#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f0r n LEU 14 N 0.00 0.14 -4.56 1.04 4.77 -1.26 -4.77 117.00 112.36 3f0r n LEU 14 Ca 0.00 0.00 -0.47 0.00 -0.03 0.00 0.00 56.01 55.51 3f0r n LEU 14 Cb 0.00 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 3f0r n LEU 14 CO 0.00 -0.27 1.74 0.55 -1.33 0.00 0.00 177.39 178.08 3f0r n VAL 15 N -2.55 0.36 -2.27 4.08 3.14 -1.26 -4.83 118.33 114.99 3f0r n VAL 15 Ca 0.00 -0.29 -0.38 0.00 -2.96 0.00 0.00 64.34 60.71 3f0r n VAL 15 Cb 0.17 -2.05 -0.02 0.00 -1.06 0.00 0.00 33.84 30.88 3f0r n VAL 15 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 3f0r s PRO 16 N 5.70 3.97 0.07 1.45 0.04 -1.26 -4.67 135.00 140.30 3f0r s PRO 16 Ca 1.02 1.83 -0.29 0.00 0.04 0.00 0.00 61.00 63.60 3f0r s PRO 16 Cb -0.62 -2.61 -0.05 0.00 0.04 0.00 0.00 34.50 31.27 3f0r s PRO 16 CO 0.45 -0.39 0.93 0.08 0.04 0.00 0.00 177.00 178.11 3f0r s VAL 17 N -1.44 4.64 -0.34 -0.36 1.01 -0.38 -1.87 120.40 121.66 3f0r s VAL 17 Ca 0.59 1.99 0.02 0.00 0.00 0.00 0.00 61.98 64.58 3f0r s VAL 17 Cb -0.30 -4.29 0.10 0.00 0.00 0.00 0.00 36.38 31.88 3f0r s VAL 17 CO 0.38 0.28 0.06 -0.47 0.00 0.00 0.00 175.10 175.35 3f0r s TYR 18 N 0.28 3.65 -0.31 5.22 5.04 -0.52 -1.19 117.35 129.53 3f0r s TYR 18 Ca 0.47 -2.75 -0.28 0.00 -2.44 0.00 0.00 57.07 52.07 3f0r s TYR 18 Cb -0.22 -2.84 -0.03 0.00 0.35 0.00 0.00 41.96 39.22 3f0r s TYR 18 CO 0.28 -0.94 1.92 0.42 -1.34 0.00 0.00 175.55 175.89 3f0r s ILE 19 N 0.99 3.35 -0.04 3.14 -1.09 -0.40 -2.30 121.20 124.85 3f0r s ILE 19 Ca 0.07 0.35 -0.30 0.00 -2.23 0.00 0.00 60.65 58.55 3f0r s ILE 19 Cb -0.20 -3.48 0.08 0.00 -1.58 0.00 0.00 42.46 37.29 3f0r s ILE 19 CO -0.06 -0.31 0.75 -0.47 -1.23 0.00 0.00 174.94 173.61 3f0r s TYR 20 N 7.37 -0.56 -0.18 3.97 5.04 -0.63 -4.80 117.35 127.56 3f0r s TYR 20 Ca 0.85 0.86 -0.28 0.00 -2.44 0.00 0.00 57.07 56.06 3f0r s TYR 20 Cb -0.25 0.45 0.09 0.00 0.35 0.00 0.00 41.96 42.59 3f0r s TYR 20 CO 0.34 -0.58 0.79 -1.54 -1.34 0.00 0.00 175.55 173.21 3f0r s SER 21 N -1.47 -0.62 0.30 4.32 1.04 -1.26 -2.86 113.70 113.15 3f0r s SER 21 Ca -0.06 0.96 -0.01 0.00 0.48 0.00 0.00 55.95 57.32 3f0r s SER 21 Cb -0.00 0.90 0.49 0.00 0.10 0.00 0.00 66.02 67.51 3f0r s SER 21 CO 0.04 -0.37 1.95 1.55 0.98 0.00 0.00 173.24 177.38 3f0r h PRO 22 N 3.85 1.03 -0.70 4.02 0.13 -2.01 -1.75 132.00 136.57 3f0r h PRO 22 Ca -0.27 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 64.74 3f0r h PRO 22 Cb 1.16 -0.23 -0.03 0.00 0.13 0.00 0.00 31.00 32.02 3f0r h PRO 22 CO 0.21 0.68 0.18 0.93 -0.23 0.00 0.00 178.00 179.78 3f0r h GLU 23 N 1.06 1.11 -0.25 0.86 3.07 -1.97 0.83 114.58 119.29 3f0r h GLU 23 Ca 0.33 -0.26 -0.00 0.00 -0.50 0.00 0.00 59.36 58.93 3f0r h GLU 23 Cb 0.01 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.76 3f0r h GLU 23 CO -0.10 0.98 0.14 -0.92 -1.40 0.00 0.00 179.01 177.71 3f0r h TYR 24 N 1.05 0.34 -0.33 4.33 3.20 -1.80 0.59 116.97 124.35 3f0r h TYR 24 Ca 0.22 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.08 3f0r h TYR 24 Cb 0.35 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 3f0r h TYR 24 CO 0.03 0.27 0.17 0.28 -1.64 0.00 0.00 178.16 177.27 3f0r h VAL 25 N 0.30 1.14 -0.78 1.81 2.07 -1.10 -1.17 116.25 118.52 3f0r h VAL 25 Ca 0.09 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.28 3f0r h VAL 25 Cb 0.04 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 3f0r h VAL 25 CO -0.02 0.14 0.51 -1.28 0.02 0.00 0.00 177.57 176.95 3f0r h SER 26 N 0.40 0.77 0.28 0.57 0.87 -0.43 -1.75 113.55 114.28 3f0r h SER 26 Ca 0.11 -0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.55 3f0r h SER 26 Cb 0.07 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 3f0r h SER 26 CO -0.02 0.51 -0.48 -0.03 -0.53 0.00 0.00 176.83 176.28 3f0r h MET 27 N 0.89 0.24 0.00 2.24 -1.53 0.87 -2.78 114.93 114.85 3f0r h MET 27 Ca 0.32 -0.13 0.00 0.00 -3.44 0.00 0.00 59.70 56.45 3f0r h MET 27 Cb 0.15 0.01 0.00 0.00 -0.55 0.00 0.00 31.60 31.21 3f0r h MET 27 CO -0.11 0.68 0.00 0.00 0.14 0.00 0.00 176.91 177.62 3f0r n ASP 29 N -3.05 3.93 -0.88 0.00 8.00 -0.74 -4.60 116.55 119.20 3f0r n ASP 29 Ca 0.03 -3.44 0.04 0.00 0.71 0.00 0.00 54.79 52.14 3f0r n ASP 29 Cb 0.47 -0.73 0.22 0.00 -0.02 0.00 0.00 41.12 41.06 3f0r n ASP 29 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3f0r n SER 30 N -0.70 3.18 -4.64 -2.24 3.41 -1.07 -4.85 113.62 106.71 3f0r n SER 30 Ca 0.43 -3.30 -0.23 0.00 -0.26 0.00 0.00 58.87 55.51 3f0r n SER 30 Cb 1.36 -0.56 -0.07 0.00 -0.26 0.00 0.00 64.21 64.67 3f0r n SER 30 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3f0r s LEU 31 N -2.99 3.13 0.28 1.04 1.43 -1.26 -4.86 118.68 115.45 3f0r s LEU 31 Ca 0.42 -0.72 -0.29 0.00 -1.03 0.00 0.00 54.13 52.51 3f0r s LEU 31 Cb 0.36 -1.63 -0.10 0.00 0.03 0.00 0.00 46.19 44.84 3f0r s LEU 31 CO 0.05 -0.04 1.41 0.00 0.23 0.00 0.00 176.35 177.99 3f0r s ALA 32 N -2.37 3.59 0.00 4.21 0.00 -1.26 -3.78 121.76 122.15 3f0r s ALA 32 Ca 0.32 1.33 0.00 0.00 0.00 0.00 0.00 51.96 53.61 3f0r s ALA 32 Cb -0.05 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.53 3f0r s ALA 32 CO 0.20 -0.74 0.00 0.36 0.00 0.00 0.00 175.76 175.57 3f0r n LYS 33 N 1.73 0.00 -2.86 0.00 2.85 -1.26 -4.83 118.16 113.79 3f0r n LYS 33 Ca 0.04 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 56.87 3f0r n LYS 33 Cb 0.41 -4.01 -0.04 0.00 -0.65 0.00 0.00 35.03 30.73 3f0r n LYS 33 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 177.40 178.31 3f0r s ILE 34 N -1.31 4.33 0.26 0.58 -5.25 -1.25 -5.03 121.20 113.54 3f0r s ILE 34 Ca 0.00 -0.34 -0.26 0.00 -0.99 0.00 0.00 60.65 59.06 3f0r s ILE 34 Cb 0.00 -4.68 -0.16 0.00 2.95 0.00 0.00 42.46 40.57 3f0r s ILE 34 CO 0.00 -1.45 0.38 -0.81 -1.79 0.00 0.00 174.94 171.28 3f0r n PRO 35 N 7.69 0.00 -0.50 0.37 -0.04 -1.26 -4.71 135.00 136.55 3f0r n PRO 35 Ca -0.04 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.32 3f0r n PRO 35 Cb 0.45 -0.99 -0.05 0.00 -0.04 0.00 0.00 33.50 32.87 3f0r n PRO 35 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 3f0r n LYS 36 N 1.10 1.20 -0.22 0.54 4.76 -1.26 -4.61 118.16 119.67 3f0r n LYS 36 Ca 0.16 -0.77 -0.07 0.00 -2.87 0.00 0.00 58.31 54.76 3f0r n LYS 36 Cb 0.30 -1.98 0.04 0.00 -1.84 0.00 0.00 35.03 31.54 3f0r n LYS 36 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 3f0r h ARG 37 N 5.47 0.91 -0.61 1.97 2.43 -1.90 -3.22 114.38 119.44 3f0r h ARG 37 Ca 0.21 -0.14 0.12 0.00 -0.81 0.00 0.00 59.98 59.36 3f0r h ARG 37 Cb 0.45 -0.16 -0.09 0.00 -0.42 0.00 0.00 29.97 29.75 3f0r h ARG 37 CO 0.77 0.74 0.08 0.00 -1.51 0.00 0.00 179.97 180.04 3f0r h ALA 38 N 1.13 0.68 -0.35 2.80 0.00 -1.86 -1.17 119.26 120.48 3f0r h ALA 38 Ca 0.21 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 3f0r h ALA 38 Cb 0.13 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3f0r h ALA 38 CO -0.03 -0.35 0.17 1.03 0.00 0.00 0.00 179.25 180.08 3f0r h SER 39 N 0.19 0.45 -0.13 0.00 0.87 -1.81 -2.12 113.55 111.02 3f0r h SER 39 Ca 0.32 -0.12 0.04 0.00 -1.23 0.00 0.00 61.79 60.81 3f0r h SER 39 Cb 0.51 -0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 62.30 3f0r h SER 39 CO -0.46 0.44 -0.17 0.24 -0.53 0.00 0.00 176.83 176.35 3f0r h MET 40 N 0.43 -0.21 -0.41 2.24 2.07 -1.38 0.37 114.93 118.04 3f0r h MET 40 Ca 0.12 0.01 0.04 0.00 -2.07 0.00 0.00 59.70 57.81 3f0r h MET 40 Cb 0.11 0.05 -0.04 0.00 -1.87 0.00 0.00 31.60 29.84 3f0r h MET 40 CO -0.02 -0.14 0.17 0.28 1.07 0.00 0.00 176.91 178.27 3f0r h VAL 41 N -0.22 0.91 -0.17 -2.22 2.07 -1.09 0.70 116.25 116.24 3f0r h VAL 41 Ca 0.10 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 3f0r h VAL 41 Cb 0.36 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 3f0r h VAL 41 CO -0.25 0.06 0.01 -0.74 0.02 0.00 0.00 177.57 176.67 3f0r h HIS 42 N 0.35 0.31 -0.41 1.57 6.17 -1.10 -2.35 115.15 119.70 3f0r h HIS 42 Ca 0.18 -0.05 0.08 0.00 0.71 0.00 0.00 60.37 61.30 3f0r h HIS 42 Cb 0.14 -0.08 -0.09 0.00 2.52 0.00 0.00 27.41 29.90 3f0r h HIS 42 CO -0.13 0.49 -0.26 1.03 0.71 0.00 0.00 177.93 179.77 3f0r h SER 43 N 0.05 -0.88 -0.01 3.26 0.87 0.18 0.14 113.55 117.16 3f0r h SER 43 Ca 0.05 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 3f0r h SER 43 Cb 0.36 0.44 -0.00 0.00 -0.44 0.00 0.00 62.40 62.75 3f0r h SER 43 CO 0.01 -0.28 0.00 0.25 -0.53 0.00 0.00 176.83 176.28 3f0r h LEU 44 N -0.19 0.01 -1.43 2.23 5.85 -0.84 0.37 115.31 121.30 3f0r h LEU 44 Ca 0.19 -0.00 0.12 0.00 0.84 0.00 0.00 57.88 59.03 3f0r h LEU 44 Cb 0.49 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 3f0r h LEU 44 CO -0.52 0.01 0.52 0.40 -0.34 0.00 0.00 178.44 178.51 3f0r h ILE 45 N 0.01 0.87 -0.27 4.05 2.04 -0.82 0.15 117.51 123.53 3f0r h ILE 45 Ca 0.00 -0.20 -0.18 0.00 1.00 0.00 0.00 64.86 65.48 3f0r h ILE 45 Cb -0.00 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.30 3f0r h ILE 45 CO -0.00 0.11 -0.55 -0.08 0.00 0.00 0.00 178.15 177.63 3f0r h GLU 46 N 0.59 0.84 -0.54 2.37 4.81 0.16 -1.73 114.58 121.09 3f0r h GLU 46 Ca 0.38 -0.55 0.12 0.00 -0.13 0.00 0.00 59.36 59.18 3f0r h GLU 46 Cb 0.65 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 3f0r h GLU 46 CO -0.14 1.18 0.37 0.00 -0.73 0.00 0.00 179.01 179.69 3f0r h ALA 47 N 0.66 2.25 -0.25 2.92 0.00 0.25 0.72 119.26 125.81 3f0r h ALA 47 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3f0r h ALA 47 Cb 1.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3f0r h ALA 47 CO 0.12 -0.38 0.00 0.66 0.00 0.00 0.00 179.25 179.65 3f0r n TYR 48 N -4.44 0.31 -3.85 0.00 4.02 -0.70 -4.86 117.16 107.65 3f0r n TYR 48 Ca 0.09 -0.16 -0.26 0.00 -0.01 0.00 0.00 57.90 57.56 3f0r n TYR 48 Cb 0.47 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.81 3f0r n TYR 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3f0r n ALA 49 N 0.72 -1.66 0.05 -0.72 0.00 0.25 -4.89 120.51 114.26 3f0r n ALA 49 Ca 0.17 -0.01 -0.06 0.00 0.00 0.00 0.00 53.44 53.54 3f0r n ALA 49 Cb 0.42 -3.09 -0.11 0.00 0.00 0.00 0.00 19.45 16.67 3f0r n ALA 49 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3f0r h LEU 50 N -1.95 0.00 -1.70 0.00 4.07 -1.53 -3.29 115.31 110.91 3f0r h LEU 50 Ca -0.60 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.32 3f0r h LEU 50 Cb 1.37 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.10 3f0r h LEU 50 CO 0.63 0.93 -0.18 1.12 -1.08 0.00 0.00 178.44 179.86 3f0r h HIS 51 N 0.00 0.00 0.00 1.13 2.07 -1.91 -1.94 115.15 114.50 3f0r h HIS 51 Ca -0.08 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.44 3f0r h HIS 51 Cb 1.78 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.76 3f0r h HIS 51 CO 0.00 0.18 0.00 1.63 -3.07 0.00 0.00 177.93 176.67 3f0r n LYS 52 N -4.06 0.06 -0.01 5.12 5.02 -1.24 -0.97 118.16 122.07 3f0r n LYS 52 Ca -0.02 0.27 0.01 0.00 -2.02 0.00 0.00 58.31 56.55 3f0r n LYS 52 Cb 0.26 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 33.78 3f0r n LYS 52 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3f0r n GLN 53 N -1.33 2.64 -4.34 1.97 6.02 -0.73 -5.03 117.38 116.59 3f0r n GLN 53 Ca 0.02 -1.55 -0.18 0.00 -0.01 0.00 0.00 57.00 55.28 3f0r n GLN 53 Cb 0.04 -1.02 -0.10 0.00 1.02 0.00 0.00 30.24 30.18 3f0r n GLN 53 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 3f0r s MET 54 N -1.13 1.32 -0.75 -1.09 -1.94 -0.15 -4.45 119.30 111.12 3f0r s MET 54 Ca 0.03 -1.63 -0.19 0.00 -1.71 0.00 0.00 55.69 52.20 3f0r s MET 54 Cb 0.03 -0.89 0.12 0.00 2.01 0.00 0.00 34.83 36.11 3f0r s MET 54 CO 0.00 0.05 0.90 1.03 -0.01 0.00 0.00 175.02 177.00 3f0r s ARG 55 N -3.74 3.32 0.32 2.03 0.52 -0.78 -4.86 118.95 115.76 3f0r s ARG 55 Ca 0.24 -1.54 -0.29 0.00 -0.52 0.00 0.00 55.73 53.62 3f0r s ARG 55 Cb 0.03 -4.50 -0.11 0.00 0.52 0.00 0.00 34.95 30.89 3f0r s ARG 55 CO 0.07 -1.64 1.41 0.42 0.02 0.00 0.00 175.30 175.59 3f0r s ILE 56 N 2.59 2.46 -0.16 1.52 1.01 -1.26 -1.43 121.20 125.93 3f0r s ILE 56 Ca 0.21 0.44 -0.04 0.00 0.00 0.00 0.00 60.65 61.26 3f0r s ILE 56 Cb -0.14 -3.28 0.08 0.00 0.01 0.00 0.00 42.46 39.13 3f0r s ILE 56 CO -0.01 0.09 0.27 -0.69 0.00 0.00 0.00 174.94 174.60 3f0r s VAL 57 N -0.75 -0.42 0.25 2.92 1.01 -0.97 -4.90 120.40 117.54 3f0r s VAL 57 Ca 0.54 0.14 -0.31 0.00 0.00 0.00 0.00 61.98 62.35 3f0r s VAL 57 Cb -0.43 -0.55 -0.12 0.00 0.00 0.00 0.00 36.38 35.29 3f0r s VAL 57 CO 0.53 0.01 1.66 -0.54 0.00 0.00 0.00 175.10 176.76 3f0r s LYS 58 N 2.41 4.12 0.90 2.72 1.02 -1.13 -1.61 119.74 128.16 3f0r s LYS 58 Ca 0.04 2.60 -0.10 0.00 0.02 0.00 0.00 55.97 58.53 3f0r s LYS 58 Cb -0.13 -3.05 0.13 0.00 -0.52 0.00 0.00 37.83 34.26 3f0r s LYS 58 CO -0.10 -0.70 1.14 -2.14 -0.92 0.00 0.00 175.35 172.63 3f0r s PRO 59 N 0.32 1.18 -0.42 -1.68 0.02 -1.26 -4.89 135.00 128.27 3f0r s PRO 59 Ca 0.69 1.49 0.02 0.00 0.02 0.00 0.00 61.00 63.22 3f0r s PRO 59 Cb -0.49 -1.75 0.11 0.00 0.02 0.00 0.00 34.50 32.39 3f0r s PRO 59 CO 0.40 -2.50 0.16 0.15 -0.33 0.00 0.00 177.00 174.88 3f0r s LYS 60 N -4.69 1.79 -0.07 5.54 1.02 -1.26 -4.92 119.74 117.15 3f0r s LYS 60 Ca 0.66 -2.08 -0.40 0.00 0.02 0.00 0.00 55.97 54.17 3f0r s LYS 60 Cb -0.22 -3.36 -0.19 0.00 -0.52 0.00 0.00 37.83 33.54 3f0r s LYS 60 CO 0.58 -1.02 1.21 0.28 -0.92 0.00 0.00 175.35 175.47 3f0r n VAL 61 N 4.02 0.01 -1.43 3.17 0.31 -1.26 -4.18 118.33 118.97 3f0r n VAL 61 Ca 0.03 -0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 64.01 3f0r n VAL 61 Cb 0.39 -0.24 0.10 0.00 -0.91 0.00 0.00 33.84 33.18 3f0r n VAL 61 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3f0r s ALA 62 N 0.62 2.11 0.23 3.52 0.00 -0.98 -4.87 121.76 122.40 3f0r s ALA 62 Ca 0.92 0.98 -0.03 0.00 0.00 0.00 0.00 51.96 53.83 3f0r s ALA 62 Cb -1.25 -3.51 -0.05 0.00 0.00 0.00 0.00 23.12 18.32 3f0r s ALA 62 CO 0.59 -1.92 0.46 -1.54 0.00 0.00 0.00 175.76 173.35 3f0r s SER 63 N -1.86 6.42 0.48 0.00 1.04 -1.26 -4.95 113.70 113.58 3f0r s SER 63 Ca 0.77 0.55 0.23 0.00 0.48 0.00 0.00 55.95 57.98 3f0r s SER 63 Cb -0.32 -2.07 1.27 0.00 0.10 0.00 0.00 66.02 65.00 3f0r s SER 63 CO 0.45 -0.10 1.91 -0.03 0.98 0.00 0.00 173.24 176.45 3f0r h MET 64 N 1.94 0.19 0.13 4.02 4.05 -1.99 -0.20 114.93 123.08 3f0r h MET 64 Ca -0.48 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 58.93 3f0r h MET 64 Cb 1.19 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.95 3f0r h MET 64 CO 0.68 0.13 -0.06 0.93 0.23 0.00 0.00 176.91 178.81 3f0r h GLU 65 N 0.20 -0.17 -0.47 0.39 5.08 -1.98 -1.97 114.58 115.65 3f0r h GLU 65 Ca 0.39 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.74 3f0r h GLU 65 Cb 1.25 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.51 3f0r h GLU 65 CO -0.08 -0.01 0.21 0.93 -1.00 0.00 0.00 179.01 179.06 3f0r h GLU 66 N -0.30 0.69 0.00 2.33 5.08 -1.45 -2.74 114.58 118.19 3f0r h GLU 66 Ca -0.02 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.16 3f0r h GLU 66 Cb 0.24 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3f0r h GLU 66 CO 0.03 0.60 -0.35 0.52 -1.00 0.00 0.00 179.01 178.81 3f0r h MET 67 N 0.62 0.00 0.00 2.33 2.86 -1.33 -1.95 114.93 117.46 3f0r h MET 67 Ca 0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.80 3f0r h MET 67 Cb 0.15 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.81 3f0r h MET 67 CO -0.02 0.35 0.00 0.00 1.06 0.00 0.00 176.91 178.31 3f0r n ALA 68 N -2.47 1.90 0.33 6.32 0.00 -0.74 -1.53 120.51 124.31 3f0r n ALA 68 Ca -0.02 -0.07 0.22 0.00 0.00 0.00 0.00 53.44 53.57 3f0r n ALA 68 Cb 0.39 -1.29 1.17 0.00 0.00 0.00 0.00 19.45 19.73 3f0r n ALA 68 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3f0r h THR 69 N 0.00 0.00 0.00 0.00 2.02 -1.27 -3.32 112.91 110.34 3f0r h THR 69 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 3f0r h THR 69 Cb 0.23 0.99 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3f0r h THR 69 CO 0.00 0.00 -0.13 0.33 0.37 0.00 0.00 175.52 176.09 3f0r n PHE 70 N -3.04 0.00 -3.10 3.16 7.35 -1.15 -5.08 117.46 115.60 3f0r n PHE 70 Ca -0.03 0.00 -0.39 0.00 -0.76 0.00 0.00 57.45 56.27 3f0r n PHE 70 Cb 0.08 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 39.86 3f0r n PHE 70 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 3f0r s HIS 71 N -1.13 3.64 0.57 -5.13 3.76 -0.58 -4.50 115.29 111.91 3f0r s HIS 71 Ca 0.00 1.25 -0.21 0.00 -0.15 0.00 0.00 55.06 55.95 3f0r s HIS 71 Cb 0.00 -2.73 -0.04 0.00 1.11 0.00 0.00 32.58 30.92 3f0r s HIS 71 CO 0.00 0.21 1.32 0.95 -0.85 0.00 0.00 174.74 176.37 3f0r s THR 72 N 0.31 2.17 0.42 1.30 -4.23 -0.81 -4.12 115.64 110.67 3f0r s THR 72 Ca 0.35 0.12 0.17 0.00 -1.18 0.00 0.00 61.69 61.15 3f0r s THR 72 Cb -0.18 -3.06 0.19 0.00 1.34 0.00 0.00 72.50 70.79 3f0r s THR 72 CO 0.18 -0.01 1.96 0.44 -0.54 0.00 0.00 174.62 176.66 3f0r h ASP 73 N 1.22 0.00 -0.27 3.99 5.19 -1.92 -2.05 116.42 122.57 3f0r h ASP 73 Ca -0.51 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 55.92 3f0r h ASP 73 Cb 1.31 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 40.80 3f0r h ASP 73 CO 0.56 0.22 0.15 0.00 -3.12 0.00 0.00 179.24 177.05 3f0r h ALA 74 N 1.78 0.33 -0.34 3.45 0.00 -1.97 -1.28 119.26 121.23 3f0r h ALA 74 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 3f0r h ALA 74 Cb 0.42 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3f0r h ALA 74 CO 0.03 -0.24 -0.32 -0.92 0.00 0.00 0.00 179.25 177.80 3f0r h TYR 75 N 0.31 0.98 0.00 0.00 3.20 -1.79 -2.31 116.97 117.36 3f0r h TYR 75 Ca 0.11 -0.29 -0.03 0.00 3.14 0.00 0.00 58.73 61.66 3f0r h TYR 75 Cb 0.01 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.07 3f0r h TYR 75 CO -0.09 1.07 -0.15 -0.07 -1.64 0.00 0.00 178.16 177.29 3f0r h LEU 76 N 0.60 0.00 0.15 2.82 3.38 -1.20 -0.99 115.31 120.07 3f0r h LEU 76 Ca 0.06 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.72 3f0r h LEU 76 Cb 0.90 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.68 3f0r h LEU 76 CO 0.08 0.15 -1.32 1.56 0.09 0.00 0.00 178.44 179.00 3f0r h GLN 77 N 0.00 0.50 -0.53 1.13 4.20 -1.13 -3.09 115.11 116.18 3f0r h GLN 77 Ca -0.00 -0.76 -0.01 0.00 0.06 0.00 0.00 58.65 57.94 3f0r h GLN 77 Cb 0.44 0.27 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 3f0r h GLN 77 CO 0.02 1.35 0.29 1.25 -0.67 0.00 0.00 178.83 181.07 3f0r h HIS 78 N 0.18 0.73 -0.89 2.96 2.76 -0.79 -2.23 115.15 117.86 3f0r h HIS 78 Ca -0.20 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 57.96 3f0r h HIS 78 Cb 2.01 -0.23 -0.04 0.00 1.55 0.00 0.00 27.41 30.69 3f0r h HIS 78 CO 0.10 0.54 0.57 -0.07 -1.30 0.00 0.00 177.93 177.78 3f0r h LEU 79 N 0.71 1.04 -1.54 0.26 3.38 -1.28 -0.87 115.31 117.01 3f0r h LEU 79 Ca 0.19 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3f0r h LEU 79 Cb 0.06 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3f0r h LEU 79 CO -0.03 0.76 0.04 1.56 0.09 0.00 0.00 178.44 180.86 3f0r h GLN 80 N 1.21 0.34 0.13 1.13 4.20 -1.34 -2.10 115.11 118.68 3f0r h GLN 80 Ca 0.32 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.98 3f0r h GLN 80 Cb -0.11 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.61 3f0r h GLN 80 CO -0.07 0.33 -0.06 0.87 -0.67 0.00 0.00 178.83 179.23 3f0r h LYS 81 N 0.33 -0.17 0.00 1.46 1.57 -0.62 -2.67 116.57 116.46 3f0r h LYS 81 Ca 0.08 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.87 3f0r h LYS 81 Cb 0.16 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 3f0r h LYS 81 CO -0.00 0.27 -0.01 -0.39 -0.57 0.00 0.00 179.45 178.75 3f0r h VAL 82 N -0.89 0.62 0.00 0.50 -1.51 -1.35 -1.20 116.25 112.42 3f0r h VAL 82 Ca -0.02 -0.06 -0.12 0.00 -1.23 0.00 0.00 66.70 65.28 3f0r h VAL 82 Cb 0.53 1.03 -0.02 0.00 -2.13 0.00 0.00 31.29 30.70 3f0r h VAL 82 CO 0.03 0.01 -0.56 -1.28 -1.23 0.00 0.00 177.57 174.54 3f0r h SER 83 N 0.00 0.00 0.32 4.19 0.87 -1.40 -3.17 113.55 114.36 3f0r h SER 83 Ca -0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 3f0r h SER 83 Cb 0.03 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.99 3f0r h SER 83 CO 0.00 0.56 -0.11 1.56 -0.53 0.00 0.00 176.83 178.31 3f0r h GLN 84 N 0.00 0.00 0.00 2.24 7.50 -0.85 -3.26 115.11 120.74 3f0r h GLN 84 Ca -0.01 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.14 3f0r h GLN 84 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.74 3f0r h GLN 84 CO 0.07 0.11 0.00 -1.91 -1.50 0.00 0.00 178.83 175.61 3f0r n GLU 85 N -3.71 0.00 -0.56 1.46 2.13 -1.20 -5.04 120.64 113.72 3f0r n GLU 85 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 3f0r n GLU 85 Cb 0.23 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.94 3f0r n GLU 85 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 3f0r n TYR 96 N 0.00 0.00 0.00 4.31 4.19 -1.26 -4.60 117.16 119.80 3f0r n TYR 96 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 3f0r n TYR 96 Cb 0.00 -0.00 0.00 0.00 0.49 0.00 0.00 39.34 39.83 3f0r n TYR 96 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 3f0r n GLY 97 N -2.56 0.87 3.72 2.98 0.00 -1.26 -3.01 105.19 105.93 3f0r n GLY 97 Ca 0.00 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 3f0r n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f0r s LEU 98 N 0.00 4.39 0.00 0.99 2.01 -1.26 -4.50 118.68 120.31 3f0r s LEU 98 Ca 0.00 2.11 0.00 0.00 0.01 0.00 0.00 54.13 56.25 3f0r s LEU 98 Cb 0.00 -3.59 0.00 0.00 0.01 0.00 0.00 46.19 42.61 3f0r s LEU 98 CO 0.00 -0.47 0.00 0.61 1.01 0.00 0.00 176.35 177.50 3f0r n GLY 99 N 3.00 1.10 0.07 -3.19 0.00 0.17 -4.99 105.19 101.35 3f0r n GLY 99 Ca 0.08 0.29 -0.08 0.00 0.00 0.00 0.00 46.02 46.32 3f0r n GLY 99 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3f0r h TYR 100 N 0.00 0.00 0.00 1.61 3.20 -1.97 -3.30 116.97 116.51 3f0r h TYR 100 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3f0r h TYR 100 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 3f0r h TYR 100 CO 0.00 0.45 0.00 -0.40 -1.64 0.00 0.00 178.16 176.57 3f0r n ASP 101 N -4.64 0.00 -3.23 -2.11 5.75 -1.26 -4.11 116.55 106.95 3f0r n ASP 101 Ca -0.10 0.09 -0.03 0.00 -0.01 0.00 0.00 54.79 54.75 3f0r n ASP 101 Cb 0.29 -0.24 -0.03 0.00 -1.03 0.00 0.00 41.12 40.11 3f0r n ASP 101 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3f0r n PRO 103 N 5.37 -1.99 -3.15 0.00 -0.02 -1.24 0.41 135.00 134.37 3f0r n PRO 103 Ca 0.03 -0.56 -0.17 0.00 -2.02 0.00 0.00 63.50 60.78 3f0r n PRO 103 Cb 0.52 -1.91 -0.02 0.00 -0.02 0.00 0.00 33.50 32.06 3f0r n PRO 103 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3f0r n ALA 104 N -4.68 1.75 -2.82 3.55 0.00 -1.26 -4.63 120.51 112.43 3f0r n ALA 104 Ca 0.02 -3.22 -0.18 0.00 0.00 0.00 0.00 53.44 50.06 3f0r n ALA 104 Cb 0.58 -0.95 0.07 0.00 0.00 0.00 0.00 19.45 19.15 3f0r n ALA 104 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3f0r n THR 105 N 0.33 0.00 -1.43 0.00 5.66 -1.26 -4.91 114.28 112.68 3f0r n THR 105 Ca 0.23 -1.34 -0.30 0.00 -3.05 0.00 0.00 64.05 59.59 3f0r n THR 105 Cb 0.66 -0.79 0.09 0.00 -1.55 0.00 0.00 70.33 68.74 3f0r n THR 105 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 3f0r s GLU 106 N -4.17 2.15 0.00 1.09 2.02 -1.26 -3.44 118.70 115.09 3f0r s GLU 106 Ca 0.47 0.86 0.00 0.00 0.02 0.00 0.00 54.97 56.32 3f0r s GLU 106 Cb -0.03 -1.91 0.00 0.00 0.10 0.00 0.00 34.13 32.29 3f0r s GLU 106 CO 0.31 -1.63 0.00 0.41 0.02 0.00 0.00 175.26 174.37 3f0r n GLY 107 N -1.70 0.69 0.31 -1.39 0.00 -1.23 -4.77 105.19 97.11 3f0r n GLY 107 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.00 3f0r n GLY 107 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3f0r h ILE 108 N 0.00 0.31 0.04 -0.61 6.09 -1.83 0.25 117.51 121.76 3f0r h ILE 108 Ca 0.00 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.49 3f0r h ILE 108 Cb 0.01 0.31 0.00 0.00 0.47 0.00 0.00 36.82 37.61 3f0r h ILE 108 CO 0.00 0.00 -0.02 0.15 -3.07 0.00 0.00 178.15 175.21 3f0r h PHE 109 N -0.32 -0.04 -0.80 2.19 3.57 -1.90 -1.13 116.94 118.50 3f0r h PHE 109 Ca 0.12 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.70 3f0r h PHE 109 Cb 0.52 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.22 3f0r h PHE 109 CO -0.43 0.28 0.52 -0.44 -2.23 0.00 0.00 178.31 176.02 3f0r h ASP 110 N -0.37 0.74 0.86 0.41 3.32 -1.91 0.21 116.42 119.68 3f0r h ASP 110 Ca -0.00 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 3f0r h ASP 110 Cb 0.34 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.75 3f0r h ASP 110 