#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pwv n ARG 28 N 0.00 1.56 0.03 5.31 0.63 -1.26 -4.36 116.66 118.56 1pwv n ARG 28 Ca 0.00 -0.04 -0.07 0.00 -0.92 0.00 0.00 57.85 56.82 1pwv n ARG 28 Cb 0.00 -1.21 0.10 0.00 0.45 0.00 0.00 32.46 31.80 1pwv n ARG 28 CO 0.00 0.00 0.00 -0.97 -2.51 0.00 0.00 177.63 174.15 1pwv h ASN 29 N 0.00 0.50 0.14 6.15 -1.24 -2.06 -3.01 115.58 116.07 1pwv h ASN 29 Ca -0.12 -0.26 -0.01 0.00 0.71 0.00 0.00 56.30 56.63 1pwv h ASN 29 Cb 0.98 -0.14 -0.00 0.00 0.73 0.00 0.00 38.32 39.89 1pwv h ASN 29 CO 0.01 0.93 -0.06 0.11 -1.29 0.00 0.00 177.43 177.12 1pwv h LYS 30 N 0.36 0.00 -0.29 6.67 1.57 -2.00 -0.57 116.57 122.32 1pwv h LYS 30 Ca 0.01 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.65 1pwv h LYS 30 Cb 1.02 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1pwv h LYS 30 CO 0.09 0.06 -0.40 1.15 -0.57 0.00 0.00 179.45 179.78 1pwv h THR 31 N 0.00 1.29 0.10 -0.16 2.02 -1.72 0.23 112.91 114.66 1pwv h THR 31 Ca -0.00 -1.57 -0.00 0.00 0.77 0.00 0.00 66.41 65.60 1pwv h THR 31 Cb 0.15 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.06 1pwv h THR 31 CO 0.01 0.51 -0.05 1.56 0.37 0.00 0.00 175.52 177.91 1pwv h GLN 32 N 0.56 -0.13 -0.17 6.66 4.20 -1.14 1.76 115.11 126.86 1pwv h GLN 32 Ca 0.05 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.76 1pwv h GLN 32 Cb 0.93 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.73 1pwv h GLN 32 CO 0.08 -0.02 0.06 0.93 -0.67 0.00 0.00 178.83 179.22 1pwv h GLU 33 N -0.21 0.23 -0.05 1.46 4.39 -1.28 -0.14 114.58 118.98 1pwv h GLU 33 Ca -0.01 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 1pwv h GLU 33 Cb 0.17 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1pwv h GLU 33 CO 0.02 0.20 0.00 0.93 -1.16 0.00 0.00 179.01 179.01 1pwv h GLU 34 N 0.23 0.09 -0.96 2.33 5.08 0.54 -2.73 114.58 119.16 1pwv h GLU 34 Ca 0.06 -0.03 0.09 0.00 -1.00 0.00 0.00 59.36 58.48 1pwv h GLU 34 Cb 0.06 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.23 1pwv h GLU 34 CO -0.01 0.35 0.62 1.25 -1.00 0.00 0.00 179.01 180.22 1pwv h HIS 35 N -0.19 1.09 0.00 4.33 2.76 0.38 -2.94 115.15 120.59 1pwv h HIS 35 Ca 0.01 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1pwv h HIS 35 Cb 0.31 -0.35 0.00 0.00 1.55 0.00 0.00 27.41 28.92 1pwv h HIS 35 CO 0.03 0.51 0.00 -0.11 -1.30 0.00 0.00 177.93 177.06 1pwv n LEU 36 N -4.54 0.00 -0.25 0.26 7.94 -0.18 -2.38 117.00 117.85 1pwv n LEU 36 Ca 0.16 0.81 0.14 0.00 -1.11 0.00 0.00 56.01 56.01 1pwv n LEU 36 Cb 0.27 -0.31 0.26 0.00 0.53 0.00 0.00 43.42 44.18 1pwv n LEU 36 CO 0.31 -0.31 0.63 0.29 -1.11 0.00 0.00 177.39 177.20 1pwv n LYS 37 N -1.62 -0.06 0.09 1.96 5.02 -1.04 -0.46 118.16 122.05 1pwv n LYS 37 Ca 0.00 1.08 -0.07 0.00 -2.02 0.00 0.00 58.31 57.31 1pwv n LYS 37 Cb 0.00 -1.77 -0.04 0.00 -0.02 0.00 0.00 35.03 33.20 1pwv n LYS 37 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1pwv h GLU 38 N 0.00 -0.34 -0.78 1.97 4.57 -1.33 -0.68 114.58 117.99 1pwv h GLU 38 Ca 0.49 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 58.76 1pwv h GLU 38 Cb 1.08 0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 29.69 1pwv h GLU 38 CO -0.67 -0.23 0.45 0.82 -1.18 0.00 0.00 179.01 178.21 1pwv h ILE 39 N -0.36 0.97 -0.30 2.32 2.04 -0.38 -2.19 117.51 119.61 1pwv h ILE 39 Ca -0.02 -0.28 0.06 0.00 1.00 0.00 0.00 64.86 65.62 1pwv h ILE 39 Cb 0.32 0.09 -0.08 0.00 -0.74 0.00 0.00 36.82 36.42 1pwv h ILE 39 CO -0.05 0.15 -0.46 0.24 0.00 0.00 0.00 178.15 178.03 1pwv h MET 40 N 0.80 -0.39 -0.74 2.37 2.86 -0.68 -0.49 114.93 118.66 1pwv h MET 40 Ca 0.35 0.03 0.28 0.00 -2.06 0.00 0.00 59.70 58.31 1pwv h MET 40 Cb 0.24 0.09 -0.11 0.00 0.06 0.00 0.00 31.60 31.89 1pwv h MET 40 CO -0.20 -0.26 0.43 1.63 1.06 0.00 0.00 176.91 179.57 1pwv n LYS 41 N -5.42 -0.03 0.00 1.72 5.02 -0.28 -0.67 118.16 118.50 1pwv n LYS 41 Ca -0.02 0.86 0.00 0.00 -2.02 0.00 0.00 58.31 57.12 1pwv n LYS 41 Cb 0.36 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.77 1pwv n LYS 41 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1pwv n HIS 42 N -4.26 0.00 -0.13 2.13 8.25 -0.21 -4.61 115.22 116.39 1pwv n HIS 42 Ca 0.25 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.86 1pwv n HIS 42 Cb 0.90 0.00 0.52 0.00 1.12 0.00 0.00 29.99 32.53 1pwv n HIS 42 CO 0.00 0.00 0.00 -0.84 0.64 0.00 0.00 176.34 176.14 1pwv h ILE 43 N 0.00 0.82 -3.31 1.59 3.07 -1.38 -3.39 117.51 114.91 1pwv h ILE 43 Ca 0.00 -0.13 -0.60 0.00 1.55 0.00 0.00 64.86 65.68 1pwv h ILE 43 Cb 0.00 0.41 -0.11 0.00 -0.27 0.00 0.00 36.82 36.84 1pwv h ILE 43 CO 0.00 0.07 0.60 -0.69 -1.05 0.00 0.00 178.15 177.08 1pwv s VAL 44 N -5.37 4.38 -0.20 0.16 1.01 0.16 0.04 120.40 120.57 1pwv s VAL 44 Ca -0.08 0.44 0.01 0.00 0.00 0.00 0.00 61.98 62.35 1pwv s VAL 44 Cb 0.20 -4.53 0.03 0.00 0.00 0.00 0.00 36.38 32.08 1pwv s VAL 44 CO 0.76 -1.07 -0.17 -0.54 0.00 0.00 0.00 175.10 174.08 1pwv s LYS 45 N 3.98 2.84 0.07 2.72 1.02 -0.37 -4.68 119.74 125.32 1pwv s LYS 45 Ca 0.33 -0.94 -0.11 0.00 0.02 0.00 0.00 55.97 55.28 1pwv s LYS 45 Cb -0.12 -2.67 -0.06 0.00 -0.52 0.00 0.00 37.83 34.47 1pwv s LYS 45 CO 0.21 -0.29 0.41 0.42 -0.92 0.00 0.00 175.35 175.18 1pwv s ILE 46 N 1.26 5.08 -0.48 2.17 1.09 -1.26 -2.37 121.20 126.68 1pwv s ILE 46 Ca 0.02 0.51 0.06 0.00 -1.10 0.00 0.00 60.65 60.14 1pwv s ILE 46 Cb -0.15 -3.66 0.19 0.00 -1.06 0.00 0.00 42.46 37.78 1pwv s ILE 46 CO -0.11 0.33 0.61 -0.62 -0.10 0.00 0.00 174.94 175.05 1pwv n GLU 47 N 1.02 0.44 -2.45 2.79 1.02 -1.12 -4.96 120.64 117.38 1pwv n GLU 47 Ca -0.09 -2.39 -0.05 0.00 -0.02 0.00 0.00 57.16 54.61 1pwv n GLU 47 Cb 0.52 -1.53 -0.01 0.00 -0.02 0.00 0.00 31.44 30.40 1pwv n GLU 47 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1pwv n VAL 48 N 2.86 0.00 -0.01 2.62 0.24 -1.26 -4.21 118.33 118.57 1pwv n VAL 48 Ca 0.21 -0.42 -0.02 0.00 -2.04 0.00 0.00 64.34 62.08 1pwv n VAL 48 Cb 0.54 0.11 -0.01 0.00 -1.47 0.00 0.00 33.84 33.02 1pwv n VAL 48 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1pwv n LYS 49 N -0.20 0.09 -0.51 7.34 2.85 -1.26 -4.78 118.16 121.70 1pwv n LYS 49 Ca -0.03 0.04 -0.19 0.00 -1.05 0.00 0.00 58.31 57.08 1pwv n LYS 49 Cb 0.11 -0.49 -0.05 0.00 -0.65 0.00 0.00 35.03 33.95 1pwv n LYS 49 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1pwv n GLY 50 N 2.53 0.59 3.22 2.58 0.00 -1.26 -4.22 105.19 108.63 1pwv n GLY 50 Ca -0.02 -0.40 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 1pwv n GLY 50 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1pwv n GLU 51 N 5.65 -0.75 -0.31 1.61 2.13 -1.26 -4.39 120.64 123.32 1pwv n GLU 51 Ca 0.20 0.94 0.28 0.00 0.66 0.00 0.00 57.16 59.24 1pwv n GLU 51 Cb 0.24 -1.25 0.48 0.00 0.27 0.00 0.00 31.44 31.18 1pwv n GLU 51 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 1pwv n GLU 52 N 0.83 -0.03 -0.56 5.31 0.28 -1.26 -1.45 120.64 123.75 1pwv n GLU 52 Ca -0.03 0.99 0.45 0.00 -0.16 0.00 0.00 57.16 58.41 1pwv n GLU 52 Cb 0.54 -1.87 0.77 0.00 1.43 0.00 0.00 31.44 32.31 1pwv n GLU 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1pwv h ALA 53 N 1.33 3.43 0.00 -1.84 0.00 -1.97 0.37 119.26 120.58 1pwv h ALA 53 Ca 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.55 1pwv h ALA 53 Cb 1.95 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.89 1pwv h ALA 53 CO -0.45 -1.96 -0.52 0.28 0.00 0.00 0.00 179.25 176.60 1pwv n VAL 54 N -4.18 1.36 -0.32 0.00 0.31 -0.53 -3.00 118.33 111.98 1pwv n VAL 54 Ca 0.39 0.22 0.12 0.00 -0.01 0.00 0.00 64.34 65.07 1pwv n VAL 54 Cb 1.71 -2.35 0.30 0.00 -0.91 0.00 0.00 33.84 32.59 1pwv n VAL 54 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1pwv h LYS 55 N -0.96 0.52 0.32 5.55 1.57 -1.58 0.18 116.57 122.17 1pwv h LYS 55 Ca 0.00 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 1pwv h LYS 55 Cb 0.52 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1pwv h LYS 55 CO 0.00 0.34 -0.15 -0.22 -0.57 0.00 0.00 179.45 178.85 1pwv h LYS 56 N 0.53 -0.42 -1.01 3.15 3.64 -0.47 -1.77 116.57 120.23 1pwv h LYS 56 Ca 0.55 0.03 0.29 0.00 -1.27 0.00 0.00 60.65 60.25 1pwv h LYS 56 Cb 0.97 0.09 -0.14 0.00 -0.41 0.00 0.00 32.23 32.75 1pwv h LYS 56 CO -0.46 -0.26 0.59 1.49 -2.27 0.00 0.00 179.45 178.54 1pwv h GLU 57 N -0.46 0.42 -0.51 1.90 4.57 -0.61 0.29 114.58 120.17 1pwv h GLU 57 Ca -0.04 -0.03 -0.12 0.00 -1.18 0.00 0.00 59.36 57.99 1pwv h GLU 57 Cb 0.35 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 1pwv h GLU 57 CO 0.07 0.28 -0.16 0.00 -1.18 0.00 0.00 179.01 178.02 1pwv h ALA 58 N 1.79 0.73 -0.10 2.92 0.00 -0.53 -2.76 119.26 121.31 1pwv h ALA 58 Ca 0.70 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 1pwv h ALA 58 Cb 1.50 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1pwv h ALA 58 CO -0.54 0.68 -0.18 0.00 0.00 0.00 0.00 179.25 179.21 1pwv h ALA 59 N 0.91 1.51 -0.10 0.00 0.00 0.38 -2.18 119.26 119.79 1pwv h ALA 59 Ca 0.13 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1pwv h ALA 59 Cb 0.74 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1pwv h ALA 59 CO 0.06 0.35 -0.22 0.93 0.00 0.00 0.00 179.25 180.36 1pwv h GLU 60 N 0.16 0.32 0.00 0.00 5.08 -1.19 -2.24 114.58 116.70 1pwv h GLU 60 Ca 0.03 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1pwv h GLU 60 Cb 0.41 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 1pwv h GLU 60 CO 0.03 0.82 -0.05 0.87 -1.00 0.00 0.00 179.01 179.68 1pwv h LYS 61 N -0.13 0.00 0.01 2.33 1.57 -1.24 -0.39 116.57 118.71 1pwv h LYS 61 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1pwv h LYS 61 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1pwv h LYS 61 CO 0.05 0.05 -0.00 1.25 -0.57 0.00 0.00 179.45 180.23 1pwv h LEU 62 N 0.00 -0.01 0.00 2.94 5.85 -1.32 -3.32 115.31 119.45 1pwv h LEU 62 Ca -0.00 -0.73 0.00 0.00 0.84 0.00 0.00 57.88 57.99 1pwv h LEU 62 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1pwv h LEU 62 CO 0.01 0.85 0.00 0.18 -0.34 0.00 0.00 178.44 179.14 1pwv n LEU 63 N -4.67 0.00 0.21 2.25 4.77 -0.85 -2.83 117.00 115.89 1pwv n LEU 63 Ca -0.08 0.44 0.08 0.00 -0.03 0.00 0.00 56.01 56.43 1pwv n LEU 63 Cb 0.36 -0.44 0.45 0.00 -2.33 0.00 0.00 43.42 41.45 1pwv n LEU 63 CO 0.26 -0.15 0.78 -0.08 -1.33 0.00 0.00 177.39 176.86 1pwv h GLU 64 N 0.00 0.00 0.00 3.23 4.81 -1.16 -2.87 114.58 118.59 1pwv h GLU 64 Ca 0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1pwv h GLU 64 Cb 0.29 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.67 1pwv h GLU 64 CO 0.00 0.28 -0.15 -0.22 -0.73 0.00 0.00 179.01 178.19 1pwv h LYS 65 N 0.00 0.00 -6.52 1.92 1.63 -1.69 -3.45 116.57 108.46 1pwv h LYS 65 Ca -0.00 0.00 -0.53 0.00 -0.85 0.00 0.00 60.65 59.27 1pwv h LYS 65 Cb 0.73 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.34 1pwv h LYS 65 CO 0.04 0.15 0.39 0.08 -3.45 0.00 0.00 179.45 176.65 1pwv s VAL 66 N -3.46 4.54 -0.32 2.00 1.01 -1.09 -4.95 120.40 118.14 1pwv s VAL 66 Ca 0.03 1.99 -0.37 0.00 0.00 0.00 0.00 61.98 63.62 1pwv s VAL 66 Cb 0.08 -4.27 -0.13 0.00 0.00 0.00 0.00 36.38 32.06 1pwv s VAL 66 CO 0.63 0.25 2.03 -2.65 0.00 0.00 0.00 175.10 175.37 1pwv n PRO 67 N 3.20 1.09 -0.20 2.72 -0.02 -1.26 -4.81 135.00 135.72 1pwv n PRO 67 Ca 0.04 0.34 -0.01 0.00 -2.02 0.00 0.00 63.50 61.85 1pwv n PRO 67 Cb 0.49 -2.29 0.01 0.00 -0.02 0.00 0.00 33.50 31.70 1pwv n PRO 67 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1pwv n SER 68 N 8.11 -0.36 0.31 2.55 2.88 -1.26 0.25 113.62 126.10 1pwv n SER 68 Ca 0.37 0.89 0.21 0.00 -1.33 0.00 0.00 58.87 59.01 1pwv n SER 68 Cb 0.18 -0.19 1.10 0.00 -0.75 0.00 0.00 64.21 64.55 1pwv n SER 68 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1pwv h ASP 69 N 0.00 0.00 0.22 -3.46 3.32 -1.98 -0.97 116.42 113.55 1pwv h ASP 69 Ca 0.16 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.06 1pwv h ASP 69 Cb 0.29 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1pwv h ASP 69 CO -0.50 0.00 -0.60 -0.37 -1.72 0.00 0.00 179.24 176.04 1pwv h VAL 70 N 0.00 1.36 -0.44 -1.35 -1.51 -0.55 -2.07 116.25 111.69 1pwv h VAL 70 Ca 0.00 -1.93 -0.13 0.00 -1.23 0.00 0.00 66.70 63.41 1pwv h VAL 70 Cb 0.05 1.93 -0.01 0.00 -2.13 0.00 0.00 31.29 31.13 1pwv h VAL 70 CO 0.00 0.58 -0.23 -0.07 -1.23 0.00 0.00 177.57 176.62 1pwv h LEU 71 N 0.29 0.93 -0.95 4.19 4.07 -1.27 -0.19 115.31 122.38 1pwv h LEU 71 Ca -0.01 -0.35 -0.11 0.00 0.08 0.00 0.00 57.88 57.49 1pwv h LEU 71 Cb 1.13 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.60 1pwv h LEU 71 CO 0.10 1.12 -0.47 -0.08 -1.08 0.00 0.00 178.44 178.03 1pwv h GLU 72 N 0.79 0.12 -0.20 1.13 4.81 -1.45 -1.54 114.58 118.24 1pwv h GLU 72 Ca 0.10 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1pwv h GLU 72 Cb 0.79 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 1pwv h GLU 72 CO 0.07 0.57 -0.07 0.52 -0.73 0.00 0.00 179.01 179.37 1pwv h MET 73 N 0.10 0.39 -0.77 1.92 2.86 -1.02 0.34 114.93 118.75 1pwv h MET 73 Ca 0.00 -0.16 0.08 0.00 -2.06 0.00 0.00 59.70 57.56 1pwv h MET 73 Cb 0.87 -0.02 -0.06 0.00 0.06 0.00 0.00 31.60 32.45 1pwv h MET 73 CO 0.07 0.66 0.44 -0.92 1.06 0.00 0.00 176.91 178.22 1pwv h TYR 74 N 0.10 0.81 0.14 -0.22 -0.00 -0.83 -1.38 116.97 115.59 1pwv h TYR 74 Ca 0.05 0.03 0.01 0.00 -0.00 0.00 0.00 58.73 58.81 1pwv h TYR 74 Cb 0.53 -0.25 -0.02 0.00 -0.00 0.00 0.00 36.73 36.99 1pwv h TYR 74 CO 0.06 0.36 -0.17 -0.22 -0.00 0.00 0.00 178.16 178.19 1pwv h LYS 75 N 0.78 -0.35 -1.19 1.82 3.64 -0.95 -0.93 116.57 119.39 1pwv h LYS 75 Ca 0.36 0.02 0.35 0.00 -1.27 0.00 0.00 60.65 60.10 1pwv h LYS 75 Cb 0.26 0.08 -0.10 0.00 -0.41 0.00 0.00 32.23 32.06 1pwv h LYS 75 CO -0.21 -0.23 0.79 0.00 -2.27 0.00 0.00 179.45 177.52 1pwv h ALA 76 N 0.44 2.61 -0.53 5.00 0.00 0.19 0.48 119.26 127.45 1pwv h ALA 76 Ca 0.01 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1pwv h ALA 76 Cb 0.36 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1pwv h ALA 76 CO -0.07 -1.08 0.00 0.44 0.00 0.00 0.00 179.25 178.54 1pwv n ILE 77 N -4.55 1.62 -1.06 0.00 -5.35 -0.99 -4.93 119.36 104.10 1pwv n ILE 77 Ca 0.30 -1.00 -0.02 0.00 -0.27 0.00 0.00 62.75 61.76 1pwv n ILE 77 Cb 1.16 0.00 -0.01 0.00 -1.74 0.00 0.00 39.64 39.06 1pwv n ILE 77 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1pwv n GLY 78 N 0.94 0.54 3.85 3.28 0.00 0.17 -4.71 105.19 109.26 1pwv n GLY 78 Ca 0.22 -0.61 -0.31 0.00 0.00 0.00 0.00 46.02 45.32 1pwv n GLY 78 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pwv s GLY 79 N -2.63 1.65 0.00 -0.02 0.00 -0.39 -4.49 107.32 101.44 1pwv s GLY 79 Ca 0.00 -0.14 -0.10 0.00 0.00 0.00 0.00 44.72 44.48 1pwv s GLY 79 CO 0.00 0.20 0.21 0.54 0.00 0.00 0.00 173.10 174.05 1pwv s LYS 80 N -5.19 0.58 -0.19 2.90 1.02 -1.20 -4.51 119.74 113.16 1pwv s LYS 80 Ca 0.58 -0.36 -0.01 0.00 0.02 0.00 0.00 55.97 56.19 1pwv s LYS 80 Cb -0.13 0.25 -0.00 0.00 -0.52 0.00 0.00 37.83 37.43 1pwv s LYS 80 CO 0.54 -0.15 -0.11 0.42 -0.92 0.00 0.00 175.35 175.12 1pwv s ILE 81 N -1.54 2.90 -0.19 2.17 1.01 0.11 -0.88 121.20 124.77 1pwv s ILE 81 Ca -0.13 -0.67 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 1pwv s ILE 81 Cb -0.06 -2.27 -0.01 0.00 0.01 0.00 0.00 42.46 40.14 1pwv s ILE 81 CO 0.02 0.48 -0.07 -0.31 0.00 0.00 0.00 174.94 175.05 1pwv s TYR 82 N 1.14 2.92 -0.78 3.97 4.12 0.13 -1.24 117.35 127.61 1pwv s TYR 82 Ca 0.01 -0.89 -0.11 0.00 0.02 0.00 0.00 57.07 56.10 1pwv s TYR 82 Cb -0.14 -2.02 0.20 0.00 -1.52 0.00 0.00 41.96 38.48 1pwv s TYR 82 CO -0.04 -0.46 0.68 0.42 0.02 0.00 0.00 175.55 176.17 1pwv s ILE 83 N 1.15 5.13 0.46 2.71 1.09 -1.00 -1.05 121.20 129.69 1pwv s ILE 83 Ca 0.02 -2.60 0.07 0.00 -1.10 0.00 0.00 60.65 57.03 1pwv s ILE 83 Cb -0.14 -4.20 -0.00 0.00 -1.06 0.00 0.00 42.46 37.05 1pwv s ILE 83 CO -0.02 -0.99 0.37 0.68 -0.10 0.00 0.00 174.94 174.88 1pwv s VAL 84 N 0.10 2.26 0.22 2.92 -7.23 -1.00 -2.81 120.40 114.86 1pwv s VAL 84 Ca 0.18 -1.44 0.06 0.00 -1.81 0.00 0.00 61.98 58.96 1pwv s VAL 84 Cb -0.13 -2.70 -0.03 0.00 0.56 0.00 0.00 36.38 34.08 1pwv s VAL 84 CO -0.07 0.00 0.24 -1.81 -0.31 0.00 0.00 175.10 173.14 1pwv s ASP 85 N -4.16 5.81 0.94 4.85 1.11 -1.26 -1.24 116.67 122.72 1pwv s ASP 85 Ca 0.43 -0.10 0.00 0.00 0.18 0.00 0.00 52.55 53.06 1pwv s ASP 85 Cb -0.02 -1.58 0.00 0.00 1.07 0.00 0.00 42.92 42.39 1pwv s ASP 85 CO 0.25 -0.02 0.00 0.61 1.18 0.00 0.00 175.17 177.20 1pwv n GLY 86 N -1.01 -0.20 3.44 0.21 0.00 -1.26 -4.61 105.19 101.75 1pwv n GLY 86 Ca -0.08 -0.95 -0.47 0.00 0.00 0.00 0.00 46.02 44.52 1pwv n GLY 86 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1pwv n ASP 87 N -2.77 1.35 -0.26 1.61 4.64 -1.26 -4.79 116.55 115.06 1pwv n ASP 87 Ca 0.00 0.25 0.30 0.00 -1.38 0.00 0.00 54.79 53.97 1pwv n ASP 87 Cb 0.00 -1.14 0.70 0.00 -1.04 0.00 0.00 41.12 39.64 1pwv n ASP 87 CO 0.00 0.00 0.00 0.16 -0.82 0.00 0.00 177.20 176.54 1pwv h ILE 88 N 7.43 0.49 0.00 5.18 3.07 -1.81 0.32 117.51 132.18 1pwv h ILE 88 Ca -0.17 -0.02 0.00 0.00 1.55 0.00 0.00 64.86 66.22 1pwv h ILE 88 Cb 1.33 0.42 0.00 0.00 -0.27 0.00 0.00 36.82 38.30 1pwv h ILE 88 CO 1.16 0.01 0.00 0.35 -1.05 0.00 0.00 178.15 178.62 1pwv n THR 89 N -4.28 0.62 -1.50 0.16 -2.24 -1.26 -3.42 114.28 102.36 1pwv n THR 89 Ca 0.22 0.15 -0.27 0.00 -2.27 0.00 0.00 64.05 61.89 1pwv n THR 89 Cb 1.07 -0.87 -0.06 0.00 -2.10 0.00 0.00 70.33 68.36 1pwv n THR 89 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1pwv n LYS 90 N -1.36 2.70 -4.04 -0.78 4.81 0.11 -4.44 118.16 115.15 1pwv n LYS 90 Ca 0.07 -2.34 -0.09 0.00 -0.87 0.00 0.00 58.31 55.08 1pwv n LYS 90 Cb 0.16 -2.21 -0.11 0.00 0.02 0.00 0.00 35.03 32.89 1pwv n LYS 90 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 1pwv s HIS 91 N -1.22 0.47 0.14 5.64 2.46 -1.22 -5.01 115.29 116.55 1pwv s HIS 91 Ca 0.60 -0.70 -0.28 0.00 0.47 0.00 0.00 55.06 55.15 1pwv s HIS 91 Cb 0.34 -0.31 -0.03 0.00 -0.13 0.00 0.00 32.58 32.45 1pwv s HIS 91 CO -0.17 -0.21 1.58 0.82 -2.47 0.00 0.00 174.74 174.28 1pwv h ILE 92 N 4.07 0.13 -0.22 0.89 5.03 -1.92 -1.39 117.51 124.10 1pwv h ILE 92 Ca -0.34 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 64.47 1pwv h ILE 92 Cb 1.19 0.13 -0.01 0.00 -3.03 0.00 0.00 36.82 35.10 1pwv h ILE 92 CO 0.50 0.00 0.18 0.28 -0.68 0.00 0.00 178.15 178.43 1pwv h SER 93 N -0.40 0.00 -0.50 1.72 0.02 -1.96 -2.05 113.55 110.37 1pwv h SER 93 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 1pwv h SER 93 Cb 0.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1pwv h SER 93 CO -0.49 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.38 1pwv n LEU 94 N -4.15 3.58 0.14 5.07 4.77 -0.78 -4.56 117.00 121.08 1pwv n LEU 94 Ca 0.02 -2.14 0.06 0.00 -0.03 0.00 0.00 56.01 53.92 1pwv n LEU 94 Cb 0.32 -0.38 0.52 0.00 -2.33 0.00 0.00 43.42 41.55 1pwv n LEU 94 CO 0.32 0.82 1.07 -0.08 -1.33 0.00 0.00 177.39 178.19 1pwv h GLU 95 N 3.00 0.24 -0.32 3.23 4.81 -0.52 -3.05 114.58 121.96 1pwv h GLU 95 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1pwv h GLU 95 Cb 0.97 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.30 1pwv h GLU 95 CO 0.05 0.20 0.00 0.00 -0.73 0.00 0.00 179.01 178.53 1pwv n ALA 96 N -2.51 2.46 -2.51 2.92 0.00 -1.26 -4.92 120.51 114.69 1pwv n ALA 96 Ca -0.00 -0.68 -0.43 0.00 0.00 0.00 0.00 53.44 52.33 1pwv n ALA 96 Cb 0.11 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.53 1pwv n ALA 96 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1pwv s LEU 97 N -1.25 4.20 0.14 0.00 1.43 -1.15 -4.94 118.68 117.10 1pwv s LEU 97 Ca 0.30 1.65 -0.31 0.00 -1.03 0.00 0.00 54.13 54.74 1pwv s LEU 97 Cb 0.16 -3.55 -0.10 0.00 0.03 0.00 0.00 46.19 42.73 1pwv s LEU 97 CO 0.23 -0.66 1.71 -0.94 0.23 0.00 0.00 176.35 176.93 1pwv s SER 98 N 1.58 6.48 0.24 2.29 1.04 -1.26 -4.86 113.70 119.21 1pwv s SER 98 Ca 0.52 2.70 0.12 0.00 0.48 0.00 0.00 55.95 59.77 1pwv s SER 98 Cb -0.21 -2.58 0.84 0.00 0.10 0.00 0.00 66.02 64.17 1pwv s SER 98 CO 0.15 -0.94 1.07 -0.62 0.98 0.00 0.00 173.24 173.88 1pwv n GLU 99 N 4.92 -0.04 0.16 4.02 -0.58 -1.26 0.00 120.64 127.85 1pwv n GLU 99 Ca 0.16 0.95 -0.14 0.00 -0.42 0.00 0.00 57.16 57.71 1pwv n GLU 99 Cb 0.38 -1.66 -0.08 0.00 -0.57 0.00 0.00 31.44 29.51 1pwv n GLU 99 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 1pwv h ASP 100 N 0.00 -0.31 0.00 1.62 1.82 -1.96 -2.62 116.42 114.97 1pwv h ASP 100 Ca 0.54 -0.08 0.00 0.00 -0.39 0.00 0.00 57.03 57.11 1pwv h ASP 100 Cb 1.40 0.08 0.00 0.00 0.68 0.00 0.00 39.33 41.49 1pwv h ASP 100 CO -0.54 -0.12 0.00 0.29 -1.61 0.00 0.00 179.24 177.26 1pwv n LYS 101 N -5.19 0.97 -0.00 0.28 4.01 0.10 -2.84 118.16 115.49 1pwv n LYS 101 Ca -0.10 0.00 0.06 0.00 -0.51 0.00 0.00 58.31 57.76 1pwv n LYS 101 Cb 0.20 -1.22 -0.07 0.00 -0.51 0.00 0.00 35.03 33.43 1pwv n LYS 101 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1pwv n LYS 102 N 0.29 2.73 -3.97 1.97 0.00 -0.99 -4.82 118.16 113.37 1pwv n LYS 102 Ca 0.00 -0.01 -0.34 0.00 0.00 0.00 0.00 58.31 57.96 1pwv n LYS 102 Cb 0.38 -1.10 -0.14 0.00 0.00 0.00 0.00 35.03 34.17 1pwv n LYS 102 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1pwv s LYS 103 N -2.22 2.94 0.02 1.64 -0.14 -1.13 -0.96 119.74 119.89 1pwv s LYS 103 Ca 0.04 -0.90 0.00 0.00 -1.36 0.00 0.00 55.97 53.75 1pwv s LYS 103 Cb 0.09 -2.95 0.00 0.00 -1.68 0.00 0.00 37.83 33.30 1pwv s LYS 103 CO 0.51 -0.35 0.01 -0.89 -0.76 0.00 0.00 175.35 173.87 1pwv n ILE 104 N 4.69 0.00 -3.75 2.17 5.41 -0.96 -4.95 119.36 121.97 1pwv n ILE 104 Ca -0.17 -0.07 -0.13 0.00 1.00 0.00 0.00 62.75 63.38 1pwv n ILE 104 Cb 0.48 -0.43 -0.14 0.00 -0.71 0.00 0.00 39.64 38.84 1pwv n ILE 104 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1pwv s LYS 105 N -2.07 0.11 1.10 0.38 1.02 -1.26 -1.26 119.74 117.76 1pwv s LYS 105 Ca 0.01 0.38 -0.18 0.00 0.02 0.00 0.00 55.97 56.19 1pwv s LYS 105 Cb -0.00 -0.16 0.26 0.00 -0.52 0.00 0.00 37.83 37.41 1pwv s LYS 105 CO 0.01 -0.16 1.26 0.16 -0.92 0.00 0.00 175.35 175.70 1pwv s ASP 106 N 1.12 1.89 0.60 2.83 3.84 -0.85 -4.80 116.67 121.30 1pwv s ASP 106 Ca -0.09 0.30 0.29 0.00 -0.00 0.00 0.00 52.55 53.05 1pwv s ASP 106 Cb -0.11 -0.32 1.49 0.00 -1.38 0.00 0.00 42.92 42.60 1pwv s ASP 106 CO -0.06 -3.49 1.90 -0.29 -0.00 0.00 0.00 175.17 173.23 1pwv h ILE 107 N -2.16 0.33 -0.01 2.11 -0.00 -1.91 -0.20 117.51 115.66 1pwv h ILE 107 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.43 1pwv h ILE 107 Cb 1.24 0.63 0.00 0.00 -0.00 0.00 0.00 36.82 38.69 1pwv h ILE 107 CO 0.31 0.00 -0.33 -1.22 -0.00 0.00 0.00 178.15 176.90 1pwv n TYR 108 N -3.62 0.00 -0.05 2.19 4.02 -1.26 -4.95 117.16 113.48 1pwv n TYR 108 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.96 1pwv n TYR 108 Cb 0.62 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 1pwv n TYR 108 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1pwv n GLY 109 N 1.37 0.45 3.69 2.72 0.00 -0.09 -5.05 105.19 108.28 1pwv n GLY 109 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1pwv n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pwv s LYS 110 N -0.88 4.34 0.27 1.61 1.02 -1.26 -4.75 119.74 120.10 1pwv s LYS 110 Ca 0.00 1.73 -0.29 0.00 0.02 0.00 0.00 55.97 57.42 1pwv s LYS 110 Cb 0.00 -3.55 -0.10 0.00 -0.52 0.00 0.00 37.83 33.66 1pwv s LYS 110 CO 0.00 -0.46 1.32 -0.51 -0.92 0.00 0.00 175.35 174.78 1pwv s ASP 111 N 1.53 6.82 0.31 2.83 1.01 -1.26 -2.00 116.67 125.90 1pwv s ASP 111 Ca 0.57 2.57 0.05 0.00 0.71 0.00 0.00 52.55 56.45 1pwv s ASP 111 Cb -0.26 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 41.01 1pwv s ASP 111 CO 0.23 -0.54 0.23 0.00 0.21 0.00 0.00 175.17 175.30 1pwv s ALA 112 N -0.51 1.78 -0.20 5.23 0.00 -0.39 -4.96 121.76 122.72 1pwv s ALA 112 Ca 0.53 -1.94 -0.02 0.00 0.00 0.00 0.00 51.96 50.54 1pwv s ALA 112 Cb -0.39 1.41 0.00 0.00 0.00 0.00 0.00 23.12 24.15 1pwv s ALA 112 CO 0.45 -0.62 -0.12 -0.51 0.00 0.00 0.00 175.76 174.96 1pwv s LEU 113 N -3.34 2.54 0.22 0.00 1.43 -1.26 -2.25 118.68 116.01 1pwv s LEU 113 Ca 0.39 -0.51 -0.18 0.00 -1.03 0.00 0.00 54.13 52.80 1pwv s LEU 113 Cb 0.03 -1.62 0.21 0.00 0.03 0.00 0.00 46.19 44.84 1pwv s LEU 113 CO 0.23 -0.01 1.57 0.25 0.23 0.00 0.00 176.35 178.63 1pwv h LEU 114 N 7.99 -1.27 -0.13 1.79 6.46 -1.43 0.33 115.31 129.06 1pwv h LEU 114 Ca -0.43 0.27 0.00 0.00 -0.12 0.00 0.00 57.88 57.60 1pwv h LEU 114 Cb 1.15 0.66 0.00 0.00 -0.73 0.00 0.00 40.66 41.75 1pwv h LEU 114 CO 0.62 -0.29 0.00 0.00 -0.62 0.00 0.00 178.44 178.14 1pwv n HIS 115 N -5.47 0.00 0.00 1.25 1.44 -1.26 -1.07 115.22 110.11 1pwv n HIS 115 Ca 0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 1pwv n HIS 115 Cb 0.39 -0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.49 1pwv n HIS 115 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1pwv n GLU 116 N -0.39 2.92 -1.50 -1.40 1.02 0.11 -4.68 120.64 116.72 1pwv n GLU 116 Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.97 1pwv n GLU 116 Cb 0.01 -0.66 0.11 0.00 -0.02 0.00 0.00 31.44 