -1.98 1.98 -0.65 -1.51 0.00 0.00 177.10 174.90 3ngj h PRO 43 N -0.60 0.33 -0.61 -0.60 0.11 -1.96 -1.24 132.00 127.42 3ngj h PRO 43 Ca -0.45 -0.02 0.14 0.00 0.11 0.00 0.00 66.00 65.78 3ngj h PRO 43 Cb 1.25 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 3ngj h PRO 43 CO 0.51 0.22 0.42 0.00 -0.21 0.00 0.00 178.00 178.94 3ngj h THR 44 N 0.34 0.79 -0.05 -1.15 1.03 -1.97 -2.56 112.91 109.33 3ngj h THR 44 Ca 0.28 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.60 3ngj h THR 44 Cb 0.63 0.55 0.00 0.00 -1.07 0.00 0.00 68.15 68.26 3ngj h THR 44 CO -0.07 0.04 0.00 0.79 -0.01 0.00 0.00 175.52 176.27 3ngj n TRP 45 N -4.43 0.05 0.04 0.00 7.02 -0.47 -4.51 117.44 115.15 3ngj n TRP 45 Ca 0.11 -0.03 -0.11 0.00 -1.02 0.00 0.00 57.50 56.46 3ngj n TRP 45 Cb 0.53 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.37 3ngj n TRP 45 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 3ngj h VAL 46 N 2.85 0.67 -0.00 -0.99 2.07 -1.56 -1.74 116.25 117.55 3ngj h VAL 46 Ca 0.00 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.39 3ngj h VAL 46 Cb 0.61 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3ngj h VAL 46 CO 0.00 0.00 -0.61 1.55 0.02 0.00 0.00 177.57 178.53 3ngj h PRO 47 N -0.21 0.02 -0.10 1.57 0.13 -1.79 0.31 132.00 131.94 3ngj h PRO 47 Ca 0.05 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.17 3ngj h PRO 47 Cb 0.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.41 3ngj h PRO 47 CO -0.15 0.63 0.04 1.25 -0.23 0.00 0.00 178.00 179.53 3ngj h LEU 48 N 0.01 0.13 -0.95 1.56 5.85 -1.84 -2.06 115.31 118.02 3ngj h LEU 48 Ca -0.01 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.54 3ngj h LEU 48 Cb 1.09 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.04 3ngj h LEU 48 CO 0.08 0.28 0.59 0.00 -0.34 0.00 0.00 178.44 179.05 3ngj h ALA 50 N 1.33 0.65 -0.23 0.00 0.00 -0.80 -0.14 119.26 120.06 3ngj h ALA 50 Ca 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3ngj h ALA 50 Cb -0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3ngj h ALA 50 CO -0.07 0.14 0.15 1.49 0.00 0.00 0.00 179.25 180.96 3ngj h GLU 51 N 0.68 0.29 -0.07 0.00 4.81 -1.08 -1.83 114.58 117.38 3ngj h GLU 51 Ca 0.18 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.31 3ngj h GLU 51 Cb 0.01 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 3ngj h GLU 51 CO -0.03 0.19 -0.33 -0.07 -0.73 0.00 0.00 179.01 178.04 3ngj h LEU 52 N 0.30 0.13 -1.12 1.64 3.38 -0.87 -3.18 115.31 115.59 3ngj h LEU 52 Ca 0.09 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3ngj h LEU 52 Cb -0.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3ngj h LEU 52 CO -0.03 0.46 -0.37 0.18 0.09 0.00 0.00 178.44 178.78 3ngj n LEU 53 N -4.11 2.11 -4.67 1.67 4.77 -0.10 -4.91 117.00 111.76 3ngj n LEU 53 Ca -0.01 -0.76 -0.49 0.00 -0.03 0.00 0.00 56.01 54.71 3ngj n LEU 53 Cb 0.40 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 3ngj n LEU 53 CO 0.40 0.38 1.29 0.29 -1.33 0.00 0.00 177.39 178.42 3ngj n LYS 54 N 0.18 1.87 -0.12 3.23 4.76 -0.70 -1.45 118.16 125.93 3ngj n LYS 54 Ca 0.11 0.68 0.00 0.00 -2.87 0.00 0.00 58.31 56.23 3ngj n LYS 54 Cb 0.48 -2.45 0.00 0.00 -1.84 0.00 0.00 35.03 31.22 3ngj n LYS 54 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3ngj n GLY 55 N 3.79 1.61 0.06 0.72 0.00 -1.26 -4.91 105.19 105.19 3ngj n GLY 55 Ca 0.21 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.35 3ngj n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3ngj n THR 56 N -2.00 0.32 -0.53 2.61 -2.24 -0.52 -4.95 114.28 106.97 3ngj n THR 56 Ca 0.00 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 3ngj n THR 56 Cb 0.00 -0.06 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 3ngj n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ngj n GLY 57 N 1.34 1.36 3.70 3.38 0.00 -1.26 -4.96 105.19 108.76 3ngj n GLY 57 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.67 3ngj n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ngj s VAL 58 N -3.32 5.22 0.44 1.61 1.01 -1.26 -4.90 120.40 119.20 3ngj s VAL 58 Ca 0.00 0.75 -0.13 0.00 0.00 0.00 0.00 61.98 62.60 3ngj s VAL 58 Cb 0.00 -3.73 -0.07 0.00 0.00 0.00 0.00 36.38 32.58 3ngj s VAL 58 CO 0.00 0.31 0.84 -0.54 0.00 0.00 0.00 175.10 175.71 3ngj s LYS 59 N 0.88 3.85 -0.27 2.72 1.02 -0.37 -4.84 119.74 122.74 3ngj s LYS 59 Ca 0.21 0.65 -0.17 0.00 0.02 0.00 0.00 55.97 56.67 3ngj s LYS 59 Cb -0.14 -2.31 -0.03 0.00 -0.52 0.00 0.00 37.83 34.83 3ngj s LYS 59 CO 0.08 -0.10 0.47 0.08 -0.92 0.00 0.00 175.35 174.96 3ngj s VAL 60 N -2.43 5.10 0.05 3.17 1.01 -1.26 -1.17 120.40 124.86 3ngj s VAL 60 Ca 0.54 0.77 0.06 0.00 0.00 0.00 0.00 61.98 63.35 3ngj s VAL 60 Cb -0.10 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 3ngj s VAL 60 CO 0.30 0.10 -0.13 0.00 0.00 0.00 0.00 175.10 175.37 3ngj s THR 62 N -1.02 0.04 0.04 0.00 -1.32 -0.85 -2.08 115.64 110.46 3ngj s THR 62 Ca 0.17 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.74 3ngj s THR 62 Cb -0.11 -2.49 -0.03 0.00 -1.51 0.00 0.00 72.50 68.36 3ngj s THR 62 CO 0.08 0.00 -0.25 0.68 -2.21 0.00 0.00 174.62 172.92 3ngj s VAL 63 N -3.57 1.99 -0.07 5.08 -7.23 -1.24 -0.27 120.40 115.10 3ngj s VAL 63 Ca 0.40 -1.32 0.03 0.00 -1.81 0.00 0.00 61.98 59.27 3ngj s VAL 63 Cb 0.03 -1.71 0.01 0.00 0.56 0.00 0.00 36.38 35.27 3ngj s VAL 63 CO 0.24 0.33 -0.16 -0.63 -0.31 0.00 0.00 175.10 174.57 3ngj s ILE 64 N -0.79 1.44 -1.46 -0.62 -1.09 -0.32 -4.49 121.20 113.87 3ngj s ILE 64 Ca 0.10 -0.66 -0.07 0.00 -2.23 0.00 0.00 60.65 57.79 3ngj s ILE 64 Cb -0.10 -1.28 0.02 0.00 -1.58 0.00 0.00 42.46 39.52 3ngj s ILE 64 CO 0.02 0.42 0.90 0.61 -1.23 0.00 0.00 174.94 175.66 3ngj n GLY 65 N 3.69 -0.53 3.61 6.18 0.00 -1.26 -1.86 105.19 115.01 3ngj n GLY 65 Ca -0.21 0.20 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 3ngj n GLY 65 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3ngj s PHE 66 N -3.25 3.04 -2.75 1.61 5.36 -1.26 -0.16 117.98 120.58 