CO 0.01 0.47 -0.41 0.22 -1.72 0.00 0.00 179.24 177.80 3f0r h TYR 111 N 0.84 -1.07 -0.11 4.55 3.20 -0.35 -2.14 116.97 121.89 3f0r h TYR 111 Ca 0.35 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.24 3f0r h TYR 111 Cb 0.29 0.35 -0.06 0.00 1.54 0.00 0.00 36.73 38.86 3f0r h TYR 111 CO -0.00 -0.66 -0.29 0.00 -1.64 0.00 0.00 178.16 175.57 3f0r h ALA 112 N -1.14 -0.33 -0.71 1.82 0.00 -0.49 -2.00 119.26 116.41 3f0r h ALA 112 Ca -0.12 0.02 0.16 0.00 0.00 0.00 0.00 54.91 54.97 3f0r h ALA 112 Cb 0.89 0.55 -0.12 0.00 0.00 0.00 0.00 17.79 19.11 3f0r h ALA 112 CO 0.19 -0.77 0.06 0.00 0.00 0.00 0.00 179.25 178.73 3f0r h ALA 113 N 0.48 0.79 -0.15 0.00 0.00 -0.60 -0.21 119.26 119.56 3f0r h ALA 113 Ca 0.09 0.20 0.03 0.00 0.00 0.00 0.00 54.91 55.24 3f0r h ALA 113 Cb 0.52 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 3f0r h ALA 113 CO -0.32 -0.39 -0.03 0.00 0.00 0.00 0.00 179.25 178.51 3f0r h ALA 114 N 1.64 0.11 0.86 0.00 0.00 -0.67 0.47 119.26 121.66 3f0r h ALA 114 Ca 0.39 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.31 3f0r h ALA 114 Cb 0.67 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.57 3f0r h ALA 114 CO -0.58 -0.47 -0.41 0.82 0.00 0.00 0.00 179.25 178.61 3f0r h ILE 115 N 0.02 0.13 -0.96 0.00 1.08 -0.77 -0.26 117.51 116.75 3f0r h ILE 115 Ca 0.07 -0.05 0.21 0.00 -0.39 0.00 0.00 64.86 64.70 3f0r h ILE 115 Cb 0.11 0.14 -0.08 0.00 -3.07 0.00 0.00 36.82 33.91 3f0r h ILE 115 CO -0.15 0.00 0.62 1.23 -0.69 0.00 0.00 178.15 179.16 3f0r h GLY 116 N -1.19 1.20 0.83 5.37 0.00 -1.05 -0.30 103.07 107.92 3f0r h GLY 116 Ca -0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 3f0r h GLY 116 CO 0.19 -0.04 -0.24 -1.33 0.00 0.00 0.00 176.54 175.12 3f0r h GLY 117 N 0.52 -0.71 0.30 4.60 0.00 -0.58 -0.69 103.07 106.51 3f0r h GLY 117 Ca 0.52 0.26 0.13 0.00 0.00 0.00 0.00 47.33 48.25 3f0r h GLY 117 CO -0.25 -0.26 0.44 0.00 0.00 0.00 0.00 176.54 176.46 3f0r h ALA 118 N -0.47 1.24 -0.37 3.60 0.00 0.41 0.17 119.26 123.84 3f0r h ALA 118 Ca -0.07 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3f0r h ALA 118 Cb 0.59 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3f0r h ALA 118 CO 0.11 -0.05 0.03 1.15 0.00 0.00 0.00 179.25 180.50 3f0r h THR 119 N 0.65 1.25 0.07 0.00 2.02 -1.07 -1.34 112.91 114.49 3f0r h THR 119 Ca 0.44 -0.91 0.01 0.00 0.77 0.00 0.00 66.41 66.72 3f0r h THR 119 Cb 0.57 1.13 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 3f0r h THR 119 CO -0.33 0.31 -0.14 0.40 0.37 0.00 0.00 175.52 176.13 3f0r h ILE 120 N 0.46 0.68 0.00 3.11 2.04 0.56 -1.26 117.51 123.10 3f0r h ILE 120 Ca 0.11 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.96 3f0r h ILE 120 Cb 0.41 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.17 3f0r h ILE 120 CO 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 178.15 178.12 3f0r h THR 121 N -0.27 0.98 -0.65 -0.27 1.03 -0.68 -0.79 112.91 112.27 3f0r h THR 121 Ca 0.02 -0.15 -0.08 0.00 -0.01 0.00 0.00 66.41 66.19 3f0r h THR 121 Cb 0.29 1.08 -0.03 0.00 -1.07 0.00 0.00 68.15 68.42 3f0r h THR 121 CO -0.08 0.04 0.08 0.00 -0.01 0.00 0.00 175.52 175.56 3f0r h ALA 122 N 1.96 0.91 -0.49 0.00 0.00 -0.16 -1.49 119.26 119.98 3f0r h ALA 122 Ca -0.00 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 3f0r h ALA 122 Cb 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3f0r h ALA 122 CO 0.01 0.67 -0.15 0.00 0.00 0.00 0.00 179.25 179.77 3f0r h ALA 123 N 1.06 0.81 -0.38 0.00 0.00 -0.10 -2.70 119.26 117.95 3f0r h ALA 123 Ca 0.20 -0.36 0.03 0.00 0.00 0.00 0.00 54.91 54.78 3f0r h ALA 123 Cb 0.46 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 3f0r h ALA 123 CO 0.02 0.66 0.19 1.96 0.00 0.00 0.00 179.25 182.07 3f0r h GLN 124 N 0.83 0.38 -0.81 0.00 1.08 -0.90 -0.05 115.11 115.63 3f0r h GLN 124 Ca 0.12 -0.02 0.09 0.00 -1.45 0.00 0.00 58.65 57.39 3f0r h GLN 124 Cb 0.69 -0.09 -0.07 0.00 -0.05 0.00 0.00 27.48 27.97 3f0r h GLN 124 CO 0.05 0.25 0.46 0.00 -0.95 0.00 0.00 178.83 178.65 3f0r h LEU 126 N 0.80 0.47 -0.18 0.00 3.38 -1.04 -2.39 115.31 116.34 3f0r h LEU 126 Ca 0.38 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 3f0r h LEU 126 Cb 0.32 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3f0r h LEU 126 CO -0.23 0.75 -0.26 0.40 0.09 0.00 0.00 178.44 179.19 3f0r h ILE 127 N 0.40 1.34 0.00 1.22 2.04 0.32 -3.13 117.51 119.70 3f0r h ILE 127 Ca 0.05 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.45 3f0r h ILE 127 Cb 0.73 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 38.67 3f0r h ILE 127 CO 0.06 0.44 0.00 0.47 0.00 0.00 0.00 178.15 179.12 3f0r n ASP 128 N -4.40 0.00 0.00 1.72 8.00 0.70 -4.82 116.55 117.74 3f0r n ASP 128 Ca -0.06 -0.01 0.00 0.00 0.71 0.00 0.00 54.79 55.43 3f0r n ASP 128 Cb 0.44 -0.21 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 3f0r n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3f0r n GLY 129 N -0.25 0.72 0.36 0.44 0.00 -1.14 -4.89 105.19 100.44 3f0r n GLY 129 Ca 0.07 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.27 3f0r n GLY 129 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3f0r h MET 130 N 2.03 0.00 0.00 1.61 -1.53 -1.70 -3.36 114.93 111.97 3f0r h MET 130 Ca 0.00 0.00 -0.00 0.00 -3.44 0.00 0.00 59.70 56.26 3f0r h MET 130 Cb 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.10 3f0r h MET 130 CO 0.00 0.00 0.07 0.00 0.14 0.00 0.00 176.91 177.12 3f0r n LYS 132 N -0.13 0.44 -3.74 0.00 4.76 -1.26 -4.64 118.16 113.59 3f0r n LYS 132 Ca -0.02 -0.02 -0.14 0.00 -2.87 0.00 0.00 58.31 55.26 3f0r n LYS 132 Cb 0.14 -1.03 -0.15 0.00 -1.84 0.00 0.00 35.03 32.15 3f0r n LYS 132 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3f0r s VAL 133 N -2.11 -0.07 -0.07 -0.18 1.01 -1.26 -0.61 120.40 117.12 3f0r s VAL 133 Ca -0.01 0.21 0.05 0.00 0.00 0.00 0.00 61.98 62.24 3f0r s VAL 133 Cb 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 3f0r s VAL 133 CO 0.10 0.09 -0.24 0.00 0.00 0.00 0.00 175.10 175.05 3f0r s ALA 134 N 1.27 2.20 -0.10 5.51 0.00 0.50 -1.24 121.76 129.90 3f0r s ALA 134 Ca -0.08 -1.03 0.04 0.00 0.00 0.00 0.00 51.96 50.89 3f0r s ALA 134 Cb -0.12 -0.72 -0.01 0.00 0.00 0.00 0.00 23.12 22.27 3f0r s ALA 134 CO -0.05 0.40 -0.21 0.42 0.00 0.00 0.00 175.76 176.31 3f0r s ILE 135 N -0.09 2.32 -0.40 0.00 1.01 -0.33 0.80 121.20 124.49 3f0r s ILE 135 Ca -0.06 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.69 3f0r s ILE 135 Cb -0.14 -1.90 0.16 0.00 0.01 0.00 0.00 42.46 40.59 3f0r s ILE 135 CO 0.04 0.56 0.35 0.21 0.00 0.00 0.00 174.94 176.10 3f0r s ASN 136 N 0.19 1.46 0.53 3.58 2.47 -0.33 -1.27 114.94 121.57 3f0r s ASN 136 Ca -0.13 -2.67 0.22 0.00 0.42 0.00 0.00 52.86 50.70 3f0r s ASN 136 Cb -0.16 -0.16 1.38 0.00 -1.45 0.00 0.00 41.25 40.85 3f0r s ASN 136 CO 0.07 -0.19 2.06 -0.50 -3.72 0.00 0.00 177.10 174.81 3f0r h TRP 137 N 5.96 0.00 0.00 0.43 -0.00 -1.89 0.29 115.95 120.75 3f0r h TRP 137 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 59.08 3f0r h TRP 137 Cb 0.95 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.11 3f0r h TRP 137 CO 0.29 0.00 0.00 0.43 -0.00 0.00 0.00 178.44 179.16 3f0r n SER 138 N -4.38 0.00 -1.93 -3.49 7.64 -1.26 -2.92 113.62 107.27 3f0r n SER 138 Ca 0.05 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.13 3f0r n SER 138 Cb 0.41 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 3f0r n SER 138 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f0r n GLY 139 N 1.09 0.30 1.56 0.23 0.00 0.08 -4.80 105.19 103.65 3f0r n GLY 139 Ca 0.09 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.35 3f0r n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f0r n GLY 140 N 5.00 0.57 3.36 -0.02 0.00 -1.26 -1.62 105.19 111.23 3f0r n GLY 140 Ca 0.00 -0.81 -0.43 0.00 0.00 0.00 0.00 46.02 44.77 3f0r n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3f0r n TRP 141 N -2.93 4.52 0.78 1.61 7.02 -1.26 -4.22 117.44 122.95 3f0r n TRP 141 Ca 0.00 -3.13 0.00 0.00 -1.02 0.00 0.00 57.50 53.35 3f0r n TRP 141 Cb 0.11 -2.28 0.00 0.00 -2.42 0.00 0.00 31.31 26.71 3f0r n TRP 141 CO 0.00 0.00 0.00 -2.39 -2.02 0.00 0.00 177.69 173.28 3f0r n HIS 142 N 6.06 0.00 -0.04 -5.99 1.44 -1.26 -3.90 115.22 111.52 3f0r n HIS 142 Ca 0.41 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 56.10 3f0r n HIS 142 Cb 0.42 -0.05 -0.09 0.00 0.12 0.00 0.00 29.99 30.39 3f0r n HIS 142 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 3f0r n HIS 143 N 0.04 0.00 -1.41 -1.40 8.25 -1.26 -1.28 115.22 118.16 3f0r n HIS 143 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 3f0r n HIS 143 Cb 0.13 -0.48 0.06 0.00 1.12 0.00 0.00 29.99 30.81 3f0r n HIS 143 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3f0r n ALA 144 N -2.27 -0.95 -2.63 -1.41 0.00 -1.25 -4.01 120.51 107.99 3f0r n ALA 144 Ca -0.14 -0.11 -0.28 0.00 0.00 0.00 0.00 53.44 52.91 3f0r n ALA 144 Cb 0.70 -1.92 -0.11 0.00 0.00 0.00 0.00 19.45 18.13 3f0r n ALA 144 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3f0r s LYS 145 N -2.58 1.98 0.25 0.00 -0.14 0.04 -4.39 119.74 114.90 3f0r s LYS 145 Ca 0.70 -2.14 -0.10 0.00 -1.36 0.00 0.00 55.97 53.07 3f0r s LYS 145 Cb -0.39 -1.60 0.38 0.00 -1.68 0.00 0.00 37.83 34.54 3f0r s LYS 145 CO 0.54 -0.09 1.60 1.57 -0.76 0.00 0.00 175.35 178.20 3f0r h LYS 146 N 1.73 0.01 -0.30 1.68 2.10 -1.94 -3.03 116.57 116.82 3f0r h LYS 146 Ca -0.44 -0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 57.97 3f0r h LYS 146 Cb 1.25 -0.00 -0.34 0.00 -0.90 0.00 0.00 32.23 32.24 3f0r h LYS 146 CO 0.80 0.01 -0.93 -0.40 -2.00 0.00 0.00 179.45 176.92 3f0r n ASP 147 N -5.51 2.12 -3.70 7.07 5.68 -1.26 -1.92 116.55 119.03 3f0r n ASP 147 Ca 0.13 -2.69 -0.14 0.00 -0.50 0.00 0.00 54.79 51.58 3f0r n ASP 147 Cb 0.44 -0.41 -0.09 0.00 -1.14 0.00 0.00 41.12 39.92 3f0r n ASP 147 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 3f0r s GLU 148 N -2.59 0.66 0.37 0.11 2.12 -1.15 -4.85 118.70 113.37 3f0r s GLU 148 Ca 0.36 0.35 -0.07 0.00 0.36 0.00 0.00 54.97 55.97 3f0r s GLU 148 Cb 0.37 0.31 -0.05 0.00 0.26 0.00 0.00 34.13 35.01 3f0r s GLU 148 CO -0.07 -0.14 0.67 0.00 -0.54 0.00 0.00 175.26 175.19 3f0r s ALA 149 N -0.41 3.49 -0.28 6.30 0.00 -1.16 -0.78 121.76 128.91 3f0r s ALA 149 Ca -0.05 -0.44 -0.25 0.00 0.00 0.00 0.00 51.96 51.21 3f0r s ALA 149 Cb -0.03 -2.48 0.11 0.00 0.00 0.00 0.00 23.12 20.72 3f0r s ALA 149 CO 0.03 0.03 0.98 0.45 0.00 0.00 0.00 175.76 177.26 3f0r s SER 150 N -3.37 -0.50 -1.40 0.00 0.15 -0.96 -4.54 113.70 103.08 3f0r s SER 150 Ca 0.47 0.96 -0.16 0.00 0.70 0.00 0.00 55.95 57.92 3f0r s SER 150 Cb -0.10 0.98 0.02 0.00 -1.71 0.00 0.00 66.02 65.20 3f0r s SER 150 CO 0.33 -0.17 0.31 0.61 1.20 0.00 0.00 173.24 175.53 3f0r n GLY 151 N 2.30 -0.44 2.41 9.45 0.00 -1.21 -0.23 105.19 117.47 3f0r n GLY 151 Ca -0.13 0.25 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 3f0r n GLY 151 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3f0r n PHE 152 N -4.81 0.00 -3.80 1.61 3.01 0.90 -4.90 117.46 109.47 3f0r n PHE 152 Ca -0.23 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 57.86 3f0r n PHE 152 Cb 0.64 -1.34 -0.13 0.00 -0.01 0.00 0.00 39.48 38.64 3f0r n PHE 152 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3f0r n TYR 154 N 4.78 1.07 -3.69 0.00 4.01 -1.26 -2.26 117.16 119.81 3f0r n TYR 154 Ca -0.13 0.32 -0.22 0.00 -0.16 0.00 0.00 57.90 57.71 3f0r n TYR 154 Cb 0.45 -1.18 -0.18 0.00 -0.31 0.00 0.00 39.34 38.13 3f0r n TYR 154 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 3f0r s LEU 155 N -6.40 0.32 -0.79 7.72 2.96 -1.26 -4.81 118.68 116.42 3f0r s LEU 155 Ca -0.11 -0.08 -0.26 0.00 -0.22 0.00 0.00 54.13 53.46 3f0r s LEU 155 Cb 0.07 -0.25 0.01 0.00 0.50 0.00 0.00 46.19 46.52 3f0r s LEU 155 CO 0.81 -0.25 1.58 0.21 -1.32 0.00 0.00 176.35 177.37 3f0r s ASN 156 N 2.10 5.83 0.20 3.68 3.84 -1.26 -4.76 114.94 124.57 3f0r s ASN 156 Ca 0.04 -0.49 0.01 0.00 0.21 0.00 0.00 52.86 52.63 3f0r s ASN 156 Cb -0.13 -2.55 0.14 0.00 -0.55 0.00 0.00 41.25 38.16 3f0r s ASN 156 CO -0.05 -2.06 1.50 -2.24 -2.79 0.00 0.00 177.10 171.46 3f0r h ASP 