30.87 1pwv n GLU 116 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 1pwv n HIS 117 N -0.90 -3.59 -0.01 -0.32 -0.00 -0.24 -5.00 115.22 105.16 1pwv n HIS 117 Ca 0.00 -0.92 0.00 0.00 0.46 0.00 0.00 57.72 57.26 1pwv n HIS 117 Cb 0.00 -0.57 0.00 0.00 -0.12 0.00 0.00 29.99 29.30 1pwv n HIS 117 CO 0.00 0.00 0.00 2.48 0.46 0.00 0.00 176.34 179.28 1pwv n TYR 118 N -2.79 0.00 -3.98 1.57 4.11 -1.26 -4.55 117.16 110.26 1pwv n TYR 118 Ca 0.11 0.00 -0.09 0.00 -0.00 0.00 0.00 57.90 57.92 1pwv n TYR 118 Cb 0.37 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.61 1pwv n TYR 118 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 1pwv s VAL 119 N -0.51 0.16 -0.28 -3.48 1.01 -1.26 0.10 120.40 116.13 1pwv s VAL 119 Ca 0.00 -1.28 -0.24 0.00 0.00 0.00 0.00 61.98 60.46 1pwv s VAL 119 Cb 0.00 -1.00 0.13 0.00 0.00 0.00 0.00 36.38 35.51 1pwv s VAL 119 CO 0.00 -0.71 1.07 -0.47 0.00 0.00 0.00 175.10 175.00 1pwv s TYR 120 N -2.88 -0.44 -0.31 5.22 5.04 -0.84 -5.00 117.35 118.14 1pwv s TYR 120 Ca -0.03 1.03 0.01 0.00 -2.44 0.00 0.00 57.07 55.64 1pwv s TYR 120 Cb 0.00 0.37 0.07 0.00 0.35 0.00 0.00 41.96 42.76 1pwv s TYR 120 CO -0.06 -0.21 -0.01 0.00 -1.34 0.00 0.00 175.55 173.93 1pwv s ALA 121 N 0.36 2.79 0.08 3.97 0.00 -1.26 -1.35 121.76 126.34 1pwv s ALA 121 Ca 0.02 -1.99 -0.30 0.00 0.00 0.00 0.00 51.96 49.69 1pwv s ALA 121 Cb -0.05 -1.88 -0.05 0.00 0.00 0.00 0.00 23.12 21.14 1pwv s ALA 121 CO -0.09 -1.38 1.11 0.21 0.00 0.00 0.00 175.76 175.62 1pwv s LYS 122 N 1.13 4.51 0.22 0.00 2.20 0.36 -4.89 119.74 123.27 1pwv s LYS 122 Ca -0.02 1.66 -0.03 0.00 -0.36 0.00 0.00 55.97 57.22 1pwv s LYS 122 Cb -0.20 -3.36 0.05 0.00 -1.51 0.00 0.00 37.83 32.81 1pwv s LYS 122 CO -0.04 -0.11 0.30 -1.91 -0.36 0.00 0.00 175.35 173.23 1pwv n GLU 123 N 3.51 -0.11 0.00 4.03 2.13 -1.26 -1.89 120.64 127.04 1pwv n GLU 123 Ca 0.06 -0.53 0.00 0.00 0.66 0.00 0.00 57.16 57.35 1pwv n GLU 123 Cb 0.48 -0.28 0.00 0.00 0.27 0.00 0.00 31.44 31.90 1pwv n GLU 123 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1pwv n GLY 124 N 2.99 1.61 0.55 8.31 0.00 -1.26 -4.38 105.19 113.01 1pwv n GLY 124 Ca 0.04 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.04 1pwv n GLY 124 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1pwv n TYR 125 N 1.50 0.00 -2.72 1.61 0.18 -1.26 -2.89 117.16 113.58 1pwv n TYR 125 Ca 0.00 -0.03 -0.07 0.00 1.88 0.00 0.00 57.90 59.68 1pwv n TYR 125 Cb 0.00 -0.06 0.08 0.00 -0.38 0.00 0.00 39.34 38.97 1pwv n TYR 125 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1pwv n GLU 126 N 0.31 0.66 -1.53 -3.48 1.02 -1.26 -5.04 120.64 111.32 1pwv n GLU 126 Ca 0.00 -1.47 -0.42 0.00 -0.02 0.00 0.00 57.16 55.25 1pwv n GLU 126 Cb 0.13 -0.93 0.01 0.00 -0.02 0.00 0.00 31.44 30.63 1pwv n GLU 126 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1pwv n PRO 127 N 1.05 0.92 -3.78 3.49 -0.04 -1.14 -4.94 135.00 130.56 1pwv n PRO 127 Ca 0.05 0.33 -0.15 0.00 -0.04 0.00 0.00 63.50 63.69 1pwv n PRO 127 Cb 0.68 -1.72 -0.16 0.00 -0.04 0.00 0.00 33.50 32.26 1pwv n PRO 127 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1pwv s VAL 128 N -1.33 -0.05 -0.23 0.52 1.01 -0.79 -3.24 120.40 116.29 1pwv s VAL 128 Ca 0.63 0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.81 1pwv s VAL 128 Cb -0.61 -0.08 0.03 0.00 0.00 0.00 0.00 36.38 35.72 1pwv s VAL 128 CO 0.57 0.09 -0.11 -0.22 0.00 0.00 0.00 175.10 175.43 1pwv s LEU 129 N 1.01 2.86 -0.19 3.92 2.96 -0.05 0.14 118.68 129.32 1pwv s LEU 129 Ca -0.08 -0.85 -0.02 0.00 -0.22 0.00 0.00 54.13 52.96 1pwv s LEU 129 Cb -0.12 -1.59 0.00 0.00 0.50 0.00 0.00 46.19 44.98 1pwv s LEU 129 CO -0.03 -0.09 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.11 1pwv s VAL 130 N 1.29 2.86 -0.09 1.68 1.01 -0.46 0.18 120.40 126.87 1pwv s VAL 130 Ca 0.01 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.34 1pwv s VAL 130 Cb -0.16 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 1pwv s VAL 130 CO -0.07 0.48 -0.21 -0.63 0.00 0.00 0.00 175.10 174.67 1pwv s ILE 131 N 1.22 2.38 -0.18 2.22 1.01 -0.21 -1.99 121.20 125.65 1pwv s ILE 131 Ca 0.02 -0.92 -0.29 0.00 0.00 0.00 0.00 60.65 59.46 1pwv s ILE 131 Cb -0.14 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.40 1pwv s ILE 131 CO -0.05 0.56 1.03 -1.58 0.00 0.00 0.00 174.94 174.90 1pwv s GLN 132 N 0.14 4.32 -0.32 2.79 0.74 0.28 -2.37 119.66 125.24 1pwv s GLN 132 Ca -0.11 1.38 -0.28 0.00 0.05 0.00 0.00 55.36 56.40 1pwv s GLN 132 Cb -0.16 -3.60 -0.03 0.00 1.10 0.00 0.00 33.01 30.32 1pwv s GLN 132 CO 0.06 -0.51 1.96 -1.54 -0.55 0.00 0.00 175.29 174.72 1pwv s SER 133 N 1.17 5.64 0.19 6.67 1.04 -0.37 -4.95 113.70 123.08 1pwv s SER 133 Ca 0.46 1.40 0.11 0.00 0.48 0.00 0.00 55.95 58.40 1pwv s SER 133 Cb -0.16 -2.52 -0.04 0.00 0.10 0.00 0.00 66.02 63.39 1pwv s SER 133 CO 0.11 -1.89 -0.24 -0.55 0.98 0.00 0.00 173.24 171.65 1pwv s SER 134 N 7.21 3.44 0.06 7.02 0.15 -1.26 -4.93 113.70 125.40 1pwv s SER 134 Ca 0.86 -0.85 -0.35 0.00 0.70 0.00 0.00 55.95 56.30 1pwv s SER 134 Cb -0.25 -0.26 -0.20 0.00 -1.71 0.00 0.00 66.02 63.60 1pwv s SER 134 CO 0.33 0.12 1.56 -0.33 1.20 0.00 0.00 173.24 176.13 1pwv h GLU 135 N 3.24 -1.11 -5.90 5.44 5.08 -1.97 -3.44 114.58 115.91 1pwv h GLU 135 Ca -0.47 0.08 -0.67 0.00 -1.00 0.00 0.00 59.36 57.30 1pwv h GLU 135 Cb 1.21 0.25 -0.20 0.00 0.50 0.00 0.00 28.75 30.51 1pwv h GLU 135 CO 0.47 -0.74 -0.69 0.34 -1.00 0.00 0.00 179.01 177.39 1pwv s ASP 136 N -4.19 4.64 0.00 1.42 -1.08 -1.26 -4.91 116.67 111.29 1pwv s ASP 136 Ca -0.19 -0.06 0.00 0.00 -0.52 0.00 0.00 52.55 51.78 1pwv s ASP 136 Cb 0.03 -1.33 0.00 0.00 -1.46 0.00 0.00 42.92 40.15 1pwv s ASP 136 CO 0.60 0.31 0.00 -1.22 0.52 0.00 0.00 175.17 175.38 1pwv n TYR 137 N 2.59 0.00 0.02 -5.34 0.53 -1.26 -4.53 117.16 109.16 1pwv n TYR 137 Ca -0.18 0.00 -0.02 0.00 -1.02 0.00 0.00 57.90 56.69 1pwv n TYR 137 Cb 0.53 0.00 -0.01 0.00 -1.03 0.00 0.00 39.34 38.83 1pwv n TYR 137 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 1pwv h VAL 138 N 0.00 0.00 -0.51 -0.72 2.07 -1.99 -3.32 116.25 111.78 1pwv h VAL 138 Ca 0.00 -0.50 0.11 0.00 0.82 0.00 0.00 66.70 67.13 1pwv h VAL 138 Cb 0.00 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.74 1pwv h VAL 138 CO 0.00 0.00 0.35 -0.33 0.02 0.00 0.00 177.57 177.61 1pwv h GLU 139 N -0.60 0.20 -4.07 1.57 4.39 -1.99 -3.25 114.58 110.83 1pwv h GLU 139 Ca -0.01 -0.01 -0.77 0.00 0.34 0.00 0.00 59.36 58.91 1pwv h GLU 139 Cb 0.08 -0.05 -0.24 0.00 -0.10 0.00 0.00 28.75 28.45 1pwv h GLU 139 CO 0.02 0.13 0.62 1.21 -1.16 0.00 0.00 179.01 179.83 1pwv s ASN 140 N -6.32 7.06 0.58 1.42 3.04 -1.25 -4.84 114.94 114.63 1pwv s ASN 140 Ca -0.06 -3.07 0.38 0.00 0.04 0.00 0.00 52.86 50.14 1pwv s ASN 140 Cb 0.19 -2.28 1.81 0.00 -1.54 0.00 0.00 41.25 39.44 1pwv s ASN 140 CO 0.73 -0.55 2.13 0.71 -3.04 0.00 0.00 177.10 177.09 1pwv h THR 141 N 4.40 0.00 -0.02 -5.21 1.35 -1.73 -3.12 112.91 108.58 1pwv h THR 141 Ca 0.19 -0.25 -0.03 0.00 -0.55 0.00 0.00 66.41 65.77 1pwv h THR 141 Cb 0.93 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.57 1pwv h THR 141 CO 1.02 0.00 -0.11 -0.33 -0.25 0.00 0.00 175.52 175.84 1pwv h GLU 142 N 0.00 0.11 0.63 4.72 4.39 -1.90 -2.71 114.58 119.82 1pwv h GLU 142 Ca 0.00 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 1pwv h GLU 142 Cb 0.26 0.02 0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1pwv h GLU 142 CO 0.00 0.77 -0.30 0.87 -1.16 0.00 0.00 179.01 179.19 1pwv h LYS 143 N -0.53 -0.82 -0.83 2.33 1.57 -1.90 -2.33 116.57 114.07 1pwv h LYS 143 Ca -0.01 0.06 0.18 0.00 -1.87 0.00 0.00 60.65 59.01 1pwv h LYS 143 Cb 0.80 0.19 -0.15 0.00 0.08 0.00 0.00 32.23 33.15 1pwv h LYS 143 CO 0.02 -0.54 -0.09 0.00 -0.57 0.00 0.00 179.45 178.27 1pwv h ALA 144 N -0.50 0.74 -0.13 3.86 0.00 -1.67 0.54 119.26 122.09 1pwv h ALA 144 Ca -0.09 0.30 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1pwv h ALA 144 Cb 0.66 0.54 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 1pwv h ALA 144 CO 0.14 -0.44 -0.20 1.25 0.00 0.00 0.00 179.25 180.01 1pwv h LEU 145 N 0.04 -0.62 -0.49 0.00 7.12 -1.27 -0.76 115.31 119.33 1pwv h LEU 145 Ca 0.44 0.10 0.02 0.00 0.13 0.00 0.00 57.88 58.57 1pwv h LEU 145 Cb 0.75 0.28 -0.03 0.00 -0.53 0.00 0.00 40.66 41.13 1pwv h LEU 145 CO -0.79 -0.25 0.30 0.78 -0.13 0.00 0.00 178.44 178.34 1pwv h ASN 146 N -0.26 0.49 -0.04 1.25 2.35 0.46 0.96 115.58 120.78 1pwv h ASN 146 Ca 0.10 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.88 1pwv h ASN 146 Cb 0.40 -0.10 -0.04 0.00 0.05 0.00 0.00 38.32 38.63 1pwv h ASN 146 CO -0.27 0.35 -0.15 0.58 -1.65 0.00 0.00 177.43 176.28 1pwv h VAL 147 N 0.60 0.62 -0.34 2.81 2.07 -0.14 0.09 116.25 121.95 1pwv h VAL 147 Ca 0.20 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.75 1pwv h VAL 147 Cb 0.01 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1pwv h VAL 147 CO -0.08 0.00 0.23 1.88 0.02 0.00 0.00 177.57 179.62 1pwv h TYR 148 N -0.23 0.32 -0.34 1.57 0.99 -0.74 -0.05 116.97 118.50 1pwv h TYR 148 Ca 0.06 0.01 -0.08 0.00 2.00 0.00 0.00 58.73 60.72 1pwv h TYR 148 Cb 0.32 -0.11 -0.02 0.00 1.00 0.00 0.00 36.73 37.93 1pwv h TYR 148 CO -0.23 0.19 -0.12 -0.92 -0.00 0.00 0.00 178.16 177.08 1pwv h TYR 149 N 0.33 0.62 0.00 4.88 3.20 0.91 0.96 116.97 127.87 1pwv h TYR 149 Ca 0.14 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 1pwv h TYR 149 Cb 0.15 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 1pwv h TYR 149 CO -0.00 0.68 -0.19 1.49 -1.64 0.00 0.00 178.16 178.50 1pwv h GLU 150 N 0.53 0.00 0.13 1.82 4.57 0.69 -0.71 114.58 121.60 1pwv h GLU 150 Ca 0.10 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.07 1pwv h GLU 150 Cb 0.52 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 29.13 1pwv h GLU 150 CO 0.03 0.03 -0.88 0.82 -1.18 0.00 0.00 179.01 177.83 1pwv h ILE 151 N 0.00 1.45 -0.28 2.32 2.04 -0.32 -1.73 117.51 121.00 1pwv h ILE 151 Ca -0.00 -2.46 -0.02 0.00 1.00 0.00 0.00 64.86 63.38 1pwv h ILE 151 Cb 1.03 3.03 -0.01 0.00 -0.74 0.00 0.00 36.82 40.12 1pwv h ILE 151 CO 0.00 0.71 0.10 1.23 0.00 0.00 0.00 178.15 180.20 1pwv h GLY 152 N -0.21 0.41 1.57 5.37 0.00 0.10 0.33 103.07 110.64 1pwv h GLY 152 Ca -0.15 -0.19 -0.11 0.00 0.00 0.00 0.00 47.33 46.89 1pwv h GLY 152 CO 0.17 0.18 -0.31 1.70 0.00 0.00 0.00 176.54 178.28 1pwv h LYS 153 N 0.39 0.50 -0.12 4.80 3.64 -1.02 -0.27 116.57 124.49 1pwv h LYS 153 Ca 0.10 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1pwv h LYS 153 Cb 0.10 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1pwv h LYS 153 CO -0.01 0.75 -0.04 0.82 -2.27 0.00 0.00 179.45 178.70 1pwv h ILE 154 N 0.43 1.30 -0.00 2.00 2.04 0.18 0.63 117.51 124.09 1pwv h ILE 154 Ca 0.05 -1.01 0.03 0.00 1.00 0.00 0.00 64.86 64.94 1pwv h ILE 154 Cb 0.75 1.73 -0.05 0.00 -0.74 0.00 0.00 36.82 38.51 1pwv h ILE 154 CO 0.06 0.29 -0.31 0.25 0.00 0.00 0.00 178.15 178.44 1pwv h LEU 155 N -0.10 -0.93 -0.07 1.44 5.85 -0.07 0.21 115.31 121.64 1pwv h LEU 155 Ca 0.03 0.12 -0.16 0.00 0.84 0.00 0.00 57.88 58.71 1pwv h LEU 155 Cb 0.47 0.38 0.01 0.00 0.37 0.00 0.00 40.66 41.88 1pwv h LEU 155 CO 0.01 -0.37 -0.58 0.77 -0.34 0.00 0.00 178.44 177.93 1pwv h SER 156 N -0.46 0.64 0.34 1.25 4.64 -1.09 0.10 113.55 118.96 1pwv h SER 156 Ca 0.06 -0.68 -0.33 0.00 -0.47 0.00 0.00 61.79 60.38 1pwv h SER 156 Cb 0.55 -0.19 0.02 0.00 -0.31 0.00 0.00 62.40 62.47 1pwv h SER 156 CO -0.26 1.22 -1.50 -0.09 -0.87 0.00 0.00 176.83 175.32 1pwv h ARG 157 N 0.10 0.43 0.01 4.77 2.43 -0.84 -3.17 114.38 118.11 1pwv h ARG 157 Ca -0.05 -0.73 -0.37 0.00 -0.81 0.00 0.00 59.98 58.02 1pwv h ARG 157 Cb 1.24 0.27 -0.06 0.00 -0.42 0.00 0.00 29.97 31.00 1pwv h ARG 157 CO 0.12 1.34 -2.33 -0.25 -1.51 0.00 0.00 179.97 177.34 1pwv n ASP 158 N -3.62 0.88 0.00 -3.80 10.43 0.66 -4.46 116.55 116.62 1pwv n ASP 158 Ca -0.17 0.01 0.00 0.00 2.57 0.00 0.00 54.79 57.20 1pwv n ASP 158 Cb 1.08 0.31 0.00 0.00 1.84 0.00 0.00 41.12 44.35 1pwv n ASP 158 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 1pwv n ILE 159 N -2.99 0.00 -0.23 0.53 -0.00 -0.78 -4.45 119.36 111.44 1pwv n ILE 159 Ca -0.36 0.40 0.30 0.00 -0.00 0.00 0.00 62.75 63.10 1pwv n ILE 159 Cb 1.09 -1.35 0.72 0.00 -0.00 0.00 0.00 39.64 40.09 1pwv n ILE 159 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.55 176.48 1pwv h LEU 160 N 0.00 0.04 -1.98 1.39 3.38 -1.13 0.21 115.31 117.21 1pwv h LEU 160 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1pwv h LEU 160 Cb 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1pwv h LEU 160 CO 0.00 0.01 0.00 0.77 0.09 0.00 0.00 178.44 179.31 1pwv h SER 161 N 0.03 0.00 0.42 -0.43 4.64 -1.47 -0.21 113.55 116.53 1pwv h SER 161 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1pwv h SER 161 Cb 1.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.93 1pwv h SER 161 CO -0.03 0.00 -0.12 0.29 -0.87 0.00 0.00 176.83 176.10 1pwv n LYS 162 N -3.05 0.59 -2.15 4.77 5.02 0.75 -3.40 118.16 120.69 1pwv n LYS 162 Ca -0.01 -0.20 -0.07 0.00 -2.02 0.00 0.00 58.31 56.01 1pwv n LYS 162 Cb 0.22 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.78 1pwv n LYS 162 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1pwv n ILE 163 N -1.03 1.63 -3.92 -0.18 -5.35 -0.69 -5.02 119.36 104.81 1pwv n ILE 163 Ca 0.13 -3.15 -0.40 0.00 -0.27 0.00 0.00 62.75 59.07 1pwv n ILE 163 Cb 0.29 0.27 0.02 0.00 -1.74 0.00 0.00 39.64 38.48 1pwv n ILE 163 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1pwv n ASN 164 N -0.55 -4.29 -3.74 7.28 5.03 -1.10 -4.97 115.26 112.92 1pwv n ASN 164 Ca 0.21 -1.18 -0.10 0.00 0.87 0.00 0.00 54.58 54.38 1pwv n ASN 164 Cb 0.89 -2.41 -0.04 0.00 -1.02 0.00 0.00 39.78 37.20 1pwv n ASN 164 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1pwv s GLN 165 N -6.83 1.25 1.07 3.52 -0.21 -0.18 -4.56 119.66 113.73 1pwv s GLN 165 Ca 0.45 -0.86 -0.14 0.00 0.02 0.00 0.00 55.36 54.83 1pwv s GLN 165 Cb -0.21 0.48 0.15 0.00 1.00 0.00 0.00 33.01 34.43 1pwv s GLN 165 CO 0.93 -0.51 0.55 -2.30 -2.12 0.00 0.00 175.29 171.84 1pwv n PRO 166 N -0.29 -1.38 0.00 2.91 -0.02 -1.26 -2.62 135.00 132.34 1pwv n PRO 166 Ca -0.11 -0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.00 1pwv n PRO 166 Cb 0.63 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 1pwv n PRO 166 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 1pwv n TYR 167 N -4.37 0.00 -0.31 6.00 9.36 -1.26 -4.98 117.16 121.61 1pwv n TYR 167 Ca 0.04 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.41 1pwv n TYR 167 Cb 0.56 0.00 0.32 0.00 -0.63 0.00 0.00 39.34 39.60 1pwv n TYR 167 CO 0.00 0.00 0.00 0.37 0.22 0.00 0.00 176.86 177.45 1pwv h GLN 168 N 0.00 0.27 -0.91 2.98 5.75 -1.95 0.89 115.11 122.14 1pwv h GLN 168 Ca 0.00 -0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.58 1pwv h GLN 168 Cb 0.00 -0.06 -0.07 0.00 1.07 0.00 0.00 27.48 28.42 1pwv h GLN 168 CO 0.00 0.18 0.59 -0.22 -2.65 0.00 0.00 178.83 176.73 1pwv h LYS 169 N 0.28 0.91 0.11 1.69 3.64 -1.96 -1.56 116.57 119.67 1pwv h LYS 169 Ca 0.58 -0.05 -0.28 0.00 -1.27 0.00 0.00 60.65 59.62 1pwv h LYS 169 Cb 1.19 -0.21 0.02 0.00 -0.41 0.00 0.00 32.23 32.82 1pwv h LYS 169 CO -0.61 0.60 -1.21 0.35 -2.27 0.00 0.00 179.45 176.31 1pwv h PHE 170 N 0.94 0.85 -0.96 1.91 3.57 0.30 -3.09 116.94 120.45 1pwv h PHE 170 Ca 0.42 -0.54 0.21 0.00 3.53 0.00 0.00 57.97 61.59 1pwv h PHE 170 Cb 0.36 -0.06 -0.08 0.00 2.79 0.00 0.00 35.95 38.95 1pwv h PHE 170 CO -0.00 1.39 0.62 -0.07 -2.23 0.00 0.00 178.31 178.01 1pwv h LEU 171 N 0.22 0.55 -0.17 0.59 3.38 -0.10 0.13 115.31 119.90 1pwv h LEU 171 Ca -0.16 0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.88 1pwv h LEU 171 Cb 1.89 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.59 1pwv h LEU 171 CO 0.22 0.20 0.10 0.44 0.09 0.00 0.00 178.44 179.49 1pwv h ASP 172 N 0.54 0.15 -0.81 -0.43 3.32 -1.23 0.13 116.42 118.09 1pwv h ASP 172 Ca 0.53 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.57 1pwv h ASP 172 Cb 1.12 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.60 1pwv h ASP 172 CO -0.26 0.12 0.49 0.58 -1.72 0.00 0.00 179.24 178.44 1pwv h VAL 173 N 0.20 1.23 0.08 -1.35 2.07 -0.82 -0.59 116.25 117.08 1pwv h VAL 173 Ca 0.07 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 1pwv h VAL 173 Cb 0.00 0.10 -0.00 0.00 -1.52 0.00 0.00 31.29 29.87 1pwv h VAL 173 CO -0.04 0.24 -0.05 -0.07 0.02 0.00 0.00 177.57 177.67 1pwv h LEU 174 N 1.12 -0.13 -0.71 2.57 3.38 -0.64 -2.47 115.31 118.43 1pwv h LEU 174 Ca 0.29 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 1pwv h LEU 174 Cb -0.03 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1pwv h LEU 174 CO -0.05 -0.08 0.39 0.78 0.09 0.00 0.00 178.44 179.56 1pwv h ASN 175 N -0.13 0.88 -0.79 -0.43 2.35 -0.43 -1.71 115.58 115.33 1pwv h ASN 175 Ca -0.01 -0.09 0.10 0.00 -0.55 0.00 0.00 56.30 55.75 1pwv h ASN 175 Cb 0.11 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.20 1pwv h ASN 175 CO 0.01 0.72 0.52 0.74 -1.65 0.00 0.00 177.43 177.76 1pwv h THR 176 N 0.97 0.93 0.14 2.81 2.02 -0.97 -1.99 112.91 116.83 1pwv h THR 176 Ca 0.25 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 1pwv h THR 176 Cb 0.03 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1pwv h THR 176 CO -0.04 0.13 -0.07 0.40 0.37 0.00 0.00 175.52 176.31 1pwv h ILE 177 N 0.70 1.00 0.63 3.11 1.08 -0.85 -3.16 117.51 120.02 1pwv h ILE 177 Ca 0.37 -0.70 -0.03 0.00 -0.39 0.00 0.00 64.86 64.11 1pwv h ILE 177 Cb 0.49 1.43 0.01 0.00 -3.07 0.00 0.00 36.82 35.68 1pwv h ILE 177 CO -0.14 0.16 -0.30 0.07 -0.69 0.00 0.00 178.15 177.25 1pwv h LYS 178 N -0.53 -0.81 -0.22 2.37 2.10 -1.06 -3.18 116.57 115.23 1pwv h LYS 178 Ca -0.02 0.06 0.00 0.00 -2.00 0.00 0.00 60.65 58.69 1pwv h LYS 178 Cb 0.42 0.18 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 1pwv h LYS 178 CO 0.03 -0.51 0.00 0.09 -2.00 0.00 0.00 179.45 177.07 1pwv n ASN 179 N -5.35 0.22 -4.80 7.07 3.02 -0.78 -4.69 115.26 109.95 1pwv n ASN 179 Ca -0.11 -0.76 -0.37 0.00 -0.03 0.00 0.00 54.58 53.31 1pwv n ASN 179 Cb 0.35 -0.11 -0.07 0.00 -0.61 0.00 0.00 39.78 39.35 1pwv n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pwv s ALA 180 N -1.42 3.72 0.32 5.41 0.00 -1.19 -4.99 121.76 123.61 1pwv s ALA 180 Ca 0.00 -0.48 0.10 0.00 0.00 0.00 0.00 51.96 51.58 1pwv s ALA 180 Cb 0.00 -2.23 0.94 0.00 0.00 0.00 0.00 23.12 21.83 1pwv s ALA 180 CO 0.00 0.36 1.67 0.66 0.00 0.00 0.00 175.76 178.45 1pwv h SER 181 N 5.65 0.39 -2.17 0.00 4.64 -1.90 -3.35 113.55 116.82 1pwv h SER 181 Ca -0.48 0.18 -0.53 0.00 -0.47 0.00 0.00 61.79 60.50 1pwv h SER 181 Cb 1.20 0.16 -0.07 0.00 -0.31 0.00 0.00 62.40 63.38 1pwv h SER 181 CO 0.67 -0.10 1.16 -0.62 -0.87 0.00 0.00 176.83 177.06 1pwv s ASP 182 N -5.00 5.91 0.40 4.97 -1.08 -1.26 -4.86 116.67 115.75 1pwv s ASP 182 Ca -0.11 -0.28 0.29 0.00 -0.52 0.00 0.00 52.55 51.93 1pwv s ASP 182 Cb 0.28 -2.55 1.36 0.00 -1.46 0.00 0.00 42.92 40.55 1pwv s ASP 182 CO 0.79 -1.99 1.86 0.77 0.52 0.00 0.00 175.17 177.12 1pwv h SER 183 N 11.41 0.00 -0.09 -0.34 4.64 -1.91 -3.08 113.55 124.18 1pwv h SER 183 Ca -0.25 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.10 1pwv h SER 183 Cb 1.08 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1pwv h SER 183 CO 1.27 0.00 0.19 0.44 -0.87 0.00 0.00 176.83 177.86 1pwv h ASP 184 N 0.00 0.00 0.30 4.97 3.45 -1.89 -1.00 116.42 122.25 1pwv h ASP 184 Ca 0.00 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.45 1pwv h ASP 184 Cb 0.22 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.00 1pwv h ASP 184 CO 0.00 0.00 -0.14 1.23 -1.57 0.00 0.00 179.24 178.76 1pwv h GLY 185 N 0.00 -0.42 0.98 2.75 0.00 -1.52 -2.93 103.07 101.92 1pwv h GLY 185 Ca 0.04 0.16 0.01 0.00 0.00 0.00 0.00 47.33 47.54 1pwv h GLY 185 CO -0.00 -0.15 0.56 1.46 0.00 0.00 0.00 176.54 178.41 1pwv h GLN 186 N -0.63 1.10 -2.96 4.80 4.20 -1.46 -3.07 115.11 117.10 1pwv h GLN 186 Ca -0.04 -0.07 -0.21 0.00 0.06 0.00 0.00 58.65 58.39 1pwv h GLN 186 Cb 0.45 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1pwv h GLN 186 CO 0.07 0.73 1.16 -0.25 -0.67 0.00 0.00 178.83 179.87 1pwv n ASP 187 N -4.51 3.48 0.00 1.46 10.43 -0.57 -1.99 116.55 124.86 1pwv n ASP 187 Ca 0.09 -2.13 0.00 0.00 2.57 0.00 0.00 54.79 55.32 1pwv n ASP 187 Cb 0.03 -0.87 0.00 0.00 1.84 0.00 0.00 41.12 42.13 1pwv n ASP 187 CO 0.00 0.00 0.00 -0.11 -1.07 0.00 0.00 177.20 176.02 1pwv n LEU 188 N 3.46 0.00 -0.01 0.64 7.94 -1.17 -4.91 117.00 122.96 1pwv n LEU 188 Ca 0.30 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 55.20 1pwv n LEU 188 Cb 0.30 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.24 1pwv n LEU 188 CO 0.41 0.00 -0.54 0.18 -1.11 0.00 0.00 177.39 176.33 1pwv n LEU 189 N -0.38 0.00 -4.90 -1.96 4.77 -1.03 -5.02 117.00 108.48 1pwv n LEU 189 Ca 0.00 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.69 1pwv n LEU 189 Cb 0.00 0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1pwv n LEU 189 CO 0.00 0.03 0.17 -0.36 -1.33 0.00 0.00 177.39 175.89 1pwv s PHE 190 N -2.06 3.47 0.77 -1.77 2.99 -0.84 -4.58 117.98 115.95 1pwv s PHE 190 Ca -0.01 0.61 -0.04 0.00 0.00 0.00 0.00 56.93 57.50 1pwv s PHE 190 Cb 0.01 -2.07 0.14 0.00 0.00 0.00 0.00 43.02 41.09 1pwv s PHE 190 CO 0.06 0.23 1.05 0.95 -0.00 0.00 0.00 175.22 177.52 1pwv s THR 191 N -2.00 2.11 0.23 0.64 -4.23 -1.26 -4.84 115.64 106.28 1pwv s THR 191 Ca 0.43 -0.48 0.10 0.00 -1.18 0.00 0.00 61.69 60.56 1pwv s THR 191 Cb -0.11 -2.62 -0.05 0.00 1.34 0.00 0.00 72.50 71.06 1pwv s THR 191 CO 0.29 0.00 1.55 -1.13 -0.54 0.00 0.00 174.62 174.79 1pwv h ASN 192 N -0.73 0.00 -0.83 3.99 -1.24 -1.97 -0.80 115.58 113.99 1pwv h ASN 192 Ca -0.38 0.00 0.10 0.00 0.71 0.00 0.00 56.30 56.73 1pwv h ASN 192 Cb 1.26 0.00 -0.08 0.00 0.73 0.00 0.00 38.32 40.24 1pwv h ASN 192 CO 0.40 0.68 0.48 -0.61 -1.29 0.00 0.00 177.43 177.08 1pwv h GLN 193 N 0.00 0.76 0.05 6.67 5.75 -2.00 0.41 115.11 126.75 1pwv h GLN 193 Ca -0.01 -0.05 -0.23 0.00 -0.15 0.00 0.00 58.65 58.22 1pwv h GLN 193 Cb 1.22 -0.17 0.02 0.00 1.07 0.00 0.00 27.48 29.62 1pwv h GLN 193 CO 0.09 0.50 -0.93 -0.07 -2.65 0.00 0.00 178.83 175.78 1pwv h LEU 194 N 0.78 0.73 -0.51 -2.39 3.38 -1.89 -3.02 115.31 112.40 1pwv h LEU 194 Ca 0.41 -0.79 0.08 0.00 0.09 0.00 0.00 57.88 57.67 1pwv h LEU 194 Cb 0.40 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.85 1pwv h LEU 194 CO -0.26 1.44 0.13 0.11 0.09 0.00 0.00 178.44 179.94 1pwv h LYS 195 N 0.11 0.26 0.14 1.13 1.57 0.08 -2.92 116.57 116.94 1pwv h LYS 195 Ca -0.13 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 1pwv h LYS 195 Cb 1.62 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.87 1pwv h LYS 195 CO 0.18 0.17 -0.07 0.93 -0.57 0.00 0.00 179.45 180.10 1pwv h GLU 196 N 0.27 -0.18 -2.57 3.15 3.07 -0.32 -3.45 114.58 114.56 1pwv h GLU 196 Ca 0.25 0.01 -0.36 0.00 -0.50 0.00 0.00 59.36 58.77 1pwv h GLU 196 Cb 0.33 0.04 0.01 0.00 -0.84 0.00 0.00 28.75 28.29 1pwv h GLU 196 CO -0.31 0.11 0.18 1.58 -1.40 0.00 0.00 179.01 179.17 1pwv n HIS 197 N -5.04 0.55 0.00 4.33 -0.00 -1.11 -4.90 115.22 109.05 1pwv n HIS 197 Ca -0.09 0.48 0.00 0.00 0.46 0.00 0.00 57.72 58.57 1pwv n HIS 197 Cb 0.20 -0.93 0.00 0.00 -0.12 0.00 0.00 29.99 29.14 1pwv n HIS 197 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1pwv n PRO 198 N 1.26 0.00 -0.41 1.57 -0.04 -1.26 -4.91 135.00 131.21 1pwv n PRO 198 Ca 0.11 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.28 1pwv n PRO 198 Cb -0.00 -0.49 0.27 0.00 -0.04 0.00 0.00 33.50 33.24 1pwv n PRO 198 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1pwv n THR 199 N -0.07 0.00 -0.95 0.52 5.66 -1.26 -4.99 114.28 113.19 1pwv n THR 199 Ca 0.00 -0.35 -0.29 0.00 -3.05 0.00 0.00 64.05 60.35 1pwv n THR 199 Cb 0.00 -0.96 0.18 0.00 -1.55 0.00 0.00 70.33 67.99 1pwv n THR 199 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1pwv s ASP 200 N -2.52 2.62 -0.39 1.09 1.01 -1.26 -4.94 116.67 112.29 1pwv s ASP 200 Ca 0.67 1.57 -0.24 0.00 0.71 0.00 0.00 52.55 55.26 1pwv s ASP 200 Cb -0.21 -2.23 0.01 0.00 1.01 0.00 0.00 42.92 41.50 1pwv s ASP 200 CO 0.63 -3.18 0.82 -0.36 0.21 0.00 0.00 175.17 173.29 1pwv s PHE 201 N -2.77 3.07 0.54 4.23 0.40 -1.26 -5.01 117.98 117.18 1pwv s PHE 201 Ca 0.65 0.53 -0.03 0.00 -0.60 0.00 0.00 56.93 57.48 1pwv s PHE 201 Cb -0.21 -3.54 0.01 0.00 0.51 0.00 0.00 43.02 39.80 1pwv s PHE 201 CO 0.59 -0.82 0.82 -1.54 0.70 0.00 0.00 175.22 174.97 1pwv s SER 202 N 1.93 5.62 0.54 1.36 1.04 -1.26 -4.91 113.70 118.01 1pwv s SER 202 Ca 0.33 0.51 0.27 0.00 0.48 0.00 0.00 55.95 57.54 1pwv s SER 202 Cb -0.12 -1.57 1.44 0.00 0.10 0.00 0.00 66.02 65.87 1pwv s SER 202 CO 0.19 -0.96 1.96 0.58 0.98 0.00 0.00 173.24 175.98 1pwv h VAL 203 N 0.02 0.65 -0.22 5.02 2.07 -2.00 0.13 116.25 121.93 1pwv h VAL 203 Ca -0.45 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 1pwv h VAL 