3ngj s PHE 66 Ca 0.47 0.03 0.24 0.00 -0.96 0.00 0.00 56.93 56.71 3ngj s PHE 66 Cb -0.21 -1.79 0.33 0.00 -0.34 0.00 0.00 43.02 41.02 3ngj s PHE 66 CO 0.58 0.32 1.35 -0.35 -1.46 0.00 0.00 175.22 175.65 3ngj n PRO 67 N 2.43 2.37 0.05 10.12 -0.04 -1.26 -4.90 135.00 143.77 3ngj n PRO 67 Ca -0.18 -2.03 0.02 0.00 -0.04 0.00 0.00 63.50 61.27 3ngj n PRO 67 Cb 0.53 -1.48 -0.06 0.00 -0.04 0.00 0.00 33.50 32.45 3ngj n PRO 67 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3ngj h LEU 68 N 4.48 0.00 0.31 1.53 3.38 -1.94 -3.48 115.31 119.58 3ngj h LEU 68 Ca 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 3ngj h LEU 68 Cb 0.97 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.66 3ngj h LEU 68 CO 0.00 0.46 -0.12 0.61 0.09 0.00 0.00 178.44 179.48 3ngj n GLY 69 N 1.35 0.72 2.59 0.83 0.00 0.78 -4.70 105.19 106.76 3ngj n GLY 69 Ca -0.07 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 3ngj n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngj n ALA 70 N 1.12 5.99 -2.50 4.61 0.00 -1.26 -3.53 120.51 124.95 3ngj n ALA 70 Ca -0.06 -3.98 -0.14 0.00 0.00 0.00 0.00 53.44 49.25 3ngj n ALA 70 Cb 0.44 -1.43 -0.11 0.00 0.00 0.00 0.00 19.45 18.35 3ngj n ALA 70 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3ngj s THR 71 N -5.07 0.88 0.68 0.00 -1.32 -1.26 -5.13 115.64 104.42 3ngj s THR 71 Ca 0.54 -1.60 -0.17 0.00 -1.21 0.00 0.00 61.69 59.25 3ngj s THR 71 Cb 0.44 -1.31 0.01 0.00 -1.51 0.00 0.00 72.50 70.14 3ngj s THR 71 CO -0.22 -0.56 1.26 -2.84 -2.21 0.00 0.00 174.62 170.05 3ngj s PRO 72 N -2.74 2.38 0.33 7.08 0.02 -1.26 -4.75 135.00 136.07 3ngj s PRO 72 Ca 0.04 1.96 0.10 0.00 0.02 0.00 0.00 61.00 63.13 3ngj s PRO 72 Cb -0.03 -1.84 0.88 0.00 0.02 0.00 0.00 34.50 33.54 3ngj s PRO 72 CO -0.00 -1.70 1.75 0.77 -0.33 0.00 0.00 177.00 177.49 3ngj h SER 73 N 0.23 0.66 0.05 2.53 0.02 -1.97 -1.11 113.55 113.97 3ngj h SER 73 Ca -0.50 0.11 -0.08 0.00 -0.84 0.00 0.00 61.79 60.48 3ngj h SER 73 Cb 1.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 3ngj h SER 73 CO 0.52 0.16 -0.26 1.05 -1.14 0.00 0.00 176.83 177.15 3ngj h GLU 74 N 0.60 0.34 -0.09 3.45 4.11 -1.97 0.01 114.58 121.03 3ngj h GLU 74 Ca 0.61 -0.12 -0.07 0.00 0.07 0.00 0.00 59.36 59.85 3ngj h GLU 74 Cb 1.17 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3ngj h GLU 74 CO -0.41 0.58 -0.22 0.28 0.07 0.00 0.00 179.01 179.31 3ngj h VAL 75 N 0.30 1.41 -0.70 -1.06 2.07 -1.58 -1.17 116.25 115.52 3ngj h VAL 75 Ca 0.05 -1.55 0.07 0.00 0.82 0.00 0.00 66.70 66.09 3ngj h VAL 75 Cb 0.62 2.20 -0.06 0.00 -1.52 0.00 0.00 31.29 32.53 3ngj h VAL 75 CO 0.04 0.44 0.38 0.11 0.02 0.00 0.00 177.57 178.57 3ngj h LYS 76 N -0.17 0.65 -0.48 1.57 1.57 -1.10 -1.38 116.57 117.23 3ngj h LYS 76 Ca -0.00 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3ngj h LYS 76 Cb 0.83 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 3ngj h LYS 76 CO 0.05 0.43 0.29 0.00 -0.57 0.00 0.00 179.45 179.65 3ngj h ALA 77 N 1.38 0.61 -0.31 3.86 0.00 -0.96 -1.54 119.26 122.30 3ngj h ALA 77 Ca 0.32 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 3ngj h ALA 77 Cb 0.26 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3ngj h ALA 77 CO -0.22 0.09 0.13 -0.92 0.00 0.00 0.00 179.25 178.34 3ngj h TYR 78 N 0.64 0.46 -1.00 0.00 3.20 -0.83 0.22 116.97 119.66 3ngj h TYR 78 Ca 0.17 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.05 3ngj h TYR 78 Cb -0.02 -0.14 -0.06 0.00 1.54 0.00 0.00 36.73 38.05 3ngj h TYR 78 CO -0.03 0.44 0.66 1.49 -1.64 0.00 0.00 178.16 179.07 3ngj h GLU 79 N 0.36 1.23 -0.08 1.82 4.81 -1.20 -1.15 114.58 120.36 3ngj h GLU 79 Ca 0.10 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3ngj h GLU 79 Cb 0.16 -0.28 -0.00 0.00 0.63 0.00 0.00 28.75 29.26 3ngj h GLU 79 CO -0.01 0.81 0.04 1.15 -0.73 0.00 0.00 179.01 180.27 3ngj h THR 80 N 1.27 1.11 -0.50 0.32 2.02 -1.01 -0.61 112.91 115.50 3ngj h THR 80 Ca 0.40 -0.32 0.05 0.00 0.77 0.00 0.00 66.41 67.32 3ngj h THR 80 Cb -0.00 1.18 -0.05 0.00 -1.74 0.00 0.00 68.15 67.54 3ngj h THR 80 CO -0.12 0.09 0.22 0.50 0.37 0.00 0.00 175.52 176.58 3ngj h LYS 81 N 0.01 0.42 -0.32 6.66 3.64 -0.49 -0.06 116.57 126.43 3ngj h LYS 81 Ca 0.03 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 3ngj h LYS 81 Cb 0.12 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3ngj h LYS 81 CO -0.00 0.28 -0.10 0.28 -2.27 0.00 0.00 179.45 177.63 3ngj h VAL 82 N 0.44 1.28 -0.56 2.00 2.07 -1.12 -1.32 116.25 119.04 3ngj h VAL 82 Ca 0.23 -1.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 3ngj h VAL 82 Cb 0.19 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 3ngj h VAL 82 CO -0.19 0.38 0.34 0.00 0.02 0.00 0.00 177.57 178.12 3ngj h ALA 83 N 0.79 0.71 -0.40 1.67 0.00 -0.64 -0.62 119.26 120.77 3ngj h ALA 83 Ca 0.08 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3ngj h ALA 83 Cb 0.61 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3ngj h ALA 83 CO 0.04 0.19 -0.06 0.28 0.00 0.00 0.00 179.25 179.69 3ngj h VAL 84 N 0.75 1.27 -0.93 0.00 2.07 -0.90 -0.35 116.25 118.17 3ngj h VAL 84 Ca 0.20 -1.12 0.16 0.00 0.82 0.00 0.00 66.70 66.75 3ngj h VAL 84 Cb -0.03 1.19 -0.10 0.00 -1.52 0.00 0.00 31.29 30.83 3ngj h VAL 84 CO -0.04 0.38 0.53 -0.33 0.02 0.00 0.00 177.57 178.13 3ngj h GLU 85 N 0.56 0.71 -0.01 1.57 5.08 -1.00 -2.00 114.58 119.50 3ngj h GLU 85 Ca 0.11 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3ngj h GLU 85 Cb 0.57 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3ngj h GLU 85 CO 0.03 0.47 -0.08 1.04 -1.00 0.00 0.00 179.01 179.47 3ngj n GLN 86 N -4.80 0.97 0.00 2.33 6.02 -0.26 -4.89 117.38 116.76 3ngj n GLN 86 Ca 0.19 -0.39 0.00 0.00 -0.01 0.00 0.00 57.00 56.79 3ngj n GLN 86 Cb 0.47 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.24 3ngj n GLN 86 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ngj n GLY 87 N 1.22 0.92 3.73 1.08 0.00 -0.75 -3.69 105.19 107.69 3ngj n GLY 87 