157 N 11.50 0.42 -0.55 -4.21 2.03 -1.95 -3.13 116.42 120.53 3f0r h ASP 157 Ca -0.11 -0.25 0.11 0.00 -0.73 0.00 0.00 57.03 56.05 3f0r h ASP 157 Cb 1.06 -0.12 -0.10 0.00 -0.83 0.00 0.00 39.33 39.34 3f0r h ASP 157 CO 1.28 0.95 -0.14 0.00 -1.03 0.00 0.00 179.24 180.31 3f0r h ALA 158 N 1.05 0.36 -0.40 4.15 0.00 -1.88 0.36 119.26 122.89 3f0r h ALA 158 Ca -0.01 0.21 0.01 0.00 0.00 0.00 0.00 54.91 55.12 3f0r h ALA 158 Cb 1.19 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 19.38 3f0r h ALA 158 CO 0.11 -0.44 0.26 0.28 0.00 0.00 0.00 179.25 179.46 3f0r h VAL 159 N -0.00 1.09 -0.17 0.00 2.07 -1.93 -1.16 116.25 116.15 3f0r h VAL 159 Ca 0.26 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.60 3f0r h VAL 159 Cb 0.40 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3f0r h VAL 159 CO -0.57 0.10 0.11 -0.07 0.02 0.00 0.00 177.57 177.16 3f0r h LEU 160 N 0.53 0.19 -1.02 2.57 3.38 -0.91 -0.15 115.31 119.91 3f0r h LEU 160 Ca 0.15 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.14 3f0r h LEU 160 Cb -0.05 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 3f0r h LEU 160 CO -0.04 0.14 0.66 1.23 0.09 0.00 0.00 178.44 180.52 3f0r h GLY 161 N 0.23 1.43 0.82 0.83 0.00 -0.20 -1.78 103.07 104.39 3f0r h GLY 161 Ca 0.06 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 3f0r h GLY 161 CO -0.01 0.49 -0.10 -2.22 0.00 0.00 0.00 176.54 174.69 3f0r h ILE 162 N 1.33 0.86 -0.65 2.60 2.04 -0.76 -1.61 117.51 121.32 3f0r h ILE 162 Ca 0.38 -0.38 0.17 0.00 1.00 0.00 0.00 64.86 66.03 3f0r h ILE 162 Cb -0.10 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 3f0r h ILE 162 CO -0.10 0.09 0.46 -0.07 0.00 0.00 0.00 178.15 178.53 3f0r h LEU 163 N -0.46 0.10 -0.10 1.44 3.38 -0.80 0.08 115.31 118.95 3f0r h LEU 163 Ca -0.03 0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.77 3f0r h LEU 163 Cb 0.35 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.10 3f0r h LEU 163 CO 0.05 0.05 -0.64 -0.09 0.09 0.00 0.00 178.44 177.89 3f0r h ARG 164 N 0.11 0.62 -0.27 1.13 9.65 -0.96 -3.26 114.38 121.39 3f0r h ARG 164 Ca 0.31 -0.53 -0.00 0.00 -1.10 0.00 0.00 59.98 58.67 3f0r h ARG 164 Cb 1.10 0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 29.78 3f0r h ARG 164 CO -0.04 1.15 0.17 -0.07 2.80 0.00 0.00 179.97 183.98 3f0r h LEU 165 N 0.26 0.32 -0.83 3.80 3.38 -0.04 -2.92 115.31 119.28 3f0r h LEU 165 Ca -0.05 -0.04 0.05 0.00 0.09 0.00 0.00 57.88 57.93 3f0r h LEU 165 Cb 1.29 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 3f0r h LEU 165 CO 0.13 0.26 0.81 0.03 0.09 0.00 0.00 178.44 179.76 3f0r h ARG 166 N 0.35 0.00 0.00 1.13 3.08 -1.31 0.52 114.38 118.14 3f0r h ARG 166 Ca 0.10 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 3f0r h ARG 166 Cb -0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 3f0r h ARG 166 CO -0.02 0.00 -0.03 0.00 -1.07 0.00 0.00 179.97 178.85 3f0r h ARG 167 N 0.00 0.00 0.00 0.04 3.08 -1.65 -3.35 114.38 112.50 3f0r h ARG 167 Ca 0.08 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 3f0r h ARG 167 Cb 1.69 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.74 3f0r h ARG 167 CO -0.00 0.03 -0.46 1.17 -1.07 0.00 0.00 179.97 179.64 3f0r n LYS 168 N -3.82 0.10 -2.60 0.04 4.81 0.17 -5.02 118.16 111.84 3f0r n LYS 168 Ca -0.03 0.04 -0.43 0.00 -0.87 0.00 0.00 58.31 57.03 3f0r n LYS 168 Cb 0.12 -0.68 -0.02 0.00 0.02 0.00 0.00 35.03 34.47 3f0r n LYS 168 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 3f0r s PHE 169 N -2.15 3.29 0.08 5.64 0.08 -0.81 -4.96 117.98 119.15 3f0r s PHE 169 Ca -0.06 1.40 -0.29 0.00 0.12 0.00 0.00 56.93 58.09 3f0r s PHE 169 Cb 0.01 -3.30 -0.16 0.00 -0.57 0.00 0.00 43.02 39.00 3f0r s PHE 169 CO 0.08 -0.71 1.65 0.93 -0.10 0.00 0.00 175.22 177.07 3f0r h GLU 170 N 7.48 -0.58 -5.23 0.44 5.08 -1.90 -3.36 114.58 116.51 3f0r h GLU 170 Ca -0.25 0.04 -0.68 0.00 -1.00 0.00 0.00 59.36 57.47 3f0r h GLU 170 Cb 1.10 0.13 -0.34 0.00 0.50 0.00 0.00 28.75 30.15 3f0r h GLU 170 CO 0.93 -0.39 -0.87 1.03 -1.00 0.00 0.00 179.01 178.71 3f0r s ARG 171 N -6.09 3.03 -0.13 2.33 0.52 -1.26 -4.82 118.95 112.53 3f0r s ARG 171 Ca -0.16 -0.86 -0.03 0.00 -0.52 0.00 0.00 55.73 54.16 3f0r s ARG 171 Cb 0.05 -2.40 -0.03 0.00 0.52 0.00 0.00 34.95 33.08 3f0r s ARG 171 CO 0.64 0.03 -0.01 0.42 0.02 0.00 0.00 175.30 176.39 3f0r s ILE 172 N 0.71 4.16 -0.24 1.52 -1.09 -0.35 -2.39 121.20 123.52 3f0r s ILE 172 Ca -0.10 -0.28 -0.06 0.00 -2.23 0.00 0.00 60.65 57.99 3f0r s ILE 172 Cb -0.16 -2.79 -0.02 0.00 -1.58 0.00 0.00 42.46 37.91 3f0r s ILE 172 CO 0.00 0.54 0.01 -0.22 -1.23 0.00 0.00 174.94 174.05 3f0r s LEU 173 N -0.20 3.17 -0.25 2.97 2.96 -0.52 -1.29 118.68 125.53 3f0r s LEU 173 Ca 0.05 -0.30 -0.10 0.00 -0.22 0.00 0.00 54.13 53.56 3f0r s LEU 173 Cb -0.13 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 3f0r s LEU 173 CO 0.02 -0.03 0.14 -0.47 -1.32 0.00 0.00 176.35 174.69 3f0r s TYR 174 N 1.55 3.22 -0.20 5.38 6.14 0.96 -0.67 117.35 133.72 3f0r s TYR 174 Ca 0.06 0.02 -0.01 0.00 0.64 0.00 0.00 57.07 57.78 3f0r s TYR 174 Cb -0.15 -2.28 0.01 0.00 0.42 0.00 0.00 41.96 39.96 3f0r s TYR 174 CO 0.00 -0.11 -0.14 0.08 0.64 0.00 0.00 175.55 176.03 3f0r s VAL 175 N 1.38 2.56 -0.37 3.14 1.01 -0.18 0.21 120.40 128.15 3f0r s VAL 175 Ca 0.06 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.21 3f0r s VAL 175 Cb -0.15 -2.14 0.09 0.00 0.00 0.00 0.00 36.38 34.18 3f0r s VAL 175 CO 0.06 0.47 0.13 -0.62 0.00 0.00 0.00 175.10 175.14 3f0r s ASP 176 N 1.35 5.14 0.00 3.32 -1.08 -0.17 -0.45 116.67 124.78 3f0r s ASP 176 Ca 0.05 -1.76 0.23 0.00 -0.52 0.00 0.00 52.55 50.55 3f0r s ASP 176 Cb -0.14 -1.79 0.51 0.00 -1.46 0.00 0.00 42.92 40.04 3f0r s ASP 176 CO -0.09 -0.44 1.44 0.18 0.52 0.00 0.00 175.17 176.78 3f0r n LEU 177 N 4.60 2.71 -4.46 -1.34 4.77 -0.34 -2.45 117.00 120.49 3f0r n LEU 177 Ca -0.06 -1.07 -0.32 0.00 -0.03 0.00 0.00 56.01 54.54 3f0r n LEU 177 Cb 0.42 -0.12 0.16 0.00 -2.33 0.00 0.00 43.42 41.55 3f0r n LEU 177 CO 0.30 0.53 0.10 -0.67 -1.33 0.00 0.00 177.39 176.33 3f0r n ASP 178 N 1.04 -1.48 0.12 -1.43 -0.08 -1.25 -4.60 116.55 108.86 3f0r n ASP 178 Ca 0.17 0.22 0.00 0.00 -1.51 0.00 0.00 54.79 53.68 3f0r n ASP 178 Cb 0.51 -1.24 0.30 0.00 2.34 0.00 0.00 41.12 43.03 3f0r n ASP 178 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 3f0r h LEU 179 N -1.86 0.17-10.21 -2.67 5.85 -1.84 -3.41 115.31 101.35 3f0r h LEU 179 Ca -0.47 -0.06 -0.49 0.00 0.84 0.00 0.00 57.88 57.70 3f0r h LEU 179 Cb 1.30 -0.05 0.01 0.00 0.37 0.00 0.00 40.66 42.29 3f0r h LEU 179 CO 0.38 0.51 -0.12 -1.00 -0.34 0.00 0.00 178.44 177.87 3f0r s HIS 180 N -4.29 3.50 -0.02 1.25 3.76 -1.26 -0.76 115.29 117.48 3f0r s HIS 180 Ca -0.04 0.52 -0.30 0.00 -0.15 0.00 0.00 55.06 55.09 3f0r s HIS 180 Cb 0.14 -2.03 -0.05 0.00 1.11 0.00 0.00 32.58 31.75 3f0r s HIS 180 CO 0.75 0.07 1.30 -1.58 -0.85 0.00 0.00 174.74 174.43 3f0r s HIS 181 N -2.32 3.05 -1.27 1.40 2.46 -1.26 -4.84 115.29 112.51 3f0r s HIS 181 Ca 0.42 1.03 -0.18 0.00 0.47 0.00 0.00 55.06 56.80 3f0r s HIS 181 Cb -0.10 -3.54 0.01 0.00 -0.13 0.00 0.00 32.58 28.82 3f0r s HIS 181 CO 0.36 -1.87 1.95 0.41 -2.47 0.00 0.00 174.74 173.11 3f0r n GLY 182 N 3.49 2.93 0.23 1.59 0.00 -1.26 -4.69 105.19 107.47 3f0r n GLY 182 Ca 0.12 -1.36 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 3f0r n GLY 182 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3f0r h ASP 183 N 7.43 0.65 -0.44 1.61 2.03 -1.91 -1.85 116.42 123.94 3f0r h ASP 183 Ca 0.45 -0.31 0.01 0.00 -0.73 0.00 0.00 57.03 56.45 3f0r h ASP 183 Cb 0.78 -0.18 -0.02 0.00 -0.83 0.00 0.00 39.33 39.07 3f0r h ASP 183 CO 1.62 1.00 0.28 1.23 -1.03 0.00 0.00 179.24 182.35 3f0r h GLY 184 N 1.02 0.62 0.85 7.15 0.00 -1.32 0.71 103.07 112.10 3f0r h GLY 184 Ca 0.03 -0.22 -0.14 0.00 0.00 0.00 0.00 47.33 47.01 3f0r h GLY 184 CO 0.09 0.21 -0.47 -2.08 0.00 0.00 0.00 176.54 174.29 3f0r h VAL 185 N 0.58 1.37 -0.68 4.60 2.07 -1.57 -2.63 116.25 119.99 3f0r h VAL 185 Ca 0.17 -1.80 0.04 0.00 0.82 0.00 0.00 66.70 65.92 3f0r h VAL 185 Cb -0.05 2.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 3f0r h VAL 185 CO -0.05 0.54 0.41 -0.08 0.02 0.00 0.00 177.57 178.41 3f0r h GLU 186 N 0.09 0.76 -0.26 1.57 4.81 -1.16 -2.66 114.58 117.73 3f0r h GLU 186 Ca -0.03 -0.05 -0.13 0.00 -0.13 0.00 0.00 59.36 59.02 3f0r h GLU 186 Cb 1.12 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 3f0r h GLU 186 CO 0.10 0.50 -0.40 -0.44 -0.73 0.00 0.00 179.01 178.05 3f0r h ASP 187 N 0.78 0.63 0.38 1.04 3.32 -0.90 0.46 116.42 122.13 3f0r h ASP 187 Ca 0.28 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3f0r h ASP 187 Cb 0.08 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3f0r h ASP 187 CO -0.13 0.96 0.00 0.00 -1.72 0.00 0.00 179.24 178.35 3f0r n ALA 188 N -2.51 1.65 -1.91 3.45 0.00 -0.99 -2.82 120.51 117.38 3f0r n ALA 188 Ca -0.02 -0.05 0.01 0.00 0.00 0.00 0.00 53.44 53.38 3f0r n ALA 188 Cb 0.52 -1.21 0.01 0.00 0.00 0.00 0.00 19.45 18.76 3f0r n ALA 188 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3f0r n PHE 189 N -1.43 0.00 -0.03 0.00 3.01 -1.06 -4.86 117.46 113.08 3f0r n PHE 189 Ca 0.04 -0.06 -0.07 0.00 1.01 0.00 0.00 57.45 58.38 3f0r n PHE 189 Cb 0.14 -0.05 0.12 0.00 -0.01 0.00 0.00 39.48 39.67 3f0r n PHE 189 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3f0r h SER 190 N 0.00 0.65 0.25 4.37 4.64 -0.75 -3.14 113.55 119.57 3f0r h SER 190 Ca 0.00 -0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 3f0r h SER 190 Cb 1.36 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3f0r h SER 190 CO 0.00 0.91 -0.20 0.49 -0.87 0.00 0.00 176.83 177.16 3f0r n PHE 191 N -4.09 0.00 -3.48 4.77 3.01 -1.26 -2.12 117.46 114.30 3f0r n PHE 191 Ca -0.01 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.25 3f0r n PHE 191 Cb 0.46 -0.13 -0.02 0.00 -0.01 0.00 0.00 39.48 39.78 3f0r n PHE 191 CO 0.00 0.00 0.00 -0.08 1.01 0.00 0.00 176.76 177.69 3f0r s THR 192 N -2.45 2.68 0.00 4.37 -1.32 -1.19 -2.15 115.64 115.57 3f0r s THR 192 Ca 0.27 -1.29 0.00 0.00 -1.21 0.00 0.00 61.69 59.45 3f0r s THR 192 Cb 0.20 -2.97 0.00 0.00 -1.51 0.00 0.00 72.50 68.22 3f0r s THR 192 CO 0.49 0.00 0.55 -1.54 -2.21 0.00 0.00 174.62 171.92 3f0r n SER 193 N -1.61 0.97 0.19 8.08 3.41 -1.26 -3.73 113.62 119.68 3f0r n SER 193 Ca 0.04 -1.29 0.12 0.00 -0.26 0.00 0.00 58.87 57.48 3f0r n SER 193 Cb 0.61 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.72 3f0r n SER 193 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3f0r h LYS 194 N 0.00 0.00 -4.01 4.33 1.79 -1.93 -3.43 116.57 113.33 3f0r h LYS 194 Ca 0.00 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 3f0r h LYS 194 Cb 0.38 0.00 -0.38 0.00 -1.58 0.00 0.00 32.23 30.65 3f0r h LYS 194 CO 0.00 0.00 -0.79 0.08 -1.08 0.00 0.00 179.45 177.66 3f0r s VAL 195 N -3.23 0.91 -0.18 0.50 1.01 -1.26 -1.21 120.40 116.93 3f0r s VAL 195 Ca 0.06 -0.48 -0.09 0.00 0.00 0.00 0.00 61.98 61.48 3f0r s VAL 195 Cb 0.06 -1.11 -0.05 0.00 0.00 0.00 0.00 36.38 35.28 3f0r s VAL 195 CO 0.69 0.12 0.12 -0.32 0.00 0.00 0.00 175.10 175.70 3f0r s MET 196 N 1.72 4.00 -0.20 2.72 1.75 -0.41 -4.91 119.30 123.96 3f0r s MET 196 Ca 0.01 -0.23 -0.04 0.00 -1.25 0.00 0.00 55.69 54.18 3f0r s MET 196 Cb -0.15 -3.33 -0.02 0.00 2.84 0.00 0.00 34.83 34.18 3f0r s MET 196 CO -0.07 0.39 -0.03 0.95 -0.65 0.00 0.00 175.02 175.61 3f0r s THR 197 N 0.10 3.69 -0.11 10.11 -4.23 -0.95 -0.03 115.64 124.22 3f0r s THR 197 Ca 0.08 -0.40 0.03 0.00 -1.18 0.00 0.00 61.69 60.22 3f0r s THR 197 Cb -0.11 -2.66 -0.01 0.00 1.34 0.00 0.00 72.50 71.06 3f0r s THR 197 CO -0.01 0.44 -0.21 0.54 -0.54 0.00 0.00 174.62 174.84 3f0r s VAL 198 N 1.07 2.36 -0.05 2.29 0.11 0.13 -0.91 120.40 125.41 3f0r s VAL 198 Ca 0.02 -0.91 -0.02 0.00 -2.93 0.00 0.00 61.98 58.13 3f0r s VAL 198 Cb -0.15 -1.93 0.04 0.00 -1.53 0.00 0.00 36.38 32.81 3f0r s VAL 198 CO 0.01 0.55 0.10 -0.55 -3.33 0.00 0.00 175.10 171.87 3f0r s SER 199 N 0.31 0.59 -0.16 3.54 0.15 -0.03 -1.00 113.70 117.10 3f0r s SER 199 Ca -0.16 0.18 -0.11 0.00 0.70 0.00 0.00 55.95 56.57 3f0r s SER 199 Cb -0.17 0.05 -0.05 0.00 -1.71 0.00 0.00 66.02 64.14 3f0r s SER 199 CO 0.08 -0.21 0.20 -0.76 1.20 0.00 0.00 173.24 173.75 3f0r s LEU 200 N 1.81 4.28 -0.05 3.45 1.43 -1.02 -0.90 118.68 127.67 3f0r s LEU 200 Ca -0.01 0.41 -0.31 0.00 -1.03 0.00 0.00 54.13 53.19 3f0r s LEU 200 Cb -0.12 -2.20 0.12 0.00 0.03 0.00 0.00 46.19 44.02 3f0r s LEU 200 CO -0.04 0.22 1.17 -1.38 0.23 0.00 0.00 176.35 176.54 3f0r s HIS 201 N -0.01 -0.12 -0.06 0.29 -3.43 -0.95 -4.43 115.29 106.58 3f0r s HIS 201 Ca 0.13 0.00 -0.30 0.00 -0.80 0.00 0.00 55.06 54.09 3f0r s HIS 201 Cb -0.12 0.55 -0.03 0.00 -1.43 0.00 0.00 32.58 31.54 3f0r s HIS 201 CO 0.02 -0.36 1.25 0.21 -2.00 0.00 0.00 174.74 173.86 3f0r s LYS 202 N -2.62 4.32 -0.24 -0.38 2.20 0.06 0.20 119.74 123.27 3f0r s LYS 202 Ca 0.11 1.74 -0.00 0.00 -0.36 0.00 0.00 55.97 57.45 3f0r s LYS 202 Cb 0.01 -3.59 0.07 0.00 -1.51 0.00 0.00 37.83 32.81 3f0r s LYS 202 CO -0.04 -0.51 0.00 0.12 -0.36 0.00 0.00 175.35 174.56 3f0r s PHE 203 N 2.44 2.00 -0.08 4.03 5.36 -1.04 -4.72 117.98 125.97 3f0r s PHE 203 Ca 0.57 -1.59 -0.25 0.00 -0.96 0.00 0.00 56.93 54.70 3f0r s PHE 203 Cb -0.26 -1.54 0.06 0.00 -0.34 0.00 0.00 43.02 40.94 3f0r s PHE 203 CO 0.22 -0.76 0.58 -1.54 -1.46 0.00 0.00 175.22 172.26 3f0r s SER 204 N 1.52 -0.55 -0.18 6.13 1.04 -1.26 -4.78 113.70 115.62 3f0r s SER 204 Ca -0.01 0.68 -0.41 0.00 0.48 0.00 0.00 55.95 56.70 3f0r s SER 204 Cb -0.18 0.64 -0.18 0.00 0.10 0.00 0.00 66.02 66.40 3f0r s SER 204 CO -0.10 -0.49 1.50 -0.81 0.98 0.00 0.00 173.24 174.32 3f0r n PRO 205 N 1.39 0.73 0.00 4.02 -0.04 -1.26 -0.79 135.00 139.05 3f0r n PRO 205 Ca -0.18 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 3f0r n PRO 205 Cb 0.56 -1.87 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 3f0r n PRO 205 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3f0r n GLY 206 N 3.26 1.86 3.59 0.55 0.00 -1.26 -5.02 105.19 108.17 3f0r n GLY 206 Ca 0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.85 3f0r n GLY 206 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3f0r s PHE 207 N -2.60 3.19 0.42 1.61 5.36 0.03 -4.96 117.98 121.03 3f0r s PHE 207 Ca 0.00 0.46 -0.24 0.00 -0.96 0.00 0.00 56.93 56.19 3f0r s PHE 207 Cb 0.00 -3.01 -0.11 0.00 -0.34 0.00 0.00 43.02 39.56 3f0r s PHE 207 CO 0.00 -0.52 0.85 0.34 -1.46 0.00 0.00 175.22 174.43 3f0r n PHE 208 N 5.89 0.59 1.38 10.12 -0.00 -1.26 -1.38 117.46 132.79 3f0r n PHE 208 Ca -0.02 0.59 0.15 0.00 -0.00 0.00 0.00 57.45 58.16 3f0r n PHE 208 Cb 0.49 -2.14 0.69 0.00 -0.00 0.00 0.00 39.48 38.52 3f0r n PHE 208 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.76 176.41 3f0r n PRO 209 N 0.29 0.46 0.00 -7.13 -0.04 -1.26 -4.61 135.00 122.71 3f0r n PRO 209 Ca 0.10 -0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 3f0r n PRO 209 Cb 0.39 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 3f0r n PRO 209 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3f0r n GLY 210 N 1.30 3.13 3.36 0.55 0.00 -0.48 -5.05 105.19 108.00 3f0r n GLY 210 Ca 0.14 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.97 3f0r n GLY 210 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3f0r n THR 211 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -4.78 114.28 108.61 3f0r n THR 211 Ca 0.00 -0.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 3f0r n THR 211 Cb 0.00 -1.55 0.00 0.00 -2.10 0.00 0.00 70.33 66.68 3f0r n THR 211 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3f0r n GLY 212 N -2.70 1.21 3.75 3.38 0.00 -1.26 -4.81 105.19 104.75 3f0r n GLY 212 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 3f0r n GLY 212 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3f0r s ASP 213 N -2.00 4.93 0.58 1.61 2.15 -1.26 -4.43 116.67 118.25 3f0r s ASP 213 Ca 0.00 2.26 0.28 0.00 0.43 0.00 0.00 52.55 55.52 3f0r s ASP 213 Cb 0.00 -2.58 1.69 0.00 -0.30 0.00 0.00 42.92 41.73 3f0r s ASP 213 CO 0.00 -1.76 2.17 1.62 -0.17 0.00 0.00 175.17 177.02 3f0r h VAL 214 N 0.36 0.54 0.00 1.11 3.04 -1.97 -0.45 116.25 118.87 3f0r h VAL 214 Ca -0.49 0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.15 3f0r h VAL 214 Cb 1.28 0.91 -0.01 0.00 -2.01 0.00 0.00 31.29 31.47 3f0r h VAL 214 CO 0.53 0.00 -0.23 0.77 -1.01 0.00 0.00 177.57 177.63 3f0r h SER 215 N 0.00 0.00 -2.66 3.17 4.64 -1.90 -3.42 113.55 113.38 3f0r h SER 215 Ca 0.05 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.84 3f0r h SER 215 Cb 0.27 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.38 3f0r h SER 215 CO -0.00 0.23 1.02 -0.62 -0.87 0.00 0.00 176.83 176.60 3f0r s ASP 216 N -6.70 6.58 0.00 4.97 3.68 -0.18 -4.82 116.67 120.21 3f0r s ASP 216 Ca -0.03 2.50 0.00 0.00 2.13 0.00 0.00 52.55 57.15 3f0r s ASP 216 Cb 0.14 -2.56 0.00 0.00 -1.45 0.00 0.00 42.92 39.05 3f0r s ASP 216 CO 0.67 -0.91 0.00 1.33 0.13 0.00 0.00 175.17 176.40 3f0r n VAL 217 N 4.80 0.00 0.00 1.11 0.24 -1.26 -4.13 118.33 119.09 3f0r n VAL 217 Ca 0.16 -0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.46 3f0r n VAL 217 Cb 0.40 0.47 0.00 0.00 -1.47 0.00 0.00 33.84 33.25 3f0r n VAL 217 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3f0r n GLY 218 N 0.01 1.14 3.18 7.63 0.00 -1.26 -0.68 105.19 115.21 3f0r n GLY 218 Ca 0.00 -2.16 -0.11 0.00 0.00 0.00 0.00 46.02 43.75 3f0r n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3f0r s LEU 219 N 0.00 1.69 0.00 0.99 1.43 -0.90 -4.48 118.68 117.41 3f0r s LEU 219 Ca 0.00 -1.25 0.00 0.00 -1.03 0.00 0.00 54.13 51.85 3f0r s LEU 219 Cb 0.00 0.25 0.00 0.00 0.03 0.00 0.00 46.19 46.47 3f0r s LEU 219 CO 0.00 -0.73 0.00 0.61 0.23 0.00 0.00 176.35 176.46 3f0r n GLY 220 N -0.17 2.22 0.00 -3.19 0.00 -1.26 0.10 105.19 102.88 3f0r n GLY 220 Ca -0.04 -0.27 0.07 0.00 0.00 0.00 0.00 46.02 45.79 3f0r n GLY 220 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3f0r n LYS 221 N 14.00 0.25 -0.26 1.61 5.02 -1.23 -2.13 118.16 135.42 3f0r n LYS 221 Ca 0.00 0.13 0.12 0.00 -2.02 0.00 0.00 58.31 56.53 3f0r n LYS 221 Cb 0.00 -1.50 0.26 0.00 -0.02 0.00 0.00 35.03 33.77 3f0r n LYS 221 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3f0r n GLY 222 N -0.07 2.00 3.77 0.72 0.00 0.12 -4.10 105.19 107.62 3f0r n GLY 222 Ca 0.08 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 3f0r n GLY 222 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3f0r s ARG 223 N -1.32 4.24 -0.16 1.61 3.52 -0.91 -1.88 118.95 124.05 3f0r s ARG 223 Ca 0.43 2.37 0.00 0.00 -0.13 0.00 0.00 55.73 58.40 3f0r s ARG 223 Cb 0.24 -3.04 0.00 0.00 -1.56 0.00 0.00 34.95 30.59 3f0r s ARG 223 CO 0.33 -0.38 0.00 0.66 -0.81 0.00 0.00 175.30 175.10 3f0r n TYR 224 N 1.12 0.00 -0.45 5.12 4.02 -0.58 -4.87 117.16 121.52 3f0r n TYR 224 Ca 0.02 0.00 0.06 0.00 -0.01 0.00 0.00 57.90 57.98 3f0r n TYR 224 Cb 0.40 -0.76 0.18 0.00 -0.02 0.00 0.00 39.34 39.14 3f0r n TYR 224 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3f0r n TYR 225 N -2.75 0.61 -3.90 -0.72 4.02 -0.79 -4.77 117.16 108.86 3f0r n TYR 225 Ca -0.02 -0.63 -0.27 0.00 -0.01 0.00 0.00 57.90 56.97 3f0r n TYR 225 Cb 0.15 -0.13 -0.17 0.00 -0.02 0.00 0.00 39.34 39.18 3f0r n TYR 225 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 3f0r s SER 226 N -1.33 2.28 -0.29 7.72 0.01 0.15 -2.23 113.70 120.01 3f0r s SER 226 Ca 0.29 -0.36 0.02 0.00 1.31 0.00 0.00 55.95 57.21 3f0r s SER 226 Cb 0.19 -0.84 0.07 0.00 0.21 0.00 0.00 66.02 65.65 3f0r s SER 226 CO 0.13 -0.13 -0.05 0.54 0.41 0.00 0.00 173.24 174.14 3f0r s VAL 227 N 1.70 2.38 -0.21 3.43 0.11 -0.09 -4.06 120.40 123.67 3f0r s VAL 227 Ca 0.04 -1.74 -0.09 0.00 -2.93 0.00 0.00 61.98 57.27 3f0r s VAL 227 Cb -0.13 -2.47 -0.05 0.00 -1.53 0.00 0.00 36.38 32.21 3f0r s VAL 227 CO -0.08 -0.17 0.11 0.20 -3.33 0.00 0.00 175.10 171.83 3f0r s ASN 228 N 1.12 5.92 -0.44 3.54 0.01 -1.26 -0.85 114.94 122.98 3f0r s ASN 228 Ca -0.04 0.12 0.02 0.00 -0.71 0.00 0.00 52.86 52.25 3f0r s ASN 228 Cb -0.20 -2.04 0.12 0.00 0.41 0.00 0.00 41.25 39.54 3f0r s ASN 228 CO -0.05 0.13 0.18 -0.69 -1.51 0.00 0.00 177.10 175.17 3f0r s VAL 229 N 0.64 2.66 -0.26 1.60 1.01 -0.08 -4.03 120.40 121.94 3f0r s VAL 229 Ca 0.06 -2.72 -0.29 0.00 0.00 0.00 0.00 61.98 59.03 3f0r s VAL 229 Cb -0.12 -2.87 -0.01 0.00 0.00 0.00 0.00 36.38 33.37 3f0r s VAL 229 CO 0.01 -0.71 1.41 -2.16 0.00 0.00 0.00 175.10 173.65 3f0r s PRO 230 N 0.41 3.91 0.10 2.72 0.04 -1.26 -2.25 135.00 138.68 3f0r s PRO 230 Ca 0.13 1.43 0.10 0.00 0.04 0.00 0.00 61.00 62.70 3f0r s PRO 230 Cb -0.22 -3.92 -0.04 0.00 0.04 0.00 0.00 34.50 30.36 3f0r s PRO 230 CO -0.04 -1.14 -0.25 0.42 0.04 0.00 0.00 177.00 176.03 3f0r s ILE 231 N 4.57 2.34 0.43 0.56 1.01 0.13 -4.84 121.20 125.41 3f0r s ILE 231 Ca 0.61 -1.60 0.06 0.00 0.00 0.00 0.00 60.65 59.73 3f0r s ILE 231 Cb -0.20 -2.01 -0.06 0.00 0.01 0.00 0.00 42.46 40.20 3f0r s ILE 231 CO 0.24 0.18 0.06 0.00 0.00 0.00 0.00 174.94 175.42 3f0r s GLN 232 N -1.83 2.07 0.37 2.79 0.00 -1.26 -2.49 119.66 119.31 3f0r s GLN 232 Ca 0.14 -2.10 -0.25 0.00 -0.00 0.00 0.00 55.36 53.15 3f0r s GLN 232 Cb -0.10 -1.71 -0.12 0.00 0.00 0.00 0.00 33.01 31.07 3f0r s GLN 232 CO 0.06 -0.14 0.93 -0.25 0.00 0.00 0.00 175.29 175.88 3f0r n ASP 233 N -1.11 0.88 0.00 12.60 9.92 -1.26 -3.91 116.55 133.68 3f0r n ASP 233 Ca -0.06 1.07 0.00 0.00 -0.53 0.00 0.00 54.79 55.26 3f0r n ASP 233 Cb 0.66 -1.28 0.00 0.00 -0.64 0.00 0.00 41.12 39.86 3f0r n ASP 233 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3f0r n GLY 234 N 1.31 1.02 3.75 0.44 0.00 0.01 -1.54 105.19 110.18 3f0r n GLY 234 Ca 0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 3f0r n GLY 234 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3f0r s ILE 235 N -2.00 2.48 0.07 -0.61 -1.16 -1.25 -3.98 121.20 114.75 3f0r s ILE 235 Ca 0.00 0.33 0.06 0.00 -0.51 0.00 0.00 60.65 60.52 3f0r s ILE 235 Cb 0.00 -3.15 -0.03 0.00 0.61 0.00 0.00 42.46 39.89 3f0r s ILE 235 CO 0.00 -0.04 -0.16 -1.10 -2.81 0.00 0.00 174.94 170.83 3f0r s GLN 236 N -3.11 0.93 0.03 3.50 -0.21 -1.26 -0.53 119.66 119.02 3f0r s GLN 236 Ca 0.74 -0.95 -0.06 0.00 0.02 0.00 0.00 55.36 55.11 3f0r s GLN 236 Cb -0.34 -1.00 -0.01 0.00 1.00 0.00 0.00 33.01 32.66 3f0r s GLN 236 CO 0.38 0.23 0.43 -0.25 -2.12 0.00 0.00 175.29 173.96 3f0r n ASP 237 N 1.42 -0.21 -0.15 5.90 8.00 -1.26 -0.67 116.55 129.58 3f0r n ASP 237 Ca -0.20 0.47 -0.09 0.00 0.71 0.00 0.00 54.79 55.68 3f0r n ASP 237 Cb 0.54 -0.11 -0.04 0.00 -0.02 0.00 0.00 41.12 41.49 3f0r n ASP 237 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3f0r h GLU 238 N 0.00 -0.28 -0.31 -1.24 3.07 -1.96 0.80 114.58 114.65 3f0r h GLU 238 Ca 0.03 0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 58.88 3f0r h GLU 238 Cb 0.08 0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 3f0r h GLU 238 CO -0.19 -0.19 0.06 -0.22 -1.40 0.00 0.00 179.01 177.08 3f0r h LYS 239 N -0.29 0.51 -0.16 2.33 3.64 -1.32 -3.01 116.57 118.27 3f0r h LYS 239 Ca 0.15 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.45 3f0r h LYS 239 Cb 0.57 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.29 3f0r h LYS 239 CO -0.61 0.59 -0.12 -0.92 -2.27 0.00 0.00 179.45 176.13 3f0r h TYR 240 N 0.35 -0.29 -0.95 1.91 3.20 0.06 -1.78 116.97 119.46 3f0r h TYR 240 Ca 0.10 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.05 3f0r h TYR 240 Cb 0.32 0.15 -0.06 0.00 1.54 0.00 0.00 36.73 38.68 3f0r h TYR 240 CO 0.02 -0.18 0.61 -0.92 -1.64 0.00 0.00 178.16 176.05 3f0r h TYR 241 N -0.12 1.13 0.18 -3.82 3.20 -0.91 0.19 116.97 116.82 3f0r h TYR 241 Ca 0.10 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.00 3f0r h TYR 241 Cb 0.27 -0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.15 3f0r h TYR 241 CO -0.26 0.59 -0.19 1.96 -1.64 0.00 0.00 178.16 178.63 3f0r h GLN 242 N 1.11 -0.38 -0.43 1.82 4.20 -1.24 0.90 115.11 121.10 3f0r h GLN 242 Ca 0.41 0.03 0.06 0.00 0.06 0.00 0.00 58.65 59.20 3f0r h GLN 242 Cb 0.14 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.96 3f0r h GLN 242 CO -0.17 -0.26 0.13 0.82 -0.67 0.00 0.00 178.83 178.69 3f0r h ILE 243 N -0.40 0.84 -0.16 2.54 2.04 -0.72 -0.56 117.51 121.09 3f0r h ILE 243 Ca 0.00 