203 Cb 1.26 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1pwv h VAL 203 CO 0.59 0.00 0.01 -0.33 0.02 0.00 0.00 177.57 177.85 1pwv h GLU 204 N 0.00 0.39 -0.03 1.57 3.07 -2.00 -1.48 114.58 116.10 1pwv h GLU 204 Ca 0.29 -0.12 0.01 0.00 -0.50 0.00 0.00 59.36 59.04 1pwv h GLU 204 Cb 1.21 -0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 29.07 1pwv h GLU 204 CO -0.00 0.57 -0.14 0.35 -1.40 0.00 0.00 179.01 178.39 1pwv h PHE 205 N 0.16 -0.42 -1.34 4.33 3.04 -1.10 -0.05 116.94 121.56 1pwv h PHE 205 Ca 0.06 0.02 0.43 0.00 3.98 0.00 0.00 57.97 62.46 1pwv h PHE 205 Cb 0.39 0.19 -0.12 0.00 2.56 0.00 0.00 35.95 38.96 1pwv h PHE 205 CO 0.03 -0.14 0.87 1.25 -2.02 0.00 0.00 178.31 178.31 1pwv h LEU 206 N -0.15 0.23 -0.54 0.59 5.85 -1.41 0.18 115.31 120.06 1pwv h LEU 206 Ca 0.01 0.12 0.09 0.00 0.84 0.00 0.00 57.88 58.94 1pwv h LEU 206 Cb 0.18 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 1pwv h LEU 206 CO -0.11 -0.16 0.14 -0.08 -0.34 0.00 0.00 178.44 177.89 1pwv h GLU 207 N 0.09 0.28 -1.49 1.25 4.57 0.11 -2.13 114.58 117.27 1pwv h GLU 207 Ca 0.81 -0.02 -0.64 0.00 -1.18 0.00 0.00 59.36 58.34 1pwv h GLU 207 Cb 2.58 -0.06 -0.37 0.00 -0.16 0.00 0.00 28.75 30.74 1pwv h GLU 207 CO -0.38 0.19 -0.16 0.00 -1.18 0.00 0.00 179.01 177.48 1pwv n GLN 208 N -5.08 3.23 -0.46 1.92 10.64 0.61 -4.39 117.38 123.85 1pwv n GLN 208 Ca 0.07 -4.11 -0.02 0.00 -1.83 0.00 0.00 57.00 51.11 1pwv n GLN 208 Cb 0.26 -2.26 -0.02 0.00 -0.86 0.00 0.00 30.24 27.36 1pwv n GLN 208 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1pwv n ASN 209 N -0.56 -0.21 -0.25 2.61 3.02 -1.05 -5.01 115.26 113.80 1pwv n ASN 209 Ca 0.45 -0.66 0.05 0.00 -0.03 0.00 0.00 54.58 54.39 1pwv n ASN 209 Cb 0.60 0.06 0.17 0.00 -0.61 0.00 0.00 39.78 40.00 1pwv n ASN 209 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1pwv h SER 210 N 0.00 -0.13 -0.96 6.41 4.64 -1.60 0.65 113.55 122.56 1pwv h SER 210 Ca -0.12 0.16 0.03 0.00 -0.47 0.00 0.00 61.79 61.39 1pwv h SER 210 Cb 0.67 0.25 -0.05 0.00 -0.31 0.00 0.00 62.40 62.96 1pwv h SER 210 CO -0.06 -0.10 0.63 -1.13 -0.87 0.00 0.00 176.83 175.30 1pwv h ASN 211 N 0.19 1.07 0.54 4.97 -0.73 -1.95 -0.19 115.58 119.48 1pwv h ASN 211 Ca 0.41 -0.02 -0.02 0.00 1.87 0.00 0.00 56.30 58.55 1pwv h ASN 211 Cb 0.72 -0.25 -0.02 0.00 0.27 0.00 0.00 38.32 39.04 1pwv h ASN 211 CO -0.57 0.75 -0.43 -0.33 -0.37 0.00 0.00 177.43 176.48 1pwv h GLU 212 N 1.25 -0.92 -0.57 6.67 4.39 -1.29 -1.20 114.58 122.92 1pwv h GLU 212 Ca 0.37 0.06 0.04 0.00 0.34 0.00 0.00 59.36 60.17 1pwv h GLU 212 Cb -0.06 0.21 -0.04 0.00 -0.10 0.00 0.00 28.75 28.76 1pwv h GLU 212 CO -0.10 -0.61 0.33 0.28 -1.16 0.00 0.00 179.01 177.74 1pwv h VAL 213 N -0.95 1.02 -0.78 3.13 2.07 -1.20 -1.96 116.25 117.58 1pwv h VAL 213 Ca -0.06 -0.22 0.12 0.00 0.82 0.00 0.00 66.70 67.36 1pwv h VAL 213 Cb 0.81 0.33 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 1pwv h VAL 213 CO -0.00 0.12 0.51 1.56 0.02 0.00 0.00 177.57 179.78 1pwv h GLN 214 N 0.64 0.58 0.13 1.57 4.20 -0.81 0.57 115.11 121.99 1pwv h GLN 214 Ca 0.24 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.91 1pwv h GLN 214 Cb 0.07 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.72 1pwv h GLN 214 CO -0.12 0.39 -0.06 1.49 -0.67 0.00 0.00 178.83 179.85 1pwv h GLU 215 N 0.60 -0.16 -0.47 1.46 4.57 -0.46 0.23 114.58 120.35 1pwv h GLU 215 Ca 0.37 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.59 1pwv h GLU 215 Cb 0.62 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.22 1pwv h GLU 215 CO -0.14 0.15 0.28 0.28 -1.18 0.00 0.00 179.01 178.40 1pwv h VAL 216 N -0.49 1.05 0.55 0.32 2.07 -0.86 0.64 116.25 119.53 1pwv h VAL 216 Ca -0.02 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1pwv h VAL 216 Cb 0.39 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1pwv h VAL 216 CO 0.03 0.10 -0.46 0.15 0.02 0.00 0.00 177.57 177.41 1pwv h PHE 217 N 0.56 -1.26 -0.66 1.57 3.57 0.19 -0.58 116.94 120.33 1pwv h PHE 217 Ca 0.19 0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.83 1pwv h PHE 217 Cb 0.01 0.48 -0.10 0.00 2.79 0.00 0.00 35.95 39.13 1pwv h PHE 217 CO -0.07 -0.65 0.11 0.00 -2.23 0.00 0.00 178.31 175.48 1pwv h ALA 218 N -0.79 0.78 0.21 2.41 0.00 0.04 0.37 119.26 122.29 1pwv h ALA 218 Ca -0.06 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1pwv h ALA 218 Cb 0.85 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1pwv h ALA 218 CO -0.01 -0.34 -0.18 -0.22 0.00 0.00 0.00 179.25 178.49 1pwv h LYS 219 N 0.22 -0.40 -0.45 0.00 3.64 0.56 0.12 116.57 120.26 1pwv h LYS 219 Ca 0.36 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.75 1pwv h LYS 219 Cb 0.58 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 1pwv h LYS 219 CO -0.49 -0.27 0.21 0.00 -2.27 0.00 0.00 179.45 176.64 1pwv h ALA 220 N 0.33 1.52 -0.46 5.00 0.00 -0.38 -0.69 119.26 124.59 1pwv h ALA 220 Ca -0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1pwv h ALA 220 Cb 0.38 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1pwv h ALA 220 CO -0.02 0.38 0.12 0.35 0.00 0.00 0.00 179.25 180.08 1pwv h PHE 221 N 0.64 0.76 0.25 0.00 3.57 -0.51 -2.17 116.94 119.48 1pwv h PHE 221 Ca 0.16 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 1pwv h PHE 221 Cb 0.08 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 38.60 1pwv h PHE 221 CO 0.01 0.69 -0.18 0.00 -2.23 0.00 0.00 178.31 176.59 1pwv h ALA 222 N 0.98 -0.99 -0.94 2.41 0.00 0.45 -0.24 119.26 120.93 1pwv h ALA 222 Ca 0.15 -0.08 0.29 0.00 0.00 0.00 0.00 54.91 55.26 1pwv h ALA 222 Cb 0.30 0.33 -0.16 0.00 0.00 0.00 0.00 17.79 18.27 1pwv h ALA 222 CO -0.00 -0.98 0.31 1.88 0.00 0.00 0.00 179.25 180.46 1pwv h TYR 223 N -0.41 0.47 0.22 0.00 -1.99 -1.20 -1.29 116.97 112.77 1pwv h TYR 223 Ca -0.03 0.05 -0.01 0.00 2.00 0.00 0.00 58.73 60.74 1pwv h TYR 223 Cb 0.34 -0.05 0.00 0.00 2.00 0.00 0.00 36.73 39.02 1pwv h TYR 223 CO -0.02 -0.28 -0.11 -0.92 -0.00 0.00 0.00 178.16 176.82 1pwv h TYR 224 N 0.16 -0.28 -0.14 4.88 3.20 -1.13 -2.48 116.97 121.19 1pwv h TYR 224 Ca 0.64 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.54 1pwv h TYR 224 Cb 1.42 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.75 1pwv h TYR 224 CO -0.22 -0.01 -0.08 0.82 -1.64 0.00 0.00 178.16 177.03 1pwv h ILE 225 N -0.53 0.76 -1.76 1.81 1.08 0.08 -3.39 117.51 115.56 1pwv h ILE 225 Ca -0.03 0.00 -0.48 0.00 -0.39 0.00 0.00 64.86 63.96 1pwv h ILE 225 Cb 0.39 0.76 -0.05 0.00 -3.07 0.00 0.00 36.82 34.85 1pwv h ILE 225 CO 0.05 0.00 1.19 -0.70 -0.69 0.00 0.00 178.15 178.00 1pwv s GLU 226 N -6.18 2.81 0.22 2.37 -6.30 -0.78 -4.88 118.70 105.96 1pwv s GLU 226 Ca -0.14 0.12 0.12 0.00 -2.50 0.00 0.00 54.97 52.57 1pwv s GLU 226 Cb 0.10 -4.54 0.79 0.00 0.00 0.00 0.00 34.13 30.47 1pwv s GLU 226 CO 0.68 -2.68 0.96 -0.35 0.02 0.00 0.00 175.26 173.88 1pwv n PRO 227 N 9.15 -0.04 -0.11 4.30 -0.04 -1.26 -0.63 135.00 146.37 1pwv n PRO 227 Ca 0.21 0.84 -0.11 0.00 -0.04 0.00 0.00 63.50 64.40 1pwv n PRO 227 Cb 0.50 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.44 1pwv n PRO 227 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1pwv h GLN 228 N 0.00 0.63 -0.01 0.54 1.08 -1.90 -3.08 115.11 112.38 1pwv h GLN 228 Ca 0.50 -0.24 0.00 0.00 -1.45 0.00 0.00 58.65 57.47 1pwv h GLN 228 Cb 1.31 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.70 1pwv h GLN 228 CO -0.48 0.80 -0.00 0.72 -0.95 0.00 0.00 178.83 178.92 1pwv n HIS 229 N -4.45 0.00 -0.12 2.96 8.25 0.20 -4.04 115.22 118.01 1pwv n HIS 229 Ca -0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.33 1pwv n HIS 229 Cb 0.32 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.41 1pwv n HIS 229 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1pwv h ARG 230 N 0.95 0.61 -0.98 -0.41 2.43 -1.19 -2.90 114.38 112.89 1pwv h ARG 230 Ca 0.00 -0.17 0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1pwv h ARG 230 Cb 0.20 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.63 1pwv h ARG 230 CO 0.00 0.69 0.65 -0.44 -1.51 0.00 0.00 179.97 179.36 1pwv h ASP 231 N 0.45 1.12 -0.45 -3.80 3.32 -1.75 -1.96 116.42 113.35 1pwv h ASP 231 Ca 0.11 -0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.16 1pwv h ASP 231 Cb 0.38 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.62 1pwv h ASP 231 CO 0.01 0.80 0.26 0.58 -1.72 0.00 0.00 179.24 179.17 1pwv h VAL 232 N 1.31 1.03 0.29 -1.35 2.07 -1.76 -0.85 116.25 117.00 1pwv h VAL 232 Ca 0.36 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1pwv h VAL 232 Cb -0.13 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1pwv h VAL 232 CO -0.09 0.10 -0.31 0.25 0.02 0.00 0.00 177.57 177.54 1pwv h LEU 233 N 0.52 -0.83 -2.17 2.57 6.46 -1.21 -1.00 115.31 119.64 1pwv h LEU 233 Ca 0.18 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 58.02 1pwv h LEU 233 Cb 0.03 0.29 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1pwv h LEU 233 CO -0.09 -0.44 0.02 -0.61 -0.62 0.00 0.00 178.44 176.70 1pwv h GLN 234 N -0.64 0.00 0.00 1.25 4.15 -1.04 0.21 115.11 119.04 1pwv h GLN 234 Ca -0.01 0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 1pwv h GLN 234 Cb 0.59 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.27 1pwv h GLN 234 CO -0.07 0.00 -0.38 1.25 -1.93 0.00 0.00 178.83 177.70 1pwv h LEU 235 N 0.00 0.00 0.00 -2.39 5.85 0.09 -3.37 115.31 115.49 1pwv h LEU 235 Ca 0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1pwv h LEU 235 Cb 0.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.07 1pwv h LEU 235 CO 0.00 0.77 -0.92 -1.22 -0.34 0.00 0.00 178.44 176.73 1pwv n TYR 236 N -4.65 0.22 -3.14 1.25 4.01 -0.61 -4.55 117.16 109.69 1pwv n TYR 236 Ca -0.08 0.06 -0.19 0.00 -0.16 0.00 0.00 57.90 57.54 1pwv n TYR 236 Cb 0.24 -0.38 -0.03 0.00 -0.31 0.00 0.00 39.34 38.85 1pwv n TYR 236 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1pwv n ALA 237 N -1.75 1.78 -0.11 -0.72 0.00 0.73 -3.27 120.51 117.17 1pwv n ALA 237 Ca 0.03 -3.16 -0.05 0.00 0.00 0.00 0.00 53.44 50.25 1pwv n ALA 237 Cb 0.41 -0.93 0.02 0.00 0.00 0.00 0.00 19.45 18.95 1pwv n ALA 237 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1pwv h PRO 238 N 3.38 0.05 -0.70 0.00 0.11 -1.72 -1.57 132.00 131.56 1pwv h PRO 238 Ca 0.06 -0.00 0.13 0.00 0.11 0.00 0.00 66.00 66.30 1pwv h PRO 238 Cb 0.95 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.01 1pwv h PRO 238 CO 0.45 0.03 0.47 0.93 -0.21 0.00 0.00 178.00 179.67 1pwv h GLU 239 N 0.05 0.40 0.07 1.05 4.39 -1.94 0.38 114.58 119.00 1pwv h GLU 239 Ca 0.18 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.85 1pwv h GLU 239 Cb 0.26 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1pwv h GLU 239 CO -0.34 0.27 -0.03 0.00 -1.16 0.00 0.00 179.01 177.75 1pwv h ALA 240 N 1.66 -0.09 -0.40 3.43 0.00 -1.70 -2.72 119.26 119.44 1pwv h ALA 240 Ca 0.34 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 55.07 1pwv h ALA 240 Cb 0.73 0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.47 1pwv h ALA 240 CO -0.10 -0.27 -0.34 0.35 0.00 0.00 0.00 179.25 178.89 1pwv h PHE 241 N -0.66 -0.94 -0.24 0.00 3.04 -0.33 -1.19 116.94 116.62 1pwv h PHE 241 Ca -0.01 0.06 0.05 0.00 3.98 0.00 0.00 57.97 62.05 1pwv h PHE 241 Cb 0.55 0.47 -0.07 0.00 2.56 0.00 0.00 35.95 39.45 1pwv h PHE 241 CO 0.10 -0.39 -0.47 -0.91 -2.02 0.00 0.00 178.31 174.62 1pwv h ASN 242 N -0.26 -1.52 -0.00 0.41 -0.26 -1.00 0.22 115.58 113.16 1pwv h ASN 242 Ca 0.17 0.20 0.00 0.00 -0.56 0.00 0.00 56.30 56.11 1pwv h ASN 242 Cb 0.54 0.62 -0.00 0.00 -1.06 0.00 0.00 38.32 38.43 1pwv h ASN 242 CO -0.54 -0.43 -0.02 0.22 -1.06 0.00 0.00 177.43 175.60 1pwv h TYR 243 N -0.46 -0.06 -1.06 1.19 5.03 -1.00 0.13 116.97 120.74 1pwv h TYR 243 Ca 0.08 0.00 0.31 0.00 2.58 0.00 0.00 58.73 61.70 1pwv h TYR 243 Cb 0.63 0.03 -0.04 0.00 1.55 0.00 0.00 36.73 38.89 1pwv h TYR 243 CO -0.58 -0.02 0.79 0.52 -1.32 0.00 0.00 178.16 177.55 1pwv h MET 244 N -0.02 0.00 0.27 1.82 2.86 -1.05 0.45 114.93 119.26 1pwv h MET 244 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1pwv h MET 244 Cb 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.69 1pwv h MET 244 CO -0.02 0.00 -0.13 0.22 1.06 0.00 0.00 176.91 178.04 1pwv h ASP 245 N 0.00 -0.31 -0.66 1.22 -0.00 0.97 -2.25 116.42 115.39 1pwv h ASP 245 Ca 0.50 -0.22 0.00 0.00 -0.00 0.00 0.00 57.03 57.31 1pwv h ASP 245 Cb 2.07 0.08 -0.03 0.00 -0.00 0.00 0.00 39.33 41.45 1pwv h ASP 245 CO -0.01 0.15 0.42 0.50 -0.00 0.00 0.00 179.24 180.30 1pwv h LYS 246 N -0.87 0.89 -0.54 0.28 3.64 0.58 -1.91 116.57 118.64 1pwv h LYS 246 Ca -0.04 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.29 1pwv h LYS 246 Cb 0.51 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1pwv h LYS 246 CO 0.06 0.61 0.33 0.35 -2.27 0.00 0.00 179.45 178.54 1pwv h PHE 247 N 0.90 0.62 0.00 1.91 3.57 -1.03 -2.32 116.94 120.60 1pwv h PHE 247 Ca 0.24 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.76 1pwv h PHE 247 Cb -0.06 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.47 1pwv h PHE 247 CO -0.02 0.37 -0.08 -0.91 -2.23 0.00 0.00 178.31 175.44 1pwv h ASN 248 N 0.67 0.00 0.05 0.41 2.35 -1.26 0.60 115.58 118.40 1pwv h ASN 248 Ca 0.21 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 1pwv h ASN 248 Cb -0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.36 1pwv h ASN 248 CO -0.08 0.01 -0.31 -0.62 -1.65 0.00 0.00 177.43 174.78 1pwv n GLU 249 N -2.62 1.33 0.01 0.81 -0.58 -0.73 -4.86 120.64 114.00 1pwv n GLU 249 Ca 0.05 -1.02 0.00 0.00 -0.42 0.00 0.00 57.16 55.77 1pwv n GLU 249 Cb 0.48 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.87 1pwv n GLU 249 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1pwv n GLN 250 N 0.05 0.00 -0.32 3.49 10.64 -0.89 -5.00 117.38 125.35 1pwv n GLN 250 Ca 0.12 0.00 0.27 0.00 -1.83 0.00 0.00 57.00 55.56 1pwv n GLN 250 Cb 0.45 0.00 0.51 0.00 -0.86 0.00 0.00 30.24 30.34 1pwv n GLN 250 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1pwv n GLU 251 N -2.20 -0.06 -0.29 2.61 1.02 -1.17 -0.94 120.64 119.62 1pwv n GLU 251 Ca 0.00 1.38 0.11 0.00 -0.02 0.00 0.00 57.16 58.63 1pwv n GLU 251 Cb 0.00 -2.41 0.27 0.00 -0.02 0.00 0.00 31.44 29.28 1pwv n GLU 251 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1pwv h ILE 252 N 0.00 0.46 -0.42 -3.67 2.10 -0.05 0.21 117.51 116.13 1pwv h ILE 252 Ca 0.78 -0.11 0.12 0.00 1.08 0.00 0.00 64.86 66.73 1pwv h ILE 252 Cb 1.97 0.10 -0.02 0.00 -1.09 0.00 0.00 36.82 37.79 1pwv h ILE 252 CO -0.79 0.06 0.35 -1.13 -1.08 0.00 0.00 178.15 175.56 1pwv h ASN 253 N 0.33 0.00 0.93 2.19 -1.24 -1.30 1.05 115.58 117.54 1pwv h ASN 253 Ca 0.52 0.00 -0.16 0.00 0.71 0.00 0.00 56.30 57.37 1pwv h ASN 253 Cb 0.96 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.99 1pwv h ASN 253 CO -0.55 0.00 -0.74 -0.07 -1.29 0.00 0.00 177.43 174.78 1pwv h LEU 254 N 0.00 0.00 -0.18 0.34 3.38 -0.74 -2.16 115.31 115.96 1pwv h LEU 254 Ca 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1pwv h LEU 254 Cb 0.90 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1pwv h LEU 254 CO -0.00 0.74 0.04 0.28 0.09 0.00 0.00 178.44 179.59 1pwv h SER 255 N 0.00 0.27 -0.78 -0.43 0.02 0.13 -0.37 113.55 112.39 1pwv h SER 255 Ca -0.01 -0.24 0.06 0.00 -0.84 0.00 0.00 61.79 60.76 1pwv h SER 255 Cb 1.41 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 63.82 1pwv h SER 255 CO 0.10 0.44 0.47 0.25 -1.14 0.00 0.00 176.83 176.95 1pwv h LEU 256 N 0.10 0.73 -0.36 5.07 6.46 -1.17 0.63 115.31 126.78 1pwv h LEU 256 Ca 0.06 0.02 0.03 0.00 -0.12 0.00 0.00 57.88 57.87 1pwv h LEU 256 Cb 0.28 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 40.04 1pwv h LEU 256 CO 0.00 0.47 0.16 -0.08 -0.62 0.00 0.00 178.44 178.37 1pwv h GLU 257 N 0.87 0.32 -0.46 1.25 4.57 -0.68 -0.76 114.58 119.70 1pwv h GLU 257 Ca 0.34 -0.02 -0.10 0.00 -1.18 0.00 0.00 59.36 58.40 1pwv h GLU 257 Cb 0.16 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.66 1pwv h GLU 257 CO -0.17 0.21 -0.12 1.49 -1.18 0.00 0.00 179.01 179.25 1pwv h GLU 258 N 0.33 0.84 -0.05 1.92 4.81 -0.36 -1.78 114.58 120.29 1pwv h GLU 258 Ca 0.15 -0.29 0.01 0.00 -0.13 0.00 0.00 59.36 59.11 1pwv h GLU 258 Cb 0.09 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1pwv h GLU 258 CO -0.13 0.91 -0.03 1.25 -0.73 0.00 0.00 179.01 180.29 1pwv h LEU 259 N 0.75 -0.10 -1.02 1.64 6.46 -0.34 -2.10 115.31 120.60 1pwv h LEU 259 Ca 0.12 0.02 0.06 0.00 -0.12 0.00 0.00 57.88 57.96 1pwv h LEU 259 Cb 0.62 0.05 -0.06 0.00 -0.73 0.00 0.00 40.66 40.54 1pwv h LEU 259 CO 0.04 -0.04 0.65 0.11 -0.62 0.00 0.00 178.44 178.58 1pwv h LYS 260 N -0.03 1.16 0.00 1.25 1.57 -0.92 -0.57 116.57 119.02 1pwv h LYS 260 Ca 0.03 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1pwv h LYS 260 Cb 0.08 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.13 1pwv h LYS 260 CO -0.07 0.77 0.00 0.22 -0.57 0.00 0.00 179.45 179.80 1pwv h ASP 261 N 1.19 0.00 0.89 0.86 -0.00 -0.63 -0.11 116.42 118.63 1pwv h ASP 261 Ca 0.42 0.00 -0.23 0.00 -0.00 0.00 0.00 57.03 57.22 1pwv h ASP 261 Cb 0.13 0.00 -0.03 0.00 -0.00 0.00 0.00 39.33 39.43 1pwv h ASP 261 CO -0.16 0.00 -1.14 1.56 -0.00 0.00 0.00 179.24 179.50 1pwv h GLN 262 N 0.00 0.02 -6.20 0.28 1.08 -0.88 -3.46 115.11 105.94 1pwv h GLN 262 Ca 0.00 -0.03 -0.56 0.00 -1.45 0.00 0.00 58.65 56.61 1pwv h GLN 262 Cb 0.00 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.41 1pwv h GLN 262 CO 0.00 0.93 0.88 1.03 -0.95 0.00 0.00 178.83 180.71 1pwv s ARG 263 N -2.69 4.25 0.14 1.46 1.81 -0.05 -4.96 118.95 118.91 1pwv s ARG 263 Ca -0.00 1.72 -0.19 0.00 -1.72 0.00 0.00 55.73 55.54 1pwv s ARG 263 Cb 0.09 -3.73 0.00 0.00 -0.45 0.00 0.00 34.95 30.87 1pwv s ARG 263 CO 0.82 -0.66 1.71 1.98 -0.68 0.00 0.00 175.30 178.47 1pwv h MET 264 N 8.14 0.06 -0.62 3.54 1.85 -1.88 -1.13 114.93 124.89 1pwv h MET 264 Ca -0.30 -0.00 -0.04 0.00 -0.61 0.00 0.00 59.70 58.75 1pwv h MET 264 Cb 1.12 -0.01 -0.03 0.00 0.43 0.00 0.00 31.60 33.11 1pwv h MET 264 CO 0.95 0.04 0.23 -0.07 -0.40 0.00 0.00 176.91 177.65 1pwv h LEU 265 N 0.06 0.86 -0.49 3.39 4.07 -1.93 -2.15 115.31 119.13 1pwv h LEU 265 Ca 0.12 -0.18 0.01 0.00 0.08 0.00 0.00 57.88 57.90 1pwv h LEU 265 Cb 0.16 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 41.65 1pwv h LEU 265 CO -0.21 0.81 0.32 0.28 -1.08 0.00 0.00 178.44 178.56 1pwv h SER 266 N 0.87 0.55 -0.91 -0.43 0.02 -1.76 0.21 113.55 112.09 1pwv h SER 266 Ca 0.20 -0.01 0.09 0.00 -0.84 0.00 0.00 61.79 61.23 1pwv h SER 266 Cb 0.23 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.57 1pwv h SER 266 CO -0.01 0.40 0.59 0.03 -1.14 0.00 0.00 176.83 176.69 1pwv h ARG 267 N 0.66 0.93 0.04 3.45 3.08 -0.90 -2.19 114.38 119.45 1pwv h ARG 267 Ca 0.18 -0.06 -0.27 0.00 0.07 0.00 0.00 59.98 59.91 1pwv h ARG 267 Cb -0.07 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.74 1pwv h ARG 267 CO -0.04 0.61 -1.42 1.88 -1.07 0.00 0.00 179.97 179.93 1pwv h TYR 268 N 0.96 0.15 -0.49 3.04 0.05 -0.72 -2.58 116.97 117.38 1pwv h TYR 268 Ca 0.41 -0.11 0.02 0.00 0.05 0.00 0.00 58.73 59.10 1pwv h TYR 268 Cb 0.33 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 38.04 1pwv h TYR 268 CO -0.00 1.14 0.32 1.49 -1.05 0.00 0.00 178.16 180.06 1pwv h GLU 269 N 0.02 0.57 0.16 4.88 4.81 -0.34 -0.64 114.58 124.04 1pwv h GLU 269 Ca -0.18 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.01 1pwv h GLU 269 Cb 1.93 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 31.19 1pwv h GLU 269 CO 0.12 0.38 -0.08 -0.22 -0.73 0.00 0.00 179.01 178.48 1pwv h LYS 270 N 0.59 -0.21 -1.00 1.92 3.64 -1.41 -2.94 116.57 117.16 1pwv h LYS 270 Ca 0.19 0.01 0.23 0.00 -1.27 0.00 0.00 60.65 59.82 1pwv h LYS 270 Cb 0.04 0.05 -0.12 0.00 -0.41 0.00 0.00 32.23 31.79 1pwv h LYS 270 CO -0.05 0.21 0.59 2.35 -2.27 0.00 0.00 179.45 180.28 1pwv h TRP 271 N -0.89 1.01 0.23 1.91 2.91 -1.23 -2.63 115.95 117.26 1pwv h TRP 271 Ca -0.02 0.04 -0.01 0.00 1.13 0.00 0.00 58.89 60.02 1pwv h TRP 271 Cb 0.51 -0.29 0.00 0.00 -0.51 0.00 0.00 29.16 28.87 1pwv h TRP 271 CO 0.08 0.10 -0.11 0.93 -1.03 0.00 0.00 178.44 178.41 1pwv h GLU 272 N 0.62 -0.30 -0.78 2.65 4.39 -1.15 -0.34 114.58 119.68 1pwv h GLU 272 Ca 0.62 0.02 0.17 0.00 0.34 0.00 0.00 59.36 60.52 1pwv h GLU 272 Cb 1.14 0.07 -0.11 0.00 -0.10 0.00 0.00 28.75 29.74 1pwv h GLU 272 CO -0.46 0.02 0.23 0.87 -1.16 0.00 0.00 179.01 178.51 1pwv h LYS 273 N -0.66 0.30 -0.24 2.33 1.57 -1.29 0.25 116.57 118.84 1pwv h LYS 273 Ca -0.03 -0.02 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 1pwv h LYS 273 Cb 0.46 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1pwv h LYS 273 CO 0.05 0.20 -0.11 0.82 -0.57 0.00 0.00 179.45 179.84 1pwv h ILE 274 N 0.30 1.30 -0.66 1.86 2.04 -1.46 0.56 117.51 121.46 1pwv h ILE 274 Ca 0.45 -1.18 0.10 0.00 1.00 0.00 0.00 64.86 65.23 1pwv h ILE 274 Cb 0.78 1.57 -0.04 0.00 -0.74 0.00 0.00 36.82 38.39 1pwv h ILE 274 CO -0.51 0.37 0.44 0.50 0.00 0.00 0.00 178.15 178.94 1pwv h LYS 275 N 0.22 0.46 0.01 2.37 3.64 0.56 -1.24 116.57 122.59 1pwv h LYS 275 Ca 0.05 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.21 1pwv h LYS 275 Cb 0.61 -0.10 0.02 0.00 -0.41 0.00 0.00 32.23 32.34 1pwv h LYS 275 CO 0.03 0.31 -0.77 0.37 -2.27 0.00 0.00 179.45 177.12 1pwv h GLN 276 N 0.48 0.51 0.00 1.90 4.15 -0.28 -2.55 115.11 119.31 1pwv h GLN 276 Ca 0.31 -0.55 0.00 0.00 0.77 0.00 0.00 58.65 59.17 1pwv h GLN 276 Cb 0.56 0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.41 1pwv h GLN 276 CO -0.09 1.19 0.00 1.25 -1.93 0.00 0.00 178.83 179.24 1pwv h HIS 277 N 0.06 0.00 -0.16 3.99 2.76 0.29 -1.24 115.15 120.84 1pwv h HIS 277 Ca -0.10 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.07 1pwv h HIS 277 Cb 1.46 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.42 1pwv h HIS 277 CO 0.13 0.00 0.00 0.66 -1.30 0.00 0.00 177.93 177.42 1pwv n TYR 278 N -2.73 0.22 -0.12 5.26 4.02 -0.90 -4.79 117.16 118.13 1pwv n TYR 278 Ca -0.01 -0.51 -0.05 0.00 -0.01 0.00 0.00 57.90 57.31 1pwv n TYR 278 Cb 0.12 -0.04 0.01 0.00 -0.02 0.00 0.00 39.34 39.40 1pwv n TYR 278 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1pwv h GLN 279 N 0.95 -0.10 -0.14 -0.72 5.75 -0.78 0.78 115.11 120.84 1pwv h GLN 279 Ca 0.00 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.50 1pwv h GLN 279 Cb 0.63 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 29.19 1pwv h GLN 279 CO 0.00 -0.07 0.08 1.25 -2.65 0.00 0.00 178.83 177.44 1pwv h HIS 280 N -0.11 0.20 -0.99 3.99 2.76 -1.87 0.11 115.15 119.24 1pwv h HIS 280 Ca 0.20 -0.01 0.18 0.00 -2.20 0.00 0.00 60.37 58.54 1pwv h HIS 280 Cb 0.41 -0.06 -0.10 0.00 1.55 0.00 0.00 27.41 29.20 1pwv h HIS 280 CO -0.43 0.22 0.60 2.35 -1.30 0.00 0.00 177.93 179.37 1pwv h TRP 281 N 0.13 1.05 0.11 5.26 7.01 -1.69 0.15 115.95 127.98 1pwv h TRP 281 Ca 0.05 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.08 1pwv h TRP 281 Cb 0.08 -0.32 0.00 0.00 -2.10 0.00 0.00 29.16 26.83 1pwv h TRP 281 CO -0.04 0.26 -0.05 0.77 -2.79 0.00 0.00 178.44 176.58 1pwv h SER 282 N 0.78 -0.13 -0.82 2.65 0.02 -0.38 -2.41 113.55 113.27 1pwv h SER 282 Ca 0.56 -0.40 0.19 0.00 -0.84 0.00 0.00 61.79 61.30 1pwv h SER 282 Cb 0.83 0.03 -0.05 0.00 0.14 0.00 0.00 62.40 63.35 1pwv h SER 282 CO -0.37 0.49 0.55 0.44 -1.14 0.00 0.00 176.83 176.80 1pwv h ASP 283 N -0.91 0.32 1.30 3.07 3.32 -0.41 0.13 116.42 123.24 1pwv h ASP 283 Ca -0.02 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1pwv h ASP 283 Cb 0.52 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1pwv h ASP 283 CO 0.03 0.14 -0.31 0.77 -1.72 0.00 0.00 179.24 178.15 1pwv h SER 284 N 0.33 0.00 -2.43 6.45 4.64 -0.77 -3.46 113.55 118.31 1pwv h SER 284 Ca 0.41 -0.07 -0.56 0.00 -0.47 0.00 0.00 61.79 61.10 1pwv h SER 284 Cb 1.10 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 63.25 1pwv h SER 284 CO -0.12 0.04 0.93 -0.11 -0.87 0.00 0.00 176.83 176.69 1pwv n LEU 285 N -2.37 3.56 0.00 5.97 0.00 0.46 -4.99 117.00 119.62 1pwv n LEU 285 Ca 0.04 1.06 0.00 0.00 0.00 0.00 0.00 56.01 57.11 1pwv n LEU 285 Cb 0.46 -1.49 0.00 0.00 0.00 0.00 0.00 43.42 42.39 1pwv n LEU 285 CO 0.34 -0.05 0.00 -1.54 0.00 0.00 0.00 177.39 176.14 1pwv n SER 286 N 4.02 -0.31 -0.03 1.96 3.41 -1.26 -4.92 113.62 116.49 1pwv n SER 286 Ca 0.17 -0.66 -0.08 0.00 -0.26 0.00 0.00 58.87 58.05 1pwv n SER 286 Cb 0.32 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.21 1pwv n SER 286 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1pwv h GLU 287 N 0.00 -0.07 -0.89 4.33 4.57 -2.00 -3.19 114.58 117.33 1pwv h GLU 287 Ca 0.00 0.00 0.15 0.00 -1.18 0.00 0.00 59.36 58.34 1pwv h GLU 287 Cb 0.00 0.01 -0.10 0.00 -0.16 0.00 0.00 28.75 28.51 1pwv h GLU 287 CO 0.00 0.39 0.49 0.93 -1.18 0.00 0.00 179.01 179.64 1pwv h GLU 288 N -0.97 0.66 -0.53 1.92 5.08 -1.99 -0.37 114.58 118.38 1pwv h GLU 288 Ca -0.01 -0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.42 