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 3ngj n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngj s ALA 88 N -1.73 3.57 -0.56 4.61 0.00 -0.20 -4.69 121.76 122.76 3ngj s ALA 88 Ca 0.00 1.16 0.20 0.00 0.00 0.00 0.00 51.96 53.32 3ngj s ALA 88 Cb 0.00 -3.51 -0.25 0.00 0.00 0.00 0.00 23.12 19.36 3ngj s ALA 88 CO 0.00 -0.60 0.67 0.39 0.00 0.00 0.00 175.76 176.22 3ngj n GLU 89 N 2.85 0.60 -3.87 0.00 1.02 0.64 -4.50 120.64 117.38 3ngj n GLU 89 Ca 0.07 -0.07 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 3ngj n GLU 89 Cb 0.42 -1.44 -0.11 0.00 -0.02 0.00 0.00 31.44 30.29 3ngj n GLU 89 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3ngj s GLU 90 N -3.05 0.39 -0.02 3.49 2.02 -1.00 -1.63 118.70 118.89 3ngj s GLU 90 Ca 0.01 -0.26 0.03 0.00 0.02 0.00 0.00 54.97 54.78 3ngj s GLU 90 Cb 0.14 0.16 -0.00 0.00 0.10 0.00 0.00 34.13 34.53 3ngj s GLU 90 CO 0.81 -0.08 -0.12 0.14 0.02 0.00 0.00 175.26 176.03 3ngj s VAL 91 N -1.00 0.96 -0.37 2.63 -7.23 0.15 -2.01 120.40 113.53 3ngj s VAL 91 Ca -0.11 -0.48 -0.01 0.00 -1.81 0.00 0.00 61.98 59.57 3ngj s VAL 91 Cb -0.06 -0.82 0.09 0.00 0.56 0.00 0.00 36.38 36.15 3ngj s VAL 91 CO 0.01 0.28 0.12 -1.81 -0.31 0.00 0.00 175.10 173.39 3ngj s ASP 92 N -0.03 5.06 0.28 4.85 1.11 0.63 -0.27 116.67 128.29 3ngj s ASP 92 Ca 0.00 -1.86 -0.05 0.00 0.18 0.00 0.00 52.55 50.82 3ngj s ASP 92 Cb -0.07 -1.76 -0.05 0.00 1.07 0.00 0.00 42.92 42.11 3ngj s ASP 92 CO 0.00 -0.44 0.55 0.00 1.18 0.00 0.00 175.17 176.46 3ngj s MET 93 N 1.12 3.65 -0.15 8.23 0.23 0.16 -1.17 119.30 131.37 3ngj s MET 93 Ca 0.05 0.03 -0.09 0.00 -1.03 0.00 0.00 55.69 54.66 3ngj s MET 93 Cb -0.21 -2.66 -0.04 0.00 -1.53 0.00 0.00 34.83 30.39 3ngj s MET 93 CO -0.04 0.24 0.15 0.08 -2.03 0.00 0.00 175.02 173.41 3ngj s VAL 94 N -2.04 5.45 0.83 5.16 1.01 -0.78 0.25 120.40 130.28 3ngj s VAL 94 Ca 0.44 0.22 -0.11 0.00 0.00 0.00 0.00 61.98 62.54 3ngj s VAL 94 Cb -0.11 -3.44 0.09 0.00 0.00 0.00 0.00 36.38 32.92 3ngj s VAL 94 CO 0.29 0.54 1.13 0.27 0.00 0.00 0.00 175.10 177.33 3ngj s ILE 95 N -0.43 2.61 -0.80 2.22 -4.36 -0.91 -4.52 121.20 115.01 3ngj s ILE 95 Ca 0.12 0.21 -0.25 0.00 -0.26 0.00 0.00 60.65 60.48 3ngj s ILE 95 Cb -0.12 -2.50 0.05 0.00 1.25 0.00 0.00 42.46 41.14 3ngj s ILE 95 CO 0.02 -0.24 1.24 0.21 0.24 0.00 0.00 174.94 176.41 3ngj s ASN 96 N -2.84 6.26 0.33 4.36 3.84 -1.23 -4.27 114.94 121.39 3ngj s ASN 96 Ca 0.66 -0.87 0.07 0.00 0.21 0.00 0.00 52.86 52.92 3ngj s ASN 96 Cb -0.21 -2.52 0.58 0.00 -0.55 0.00 0.00 41.25 38.54 3ngj s ASN 96 CO 0.55 -1.64 1.80 0.40 -2.79 0.00 0.00 177.10 175.42 3ngj h ILE 97 N 6.17 1.24 -0.96 -5.21 2.04 -1.84 -1.74 117.51 117.21 3ngj h ILE 97 Ca -0.15 -1.13 0.12 0.00 1.00 0.00 0.00 64.86 64.70 3ngj h ILE 97 Cb 1.04 1.37 -0.08 0.00 -0.74 0.00 0.00 36.82 38.42 3ngj h ILE 97 CO 1.28 0.35 0.61 1.23 0.00 0.00 0.00 178.15 181.62 3ngj h GLY 98 N 0.97 1.48 1.02 5.37 0.00 -1.94 -0.82 103.07 109.15 3ngj h GLY 98 Ca 0.05 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 3ngj h GLY 98 CO 0.04 0.15 0.30 -0.33 0.00 0.00 0.00 176.54 176.69 3ngj h MET 99 N 0.90 1.02 -0.31 4.80 2.86 -1.67 -1.47 114.93 121.07 3ngj h MET 99 Ca 0.47 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.94 3ngj h MET 99 Cb 0.54 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 3ngj h MET 99 CO -0.24 0.84 0.20 0.28 1.06 0.00 0.00 176.91 179.05 3ngj h VAL 100 N 0.98 1.07 0.00 -2.22 2.07 -1.13 -0.05 116.25 116.97 3ngj h VAL 100 Ca 0.23 -0.14 -0.06 0.00 0.82 0.00 0.00 66.70 67.55 3ngj h VAL 100 Cb 0.18 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 3ngj h VAL 100 CO -0.02 0.07 -0.28 0.11 0.02 0.00 0.00 177.57 177.47 3ngj h LYS 101 N 0.41 0.00 -0.00 1.57 1.79 -1.06 -0.63 116.57 118.65 3ngj h LYS 101 Ca 0.11 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.58 3ngj h LYS 101 Cb -0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.61 3ngj h LYS 101 CO -0.03 0.28 -0.02 0.00 -1.08 0.00 0.00 179.45 178.60 3ngj n ALA 102 N -2.38 2.64 -2.16 3.86 0.00 -0.57 -4.91 120.51 116.99 3ngj n ALA 102 Ca -0.02 -0.22 -0.19 0.00 0.00 0.00 0.00 53.44 53.01 3ngj n ALA 102 Cb 0.37 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 3ngj n ALA 102 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ngj n LYS 103 N -0.97 -1.51 -2.19 0.00 5.02 -0.24 -4.89 118.16 113.39 3ngj n LYS 103 Ca 0.19 1.01 -0.41 0.00 -2.02 0.00 0.00 58.31 57.08 3ngj n LYS 103 Cb 0.20 -5.53 0.00 0.00 -0.02 0.00 0.00 35.03 29.68 3ngj n LYS 103 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3ngj n LYS 104 N -2.76 4.07 0.16 1.97 5.02 -0.11 -4.75 118.16 121.76 3ngj n LYS 104 Ca -0.22 -3.50 0.01 0.00 -2.02 0.00 0.00 58.31 52.57 3ngj n LYS 104 Cb 0.67 -2.79 0.29 0.00 -0.02 0.00 0.00 35.03 33.18 3ngj n LYS 104 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 3ngj h TYR 105 N 5.23 0.02 -0.72 2.13 0.05 -1.90 -1.24 116.97 120.53 3ngj h TYR 105 Ca 0.53 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 59.29 3ngj h TYR 105 Cb 0.48 -0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.18 3ngj h TYR 105 CO 1.41 0.47 0.38 -0.44 -1.05 0.00 0.00 178.16 178.92 3ngj h ASP 106 N 0.02 0.90 -0.43 3.88 3.32 -1.97 -1.00 116.42 121.13 3ngj h ASP 106 Ca -0.00 -0.08 -0.14 0.00 0.02 0.00 0.00 57.03 56.83 3ngj h ASP 106 Cb 0.81 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 3ngj h ASP 106 CO 0.06 0.74 -0.28 0.44 -1.72 0.00 0.00 179.24 178.48 3ngj h ASP 107 N 1.01 0.99 -0.49 6.45 3.32 -1.77 -1.03 116.42 124.89 3ngj h ASP 107 Ca 0.25 -0.43 0.06 0.00 0.02 0.00 0.00 57.03 56.94 3ngj h ASP 107 Cb 0.05 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.27 3ngj h ASP 107 CO -0.04 1.20 0.18 0.58 -1.72 0.00 0.00 179.24 179.45 3ngj h VAL 108 N 0.78 0.85 -0.64 -1.35 2.07 -0.97 0.24 116.25 117.23 3ngj h VAL 108 Ca 0.09 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.45 3ngj h VAL 108 Cb 0.87 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 