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 3f0r h ILE 243 Cb 0.38 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 3f0r h ILE 243 CO -0.05 0.05 0.01 0.00 0.00 0.00 0.00 178.15 178.16 3f0r h GLU 245 N 0.03 0.56 0.33 0.00 4.81 0.99 0.89 114.58 122.20 3f0r h GLU 245 Ca 0.05 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 3f0r h GLU 245 Cb 0.35 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.62 3f0r h GLU 245 CO 0.01 0.43 -0.16 1.03 -0.73 0.00 0.00 179.01 179.59 3f0r h SER 246 N 0.56 -0.38 -0.34 1.04 0.87 -0.84 -1.32 113.55 113.14 3f0r h SER 246 Ca 0.14 0.01 0.07 0.00 -1.23 0.00 0.00 61.79 60.78 3f0r h SER 246 Cb 0.06 0.10 -0.06 0.00 -0.44 0.00 0.00 62.40 62.06 3f0r h SER 246 CO -0.02 -0.25 -0.05 0.58 -0.53 0.00 0.00 176.83 176.56 3f0r h VAL 247 N -0.48 0.70 0.00 2.23 2.07 -1.05 -2.13 116.25 117.58 3f0r h VAL 247 Ca -0.05 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.46 3f0r h VAL 247 Cb 0.34 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3f0r h VAL 247 CO 0.08 0.01 0.00 -0.07 0.02 0.00 0.00 177.57 177.60 3f0r h LEU 248 N 0.04 0.00 -0.04 2.57 3.38 -0.88 -2.11 115.31 118.27 3f0r h LEU 248 Ca 0.17 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.96 3f0r h LEU 248 Cb 0.24 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.01 3f0r h LEU 248 CO -0.32 0.00 -0.67 0.50 0.09 0.00 0.00 178.44 178.04 3f0r h LYS 249 N 0.00 0.52 0.00 1.13 3.64 -0.54 -2.78 116.57 118.54 3f0r h LYS 249 Ca 0.00 -0.51 -0.18 0.00 -1.27 0.00 0.00 60.65 58.69 3f0r h LYS 249 Cb 0.36 0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.29 3f0r h LYS 249 CO 0.00 1.14 -0.85 0.93 -2.27 0.00 0.00 179.45 178.40 3f0r h GLU 250 N 0.09 0.00 -0.43 1.90 5.08 -1.44 -3.22 114.58 116.57 3f0r h GLU 250 Ca -0.07 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 3f0r h GLU 250 Cb 1.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 3f0r h GLU 250 CO 0.13 0.85 -0.03 0.28 -1.00 0.00 0.00 179.01 179.25 3f0r h VAL 251 N 0.00 1.27 -0.18 3.13 2.07 -1.46 -2.38 116.25 118.69 3f0r h VAL 251 Ca -0.01 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 66.43 3f0r h VAL 251 Cb 1.64 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 3f0r h VAL 251 CO 0.11 0.37 0.11 0.22 0.02 0.00 0.00 177.57 178.40 3f0r h TYR 252 N 0.61 0.23 0.03 1.57 3.20 -1.53 -1.95 116.97 119.13 3f0r h TYR 252 Ca 0.12 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 3f0r h TYR 252 Cb 0.53 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.72 3f0r h TYR 252 CO 0.04 0.15 -0.02 1.96 -1.64 0.00 0.00 178.16 178.65 3f0r h GLN 253 N 0.24 -0.04 0.00 1.82 1.08 -1.51 0.07 115.11 116.77 3f0r h GLN 253 Ca 0.07 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.26 3f0r h GLN 253 Cb -0.02 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.42 3f0r h GLN 253 CO -0.01 -0.03 -0.03 0.00 -0.95 0.00 0.00 178.83 177.80 3f0r h ALA 254 N -1.26 1.61 0.00 3.87 0.00 -1.50 -3.19 119.26 118.78 3f0r h ALA 254 Ca -0.00 -0.03 -0.30 0.00 0.00 0.00 0.00 54.91 54.58 3f0r h ALA 254 Cb 0.03 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 3f0r h ALA 254 CO 0.01 0.04 -2.13 0.34 0.00 0.00 0.00 179.25 177.51 3f0r n PHE 255 N -4.01 0.00 -3.52 0.00 7.35 -0.73 -4.54 117.46 112.00 3f0r n PHE 255 Ca -0.03 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.35 3f0r n PHE 255 Cb 0.12 -0.78 0.02 0.00 0.35 0.00 0.00 39.48 39.19 3f0r n PHE 255 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 3f0r n ASN 256 N -2.86 -5.59 -4.78 -2.13 5.15 0.01 -4.95 115.26 100.11 3f0r n ASN 256 Ca -0.31 -0.35 -0.29 0.00 -0.60 0.00 0.00 54.58 53.03 3f0r n ASN 256 Cb 0.95 -2.11 0.12 0.00 -0.53 0.00 0.00 39.78 38.21 3f0r n ASN 256 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3f0r s PRO 257 N -3.25 1.48 -0.02 1.20 0.04 -1.26 -4.96 135.00 128.23 3f0r s PRO 257 Ca 0.24 0.46 0.05 0.00 0.04 0.00 0.00 61.00 61.80 3f0r s PRO 257 Cb -0.03 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.57 3f0r s PRO 257 CO 0.87 -2.00 0.10 1.63 0.04 0.00 0.00 177.00 177.64 3f0r n LYS 258 N -3.66 0.83 -4.05 4.56 4.01 -1.01 -5.04 118.16 113.80 3f0r n LYS 258 Ca 0.07 -0.04 -0.07 0.00 -0.51 0.00 0.00 58.31 57.75 3f0r n LYS 258 Cb 0.58 -1.13 -0.10 0.00 -0.51 0.00 0.00 35.03 33.87 3f0r n LYS 258 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3f0r s ALA 259 N -2.32 0.39 -0.03 7.82 0.00 -1.20 -3.52 121.76 122.90 3f0r s ALA 259 Ca -0.02 -1.08 -0.01 0.00 0.00 0.00 0.00 51.96 50.85 3f0r s ALA 259 Cb 0.03 0.28 0.03 0.00 0.00 0.00 0.00 23.12 23.46 3f0r s ALA 259 CO 0.22 -0.36 0.06 0.08 0.00 0.00 0.00 175.76 175.76 3f0r s VAL 260 N -3.67 -0.06 -0.30 0.00 1.01 0.18 -1.43 120.40 116.14 3f0r s VAL 260 Ca 0.05 0.20 -0.05 0.00 0.00 0.00 0.00 61.98 62.18 3f0r s VAL 260 Cb 0.06 -0.12 0.03 0.00 0.00 0.00 0.00 36.38 36.35 3f0r s VAL 260 CO -0.09 0.08 0.05 -0.69 0.00 0.00 0.00 175.10 174.45 3f0r s VAL 261 N 1.06 3.57 -0.28 2.92 1.01 0.15 -0.65 120.40 128.19 3f0r s VAL 261 Ca -0.09 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 60.86 3f0r s VAL 261 Cb -0.12 -2.91 0.00 0.00 0.00 0.00 0.00 36.38 33.34 3f0r s VAL 261 CO -0.04 0.01 0.07 -0.22 0.00 0.00 0.00 175.10 174.92 3f0r s LEU 262 N 1.41 3.68 -0.26 3.92 2.96 0.44 -1.01 118.68 129.82 3f0r s LEU 262 Ca -0.00 -0.58 -0.15 0.00 -0.22 0.00 0.00 54.13 53.18 3f0r s LEU 262 Cb -0.18 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 3f0r s LEU 262 CO 0.01 -0.14 0.37 -1.58 -1.32 0.00 0.00 176.35 173.68 3f0r s GLN 263 N 1.52 4.04 -0.71 1.98 2.00 0.41 -0.26 119.66 128.63 3f0r s GLN 263 Ca 0.04 0.06 0.04 0.00 -2.00 0.00 0.00 55.36 53.49 3f0r s GLN 263 Cb -0.16 -3.64 0.31 0.00 0.80 0.00 0.00 33.01 30.31 3f0r s GLN 263 CO 0.02 -0.24 1.07 1.28 -0.50 0.00 0.00 175.29 176.92 3f0r n LEU 264 N 5.21 4.88 -4.68 3.68 4.77 -0.39 -1.20 117.00 129.27 3f0r n LEU 264 Ca -0.09 -5.53 -0.43 0.00 -0.03 0.00 0.00 56.01 49.93 3f0r n LEU 264 Cb 0.51 -0.75 -0.01 0.00 -2.33 0.00 0.00 43.42 40.84 3f0r n LEU 264 CO 0.37 2.17 0.92 0.61 -1.33 0.00 0.00 177.39 180.13 3f0r n GLY 265 N 0.24 0.59 0.71 -0.72 0.00 -1.15 -4.67 105.19 100.20 3f0r n GLY 265 Ca 0.33 0.38 0.13 0.00 0.00 0.00 0.00 46.02 46.86 3f0r n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f0r n ALA 266 N 0.89 2.52 1.16 4.61 0.00 0.17 -4.30 120.51 125.57 3f0r n ALA 266 Ca 0.07 -0.57 0.00 0.00 0.00 0.00 0.00 53.44 52.94 3f0r n ALA 266 Cb 0.34 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.79 3f0r n ALA 266 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3f0r n ASP 267 N 0.72 0.41 -0.50 0.00 5.68 -1.11 -2.43 116.55 119.32 3f0r n ASP 267 Ca 0.17 -1.58 0.07 0.00 -0.50 0.00 0.00 54.79 52.95 3f0r n ASP 267 Cb 0.46 -0.21 0.05 0.00 -1.14 0.00 0.00 41.12 40.29 3f0r n ASP 267 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 3f0r n THR 268 N -0.18 0.00 -2.92 2.12 -2.24 -1.26 -4.64 114.28 105.15 3f0r n THR 268 Ca 0.00 -0.49 -0.40 0.00 -2.27 0.00 0.00 64.05 60.90 3f0r n THR 268 Cb 0.10 1.26 -0.05 0.00 -2.10 0.00 0.00 70.33 69.54 3f0r n THR 268 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3f0r s ILE 269 N -1.16 4.45 -0.06 2.28 -1.09 -1.02 -2.43 121.20 122.17 3f0r s ILE 269 Ca 0.15 1.78 -0.39 0.00 -2.23 0.00 0.00 60.65 59.96 3f0r s ILE 269 Cb 0.11 -4.18 -0.17 0.00 -1.58 0.00 0.00 42.46 36.64 3f0r s ILE 269 CO 0.18 0.45 1.41 0.00 -1.23 0.00 0.00 174.94 175.75 3f0r n ALA 270 N 2.09 -1.27 -0.11 9.38 0.00 0.60 -1.87 120.51 129.33 3f0r n ALA 270 Ca -0.03 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.91 3f0r n ALA 270 Cb 0.49 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.89 3f0r n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f0r n GLY 271 N 2.87 0.94 3.82 0.00 0.00 -1.26 -4.88 105.19 106.69 3f0r n GLY 271 Ca 0.22 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 3f0r n GLY 271 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3f0r s ASP 272 N -2.03 6.96 0.27 1.61 2.15 -0.78 -4.79 116.67 120.06 3f0r s ASP 272 Ca 0.00 1.16 -0.09 0.00 0.43 0.00 0.00 52.55 54.05 3f0r s ASP 272 Cb 0.00 -2.32 0.44 0.00 -0.30 0.00 0.00 42.92 40.74 3f0r s ASP 272 CO 0.00 0.24 1.57 -0.65 -0.17 0.00 0.00 175.17 176.16 3f0r h PRO 273 N 4.31 -0.00 -1.15 4.34 0.11 -1.91 1.55 132.00 139.25 3f0r h PRO 273 Ca -0.50 0.00 0.35 0.00 0.11 0.00 0.00 66.00 65.96 3f0r h PRO 273 Cb 1.21 0.00 -0.12 0.00 0.11 0.00 0.00 31.00 32.20 3f0r h PRO 273 CO 0.64 -0.00 0.73 0.52 -0.21 0.00 0.00 178.00 179.68 3f0r h MET 274 N -0.00 0.24 -6.60 1.05 2.86 -1.93 -3.45 114.93 107.11 3f0r h MET 274 Ca 0.46 -0.01 -0.52 0.00 -2.06 0.00 0.00 59.70 57.57 3f0r h MET 274 Cb 0.70 -0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.23 3f0r h MET 274 CO -0.99 0.16 -0.90 0.00 1.06 0.00 0.00 176.91 176.23 3f0r n SER 276 N -2.97 0.87 -4.93 0.00 7.64 -1.26 -4.97 113.62 108.00 3f0r n SER 276 Ca -0.31 0.14 -0.25 0.00 1.01 0.00 0.00 58.87 59.45 3f0r n SER 276 Cb 0.69 -0.43 0.07 0.00 -1.01 0.00 0.00 64.21 63.52 3f0r n SER 276 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3f0r s PHE 277 N -1.83 2.90 -0.43 1.43 0.40 -1.26 -0.81 117.98 118.38 3f0r s PHE 277 Ca -0.09 0.39 0.10 0.00 -0.60 0.00 0.00 56.93 56.73 3f0r s PHE 277 Cb 0.01 -3.15 0.36 0.00 0.51 0.00 0.00 43.02 40.75 3f0r s PHE 277 CO 0.13 -1.36 0.83 -1.71 0.70 0.00 0.00 175.22 173.81 3f0r n ASN 278 N -2.86 2.09 -4.99 1.36 5.15 0.31 -4.30 115.26 112.01 3f0r n ASN 278 Ca 0.08 -3.21 -0.19 0.00 -0.60 0.00 0.00 54.58 50.67 3f0r n ASN 278 Cb 0.60 -0.59 0.01 0.00 -0.53 0.00 0.00 39.78 39.28 3f0r n ASN 278 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 3f0r s MET 279 N -2.83 2.88 0.12 1.20 -1.94 -1.02 -4.23 119.30 113.48 3f0r s MET 279 Ca 0.42 -1.02 0.06 0.00 -1.71 0.00 0.00 55.69 53.44 3f0r s MET 279 Cb 0.34 -2.71 -0.04 0.00 2.01 0.00 0.00 34.83 34.44 3f0r s MET 279 CO -0.09 -0.26 -0.14 0.95 -0.01 0.00 0.00 175.02 175.47 3f0r s THR 280 N -2.40 1.35 0.55 2.05 -4.23 -1.26 -0.29 115.64 111.41 3f0r s THR 280 Ca 0.52 -1.70 0.32 0.00 -1.18 0.00 0.00 61.69 59.66 3f0r s THR 280 Cb -0.10 -1.52 0.48 0.00 1.34 0.00 0.00 72.50 72.70 3f0r s THR 280 CO 0.34 -0.39 1.85 -0.65 -0.54 0.00 0.00 174.62 175.23 3f0r h PRO 281 N 3.57 0.00 -0.44 3.99 0.11 -1.92 -1.05 132.00 136.25 3f0r h PRO 281 Ca -0.40 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.71 3f0r h PRO 281 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3f0r h PRO 281 CO 0.50 0.00 0.27 0.28 -0.21 0.00 0.00 178.00 178.84 3f0r h VAL 282 N 0.00 1.13 -0.45 3.15 2.07 -1.96 -0.48 116.25 119.72 3f0r h VAL 282 Ca 0.43 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.59 3f0r h VAL 282 Cb 1.81 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 32.10 3f0r h VAL 282 CO -0.00 0.13 0.04 1.23 0.02 0.00 0.00 177.57 178.99 3f0r h GLY 283 N 0.59 0.82 1.88 2.17 0.00 -1.55 -1.72 103.07 105.25 3f0r h GLY 283 Ca 0.16 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 46.89 3f0r h GLY 283 CO -0.03 0.53 -0.03 -2.22 0.00 0.00 0.00 176.54 174.79 3f0r h ILE 284 N 0.61 1.10 -0.28 2.60 1.08 -1.43 -1.78 117.51 119.41 3f0r h ILE 284 Ca 0.13 -0.40 -0.12 0.00 -0.39 0.00 0.00 64.86 64.08 3f0r h ILE 284 Cb 0.44 1.05 -0.01 0.00 -3.07 0.00 0.00 36.82 35.23 3f0r h ILE 284 CO 0.02 0.13 -0.34 1.23 -0.69 0.00 0.00 178.15 178.50 3f0r h GLY 285 N 0.43 0.67 1.57 5.37 0.00 -0.49 0.67 103.07 111.30 3f0r h GLY 285 Ca 0.04 -0.63 -0.08 0.00 0.00 0.00 0.00 47.33 46.66 3f0r h GLY 285 CO 0.01 0.57 -0.16 0.50 0.00 0.00 0.00 176.54 177.46 3f0r h LYS 286 N 0.52 0.51 -0.43 4.80 1.57 -0.46 0.31 116.57 123.39 3f0r h LYS 286 Ca 0.06 -0.16 -0.13 0.00 -1.87 0.00 0.00 60.65 58.55 3f0r h LYS 286 Cb 0.83 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 3f0r h LYS 286 CO 0.07 0.66 -0.23 0.00 -0.57 0.00 0.00 179.45 179.38 3f0r h LEU 288 N 0.75 0.52 -0.68 0.00 5.85 0.18 -2.81 115.31 119.13 3f0r h LEU 288 Ca 0.09 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 3f0r h LEU 288 Cb 0.80 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 3f0r h LEU 288 CO 0.07 0.49 0.34 0.11 -0.34 0.00 0.00 