1pwv h GLU 288 Cb 0.49 -0.15 -0.09 0.00 0.50 0.00 0.00 28.75 29.50 1pwv h GLU 288 CO 0.01 0.44 0.00 0.78 -1.00 0.00 0.00 179.01 179.24 1pwv h GLY 289 N 0.68 0.55 1.85 -3.84 0.00 -1.93 0.32 103.07 100.70 1pwv h GLY 289 Ca 0.49 0.07 -0.12 0.00 0.00 0.00 0.00 47.33 47.77 1pwv h GLY 289 CO -0.36 -0.15 -0.50 3.21 0.00 0.00 0.00 176.54 178.74 1pwv h ARG 290 N 0.12 0.16 -0.40 4.80 3.08 -1.11 -2.25 114.38 118.78 1pwv h ARG 290 Ca 0.27 -0.09 -0.04 0.00 0.07 0.00 0.00 59.98 60.19 1pwv h ARG 290 Cb 0.42 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 1pwv h ARG 290 CO -0.45 0.63 0.06 0.78 -1.07 0.00 0.00 179.97 179.92 1pwv h GLY 291 N 1.39 0.66 0.50 0.04 0.00 0.26 -1.14 103.07 104.78 1pwv h GLY 291 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 1pwv h GLY 291 CO 0.07 0.35 -0.21 1.41 0.00 0.00 0.00 176.54 178.15 1pwv h LEU 292 N 0.59 -0.51 -1.95 3.11 3.38 -0.85 -1.32 115.31 117.77 1pwv h LEU 292 Ca 0.13 -0.04 0.26 0.00 0.09 0.00 0.00 57.88 58.32 1pwv h LEU 292 Cb 0.28 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 1pwv h LEU 292 CO 0.00 -0.08 0.69 -0.07 0.09 0.00 0.00 178.44 179.07 1pwv h LEU 293 N -1.11 0.00 0.12 1.67 3.38 -1.32 -1.40 115.31 116.66 1pwv h LEU 293 Ca -0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1pwv h LEU 293 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1pwv h LEU 293 CO 0.10 0.00 -0.06 0.50 0.09 0.00 0.00 178.44 179.07 1pwv h LYS 294 N 0.00 -0.15 0.00 1.13 1.63 -1.13 -3.17 116.57 114.88 1pwv h LYS 294 Ca 0.43 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.24 1pwv h LYS 294 Cb 1.80 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 33.47 1pwv h LYS 294 CO -0.00 0.18 0.00 0.36 -3.45 0.00 0.00 179.45 176.54 1pwv n LYS 295 N -4.85 0.07 0.11 1.90 2.85 -0.50 -0.78 118.16 116.95 1pwv n LYS 295 Ca -0.05 0.27 0.07 0.00 -1.05 0.00 0.00 58.31 57.55 1pwv n LYS 295 Cb 0.20 -1.50 0.02 0.00 -0.65 0.00 0.00 35.03 33.10 1pwv n LYS 295 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1pwv h LEU 296 N 0.00 0.00 0.00 -5.58 7.12 -1.32 -3.34 115.31 112.19 1pwv h LEU 296 Ca 0.00 0.00 -0.18 0.00 0.13 0.00 0.00 57.88 57.83 1pwv h LEU 296 Cb 0.12 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.22 1pwv h LEU 296 CO 0.00 0.22 -1.58 0.00 -0.13 0.00 0.00 178.44 176.95 1pwv n GLN 297 N -2.90 0.63 -3.58 1.25 6.02 0.04 -4.72 117.38 114.11 1pwv n GLN 297 Ca -0.01 0.16 -0.26 0.00 -0.01 0.00 0.00 57.00 56.87 1pwv n GLN 297 Cb 0.65 -1.75 -0.16 0.00 1.02 0.00 0.00 30.24 30.00 1pwv n GLN 297 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1pwv s ILE 298 N -2.93 -0.10 0.52 5.09 -4.36 -1.06 -5.13 121.20 113.23 1pwv s ILE 298 Ca -0.04 -0.31 -0.23 0.00 -0.26 0.00 0.00 60.65 59.81 1pwv s ILE 298 Cb 0.09 -0.68 -0.06 0.00 1.25 0.00 0.00 42.46 43.06 1pwv s ILE 298 CO 0.82 -0.39 1.37 -2.65 0.24 0.00 0.00 174.94 174.34 1pwv n PRO 299 N 5.28 1.82 -2.97 0.37 -0.02 -1.26 -4.59 135.00 133.63 1pwv n PRO 299 Ca -0.07 0.66 -0.41 0.00 -2.02 0.00 0.00 63.50 61.67 1pwv n PRO 299 Cb 0.47 -2.59 -0.05 0.00 -0.02 0.00 0.00 33.50 31.32 1pwv n PRO 299 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1pwv s ILE 300 N -1.26 4.94 0.50 4.25 1.09 -1.03 -4.87 121.20 124.81 1pwv s ILE 300 Ca 0.69 1.49 -0.16 0.00 -1.10 0.00 0.00 60.65 61.57 1pwv s ILE 300 Cb -0.43 -4.07 -0.08 0.00 -1.06 0.00 0.00 42.46 36.82 1pwv s ILE 300 CO 0.51 0.09 0.96 -0.70 -0.10 0.00 0.00 174.94 175.70 1pwv s GLU 301 N 1.84 3.94 0.39 2.79 2.56 -1.26 -1.29 118.70 127.68 1pwv s GLU 301 Ca 0.36 0.91 -0.27 0.00 0.00 0.00 0.00 54.97 55.97 1pwv s GLU 301 Cb -0.17 -2.16 -0.09 0.00 2.00 0.00 0.00 34.13 33.71 1pwv s GLU 301 CO 0.13 -0.23 1.32 -2.14 -0.56 0.00 0.00 175.26 173.77 1pwv s PRO 302 N -4.01 4.05 -0.15 4.30 0.02 -1.26 -4.93 135.00 133.02 1pwv s PRO 302 Ca 0.58 2.20 -0.07 0.00 0.02 0.00 0.00 61.00 63.74 1pwv s PRO 302 Cb -0.10 -2.83 -0.04 0.00 0.02 0.00 0.00 34.50 31.55 1pwv s PRO 302 CO 0.30 -0.44 0.10 0.15 -0.33 0.00 0.00 177.00 176.78 1pwv s LYS 303 N -2.15 3.67 0.11 5.54 1.02 -1.26 -5.02 119.74 121.65 1pwv s LYS 303 Ca 0.55 -0.25 -0.31 0.00 0.02 0.00 0.00 55.97 55.98 1pwv s LYS 303 Cb -0.39 -3.19 -0.11 0.00 -0.52 0.00 0.00 37.83 33.62 1pwv s LYS 303 CO 0.51 0.53 1.59 0.87 -0.92 0.00 0.00 175.35 177.93 1pwv h LYS 304 N 5.82 -0.67 0.00 1.68 6.56 -1.99 -1.04 116.57 126.93 1pwv h LYS 304 Ca -0.47 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.17 1pwv h LYS 304 Cb 1.19 0.15 0.00 0.00 -0.57 0.00 0.00 32.23 33.00 1pwv h LYS 304 CO 0.65 -0.45 0.52 -0.44 -2.06 0.00 0.00 179.45 177.67 1pwv h ASP 305 N -0.70 0.00 0.00 0.86 5.19 -1.99 0.12 116.42 119.90 1pwv h ASP 305 Ca 0.00 0.00 -0.22 0.00 -0.62 0.00 0.00 57.03 56.19 1pwv h ASP 305 Cb 0.69 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 40.17 1pwv h ASP 305 CO -0.18 0.00 -1.64 0.47 -3.12 0.00 0.00 179.24 174.76 1pwv n ASP 306 N -2.21 1.93 0.03 6.45 9.92 -0.61 -3.53 116.55 128.52 1pwv n ASP 306 Ca -0.01 0.37 -0.15 0.00 -0.53 0.00 0.00 54.79 54.48 1pwv n ASP 306 Cb 0.54 -0.81 -0.10 0.00 -0.64 0.00 0.00 41.12 40.11 1pwv n ASP 306 CO 0.00 0.00 0.00 0.40 0.13 0.00 0.00 177.20 177.73 1pwv h ILE 307 N -1.00 0.00 -0.55 0.53 1.08 0.17 0.71 117.51 118.45 1pwv h ILE 307 Ca -0.34 0.00 0.11 0.00 -0.39 0.00 0.00 64.86 64.24 1pwv h ILE 307 Cb 1.25 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 34.91 1pwv h ILE 307 CO -0.21 0.00 0.02 0.40 -0.69 0.00 0.00 178.15 177.68 1pwv h ILE 308 N -0.63 0.58 -0.94 -0.67 1.08 -1.09 0.30 117.51 116.14 1pwv h ILE 308 Ca 0.02 -0.05 0.05 0.00 -0.39 0.00 0.00 64.86 64.49 1pwv h ILE 308 Cb 0.69 0.43 -0.06 0.00 -3.07 0.00 0.00 36.82 34.80 1pwv h ILE 308 CO -0.37 0.03 0.61 -0.74 -0.69 0.00 0.00 178.15 176.98 1pwv h HIS 309 N 0.14 1.13 -0.30 1.37 2.76 -1.21 -2.80 115.15 116.25 1pwv h HIS 309 Ca 0.28 0.03 -0.06 0.00 -2.20 0.00 0.00 60.37 58.42 1pwv h HIS 309 Cb 0.44 -0.37 -0.01 0.00 1.55 0.00 0.00 27.41 29.01 1pwv h HIS 309 CO -0.32 0.62 -0.05 0.77 -1.30 0.00 0.00 177.93 177.65 1pwv h SER 310 N 1.14 0.57 -1.01 3.26 0.02 0.23 -3.45 113.55 114.32 1pwv h SER 310 Ca 0.39 -0.35 -0.86 0.00 -0.84 0.00 0.00 61.79 60.14 1pwv h SER 310 Cb 0.09 -0.15 0.02 0.00 0.14 0.00 0.00 62.40 62.49 1pwv h SER 310 CO -0.15 0.78 0.54 0.18 -1.14 0.00 0.00 176.83 177.04 1pwv n LEU 311 N -4.50 0.93 -4.56 5.07 4.77 -0.31 -4.92 117.00 113.48 1pwv n LEU 311 Ca -0.03 1.18 -0.29 0.00 -0.03 0.00 0.00 56.01 56.85 1pwv n LEU 311 Cb 0.30 -0.89 0.22 0.00 -2.33 0.00 0.00 43.42 40.72 1pwv n LEU 311 CO 0.40 -1.09 0.57 -0.55 -1.33 0.00 0.00 177.39 175.38 1pwv s SER 312 N 2.28 1.60 0.11 -1.43 0.15 -1.26 -4.49 113.70 110.66 1pwv s SER 312 Ca 1.02 1.44 -0.25 0.00 0.70 0.00 0.00 55.95 58.85 1pwv s SER 312 Cb -1.44 -2.17 -0.07 0.00 -1.71 0.00 0.00 66.02 60.63 1pwv s SER 312 CO 0.76 -3.81 1.66 -0.61 1.20 0.00 0.00 173.24 172.44 1pwv h GLN 313 N -2.35 -0.32 -0.43 5.44 5.75 -1.98 0.39 115.11 121.61 1pwv h GLN 313 Ca -0.58 0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 57.88 1pwv h GLN 313 Cb 1.33 0.07 -0.02 0.00 1.07 0.00 0.00 27.48 29.93 1pwv h GLN 313 CO 0.52 -0.21 0.05 1.05 -2.65 0.00 0.00 178.83 177.60 1pwv h GLU 314 N -0.33 0.73 -0.04 1.69 4.11 -1.99 -1.60 114.58 117.15 1pwv h GLU 314 Ca 0.05 -0.20 0.03 0.00 0.07 0.00 0.00 59.36 59.31 1pwv h GLU 314 Cb 0.38 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 1pwv h GLU 314 CO -0.15 0.77 -0.19 0.93 0.07 0.00 0.00 179.01 180.43 1pwv h GLU 315 N 0.58 -0.28 -0.58 1.06 5.08 -1.77 0.68 114.58 119.35 1pwv h GLU 315 Ca 0.13 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.58 1pwv h GLU 315 Cb 0.40 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.66 1pwv h GLU 315 CO 0.01 -0.19 0.24 -0.22 -1.00 0.00 0.00 179.01 177.86 1pwv h LYS 316 N -0.29 0.44 0.83 2.33 3.64 -0.16 -1.44 116.57 121.92 1pwv h LYS 316 Ca 0.07 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1pwv h LYS 316 Cb 0.39 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1pwv h LYS 316 CO -0.21 0.29 -0.40 0.93 -2.27 0.00 0.00 179.45 177.79 1pwv h GLU 317 N 0.45 -1.08 0.00 1.90 4.39 -0.44 -2.80 114.58 117.00 1pwv h GLU 317 Ca 0.28 0.07 0.00 0.00 0.34 0.00 0.00 59.36 60.05 1pwv h GLU 317 Cb 0.29 0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.19 1pwv h GLU 317 CO -0.25 -0.71 0.47 1.25 -1.16 0.00 0.00 179.01 178.61 1pwv h LEU 318 N -1.23 0.00 0.00 1.33 5.85 0.64 -0.81 115.31 121.09 1pwv h LEU 318 Ca -0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1pwv h LEU 318 Cb 0.87 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.90 1pwv h LEU 318 CO 0.19 0.00 0.00 -0.11 -0.34 0.00 0.00 178.44 178.18 1pwv n LEU 319 N -2.68 0.00 -0.03 2.25 7.94 -0.57 -3.14 117.00 120.77 1pwv n LEU 319 Ca -0.01 0.00 0.04 0.00 -1.11 0.00 0.00 56.01 54.92 1pwv n LEU 319 Cb 0.50 0.00 -0.14 0.00 0.53 0.00 0.00 43.42 44.31 1pwv n LEU 319 CO 0.09 0.00 -0.83 0.29 -1.11 0.00 0.00 177.39 175.84 1pwv n LYS 320 N -0.94 0.75 -0.32 1.96 4.01 -0.31 -4.32 118.16 118.99 1pwv n LYS 320 Ca 0.12 -0.12 0.07 0.00 -0.51 0.00 0.00 58.31 57.87 1pwv n LYS 320 Cb 0.06 -1.44 0.23 0.00 -0.51 0.00 0.00 35.03 33.36 1pwv n LYS 320 CO 0.00 0.00 0.00 -2.13 -1.11 0.00 0.00 177.40 174.16 1pwv n ARG 321 N -2.30 2.43 -3.56 1.97 3.00 -1.19 -4.90 116.66 112.12 1pwv n ARG 321 Ca -0.11 -1.85 -0.36 0.00 -0.00 0.00 0.00 57.85 55.53 1pwv n ARG 321 Cb 0.66 -1.51 -0.07 0.00 0.00 0.00 0.00 32.46 31.54 1pwv n ARG 321 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.63 178.59 1pwv s ILE 322 N -1.50 5.32 -0.91 5.15 -4.36 -1.26 -4.96 121.20 118.69 1pwv s ILE 322 Ca 0.34 0.50 -0.00 0.00 -0.26 0.00 0.00 60.65 61.23 1pwv s ILE 322 Cb 0.19 -3.61 0.33 0.00 1.25 0.00 0.00 42.46 40.63 1pwv s ILE 322 CO 0.20 0.39 1.74 1.67 0.24 0.00 0.00 174.94 179.18 1pwv n GLN 323 N 3.59 4.46 -0.01 0.37 0.00 -1.26 -4.88 117.38 119.64 1pwv n GLN 323 Ca -0.12 -4.41 0.01 0.00 -0.00 0.00 0.00 57.00 52.47 1pwv n GLN 323 Cb 0.52 -2.38 0.02 0.00 0.00 0.00 0.00 30.24 28.39 1pwv n GLN 323 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1pwv n ILE 324 N -0.22 -0.02 0.18 1.69 2.08 -1.26 0.36 119.36 122.18 1pwv n ILE 324 Ca 0.46 0.09 0.01 0.00 0.56 0.00 0.00 62.75 63.88 1pwv n ILE 324 Cb 0.29 -0.14 0.08 0.00 -0.75 0.00 0.00 39.64 39.12 1pwv n ILE 324 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1pwv n ASP 325 N -3.55 0.00 0.10 4.38 8.00 -1.26 -2.89 116.55 121.33 1pwv n ASP 325 Ca 0.01 -0.09 -0.05 0.00 0.71 0.00 0.00 54.79 55.37 1pwv n ASP 325 Cb 0.04 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.12 1pwv n ASP 325 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1pwv h SER 326 N 0.00 -0.25 -0.51 -2.24 0.87 0.61 -3.46 113.55 108.56 1pwv h SER 326 Ca 0.00 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1pwv h SER 326 Cb 0.00 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1pwv h SER 326 CO 0.00 -0.01 0.00 -1.54 -0.53 0.00 0.00 176.83 174.75 1pwv n SER 327 N -3.72 -1.02 0.00 6.23 3.41 -1.14 -5.03 113.62 112.34 1pwv n SER 327 Ca -0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 1pwv n SER 327 Cb 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 1pwv n SER 327 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1pwv n ASP 328 N -1.54 0.00 0.00 4.04 5.75 -1.26 -4.82 116.55 118.73 1pwv n ASP 328 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1pwv n ASP 328 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1pwv n ASP 328 CO 0.00 0.00 0.00 2.22 -0.11 0.00 0.00 177.20 179.31 1pwv n PHE 329 N -1.19 0.00 -3.82 2.11 1.16 -1.26 -4.20 117.46 110.25 1pwv n PHE 329 Ca 0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.21 1pwv n PHE 329 Cb 0.00 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 37.74 1pwv n PHE 329 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 1pwv s LEU 330 N -1.84 4.08 0.75 5.98 1.43 -1.26 -5.09 118.68 122.73 1pwv s LEU 330 Ca 0.00 -1.15 -0.13 0.00 -1.03 0.00 0.00 54.13 51.82 1pwv s LEU 330 Cb 0.00 -1.80 0.05 0.00 0.03 0.00 0.00 46.19 44.47 1pwv s LEU 330 CO 0.00 -0.29 1.13 -0.94 0.23 0.00 0.00 176.35 176.49 1pwv s SER 331 N 1.35 4.39 0.27 2.29 1.04 -1.26 -4.51 113.70 117.27 1pwv s SER 331 Ca -0.03 2.06 -0.06 0.00 0.48 0.00 0.00 55.95 58.40 1pwv s SER 331 Cb -0.19 -2.55 0.49 0.00 0.10 0.00 0.00 66.02 63.86 1pwv s SER 331 CO 0.01 -2.11 1.59 0.74 0.98 0.00 0.00 173.24 174.44 1pwv h THR 332 N -0.66 0.13 -0.30 2.02 2.02 -1.98 0.43 112.91 114.58 1pwv h THR 332 Ca -0.45 -0.01 0.07 0.00 0.77 0.00 0.00 66.41 66.78 1pwv h THR 332 Cb 1.26 0.11 -0.07 0.00 -1.74 0.00 0.00 68.15 67.71 1pwv h THR 332 CO 0.50 0.00 -0.13 -0.33 0.37 0.00 0.00 175.52 175.94 1pwv h GLU 333 N 0.02 -0.08 -0.32 6.66 3.07 -1.99 0.25 114.58 122.20 1pwv h GLU 333 Ca 0.47 0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 59.32 1pwv h GLU 333 Cb 0.80 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.72 1pwv h GLU 333 CO -0.87 -0.05 0.14 0.93 -1.40 0.00 0.00 179.01 177.76 1pwv h GLU 334 N -0.08 0.46 -0.16 2.33 5.08 -0.99 0.18 114.58 121.41 1pwv h GLU 334 Ca 0.15 -0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 1pwv h GLU 334 Cb 0.31 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 29.42 1pwv h GLU 334 CO -0.35 0.45 -0.38 0.87 -1.00 0.00 0.00 179.01 178.59 1pwv h LYS 335 N 0.37 -0.43 -0.35 2.33 1.79 0.74 0.18 116.57 121.21 1pwv h LYS 335 Ca 0.11 0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.60 1pwv h LYS 335 Cb 0.14 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 1pwv h LYS 335 CO -0.01 -0.28 0.20 0.93 -1.08 0.00 0.00 179.45 179.20 1pwv h GLU 336 N -0.44 0.48 0.40 3.15 5.08 -0.41 0.66 114.58 123.50 1pwv h GLU 336 Ca 0.09 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1pwv h GLU 336 Cb 0.60 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 1pwv h GLU 336 CO -0.40 0.39 -0.51 0.35 -1.00 0.00 0.00 179.01 177.84 1pwv h PHE 337 N 0.44 -1.44 -0.15 4.33 3.57 -0.36 -1.51 116.94 121.82 1pwv h PHE 337 Ca 0.12 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.69 1pwv h PHE 337 Cb 0.04 0.58 -0.07 0.00 2.79 0.00 0.00 35.95 39.29 1pwv h PHE 337 CO -0.03 -0.65 -0.38 -0.07 -2.23 0.00 0.00 178.31 174.95 1pwv h LEU 338 N -0.94 -1.19 -1.30 0.59 3.38 -0.59 -1.51 115.31 113.74 1pwv h LEU 338 Ca -0.05 0.17 0.41 0.00 0.09 0.00 0.00 57.88 58.50 1pwv h LEU 338 Cb 0.85 0.50 -0.14 0.00 0.09 0.00 0.00 40.66 41.96 1pwv h LEU 338 CO -0.12 -0.40 0.77 0.50 0.09 0.00 0.00 178.44 179.28 1pwv h LYS 339 N -0.44 0.11 -0.00 1.13 3.64 -0.34 0.77 116.57 121.44 1pwv h LYS 339 Ca 0.09 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1pwv h LYS 339 Cb 0.59 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1pwv h LYS 339 CO -0.40 0.07 -0.06 1.17 -2.27 0.00 0.00 179.45 177.96 1pwv n LYS 340 N -4.81 0.69 0.12 1.90 4.81 -0.58 -3.23 118.16 117.06 1pwv n LYS 340 Ca 0.36 -0.16 -0.02 0.00 -0.87 0.00 0.00 58.31 57.62 1pwv n LYS 340 Cb 1.34 -1.50 0.13 0.00 0.02 0.00 0.00 35.03 35.03 1pwv n LYS 340 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1pwv h LEU 341 N 0.40 0.03 -0.29 3.14 3.38 0.64 -3.08 115.31 119.53 1pwv h LEU 341 Ca 0.00 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1pwv h LEU 341 Cb 0.30 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1pwv h LEU 341 CO 0.00 0.68 -0.10 1.56 0.09 0.00 0.00 178.44 180.67 1pwv h GLN 342 N 0.02 0.58 -1.09 1.13 4.20 -1.63 -3.10 115.11 115.22 1pwv h GLN 342 Ca -0.01 -0.24 0.30 0.00 0.06 0.00 0.00 58.65 58.77 1pwv h GLN 342 Cb 1.18 -0.03 -0.07 0.00 0.30 0.00 0.00 27.48 28.86 1pwv h GLN 342 CO 0.09 0.80 0.75 0.82 -0.67 0.00 0.00 178.83 180.61 1pwv h ILE 343 N 0.34 0.47 0.02 2.54 2.04 -1.68 0.47 117.51 121.71 1pwv h ILE 343 Ca 0.07 -0.07 -0.25 0.00 1.00 0.00 0.00 64.86 65.61 1pwv h ILE 343 Cb 0.60 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 1pwv h ILE 343 CO 0.03 0.04 -1.31 0.44 0.00 0.00 0.00 178.15 177.35 1pwv h ASP 344 N 0.19 0.07 0.86 1.72 3.32 -1.60 -3.32 116.42 117.67 1pwv h ASP 344 Ca 0.58 -0.10 -0.18 0.00 0.02 0.00 0.00 57.03 57.35 1pwv h ASP 344 Cb 1.86 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 41.36 1pwv h ASP 344 CO -0.16 1.08 -0.84 0.40 -1.72 0.00 0.00 179.24 178.00 1pwv h ILE 345 N 0.01 1.60 0.00 0.35 2.04 -0.52 -3.30 117.51 117.69 1pwv h ILE 345 Ca -0.13 -2.90 0.00 0.00 1.00 0.00 0.00 64.86 62.82 1pwv h ILE 345 Cb 1.89 2.57 0.00 0.00 -0.74 0.00 0.00 36.82 40.54 1pwv h ILE 345 CO 0.12 0.83 0.15 0.08 0.00 0.00 0.00 178.15 179.33 1pwv h ARG 346 N 0.00 0.00 -3.56 2.37 -0.00 -0.36 -3.29 114.38 109.54 1pwv h ARG 346 Ca -0.01 0.00 -0.11 0.00 -0.00 0.00 0.00 59.98 59.87 1pwv h ARG 346 Cb 1.50 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.47 1pwv h ARG 346 CO 0.11 0.00 1.25 -0.40 -0.00 0.00 0.00 179.97 180.93 1pwv n ASP 347 N -2.85 1.52 -3.57 0.08 5.75 -1.25 -4.60 116.55 111.63 1pwv n ASP 347 Ca -0.02 -2.01 -0.14 0.00 -0.01 0.00 0.00 54.79 52.61 1pwv n ASP 347 Cb 0.20 -0.60 -0.06 0.00 -1.03 0.00 0.00 41.12 39.63 1pwv n ASP 347 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1pwv s SER 348 N 4.05 0.76 0.00 -1.12 0.01 -1.24 -5.18 113.70 110.98 1pwv s SER 348 Ca 0.13 -1.44 0.00 0.00 1.31 0.00 0.00 55.95 55.96 1pwv s SER 348 Cb 0.04 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.85 1pwv s SER 348 CO -0.01 -1.14 0.00 -0.11 0.41 0.00 0.00 173.24 172.39 1pwv n LEU 349 N -0.49 0.00 0.00 2.44 7.94 -1.26 -5.21 117.00 120.42 1pwv n LEU 349 Ca 0.02 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.92 1pwv n LEU 349 Cb 0.63 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.58 1pwv n LEU 349 CO 0.30 0.00 0.00 -2.65 -1.11 0.00 0.00 177.39 173.93 1pwv n PRO 367 N -0.91 3.14 -4.31 1.96 -0.02 -1.26 -5.18 135.00 128.42 1pwv n PRO 367 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.31 1pwv n PRO 367 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 33.50 33.38 1pwv n PRO 367 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1pwv s LEU 368 N 0.00 2.54 0.85 2.45 0.20 -1.26 -5.14 118.68 118.31 1pwv s LEU 368 Ca 0.00 -1.03 -0.14 0.00 0.69 0.00 0.00 54.13 53.66 1pwv s LEU 368 Cb 0.00 -0.54 0.04 0.00 -0.43 0.00 0.00 46.19 45.26 1pwv s LEU 368 CO 0.00 -0.24 0.75 -1.54 -0.29 0.00 0.00 176.35 175.03 1pwv n SER 369 N -0.32 -0.66 0.10 3.68 3.41 -1.26 -4.86 113.62 113.71 1pwv n SER 369 Ca -0.09 0.48 0.12 0.00 -0.26 0.00 0.00 58.87 59.13 1pwv n SER 369 Cb 0.61 -1.33 0.23 0.00 -0.26 0.00 0.00 64.21 63.45 1pwv n SER 369 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1pwv h GLU 370 N -1.09 0.00 0.00 4.33 4.81 -2.00 -2.42 114.58 118.21 1pwv h GLU 370 Ca -0.45 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.73 1pwv h GLU 370 Cb 1.30 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.68 1pwv h GLU 370 CO 0.41 0.00 -0.26 -0.22 -0.73 0.00 0.00 179.01 178.20 1pwv h LYS 371 N 0.00 0.00 0.13 1.92 1.63 -1.99 0.27 116.57 118.53 1pwv h LYS 371 Ca 0.00 0.00 -0.28 0.00 -0.85 0.00 0.00 60.65 59.52 1pwv h LYS 371 Cb 0.80 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.43 1pwv h LYS 371 CO 0.00 0.26 -1.44 0.93 -3.45 0.00 0.00 179.45 175.76 1pwv h GLU 372 N 0.00 0.27 -1.08 1.90 4.39 -1.93 -2.87 114.58 115.26 1pwv h GLU 372 Ca -0.00 -0.46 0.29 0.00 0.34 0.00 0.00 59.36 59.53 1pwv h GLU 372 Cb 0.53 0.17 -0.08 0.00 -0.10 0.00 0.00 28.75 29.28 1pwv h GLU 372 CO 0.03 1.22 0.73 -0.22 -1.16 0.00 0.00 179.01 179.61 1pwv h LYS 373 N -0.24 0.23 -0.04 2.33 3.64 -0.86 0.87 116.57 122.51 1pwv h LYS 373 Ca -0.30 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.04 1pwv h LYS 373 Cb 1.81 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.58 1pwv h LYS 373 CO 0.08 0.15 -0.05 1.49 -2.27 0.00 0.00 179.45 178.85 1pwv h GLU 374 N 0.24 0.11 -0.89 1.90 4.81 -0.53 -2.07 114.58 118.14 1pwv h GLU 374 Ca 0.58 -0.06 0.15 0.00 -0.13 0.00 0.00 59.36 59.89 1pwv h GLU 374 Cb 1.77 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 31.07 1pwv h GLU 374 CO -0.19 0.60 0.50 0.35 -0.73 0.00 0.00 179.01 179.53 1pwv h PHE 375 N -0.38 0.88 -0.07 0.92 3.57 0.87 -0.96 116.94 121.77 1pwv h PHE 375 Ca 0.00 0.03 -0.22 0.00 3.53 0.00 0.00 57.97 61.32 1pwv h PHE 375 Cb 0.59 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 39.08 1pwv h PHE 375 CO 0.10 0.24 -0.84 -0.07 -2.23 0.00 0.00 178.31 175.52 1pwv h LEU 376 N 0.71 0.68 -2.24 0.59 3.38 -0.80 -1.46 115.31 116.17 1pwv h LEU 376 Ca 0.48 -0.48 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1pwv h LEU 376 Cb 0.65 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1pwv h LEU 376 CO -0.34 1.26 -0.05 0.11 0.09 0.00 0.00 178.44 179.51 1pwv h LYS 377 N 0.35 0.00 0.07 1.13 1.57 -0.59 0.41 116.57 119.51 1pwv h LYS 377 Ca -0.06 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.62 1pwv h LYS 377 Cb 1.45 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.77 1pwv h LYS 377 CO 0.16 0.05 -0.45 -0.22 -0.57 0.00 0.00 179.45 178.41 1pwv h LYS 378 N 0.00 0.15 0.00 3.15 3.64 -0.92 -3.34 116.57 119.26 1pwv h LYS 378 Ca -0.00 -0.26 -0.06 0.00 -1.27 0.00 0.00 60.65 59.07 1pwv h LYS 378 Cb 0.21 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1pwv h LYS 378 CO 0.01 1.12 -0.27 -0.07 -2.27 0.00 0.00 179.45 177.97 1pwv h LEU 379 N -0.68 0.00 -0.34 5.20 3.38 -0.66 -3.04 115.31 119.18 1pwv h LEU 379 Ca -0.08 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.96 1pwv h LEU 379 Cb 1.33 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.02 1pwv h LEU 379 CO 0.07 0.27 -0.10 0.50 0.09 0.00 0.00 178.44 179.27 1pwv h LYS 380 N 0.00 -0.02 -0.00 1.13 3.64 -1.05 -0.99 116.57 119.28 1pwv h LYS 380 Ca -0.00 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1pwv h LYS 380 Cb 0.65 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.44 1pwv h LYS 380 CO 0.04 -0.01 -0.18 -0.07 -2.27 0.00 0.00 179.45 176.95 1pwv h LEU 381 N -0.02 -0.53 -2.11 5.20 3.38 -1.68 -2.82 115.31 116.73 1pwv h LEU 381 Ca 0.17 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1pwv h LEU 381 Cb 0.27 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1pwv h LEU 381 CO -0.36 -0.25 -0.06 0.44 0.09 0.00 0.00 178.44 178.30 1pwv h ASP 382 N -0.29 0.00 -0.60 -0.43 3.32 -1.42 -2.93 116.42 114.06 1pwv h ASP 382 Ca 0.06 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.90 1pwv h ASP 382 Cb 0.37 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.79 1pwv h ASP 382 CO -0.17 0.06 0.27 2.30 -1.72 0.00 0.00 179.24 179.97 1pwv n ILE 383 N -4.03 2.39 -3.50 0.35 -5.35 -0.44 -4.92 119.36 103.85 1pwv n ILE 383 Ca -0.03 -1.26 -0.35 0.00 -0.27 0.00 0.00 62.75 60.85 1pwv n ILE 383 Cb 0.15 -0.48 -0.06 0.00 -1.74 0.00 0.00 39.64 37.51 1pwv n ILE 383 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1pwv s GLN 384 N -2.40 3.84 0.50 6.28 -1.52 -1.11 -4.79 119.66 120.47 1pwv s GLN 384 Ca 0.42 0.29 -0.22 0.00 -1.95 0.00 0.00 55.36 53.90 1pwv s GLN 384 Cb 0.34 -3.00 -0.06 0.00 -0.22 0.00 0.00 33.01 30.07 1pwv s GLN 384 CO 0.10 0.55 1.20 -2.14 -0.25 0.00 0.00 175.29 174.75 1pwv s PRO 385 N -1.84 3.50 -0.69 2.91 0.02 -1.26 -4.60 135.00 133.03 1pwv s PRO 385 Ca 0.34 1.84 -0.24 0.00 0.02 0.00 0.00 61.00 62.96 1pwv s PRO 385 Cb -0.14 -2.27 0.05 0.00 0.02 0.00 0.00 34.50 32.16 1pwv s PRO 385 CO 0.18 -0.79 1.10 -0.47 -0.33 0.00 0.00 177.00 176.69 1pwv s TYR 386 N -1.53 2.51 -0.39 6.54 5.04 -0.41 -4.91 117.35 124.20 1pwv s TYR 386 Ca 0.68 -0.33 0.02 0.00 -2.44 0.00 0.00 57.07 55.01 1pwv s TYR 386 Cb -0.30 -4.43 0.11 0.00 0.35 0.00 0.00 41.96 37.69 1pwv s TYR 386 CO 0.36 -1.82 0.15 0.34 -1.34 0.00 0.00 175.55 173.23 1pwv s ASP 387 N 3.68 4.26 0.11 4.32 -1.08 -1.26 -2.47 116.67 124.23 1pwv s ASP 387 Ca 0.28 -2.33 -0.33 0.00 -0.52 0.00 0.00 52.55 49.65 1pwv s ASP 387 Cb -0.13 -1.33 -0.12 0.00 -1.46 0.00 0.00 42.92 39.88 1pwv s ASP 387 CO 0.12 -0.33 1.57 0.40 0.52 0.00 0.00 175.17 177.45 1pwv h ILE 388 N 6.05 0.07 -0.60 4.11 2.04 -1.89 -0.25 117.51 127.04 1pwv h ILE 388 Ca -0.06 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.89 1pwv h ILE 388 Cb 0.97 0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 1pwv h ILE 388 CO 0.54 0.00 0.40 0.78 0.00 0.00 0.00 178.15 179.87 1pwv h ASN 389 N -0.71 0.38 0.06 1.72 2.35 -1.95 0.01 115.58 117.44 1pwv h ASN 389 Ca 0.01 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1pwv h ASN 389 Cb 0.73 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 39.03 1pwv h ASN 389 CO -0.27 0.23 -0.03 -0.61 -1.65 0.00 0.00 177.43 175.10 1pwv h GLN 390 N 0.42 -0.08 -0.79 0.81 5.75 -1.78 -1.67 115.11 117.78 1pwv h GLN 390 Ca 0.28 0.01 0.13 0.00 -0.15 0.00 0.00 58.65 58.91 1pwv h GLN 390 Cb 0.53 0.02 -0.09 0.00 1.07 0.00 0.00 27.48 29.01 1pwv h GLN 390 CO -0.08 0.07 0.39 -0.09 -2.65 0.00 0.00 178.83 176.48 1pwv h ARG 391 N -0.22 0.58 -0.51 1.69 9.65 0.72 -0.80 114.38 125.49 1pwv h