3ngj h VAL 108 CO 0.08 0.07 0.30 -0.08 0.02 0.00 0.00 177.57 177.96 3ngj h GLU 109 N 0.37 0.93 -0.51 1.57 4.81 -0.99 -1.70 114.58 119.06 3ngj h GLU 109 Ca 0.23 -0.14 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 3ngj h GLU 109 Cb 0.23 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.42 3ngj h GLU 109 CO -0.23 0.75 0.08 0.87 -0.73 0.00 0.00 179.01 179.76 3ngj h LYS 110 N 0.89 0.79 -0.10 1.92 1.57 -0.73 0.68 116.57 121.60 3ngj h LYS 110 Ca 0.22 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3ngj h LYS 110 Cb 0.13 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3ngj h LYS 110 CO -0.03 0.75 0.05 0.22 -0.57 0.00 0.00 179.45 179.87 3ngj h ASP 111 N 0.76 0.14 -0.38 0.86 3.58 -0.57 -0.73 116.42 120.07 3ngj h ASP 111 Ca 0.16 -0.13 -0.01 0.00 0.42 0.00 0.00 57.03 57.47 3ngj h ASP 111 Cb 0.34 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.34 3ngj h ASP 111 CO 0.01 0.23 0.21 0.58 -2.88 0.00 0.00 179.24 177.38 3ngj h VAL 112 N 0.04 1.15 -0.44 2.25 2.07 -1.12 -2.88 116.25 117.31 3ngj h VAL 112 Ca 0.04 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.17 3ngj h VAL 112 Cb 0.13 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 3ngj h VAL 112 CO -0.00 0.16 0.29 0.50 0.02 0.00 0.00 177.57 178.53 3ngj h LYS 113 N 0.48 0.55 -0.88 1.57 1.63 -0.70 0.88 116.57 120.10 3ngj h LYS 113 Ca 0.13 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.89 3ngj h LYS 113 Cb 0.06 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.53 3ngj h LYS 113 CO -0.02 0.37 0.52 0.00 -3.45 0.00 0.00 179.45 176.86 3ngj h ALA 114 N 1.73 1.13 -0.09 5.00 0.00 -0.92 0.84 119.26 126.96 3ngj h ALA 114 Ca 0.16 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 3ngj h ALA 114 Cb -0.04 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.40 3ngj h ALA 114 CO -0.04 0.61 -0.44 0.28 0.00 0.00 0.00 179.25 179.66 3ngj h VAL 115 N 1.22 1.38 -0.44 0.00 2.07 -1.27 -2.39 116.25 116.83 3ngj h VAL 115 Ca 0.31 -1.79 0.08 0.00 0.82 0.00 0.00 66.70 66.12 3ngj h VAL 115 Cb -0.02 2.23 -0.06 0.00 -1.52 0.00 0.00 31.29 31.91 3ngj h VAL 115 CO -0.06 0.53 0.05 0.58 0.02 0.00 0.00 177.57 178.70 3ngj h VAL 116 N 0.04 0.72 -0.34 2.57 2.07 -0.59 0.56 116.25 121.27 3ngj h VAL 116 Ca -0.03 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.47 3ngj h VAL 116 Cb 1.09 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 3ngj h VAL 116 CO 0.09 0.03 0.12 0.44 0.02 0.00 0.00 177.57 178.27 3ngj h ASP 117 N 0.17 0.13 0.70 0.57 3.32 -0.84 -2.71 116.42 117.76 3ngj h ASP 117 Ca 0.22 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.26 3ngj h ASP 117 Cb 0.29 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3ngj h ASP 117 CO -0.32 0.11 -0.22 0.00 -1.72 0.00 0.00 179.24 177.10 3ngj h ALA 118 N 1.22 1.12 0.00 3.45 0.00 -0.88 -3.20 119.26 120.95 3ngj h ALA 118 Ca 0.15 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3ngj h ALA 118 Cb 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3ngj h ALA 118 CO -0.16 0.27 -0.24 0.66 0.00 0.00 0.00 179.25 179.78 3ngj h SER 119 N 0.00 0.00 0.00 0.00 4.64 -0.56 -3.38 113.55 114.25 3ngj h SER 119 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ngj h SER 119 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3ngj h SER 119 CO 0.03 0.24 0.00 0.61 -0.87 0.00 0.00 176.83 176.84 3ngj n GLY 120 N -0.50 3.51 0.07 -0.77 0.00 -1.21 -1.36 105.19 104.92 3ngj n GLY 120 Ca -0.02 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.00 3ngj n GLY 120 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3ngj n LYS 121 N 13.88 0.12 -2.48 1.61 0.00 -1.26 -4.78 118.16 125.25 3ngj n LYS 121 Ca 0.00 0.28 -0.37 0.00 -0.00 0.00 0.00 58.31 58.22 3ngj n LYS 121 Cb 0.00 -1.70 -0.03 0.00 -0.00 0.00 0.00 35.03 33.29 3ngj n LYS 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3ngj s ALA 122 N -3.15 3.11 0.37 0.58 0.00 -0.46 -5.00 121.76 117.21 3ngj s ALA 122 Ca 0.07 0.78 -0.25 0.00 0.00 0.00 0.00 51.96 52.56 3ngj s ALA 122 Cb 0.11 -3.30 -0.09 0.00 0.00 0.00 0.00 23.12 19.84 3ngj s ALA 122 CO 0.41 -0.29 1.02 -1.17 0.00 0.00 0.00 175.76 175.72 3ngj s LEU 123 N -2.54 4.20 -0.16 0.00 0.20 -0.65 -4.83 118.68 114.91 3ngj s LEU 123 Ca 0.57 1.99 -0.03 0.00 0.69 0.00 0.00 54.13 57.34 3ngj s LEU 123 Cb -0.25 -4.13 -0.03 0.00 -0.43 0.00 0.00 46.19 41.36 3ngj s LEU 123 CO 0.31 -0.36 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.08 3ngj s THR 124 N -1.64 3.81 -0.01 3.68 2.01 -1.26 -0.68 115.64 121.55 3ngj s THR 124 Ca 0.55 -0.38 0.05 0.00 0.31 0.00 0.00 61.69 62.22 3ngj s THR 124 Cb -0.21 -2.67 -0.03 0.00 0.01 0.00 0.00 72.50 69.60 3ngj s THR 124 CO 0.27 0.49 -0.16 -0.54 -0.69 0.00 0.00 174.62 173.99 3ngj s LYS 125 N 0.41 2.30 -0.20 4.92 1.02 0.63 -1.87 119.74 126.95 3ngj s LYS 125 Ca -0.04 -0.83 0.00 0.00 0.02 0.00 0.00 55.97 55.12 3ngj s LYS 125 Cb -0.14 -2.28 0.02 0.00 -0.52 0.00 0.00 37.83 34.91 3ngj s LYS 125 CO 0.03 0.58 -0.16 0.08 -0.92 0.00 0.00 175.35 174.96 3ngj s VAL 126 N -0.82 2.33 -0.30 3.17 1.01 -0.25 -0.66 120.40 124.87 3ngj s VAL 126 Ca 0.13 -0.93 -0.25 0.00 0.00 0.00 0.00 61.98 60.93 3ngj s VAL 126 Cb -0.11 -2.04 0.01 0.00 0.00 0.00 0.00 36.38 34.24 3ngj s VAL 126 CO 0.03 0.46 0.89 -0.63 0.00 0.00 0.00 175.10 175.84 3ngj s ILE 127 N 1.31 4.71 -0.95 2.22 1.01 0.14 -0.38 121.20 129.25 3ngj s ILE 127 Ca 0.04 1.43 0.24 0.00 0.00 0.00 0.00 60.65 62.35 3ngj s ILE 127 Cb -0.14 -4.23 -0.05 0.00 0.01 0.00 0.00 42.46 38.05 3ngj s ILE 127 CO -0.10 -0.29 1.28 2.30 0.00 0.00 0.00 174.94 178.12 3ngj n ILE 128 N 5.59 0.03 -3.49 2.92 -5.35 -0.53 -2.14 119.36 116.39 3ngj n ILE 128 Ca 0.07 -0.04 -0.19 0.00 -0.27 0.00 0.00 62.75 62.32 3ngj n ILE 128 Cb 0.48 0.36 0.02 0.00 -1.74 0.00 0.00 39.64 38.76 3ngj n ILE 128 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 3ngj n GLU 129 N -1.57 -1.39 -0.34 6.28 4.07 -1.01 -4.83 120.64 121.84 3ngj n GLU 129 Ca 0.05 0.88 0.22 0.00 -0.06 0.00 0.00 57.16 58.25 3ngj n GLU 129 Cb 0.35 -4.29 0.46 0.00 -0.06 0.00 0.00 31.44 27.90 3ngj n GLU 129 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3ngj n TYR 132 N -3.45 0.07 -4.20 0.00 4.01 -0.63 -4.94 117.16 108.02 3ngj n TYR 132 Ca 0.02 -0.04 -0.30 0.00 -0.16 0.00 0.00 57.90 57.41 3ngj n TYR 132 Cb 0.40 -0.00 -0.09 0.00 -0.31 0.00 0.00 39.34 39.34 3ngj n TYR 132 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3ngj s LEU 133 N -1.53 3.29 0.83 7.72 1.43 -0.59 -5.11 118.68 124.73 3ngj s LEU 133 Ca 0.23 -0.24 -0.12 0.00 -1.03 0.00 0.00 54.13 52.97 3ngj s LEU 133 Cb 0.16 -2.03 0.09 0.00 0.03 0.00 0.00 46.19 44.44 3ngj s LEU 133 CO 0.24 0.19 1.14 0.42 0.23 0.00 0.00 176.35 178.57 3ngj s THR 134 N -1.24 2.33 0.22 5.49 -4.23 -1.26 -4.87 115.64 112.07 3ngj s THR 134 Ca 0.23 0.11 -0.06 0.00 -1.18 0.00 0.00 61.69 60.78 3ngj s THR 134 Cb -0.11 -2.98 0.11 0.00 1.34 0.00 0.00 72.50 70.86 3ngj s THR 134 CO 0.16 -0.14 1.72 0.78 -0.54 0.00 0.00 174.62 176.59 3ngj h ASN 135 N -1.18 0.98 -0.82 3.99 2.35 -1.99 -0.37 115.58 118.53 3ngj h ASN 135 Ca -0.48 -0.23 0.06 0.00 -0.55 0.00 0.00 56.30 55.10 3ngj h ASN 135 Cb 1.31 -0.26 -0.06 0.00 0.05 0.00 0.00 38.32 39.37 3ngj h ASN 135 CO 0.63 0.99 0.51 -0.33 -1.65 0.00 0.00 177.43 177.58 3ngj h GLU 136 N 0.96 0.91 -0.35 0.81 5.08 -2.00 -1.61 114.58 118.38 3ngj h GLU 136 Ca 0.19 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.39 3ngj h GLU 136 Cb 0.44 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 3ngj h GLU 136 CO 0.01 0.60 -0.20 0.93 -1.00 0.00 0.00 179.01 179.35 3ngj h GLU 137 N 0.94 0.76 -0.34 2.33 5.08 -1.79 -1.79 114.58 119.76 3ngj h GLU 137 Ca 0.36 -0.35 0.06 0.00 -1.00 0.00 0.00 59.36 58.43 3ngj h GLU 137 Cb 0.15 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 3ngj h GLU 137 CO -0.16 0.96 -0.03 0.87 -1.00 0.00 0.00 179.01 179.64 3ngj h LYS 138 N 0.54 0.05 0.10 2.33 1.57 -0.75 -0.11 116.57 120.30 3ngj h LYS 138 Ca 0.07 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3ngj h LYS 138 Cb 0.76 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.05 3ngj h LYS 138 CO 0.06 0.04 -0.06 0.28 -0.57 0.00 0.00 179.45 179.19 3ngj h VAL 139 N 0.06 0.86 -0.55 0.50 2.07 -1.20 -1.81 116.25 116.18 3ngj h VAL 139 Ca 0.16 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.58 3ngj h VAL 139 Cb 0.24 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 3ngj h VAL 139 CO -0.31 0.00 -0.07 -0.08 0.02 0.00 0.00 177.57 177.14 3ngj h GLU 140 N -0.16 1.02 -0.30 1.57 4.57 -1.11 -2.09 114.58 118.08 3ngj h GLU 140 Ca -0.01 -0.36 0.02 0.00 -1.18 0.00 0.00 59.36 57.83 3ngj h GLU 140 Cb 0.14 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 3ngj h GLU 140 CO 0.01 1.05 0.16 0.28 -1.18 0.00 0.00 179.01 179.33 3ngj h VAL 141 N 0.90 1.01 -0.87 0.32 2.07 -0.99 -1.71 116.25 116.98 3ngj h VAL 141 Ca 0.15 -0.12 0.07 0.00 0.82 0.00 0.00 66.70 67.62 3ngj h VAL 141 Cb 0.63 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 3ngj h VAL 141 CO 0.04 0.06 0.54 0.00 0.02 0.00 0.00 177.57 178.23 3ngj h LYS 143 N 0.97 0.91 -0.37 0.00 1.57 -0.86 -2.11 116.57 116.67 3ngj h LYS 143 Ca 0.39 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 59.02 3ngj h LYS 143 Cb 0.20 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 3ngj h LYS 143 CO -0.18 0.64 -0.07 0.00 -0.57 0.00 0.00 179.45 179.26 3ngj h ARG 144 N 0.91 0.62 -0.47 3.15 2.47 -0.66 -0.73 114.38 119.68 3ngj h ARG 144 Ca 0.24 -0.17 -0.01 0.00 -1.26 0.00 0.00 59.98 58.78 3ngj h ARG 144 Cb -0.05 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.18 3ngj h ARG 144 CO -0.05 0.70 0.25 0.00 0.56 0.00 0.00 179.97 181.42 3ngj h VAL 146 N 0.62 1.17 -0.50 0.00 2.07 -1.15 -1.62 116.25 116.85 3ngj h VAL 146 Ca 0.16 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.26 3ngj h VAL 146 Cb 0.08 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 3ngj h VAL 146 CO -0.02 0.18 0.33 0.00 0.02 0.00 0.00 177.57 178.07 3ngj h ALA 147 N 1.10 1.67 0.00 1.67 0.00 -0.82 -1.83 119.26 121.05 3ngj h ALA 147 Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3ngj h ALA 147 Cb 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3ngj h ALA 147 CO -0.03 0.30 -0.05 0.00 0.00 0.00 0.00 179.25 179.47 3ngj n ALA 148 N -2.47 2.38 -0.22 0.00 0.00 -0.21 -4.95 120.51 115.06 3ngj n ALA 148 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3ngj n ALA 148 Cb 0.07 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.08 3ngj n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ngj n GLY 149 N 1.40 0.88 3.76 0.00 0.00 -0.69 -4.61 105.19 105.93 3ngj n GLY 149 Ca 0.06 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 3ngj n GLY 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngj s ALA 150 N -2.00 3.45 0.23 4.61 0.00 -0.66 -4.94 121.76 122.44 3ngj s ALA 150 Ca 0.00 1.06 0.08 0.00 0.00 0.00 0.00 51.96 53.10 3ngj s ALA 150 Cb 0.00 -3.40 0.19 0.00 0.00 0.00 0.00 23.12 19.91 3ngj s ALA 150 CO 0.00 -0.38 1.51 0.93 0.00 0.00 0.00 175.76 177.83 3ngj h GLU 151 N 3.76 0.06 -4.97 0.00 3.07 -1.71 -3.42 114.58 111.37 3ngj h GLU 151 Ca -0.47 -0.05 -0.37 0.00 -0.50 0.00 0.00 59.36 57.97 3ngj h GLU 151 Cb 1.22 0.01 -0.23 0.00 -0.84 0.00 0.00 28.75 28.91 3ngj h GLU 151 CO 0.67 0.75 -0.77 0.71 -1.40 0.00 0.00 179.01 178.98 3ngj s TYR 152 N -3.42 0.96 0.06 4.33 2.02 -0.91 -0.92 117.35 119.47 3ngj s TYR 152 Ca -0.01 -0.41 0.06 0.00 -0.37 0.00 0.00 57.07 56.34 3ngj s TYR 152 Cb 0.12 -0.56 -0.04 0.00 -0.40 0.00 0.00 41.96 41.08 3ngj s TYR 152 CO 0.79 -0.00 -0.09 0.14 -1.57 0.00 0.00 175.55 174.81 3ngj s VAL 153 N -1.07 3.42 -0.01 0.71 -7.23 -0.34 -1.09 120.40 114.78 3ngj s VAL 153 Ca -0.03 -1.09 0.01 0.00 -1.81 0.00 0.00 61.98 59.06 3ngj s VAL 153 Cb -0.09 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 34.31 3ngj s VAL 153 CO 0.01 0.23 -0.04 -0.75 -0.31 0.00 0.00 175.10 174.24 3ngj s LYS 154 N -1.87 0.44 0.12 4.82 2.20 0.48 -0.74 119.74 125.20 3ngj s LYS 154 Ca 0.19 -0.13 -0.15 0.00 -0.36 0.00 0.00 55.97 55.52 3ngj s LYS 154 Cb -0.11 -0.45 -0.02 0.00 -1.51 0.00 0.00 37.83 35.74 3ngj s LYS 154 CO 0.11 0.05 1.60 1.79 -0.36 0.00 0.00 175.35 178.54 3ngj h THR 155 N 5.35 1.24 -2.97 3.43 1.35 -1.50 -1.41 112.91 118.40 3ngj h THR 155 Ca -0.31 -0.87 -0.03 0.00 -0.55 0.00 0.00 66.41 64.65 3ngj h THR 155 Cb 1.18 1.05 -0.13 0.00 -1.73 0.00 0.00 68.15 68.52 3ngj h THR 155 CO 0.50 0.30 0.18 -0.44 -0.25 0.00 0.00 175.52 175.80 3ngj s SER 156 N -6.07 -0.54 0.20 5.36 0.01 -1.26 -1.00 113.70 110.41 3ngj s SER 156 Ca -0.13 0.02 0.18 0.00 1.31 0.00 0.00 55.95 57.33 3ngj s SER 156 Cb 0.10 0.58 0.01 0.00 0.21 0.00 0.00 66.02 66.92 3ngj s SER 156 CO 0.78 -0.93 1.14 0.71 0.41 0.00 0.00 173.24 175.35 3ngj h THR 157 N 2.12 0.42 0.00 1.44 1.35 -1.91 -3.44 112.91 112.90 3ngj h THR 157 Ca -0.33 -1.70 0.00 0.00 -0.55 0.00 0.00 66.41 63.82 3ngj h THR 157 Cb 1.29 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 69.72 3ngj h THR 157 CO 0.39 0.24 0.00 0.61 -0.25 0.00 0.00 175.52 176.51 3ngj n GLY 158 N 1.26 1.73 0.11 5.82 0.00 -1.26 -4.86 105.19 107.98 3ngj n GLY 158 Ca -0.02 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 3ngj n GLY 158 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ngj n PHE 159 N -2.00 0.00 -1.04 1.61 3.01 -1.26 -4.96 117.46 112.83 3ngj n PHE 159 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3ngj n PHE 159 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 3ngj n PHE 159 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3ngj n GLY 160 N 1.28 -0.11 0.22 1.37 0.00 -1.26 -4.99 105.19 101.69 3ngj n GLY 160 Ca 0.04 -1.77 -0.09 0.00 0.00 0.00 0.00 46.02 44.20 3ngj n GLY 160 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3ngj h THR 161 N -0.33 1.32 -3.90 2.61 1.35 -1.94 -3.45 112.91 108.56 3ngj h THR 161 Ca 0.00 -1.74 -0.11 0.00 -0.55 0.00 0.00 66.41 64.01 3ngj h THR 161 Cb 0.00 1.72 -0.12 0.00 -1.73 0.00 0.00 68.15 68.02 3ngj h THR 161 CO 0.00 0.54 -0.30 -1.38 -0.25 0.00 0.00 175.52 174.14 3ngj s HIS 162 N -4.05 0.46 0.00 4.73 0.00 -1.26 -5.14 115.29 110.03 3ngj s HIS 162 Ca -0.07 -0.81 0.00 0.00 -3.00 0.00 0.00 55.06 51.18 3ngj s HIS 162 Cb 0.12 -0.04 0.00 0.00 -4.00 0.00 0.00 32.58 28.65 3ngj s HIS 162 CO 0.84 -0.78 0.00 0.41 -1.00 0.00 0.00 174.74 174.21 3ngj n GLY 163 N -0.26 2.81 3.74 -1.38 0.00 -1.26 -4.47 105.19 104.36 3ngj n GLY 163 Ca -0.05 -1.26 -0.41 0.00 0.00 0.00 0.00 46.02 44.30 3ngj n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngj s ALA 164 N -2.56 3.61 0.07 4.61 0.00 -0.69 -4.82 121.76 121.97 3ngj s ALA 164 Ca 0.00 1.25 0.09 0.00 0.00 0.00 0.00 51.96 53.31 3ngj s ALA 164 Cb 0.00 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 3ngj s ALA 164 CO 0.00 -0.68 -0.26 0.95 0.00 0.00 0.00 175.76 175.78 3ngj s THR 165 N 0.17 2.10 0.40 0.00 -4.23 -1.26 -4.95 115.64 107.86 3ngj s THR 165 Ca 0.60 -1.46 0.07 0.00 -1.18 0.00 0.00 61.69 59.72 3ngj s THR 165 Cb -0.40 -1.82 0.28 0.00 1.34 0.00 0.00 72.50 71.90 3ngj s THR 165 CO 0.40 0.27 2.03 -0.65 -0.54 0.00 0.00 174.62 176.13 3ngj h PRO 166 N 4.58 0.60 -0.62 3.99 0.11 -1.96 -1.59 132.00 137.10 3ngj h PRO 166 Ca -0.47 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 3ngj h PRO 166 Cb 1.15 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.10 3ngj h PRO 166 CO 0.42 0.39 0.19 0.93 -0.21 0.00 0.00 178.00 179.73 3ngj h GLU 167 N 0.61 0.97 -0.33 1.05 3.07 -1.97 -1.00 114.58 116.98 3ngj h GLU 167 Ca 0.20 -0.21 -0.04 0.00 -0.50 0.00 0.00 59.36 58.81 3ngj h GLU 167 Cb 0.05 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.81 3ngj h GLU 167 CO -0.05 0.86 0.03 -0.44 -1.40 0.00 0.00 179.01 178.01 3ngj h ASP 168 N 0.89 0.55 -0.40 1.42 3.32 -1.84 -0.32 116.42 120.04 3ngj h ASP 168 Ca 0.20 -0.28 0.07 0.00 0.02 0.00 0.00 57.03 57.04 3ngj h ASP 168 Cb 0.30 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 39.65 3ngj h ASP 168 CO -0.01 0.69 0.05 0.58 -1.72 0.00 0.00 179.24 178.83 3ngj h VAL 169 N 0.39 0.75 -0.35 -1.35 2.07 -1.13 0.69 116.25 117.32 3ngj h VAL 169 Ca 0.10 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 3ngj h VAL 169 Cb 0.39 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 3ngj h VAL 169 CO 0.01 0.03 0.11 0.50 0.02 0.00 0.00 177.57 178.24 3ngj h LYS 170 N 0.17 0.53 -0.70 1.57 3.64 -1.06 0.56 116.57 121.27 3ngj h LYS 170 Ca 0.20 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 3ngj h LYS 170 Cb 0.25 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.96 3ngj h LYS 170 CO -0.28 0.56 0.46 1.25 -2.27 0.00 0.00 179.45 179.16 3ngj h LEU 171 N 0.41 0.79 -0.31 5.20 5.85 -0.69 0.64 115.31 127.21 3ngj h LEU 171 Ca 0.11 -0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 3ngj h LEU 171 Cb 0.24 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 3ngj h LEU 171 CO -0.00 0.57 0.05 0.24 -0.34 0.00 0.00 178.44 178.96 3ngj h MET 172 N 0.94 0.51 -0.47 1.25 2.86 -0.52 -1.92 114.93 117.57 3ngj h MET 172 Ca 0.26 -0.14 -0.12 0.00 -2.06 0.00 0.00 59.70 57.64 3ngj h MET 172 Cb -0.09 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 3ngj h MET 172 CO -0.06 0.60 -0.19 -0.22 1.06 0.00 0.00 176.91 178.10 3ngj h LYS 173 N 0.33 0.93 -0.37 1.72 1.63 -0.68 -1.68 116.57 118.45 3ngj h LYS 173 Ca 0.09 -0.37 0.01 0.00 -0.85 0.00 0.00 60.65 59.53 3ngj h LYS 173 Cb 0.34 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.91 3ngj h LYS 173 CO 0.01 1.03 0.24 -0.44 -3.45 0.00 0.00 179.45 176.84 3ngj h ASP 174 N 0.81 0.40 -0.08 4.20 3.32 -0.81 0.59 116.42 124.85 3ngj h ASP 174 Ca 0.11 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.06 3ngj h ASP 174 Cb 0.74 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.19 3ngj h ASP 174 CO 0.06 0.29 -0.31 0.74 -1.72 0.00 0.00 179.24 178.30 3ngj h THR 175 N 0.47 1.41 0.00 0.35 2.02 -0.86 -3.34 112.91 112.97 3ngj h THR 175 Ca 0.14 -1.68 0.00 0.00 0.77 0.00 0.00 66.41 65.64 3ngj h THR 175 Cb -0.02 2.