178.44 179.10 3f0r h LYS 289 N 0.52 0.97 -0.61 1.25 1.57 -0.37 0.41 116.57 120.31 3f0r h LYS 289 Ca 0.14 -0.13 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 3f0r h LYS 289 Cb 0.09 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 3f0r h LYS 289 CO -0.02 0.76 0.40 -0.92 -0.57 0.00 0.00 179.45 179.10 3f0r h TYR 290 N 0.94 0.66 0.10 -1.35 3.20 -1.29 0.17 116.97 119.40 3f0r h TYR 290 Ca 0.24 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.95 3f0r h TYR 290 Cb 0.09 -0.22 0.02 0.00 1.54 0.00 0.00 36.73 38.16 3f0r h TYR 290 CO 0.00 0.37 -0.72 0.82 -1.64 0.00 0.00 178.16 176.99 3f0r h ILE 291 N 0.67 1.51 0.00 1.81 2.04 -1.18 -3.16 117.51 119.20 3f0r h ILE 291 Ca 0.25 -2.41 -0.00 0.00 1.00 0.00 0.00 64.86 63.69 3f0r h ILE 291 Cb 0.15 3.07 -0.00 0.00 -0.74 0.00 0.00 36.82 39.29 3f0r h ILE 291 CO -0.07 0.68 -0.02 -0.07 0.00 0.00 0.00 178.15 178.68 3f0r h LEU 292 N -0.34 0.00 -1.57 1.44 3.38 -0.50 -0.39 115.31 117.33 3f0r h LEU 292 Ca -0.12 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 3f0r h LEU 292 Cb 1.53 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 3f0r h LEU 292 CO 0.14 0.02 -0.23 -0.61 0.09 0.00 0.00 178.44 177.85 3f0r h GLN 293 N 0.00 0.00 0.00 1.13 4.15 -0.64 -2.30 115.11 117.45 3f0r h GLN 293 Ca -0.00 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.39 3f0r h GLN 293 Cb 0.08 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.77 3f0r h GLN 293 CO 0.00 0.23 -0.13 -1.49 -1.93 0.00 0.00 178.83 175.51 3f0r h TRP 294 N 0.00 0.00 -0.08 3.99 6.55 -1.15 -3.46 115.95 121.80 3f0r h TRP 294 Ca -0.00 0.00 -0.04 0.00 0.95 0.00 0.00 58.89 59.80 3f0r h TRP 294 Cb 0.47 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.76 3f0r h TRP 294 CO 0.00 0.13 -0.03 1.04 -1.05 0.00 0.00 178.44 178.53 3f0r n GLN 295 N -3.57 -0.80 -1.83 0.49 1.13 -0.87 -5.01 117.38 106.92 3f0r n GLN 295 Ca -0.01 0.33 -0.29 0.00 -1.94 0.00 0.00 57.00 55.08 3f0r n GLN 295 Cb 0.27 -4.01 0.12 0.00 0.11 0.00 0.00 30.24 26.73 3f0r n GLN 295 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3f0r s LEU 296 N -0.39 2.43 0.04 1.08 1.43 -1.26 -4.98 118.68 117.02 3f0r s LEU 296 Ca 0.00 0.70 -0.30 0.00 -1.03 0.00 0.00 54.13 53.50 3f0r s LEU 296 Cb 0.00 -3.06 -0.06 0.00 0.03 0.00 0.00 46.19 43.10 3f0r s LEU 296 CO 0.00 -2.23 1.44 0.00 0.23 0.00 0.00 176.35 175.79 3f0r s ALA 297 N -3.58 3.60 -0.06 4.21 0.00 -1.23 -4.81 121.76 119.88 3f0r s ALA 297 Ca 0.65 0.99 0.01 0.00 0.00 0.00 0.00 51.96 53.61 3f0r s ALA 297 Cb -0.10 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.44 3f0r s ALA 297 CO 0.51 -0.88 -0.09 0.99 0.00 0.00 0.00 175.76 176.29 3f0r s THR 298 N 2.17 0.90 -0.32 0.00 2.01 0.22 0.51 115.64 121.13 3f0r s THR 298 Ca 0.66 -0.32 -0.10 0.00 0.31 0.00 0.00 61.69 62.24 3f0r s THR 298 Cb -0.34 -0.87 -0.00 0.00 0.01 0.00 0.00 72.50 71.30 3f0r s THR 298 CO 0.28 0.31 0.16 -0.22 -0.69 0.00 0.00 174.62 174.46 3f0r s LEU 299 N 0.92 4.20 -0.17 4.42 0.20 0.17 -0.37 118.68 128.05 3f0r s LEU 299 Ca -0.10 -0.61 -0.17 0.00 0.69 0.00 0.00 54.13 53.94 3f0r s LEU 299 Cb -0.15 -2.00 -0.04 0.00 -0.43 0.00 0.00 46.19 43.57 3f0r s LEU 299 CO 0.01 -0.23 0.45 -0.63 -0.29 0.00 0.00 176.35 175.66 3f0r s ILE 300 N 1.60 5.18 0.19 6.68 -1.09 0.24 -0.42 121.20 133.57 3f0r s ILE 300 Ca 0.04 0.84 0.11 0.00 -2.23 0.00 0.00 60.65 59.41 3f0r s ILE 300 Cb -0.17 -3.78 -0.04 0.00 -1.58 0.00 0.00 42.46 36.88 3f0r s ILE 300 CO 0.06 0.26 -0.24 -0.76 -1.23 0.00 0.00 174.94 173.03 3f0r s LEU 301 N 1.13 2.43 0.00 2.97 1.43 0.64 -1.18 118.68 126.09 3f0r s LEU 301 Ca 0.22 -0.86 0.00 0.00 -1.03 0.00 0.00 54.13 52.46 3f0r s LEU 301 Cb -0.15 -1.16 0.00 0.00 0.03 0.00 0.00 46.19 44.91 3f0r s LEU 301 CO 0.09 0.12 0.00 0.61 0.23 0.00 0.00 176.35 177.40 3f0r n GLY 302 N 0.31 0.52 0.00 -3.19 0.00 -1.10 -1.26 105.19 100.46 3f0r n GLY 302 Ca -0.13 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3f0r n GLY 302 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f0r n GLY 303 N 4.32 0.44 3.68 -0.02 0.00 -0.64 -2.74 105.19 110.23 3f0r n GLY 303 Ca 0.00 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.92 3f0r n GLY 303 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f0r n GLY 304 N 0.00 0.03 0.00 -0.02 0.00 -1.26 -4.77 105.19 99.17 3f0r n GLY 304 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3f0r n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f0r n GLY 305 N 0.79 1.26 0.00 -0.02 0.00 -1.26 0.46 105.19 106.43 3f0r n GLY 305 Ca 0.14 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.59 3f0r n GLY 305 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3f0r n TYR 306 N 0.00 0.00 -3.09 1.61 0.53 -1.26 -4.63 117.16 110.32 3f0r n TYR 306 Ca 0.00 0.00 -0.45 0.00 -1.02 0.00 0.00 57.90 56.43 3f0r n TYR 306 Cb 0.00 0.00 -0.02 0.00 -1.03 0.00 0.00 39.34 38.29 3f0r n TYR 306 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 3f0r s ASN 307 N -0.66 6.74 0.12 7.72 3.84 -1.26 -4.80 114.94 126.64 3f0r s ASN 307 Ca 0.00 -2.40 -0.24 0.00 0.21 0.00 0.00 52.86 50.43 3f0r s ASN 307 Cb 0.00 -2.32 -0.05 0.00 -0.55 0.00 0.00 41.25 38.32 3f0r s ASN 307 CO 0.00 -0.83 1.40 0.18 -2.79 0.00 0.00 177.10 175.06 3f0r n LEU 308 N 5.40 -0.83 -0.24 3.21 4.77 -1.26 -1.11 117.00 126.95 3f0r n LEU 308 Ca 0.21 1.59 0.03 0.00 -0.03 0.00 0.00 56.01 57.82 3f0r n LEU 308 Cb 0.48 -0.28 0.16 0.00 -2.33 0.00 0.00 43.42 41.44 3f0r n LEU 308 CO 0.45 -1.23 1.00 0.00 -1.33 0.00 0.00 177.39 176.28 3f0r h ALA 309 N 0.19 0.96 -0.48 -1.18 0.00 -1.93 -0.66 119.26 116.17 3f0r h ALA 309 Ca 0.12 0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 3f0r h ALA 309 Cb 0.32 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3f0r h ALA 309 CO -0.73 -0.21 0.02 -0.91 0.00 0.00 0.00 179.25 177.41 3f0r h ASN 310 N 0.42 0.74 -0.58 0.00 4.21 -1.63 0.29 115.58 119.03 3f0r h ASN 310 Ca 0.38 -0.17 -0.07 0.00 1.21 0.00 0.00 56.30 57.65 3f0r h ASN 310 Cb 0.55 -0.20 -0.02 0.00 -1.12 0.00 0.00 38.32 37.53 3f0r h ASN 310 CO -0.38 0.80 0.10 0.74 -1.29 0.00 0.00 177.43 177.40 3f0r h THR 311 N 0.73 1.26 -0.51 2.81 2.02 0.07 0.19 112.91 119.48 3f0r h THR 311 Ca 0.15 -0.97 -0.09 0.00 0.77 0.00 0.00 66.41 66.27 3f0r h THR 311 Cb 0.42 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 3f0r h THR 311 CO 0.02 0.35 -0.03 0.00 0.37 0.00 0.00 175.52 176.23 3f0r h ALA 312 N 1.01 0.69 -0.90 6.16 0.00 -0.72 0.57 119.26 126.07 3f0r h ALA 312 Ca 0.18 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3f0r h ALA 312 Cb 0.41 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 3f0r h ALA 312 CO 0.01 0.53 0.54 0.00 0.00 0.00 0.00 179.25 180.33 3f0r h ARG 313 N 0.79 1.23 -0.09 0.00 3.08 0.05 -2.68 114.38 116.76 3f0r h ARG 313 Ca 0.14 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 3f0r h ARG 313 Cb 0.56 -0.26 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 3f0r h ARG 313 CO 0.03 0.86 -0.09 0.00 -1.07 0.00 0.00 179.97 179.70 3f0r h TRP 315 N -0.19 0.10 -0.13 0.00 6.55 -0.85 -1.14 115.95 120.30 3f0r h TRP 315 Ca 0.02 -0.04 -0.21 0.00 0.95 0.00 0.00 58.89 59.61 3f0r h TRP 315 Cb 0.60 -0.02 0.01 0.00 -0.86 0.00 0.00 29.16 28.90 3f0r h TRP 315 CO 0.09 0.68 -0.73 1.79 -1.05 0.00 0.00 178.44 179.22 3f0r h THR 316 N 0.06 1.30 -0.35 1.49 1.35 -1.58 -0.17 112.91 115.00 3f0r h THR 316 Ca -0.01 -1.96 0.06 0.00 -0.55 0.00 0.00 66.41 63.96 3f0r h THR 316 Cb 1.12 2.07 -0.06 0.00 -1.73 0.00 0.00 68.15 69.55 3f0r h THR 316 CO 0.09 0.61 -0.00 0.22 -0.25 0.00 0.00 175.52 176.19 3f0r h TYR 317 N 0.42 -0.03 -0.13 4.73 3.20 -1.42 0.34 116.97 124.08 3f0r h TYR 317 Ca -0.05 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 3f0r h TYR 317 Cb 1.37 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.69 3f0r h TYR 317 CO 0.10 -0.07 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.40 3f0r h LEU 318 N 0.09 0.18 0.23 2.82 3.38 -1.10 0.20 115.31 121.11 3f0r h LEU 318 Ca 0.17 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3f0r h LEU 318 Cb 0.24 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3f0r h LEU 318 CO -0.29 0.28 -0.11 0.74 0.09 0.00 0.00 178.44 179.16 3f0r h THR 319 N 0.19 0.82 -0.73 0.22 2.02 0.10 -0.60 112.91 114.93 3f0r h THR 319 Ca 0.04 -0.24 0.14 0.00 0.77 0.00 0.00 66.41 67.13 3f0r h THR 319 Cb 0.26 0.96 -0.05 0.00 -1.74 0.00 0.00 68.15 67.58 3f0r h THR 319 CO 0.01 0.05 0.49 1.23 0.37 0.00 0.00 175.52 177.68 3f0r h GLY 320 N -0.42 0.69 1.40 2.16 0.00 0.43 0.49 103.07 107.82 3f0r h GLY 320 Ca -0.03 -0.18 -0.06 0.00 0.00 0.00 0.00 47.33 47.06 3f0r h GLY 320 CO 0.05 0.07 0.03 -2.08 0.00 0.00 0.00 176.54 174.61 3f0r h VAL 321 N 0.42 1.23 -0.12 4.60 2.07 -0.09 0.29 116.25 124.65 3f0r h VAL 321 Ca 0.36 -0.91 -0.12 0.00 0.82 0.00 0.00 66.70 66.84 3f0r h VAL 321 Cb 0.80 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3f0r h VAL 321 CO -0.11 0.32 -0.41 0.40 0.02 0.00 0.00 177.57 177.79 3f0r h ILE 322 N 0.70 1.37 0.00 4.57 2.04 0.14 -2.70 117.51 123.63 3f0r h ILE 322 Ca 0.14 -1.73 0.00 0.00 1.00 0.00 0.00 64.86 64.28 3f0r h ILE 322 Cb 0.38 2.14 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 3f0r h ILE 322 CO 0.01 0.52 0.00 0.18 0.00 0.00 0.00 178.15 178.86 3f0r n LEU 323 N -4.30 0.00 -0.64 1.44 7.99 0.44 -4.84 117.00 117.09 3f0r n LEU 323 Ca -0.07 0.49 -0.07 0.00 -0.01 0.00 0.00 56.01 56.35 3f0r n LEU 323 Cb 0.55 -0.49 -0.01 0.00 -0.11 0.00 0.00 43.42 43.35 3f0r n LEU 323 CO 0.45 -0.30 -0.08 0.61 -1.51 0.00 0.00 177.39 176.56 3f0r n GLY 324 N -0.33 0.46 3.36 -0.72 0.00 -0.12 -5.03 105.19 102.81 3f0r n GLY 324 Ca 0.03 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 3f0r n GLY 324 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f0r s LYS 325 N -3.53 1.34 -0.23 1.61 1.02 0.85 -5.00 119.74 115.79 3f0r s LYS 325 Ca 0.00 -1.39 -0.09 0.00 0.02 0.00 0.00 55.97 54.50 3f0r s LYS 325 Cb 0.00 -1.57 -0.04 0.00 -0.52 0.00 0.00 37.83 35.70 3f0r s LYS 325 CO 0.00 0.34 0.12 0.95 -0.92 0.00 0.00 175.35 175.84 3f0r s THR 326 N -1.65 4.98 0.62 2.17 -4.23 -1.26 -4.02 115.64 112.24 3f0r s THR 326 Ca 0.15 0.05 -0.10 0.00 -1.18 0.00 0.00 61.69 60.62 3f0r s THR 326 Cb -0.08 -3.31 -0.02 0.00 1.34 0.00 0.00 72.50 70.43 3f0r s THR 326 CO 0.07 0.36 1.00 -0.76 -0.54 0.00 0.00 174.62 174.74 3f0r s LEU 327 N 1.14 3.20 0.24 4.79 1.02 -1.26 -5.04 118.68 122.77 3f0r s LEU 327 Ca 0.06 1.19 -0.28 0.00 0.02 0.00 0.00 54.13 55.13 3f0r s LEU 327 Cb -0.14 -4.14 -0.09 0.00 0.02 0.00 0.00 46.19 41.84 3f0r s LEU 327 CO 0.04 -0.97 0.90 -0.94 0.02 0.00 0.00 176.35 175.40 3f0r s SER 328 N -4.23 7.50 0.50 2.29 1.04 -1.26 -4.93 113.70 114.61 3f0r s SER 328 Ca 0.55 1.84 0.27 0.00 0.48 0.00 0.00 55.95 59.08 3f0r s SER 328 Cb -0.11 -2.57 1.35 0.00 0.10 0.00 0.00 66.02 64.79 3f0r s SER 328 CO 0.51 0.12 1.88 -1.28 0.98 0.00 0.00 173.24 175.44 3f0r h SER 329 N 3.94 0.14 -3.36 7.02 0.87 -1.99 -3.41 113.55 116.75 3f0r h SER 329 Ca -0.46 0.02 -0.56 0.00 -1.23 0.00 0.00 61.79 59.56 3f0r h SER 329 Cb 1.20 -0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 63.09 3f0r h SER 329 CO 0.67 0.05 0.05 -1.61 -0.53 0.00 0.00 176.83 175.46 3f0r s GLU 330 N -5.13 4.42 -0.16 2.24 2.02 -1.26 -1.34 118.70 119.49 3f0r s GLU 330 Ca -0.06 0.82 -0.29 0.00 0.02 0.00 0.00 54.97 55.46 3f0r s GLU 330 Cb 0.22 -3.44 -0.05 0.00 0.10 0.00 0.00 34.13 30.96 3f0r s GLU 330 CO 0.78 0.08 1.81 0.42 0.02 0.00 0.00 175.26 178.36 3f0r s ILE 331 N 0.76 3.42 0.53 -1.63 -1.09 -1.01 -4.87 121.20 117.31 3f0r s ILE 331 Ca 0.36 0.47 -0.21 0.00 -2.23 0.00 0.00 60.65 59.05 3f0r s ILE 331 Cb -0.17 -3.42 -0.05 0.00 -1.58 0.00 0.00 42.46 37.24 3f0r s ILE 331 CO 0.17 -0.16 1.21 -2.16 -1.23 0.00 0.00 174.94 172.77 3f0r s PRO 332 N 4.92 3.31 0.28 2.79 0.04 -1.26 -4.93 135.00 140.15 3f0r s PRO 332 Ca 0.81 1.85 -0.30 0.00 0.04 0.00 0.00 61.00 63.40 3f0r s PRO 332 Cb -0.31 -2.15 -0.10 0.00 0.04 0.00 0.00 34.50 31.98 3f0r s PRO 332 CO 0.33 -0.94 1.45 0.34 0.04 0.00 0.00 177.00 178.22 3f0r s ASP 333 N -1.43 6.59 0.22 6.66 2.15 -1.26 -4.89 116.67 124.70 3f0r s ASP 333 Ca 0.71 2.76 -0.22 