ARG 391 Ca -0.01 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 58.76 1pwv h ARG 391 Cb 0.19 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.62 1pwv h ARG 391 CO 0.01 0.38 0.01 -0.07 2.80 0.00 0.00 179.97 183.10 1pwv h LEU 392 N 0.60 0.87 -0.56 3.80 3.38 -0.95 -2.67 115.31 119.78 1pwv h LEU 392 Ca 0.42 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1pwv h LEU 392 Cb 0.55 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1pwv h LEU 392 CO -0.34 0.96 0.20 -0.61 0.09 0.00 0.00 178.44 178.74 1pwv h GLN 393 N 0.75 0.86 -0.39 1.13 4.15 -0.48 0.11 115.11 121.25 1pwv h GLN 393 Ca 0.14 -0.17 -0.06 0.00 0.77 0.00 0.00 58.65 59.33 1pwv h GLN 393 Cb 0.51 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.05 1pwv h GLN 393 CO 0.02 0.77 -0.02 -0.44 -1.93 0.00 0.00 178.83 177.23 1pwv h ASP 394 N 0.78 0.59 0.00 -0.69 3.32 -1.13 -2.89 116.42 116.40 1pwv h ASP 394 Ca 0.18 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1pwv h ASP 394 Cb 0.25 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.64 1pwv h ASP 394 CO -0.01 0.67 -0.20 0.35 -1.72 0.00 0.00 179.24 178.33 1pwv n THR 395 N -4.24 0.00 -1.61 0.35 -2.24 -1.01 -2.35 114.28 103.18 1pwv n THR 395 Ca 0.02 -0.35 -0.20 0.00 -2.27 0.00 0.00 64.05 61.25 1pwv n THR 395 Cb 0.28 1.19 -0.08 0.00 -2.10 0.00 0.00 70.33 69.62 1pwv n THR 395 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pwv n GLY 396 N 1.36 1.80 0.00 3.38 0.00 0.31 -1.67 105.19 110.37 1pwv n GLY 396 Ca 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1pwv n GLY 396 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwv n GLY 397 N -0.57 3.03 3.57 -0.02 0.00 -0.73 -4.90 105.19 105.58 1pwv n GLY 397 Ca -0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 1pwv n GLY 397 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pwv s LEU 398 N 0.00 3.41 0.08 0.99 1.43 -0.67 -4.71 118.68 119.21 1pwv s LEU 398 Ca 0.00 -1.65 0.18 0.00 -1.03 0.00 0.00 54.13 51.63 1pwv s LEU 398 Cb 0.00 -2.58 0.76 0.00 0.03 0.00 0.00 46.19 44.40 1pwv s LEU 398 CO 0.00 -2.09 1.57 2.30 0.23 0.00 0.00 176.35 178.36 1pwv n ILE 399 N 7.19 0.90 1.35 -0.59 -5.35 -1.26 -2.50 119.36 119.10 1pwv n ILE 399 Ca 0.42 0.22 0.12 0.00 -0.27 0.00 0.00 62.75 63.25 1pwv n ILE 399 Cb 0.47 -1.02 0.44 0.00 -1.74 0.00 0.00 39.64 37.80 1pwv n ILE 399 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1pwv n ASP 400 N -1.74 1.58 -4.69 7.28 10.43 -1.26 -4.86 116.55 123.28 1pwv n ASP 400 Ca 0.03 -1.61 -0.44 0.00 2.57 0.00 0.00 54.79 55.34 1pwv n ASP 400 Cb 0.20 -0.06 -0.03 0.00 1.84 0.00 0.00 41.12 43.07 1pwv n ASP 400 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1pwv n SER 401 N 0.25 3.22 -1.55 -2.24 7.64 -1.04 -4.85 113.62 115.04 1pwv n SER 401 Ca 0.17 1.13 -0.06 0.00 1.01 0.00 0.00 58.87 61.12 1pwv n SER 401 Cb 0.34 -1.48 0.02 0.00 -1.01 0.00 0.00 64.21 62.07 1pwv n SER 401 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1pwv n PRO 402 N 2.48 1.30 -0.07 1.43 -0.04 -1.26 -4.13 135.00 134.71 1pwv n PRO 402 Ca 0.12 -0.62 0.11 0.00 -0.04 0.00 0.00 63.50 63.08 1pwv n PRO 402 Cb 0.33 -1.24 0.39 0.00 -0.04 0.00 0.00 33.50 32.94 1pwv n PRO 402 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1pwv n SER 403 N 0.82 1.75 -3.98 3.54 3.41 -1.26 -4.87 113.62 113.03 1pwv n SER 403 Ca 0.12 -1.68 -0.09 0.00 -0.26 0.00 0.00 58.87 56.96 1pwv n SER 403 Cb 0.58 -0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 64.36 1pwv n SER 403 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1pwv s ILE 404 N -1.83 0.14 0.11 -1.33 -4.36 -1.26 -4.99 121.20 107.68 1pwv s ILE 404 Ca 0.34 -1.48 -0.31 0.00 -0.26 0.00 0.00 60.65 58.94 1pwv s ILE 404 Cb 0.19 -1.60 -0.09 0.00 1.25 0.00 0.00 42.46 42.20 1pwv s ILE 404 CO 0.28 -0.62 1.70 0.20 0.24 0.00 0.00 174.94 176.74 1pwv s ASN 405 N -2.93 6.53 0.07 4.36 0.01 -1.26 -4.71 114.94 117.02 1pwv s ASN 405 Ca 0.11 2.61 -0.10 0.00 -0.71 0.00 0.00 52.86 54.78 1pwv s ASN 405 Cb 0.06 -2.57 0.01 0.00 0.41 0.00 0.00 41.25 39.16 1pwv s ASN 405 CO -0.06 -0.92 0.56 -0.11 -1.51 0.00 0.00 177.10 175.06 1pwv n LEU 406 N 5.26 -0.33 -0.23 0.60 7.94 -1.26 0.00 117.00 128.98 1pwv n LEU 406 Ca 0.16 0.64 0.03 0.00 -1.11 0.00 0.00 56.01 55.73 1pwv n LEU 406 Cb 0.39 -0.10 0.15 0.00 0.53 0.00 0.00 43.42 44.39 1pwv n LEU 406 CO 0.63 -0.54 0.93 -2.24 -1.11 0.00 0.00 177.39 175.07 1pwv h ASP 407 N 0.00 0.03 0.15 1.96 2.03 -1.99 0.14 116.42 118.74 1pwv h ASP 407 Ca 0.08 0.13 -0.18 0.00 -0.73 0.00 0.00 57.03 56.33 1pwv h ASP 407 Cb 0.17 0.17 -0.00 0.00 -0.83 0.00 0.00 39.33 38.83 1pwv h ASP 407 CO -0.34 -0.00 -0.68 0.58 -1.03 0.00 0.00 179.24 177.76 1pwv h VAL 408 N 0.28 1.35 -0.42 4.15 2.07 -0.79 -0.03 116.25 122.86 1pwv h VAL 408 Ca 0.37 -2.02 0.04 0.00 0.82 0.00 0.00 66.70 65.91 1pwv h VAL 408 Cb 0.59 2.00 -0.04 0.00 -1.52 0.00 0.00 31.29 32.31 1pwv h VAL 408 CO -0.45 0.62 0.19 -0.09 0.02 0.00 0.00 177.57 177.86 1pwv h ARG 409 N 0.34 0.38 -0.15 1.57 2.43 -0.26 0.69 114.38 119.39 1pwv h ARG 409 Ca -0.02 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1pwv h ARG 409 Cb 1.25 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.71 1pwv h ARG 409 CO 0.12 0.25 0.03 -0.22 -1.51 0.00 0.00 179.97 178.64 1pwv h LYS 410 N 0.39 0.24 -0.86 0.20 3.64 -0.61 -0.93 116.57 118.64 1pwv h LYS 410 Ca 0.19 -0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.59 1pwv h LYS 410 Cb 0.12 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 31.84 1pwv h LYS 410 CO -0.15 0.40 0.52 0.37 -2.27 0.00 0.00 179.45 178.32 1pwv h GLN 411 N 0.04 0.88 -0.34 1.90 5.75 -0.61 -0.18 115.11 122.54 1pwv h GLN 411 Ca 0.05 -0.05 -0.12 0.00 -0.15 0.00 0.00 58.65 58.37 1pwv h GLN 411 Cb 0.27 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.61 1pwv h GLN 411 CO 0.00 0.58 -0.28 1.88 -2.65 0.00 0.00 178.83 178.36 1pwv h TYR 412 N 0.90 0.82 -0.23 3.99 -1.99 -0.63 -2.87 116.97 116.95 1pwv h TYR 412 Ca 0.40 -0.20 -0.06 0.00 2.00 0.00 0.00 58.73 60.87 1pwv h TYR 412 Cb 0.28 -0.19 -0.01 0.00 2.00 0.00 0.00 36.73 38.82 1pwv h TYR 412 CO -0.04 0.91 -0.07 -0.22 -0.00 0.00 0.00 178.16 178.74 1pwv h LYS 413 N 0.61 0.46 0.06 4.88 3.64 -0.30 -1.72 116.57 124.20 1pwv h LYS 413 Ca 0.08 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1pwv h LYS 413 Cb 0.79 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.55 1pwv h LYS 413 CO 0.06 0.70 -0.27 -0.09 -2.27 0.00 0.00 179.45 177.58 1pwv h ARG 414 N 0.18 -0.44 -0.90 1.90 2.43 -1.06 0.74 114.38 117.24 1pwv h ARG 414 Ca 0.06 0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.26 1pwv h ARG 414 Cb 0.54 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.15 1pwv h ARG 414 CO 0.03 -0.29 0.59 -0.44 -1.51 0.00 0.00 179.97 178.34 1pwv h ASP 415 N -0.45 1.04 -0.17 -3.80 3.32 -1.52 -2.14 116.42 112.70 1pwv h ASP 415 Ca 0.05 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1pwv h ASP 415 Cb 0.51 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.79 1pwv h ASP 415 CO -0.20 0.76 -0.03 0.40 -1.72 0.00 0.00 179.24 178.46 1pwv h ILE 416 N 1.23 1.28 -0.21 0.35 2.04 -0.90 0.42 117.51 121.71 1pwv h ILE 416 Ca 0.33 -0.95 0.06 0.00 1.00 0.00 0.00 64.86 65.30 1pwv h ILE 416 Cb -0.13 1.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1pwv h ILE 416 CO -0.07 0.28 0.16 1.56 0.00 0.00 0.00 178.15 180.08 1pwv h GLN 417 N 0.04 0.00 -0.01 2.37 4.20 -0.70 -0.18 115.11 120.83 1pwv h GLN 417 Ca 0.04 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 1pwv h GLN 417 Cb 0.44 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.23 1pwv h GLN 417 CO 0.01 0.00 -0.31 -0.91 -0.67 0.00 0.00 178.83 176.96 1pwv h ASN 418 N 0.00 0.28 -0.24 1.46 2.35 -0.89 -2.77 115.58 115.78 1pwv h ASN 418 Ca 0.10 -0.76 -0.02 0.00 -0.55 0.00 0.00 56.30 55.07 1pwv h ASN 418 Cb 0.41 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 1pwv h ASN 418 CO -0.00 1.00 0.11 0.40 -1.65 0.00 0.00 177.43 177.29 1pwv h ILE 419 N -0.41 1.12 -0.31 2.81 2.04 -0.25 0.21 117.51 122.73 1pwv h ILE 419 Ca -0.04 -0.37 -0.06 0.00 1.00 0.00 0.00 64.86 65.39 1pwv h ILE 419 Cb 1.04 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 1pwv h ILE 419 CO 0.06 0.14 -0.07 0.44 0.00 0.00 0.00 178.15 178.72 1pwv h ASP 420 N 0.40 0.47 -0.03 1.72 3.32 -1.06 0.87 116.42 122.11 1pwv h ASP 420 Ca 0.10 -0.11 -0.18 0.00 0.02 0.00 0.00 57.03 56.86 1pwv h ASP 420 Cb 0.09 -0.12 0.01 0.00 0.22 0.00 0.00 39.33 39.53 1pwv h ASP 420 CO -0.01 0.59 -0.70 0.00 -1.72 0.00 0.00 179.24 177.40 1pwv h ALA 421 N 1.46 0.13 -0.59 3.45 0.00 -0.75 -3.28 119.26 119.68 1pwv h ALA 421 Ca 0.09 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1pwv h ALA 421 Cb 0.42 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1pwv h ALA 421 CO 0.02 0.46 0.33 -0.07 0.00 0.00 0.00 179.25 179.99 1pwv h LEU 422 N 0.11 0.73 -5.39 0.00 3.38 -0.30 -3.17 115.31 110.66 1pwv h LEU 422 Ca -0.08 -0.08 -0.71 0.00 0.09 0.00 0.00 57.88 57.10 1pwv h LEU 422 Cb 1.38 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.90 1pwv h LEU 422 CO 0.14 0.60 3.15 0.18 0.09 0.00 0.00 178.44 182.60 1pwv n LEU 423 N -4.60 8.27 -0.03 1.67 4.77 0.27 -4.50 117.00 122.85 1pwv n LEU 423 Ca 0.04 -4.58 -0.11 0.00 -0.03 0.00 0.00 56.01 51.33 1pwv n LEU 423 Cb 0.08 -1.48 -0.14 0.00 -2.33 0.00 0.00 43.42 39.54 1pwv n LEU 423 CO 0.37 1.98 -0.70 0.00 -1.33 0.00 0.00 177.39 177.71 1pwv n HIS 424 N 3.00 0.84 -2.74 -1.77 1.44 -1.20 -4.44 115.22 110.34 1pwv n HIS 424 Ca 0.69 0.28 -0.42 0.00 -2.01 0.00 0.00 57.72 56.25 1pwv n HIS 424 Cb 0.25 -1.15 -0.03 0.00 0.12 0.00 0.00 29.99 29.19 1pwv n HIS 424 CO 0.00 0.00 0.00 -1.14 -2.81 0.00 0.00 176.34 172.39 1pwv s GLN 425 N -2.57 4.30 0.66 -1.40 0.74 -1.26 -4.87 119.66 115.25 1pwv s GLN 425 Ca -0.09 1.24 -0.12 0.00 0.05 0.00 0.00 55.36 56.44 1pwv s GLN 425 Cb 0.07 -3.60 -0.01 0.00 1.10 0.00 0.00 33.01 30.57 1pwv s GLN 425 CO 0.81 -0.48 1.06 -1.54 -0.55 0.00 0.00 175.29 174.59 1pwv s SER 426 N 1.19 5.53 0.35 6.67 1.04 -1.26 -2.10 113.70 125.11 1pwv s SER 426 Ca 0.43 1.68 0.15 0.00 0.48 0.00 0.00 55.95 58.69 1pwv s SER 426 Cb -0.16 -2.51 0.62 0.00 0.10 0.00 0.00 66.02 64.07 1pwv s SER 426 CO 0.10 -1.34 1.73 -0.29 0.98 0.00 0.00 173.24 174.43 1pwv h ILE 427 N -0.31 1.14 -1.77 -1.02 2.10 -0.85 -3.46 117.51 113.34 1pwv h ILE 427 Ca -0.45 -1.62 -0.67 0.00 1.08 0.00 0.00 64.86 63.21 1pwv h ILE 427 Cb 1.21 1.92 0.07 0.00 -1.09 0.00 0.00 36.82 38.93 1pwv h ILE 427 CO 0.57 0.43 0.29 0.61 -1.08 0.00 0.00 178.15 178.98 1pwv n GLY 428 N 0.03 0.12 3.57 8.18 0.00 -0.36 -4.96 105.19 111.77 1pwv n GLY 428 Ca -0.01 0.60 -0.09 0.00 0.00 0.00 0.00 46.02 46.52 1pwv n GLY 428 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pwv s SER 429 N 0.13 -0.15 0.00 1.61 0.15 -1.26 -5.02 113.70 109.16 1pwv s SER 429 Ca 0.78 -0.75 0.26 0.00 0.70 0.00 0.00 55.95 56.94 1pwv s SER 429 Cb -0.91 0.58 0.68 0.00 -1.71 0.00 0.00 66.02 64.66 1pwv s SER 429 CO 0.51 -1.11 1.52 0.35 1.20 0.00 0.00 173.24 175.71 1pwv n THR 430 N -0.36 0.00 1.88 6.45 -2.24 -1.26 -3.80 114.28 114.95 1pwv n THR 430 Ca -0.05 -0.09 0.16 0.00 -2.27 0.00 0.00 64.05 61.80 1pwv n THR 430 Cb 0.62 0.35 0.90 0.00 -2.10 0.00 0.00 70.33 70.10 1pwv n THR 430 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1pwv n LEU 431 N -0.91 0.06 0.00 3.22 4.77 -1.26 -4.92 117.00 117.96 1pwv n LEU 431 Ca 0.10 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 1pwv n LEU 431 Cb 0.34 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1pwv n LEU 431 CO 0.29 0.01 0.00 0.00 -1.33 0.00 0.00 177.39 176.36 1pwv n TYR 432 N -1.00 0.00 0.00 -1.77 0.18 -1.25 -5.03 117.16 108.29 1pwv n TYR 432 Ca 0.22 0.00 0.00 0.00 1.88 0.00 0.00 57.90 60.00 1pwv n TYR 432 Cb 0.14 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.10 1pwv n TYR 432 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 1pwv n ASN 433 N 0.00 0.00 -4.74 9.48 3.02 -1.26 -4.45 115.26 117.31 1pwv n ASN 433 Ca 0.00 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.14 1pwv n ASN 433 Cb 0.00 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.13 1pwv n ASN 433 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1pwv s LYS 434 N 0.82 4.55 -0.09 3.52 1.02 -1.26 -4.98 119.74 123.32 1pwv s LYS 434 Ca 0.00 1.81 -0.02 0.00 0.02 0.00 0.00 55.97 57.78 1pwv s LYS 434 Cb 0.00 -3.25 0.03 0.00 -0.52 0.00 0.00 37.83 34.09 1pwv s LYS 434 CO 0.00 0.01 0.02 0.42 -0.92 0.00 0.00 175.35 174.88 1pwv s ILE 435 N -0.24 0.30 -0.15 2.17 1.09 -1.26 -5.10 121.20 118.01 1pwv s ILE 435 Ca 0.51 0.06 -0.11 0.00 -1.10 0.00 0.00 60.65 60.01 1pwv s ILE 435 Cb -0.31 -0.55 -0.05 0.00 -1.06 0.00 0.00 42.46 40.50 1pwv s ILE 435 CO 0.36 0.16 0.20 -0.31 -0.10 0.00 0.00 174.94 175.26 1pwv s TYR 436 N 2.00 3.51 0.22 3.97 1.51 -1.26 -2.63 117.35 124.66 1pwv s TYR 436 Ca 0.04 0.52 0.11 0.00 -1.01 0.00 0.00 57.07 56.73 1pwv s TYR 436 Cb -0.13 -2.16 -0.04 0.00 -0.11 0.00 0.00 41.96 39.52 1pwv s TYR 436 CO -0.05 0.44 -0.16 -0.51 -1.11 0.00 0.00 175.55 174.16 1pwv s LEU 437 N -0.15 2.72 0.15 -1.29 1.43 0.94 -4.87 118.68 117.62 1pwv s LEU 437 Ca 0.14 -0.79 0.11 0.00 -1.03 0.00 0.00 54.13 52.55 1pwv s LEU 437 Cb -0.12 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.69 1pwv s LEU 437 CO 0.03 0.08 -0.25 -0.31 0.23 0.00 0.00 176.35 176.13 1pwv s TYR 438 N -1.95 2.20 -0.08 0.29 1.51 -0.61 -0.11 117.35 118.60 1pwv s TYR 438 Ca 0.25 -0.38 -0.04 0.00 -1.01 0.00 0.00 57.07 55.89 1pwv s TYR 438 Cb -0.07 -1.15 0.04 0.00 -0.11 0.00 0.00 41.96 40.67 1pwv s TYR 438 CO 0.14 0.37 0.18 -2.00 -1.11 0.00 0.00 175.55 173.13 1pwv s GLU 439 N -2.29 0.10 -0.32 -0.62 2.12 -0.85 -0.19 118.70 116.65 1pwv s GLU 439 Ca 0.15 0.49 -0.16 0.00 0.36 0.00 0.00 54.97 55.81 1pwv s GLU 439 Cb -0.09 -0.19 -0.02 0.00 0.26 0.00 0.00 34.13 34.10 1pwv s GLU 439 CO 0.07 -0.22 0.41 -0.80 -0.54 0.00 0.00 175.26 174.18 1pwv s ASN 440 N 1.64 6.24 0.24 -1.70 0.02 -1.26 -0.20 114.94 119.92 1pwv s ASN 440 Ca -0.05 0.02 0.11 0.00 -1.02 0.00 0.00 52.86 51.93 1pwv s ASN 440 Cb -0.12 -2.22 -0.05 0.00 0.02 0.00 0.00 41.25 38.89 1pwv s ASN 440 CO -0.07 -0.32 -0.18 -0.32 0.02 0.00 0.00 177.10 176.24 1pwv s MET 441 N 2.13 1.75 -0.21 -0.60 1.75 0.61 -5.00 119.30 119.73 1pwv s MET 441 Ca 0.15 -1.59 -0.12 0.00 -1.25 0.00 0.00 55.69 52.88 1pwv s MET 441 Cb -0.16 -1.89 -0.05 0.00 2.84 0.00 0.00 34.83 35.57 1pwv s MET 441 CO 0.11 0.37 0.24 1.21 -0.65 0.00 0.00 175.02 176.31 1pwv s ASN 442 N -3.18 6.27 0.36 1.11 3.84 -1.26 -1.73 114.94 120.35 1pwv s ASN 442 Ca 0.27 0.31 0.11 0.00 0.21 0.00 0.00 52.86 53.76 1pwv s ASN 442 Cb -0.07 -2.15 0.90 0.00 -0.55 0.00 0.00 41.25 39.38 1pwv s ASN 442 CO 0.14 0.05 1.82 -0.29 -2.79 0.00 0.00 177.10 176.03 1pwv h ILE 443 N 4.91 0.71 -0.65 -5.21 6.09 -1.95 -0.28 117.51 121.13 1pwv h ILE 443 Ca -0.38 -0.21 0.16 0.00 -1.37 0.00 0.00 64.86 63.06 1pwv h ILE 443 Cb 1.16 0.05 -0.03 0.00 0.47 0.00 0.00 36.82 38.47 1pwv h ILE 443 CO 0.71 0.11 0.45 0.78 -3.07 0.00 0.00 178.15 177.13 1pwv h ASN 444 N 0.61 0.15 -0.12 2.19 2.35 -1.89 0.94 115.58 119.80 1pwv h ASN 444 Ca 0.52 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 56.27 1pwv h ASN 444 Cb 1.00 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.34 1pwv h ASN 444 CO -0.27 0.07 0.07 -1.13 -1.65 0.00 0.00 177.43 174.53 1pwv h ASN 445 N 0.16 0.17 0.02 5.81 -1.24 -1.38 -3.14 115.58 115.97 1pwv h ASN 445 Ca 0.31 -0.01 -0.37 0.00 0.71 0.00 0.00 56.30 56.94 1pwv h ASN 445 Cb 1.02 -0.04 -0.07 0.00 0.73 0.00 0.00 38.32 39.96 1pwv h ASN 445 CO -0.05 0.15 -2.39 0.18 -1.29 0.00 0.00 177.43 174.03 1pwv n LEU 446 N -4.49 1.14 -3.07 0.34 4.32 0.19 -4.92 117.00 110.51 1pwv n LEU 446 Ca -0.01 -0.03 0.02 0.00 -0.02 0.00 0.00 56.01 55.97 1pwv n LEU 446 Cb 0.10 -0.04 -0.00 0.00 -1.62 0.00 0.00 43.42 41.86 1pwv n LEU 446 CO 0.35 0.66 0.24 0.28 -1.22 0.00 0.00 177.39 177.70 1pwv s THR 447 N -2.51 -0.70 0.41 -5.08 -1.32 -0.39 -4.51 115.64 101.55 1pwv s THR 447 Ca -0.19 0.00 0.15 0.00 -1.21 0.00 0.00 61.69 60.44 1pwv s THR 447 Cb 0.07 -0.15 0.35 0.00 -1.51 0.00 0.00 72.50 71.27 1pwv s THR 447 CO 0.75 0.00 1.90 0.00 -2.21 0.00 0.00 174.62 175.06 1pwv h ALA 448 N 6.68 2.09 0.39 11.08 0.00 -1.36 0.44 119.26 138.58 1pwv h ALA 448 Ca 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1pwv h ALA 448 Cb 1.20 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1pwv h ALA 448 CO 0.04 -0.31 -0.28 1.15 0.00 0.00 0.00 179.25 179.85 1pwv h THR 449 N 0.46 0.42 -0.04 0.00 2.02 -1.83 -0.69 112.91 113.25 1pwv h THR 449 Ca 0.40 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.45 1pwv h THR 449 Cb 0.88 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 1pwv h THR 449 CO -0.14 0.00 -0.55 -0.07 0.37 0.00 0.00 175.52 175.13 1pwv h LEU 450 N -0.66 0.13 -2.01 2.58 3.38 -1.86 -2.56 115.31 114.31 1pwv h LEU 450 Ca -0.04 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1pwv h LEU 450 Cb 0.56 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1pwv h LEU 450 CO 0.01 0.65 0.00 1.23 0.09 0.00 0.00 178.44 180.43 1pwv h GLY 451 N 1.53 0.00 2.00 0.83 0.00 -0.36 -0.51 103.07 106.55 1pwv h GLY 451 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1pwv h GLY 451 CO 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 176.54 176.18 1pwv h ALA 452 N 2.01 0.80 -0.42 3.60 0.00 -0.70 -3.33 119.26 121.22 1pwv h ALA 452 Ca 0.00 -0.40 -0.31 0.00 0.00 0.00 0.00 54.91 54.20 1pwv h ALA 452 Cb 0.04 -0.07 -0.34 0.00 0.00 0.00 0.00 17.79 17.42 1pwv h ALA 452 CO 0.00 0.55 -0.88 -0.25 0.00 0.00 0.00 179.25 178.67 1pwv n ASP 453 N -3.33 2.83 0.05 0.00 8.00 -0.24 -4.83 116.55 119.04 1pwv n ASP 453 Ca 0.01 -3.02 -0.21 0.00 0.71 0.00 0.00 54.79 52.27 1pwv n ASP 453 Cb 0.64 -0.41 -0.15 0.00 -0.02 0.00 0.00 41.12 41.18 1pwv n ASP 453 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1pwv h LEU 454 N 1.95 0.50 -9.46 0.64 5.85 -1.57 -3.42 115.31 109.78 1pwv h LEU 454 Ca 0.07 -0.91 -0.57 0.00 0.84 0.00 0.00 57.88 57.31 1pwv h LEU 454 Cb 1.41 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 42.22 1pwv h LEU 454 CO 0.36 1.54 -0.04 -0.69 -0.34 0.00 0.00 178.44 179.27 1pwv s VAL 455 N -2.48 5.01 0.10 1.05 1.01 -1.26 -0.72 120.40 123.11 1pwv s VAL 455 Ca -0.15 1.18 -0.32 0.00 0.00 0.00 0.00 61.98 62.69 1pwv s VAL 455 Cb 0.03 -3.91 -0.11 0.00 0.00 0.00 0.00 36.38 32.39 1pwv s VAL 455 CO 0.82 0.38 1.83 -0.67 0.00 0.00 0.00 175.10 177.46 1pwv n ASP 456 N 3.07 3.91 0.00 3.32 2.03 -0.84 -4.80 116.55 123.24 1pwv n ASP 456 Ca -0.06 0.99 0.08 0.00 0.52 0.00 0.00 54.79 56.32 1pwv n ASP 456 Cb 0.51 -1.52 0.38 0.00 -0.72 0.00 0.00 41.12 39.78 1pwv n ASP 456 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1pwv n SER 457 N 5.66 0.00 -0.08 1.67 2.88 -1.26 -2.57 113.62 119.92 1pwv n SER 457 Ca 0.19 0.38 -0.16 0.00 -1.33 0.00 0.00 58.87 57.94 1pwv n SER 457 Cb 0.36 -0.45 -0.13 0.00 -0.75 0.00 0.00 64.21 63.24 1pwv n SER 457 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1pwv n THR 458 N -1.45 1.55 -3.67 2.46 -2.24 -1.26 -4.79 114.28 104.87 1pwv n THR 458 Ca 0.05 -0.67 -0.29 0.00 -2.27 0.00 0.00 64.05 60.87 1pwv n THR 458 Cb 0.18 -1.27 -0.13 0.00 -2.10 0.00 0.00 70.33 67.02 1pwv n THR 458 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1pwv s ASP 459 N -6.40 3.58 0.00 3.42 3.68 -1.06 -5.00 116.67 114.89 1pwv s ASP 459 Ca -0.25 -2.45 0.00 0.00 2.13 0.00 0.00 52.55 51.98 1pwv s ASP 459 Cb 0.08 -0.92 0.00 0.00 -1.45 0.00 0.00 42.92 40.63 1pwv s ASP 459 CO 0.70 -0.29 0.10 -0.46 0.13 0.00 0.00 175.17 175.36 1pwv n ASN 460 N 3.76 0.19 -0.00 -0.34 2.04 -1.10 -0.48 115.26 119.33 1pwv n ASN 460 Ca 0.08 -0.40 0.03 0.00 -0.44 0.00 0.00 54.58 53.85 1pwv n ASN 460 Cb 0.36 -0.10 -0.04 0.00 -2.53 0.00 0.00 39.78 37.47 1pwv n ASN 460 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 1pwv n THR 461 N 0.36 0.00 -4.04 5.53 -2.24 -1.26 -4.91 114.28 107.72 1pwv n THR 461 Ca 0.00 -0.30 -0.28 0.00 -2.27 0.00 0.00 64.05 61.20 1pwv n THR 461 Cb 0.05 0.86 -0.05 0.00 -2.10 0.00 0.00 70.33 69.09 1pwv n THR 461 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1pwv s LYS 462 N -1.83 3.00 -0.16 -0.78 -0.14 0.37 0.38 119.74 120.58 1pwv s LYS 462 Ca 0.02 -0.74 -0.06 0.00 -1.36 0.00 0.00 55.97 53.83 1pwv s LYS 462 Cb 0.05 -2.74 -0.04 0.00 -1.68 0.00 0.00 37.83 33.42 1pwv s LYS 462 CO 0.29 0.53 0.03 0.42 -0.76 0.00 0.00 175.35 175.85 1pwv s ILE 463 N -1.60 4.48 -0.42 2.17 -1.09 -1.26 -1.99 121.20 121.47 1pwv s ILE 463 Ca 0.31 -0.15 -0.27 0.00 -2.23 0.00 0.00 60.65 58.31 1pwv s ILE 463 Cb -0.11 -2.99 -0.03 0.00 -1.58 0.00 0.00 42.46 37.75 1pwv s ILE 463 CO 0.24 0.49 1.97 0.21 -1.23 0.00 0.00 174.94 176.62 1pwv s ASN 464 N 0.20 5.42 0.56 3.58 3.84 0.10 -4.84 114.94 123.81 1pwv s ASN 464 Ca 0.02 1.06 0.34 0.00 0.21 0.00 0.00 52.86 54.49 1pwv s ASN 464 Cb -0.13 -2.52 1.48 0.00 -0.55 0.00 0.00 41.25 39.53 1pwv s ASN 464 CO 0.01 -2.13 1.79 0.03 -2.79 0.00 0.00 177.10 174.02 1pwv h ARG 465 N 14.84 0.00 0.68 0.43 -0.00 -1.95 -1.02 114.38 127.35 1pwv h ARG 465 Ca -0.31 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.14 1pwv h ARG 465 Cb 1.19 0.00 0.01 0.00 0.00 0.00 0.00 29.97 31.17 1pwv h ARG 465 CO 1.10 0.00 -0.32 0.78 0.00 0.00 0.00 179.97 181.52 1pwv h GLY 466 N 0.00 -0.95 1.79 0.04 0.00 -1.95 -1.57 103.07 100.43 1pwv h GLY 466 Ca 0.47 0.35 -0.03 0.00 0.00 0.00 0.00 47.33 48.12 1pwv h GLY 466 CO -0.00 -0.34 -0.04 -2.22 0.00 0.00 0.00 176.54 173.93 1pwv h ILE 467 N -1.17 1.14 -0.08 2.60 5.03 -1.72 -2.52 117.51 120.79 1pwv h ILE 467 Ca -0.09 -0.58 0.02 0.00 -0.12 0.00 0.00 64.86 64.09 1pwv h ILE 467 Cb 0.70 1.05 -0.02 0.00 -3.03 0.00 0.00 36.82 35.52 1pwv h ILE 467 CO 0.15 0.19 -0.04 0.15 -0.68 0.00 0.00 178.15 177.93 1pwv h PHE 468 N 0.27 -0.08 -0.54 1.37 3.57 -1.13 0.16 116.94 120.55 1pwv h PHE 468 Ca 0.06 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1pwv h PHE 468 Cb 0.25 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 1pwv h PHE 468 CO 0.00 -0.06 0.35 -0.91 -2.23 0.00 0.00 178.31 175.46 1pwv h ASN 469 N -0.03 0.63 -0.48 0.41 2.35 -0.88 -0.58 115.58 117.00 1pwv h ASN 469 Ca 0.05 -0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 1pwv h ASN 469 Cb 0.09 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 1pwv h ASN 469 CO -0.10 0.47 0.16 -0.08 -1.65 0.00 0.00 177.43 176.23 1pwv h GLU 470 N 0.73 0.80 0.00 0.81 4.81 -1.13 -1.69 114.58 118.91 1pwv h GLU 470 Ca 0.20 -0.15 -0.11 0.00 -0.13 0.00 0.00 59.36 59.17 1pwv h GLU 470 Cb -0.06 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 1pwv h GLU 470 CO -0.04 0.70 -0.52 0.35 -0.73 0.00 0.00 179.01 178.77 1pwv h PHE 471 N 0.78 0.00 0.00 0.92 3.57 0.09 -3.10 116.94 119.20 1pwv h PHE 471 Ca 0.18 0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.51 1pwv h PHE 471 Cb 0.24 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1pwv h PHE 471 CO 0.01 0.52 -0.91 -0.22 -2.23 0.00 0.00 178.31 175.48 1pwv h LYS 472 N 0.00 0.00 0.00 1.11 3.64 -0.72 -3.41 116.57 117.19 1pwv h LYS 472 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1pwv h LYS 472 Cb 0.94 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.76 1pwv h LYS 472 CO 0.07 0.68 0.00 1.17 -2.27 0.00 0.00 179.45 179.09 1pwv n LYS 473 N -3.22 0.00 -0.91 1.90 3.00 -0.67 -2.83 118.16 115.43 1pwv n LYS 473 Ca -0.02 0.14 -0.05 0.00 -0.00 0.00 0.00 58.31 58.39 1pwv n LYS 473 Cb 0.86 -0.35 0.27 0.00 0.00 0.00 0.00 35.03 35.81 1pwv n LYS 473 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1pwv n ASN 474 N -0.48 4.22 -4.50 3.14 5.03 -1.26 -4.87 115.26 116.54 1pwv n ASN 474 Ca 0.00 -3.31 -0.42 0.00 0.87 0.00 0.00 54.58 51.71 1pwv n ASN 474 Cb 0.00 -0.70 -0.03 0.00 -1.02 0.00 0.00 39.78 38.03 1pwv n ASN 474 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1pwv s PHE 475 N -3.04 2.76 -0.12 3.10 5.36 -1.13 -3.66 117.98 121.26 1pwv s PHE 475 Ca 0.52 -0.97 0.01 0.00 -0.96 0.00 0.00 56.93 55.53 1pwv s PHE 475 Cb 0.42 -4.48 -0.08 0.00 -0.34 0.00 0.00 43.02 38.54 1pwv s PHE 475 CO 0.10 -1.74 -0.09 1.63 -1.46 0.00 0.00 175.22 173.66 1pwv n LYS 476 N 7.86 0.46 -4.20 10.12 5.02 -1.26 -4.78 118.16 131.39 1pwv n LYS 476 Ca 0.23 0.06 -0.12 0.00 -2.02 0.00 0.00 58.31 56.47 1pwv n LYS 476 Cb 0.49 -1.23 -0.10 0.00 -0.02 0.00 0.00 35.03 34.17 1pwv n LYS 476 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 1pwv s TYR 477 N -2.23 1.01 0.03 2.13 -0.85 -1.26 -0.09 117.35 116.08 1pwv s TYR 477 Ca -0.15 -0.91 -0.04 0.00 -0.52 0.00 0.00 57.07 55.45 1pwv s TYR 477 Cb 0.04 -0.57 -0.01 0.00 0.38 0.00 0.00 41.96 41.80 1pwv s TYR 477 CO 0.28 -0.12 0.06 0.45 -1.52 0.00 0.00 175.55 174.70 1pwv s SER 478 N -3.09 0.20 -0.01 -0.18 0.15 0.68 -1.62 113.70 109.83 1pwv s SER 478 Ca 0.15 -0.52 0.04 0.00 0.70 0.00 0.00 55.95 56.32 1pwv s SER 478 Cb 0.05 0.19 -0.01 0.00 -1.71 0.00 