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 3ngj h THR 175 CO -0.03 0.49 -0.83 -0.37 0.37 0.00 0.00 175.52 175.15 3ngj h VAL 176 N -0.13 0.00 0.00 3.16 -1.51 -1.19 -3.48 116.25 113.11 3ngj h VAL 176 Ca -0.02 -0.97 0.00 0.00 -1.23 0.00 0.00 66.70 64.49 3ngj h VAL 176 Cb 0.94 1.55 0.00 0.00 -2.13 0.00 0.00 31.29 31.65 3ngj h VAL 176 CO 0.06 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.01 3ngj n GLY 177 N 1.18 3.13 0.61 5.19 0.00 0.19 -1.24 105.19 114.24 3ngj n GLY 177 Ca 0.01 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.07 3ngj n GLY 177 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ngj n ASP 178 N 3.13 1.85 0.21 1.61 8.00 -1.26 -4.10 116.55 125.98 3ngj n ASP 178 Ca 0.00 -1.71 0.13 0.00 0.71 0.00 0.00 54.79 53.92 3ngj n ASP 178 Cb 0.00 -0.10 0.33 0.00 -0.02 0.00 0.00 41.12 41.34 3ngj n ASP 178 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3ngj h LYS 179 N 2.52 0.00 -3.53 -1.24 6.56 -1.58 -3.46 116.57 115.85 3ngj h LYS 179 Ca 0.00 0.00 -0.05 0.00 -1.06 0.00 0.00 60.65 59.54 3ngj h LYS 179 Cb 0.55 0.00 -0.11 0.00 -0.57 0.00 0.00 32.23 32.10 3ngj h LYS 179 CO 0.00 0.00 -0.10 0.00 -2.06 0.00 0.00 179.45 177.29 3ngj s ALA 180 N -3.29 -0.56 0.28 3.86 0.00 -1.25 -4.95 121.76 115.85 3ngj s ALA 180 Ca 0.06 -0.50 0.07 0.00 0.00 0.00 0.00 51.96 51.59 3ngj s ALA 180 Cb 0.07 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 24.03 3ngj s ALA 180 CO 0.62 -0.76 0.25 -0.51 0.00 0.00 0.00 175.76 175.36 3ngj s LEU 181 N -2.92 3.80 -0.11 0.00 1.43 -0.10 -4.70 118.68 116.08 3ngj s LEU 181 Ca 0.13 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 52.95 3ngj s LEU 181 Cb 0.00 -2.37 -0.02 0.00 0.03 0.00 0.00 46.19 43.84 3ngj s LEU 181 CO -0.01 -0.15 -0.14 -0.69 0.23 0.00 0.00 176.35 175.58 3ngj s VAL 182 N -2.17 2.96 -0.18 -1.59 1.01 -1.26 -1.20 120.40 117.97 3ngj s VAL 182 Ca 0.36 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 3ngj s VAL 182 Cb -0.07 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 3ngj s VAL 182 CO 0.26 0.54 -0.07 -0.75 0.00 0.00 0.00 175.10 175.08 3ngj s LYS 183 N 0.08 3.42 -0.15 2.72 2.20 0.09 -0.35 119.74 127.74 3ngj s LYS 183 Ca -0.06 -0.63 -0.13 0.00 -0.36 0.00 0.00 55.97 54.79 3ngj s LYS 183 Cb -0.15 -2.86 -0.05 0.00 -1.51 0.00 0.00 37.83 33.27 3ngj s LYS 183 CO 0.05 0.01 0.26 0.00 -0.36 0.00 0.00 175.35 175.30 3ngj s ALA 184 N 0.93 3.64 -0.02 3.13 0.00 -0.55 -1.32 121.76 127.57 3ngj s ALA 184 Ca -0.01 -0.49 -0.13 0.00 0.00 0.00 0.00 51.96 51.33 3ngj s ALA 184 Cb -0.15 -2.32 0.02 0.00 0.00 0.00 0.00 23.12 20.68 3ngj s ALA 184 CO 0.00 0.19 0.28 0.00 0.00 0.00 0.00 175.76 176.23 3ngj s ALA 185 N 0.18 -0.71 0.00 0.00 0.00 -1.26 -0.23 121.76 119.73 3ngj s ALA 185 Ca 0.16 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.43 3ngj s ALA 185 Cb -0.13 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.01 3ngj s ALA 185 CO 0.04 -0.24 0.00 0.41 0.00 0.00 0.00 175.76 175.97 3ngj n GLY 186 N 1.46 0.67 2.10 0.00 0.00 -1.24 -1.92 105.19 106.25 3ngj n GLY 186 Ca -0.21 -1.03 -0.01 0.00 0.00 0.00 0.00 46.02 44.77 3ngj n GLY 186 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ngj n GLY 187 N 2.81 0.52 3.47 -0.02 0.00 -1.26 -1.70 105.19 109.01 3ngj n GLY 187 Ca 0.00 -0.53 -0.43 0.00 0.00 0.00 0.00 46.02 45.05 3ngj n GLY 187 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ngj s ILE 188 N -2.00 4.85 -0.01 -0.61 1.01 -1.26 -4.88 121.20 118.30 3ngj s ILE 188 Ca 0.00 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 60.39 3ngj s ILE 188 Cb 0.00 -4.28 -0.09 0.00 0.01 0.00 0.00 42.46 38.10 3ngj s ILE 188 CO 0.00 -0.75 0.13 0.54 0.00 0.00 0.00 174.94 174.85 3ngj n ARG 189 N 6.22 0.33 -4.20 2.79 1.74 -1.26 -4.54 116.66 117.74 3ngj n ARG 189 Ca -0.05 -0.05 -0.12 0.00 -0.77 0.00 0.00 57.85 56.86 3ngj n ARG 189 Cb 0.46 -1.15 -0.10 0.00 -1.02 0.00 0.00 32.46 30.66 3ngj n ARG 189 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3ngj s THR 190 N -2.41 0.76 0.21 0.55 -4.23 -1.26 -4.40 115.64 104.86 3ngj s THR 190 Ca -0.02 -1.96 -0.09 0.00 -1.18 0.00 0.00 61.69 58.43 3ngj s THR 190 Cb 0.04 -1.80 0.17 0.00 1.34 0.00 0.00 72.50 72.25 3ngj s THR 190 CO 0.25 -0.77 1.71 0.15 -0.54 0.00 0.00 174.62 175.42 3ngj h PHE 191 N 2.88 0.22 -0.61 3.99 3.57 -1.80 -1.19 116.94 124.00 3ngj h PHE 191 Ca -0.36 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.12 3ngj h PHE 191 Cb 1.18 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.89 3ngj h PHE 191 CO 0.59 -0.03 0.13 -0.44 -2.23 0.00 0.00 178.31 176.33 3ngj h ASP 192 N 0.27 0.92 0.03 0.41 3.32 -1.92 -0.85 116.42 118.59 3ngj h ASP 192 Ca 0.33 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.19 3ngj h ASP 192 Cb 0.49 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3ngj h ASP 192 CO -0.41 0.90 -0.01 0.44 -1.72 0.00 0.00 179.24 178.44 3ngj h ASP 193 N 0.92 -0.03 -0.45 6.45 3.32 -1.84 -1.44 116.42 123.35 3ngj h ASP 193 Ca 0.19 -0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.23 3ngj h ASP 193 Cb 0.36 0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 3ngj h ASP 193 CO 0.00 0.00 0.29 0.00 -1.72 0.00 0.00 179.24 177.81 3ngj h ALA 194 N 0.92 0.57 -0.77 3.45 0.00 -0.93 -2.32 119.26 120.17 3ngj h ALA 194 Ca -0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3ngj h ALA 194 Cb 0.05 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3ngj h ALA 194 CO 0.01 -0.01 0.41 0.52 0.00 0.00 0.00 179.25 180.18 3ngj h MET 195 N 0.58 1.07 -0.88 0.00 2.86 -0.97 -0.56 114.93 117.03 3ngj h MET 195 Ca 0.17 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 3ngj h MET 195 Cb -0.04 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 31.37 3ngj h MET 195 CO -0.05 0.79 0.54 0.87 1.06 0.00 0.00 176.91 180.12 3ngj h LYS 196 N 1.07 1.20 -0.15 1.72 1.57 -0.84 0.20 116.57 121.35 3ngj h LYS 196 Ca 0.27 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.91 