0.00 0.43 0.00 0.00 52.55 56.24 3f0r s ASP 333 Cb -0.31 -2.63 0.06 0.00 -0.30 0.00 0.00 42.92 39.74 3f0r s ASP 333 CO 0.35 -0.73 0.92 -1.38 -0.17 0.00 0.00 175.17 174.16 3f0r s HIS 334 N -0.30 -0.05 0.32 -5.34 -3.43 -1.26 -4.95 115.29 100.28 3f0r s HIS 334 Ca 0.58 -0.37 0.12 0.00 -0.80 0.00 0.00 55.06 54.59 3f0r s HIS 334 Cb -0.43 0.70 1.03 0.00 -1.43 0.00 0.00 32.58 32.44 3f0r s HIS 334 CO 0.48 -1.03 1.44 -1.91 -2.00 0.00 0.00 174.74 171.71 3f0r n GLU 335 N -0.54 -0.06 -0.52 -0.38 2.13 -1.26 -0.35 120.64 119.66 3f0r n GLU 335 Ca -0.05 1.30 0.08 0.00 0.66 0.00 0.00 57.16 59.15 3f0r n GLU 335 Cb 0.60 -2.23 0.30 0.00 0.27 0.00 0.00 31.44 30.38 3f0r n GLU 335 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 3f0r n PHE 336 N -5.17 1.21 -0.29 4.31 3.01 -1.26 -4.71 117.46 114.56 3f0r n PHE 336 Ca 0.30 -0.69 -0.02 0.00 1.01 0.00 0.00 57.45 58.05 3f0r n PHE 336 Cb 0.99 -0.26 0.04 0.00 -0.01 0.00 0.00 39.48 40.24 3f0r n PHE 336 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 3f0r h PHE 337 N 2.98 -0.90 0.00 1.38 3.57 -1.04 0.19 116.94 123.11 3f0r h PHE 337 Ca 0.00 0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3f0r h PHE 337 Cb 1.39 0.51 0.00 0.00 2.79 0.00 0.00 35.95 40.65 3f0r h PHE 337 CO 0.63 -0.39 0.08 0.25 -2.23 0.00 0.00 178.31 176.65 3f0r n THR 338 N -5.47 0.85 0.81 4.41 -2.24 -1.26 -1.31 114.28 110.07 3f0r n THR 338 Ca 0.08 0.29 0.09 0.00 -2.27 0.00 0.00 64.05 62.24 3f0r n THR 338 Cb 0.39 -1.29 -0.02 0.00 -2.10 0.00 0.00 70.33 67.31 3f0r n THR 338 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f0r n ALA 339 N -1.16 3.46 -3.08 6.98 0.00 0.66 -4.84 120.51 122.53 3f0r n ALA 339 Ca 0.00 -0.56 -0.45 0.00 0.00 0.00 0.00 53.44 52.43 3f0r n ALA 339 Cb 0.08 -0.64 -0.01 0.00 0.00 0.00 0.00 19.45 18.88 3f0r n ALA 339 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3f0r s TYR 340 N -2.18 3.58 0.29 0.00 1.51 -0.43 -4.79 117.35 115.34 3f0r s TYR 340 Ca 0.14 -2.01 0.00 0.00 -1.01 0.00 0.00 57.07 54.19 3f0r s TYR 340 Cb 0.14 -4.13 0.00 0.00 -0.11 0.00 0.00 41.96 37.86 3f0r s TYR 340 CO 0.50 -1.27 0.00 0.41 -1.11 0.00 0.00 175.55 174.08 3f0r n GLY 341 N 4.22 -1.99 0.67 0.71 0.00 -1.26 -2.47 105.19 105.06 3f0r n GLY 341 Ca 0.27 -1.23 0.09 0.00 0.00 0.00 0.00 46.02 45.14 3f0r n GLY 341 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3f0r n PRO 342 N -3.58 1.86 0.00 1.61 -0.04 -1.26 -4.30 135.00 129.29 3f0r n PRO 342 Ca -0.01 -1.31 0.00 0.00 -0.04 0.00 0.00 63.50 62.15 3f0r n PRO 342 Cb 0.50 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 3f0r n PRO 342 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3f0r n ASP 343 N 0.54 1.79 -3.83 3.54 9.92 -1.26 -5.05 116.55 122.20 3f0r n ASP 343 Ca 0.15 -0.12 -0.24 0.00 -0.53 0.00 0.00 54.79 54.05 3f0r n ASP 343 Cb 0.35 0.60 0.01 0.00 -0.64 0.00 0.00 41.12 41.44 3f0r n ASP 343 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 3f0r n TYR 344 N -0.77 -1.89 -4.39 1.24 4.02 -1.03 -4.96 117.16 109.37 3f0r n TYR 344 Ca 0.00 0.82 -0.20 0.00 -0.01 0.00 0.00 57.90 58.51 3f0r n TYR 344 Cb 0.00 -4.08 -0.10 0.00 -0.02 0.00 0.00 39.34 35.14 3f0r n TYR 344 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 3f0r s VAL 345 N -3.68 1.70 -0.15 -0.72 -7.23 -1.26 -2.41 120.40 106.66 3f0r s VAL 345 Ca 0.14 -2.17 -0.26 0.00 -1.81 0.00 0.00 61.98 57.88 3f0r s VAL 345 Cb -0.07 -2.27 -0.25 0.00 0.56 0.00 0.00 36.38 34.35 3f0r s VAL 345 CO 0.84 -0.43 0.63 0.25 -0.31 0.00 0.00 175.10 176.08 3f0r h LEU 346 N 2.40 0.06 -9.61 1.32 5.85 -1.50 -3.45 115.31 110.38 3f0r h LEU 346 Ca -0.39 -0.86 -0.58 0.00 0.84 0.00 0.00 57.88 56.89 3f0r h LEU 346 Cb 1.23 -0.02 0.17 0.00 0.37 0.00 0.00 40.66 42.41 3f0r h LEU 346 CO 0.65 1.19 -0.27 -0.62 -0.34 0.00 0.00 178.44 179.05 3f0r n GLU 347 N -4.49 0.56 -4.57 1.25 4.71 -1.26 -4.88 120.64 111.95 3f0r n GLU 347 Ca -0.17 0.22 -0.30 0.00 -0.01 0.00 0.00 57.16 56.90 3f0r n GLU 347 Cb 0.58 -1.84 -0.13 0.00 -1.01 0.00 0.00 31.44 29.05 3f0r n GLU 347 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 3f0r s ILE 348 N -1.71 2.62 -0.21 -3.67 1.01 -1.26 -5.12 121.20 112.86 3f0r s ILE 348 Ca 0.70 -1.38 -0.07 0.00 0.00 0.00 0.00 60.65 59.90 3f0r s ILE 348 Cb -0.42 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 39.90 3f0r s ILE 348 CO 0.53 0.25 0.04 -0.89 0.00 0.00 0.00 174.94 174.87 3f0r s THR 349 N -0.98 4.33 0.19 2.92 2.01 -1.26 -4.93 115.64 117.92 3f0r s THR 349 Ca 0.15 -0.18 -0.31 0.00 0.31 0.00 0.00 61.69 61.66 3f0r s THR 349 Cb -0.10 -2.98 -0.10 0.00 0.01 0.00 0.00 72.50 69.33 3f0r s THR 349 CO 0.06 0.40 1.53 -2.16 -0.69 0.00 0.00 174.62 173.76 3f0r s PRO 350 N 1.06 4.23 1.11 4.92 0.04 -1.26 -4.83 135.00 140.27 3f0r s PRO 350 Ca 0.03 2.35 -0.13 0.00 0.04 0.00 0.00 61.00 63.29 3f0r s PRO 350 Cb -0.14 -3.14 0.25 0.00 0.04 0.00 0.00 34.50 31.51 3f0r s PRO 350 CO 0.03 -0.55 1.05 -1.54 0.04 0.00 0.00 177.00 176.02 3f0r s SER 351 N 0.91 1.52 -0.96 6.66 1.04 -1.26 -4.93 113.70 116.68 3f0r s SER 351 Ca 0.67 1.36 -0.15 0.00 0.48 0.00 0.00 55.95 58.30 3f0r s SER 351 Cb -0.43 -2.11 0.18 0.00 0.10 0.00 0.00 66.02 63.76 3f0r s SER 351 CO 0.35 -3.84 1.06 0.00 0.98 0.00 0.00 173.24 171.79 3f0r s ARG 353 N 1.29 0.72 0.56 0.00 0.52 -1.26 -5.15 118.95 115.63 3f0r s ARG 353 Ca 0.29 -1.01 -0.15 0.00 -0.52 0.00 0.00 55.73 54.34 3f0r s ARG 353 Cb -0.07 -0.43 -0.06 0.00 0.52 0.00 0.00 34.95 34.91 3f0r s ARG 353 CO -0.08 0.07 1.01 -1.25 0.02 0.00 0.00 175.30 175.07 3f0r s PRO 354 N -2.37 3.73 -0.97 3.54 0.04 -1.26 -4.98 135.00 132.73 3f0r s PRO 354 Ca -0.00 0.96 -0.20 0.00 0.04 0.00 0.00 61.00 61.79 3f0r s PRO 354 Cb -0.05 -2.10 0.10 0.00 0.04 0.00 0.00 34.50 32.49 3f0r s PRO 354 CO -0.00 -0.46 1.25 0.34 0.04 0.00 0.00 177.00 178.17 3f0r s ASP 355 N -3.28 6.59 -0.28 6.66 -1.08 -1.26 -4.25 116.67 119.78 3f0r s ASP 355 Ca 0.59 -1.84 -0.06 0.00 -0.52 0.00 0.00 52.55 50.71 3f0r s ASP 355 Cb -0.11 -2.46 -0.22 0.00 -1.46 0.00 0.00 42.92 38.67 3f0r s ASP 355 CO 0.38 -1.22 3.47 0.54 0.52 0.00 0.00 175.17 178.86 3f0r n ARG 356 N 7.39 2.30 -3.28 4.34 1.74 -0.59 -4.53 116.66 124.03 3f0r n ARG 356 Ca 0.27 -1.28 -0.06 0.00 -0.77 0.00 0.00 57.85 56.01 3f0r n ARG 356 Cb 0.50 -2.13 -0.05 0.00 -1.02 0.00 0.00 32.46 29.75 3f0r n ARG 356 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3f0r s ASN 357 N 1.91 -0.06 0.36 0.55 4.22 -1.26 -4.64 114.94 116.01 3f0r s ASN 357 Ca 0.67 -0.03 -0.28 0.00 -2.14 0.00 0.00 52.86 51.07 3f0r s ASN 357 Cb 0.30 1.32 -0.11 0.00 1.28 0.00 0.00 41.25 44.04 3f0r s ASN 357 CO -0.02 -0.32 1.47 -0.62 -2.04 0.00 0.00 177.10 175.57 3f0r n GLU 358 N 5.37 2.59 0.00 3.55 4.71 -1.26 -4.81 120.64 130.78 3f0r n GLU 358 Ca -0.00 0.91 0.00 0.00 -0.01 0.00 0.00 57.16 58.06 3f0r n GLU 358 Cb 0.50 -2.63 0.00 0.00 -1.01 0.00 0.00 31.44 28.31 3f0r n GLU 358 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 3f0r n PRO 359 N 0.75 0.00 0.13 3.49 -0.04 -1.26 -2.13 135.00 135.93 3f0r n PRO 359 Ca 0.03 0.06 -0.10 0.00 -0.04 0.00 0.00 63.50 63.45 3f0r n PRO 359 Cb 0.38 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.28 3f0r n PRO 359 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3f0r h HIS 360 N 0.00 -0.38 0.00 0.54 3.86 -2.00 -2.14 115.15 115.03 3f0r h HIS 360 Ca 0.00 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.16 3f0r h HIS 360 Cb 0.00 0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.59 3f0r h HIS 360 CO 0.00 -0.08 -0.19 -0.09 0.86 0.00 0.00 177.93 178.43 3f0r h ARG 361 N -1.00 0.00 -0.23 2.45 9.65 -1.80 -2.77 114.38 120.68 3f0r h ARG 361 Ca -0.04 0.00 -0.10 0.00 -1.10 0.00 0.00 59.98 58.73 3f0r h ARG 361 Cb 0.47 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.05 3f0r h ARG 361 CO 0.07 0.19 -0.27 0.82 2.80 0.00 0.00 179.97 183.58 3f0r h ILE 362 N 0.00 1.32 0.00 1.20 2.04 -1.56 -2.18 117.51 118.34 3f0r h ILE 362 Ca -0.00 -1.45 -0.11 0.00 1.00 0.00 0.00 64.86 64.30 3f0r h ILE 362 Cb 0.56 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 3f0r h ILE 362 CO 0.02 0.45 -0.51 -0.61 0.00 0.00 0.00 178.15 177.51 3f0r h GLN 363 N 0.27 0.00 0.64 2.37 5.75 -1.23 0.23 115.11 123.15 3f0r h GLN 363 Ca 0.03 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.50 3f0r h GLN 363 Cb 0.83 0.00 0.01 0.00 1.07 0.00 0.00 27.48 29.39 3f0r h GLN 363 CO 0.06 0.51 -0.31 1.96 -2.65 0.00 0.00 178.83 178.41 3f0r h GLN 364 N 0.00 -0.82 -0.57 1.69 4.20 -1.42 0.35 115.11 118.53 3f0r h GLN 364 Ca -0.01 0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.77 3f0r h GLN 364 Cb 0.92 0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.86 3f0r h GLN 364 CO 0.07 -0.52 0.38 0.82 -0.67 0.00 0.00 178.83 178.90 3f0r h ILE 365 N -0.96 1.14 -0.58 2.54 2.04 -1.29 0.16 117.51 120.56 3f0r h ILE 365 Ca -0.09 -0.26 -0.07 0.00 1.00 0.00 0.00 64.86 65.44 3f0r h ILE 365 Cb 0.69 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 3f0r h ILE 365 CO 0.14 0.14 0.07 -0.07 0.00 0.00 0.00 178.15 178.43 3f0r h LEU 366 N 0.76 0.90 0.01 1.44 3.38 -0.14 -2.98 115.31 118.68 3f0r h LEU 366 Ca 0.21 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3f0r h LEU 366 Cb -0.07 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.44 3f0r h LEU 366 CO -0.05 0.92 -0.00 0.78 0.09 0.00 0.00 178.44 180.18 3f0r h ASN 367 N 0.89 -0.01 -0.97 -0.43 4.21 0.58 -2.67 115.58 117.18 3f0r h ASN 367 Ca 0.18 -0.83 0.30 0.00 1.21 0.00 0.00 56.30 57.16 3f0r h ASN 367 Cb 0.42 0.00 -0.17 0.00 -1.12 0.00 0.00 38.32 37.45 3f0r h ASN 367 CO 0.01 0.85 0.19 0.22 -1.29 0.00 0.00 177.43 177.41 3f0r h TYR 368 N -0.89 0.24 -0.03 1.19 3.20 -0.76 0.12 116.97 120.04 3f0r h TYR 368 Ca -0.00 0.06 -0.11 0.00 3.14 0.00 0.00 58.73 61.82 3f0r h TYR 368 Cb 0.83 0.05 0.01 0.00 1.54 0.00 0.00 36.73 39.16 3f0r h TYR 368 CO 0.22 -0.39 -0.40 0.97 -1.64 0.00 0.00 178.16 176.92 3f0r h ILE 369 N 0.05 1.46 -1.01 1.81 2.10 -1.61 -1.84 117.51 118.47 3f0r h ILE 369 Ca 0.65 -1.92 0.25 0.00 1.08 0.00 0.00 64.86 64.92 3f0r h ILE 369 Cb 1.44 2.55 -0.12 0.00 -1.09 0.00 0.00 36.82 39.60 3f0r h ILE 369 CO -0.83 0.55 0.60 0.11 -1.08 0.00 0.00 178.15 177.50 3f0r h LYS 370 N -0.24 0.55 0.04 2.19 1.57 -0.47 0.27 116.57 120.47 3f0r h LYS 370 Ca -0.04 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.70 3f0r h LYS 370 Cb 1.11 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.29 3f0r h LYS 370 CO 0.08 0.36 -0.02 0.78 -0.57 0.00 0.00 179.45 180.08 3f0r h GLY 371 N 0.56 -0.05 -0.18 3.86 0.00 -1.13 -3.10 103.07 103.02 3f0r h GLY 371 Ca 0.64 0.02 0.29 0.00 0.00 0.00 0.00 47.33 48.28 3f0r h GLY 371 CO -0.46 -0.02 0.72 3.43 0.00 0.00 0.00 176.54 180.21 3f0r h ASN 372 N -0.64 0.29 0.83 0.19 -0.26 -0.03 0.83 115.58 116.78 3f0r h ASN 372 Ca -0.01 0.06 0.00 0.00 -0.56 0.00 0.00 56.30 55.79 3f0r h ASN 372 Cb 0.58 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.85 3f0r h ASN 372 CO 0.01 0.05 0.00 0.18 -1.06 0.00 0.00 177.43 176.61 3f0r n LEU 373 N -4.48 0.16 0.04 1.61 4.77 0.71 -2.74 117.00 117.07 3f0r n LEU 373 Ca 0.25 0.53 -0.13 0.00 -0.03 0.00 0.00 56.01 56.62 3f0r n LEU 373 Cb 0.99 -0.49 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 3f0r n LEU 373 CO 0.30 -0.17 0.26 0.11 -1.33 0.00 0.00 177.39 176.56 3f0r h LYS 374 N 0.00 0.49 0.00 3.23 1.57 0.70 -2.95 116.57 119.62 3f0r h LYS 374 Ca 0.00 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3f0r h LYS 374 Cb 0.42 0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3f0r h LYS 374 CO 0.00 1.09 0.00 0.72 -0.57 0.00 0.00 179.45 180.69 3f0r n HIS 375 N -3.82 0.49 -2.57 -1.35 8.25 -1.11 -4.57 115.22 110.54 3f0r n HIS 375 Ca -0.06 0.22 -0.43 0.00 -0.26 0.00 0.00 57.72 57.19 3f0r n HIS 375 Cb 0.77 -0.85 -0.02 0.00 1.12 0.00 0.00 29.99 31.01 3f0r n HIS 375 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3f0r s VAL 376 N -3.27 4.32 -2.18 1.59 1.01 -1.12 -5.05 120.40 115.70 3f0r s VAL 376 Ca 0.02 1.48 0.31 0.00 0.00 0.00 0.00 61.98 63.78 3f0r s VAL 376 Cb 0.07 -4.40 0.78 0.00 0.00 0.00 0.00 36.38 32.83 3f0r s VAL 376 CO 0.24 -0.62 2.05 0.52 0.00 0.00 0.00 175.10 177.29