0.00 66.02 64.54 1pwv s SER 478 CO -0.02 -0.44 -0.12 -0.63 1.20 0.00 0.00 173.24 173.23 1pwv s ILE 479 N -2.24 0.94 -0.34 6.45 1.01 -1.15 -1.35 121.20 124.50 1pwv s ILE 479 Ca -0.08 -0.50 -0.03 0.00 0.00 0.00 0.00 60.65 60.03 1pwv s ILE 479 Cb -0.04 -0.78 0.07 0.00 0.01 0.00 0.00 42.46 41.72 1pwv s ILE 479 CO -0.03 0.27 0.09 -0.55 0.00 0.00 0.00 174.94 174.71 1pwv s SER 480 N -0.25 5.10 0.00 3.58 0.15 -0.86 -0.80 113.70 120.62 1pwv s SER 480 Ca 0.04 -1.50 0.26 0.00 0.70 0.00 0.00 55.95 55.45 1pwv s SER 480 Cb -0.05 -1.78 0.70 0.00 -1.71 0.00 0.00 66.02 63.18 1pwv s SER 480 CO -0.00 -0.37 1.53 -1.20 1.20 0.00 0.00 173.24 174.40 1pwv n SER 481 N 4.65 1.01 -4.34 5.45 7.64 -1.26 0.20 113.62 126.97 1pwv n SER 481 Ca -0.09 -0.86 -0.29 0.00 1.01 0.00 0.00 58.87 58.64 1pwv n SER 481 Cb 0.43 0.16 -0.08 0.00 -1.01 0.00 0.00 64.21 63.71 1pwv n SER 481 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1pwv s ASN 482 N -2.55 3.34 -0.33 6.43 4.22 -1.26 -4.42 114.94 120.37 1pwv s ASN 482 Ca 0.23 -1.69 -0.27 0.00 -2.14 0.00 0.00 52.86 48.99 1pwv s ASN 482 Cb 0.19 0.56 0.01 0.00 1.28 0.00 0.00 41.25 43.29 1pwv s ASN 482 CO 0.54 -0.93 0.96 -0.31 -2.04 0.00 0.00 177.10 175.32 1pwv s TYR 483 N -3.07 3.14 0.12 1.54 1.51 -1.26 -4.39 117.35 114.93 1pwv s TYR 483 Ca 0.16 0.96 -0.31 0.00 -1.01 0.00 0.00 57.07 56.87 1pwv s TYR 483 Cb 0.02 -3.57 -0.07 0.00 -0.11 0.00 0.00 41.96 38.23 1pwv s TYR 483 CO 0.10 -0.74 1.27 -1.64 -1.11 0.00 0.00 175.55 173.43 1pwv s MET 484 N 3.43 4.41 -0.46 -0.62 -1.94 -1.24 -4.85 119.30 118.02 1pwv s MET 484 Ca 0.40 1.91 -0.05 0.00 -1.71 0.00 0.00 55.69 56.24 1pwv s MET 484 Cb -0.13 -3.28 0.12 0.00 2.01 0.00 0.00 34.83 33.56 1pwv s MET 484 CO 0.16 -0.27 0.29 0.42 -0.01 0.00 0.00 175.02 175.60 1pwv s ILE 485 N 0.73 3.71 0.43 2.53 1.01 -1.26 -0.88 121.20 127.47 1pwv s ILE 485 Ca 0.59 -2.06 0.08 0.00 0.00 0.00 0.00 60.65 59.26 1pwv s ILE 485 Cb -0.33 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.66 1pwv s ILE 485 CO 0.32 -0.75 0.51 0.68 0.00 0.00 0.00 174.94 175.71 1pwv s VAL 486 N 1.08 2.83 -0.03 2.92 -7.23 -0.57 -4.91 120.40 114.49 1pwv s VAL 486 Ca 0.08 -1.12 0.01 0.00 -1.81 0.00 0.00 61.98 59.14 1pwv s VAL 486 Cb -0.24 -2.95 -0.03 0.00 0.56 0.00 0.00 36.38 33.72 1pwv s VAL 486 CO -0.03 0.00 -0.02 -1.81 -0.31 0.00 0.00 175.10 172.93 1pwv s ASP 487 N -4.29 5.03 0.11 4.85 1.01 0.73 -1.31 116.67 122.79 1pwv s ASP 487 Ca 0.53 0.02 -0.17 0.00 0.71 0.00 0.00 52.55 53.64 1pwv s ASP 487 Cb -0.07 -1.32 -0.05 0.00 1.01 0.00 0.00 42.92 42.48 1pwv s ASP 487 CO 0.31 0.32 1.56 0.40 0.21 0.00 0.00 175.17 177.97 1pwv h ILE 488 N 3.81 1.25 -4.37 0.77 2.04 -1.54 -1.61 117.51 117.86 1pwv h ILE 488 Ca -0.49 -0.91 -0.70 0.00 1.00 0.00 0.00 64.86 63.76 1pwv h ILE 488 Cb 1.18 1.21 -0.27 0.00 -0.74 0.00 0.00 36.82 38.20 1pwv h ILE 488 CO 0.55 0.30 -0.87 0.20 0.00 0.00 0.00 178.15 178.33 1pwv s ASN 489 N -6.03 3.22 0.33 1.72 0.01 -1.26 -4.68 114.94 108.25 1pwv s ASN 489 Ca -0.13 -0.51 -0.29 0.00 -0.71 0.00 0.00 52.86 51.21 1pwv s ASN 489 Cb 0.09 -0.36 -0.12 0.00 0.41 0.00 0.00 41.25 41.27 1pwv s ASN 489 CO 0.77 0.28 1.43 1.21 -1.51 0.00 0.00 177.10 179.28 1pwv n GLU 490 N 2.02 2.42 -4.46 -0.60 2.13 -1.26 -4.90 120.64 115.99 1pwv n GLU 490 Ca -0.17 0.85 -0.23 0.00 0.66 0.00 0.00 57.16 58.28 1pwv n GLU 490 Cb 0.52 -2.54 -0.10 0.00 0.27 0.00 0.00 31.44 29.59 1pwv n GLU 490 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1pwv s ARG 491 N -1.48 1.64 0.64 5.31 1.81 -1.26 -5.10 118.95 120.50 1pwv s ARG 491 Ca 0.58 -1.84 -0.18 0.00 -1.72 0.00 0.00 55.73 52.57 1pwv s ARG 491 Cb -0.53 -1.27 -0.01 0.00 -0.45 0.00 0.00 34.95 32.68 1pwv s ARG 491 CO 0.58 0.04 1.22 -1.25 -0.68 0.00 0.00 175.30 175.21 1pwv s PRO 492 N -3.71 2.70 0.68 3.54 0.04 -1.26 -5.00 135.00 131.98 1pwv s PRO 492 Ca 0.31 1.84 0.04 0.00 0.04 0.00 0.00 61.00 63.23 1pwv s PRO 492 Cb 0.04 -1.89 0.12 0.00 0.04 0.00 0.00 34.50 32.81 1pwv s PRO 492 CO 0.13 -1.43 0.94 0.00 0.04 0.00 0.00 177.00 176.69 1pwv s ALA 493 N -1.67 4.14 0.62 8.56 0.00 -1.26 -5.06 121.76 127.08 1pwv s ALA 493 Ca 0.77 -1.99 0.03 0.00 0.00 0.00 0.00 51.96 50.77 1pwv s ALA 493 Cb -0.31 -1.74 0.08 0.00 0.00 0.00 0.00 23.12 21.15 1pwv s ALA 493 CO 0.37 -1.31 0.86 -0.51 0.00 0.00 0.00 175.76 175.18 1pwv s LEU 494 N -4.99 3.14 0.03 0.00 1.02 -1.26 -5.00 118.68 111.62 1pwv s LEU 494 Ca 0.66 -0.36 -0.27 0.00 0.02 0.00 0.00 54.13 54.17 1pwv s LEU 494 Cb -0.05 -2.21 -0.17 0.00 0.02 0.00 0.00 46.19 43.78 1pwv s LEU 494 CO 0.43 -1.47 1.35 0.44 0.02 0.00 0.00 176.35 177.12 1pwv h ASP 495 N -0.13 -0.48 0.00 2.29 3.32 -2.02 -2.86 116.42 116.54 1pwv h ASP 495 Ca -0.37 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1pwv h ASP 495 Cb 1.28 0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.96 1pwv h ASP 495 CO 0.44 -0.18 0.00 -0.46 -1.72 0.00 0.00 179.24 177.32 1pwv n ASN 496 N -5.25 0.00 -4.24 6.45 6.94 -1.26 -4.43 115.26 113.47 1pwv n ASN 496 Ca -0.11 -0.39 -0.43 0.00 -0.02 0.00 0.00 54.58 53.64 1pwv n ASN 496 Cb 0.29 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.64 1pwv n ASN 496 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 1pwv s GLU 497 N -2.00 2.85 -0.10 -3.83 2.02 -1.08 -4.26 118.70 112.30 1pwv s GLU 497 Ca 0.18 -2.00 0.14 0.00 0.02 0.00 0.00 54.97 53.31 1pwv s GLU 497 Cb 0.08 -4.09 0.45 0.00 0.10 0.00 0.00 34.13 30.67 1pwv s GLU 497 CO 0.14 -1.24 1.37 0.54 0.02 0.00 0.00 175.26 176.08 1pwv n ARG 498 N 4.60 2.97 -3.93 1.61 5.12 -1.14 -4.39 116.66 121.49 1pwv n ARG 498 Ca -0.03 -2.52 -0.35 0.00 -1.93 0.00 0.00 57.85 53.03 1pwv n ARG 498 Cb 0.42 -1.62 -0.14 0.00 -1.16 0.00 0.00 32.46 29.96 1pwv n ARG 498 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1pwv s LEU 499 N -2.03 2.83 -0.35 0.55 2.96 -0.71 -1.65 118.68 120.29 1pwv s LEU 499 Ca 0.35 -0.45 -0.00 0.00 -0.22 0.00 0.00 54.13 53.80 1pwv s LEU 499 Cb 0.25 -1.71 0.08 0.00 0.50 0.00 0.00 46.19 45.32 1pwv s LEU 499 CO 0.12 -0.03 0.08 -0.54 -1.32 0.00 0.00 176.35 174.67 1pwv s LYS 500 N 1.45 2.03 0.15 1.98 1.02 -0.37 -0.29 119.74 125.72 1pwv s LYS 500 Ca 0.05 -1.62 -0.26 0.00 0.02 0.00 0.00 55.97 54.16 1pwv s LYS 500 Cb -0.14 -3.31 -0.08 0.00 -0.52 0.00 0.00 37.83 33.78 1pwv s LYS 500 CO -0.04 -0.86 0.80 -1.58 -0.92 0.00 0.00 175.35 172.75 1pwv s TRP 501 N 1.12 3.89 -0.35 3.18 0.52 0.73 -1.67 118.94 126.34 1pwv s TRP 501 Ca 0.03 1.65 0.03 0.00 0.02 0.00 0.00 56.10 57.83 1pwv s TRP 501 Cb -0.21 -2.81 0.10 0.00 -1.15 0.00 0.00 33.47 29.40 1pwv s TRP 501 CO -0.04 0.46 0.08 0.50 0.02 0.00 0.00 176.95 177.96 1pwv s ARG 502 N -0.92 1.39 -0.14 4.98 3.52 0.25 -2.00 118.95 126.03 1pwv s ARG 502 Ca 0.37 -1.81 -0.13 0.00 -0.13 0.00 0.00 55.73 54.03 1pwv s ARG 502 Cb -0.23 -3.00 -0.05 0.00 -1.56 0.00 0.00 34.95 30.11 1pwv s ARG 502 CO 0.27 -0.96 0.29 0.42 -0.81 0.00 0.00 175.30 174.50 1pwv s ILE 503 N 0.92 5.29 -0.66 4.11 -1.09 0.84 -2.04 121.20 128.58 1pwv s ILE 503 Ca 0.11 0.55 -0.16 0.00 -2.23 0.00 0.00 60.65 58.92 1pwv s ILE 503 Cb -0.19 -3.62 0.15 0.00 -1.58 0.00 0.00 42.46 37.22 1pwv s ILE 503 CO -0.10 0.43 0.66 -1.58 -1.23 0.00 0.00 174.94 173.12 1pwv s GLN 504 N 0.15 3.21 0.64 2.79 0.74 0.10 -0.04 119.66 127.26 1pwv s GLN 504 Ca 0.17 -1.83 -0.18 0.00 0.05 0.00 0.00 55.36 53.58 1pwv s GLN 504 Cb -0.13 -4.37 -0.01 0.00 1.10 0.00 0.00 33.01 29.60 1pwv s GLN 504 CO 0.05 -1.40 1.24 -0.51 -0.55 0.00 0.00 175.29 174.12 1pwv s LEU 505 N 1.53 3.55 0.13 3.68 2.01 -1.08 -1.73 118.68 126.77 1pwv s LEU 505 Ca 0.11 2.46 -0.09 0.00 0.01 0.00 0.00 54.13 56.62 1pwv s LEU 505 Cb -0.22 -4.60 -0.06 0.00 0.01 0.00 0.00 46.19 41.32 1pwv s LEU 505 CO -0.00 -1.89 0.44 -0.55 1.01 0.00 0.00 176.35 175.35 1pwv s SER 506 N -1.63 6.61 0.41 2.29 0.15 -1.26 -4.65 113.70 115.61 1pwv s SER 506 Ca 0.78 0.79 0.10 0.00 0.70 0.00 0.00 55.95 58.33 1pwv s SER 506 Cb -0.33 -2.17 0.91 0.00 -1.71 0.00 0.00 66.02 62.72 1pwv s SER 506 CO 0.38 0.08 1.98 -0.65 1.20 0.00 0.00 173.24 176.24 1pwv h PRO 507 N 3.22 0.53 -0.23 5.44 0.11 -1.95 -1.08 132.00 138.04 1pwv h PRO 507 Ca -0.48 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.53 1pwv h PRO 507 Cb 1.18 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1pwv h PRO 507 CO 0.69 0.35 -0.15 -0.44 -0.21 0.00 0.00 178.00 178.23 1pwv h ASP 508 N 0.54 0.37 -2.03 -2.05 3.45 -1.97 -0.95 116.42 113.79 1pwv h ASP 508 Ca 0.27 -0.09 -0.62 0.00 0.43 0.00 0.00 57.03 57.02 1pwv h ASP 508 Cb 0.37 -0.10 0.03 0.00 -0.56 0.00 0.00 39.33 39.07 1pwv h ASP 508 CO -0.08 0.55 1.00 0.41 -1.57 0.00 0.00 179.24 179.54 1pwv n THR 509 N -4.21 0.41 -2.81 0.35 -1.04 -0.41 -4.68 114.28 101.89 1pwv n THR 509 Ca -0.00 -0.07 -0.32 0.00 -2.04 0.00 0.00 64.05 61.61 1pwv n THR 509 Cb 0.32 -1.71 -0.05 0.00 -1.82 0.00 0.00 70.33 67.07 1pwv n THR 509 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1pwv s ARG 510 N 3.22 4.02 0.16 -2.82 0.52 -1.26 -0.48 118.95 122.31 1pwv s ARG 510 Ca 0.90 0.85 -0.24 0.00 -0.52 0.00 0.00 55.73 56.72 1pwv s ARG 510 Cb -0.73 -2.27 0.06 0.00 0.52 0.00 0.00 34.95 32.53 1pwv s ARG 510 CO 0.50 -0.04 0.75 0.00 0.02 0.00 0.00 175.30 176.53 1pwv s ALA 511 N -2.27 -1.56 -0.04 2.13 0.00 -0.89 -2.55 121.76 116.58 1pwv s ALA 511 Ca 0.57 0.33 0.06 0.00 0.00 0.00 0.00 51.96 52.93 1pwv s ALA 511 Cb -0.10 0.74 -0.01 0.00 0.00 0.00 0.00 23.12 23.76 1pwv s ALA 511 CO 0.22 -0.87 -0.23 0.20 0.00 0.00 0.00 175.76 175.08 1pwv s GLY 512 N -2.77 1.17 0.00 0.00 0.00 0.60 -4.47 107.32 101.85 1pwv s GLY 512 Ca 0.06 -0.95 -0.21 0.00 0.00 0.00 0.00 44.72 43.62 1pwv s GLY 512 CO -0.05 -0.63 0.62 -0.47 0.00 0.00 0.00 173.10 172.57 1pwv s TYR 513 N -0.22 3.69 0.01 1.90 5.04 -1.26 -0.23 117.35 126.28 1pwv s TYR 513 Ca -0.00 1.24 0.04 0.00 -2.44 0.00 0.00 57.07 55.90 1pwv s TYR 513 Cb -0.12 -2.64 -0.03 0.00 0.35 0.00 0.00 41.96 39.52 1pwv s TYR 513 CO 0.02 0.34 -0.09 -0.51 -1.34 0.00 0.00 175.55 173.97 1pwv s LEU 514 N -0.18 3.05 0.44 6.97 1.43 -0.37 -4.97 118.68 125.04 1pwv s LEU 514 Ca 0.32 -0.19 0.13 0.00 -1.03 0.00 0.00 54.13 53.35 1pwv s LEU 514 Cb -0.19 -1.75 1.01 0.00 0.03 0.00 0.00 46.19 45.30 1pwv s LEU 514 CO 0.18 0.28 2.01 -0.33 0.23 0.00 0.00 176.35 178.72 1pwv h GLU 515 N 4.58 0.39 -0.90 1.70 4.39 -1.98 -2.43 114.58 120.33 1pwv h GLU 515 Ca -0.48 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.19 1pwv h GLU 515 Cb 1.16 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 1pwv h GLU 515 CO 0.52 0.26 0.00 0.27 -1.16 0.00 0.00 179.01 178.91 1pwv n ASN 516 N -4.47 0.96 -0.41 1.42 6.94 -1.26 -4.82 115.26 113.62 1pwv n ASN 516 Ca 0.07 -1.79 -0.05 0.00 -0.02 0.00 0.00 54.58 52.80 1pwv n ASN 516 Cb 0.28 -0.45 -0.01 0.00 -2.36 0.00 0.00 39.78 37.24 1pwv n ASN 516 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1pwv n GLY 517 N 0.07 0.52 3.38 4.83 0.00 -0.91 -4.99 105.19 108.09 1pwv n GLY 517 Ca 0.00 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 1pwv n GLY 517 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pwv s LYS 518 N -3.09 1.63 0.06 1.61 1.02 -1.24 -1.36 119.74 118.36 1pwv s LYS 518 Ca 0.00 -1.22 0.04 0.00 0.02 0.00 0.00 55.97 54.81 1pwv s LYS 518 Cb 0.00 -1.96 -0.04 0.00 -0.52 0.00 0.00 37.83 35.31 1pwv s LYS 518 CO 0.00 0.48 -0.01 -0.51 -0.92 0.00 0.00 175.35 174.39 1pwv s LEU 519 N -1.69 3.42 -0.32 3.17 1.43 -0.43 -1.24 118.68 123.02 1pwv s LEU 519 Ca 0.13 -0.15 -0.04 0.00 -1.03 0.00 0.00 54.13 53.04 1pwv s LEU 519 Cb -0.10 -2.10 0.05 0.00 0.03 0.00 0.00 46.19 44.07 1pwv s LEU 519 CO 0.05 0.21 0.06 -0.63 0.23 0.00 0.00 176.35 176.26 1pwv s ILE 520 N -1.23 3.32 0.50 -0.59 1.01 0.68 -1.52 121.20 123.38 1pwv s ILE 520 Ca 0.23 -1.35 -0.15 0.00 0.00 0.00 0.00 60.65 59.38 1pwv s ILE 520 Cb -0.12 -2.93 -0.07 0.00 0.01 0.00 0.00 42.46 39.35 1pwv s ILE 520 CO 0.15 -0.19 0.95 -0.76 0.00 0.00 0.00 174.94 175.10 1pwv s LEU 521 N 1.30 3.64 0.43 2.97 1.43 -0.06 -0.29 118.68 128.11 1pwv s LEU 521 Ca -0.03 1.49 -0.23 0.00 -1.03 0.00 0.00 54.13 54.34 1pwv s LEU 521 Cb -0.20 -4.43 -0.08 0.00 0.03 0.00 0.00 46.19 41.51 1pwv s LEU 521 CO 0.00 -0.57 1.09 0.00 0.23 0.00 0.00 176.35 177.11 1pwv s GLN 522 N -4.08 3.96 1.05 1.70 1.03 -1.06 -3.71 119.66 118.56 1pwv s GLN 522 Ca 0.57 1.59 -0.12 0.00 0.04 0.00 0.00 55.36 57.45 1pwv s GLN 522 Cb -0.10 -2.44 0.22 0.00 0.03 0.00 0.00 33.01 30.73 1pwv s GLN 522 CO 0.32 -0.33 1.07 -0.98 -2.54 0.00 0.00 175.29 172.83 1pwv s ARG 523 N -2.66 -0.07 -0.94 9.60 1.70 -1.26 -4.28 118.95 121.04 1pwv s ARG 523 Ca 0.61 1.09 -0.00 0.00 -0.47 0.00 0.00 55.73 56.96 1pwv s ARG 523 Cb -0.24 -1.63 -0.00 0.00 -0.57 0.00 0.00 34.95 32.51 1pwv s ARG 523 CO 0.29 -3.22 0.78 0.09 -1.08 0.00 0.00 175.30 172.16 1pwv n ASN 524 N -4.60 -2.06 -4.87 -2.89 5.03 0.13 -4.99 115.26 101.01 1pwv n ASN 524 Ca 0.06 -0.49 -0.32 0.00 0.87 0.00 0.00 54.58 54.70 1pwv n ASN 524 Cb 0.54 -4.13 -0.05 0.00 -1.02 0.00 0.00 39.78 35.11 1pwv n ASN 524 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1pwv s ILE 525 N -3.28 4.95 -0.09 2.41 -1.09 -0.82 -4.49 121.20 118.77 1pwv s ILE 525 Ca 0.00 0.48 -0.01 0.00 -2.23 0.00 0.00 60.65 58.89 1pwv s ILE 525 Cb -0.00 -3.63 -0.03 0.00 -1.58 0.00 0.00 42.46 37.22 1pwv s ILE 525 CO 0.57 -0.02 -0.03 -0.83 -1.23 0.00 0.00 174.94 173.41 1pwv s GLY 526 N -2.28 1.78 -0.03 6.18 0.00 -0.97 -2.02 107.32 109.98 1pwv s GLY 526 Ca 0.45 -0.83 0.01 0.00 0.00 0.00 0.00 44.72 44.35 1pwv s GLY 526 CO 0.21 -0.51 -0.03 1.08 0.00 0.00 0.00 173.10 173.85 1pwv s LEU 527 N -0.64 1.44 -0.14 0.66 1.43 -0.46 -0.18 118.68 120.79 1pwv s LEU 527 Ca 0.10 -0.09 -0.05 0.00 -1.03 0.00 0.00 54.13 53.07 1pwv s LEU 527 Cb -0.12 -0.33 -0.04 0.00 0.03 0.00 0.00 46.19 45.73 1pwv s LEU 527 CO 0.02 -0.04 0.03 -1.61 0.23 0.00 0.00 176.35 174.97 1pwv s GLU 528 N 0.70 3.55 -0.18 1.70 2.02 -0.41 -0.23 118.70 125.85 1pwv s GLU 528 Ca -0.08 -0.39 -0.27 0.00 0.02 0.00 0.00 54.97 54.25 1pwv s GLU 528 Cb -0.12 -3.01 -0.01 0.00 0.10 0.00 0.00 34.13 31.10 1pwv s GLU 528 CO -0.00 0.44 0.90 0.42 0.02 0.00 0.00 175.26 177.04 1pwv s ILE 529 N -0.14 4.82 -0.07 -1.63 -1.09 0.87 -1.29 121.20 122.67 1pwv s ILE 529 Ca 0.05 1.77 0.18 0.00 -2.23 0.00 0.00 60.65 60.42 1pwv s ILE 529 Cb -0.12 -4.20 -0.26 0.00 -1.58 0.00 0.00 42.46 36.30 1pwv s ILE 529 CO 0.02 -0.04 0.30 0.29 -1.23 0.00 0.00 174.94 174.28 1pwv n LYS 530 N 5.56 0.75 -3.64 2.79 4.76 0.16 -4.88 118.16 123.66 1pwv n LYS 530 Ca 0.07 -0.12 -0.08 0.00 -2.87 0.00 0.00 58.31 55.31 1pwv n LYS 530 Cb 0.48 -1.44 -0.07 0.00 -1.84 0.00 0.00 35.03 32.16 1pwv n LYS 530 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1pwv s ASP 531 N -4.41 -0.43 -0.07 4.39 -1.08 -1.04 -4.98 116.67 109.06 1pwv s ASP 531 Ca -0.07 0.82 0.01 0.00 -0.52 0.00 0.00 52.55 52.79 1pwv s ASP 531 Cb 0.10 0.87 0.02 0.00 -1.46 0.00 0.00 42.92 42.44 1pwv s ASP 531 CO 0.75 -0.14 -0.07 -0.69 0.52 0.00 0.00 175.17 175.54 1pwv s VAL 532 N 0.33 0.80 0.14 1.11 1.01 -1.26 -0.99 120.40 121.55 1pwv s VAL 532 Ca 0.02 -0.24 -0.17 0.00 0.00 0.00 0.00 61.98 61.59 1pwv s VAL 532 Cb -0.05 -0.80 0.04 0.00 0.00 0.00 0.00 36.38 35.57 1pwv s VAL 532 CO -0.08 0.30 0.45 0.00 0.00 0.00 0.00 175.10 175.76 1pwv s GLN 533 N 1.07 1.15 -0.05 2.72 -2.07 -1.03 -5.01 119.66 116.45 1pwv s GLN 533 Ca -0.08 -0.71 -0.17 0.00 -1.82 0.00 0.00 55.36 52.58 1pwv s GLN 533 Cb -0.14 0.49 -0.05 0.00 -1.09 0.00 0.00 33.01 32.22 1pwv s GLN 533 CO -0.01 -0.46 0.45 0.42 -1.32 0.00 0.00 175.29 174.37 1pwv s ILE 534 N -3.81 5.07 0.11 3.63 1.01 -1.26 -0.86 121.20 125.08 1pwv s ILE 534 Ca 0.04 0.92 0.03 0.00 0.00 0.00 0.00 60.65 61.64 1pwv s ILE 534 Cb 0.01 -3.78 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 1pwv s ILE 534 CO -0.10 0.46 -0.08 0.27 0.00 0.00 0.00 174.94 175.48 1pwv s ILE 535 N -0.30 0.88 -0.12 2.92 -4.36 0.19 -4.40 121.20 116.01 1pwv s ILE 535 Ca 0.25 -1.88 -0.03 0.00 -0.26 0.00 0.00 60.65 58.73 1pwv s ILE 535 Cb -0.16 -1.62 -0.03 0.00 1.25 0.00 0.00 42.46 41.90 1pwv s ILE 535 CO 0.12 -0.75 -0.01 -0.75 0.24 0.00 0.00 174.94 173.79 1pwv s LYS 536 N -3.50 3.35 -0.21 0.37 2.20 -1.26 0.29 119.74 120.98 1pwv s LYS 536 Ca 0.11 -0.45 -0.06 0.00 -0.36 0.00 0.00 55.97 55.21 1pwv s LYS 536 Cb 0.02 -2.88 0.10 0.00 -1.51 0.00 0.00 37.83 33.56 1pwv s LYS 536 CO -0.02 0.48 0.42 -1.14 -0.36 0.00 0.00 175.35 174.73 1pwv s GLN 537 N -0.28 0.33 -1.02 4.03 0.74 0.12 -4.68 119.66 118.90 1pwv s GLN 537 Ca 0.06 0.97 -0.03 0.00 0.05 0.00 0.00 55.36 56.41 1pwv s GLN 537 Cb -0.12 0.23 -0.04 0.00 1.10 0.00 0.00 33.01 34.18 1pwv s GLN 537 CO 0.02 -0.31 0.87 0.43 -0.55 0.00 0.00 175.29 175.75 1pwv n SER 538 N 5.39 -4.44 -1.92 6.67 7.64 -1.26 -2.11 113.62 123.59 1pwv n SER 538 Ca -0.08 -0.61 -0.08 0.00 1.01 0.00 0.00 58.87 59.11 1pwv n SER 538 Cb 0.50 -4.78 -0.02 0.00 -1.01 0.00 0.00 64.21 58.90 1pwv n SER 538 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1pwv n GLU 539 N -3.42 -1.93 -3.98 1.43 4.71 -1.26 -4.90 120.64 111.30 1pwv n GLU 539 Ca -0.15 0.40 -0.12 0.00 -0.01 0.00 0.00 57.16 57.28 1pwv n GLU 539 Cb 0.63 -4.78 -0.13 0.00 -1.01 0.00 0.00 31.44 26.15 1pwv n GLU 539 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 1pwv s LYS 540 N -3.98 0.21 0.04 3.49 2.20 -0.90 -4.90 119.74 115.91 1pwv s LYS 540 Ca 0.00 -0.25 -0.18 0.00 -0.36 0.00 0.00 55.97 55.18 1pwv s LYS 540 Cb 0.00 -0.10 -0.06 0.00 -1.51 0.00 0.00 37.83 36.16 1pwv s LYS 540 CO 0.00 0.02 0.51 -1.21 -0.36 0.00 0.00 175.35 174.31 1pwv s GLU 541 N -0.50 4.11 0.07 4.03 2.02 0.16 0.12 118.70 128.72 1pwv s GLU 541 Ca -0.04 0.62 0.01 0.00 0.02 0.00 0.00 54.97 55.58 1pwv s GLU 541 Cb -0.04 -3.24 -0.04 0.00 0.10 0.00 0.00 34.13 30.91 1pwv s GLU 541 CO -0.00 0.64 -0.05 0.71 0.02 0.00 0.00 175.26 176.57 1pwv s TYR 542 N -1.02 0.73 -0.39 1.61 1.51 0.15 -4.75 117.35 115.17 1pwv s TYR 542 Ca 0.27 -0.90 -0.14 0.00 -1.01 0.00 0.00 57.07 55.29 1pwv s TYR 542 Cb -0.18 -0.45 0.01 0.00 -0.11 0.00 0.00 41.96 41.22 1pwv s TYR 542 CO 0.17 -0.21 0.29 0.42 -1.11 0.00 0.00 175.55 175.10 1pwv s ILE 543 N -3.38 5.26 -0.10 2.71 1.01 -0.66 0.57 121.20 126.62 1pwv s ILE 543 Ca 0.07 -0.52 -0.26 0.00 0.00 0.00 0.00 60.65 59.94 1pwv s ILE 543 Cb 0.04 -3.87 -0.02 0.00 0.01 0.00 0.00 42.46 38.61 1pwv s ILE 543 CO -0.06 -0.23 0.81 -0.60 0.00 0.00 0.00 174.94 174.87 1pwv s ARG 544 N 1.71 4.39 -0.25 2.79 6.06 -0.04 -1.23 118.95 132.38 1pwv s ARG 544 Ca 0.06 1.05 -0.02 0.00 -2.50 0.00 0.00 55.73 54.31 1pwv s ARG 544 Cb -0.18 -3.51 0.02 0.00 0.06 0.00 0.00 34.95 31.33 1pwv s ARG 544 CO 0.10 -0.14 -0.05 0.42 -2.50 0.00 0.00 175.30 173.13 1pwv s ILE 545 N 1.48 3.02 -0.45 4.11 1.01 -0.67 -2.46 121.20 127.23 1pwv s ILE 545 Ca 0.41 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 59.99 1pwv s ILE 545 Cb -0.18 -2.50 0.06 0.00 0.01 0.00 0.00 42.46 39.85 1pwv s ILE 545 CO 0.17 0.24 0.37 -1.81 0.00 0.00 0.00 174.94 173.91 1pwv s ASP 546 N 1.36 6.14 0.14 3.58 1.01 -0.16 -0.58 116.67 128.16 1pwv s ASP 546 Ca 0.01 -1.19 0.11 0.00 0.71 0.00 0.00 52.55 52.19 1pwv s ASP 546 Cb -0.16 -2.18 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 1pwv s ASP 546 CO -0.04 -0.59 -0.25 0.00 0.21 0.00 0.00 175.17 174.50 1pwv s ALA 547 N 1.67 2.46 -0.14 5.23 0.00 -0.86 0.35 121.76 130.47 1pwv s ALA 547 Ca 0.05 -1.48 0.02 0.00 0.00 0.00 0.00 51.96 50.54 1pwv s ALA 547 Cb -0.23 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.48 1pwv s ALA 547 CO 0.08 0.53 -0.21 0.21 0.00 0.00 0.00 175.76 176.37 1pwv s LYS 548 N -2.19 3.07 0.23 0.00 2.20 -0.42 0.03 119.74 122.66 1pwv s LYS 548 Ca 0.16 -0.83 -0.30 0.00 -0.36 0.00 0.00 55.97 54.64 1pwv s LYS 548 Cb -0.10 -2.46 -0.10 0.00 -1.51 0.00 0.00 37.83 33.67 1pwv s LYS 548 CO 0.07 0.02 1.38 0.08 -0.36 0.00 0.00 175.35 176.54 1pwv s VAL 549 N 0.75 2.89 0.28 4.02 1.01 -0.70 -1.28 120.40 127.36 1pwv s VAL 549 Ca -0.08 0.75 0.03 0.00 0.00 0.00 0.00 61.98 62.68 1pwv s VAL 549 Cb -0.16 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1pwv s VAL 549 CO -0.00 0.12 0.24 0.68 0.00 0.00 0.00 175.10 176.14 1pwv s VAL 550 N -0.03 0.00 0.03 2.92 -7.23 0.75 -4.59 120.40 112.26 1pwv s VAL 550 Ca 0.58 -1.96 -0.30 0.00 -1.81 0.00 0.00 61.98 58.48 1pwv s VAL 550 Cb -0.39 -2.50 -0.07 0.00 0.56 0.00 0.00 36.38 33.98 1pwv s VAL 550 CO 0.42 0.00 1.54 -2.84 -0.31 0.00 0.00 175.10 173.91 1pwv s PRO 551 N -3.72 4.23 0.40 4.82 0.02 -1.26 -2.30 135.00 137.18 1pwv s PRO 551 Ca 0.39 2.16 0.18 0.00 0.02 0.00 0.00 61.00 63.75 1pwv s PRO 551 Cb 0.04 -3.60 1.08 0.00 0.02 0.00 0.00 34.50 32.04 1pwv s PRO 551 CO 0.20 -0.67 1.79 -0.22 -0.33 0.00 0.00 177.00 177.78 1pwv h LYS 552 N 8.15 0.40 -0.94 5.54 3.64 -1.86 0.13 116.57 131.63 1pwv h LYS 552 Ca -0.40 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 58.97 1pwv h LYS 552 Cb 1.19 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.87 1pwv h LYS 552 CO 0.92 0.27 0.62 0.66 -2.27 0.00 0.00 179.45 179.65 1pwv h SER 553 N 0.42 1.06 -0.98 4.20 4.64 -1.93 0.49 113.55 121.44 1pwv h SER 553 Ca 0.56 -0.02 0.05 0.00 -0.47 0.00 0.00 61.79 61.91 1pwv h SER 553 Cb 1.40 -0.26 -0.06 0.00 -0.31 0.00 0.00 62.40 63.17 1pwv h SER 553 CO -0.27 0.76 0.64 0.50 -0.87 0.00 0.00 176.83 177.59 1pwv h LYS 554 N 1.25 1.17 -0.02 4.77 3.64 -1.12 0.25 116.57 126.50 1pwv h LYS 554 Ca 0.35 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.64 1pwv h LYS 554 Cb -0.10 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.45 1pwv h LYS 554 CO -0.09 0.77 -0.05 0.82 -2.27 0.00 0.00 179.45 178.64 1pwv h ILE 555 N 1.21 1.45 -0.87 2.00 5.03 -1.30 -3.08 117.51 121.94 1pwv h ILE 555 Ca 0.41 -1.40 0.13 0.00 -0.12 0.00 0.00 64.86 63.87 1pwv h ILE 555 Cb 0.07 2.32 -0.07 0.00 -3.03 0.00 0.00 36.82 36.12 1pwv h ILE 555 CO -0.14 0.37 0.56 0.44 -0.68 0.00 0.00 178.15 178.70 1pwv h ASP 556 N -0.47 0.67 -0.78 1.72 3.45 -0.37 0.11 116.42 120.75 1pwv h ASP 556 Ca 0.00 0.03 -0.04 0.00 0.43 0.00 0.00 57.03 57.46 1pwv h ASP 556 Cb 0.63 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 39.27 1pwv h ASP 556 CO 0.01 0.36 0.35 0.74 -1.57 0.00 0.00 179.24 179.14 1pwv h THR 557 N 0.72 1.25 -0.18 0.35 2.02 -0.51 0.79 112.91 117.36 1pwv h THR 557 Ca 0.42 -0.75 -0.01 0.00 0.77 0.00 0.00 66.41 66.85 1pwv h THR 557 Cb 0.62 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.29 1pwv h THR 557 CO -0.19 0.31 0.09 0.11 0.37 0.00 0.00 175.52 176.22 1pwv h LYS 558 N 1.13 0.26 0.17 6.66 1.57 -0.91 0.24 116.57 125.70 1pwv h LYS 558 Ca 0.27 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 59.02 1pwv h LYS 558 Cb 0.16 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 1pwv h LYS 558 CO -0.03 0.28 -0.26 0.82 -0.57 0.00 0.00 179.45 179.69 1pwv h ILE 559 N 0.17 0.43 -0.98 1.86 2.04 -0.89 0.42 117.51 120.55 1pwv h ILE 559 Ca 0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.99 1pwv h ILE 559 Cb 0.11 0.43 -0.07 0.00 -0.74 0.00 0.00 36.82 36.55 1pwv h ILE 559 CO -0.01 0.00 0.64 1.56 0.00 0.00 0.00 178.15 180.34 1pwv h GLN 560 N -0.50 1.11 -0.34 2.37 1.08 -0.61 0.19 115.11 118.41 1pwv h GLN 560 Ca 0.02 -0.07 -0.10 0.00 -1.45 0.00 0.00 58.65 57.04 1pwv h GLN 560 Cb 0.50 -0.25 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 1pwv h GLN 560 CO -0.11 0.74 -0.22 0.93 -0.95 0.00 0.00 178.83 179.22 1pwv h GLU 561 N 1.15 0.66 0.06 1.46 5.08 -0.09 -2.33 114.58 120.57 1pwv h GLU 561 Ca 0.42 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1pwv h GLU 561 Cb 0.17 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1pwv h GLU 561 CO -0.17 0.82 -0.03 0.00 -1.00 0.00 0.00 179.01 178.64 1pwv h ALA 562 N 1.18 -0.08 -0.85 3.43 0.00 0.12 -1.49 119.26 121.57 1pwv h ALA 562 Ca 0.09 -0.16 0.14 0.00 0.00 0.00 0.00 54.91 54.97 1pwv h ALA 562 Cb 0.69 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 1pwv h ALA 562 CO 0.05 -0.39 0.55 0.37 0.00 0.00 0.00 179.25 179.84 1pwv h GLN 563 N -0.40 0.63 -0.34 0.00 4.15 -0.93 0.20 115.11 118.42 1pwv h GLN 563 Ca -0.01 -0.04 -0.11 0.00 0.77 0.00 0.00 58.65 59.26 1pwv h GLN 563 Cb 0.36 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 1pwv h GLN 563 CO 0.01 0.42 -0.22 1.25 -1.93 0.00 0.00 178.83 178.36 1pwv h LEU 564 N 0.65 0.78 0.07 -2.39 6.46 -1.28 -3.08 115.31 116.51 1pwv h LEU 564 Ca 0.42 -0.43 -0.00 0.00 -0.12 0.00 0.00 57.88 57.75 1pwv h LEU 564 Cb 0.71 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.42 1pwv h LEU 564 CO -0.18 1.04 -0.03 -1.13 -0.62 0.00 0.00 178.44 177.52 1pwv h ASN 565 N 0.52 -0.07 -0.43 1.25 -0.73 0.07 -2.96 115.58 113.22 1pwv h ASN 565 Ca 0.07 -0.20 0.13 0.00 1.87 0.00 0.00 56.30 58.16 1pwv h ASN 565 Cb 0.78 0.02 -0.02 0.00 0.27 0.00 0.00 38.32 39.37 1pwv h ASN 565 CO 0.06 0.16 0.34 -0.29 -0.37 0.00 0.00 177.43 177.34 1pwv h ILE 566 N -0.31 0.65 0.20 2.57 2.10 -0.73 -1.52 117.51 120.48 1pwv h ILE 566 Ca -0.01 0.00 -0.32 0.00 1.08 0.00 