3ngj h LYS 196 Cb 0.04 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 3ngj h LYS 196 CO -0.04 0.84 -0.03 0.52 -0.57 0.00 0.00 179.45 180.16 3ngj h MET 197 N 1.22 0.28 -0.74 3.15 2.86 -0.90 -2.54 114.93 118.26 3ngj h MET 197 Ca 0.32 -0.11 0.02 0.00 -2.06 0.00 0.00 59.70 57.87 3ngj h MET 197 Cb -0.06 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.54 3ngj h MET 197 CO -0.06 0.56 0.48 0.82 1.06 0.00 0.00 176.91 179.77 3ngj h ILE 198 N -0.02 1.14 0.00 -1.22 2.04 -0.82 -1.87 117.51 116.77 3ngj h ILE 198 Ca 0.04 -0.33 0.00 0.00 1.00 0.00 0.00 64.86 65.57 3ngj h ILE 198 Cb 0.46 0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 3ngj h ILE 198 CO 0.01 0.17 0.00 0.78 0.00 0.00 0.00 178.15 179.12 3ngj h ASN 199 N 0.95 0.00 -0.28 1.72 2.35 -0.56 -1.98 115.58 117.78 3ngj h ASN 199 Ca 0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 3ngj h ASN 199 Cb -0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3ngj h ASN 199 CO -0.09 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.28 3ngj n ASN 200 N -3.00 2.81 0.00 5.81 3.02 -0.80 -4.95 115.26 118.15 3ngj n ASN 200 Ca -0.01 -1.90 0.00 0.00 -0.03 0.00 0.00 54.58 52.64 3ngj n ASN 200 Cb 0.20 -0.18 0.00 0.00 -0.61 0.00 0.00 39.78 39.19 3ngj n ASN 200 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ngj n GLY 201 N 1.37 1.21 3.73 7.41 0.00 -0.74 -3.43 105.19 114.73 3ngj n GLY 201 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3ngj n GLY 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ngj s ALA 202 N -2.00 3.37 -0.93 4.61 0.00 -0.77 -4.41 121.76 121.63 3ngj s ALA 202 Ca 0.00 0.83 0.20 0.00 0.00 0.00 0.00 51.96 52.99 3ngj s ALA 202 Cb 0.00 -3.40 -0.22 0.00 0.00 0.00 0.00 23.12 19.50 3ngj s ALA 202 CO 0.00 -0.32 0.85 0.43 0.00 0.00 0.00 175.76 176.71 3ngj n SER 203 N 3.14 0.94 -3.80 0.00 7.64 0.53 -4.45 113.62 117.61 3ngj n SER 203 Ca 0.06 -0.96 -0.12 0.00 1.01 0.00 0.00 58.87 58.86 3ngj n SER 203 Cb 0.46 1.02 -0.09 0.00 -1.01 0.00 0.00 64.21 64.59 3ngj n SER 203 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 3ngj s ARG 204 N -2.91 0.63 -0.12 1.43 6.06 -1.11 -4.68 118.95 118.25 3ngj s ARG 204 Ca 0.07 -0.32 0.00 0.00 -2.50 0.00 0.00 55.73 52.99 3ngj s ARG 204 Cb 0.15 0.27 0.02 0.00 0.06 0.00 0.00 34.95 35.46 3ngj s ARG 204 CO 0.83 -0.17 -0.11 0.42 -2.50 0.00 0.00 175.30 173.77 3ngj s ILE 205 N -1.55 1.25 -0.19 4.11 -1.09 0.11 -1.49 121.20 122.35 3ngj s ILE 205 Ca -0.13 -0.44 -0.15 0.00 -2.23 0.00 0.00 60.65 57.70 3ngj s ILE 205 Cb -0.05 -1.21 -0.04 0.00 -1.58 0.00 0.00 42.46 39.58 3ngj s ILE 205 CO 0.02 0.40 0.35 -0.83 -1.23 0.00 0.00 174.94 173.66 3ngj s GLY 206 N 1.48 2.12 -0.02 6.18 0.00 0.68 -0.95 107.32 116.81 3ngj s GLY 206 Ca 0.02 -0.53 -0.29 0.00 0.00 0.00 0.00 44.72 43.93 3ngj s GLY 206 CO -0.07 0.68 0.64 0.00 0.00 0.00 0.00 173.10 174.35 3ngj s ALA 207 N 1.05 -1.67 -0.25 3.20 0.00 -1.06 -3.71 121.76 119.33 3ngj s ALA 207 Ca 0.18 1.14 0.21 0.00 0.00 0.00 0.00 51.96 53.48 3ngj s ALA 207 Cb -0.14 0.11 0.05 0.00 0.00 0.00 0.00 23.12 23.14 3ngj s ALA 207 CO 0.07 -0.41 1.16 0.66 0.00 0.00 0.00 175.76 177.24 3ngj h SER 208 N 2.95 0.00 -0.65 0.00 4.64 -1.84 -0.97 113.55 117.67 3ngj h SER 208 Ca -0.28 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.70 3ngj h SER 208 Cb 1.16 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.05 3ngj h SER 208 CO 0.39 0.16 0.43 0.00 -0.87 0.00 0.00 176.83 176.95 3ngj n ALA 209 N -2.21 4.53 -0.34 5.18 0.00 -1.26 -4.67 120.51 121.74 3ngj n ALA 209 Ca -0.01 -1.89 0.09 0.00 0.00 0.00 0.00 53.44 51.63 3ngj n ALA 209 Cb 0.62 -1.29 0.29 0.00 0.00 0.00 0.00 19.45 19.07 3ngj n ALA 209 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3ngj h GLY 210 N 2.04 1.58 0.94 0.00 0.00 -1.90 -0.99 103.07 104.74 3ngj h GLY 210 Ca 0.42 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 47.36 3ngj h GLY 210 CO 0.72 0.10 -0.02 -2.22 0.00 0.00 0.00 176.54 175.12 3ngj h ILE 211 N 0.88 1.00 -0.97 2.60 2.04 -1.97 -0.22 117.51 120.88 3ngj h ILE 211 Ca 0.51 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 66.23 3ngj h ILE 211 Cb 0.63 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 3ngj h ILE 211 CO -0.28 0.04 0.62 0.00 0.00 0.00 0.00 178.15 178.53 3ngj h ALA 212 N 0.82 1.24 0.31 1.87 0.00 -1.70 -0.60 119.26 121.20 3ngj h ALA 212 Ca -0.01 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3ngj h ALA 212 Cb 0.11 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.51 3ngj h ALA 212 CO 0.01 0.65 -0.15 0.82 0.00 0.00 0.00 179.25 180.58 3ngj h ILE 213 N 1.33 0.71 -0.89 0.00 2.04 -1.04 -1.13 117.51 118.53 3ngj h ILE 213 Ca 0.35 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 66.02 3ngj h ILE 213 Cb -0.12 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 3ngj h ILE 213 CO -0.07 0.04 0.48 0.25 0.00 0.00 0.00 178.15 178.85 3ngj h LEU 214 N -0.51 1.12 0.00 1.44 5.85 -0.90 -2.62 115.31 119.69 3ngj h LEU 214 Ca -0.04 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.57 3ngj h LEU 214 Cb 0.38 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.13 3ngj h LEU 214 CO 0.07 0.90 0.00 0.59 -0.34 0.00 0.00 178.44 179.66 3ngj n ASN 215 N -4.33 0.00 -0.46 1.25 3.02 -0.24 -3.14 115.26 111.36 3ngj n ASN 215 Ca 0.09 0.31 0.14 0.00 -0.03 0.00 0.00 54.58 55.09 3ngj n ASN 215 Cb 0.10 -0.43 0.49 0.00 -0.61 0.00 0.00 39.78 39.33 3ngj n ASN 215 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ngj n GLY 216 N 1.21 -0.06 3.66 7.41 0.00 -0.44 -4.97 105.19 112.00 3ngj n GLY 216 Ca 0.09 -0.45 -0.46 0.00 0.00 0.00 0.00 46.02 45.20 3ngj n GLY 216 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ngj n ILE 217 N 0.08 0.65 -1.18 -0.61 5.41 -1.19 -4.80 119.36 117.73 3ngj n ILE 217 Ca 0.18 -0.16 0.00 0.00 1.00 0.00 0.00 62.75 63.76 3ngj n ILE 217 Cb 0.36 -1.39 0.00 0.00 -0.71 0.00 0.00 39.64 37.90 3ngj n ILE 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55