0.00 64.86 65.61 1pwv h ILE 566 Cb 0.27 0.75 0.02 0.00 -1.09 0.00 0.00 36.82 36.77 1pwv h ILE 566 CO 0.01 0.00 -1.44 0.78 -1.08 0.00 0.00 178.15 176.43 1pwv h ASN 567 N 0.00 0.65 -0.31 2.19 4.21 -1.46 -1.47 115.58 119.40 1pwv h ASN 567 Ca 0.21 -0.74 0.07 0.00 1.21 0.00 0.00 56.30 57.05 1pwv h ASN 567 Cb 0.89 -0.21 -0.07 0.00 -1.12 0.00 0.00 38.32 37.81 1pwv h ASN 567 CO -0.00 1.58 -0.15 1.56 -1.29 0.00 0.00 177.43 179.13 1pwv h GLN 568 N 0.11 -0.10 0.83 0.81 4.20 -1.13 0.48 115.11 120.32 1pwv h GLN 568 Ca -0.23 0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.45 1pwv h GLN 568 Cb 2.09 0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.90 1pwv h GLN 568 CO 0.24 -0.07 -0.43 1.49 -0.67 0.00 0.00 178.83 179.38 1pwv h GLU 569 N -0.11 -1.12 0.00 1.46 4.81 -1.47 -2.44 114.58 115.72 1pwv h GLU 569 Ca 0.16 0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.47 1pwv h GLU 569 Cb 0.35 0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.99 1pwv h GLU 569 CO -0.38 -0.74 0.00 0.91 -0.73 0.00 0.00 179.01 178.06 1pwv n TRP 570 N -5.60 0.00 0.06 0.92 7.02 -0.55 -1.83 117.44 117.46 1pwv n TRP 570 Ca -0.15 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 56.15 1pwv n TRP 570 Cb 0.47 -0.17 -0.14 0.00 -2.42 0.00 0.00 31.31 29.05 1pwv n TRP 570 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 1pwv h ASN 571 N 0.00 0.40 -0.20 -0.99 -0.26 0.05 -2.87 115.58 111.72 1pwv h ASN 571 Ca 0.00 -0.59 -0.19 0.00 -0.56 0.00 0.00 56.30 54.97 1pwv h ASN 571 Cb 0.16 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.29 1pwv h ASN 571 CO 0.00 1.49 -0.58 0.50 -1.06 0.00 0.00 177.43 177.78 1pwv h LYS 572 N 0.07 0.80 0.69 0.81 3.64 -1.19 0.28 116.57 121.67 1pwv h LYS 572 Ca -0.27 -0.53 -0.03 0.00 -1.27 0.00 0.00 60.65 58.55 1pwv h LYS 572 Cb 2.03 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 33.92 1pwv h LYS 572 CO 0.15 1.15 -0.33 0.00 -2.27 0.00 0.00 179.45 178.15 1pwv h ALA 573 N 0.73 -1.04 0.00 5.00 0.00 -1.48 -2.96 119.26 119.52 1pwv h ALA 573 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1pwv h ALA 573 Cb 1.18 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1pwv h ALA 573 CO 0.12 -0.97 0.00 1.28 0.00 0.00 0.00 179.25 179.69 1pwv n LEU 574 N -5.03 0.00 -2.58 0.00 4.32 -1.08 -4.89 117.00 107.74 1pwv n LEU 574 Ca -0.12 0.46 -0.14 0.00 -0.02 0.00 0.00 56.01 56.19 1pwv n LEU 574 Cb 0.37 -0.46 0.06 0.00 -1.62 0.00 0.00 43.42 41.77 1pwv n LEU 574 CO 0.28 -0.29 0.13 0.61 -1.22 0.00 0.00 177.39 176.90 1pwv n GLY 575 N -0.37 -0.06 4.00 -0.72 0.00 0.19 -4.90 105.19 103.33 1pwv n GLY 575 Ca 0.03 -0.07 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 1pwv n GLY 575 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pwv s LEU 576 N -5.07 3.36 0.11 0.99 1.43 0.74 -5.01 118.68 115.22 1pwv s LEU 576 Ca 0.24 -0.40 -0.31 0.00 -1.03 0.00 0.00 54.13 52.63 1pwv s LEU 576 Cb -0.11 -2.41 -0.09 0.00 0.03 0.00 0.00 46.19 43.61 1pwv s LEU 576 CO 0.48 -1.12 1.70 -2.84 0.23 0.00 0.00 176.35 174.81 1pwv s PRO 577 N -4.62 4.18 0.15 1.29 0.02 -1.26 -4.73 135.00 130.03 1pwv s PRO 577 Ca 0.58 2.43 0.04 0.00 0.02 0.00 0.00 61.00 64.07 1pwv s PRO 577 Cb -0.09 -3.50 0.42 0.00 0.02 0.00 0.00 34.50 31.35 1pwv s PRO 577 CO 0.37 -0.75 0.69 1.17 -0.33 0.00 0.00 177.00 178.15 1pwv n LYS 578 N 5.30 -0.03 -1.01 5.54 4.81 -1.26 -0.60 118.16 130.91 1pwv n LYS 578 Ca 0.16 0.64 -0.07 0.00 -0.87 0.00 0.00 58.31 58.17 1pwv n LYS 578 Cb 0.39 -1.06 0.28 0.00 0.02 0.00 0.00 35.03 34.66 1pwv n LYS 578 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1pwv n TYR 579 N -4.31 2.37 -2.74 5.64 0.53 -1.26 -4.78 117.16 112.60 1pwv n TYR 579 Ca 0.12 -1.29 -0.34 0.00 -1.02 0.00 0.00 57.90 55.37 1pwv n TYR 579 Cb 0.42 -0.69 -0.06 0.00 -1.03 0.00 0.00 39.34 37.98 1pwv n TYR 579 CO 0.00 0.00 0.00 -0.08 -1.02 0.00 0.00 176.86 175.76 1pwv s THR 580 N -3.04 4.20 -0.80 -0.72 -1.32 0.23 -5.00 115.64 109.18 1pwv s THR 580 Ca 0.54 1.49 -0.15 0.00 -1.21 0.00 0.00 61.69 62.37 1pwv s THR 580 Cb 0.44 -3.67 0.20 0.00 -1.51 0.00 0.00 72.50 67.96 1pwv s THR 580 CO 0.12 -0.18 0.77 -0.75 -2.21 0.00 0.00 174.62 172.37 1pwv s LYS 581 N -2.88 3.54 -0.16 7.08 2.47 -1.26 -4.88 119.74 123.66 1pwv s LYS 581 Ca 0.60 -2.33 -0.13 0.00 -1.56 0.00 0.00 55.97 52.55 1pwv s LYS 581 Cb -0.13 -4.45 -0.04 0.00 -1.46 0.00 0.00 37.83 31.75 1pwv s LYS 581 CO 0.18 -1.33 -0.25 -0.11 0.16 0.00 0.00 175.35 174.00 1pwv n LEU 582 N 4.30 1.85 -4.75 5.43 0.00 -1.26 -4.88 117.00 117.69 1pwv n LEU 582 Ca 0.11 0.51 -0.38 0.00 0.00 0.00 0.00 56.01 56.26 1pwv n LEU 582 Cb 0.46 -0.82 -0.06 0.00 0.00 0.00 0.00 43.42 43.01 1pwv n LEU 582 CO 0.37 -0.39 0.13 -0.63 0.00 0.00 0.00 177.39 176.86 1pwv s ILE 583 N -2.51 5.15 -0.03 1.96 1.01 -1.26 -1.67 121.20 123.85 1pwv s ILE 583 Ca -0.21 0.86 0.03 0.00 0.00 0.00 0.00 60.65 61.34 1pwv s ILE 583 Cb 0.03 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.74 1pwv s ILE 583 CO 0.30 0.41 -0.13 0.42 0.00 0.00 0.00 174.94 175.95 1pwv s THR 584 N 0.11 1.07 -0.54 2.92 -4.23 -0.31 -4.93 115.64 109.72 1pwv s THR 584 Ca 0.24 -0.52 -0.17 0.00 -1.18 0.00 0.00 61.69 60.06 1pwv s THR 584 Cb -0.15 -0.94 0.11 0.00 1.34 0.00 0.00 72.50 72.86 1pwv s THR 584 CO 0.10 0.32 0.56 -0.36 -0.54 0.00 0.00 174.62 174.71 1pwv s PHE 585 N 0.14 3.15 -1.11 3.99 2.99 -1.26 -2.12 117.98 123.76 1pwv s PHE 585 Ca -0.04 -1.07 -0.04 0.00 0.00 0.00 0.00 56.93 55.78 1pwv s PHE 585 Cb -0.10 -3.76 0.29 0.00 0.00 0.00 0.00 43.02 39.45 1pwv s PHE 585 CO 0.01 -1.08 1.61 -1.71 -0.00 0.00 0.00 175.22 174.05 1pwv n ASN 586 N 5.67 6.44 -4.59 1.36 2.85 -0.85 -4.98 115.26 121.17 1pwv n ASN 586 Ca -0.12 -3.41 -0.38 0.00 -0.11 0.00 0.00 54.58 50.56 1pwv n ASN 586 Cb 0.42 -1.29 -0.11 0.00 1.24 0.00 0.00 39.78 40.04 1pwv n ASN 586 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1pwv s VAL 587 N -2.57 5.27 0.00 3.44 1.01 -1.26 -3.29 120.40 123.00 1pwv s VAL 587 Ca 0.34 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.47 1pwv s VAL 587 Cb 0.08 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.95 1pwv s VAL 587 CO 0.06 0.26 0.00 1.41 0.00 0.00 0.00 175.10 176.82 1pwv n HIS 588 N 5.04 0.00 -2.62 5.22 8.25 -1.26 -5.02 115.22 124.83 1pwv n HIS 588 Ca -0.14 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.08 1pwv n HIS 588 Cb 0.52 0.00 0.11 0.00 1.12 0.00 0.00 29.99 31.74 1pwv n HIS 588 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1pwv s ASN 589 N -1.77 4.32 0.62 0.41 0.02 -1.26 -4.10 114.94 113.18 1pwv s ASN 589 Ca 0.00 -0.44 0.27 0.00 -1.02 0.00 0.00 52.86 51.66 1pwv s ASN 589 Cb 0.00 0.10 1.36 0.00 0.02 0.00 0.00 41.25 42.72 1pwv s ASN 589 CO 0.00 -1.89 1.77 0.03 0.02 0.00 0.00 177.10 177.04 1pwv h ARG 590 N -0.52 0.00 -0.82 -0.60 2.47 -1.33 -1.39 114.38 112.19 1pwv h ARG 590 Ca -0.35 0.00 -0.37 0.00 -1.26 0.00 0.00 59.98 58.00 1pwv h ARG 590 Cb 1.27 0.00 -0.22 0.00 -1.65 0.00 0.00 29.97 29.36 1pwv h ARG 590 CO 0.39 0.00 0.43 0.98 0.56 0.00 0.00 179.97 182.33 1pwv n TYR 591 N -3.28 2.57 0.00 3.04 9.36 -1.26 -4.29 117.16 123.29 1pwv n TYR 591 Ca 0.05 -1.60 0.00 0.00 3.32 0.00 0.00 57.90 59.67 1pwv n TYR 591 Cb 0.68 -0.79 0.00 0.00 -0.63 0.00 0.00 39.34 38.59 1pwv n TYR 591 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1pwv n ALA 592 N -0.84 0.00 -0.34 2.98 0.00 -0.53 -1.52 120.51 120.26 1pwv n ALA 592 Ca 0.50 0.00 0.24 0.00 0.00 0.00 0.00 53.44 54.17 1pwv n ALA 592 Cb 1.49 0.21 0.50 0.00 0.00 0.00 0.00 19.45 21.65 1pwv n ALA 592 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1pwv h SER 593 N 0.00 0.46 0.00 0.00 4.64 -1.59 -1.71 113.55 115.35 1pwv h SER 593 Ca 0.00 0.10 0.01 0.00 -0.47 0.00 0.00 61.79 61.43 1pwv h SER 593 Cb 0.00 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1pwv h SER 593 CO 0.00 0.05 -0.06 -1.13 -0.87 0.00 0.00 176.83 174.82 1pwv h ASN 594 N 0.38 -0.16 -0.86 4.97 -0.73 -1.34 -1.77 115.58 116.08 1pwv h ASN 594 Ca 0.63 0.03 0.21 0.00 1.87 0.00 0.00 56.30 59.04 1pwv h ASN 594 Cb 1.59 0.07 -0.15 0.00 0.27 0.00 0.00 38.32 40.09 1pwv h ASN 594 CO -0.35 -0.08 -0.01 0.40 -0.37 0.00 0.00 177.43 177.01 1pwv h ILE 595 N -0.10 0.20 0.26 2.57 1.08 -1.26 -0.03 117.51 120.22 1pwv h ILE 595 Ca 0.02 -0.02 -0.01 0.00 -0.39 0.00 0.00 64.86 64.46 1pwv h ILE 595 Cb 0.13 0.13 0.00 0.00 -3.07 0.00 0.00 36.82 34.01 1pwv h ILE 595 CO -0.06 0.01 -0.12 0.58 -0.69 0.00 0.00 178.15 177.87 1pwv h VAL 596 N 0.06 0.78 0.00 1.67 2.07 -1.47 -2.85 116.25 116.51 1pwv h VAL 596 Ca 0.48 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.80 1pwv h VAL 596 Cb 0.89 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1pwv h VAL 596 CO -0.79 0.05 0.00 -0.33 0.02 0.00 0.00 177.57 176.52 1pwv h GLU 597 N -0.45 0.00 0.00 1.57 4.39 -0.31 -2.61 114.58 117.16 1pwv h GLU 597 Ca -0.04 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.60 1pwv h GLU 597 Cb 0.34 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 1pwv h GLU 597 CO 0.06 0.00 -1.19 -1.13 -1.16 0.00 0.00 179.01 175.59 1pwv n SER 598 N -2.62 0.84 -0.19 1.42 3.41 -0.17 -3.88 113.62 112.43 1pwv n SER 598 Ca 0.01 0.34 -0.07 0.00 -0.26 0.00 0.00 58.87 58.89 1pwv n SER 598 Cb 0.21 0.36 0.03 0.00 -0.26 0.00 0.00 64.21 64.55 1pwv n SER 598 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pwv h ALA 599 N 1.77 0.71 0.54 7.33 0.00 -1.22 0.31 119.26 128.69 1pwv h ALA 599 Ca -0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1pwv h ALA 599 Cb 1.24 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1pwv h ALA 599 CO 0.02 0.21 -0.44 1.88 0.00 0.00 0.00 179.25 180.91 1pwv h TYR 600 N 0.75 -1.19 -0.88 0.00 -1.99 -1.69 -1.56 116.97 110.41 1pwv h TYR 600 Ca 0.20 0.00 0.10 0.00 2.00 0.00 0.00 58.73 61.03 1pwv h TYR 600 Cb 0.01 0.45 -0.08 0.00 2.00 0.00 0.00 36.73 39.11 1pwv h TYR 600 CO -0.02 -0.62 0.52 -0.07 -0.00 0.00 0.00 178.16 177.97 1pwv h LEU 601 N -0.96 0.74 -0.64 3.88 3.38 -1.61 -0.34 115.31 119.77 1pwv h LEU 601 Ca -0.06 0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1pwv h LEU 601 Cb 0.82 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.43 1pwv h LEU 601 CO -0.01 0.41 0.38 0.40 0.09 0.00 0.00 178.44 179.71 1pwv h ILE 602 N 0.85 1.05 -0.40 1.22 2.04 -0.14 -1.53 117.51 120.58 1pwv h ILE 602 Ca 0.43 -0.25 -0.16 0.00 1.00 0.00 0.00 64.86 65.88 1pwv h ILE 602 Cb 0.41 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1pwv h ILE 602 CO -0.26 0.14 -0.36 -0.07 0.00 0.00 0.00 178.15 177.59 1pwv h LEU 603 N 0.74 1.01 -1.22 1.44 3.38 -0.15 -1.19 115.31 119.32 1pwv h LEU 603 Ca 0.27 -0.45 0.03 0.00 0.09 0.00 0.00 57.88 57.81 1pwv h LEU 603 Cb 0.07 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 1pwv h LEU 603 CO -0.13 1.26 0.54 0.78 0.09 0.00 0.00 178.44 180.98 1pwv h ASN 604 N 0.78 0.87 0.52 -0.43 2.35 -0.86 0.15 115.58 118.97 1pwv h ASN 604 Ca 0.07 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.78 1pwv h ASN 604 Cb 0.96 -0.20 0.01 0.00 0.05 0.00 0.00 38.32 39.13 1pwv h ASN 604 CO 0.09 0.60 -0.25 -0.33 -1.65 0.00 0.00 177.43 175.89 1pwv h GLU 605 N 1.01 -0.67 -0.96 0.81 4.39 -0.96 -0.86 114.58 117.35 1pwv h GLU 605 Ca 0.32 0.05 0.29 0.00 0.34 0.00 0.00 59.36 60.35 1pwv h GLU 605 Cb 0.02 0.15 -0.15 0.00 -0.10 0.00 0.00 28.75 28.68 1pwv h GLU 605 CO -0.09 -0.41 0.44 2.35 -1.16 0.00 0.00 179.01 180.14 1pwv h TRP 606 N -0.79 0.71 0.50 4.33 7.01 -0.53 -1.74 115.95 125.44 1pwv h TRP 606 Ca -0.07 0.04 -0.02 0.00 2.11 0.00 0.00 58.89 60.95 1pwv h TRP 606 Cb 0.57 -0.16 0.00 0.00 -2.10 0.00 0.00 29.16 27.48 1pwv h TRP 606 CO -0.02 -0.18 -0.24 -0.22 -2.79 0.00 0.00 178.44 174.98 1pwv h LYS 607 N 0.29 -0.65 0.00 2.65 3.64 -0.50 -3.02 116.57 118.98 1pwv h LYS 607 Ca 0.66 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 60.09 1pwv h LYS 607 Cb 1.45 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.42 1pwv h LYS 607 CO -0.63 -0.38 0.00 0.09 -2.27 0.00 0.00 179.45 176.27 1pwv n ASN 608 N -5.24 0.00 0.00 4.20 5.03 -0.35 -2.67 115.26 116.23 1pwv n ASN 608 Ca -0.10 -0.44 0.00 0.00 0.87 0.00 0.00 54.58 54.91 1pwv n ASN 608 Cb 0.30 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.06 1pwv n ASN 608 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1pwv n ASN 609 N -0.91 2.65 -4.39 6.41 4.13 -0.91 -5.06 115.26 117.18 1pwv n ASN 609 Ca 0.07 -0.19 -0.25 0.00 1.68 0.00 0.00 54.58 55.89 1pwv n ASN 609 Cb 0.03 0.92 -0.11 0.00 -1.54 0.00 0.00 39.78 39.08 1pwv n ASN 609 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1pwv s ILE 610 N -1.45 2.17 -0.22 2.41 1.01 -1.09 -4.78 121.20 119.26 1pwv s ILE 610 Ca 0.00 -2.02 -0.29 0.00 0.00 0.00 0.00 60.65 58.35 1pwv s ILE 610 Cb 0.00 -2.04 -0.04 0.00 0.01 0.00 0.00 42.46 40.39 1pwv s ILE 610 CO 0.00 -0.21 1.98 -1.10 0.00 0.00 0.00 174.94 175.61 1pwv s GLN 611 N -2.77 3.42 0.25 2.79 -0.21 -1.26 -4.85 119.66 117.03 1pwv s GLN 611 Ca 0.20 1.88 0.09 0.00 0.02 0.00 0.00 55.36 57.55 1pwv s GLN 611 Cb -0.07 -4.24 0.80 0.00 1.00 0.00 0.00 33.01 30.50 1pwv s GLN 611 CO 0.09 -1.76 1.17 0.45 -2.12 0.00 0.00 175.29 173.12 1pwv n SER 612 N 10.27 0.10 0.23 5.90 2.88 -1.26 0.16 113.62 131.89 1pwv n SER 612 Ca 0.25 1.25 0.12 0.00 -1.33 0.00 0.00 58.87 59.16 1pwv n SER 612 Cb 0.45 -0.54 0.39 0.00 -0.75 0.00 0.00 64.21 63.76 1pwv n SER 612 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1pwv h ASP 613 N 0.00 0.00 0.25 -3.46 3.32 -2.00 -2.03 116.42 112.51 1pwv h ASP 613 Ca 0.55 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 57.29 1pwv h ASP 613 Cb 1.33 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.91 1pwv h ASP 613 CO -0.63 0.12 -1.32 0.25 -1.72 0.00 0.00 179.24 175.94 1pwv h LEU 614 N 0.00 0.80 0.42 1.55 5.85 0.11 -2.67 115.31 121.37 1pwv h LEU 614 Ca -0.00 -0.79 -0.01 0.00 0.84 0.00 0.00 57.88 57.92 1pwv h LEU 614 Cb 0.83 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1pwv h LEU 614 CO 0.02 1.60 -0.27 0.40 -0.34 0.00 0.00 178.44 179.85 1pwv h ILE 615 N 0.20 0.45 -0.33 4.05 2.04 -1.16 -1.74 117.51 121.03 1pwv h ILE 615 Ca -0.20 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 1pwv h ILE 615 Cb 2.00 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 38.52 1pwv h ILE 615 CO 0.25 0.00 0.19 0.11 0.00 0.00 0.00 178.15 178.69 1pwv h LYS 616 N -0.66 0.46 -0.10 2.37 1.57 -1.46 0.18 116.57 118.93 1pwv h LYS 616 Ca -0.05 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1pwv h LYS 616 Cb 0.55 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1pwv h LYS 616 CO 0.04 0.37 0.04 0.87 -0.57 0.00 0.00 179.45 180.20 1pwv h LYS 617 N 0.42 0.09 -0.10 3.15 1.79 -1.43 -1.42 116.57 119.07 1pwv h LYS 617 Ca 0.12 -0.01 -0.05 0.00 -2.18 0.00 0.00 60.65 58.53 1pwv h LYS 617 Cb 0.04 -0.02 -0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1pwv h LYS 617 CO -0.02 0.06 -0.15 0.28 -1.08 0.00 0.00 179.45 178.54 1pwv h VAL 618 N 0.09 1.38 -0.90 0.50 2.07 -1.25 -2.84 116.25 115.31 1pwv h VAL 618 Ca 0.04 -1.39 0.11 0.00 0.82 0.00 0.00 66.70 66.28 1pwv h VAL 618 Cb 0.01 2.07 -0.08 0.00 -1.52 0.00 0.00 31.29 31.77 1pwv h VAL 618 CO -0.04 0.40 0.53 0.00 0.02 0.00 0.00 177.57 178.48 1pwv h THR 619 N -0.17 0.89 -0.73 2.57 1.03 -0.61 -0.56 112.91 115.33 1pwv h THR 619 Ca 0.01 -0.29 -0.04 0.00 -0.01 0.00 0.00 66.41 66.07 1pwv h THR 619 Cb 0.71 -0.03 -0.03 0.00 -1.07 0.00 0.00 68.15 67.72 1pwv h THR 619 CO 0.03 0.15 0.28 0.78 -0.01 0.00 0.00 175.52 176.76 1pwv h ASN 620 N 0.84 1.02 -0.67 0.00 2.35 -1.26 -0.85 115.58 117.03 1pwv h ASN 620 Ca 0.45 -0.18 0.06 0.00 -0.55 0.00 0.00 56.30 56.07 1pwv h ASN 620 Cb 0.46 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.51 1pwv h ASN 620 CO -0.27 0.92 0.37 0.22 -1.65 0.00 0.00 177.43 177.03 1pwv h TYR 621 N 1.06 0.69 0.10 1.19 3.20 -0.89 0.73 116.97 123.05 1pwv h TYR 621 Ca 0.24 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 1pwv h TYR 621 Cb 0.23 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.29 1pwv h TYR 621 CO 0.02 0.34 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.75 1pwv h LEU 622 N 0.70 -0.12 -0.80 2.82 3.38 -0.66 -2.97 115.31 117.65 1pwv h LEU 622 Ca 0.30 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.14 1pwv h LEU 622 Cb 0.17 0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 1pwv h LEU 622 CO -0.17 0.12 0.49 0.58 0.09 0.00 0.00 178.44 179.54 1pwv h VAL 623 N -0.36 1.02 -0.26 1.22 2.07 -0.84 0.25 116.25 119.35 1pwv h VAL 623 Ca -0.01 -0.30 0.08 0.00 0.82 0.00 0.00 66.70 67.28 1pwv h VAL 623 Cb 0.30 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 1pwv h VAL 623 CO 0.02 0.16 0.29 -0.78 0.02 0.00 0.00 177.57 177.29 1pwv h ASP 624 N 0.89 0.00 -0.45 0.57 3.58 -0.71 0.40 116.42 120.70 1pwv h ASP 624 Ca 0.35 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.76 1pwv h ASP 624 Cb 0.18 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.20 1pwv h ASP 624 CO -0.18 0.00 0.04 0.61 -2.88 0.00 0.00 179.24 176.83 1pwv n GLY 625 N -1.43 3.67 2.55 -0.78 0.00 0.32 -4.92 105.19 104.61 1pwv n GLY 625 Ca 0.04 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 1pwv n GLY 625 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1pwv n ASN 626 N -0.10 -4.95 -4.28 1.61 4.13 0.14 -4.66 115.26 107.14 1pwv n ASN 626 Ca 0.27 0.22 -0.33 0.00 1.68 0.00 0.00 54.58 56.43 1pwv n ASN 626 Cb 1.09 -3.25 0.14 0.00 -1.54 0.00 0.00 39.78 36.22 1pwv n ASN 626 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1pwv n GLY 627 N -0.73 -2.49 3.26 7.41 0.00 0.61 -4.94 105.19 108.31 1pwv n GLY 627 Ca -0.09 -0.73 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 1pwv n GLY 627 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pwv s ARG 628 N -3.34 0.70 -0.47 1.61 1.81 -1.15 -4.70 118.95 113.41 1pwv s ARG 628 Ca 0.54 -0.18 -0.10 0.00 -1.72 0.00 0.00 55.73 54.27 1pwv s ARG 628 Cb -0.13 0.31 0.11 0.00 -0.45 0.00 0.00 34.95 34.79 1pwv s ARG 628 CO 0.67 -0.20 0.35 -0.06 -0.68 0.00 0.00 175.30 175.39 1pwv s PHE 629 N -1.38 3.38 -0.34 -0.53 2.99 -0.67 0.16 117.98 121.59 1pwv s PHE 629 Ca -0.13 -1.71 -0.12 0.00 0.00 0.00 0.00 56.93 54.97 1pwv s PHE 629 Cb -0.05 -3.43 -0.01 0.00 0.00 0.00 0.00 43.02 39.53 1pwv s PHE 629 CO 0.04 -0.97 0.23 0.08 -0.00 0.00 0.00 175.22 174.61 1pwv s VAL 630 N 1.41 5.15 -0.35 -0.44 1.01 0.70 -1.16 120.40 126.72 1pwv s VAL 630 Ca 0.05 -0.30 -0.10 0.00 0.00 0.00 0.00 61.98 61.63 1pwv s VAL 630 Cb -0.26 -3.67 0.02 0.00 0.00 0.00 0.00 36.38 32.47 1pwv s VAL 630 CO 0.00 -0.03 0.18 -0.36 0.00 0.00 0.00 175.10 174.90 1pwv s PHE 631 N 1.70 3.22 0.20 5.22 0.40 -0.90 -0.58 117.98 127.24 1pwv s PHE 631 Ca 0.06 -0.88 -0.00 0.00 -0.60 0.00 0.00 56.93 55.50 1pwv s PHE 631 Cb -0.18 -2.40 -0.04 0.00 0.51 0.00 0.00 43.02 40.91 1pwv s PHE 631 CO 0.10 -0.60 0.09 -0.08 0.70 0.00 0.00 175.22 175.43 1pwv s THR 632 N 1.56 0.24 -0.10 0.64 -1.32 -0.88 -2.00 115.64 113.79 1pwv s THR 632 Ca 0.03 -1.98 0.14 0.00 -1.21 0.00 0.00 61.69 58.67 1pwv s THR 632 Cb -0.18 -2.40 0.22 0.00 -1.51 0.00 0.00 72.50 68.62 1pwv s THR 632 CO 0.06 -0.15 1.11 -0.90 -2.21 0.00 0.00 174.62 172.53 1pwv n ASP 633 N -0.28 2.17 -4.61 8.08 5.68 -1.21 -1.04 116.55 125.34 1pwv n ASP 633 Ca -0.01 -2.81 -0.31 0.00 -0.50 0.00 0.00 54.79 51.16 1pwv n ASP 633 Cb 0.65 -0.33 -0.10 0.00 -1.14 0.00 0.00 41.12 40.21 1pwv n ASP 633 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 1pwv s ILE 634 N -2.36 3.66 0.25 2.12 -4.36 -1.26 -4.66 121.20 114.58 1pwv s ILE 634 Ca 0.24 -0.94 -0.31 0.00 -0.26 0.00 0.00 60.65 59.38 1pwv s ILE 634 Cb 0.21 -2.65 -0.13 0.00 1.25 0.00 0.00 42.46 41.14 1pwv s ILE 634 CO 0.02 0.27 1.38 0.35 0.24 0.00 0.00 174.94 177.20 1pwv n THR 635 N 1.14 1.07 -0.37 8.37 -2.24 -0.99 -4.87 114.28 116.38 1pwv n THR 635 Ca -0.14 -0.27 0.29 0.00 -2.27 0.00 0.00 64.05 61.67 1pwv n THR 635 Cb 0.52 -1.46 0.58 0.00 -2.10 0.00 0.00 70.33 67.87 1pwv n THR 635 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1pwv h LEU 636 N 4.00 0.34 0.00 3.22 4.07 -1.86 -1.03 115.31 124.06 1pwv h LEU 636 Ca -0.45 0.10 0.00 0.00 0.08 0.00 0.00 57.88 57.61 1pwv h LEU 636 Cb 1.28 0.06 0.00 0.00 1.08 0.00 0.00 40.66 43.08 1pwv h LEU 636 CO 0.74 -0.03 0.00 -2.65 -1.08 0.00 0.00 178.44 175.42 1pwv n PRO 637 N -4.63 0.19 -0.16 1.13 -0.02 -1.24 -1.50 135.00 128.76 1pwv n PRO 637 Ca 0.30 0.00 0.06 0.00 -2.02 0.00 0.00 63.50 61.84 1pwv n PRO 637 Cb 1.12 -1.50 0.15 0.00 -0.02 0.00 0.00 33.50 33.25 1pwv n PRO 637 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1pwv n ASN 638 N -1.00 2.85 -4.68 2.55 3.02 -0.39 -4.57 115.26 113.04 1pwv n ASN 638 Ca 0.04 -1.92 -0.37 0.00 -0.03 0.00 0.00 54.58 52.30 1pwv n ASN 638 Cb 0.02 -0.21 -0.08 0.00 -0.61 0.00 0.00 39.78 38.90 1pwv n ASN 638 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1pwv s ILE 639 N -1.00 5.26 0.15 2.41 1.09 -0.56 -4.99 121.20 123.56 1pwv s ILE 639 Ca 0.23 0.56 -0.24 0.00 -1.10 0.00 0.00 60.65 60.11 1pwv s ILE 639 Cb 0.13 -3.66 0.03 0.00 -1.06 0.00 0.00 42.46 37.89 1pwv s ILE 639 CO 0.17 0.30 1.61 0.00 -0.10 0.00 0.00 174.94 176.91 1pwv h ALA 640 N 7.26 -0.24 0.00 9.38 0.00 -1.91 -1.36 119.26 132.39 1pwv h ALA 640 Ca -0.37 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1pwv h ALA 640 Cb 1.16 0.65 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1pwv h ALA 640 CO 0.71 -0.75 0.79 0.39 0.00 0.00 0.00 179.25 180.40 1pwv n GLU 641 N -5.41 0.02 -0.03 0.00 4.71 -1.26 -0.21 120.64 118.46 1pwv n GLU 641 Ca -0.01 0.66 -0.08 0.00 -0.01 0.00 0.00 57.16 57.72 1pwv n GLU 641 Cb 0.33 -2.17 -0.03 0.00 -1.01 0.00 0.00 31.44 28.56 1pwv n GLU 641 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1pwv n GLN 642 N -1.97 0.19 0.20 3.49 7.27 -0.57 -4.59 117.38 121.41 1pwv n GLN 642 Ca 0.00 0.08 0.05 0.00 0.07 0.00 0.00 57.00 57.20 1pwv n GLN 642 Cb 0.79 -0.82 0.43 0.00 2.41 0.00 0.00 30.24 33.06 1pwv n GLN 642 CO 0.00 0.00 0.00 0.10 0.07 0.00 0.00 177.06 177.23 1pwv h TYR 643 N -0.32 0.00 -0.71 3.69 -0.00 -0.53 -2.85 116.97 116.25 1pwv h TYR 643 Ca -0.17 0.00 0.04 0.00 0.00 0.00 0.00 58.73 58.59 1pwv h TYR 643 Cb 0.99 0.00 -0.04 0.00 0.00 0.00 0.00 36.73 37.68 1pwv h TYR 643 CO -0.06 0.31 0.47 1.15 -0.00 0.00 0.00 178.16 180.03 1pwv h THR 644 N 0.00 1.09 -0.80 -0.90 2.02 -0.83 -2.31 112.91 111.18 1pwv h THR 644 Ca -0.00 -0.29 -0.33 0.00 0.77 0.00 0.00 66.41 66.56 1pwv h THR 644 Cb 0.59 0.18 -0.20 0.00 -1.74 0.00 0.00 68.15 66.99 1pwv h THR 644 CO 0.04 0.15 0.39 1.41 0.37 0.00 0.00 175.52 177.89 1pwv n HIS 645 N -4.46 2.57 -3.27 3.16 8.25 -1.08 -4.98 115.22 115.42 1pwv n HIS 645 Ca 0.09 -1.48 -0.29 0.00 -0.26 0.00 0.00 57.72 55.78 1pwv n HIS 645 Cb 0.14 -0.77 -0.03 0.00 1.12 0.00 0.00 29.99 30.45 1pwv n HIS 645 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1pwv s GLN 646 N -3.13 3.64 -0.04 -0.41 -0.21 -0.87 -5.01 119.66 113.63 1pwv s GLN 646 Ca 0.55 0.05 -0.02 0.00 0.02 0.00 0.00 55.36 55.96 1pwv s GLN 646 Cb 0.45 -2.61 -0.01 0.00 1.00 0.00 0.00 33.01 31.84 1pwv s GLN 646 CO 0.11 0.17 -0.04 -0.44 -2.12 0.00 0.00 175.29 172.98 1pwv h ASP 647 N 1.56 0.00 -2.29 5.90 3.32 -1.92 -3.48 116.42 119.50 1pwv h ASP 647 Ca -0.48 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.03 1pwv h ASP 647 Cb 1.19 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.66 1pwv h ASP 647 CO 0.66 0.19 -0.60 -1.61 -1.72 0.00 0.00 179.24 176.16 1pwv s GLU 648 N -1.30 2.58 0.10 3.56 0.41 -1.26 -5.04 118.70 117.76 1pwv s GLU 648 Ca -0.03 -1.22 -0.14 0.00 -0.41 0.00 0.00 54.97 53.18 1pwv s GLU 648 Cb 0.00 -2.36 -0.12 0.00 -1.78 0.00 0.00 34.13 29.87 1pwv s GLU 648 CO 0.05 0.39 1.35 0.82 -0.49 0.00 0.00 175.26 177.38 1pwv h ILE 649 N 1.80 1.30 0.00 -1.63 2.04 -1.93 -2.89 117.51 116.20 1pwv h ILE 649 Ca -0.46 -1.76 0.00 0.00 1.00 0.00 0.00 64.86 63.64 1pwv h ILE 649 Cb 1.24 1.81 0.00 0.00 -0.74 0.00 0.00 36.82 39.13 1pwv h ILE 649 CO 0.60 0.56 0.00 0.00 0.00 0.00 0.00 178.15 179.31 1pwv n TYR 650 N -4.08 0.00 -1.28 1.37 4.11 -1.26 -1.60 117.16 114.42 1pwv n TYR 650 Ca -0.06 0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 57.64 1pwv n TYR 650 Cb 0.63 -0.02 0.18 0.00 -0.00 0.00 0.00 39.34 40.13 1pwv n TYR 650 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 1pwv n GLU 651 N -1.02 2.17 -2.97 -3.48 1.02 -1.09 -4.66 120.64 110.60 1pwv n GLU 651 Ca 0.02 -3.06 -0.28 0.00 -0.02 0.00 0.00 57.16 53.83 1pwv n GLU 651 Cb 0.01 -2.11 -0.02 0.00 -0.02 0.00 0.00 31.44 29.31 1pwv n GLU 651 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 1pwv s GLN 652 N -3.30 3.62 -0.03 3.49 -2.07 -0.63 -4.95 119.66 115.79 1pwv s GLN 652 Ca 0.54 0.14 0.03 0.00 -1.82 0.00 0.00 55.36 54.25 1pwv s GLN 652 Cb 0.47 -2.49 0.01 0.00 -1.09 0.00 0.00 33.01 29.90 1pwv s GLN 652 CO 0.08 -0.01 -0.10 0.14 -1.32 0.00 0.00 175.29 174.09 1pwv s VAL 653 N -2.42 0.88 -0.12 3.63 -7.23 -1.26 -5.05 120.40 108.83 1pwv s VAL 653 Ca 0.46 -0.39 0.03 0.00 -1.81 0.00 0.00 61.98 60.27 1pwv s VAL 653 Cb -0.10 -0.79 0.00 0.00 0.56 0.00 0.00 36.38 36.05 1pwv s VAL 653 CO 0.36 0.28 -0.22 -2.28 -0.31 0.00 0.00 175.10 172.94 1pwv s HIS 654 N 0.31 2.64 0.15 2.82 5.04 -1.26 -3.63 115.29 121.37 1pwv s HIS 654 Ca -0.06 -1.15 -0.07 0.00 -1.54 0.00 0.00 55.06 52.24 1pwv s HIS 654 Cb -0.11 -1.78 0.03 0.00 0.04 0.00 0.00 32.58 30.76 1pwv s HIS 654 CO 0.01 -0.49 0.37 -1.13 -2.34 0.00 0.00 174.74 171.16 1pwv n SER 655 N 3.80 -0.94 0.07 9.88 3.41 -1.26 -5.02 113.62 123.56 1pwv n SER 655 Ca -0.19 -1.62 -0.13 0.00 -0.26 0.00 0.00 58.87 56.67 1pwv n SER 655 Cb 0.52 1.56 -0.04 0.00 -0.26 0.00 0.00 64.21 65.99 1pwv n SER 655 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1pwv h LYS 656 N 0.00 0.40 -3.99 4.33 3.11 -1.93 -3.39 116.57 115.10 1pwv h LYS 656 Ca -0.14 -0.43 -0.11 0.00 -2.81 0.00 0.00 60.65 57.16 1pwv h LYS 656 Cb 0.53 0.12 -0.15 0.00 -1.00 0.00 0.00 32.23 31.73 1pwv h LYS 656 CO 0.18 1.10 -0.54 0.20 -2.81 0.00 0.00 179.45 177.58 1pwv s GLY 657 N -4.42 0.27 -0.27 5.01 0.00 -1.26 -0.69 107.32 105.96 1pwv s GLY 657 Ca -0.06 -0.85 -0.25 0.00 0.00 0.00 0.00 44.72 43.57 1pwv s GLY 657 CO 0.87 -0.99 0.78 -2.27 0.00 0.00 0.00 173.10 171.49 1pwv s LEU 658 N -2.69 -0.70 -0.13 0.66 0.20 -0.51 -5.00 118.68 110.51 1pwv s LEU 658 Ca 0.03 1.33 -0.00 0.00 0.69 0.00 0.00 54.13 56.18 1pwv s LEU 658 Cb 0.05 2.34 -0.01 0.00 -0.43 0.00 0.00 46.19 48.13 1pwv s LEU 658 CO -0.09 -0.23 -0.13 -0.47 -0.29 0.00 0.00 176.35 175.14 1pwv s TYR 659 N 0.41 2.81 -0.32 5.38 5.04 -1.26 -0.90 117.35 128.52 1pwv s TYR 659 Ca 0.00 -0.64 0.01 0.00 -2.44 0.00 0.00 57.07 54.00 1pwv s TYR 659 Cb -0.05 -1.85 0.08 0.00 0.35 0.00 0.00 41.96 40.49 1pwv s TYR 659 CO -0.01 -0.21 0.01 0.08 -1.34 0.00 0.00 175.55 174.08 1pwv s VAL 660 N 0.35 2.62 0.08 3.14 1.01 -0.69 -5.00 120.40 121.92 1pwv s VAL 660 Ca -0.11 -1.82 -0.36 0.00 0.00 0.00 0.00 61.98 59.69 1pwv s VAL 660 Cb -0.16 -2.67 -0.18 0.00 0.00 0.00 0.00 36.38 33.37 1pwv s VAL 660 CO 0.06 -0.31 1.57 -0.65 0.00 0.00 0.00 175.10 175.77 1pwv h PRO 661 N 7.84 -1.03 -1.68 2.72 0.11 -1.95 0.40 132.00 138.41 1pwv h PRO 661 Ca -0.15 0.07 0.49 0.00 0.11 0.00 0.00 66.00 66.52 1pwv h PRO 661 Cb 1.04 0.23 -0.07 0.00 0.11 0.00 0.00 31.00 32.32 1pwv h PRO 661 CO 0.53 -0.69 1.26 0.93 -0.21 0.00 0.00 178.00 179.82 1pwv h GLU 662 N -1.07 0.00 0.00 1.05 3.07 -1.94 0.85 114.58 116.54 1pwv h GLU 662 Ca -0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.79 1pwv h GLU 662 Cb 0.90 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.81 1pwv h GLU 662 CO -0.02 0.00 -0.88 -1.13 -1.40 0.00 0.00 179.01 175.58 1pwv n SER 663 N -3.92 1.11 -3.66 1.42 3.41 -1.02 -4.99 113.62 105.97 1pwv n SER 663 Ca 0.37 -0.52 -0.25 0.00 -0.26 0.00 0.00 58.87 58.22 1pwv n SER 663 Cb 1.77 1.18 0.07 0.00 -0.26 0.00 0.00 64.21 66.97 1pwv n SER 663 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1pwv n ARG 664 N -1.49 -7.18 -4.31 4.33 1.74 0.30 -3.27 116.66 106.77 1pwv n ARG 664 Ca 0.01 0.77 -0.21 0.00 -0.77 0.00 0.00 57.85 57.64 1pwv n ARG 664 Cb 0.23 -5.77 -0.11 0.00 -1.02 0.00 0.00 32.46 25.79 1pwv n ARG 664 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1pwv s SER 665 N -3.45 2.54 -0.17 0.55 0.01 -1.00 -2.93 113.70 109.25 1pwv s SER 665 Ca 0.53 -0.84 -0.01 0.00 1.31 0.00 0.00 55.95 56.94 1pwv s SER 665 Cb -0.24 -0.14 -0.01 0.00 0.21 0.00 0.00 66.02 65.84 1pwv s SER 665 CO 0.76 -0.05 -0.10 -0.63 0.41 0.00 0.00 173.24 173.63 1pwv s ILE 666 N -1.99 3.11 -0.10 1.44 1.01 0.12 -1.70 121.20 123.09 1pwv s ILE 666 Ca 0.14 -0.61 -0.00 0.00 0.00 0.00 0.00 60.65 60.17 1pwv s ILE 666 Cb -0.06 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.04 1pwv s ILE 666 CO 0.06 0.49 -0.07 -0.76 0.00 0.00 0.00 174.94 174.65 1pwv s LEU 667 N 0.82 3.10 -0.18 2.97 1.43 -0.08 -0.22 118.68 126.51 1pwv s LEU 667 Ca -0.03 -0.11 -0.02 0.00 -1.03 0.00 0.00 54.13 52.94 1pwv s LEU 667 Cb -0.15 -1.70 0.05 0.00 0.03 0.00 0.00 46.19 44.43 1pwv s LEU 667 CO 0.01 0.28 0.01 -0.22 0.23 0.00 0.00 176.35 176.65 1pwv s LEU 668 N -0.29 1.39 -0.43 1.79 2.96 0.25 -1.42 118.68 122.92 1pwv s LEU 668 Ca 0.04 -0.78 -0.24 0.00 -0.22 0.00 0.00 54.13 52.93 1pwv s LEU 668 Cb -0.13 -0.71 0.02 0.00 0.50 0.00 0.00 46.19 45.87 1pwv s LEU 668 CO 0.02 -0.27 0.86 -2.28 -1.32 0.00 0.00 176.35 173.37 1pwv s HIS 669 N 1.77 2.99 0.12 5.38 5.65 0.13 -2.06 115.29 129.27 1pwv s HIS 669 Ca -0.01 0.40 -0.12 0.00 0.25 0.00 0.00 55.06 55.58 1pwv s HIS 669 Cb -0.17 -3.74 -0.09 0.00 -1.18 0.00 0.00 32.58 27.40 1pwv s HIS 669 CO -0.07 -0.97 1.40 0.78 -0.65 0.00 0.00 174.74 175.23 1pwv h GLY 670 N 10.24 0.94 1.90 1.59 0.00 -1.38 -3.33 103.07 113.03 1pwv h GLY 670 Ca -0.24 -1.09 0.00 0.00 0.00 0.00 0.00 47.33 45.99 1pwv h GLY 670 CO 0.98 0.98 0.04 -2.55 0.00 0.00 0.00 176.54 175.99 1pwv h PRO 671 N 0.64 0.00 0.00 4.80 0.11 -1.79 -3.45 132.00 132.31 1pwv h PRO 671 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1pwv h PRO 671 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1pwv h PRO 671 CO 0.12 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.78 1pwv n SER 672 N -2.58 0.00 -3.86 -2.05 3.41 -1.25 -2.03 113.62 105.25 1pwv n SER 672 Ca -0.02 -0.98 -0.27 0.00 -0.26 0.00 0.00 58.87 57.33 1pwv n SER 672 Cb 0.09 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 63.87 1pwv n SER 672 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1pwv s LYS 673 N -2.26 1.28 0.38 4.33 2.47 -1.26 -3.84 119.74 120.85 1pwv s LYS 673 Ca 0.00 -0.42 -0.27 0.00 -1.56 0.00 0.00 55.97 53.72 1pwv s LYS 673 Cb 0.00 -1.87 -0.09 0.00 -1.46 0.00 0.00 37.83 34.41 1pwv s LYS 673 CO 0.00 -0.42 1.30 0.20 0.16 0.00 0.00 175.35 176.59 1pwv s GLY 674 N 1.70 2.94 -0.78 5.54 0.00 -1.26 -4.76 107.32 110.70 1pwv s GLY 674 Ca 0.01 1.23 -0.24 0.00 0.00 0.00 0.00 44.72 45.73 1pwv s GLY 674 CO -0.08 1.83 2.43 1.55 0.00 0.00 0.00 173.10 178.84 1pwv n VAL 675 N 0.32 -0.03 -3.85 1.40 3.14 -1.26 -2.08 118.33 115.97 1pwv n VAL 675 Ca 0.03 -0.49 -0.32 0.00 -2.96 0.00 0.00 64.34 60.59 1pwv n VAL 675 Cb 0.43 -1.57 0.01 0.00 -1.06 0.00 0.00 33.84 31.65 1pwv n VAL 675 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1pwv n GLU 676 N 8.19 -1.03 -4.41 1.45 -0.58 -1.26 -4.98 120.64 118.02 1pwv n GLU 676 Ca 0.52 0.52 -0.34 0.00 -0.42 0.00 0.00 57.16 57.44 1pwv n GLU 676 Cb 0.33 -2.68 -0.13 0.00 -0.57 0.00 0.00 31.44 28.39 1pwv n GLU 676 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1pwv s LEU 677 N -5.96 3.15 0.25 -4.62 1.43 -0.88 -5.00 118.68 107.05 1pwv s LEU 677 Ca 0.22 -0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 53.11 1pwv s LEU 677 Cb -0.11 -1.76 0.43 0.00 0.03 0.00 0.00 46.19 44.78 1pwv s LEU 677 CO 0.92 0.15 1.79 0.03 0.23 0.00 0.00 176.35 179.47 1pwv h ARG 678 N 6.82 0.68 0.00 1.70 2.47 -1.93 -3.44 114.38 120.68 1pwv h ARG 678 Ca -0.31 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.34 1pwv h ARG 678 Cb 1.19 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.36 1pwv h ARG 678 CO 0.61 0.45 0.12 0.27 0.56 0.00 0.00 179.97 181.98 1pwv n ASN 679 N -4.80 -1.08 0.00 7.04 2.04 -1.26 -5.06 115.26 112.15 1pwv n ASN 679 Ca 0.14 -1.79 -0.06 0.00 -0.44 0.00 0.00 54.58 52.44 1pwv n ASN 679 Cb 0.32 1.80 0.13 0.00 -2.53 0.00 0.00 39.78 39.51 1pwv n ASN 679 CO 0.00 0.00 0.00 0.44 -0.44 0.00 0.00 177.26 177.26 1pwv h ASP 680 N 0.96 0.54 -0.51 0.53 3.45 -1.99 -3.19 116.42 116.21 1pwv h ASP 680 Ca -0.16 -0.23 0.09 0.00 0.43 0.00 0.00 57.03 57.16 1pwv h ASP 680 Cb 0.60 -0.15 -0.10 0.00 -0.56 0.00 0.00 39.33 39.11 1pwv h ASP 680 CO 0.20 0.87 -0.36 0.28 -1.57 0.00 0.00 179.24 178.66 1pwv h SER 681 N 0.44 -1.24 0.09 6.45 0.02 -1.95 -0.31 113.55 117.05 1pwv h SER 681 Ca 0.04 0.22 0.02 0.00 -0.84 0.00 0.00 61.79 61.23 1pwv h SER 681 Cb 0.85 0.58 -0.04 0.00 0.14 0.00 0.00 62.40 63.93 1pwv h SER 681 CO 0.07 -0.32 -0.28 -0.33 -1.14 0.00 0.00 176.83 174.83 1pwv h GLU 682 N -0.22 -0.46 -0.99 3.45 5.08 -1.95 -1.48 114.58 118.01 1pwv h GLU 682 Ca 0.19 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.73 1pwv h GLU 682 Cb 0.56 0.10 -0.09 0.00 0.50 0.00 0.00 28.75 29.82 1pwv h GLU 682 CO -0.63 -0.30 0.62 0.78 -1.00 0.00 0.00 179.01 178.48 1pwv h GLY 683 N -0.47 1.63 0.86 -3.84 0.00 -1.37 0.18 103.07 100.05 1pwv h GLY 683 Ca 0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 1pwv h GLY 683 CO -0.18 0.09 -0.06 -2.75 0.00 0.00 0.00 176.54 173.64 1pwv h PHE 684 N 0.89 -0.16 -0.85 5.60 3.57 -0.51 -2.06 116.94 123.42 1pwv h PHE 684 Ca 0.51 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 62.05 1pwv h PHE 684 Cb 0.64 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.38 1pwv h PHE 684 CO -0.00 0.02 0.54 0.82 -2.23 0.00 0.00 178.31 177.46 1pwv h ILE 685 N -0.32 1.13 -1.00 1.41 2.04 -0.30 0.57 117.51 121.03 1pwv h ILE 685 Ca -0.02 -0.36 0.17 0.00 1.00 0.00 0.00 64.86 65.65 1pwv h ILE 685 Cb 0.26 -0.02 -0.10 0.00 -0.74 0.00 0.00 36.82 36.22 1pwv h ILE 685 CO 0.03 0.19 0.62 -0.74 0.00 0.00 0.00 178.15 178.25 1pwv h HIS 686 N 1.05 1.09 -0.23 1.37 2.76 -0.38 0.21 115.15 121.02 1pwv h HIS 686 Ca 0.34 0.03 -0.17 0.00 -2.20 0.00 0.00 60.37 58.37 1pwv h HIS 686 Cb 0.02 -0.34 -0.00 0.00 1.55 0.00 0.00 27.41 28.65 1pwv h HIS 686 CO -0.02 0.31 -0.56 0.93 -1.30 0.00 0.00 177.93 177.29 1pwv h GLU 687 N 0.84 0.71 0.00 5.26 4.39 -0.26 -2.20 114.58 123.33 1pwv h GLU 687 Ca 0.55 -0.46 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1pwv h GLU 687 Cb 0.77 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 1pwv h GLU 687 CO -0.34 1.08 0.00 0.35 -1.16 0.00 0.00 179.01 178.94 1pwv h PHE 688 N 0.55 0.00 -0.01 4.33 3.57 0.11 0.10 116.94 125.59 1pwv h PHE 688 Ca 0.01 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 1pwv h PHE 688 Cb 1.13 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.87 1pwv h PHE 688 CO 0.06 0.00 -0.01 0.78 -2.23 0.00 0.00 178.31 176.91 1pwv h GLY 689 N 0.45 0.02 1.63 2.40 0.00 -0.25 -0.18 103.07 107.15 1pwv h GLY 689 Ca 0.00 -0.02 0.05 0.00 0.00 0.00 0.00 47.33 47.36 1pwv h GLY 689 CO 0.00 0.02 0.14 0.45 0.00 0.00 0.00 176.54 177.15 1pwv h HIS 690 N -0.47 0.00 -0.06 5.60 3.86 -0.75 0.16 115.15 123.50 1pwv h HIS 690 Ca 0.00 0.00 -0.24 0.00 -1.16 0.00 0.00 60.37 58.97 1pwv h HIS 690 Cb 0.50 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.98 1pwv h HIS 690 CO 0.09 0.00 -0.92 0.00 0.86 0.00 0.00 177.93 177.96 1pwv h ALA 691 N 1.87 0.26 -0.43 2.45 0.00 -0.96 -1.22 119.26 121.23 1pwv h ALA 691 Ca 0.08 -0.66 -0.06 0.00 0.00 0.00 0.00 54.91 54.26 1pwv h ALA 691 Cb 0.35 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1pwv h ALA 691 CO -0.00 0.71 0.03 0.28 0.00 0.00 0.00 179.25 180.27 1pwv h VAL 692 N 0.41 1.25 -0.93 0.00 2.07 0.84 -1.37 116.25 118.52 1pwv h VAL 692 Ca -0.09 -0.97 0.08 0.00 0.82 0.00 0.00 66.70 66.54 1pwv h VAL 692 Cb 1.56 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 32.31 1pwv h VAL 692 CO 0.18 0.33 0.58 -0.78 0.02 0.00 0.00 177.57 177.90 1pwv h ASP 693 N 0.58 0.90 0.62 0.57 -0.00 -0.73 -1.77 116.42 116.59 1pwv h ASP 693 Ca 0.12 0.02 -0.09 0.00 -0.00 0.00 0.00 57.03 57.09 1pwv h ASP 693 Cb 0.44 -0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 39.59 1pwv h ASP 693 CO 0.02 0.55 -0.44 -0.78 -0.00 0.00 0.00 179.24 178.59 1pwv h ASP 694 N 1.02 0.00 0.05 2.28 3.58 -0.52 -2.74 116.42 120.08 1pwv h ASP 694 Ca 0.42 0.00 -0.19 0.00 0.42 0.00 0.00 57.03 57.68 1pwv h ASP 694 Cb 0.26 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 1pwv h ASP 694 CO -0.20 0.44 -0.99 0.22 -2.88 0.00 0.00 179.24 175.82 1pwv h TYR 695 N 0.00 0.19 -0.41 0.28 3.20 -0.85 -3.27 116.97 116.12 1pwv h TYR 695 Ca -0.00 -0.14 0.07 0.00 3.14 0.00 0.00 58.73 61.80 1pwv h TYR 695 Cb 0.86 -0.01 -0.06 0.00 1.54 0.00 0.00 36.73 39.07 1pwv h TYR 695 CO 0.00 1.39 0.05 0.00 -1.64 0.00 0.00 178.16 177.96 1pwv h ALA 696 N -0.18 0.42 -0.82 1.82 0.00 -1.42 0.53 119.26 119.60 1pwv h ALA 696 Ca -0.24 0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.82 1pwv h ALA 696 Cb 1.42 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.30 1pwv h ALA 696 CO -0.04 -0.35 0.54 0.78 0.00 0.00 0.00 179.25 180.18 1pwv h GLY 697 N 0.17 1.16 0.87 0.00 0.00 -1.61 -1.60 103.07 102.05 1pwv h GLY 697 Ca 0.20 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.12 1pwv h GLY 697 CO -0.29 0.29 0.02 -1.82 0.00 0.00 0.00 176.54 174.73 1pwv h TYR 698 N 0.93 0.51 -0.49 5.60 5.03 -1.17 -2.80 116.97 124.58 1pwv h TYR 698 Ca 0.35 -0.08 0.02 0.00 2.58 0.00 0.00 58.73 61.59 1pwv h TYR 698 Cb 0.18 -0.13 -0.03 0.00 1.55 0.00 0.00 36.73 38.30 1pwv h TYR 698 CO -0.00 0.60 0.32 -0.07 -1.32 0.00 0.00 178.16 177.69 1pwv h LEU 699 N 0.26 0.52 0.00 2.82 3.38 -0.13 -0.71 115.31 121.45 1pwv h LEU 699 Ca 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1pwv h LEU 699 Cb 0.39 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1pwv h LEU 699 CO 0.01 0.37 0.00 0.18 0.09 0.00 0.00 178.44 179.09 1pwv n LEU 700 N -4.47 0.00 -4.30 1.67 4.77 -0.68 -4.06 117.00 109.93 1pwv n LEU 700 Ca 0.05 0.00 -0.44 0.00 -0.03 0.00 0.00 56.01 55.59 1pwv n LEU 700 Cb 0.10 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 1pwv n LEU 700 CO 0.35 0.00 1.23 -0.67 -1.33 0.00 0.00 177.39 176.97 1pwv n ASP 701 N 0.00 5.45 0.14 -1.43 4.64 -1.20 -4.86 116.55 119.28 1pwv n ASP 701 Ca 0.00 -3.06 0.02 0.00 -1.38 0.00 0.00 54.79 50.36 1pwv n ASP 701 Cb 0.00 -1.46 0.10 0.00 -1.04 0.00 0.00 41.12 38.72 1pwv n ASP 701 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 1pwv n LYS 702 N 3.91 0.03 0.00 -0.67 4.01 -0.27 -0.18 118.16 124.99 1pwv n LYS 702 Ca 0.32 0.43 0.13 0.00 -0.51 0.00 0.00 58.31 58.68 1pwv n LYS 702 Cb 0.40 -2.17 0.61 0.00 -0.51 0.00 0.00 35.03 33.36 1pwv n LYS 702 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1pwv n ASN 703 N -1.72 0.00 -3.72 4.39 5.03 -1.26 -4.86 115.26 113.13 1pwv n ASN 703 Ca -0.00 0.41 -0.13 0.00 0.87 0.00 0.00 54.58 55.73 1pwv n ASN 703 Cb 0.57 -0.47 -0.07 0.00 -1.02 0.00 0.00 39.78 38.78 1pwv n ASN 703 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1pwv s GLN 704 N -2.94 0.80 -1.05 3.52 -2.07 0.74 -5.09 119.66 113.57 1pwv s GLN 704 Ca 0.15 -0.29 -0.16 0.00 -1.82 0.00 0.00 55.36 53.25 1pwv s GLN 704 Cb 0.18 0.35 0.16 0.00 -1.09 0.00 0.00 33.01 32.62 1pwv s GLN 704 CO 0.50 -0.25 1.24 -1.12 -1.32 0.00 0.00 175.29 174.33 1pwv s SER 705 N -1.69 6.85 0.13 12.60 0.01 -1.26 -4.52 113.70 125.82 1pwv s SER 705 Ca -0.09 -2.55 0.09 0.00 1.31 0.00 0.00 55.95 54.72 1pwv s SER 705 Cb -0.03 -2.38 -0.04 0.00 0.21 0.00 0.00 66.02 63.79 1pwv s SER 705 CO 0.01 -0.87 -0.23 -1.81 0.41 0.00 0.00 173.24 170.75 1pwv s ASP 706 N 3.12 2.87 0.07 2.44 1.11 -1.26 -5.02 116.67 119.99 1pwv s ASP 706 Ca 0.36 -0.74 -0.25 0.00 0.18 0.00 0.00 52.55 52.10 1pwv s ASP 706 Cb -0.04 -0.18 -0.06 0.00 1.07 0.00 0.00 42.92 43.71 1pwv s ASP 706 CO -0.05 0.09 0.78 -0.76 1.18 0.00 0.00 175.17 176.41 1pwv s LEU 707 N -2.10 4.47 0.62 1.23 1.43 -1.26 -3.37 118.68 119.71 1pwv s LEU 707 Ca 0.11 1.50 0.40 0.00 -1.03 0.00 0.00 54.13 55.11 1pwv s LEU 707 Cb -0.09 -3.27 2.04 0.00 0.03 0.00 0.00 46.19 44.90 1pwv s LEU 707 CO 0.05 0.04 2.24 1.62 0.23 0.00 0.00 176.35 180.53 1pwv h VAL 708 N 4.00 0.05 0.00 -1.59 3.04 -1.86 0.28 116.25 120.17 1pwv h VAL 708 Ca -0.44 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.06 1pwv h VAL 708 Cb 1.21 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 31.66 1pwv h VAL 708 CO 0.70 0.01 0.00 1.07 -1.01 0.00 0.00 177.57 178.34 1pwv n THR 709 N -3.14 0.00 -0.01 3.17 5.66 -1.26 -2.65 114.28 116.04 1pwv n THR 709 Ca -0.02 0.00 0.08 0.00 -3.05 0.00 0.00 64.05 61.07 1pwv n THR 709 Cb 0.15 -0.53 -0.14 0.00 -1.55 0.00 0.00 70.33 68.27 1pwv n THR 709 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1pwv n ASN 710 N -0.95 1.00 -4.61 1.09 4.05 0.97 -4.57 115.26 112.24 1pwv n ASN 710 Ca 0.18 0.00 -0.41 0.00 0.45 0.00 0.00 54.58 54.80 1pwv n ASN 710 Cb 0.08 1.78 0.01 0.00 1.23 0.00 0.00 39.78 42.89 1pwv n ASN 710 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 1pwv n SER 711 N -2.12 1.29 -0.26 1.20 3.41 -1.08 -4.65 113.62 111.41 1pwv n SER 711 Ca -0.04 1.03 0.00 0.00 -0.26 0.00 0.00 58.87 59.61 1pwv n SER 711 Cb 0.47 -1.36 0.12 0.00 -0.26 0.00 0.00 64.21 63.18 1pwv n SER 711 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1pwv h LYS 712 N 1.54 0.71 -1.03 4.33 3.64 -1.95 0.17 116.57 123.98 1pwv h LYS 712 Ca -0.45 -0.04 0.26 0.00 -1.27 0.00 0.00 60.65 59.16 1pwv h LYS 712 Cb 1.34 -0.16 -0.09 0.00 -0.41 0.00 0.00 32.23 32.91 1pwv h LYS 712 CO 0.57 0.47 0.67 -0.22 -2.27 0.00 0.00 179.45 178.67 1pwv h LYS 713 N 0.73 0.35 0.10 1.90 3.64 -1.95 -0.22 116.57 121.14 1pwv h LYS 713 Ca 0.34 -0.02 -0.34 0.00 -1.27 0.00 0.00 60.65 59.35 1pwv h LYS 713 Cb 0.24 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.96 1pwv h LYS 713 CO -0.21 0.23 -1.86 0.35 -2.27 0.00 0.00 179.45 175.69 1pwv h PHE 714 N 0.36 0.40 0.00 1.91 3.57 -1.31 -3.27 116.94 118.61 1pwv h PHE 714 Ca 0.58 -0.29 0.00 0.00 3.53 0.00 0.00 57.97 61.78 1pwv h PHE 714 Cb 1.52 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.25 1pwv h PHE 714 CO -0.00 1.57 0.26 0.82 -2.23 0.00 0.00 178.31 178.72 1pwv h ILE 715 N 0.06 0.00 0.00 1.41 2.04 0.10 -0.89 117.51 120.23 1pwv h ILE 715 Ca -0.37 0.00 -0.20 0.00 1.00 0.00 0.00 64.86 65.29 1pwv h ILE 715 Cb 2.04 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.74 1pwv h ILE 715 CO 0.10 0.00 -1.12 0.44 0.00 0.00 0.00 178.15 177.57 1pwv h ASP 716 N 0.00 0.00 -0.96 1.72 3.45 -1.44 -2.85 116.42 116.35 1pwv h ASP 716 Ca 0.00 -0.53 0.19 0.00 0.43 0.00 0.00 57.03 57.11 1pwv h ASP 716 Cb 0.52 0.00 -0.08 0.00 -0.56 0.00 0.00 39.33 39.20 1pwv h ASP 716 CO 0.00 1.42 0.61 0.40 -1.57 0.00 0.00 179.24 180.10 1pwv h ILE 717 N -1.00 0.72 -0.16 0.35 2.04 -1.31 0.11 117.51 118.26 1pwv h ILE 717 Ca -0.31 -0.21 -0.08 0.00 1.00 0.00 0.00 64.86 65.26 1pwv h ILE 717 Cb 1.25 0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1pwv h ILE 717 CO -0.19 0.11 -0.21 0.15 0.00 0.00 0.00 178.15 178.01 1pwv h PHE 718 N 0.62 0.52 0.00 1.37 3.57 -1.36 0.32 116.94 121.99 1pwv h PHE 718 Ca 0.52 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.85 1pwv h PHE 718 Cb 0.99 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.62 1pwv h PHE 718 CO -0.00 0.84 0.04 1.17 -2.23 0.00 0.00 178.31 178.12 1pwv n LYS 719 N -4.47 0.11 -0.00 1.11 4.81 0.29 0.19 118.16 120.20 1pwv n LYS 719 Ca -0.06 0.60 -0.01 0.00 -0.87 0.00 0.00 58.31 57.98 1pwv n LYS 719 Cb 0.41 -1.91 -0.00 0.00 0.02 0.00 0.00 35.03 33.55 1pwv n LYS 719 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1pwv n GLU 720 N -2.11 0.05 0.00 1.64 2.13 -0.63 -4.71 120.64 117.00 1pwv n GLU 720 Ca -0.01 0.02 0.14 0.00 0.66 0.00 0.00 57.16 57.97 1pwv n GLU 720 Cb 0.06 -0.37 0.77 0.00 0.27 0.00 0.00 31.44 32.18 1pwv n GLU 720 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1pwv n GLU 721 N -2.77 0.55 0.00 5.31 1.02 0.11 -4.24 120.64 120.62 1pwv n GLU 721 Ca -0.01 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1pwv n GLU 721 Cb 0.05 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.97 1pwv n GLU 721 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pwv n GLY 722 N 1.10 0.62 0.00 0.62 0.00 0.13 -1.37 105.19 106.29 1pwv n GLY 722 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1pwv n GLY 722 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1pwv n SER 723 N 0.58 0.00 0.05 1.61 7.64 -1.26 -4.30 113.62 117.93 1pwv n SER 723 Ca 0.00 -1.00 -0.10 0.00 1.01 0.00 0.00 58.87 58.78 1pwv n SER 723 Cb 0.13 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.20 1pwv n SER 723 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1pwv h ASN 724 N 0.00 0.12 -1.01 6.43 4.21 -1.52 -3.47 115.58 120.34 1pwv h ASN 724 Ca 0.00 -0.16 -0.49 0.00 1.21 0.00 0.00 56.30 56.86 1pwv h ASN 724 Cb 0.69 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.85 1pwv h ASN 724 CO 0.00 1.13 -0.22 -0.76 -1.29 0.00 0.00 177.43 176.29 1pwv s LEU 725 N -6.67 3.19 0.01 1.61 1.43 -1.26 -5.01 118.68 111.98 1pwv s LEU 725 Ca -0.03 -0.82 -0.00 0.00 -1.03 0.00 0.00 54.13 52.25 1pwv s LEU 725 Cb 0.09 -1.84 -0.00 0.00 0.03 0.00 0.00 46.19 44.46 1pwv s LEU 725 CO 0.83 -1.05 0.00 0.35 0.23 0.00 0.00 176.35 176.72 1pwv n THR 726 N -1.94 0.02 -0.18 5.49 -2.24 -1.26 -4.59 114.28 109.57 1pwv n THR 726 Ca 0.09 -0.01 -0.04 0.00 -2.27 0.00 0.00 64.05 61.82 1pwv n THR 726 Cb 0.62 0.00 0.06 0.00 -2.10 0.00 0.00 70.33 68.91 1pwv n THR 726 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1pwv h SER 727 N 0.01 0.39 -0.99 3.42 4.64 -1.96 -0.93 113.55 118.13 1pwv h SER 727 Ca -0.01 0.03 0.14 0.00 -0.47 0.00 0.00 61.79 61.48 1pwv h SER 727 Cb 0.03 -0.04 -0.09 0.00 -0.31 0.00 0.00 62.40 61.99 1pwv h SER 727 CO 0.01 0.27 0.62 0.22 -0.87 0.00 0.00 176.83 177.08 1pwv h TYR 728 N 0.53 1.09 -0.50 4.77 3.20 -1.99 0.53 116.97 124.60 1pwv h TYR 728 Ca 0.24 0.03 0.08 0.00 3.14 0.00 0.00 58.73 62.22 1pwv h TYR 728 Cb 0.15 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 1pwv h TYR 728 CO -0.10 0.38 0.34 0.78 -1.64 0.00 0.00 178.16 177.92 1pwv h GLY 729 N 0.91 0.45 1.77 1.82 0.00 -1.44 -0.21 103.07 106.38 1pwv h GLY 729 Ca 0.51 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1pwv h GLY 729 CO -0.29 0.10 0.00 -2.13 0.00 0.00 0.00 176.54 174.22 1pwv n ARG 730 N -4.47 0.04 0.41 4.80 0.63 0.18 -2.86 116.66 115.40 1pwv n ARG 730 Ca 0.07 0.31 -0.19 0.00 -0.92 0.00 0.00 57.85 57.13 1pwv n ARG 730 Cb 0.32 -1.50 -0.09 0.00 0.45 0.00 0.00 32.46 31.63 1pwv n ARG 730 CO 0.00 0.00 0.00 1.15 -2.51 0.00 0.00 177.63 176.27 1pwv h THR 731 N 0.00 0.10 -2.81 5.15 2.02 -1.08 -3.48 112.91 112.81 1pwv h THR 731 Ca 0.00 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.26 1pwv h THR 731 Cb 0.07 0.10 -0.04 0.00 -1.74 0.00 0.00 68.15 66.54 1pwv h THR 731 CO 0.00 0.00 0.34 0.54 0.37 0.00 0.00 175.52 176.77 1pwv s ASN 732 N -4.23 -0.13 0.12 4.18 2.20 -1.23 -5.04 114.94 110.80 1pwv s ASN 732 Ca -0.19 -0.74 -0.25 0.00 -0.94 0.00 0.00 52.86 50.74 1pwv s ASN 732 Cb 0.03 0.69 -0.07 0.00 -2.00 0.00 0.00 41.25 39.91 1pwv s ASN 732 CO 0.61 -1.32 1.66 1.05 -2.94 0.00 0.00 177.10 176.15 1pwv h GLU 733 N 2.00 -0.33 -0.99 3.55 9.09 -1.88 0.26 114.58 126.28 1pwv h GLU 733 Ca -0.25 0.02 0.11 0.00 0.05 0.00 0.00 59.36 59.29 1pwv h GLU 733 Cb 1.24 0.07 -0.08 0.00 -1.65 0.00 0.00 28.75 28.34 1pwv h GLU 733 CO 0.30 -0.22 0.62 0.00 0.05 0.00 0.00 179.01 179.77 1pwv h ALA 734 N 0.53 1.47 -0.05 1.06 0.00 -1.95 0.90 119.26 121.22 1pwv h ALA 734 Ca 0.05 0.02 -0.24 0.00 0.00 0.00 0.00 54.91 54.73 1pwv h ALA 734 Cb 0.40 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 17.99 1pwv h ALA 734 CO -0.17 0.25 -0.93 0.93 0.00 0.00 0.00 179.25 179.34 1pwv h GLU 735 N 1.01 0.67 0.03 0.00 4.39 -1.76 -2.18 114.58 116.74 1pwv h GLU 735 Ca 0.48 -0.65 -0.00 0.00 0.34 0.00 0.00 59.36 59.53 1pwv h GLU 735 Cb 0.43 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 1pwv h GLU 735 CO -0.25 1.25 -0.02 0.35 -1.16 0.00 0.00 179.01 179.18 1pwv h PHE 736 N 0.41 -0.04 -0.60 4.33 3.57 0.69 0.62 116.94 125.91 1pwv h PHE 736 Ca -0.09 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.52 1pwv h PHE 736 Cb 1.56 0.01 -0.08 0.00 2.79 0.00 0.00 35.95 40.24 1pwv h PHE 736 CO 0.09 0.04 0.15 0.35 -2.23 0.00 0.00 178.31 176.71 1pwv h PHE 737 N -0.12 0.25 -0.17 0.41 3.57 0.77 0.41 116.94 122.06 1pwv h PHE 737 Ca -0.00 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 1pwv h PHE 737 Cb 0.10 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.82 1pwv h PHE 737 CO -0.05 -0.00 -0.12 0.00 -2.23 0.00 0.00 178.31 175.91 1pwv h ALA 738 N 1.47 0.24 -0.23 2.41 0.00 -1.07 0.55 119.26 122.62 1pwv h ALA 738 Ca 0.31 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1pwv h ALA 738 Cb 0.45 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1pwv h ALA 738 CO -0.38 0.09 0.03 0.93 0.00 0.00 0.00 179.25 179.92 1pwv h GLU 739 N 0.04 0.11 0.24 0.00 4.39 0.93 0.25 114.58 120.54 1pwv h GLU 739 Ca 0.03 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 1pwv h GLU 739 Cb 0.62 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1pwv h GLU 739 CO 0.03 0.07 -0.12 0.00 -1.16 0.00 0.00 179.01 177.83 1pwv h ALA 740 N 1.18 -0.33 -0.80 3.43 0.00 -0.15 -1.50 119.26 121.10 1pwv h ALA 740 Ca 0.11 -0.10 0.19 0.00 0.00 0.00 0.00 54.91 55.11 1pwv h ALA 740 Cb 0.12 0.13 -0.12 0.00 0.00 0.00 0.00 17.79 17.91 1pwv h ALA 740 CO -0.16 -0.65 0.22 0.35 0.00 0.00 0.00 179.25 179.01 1pwv h PHE 741 N -0.39 0.34 0.54 0.00 3.57 0.62 -1.83 116.94 119.79 1pwv h PHE 741 Ca -0.03 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1pwv h PHE 741 Cb 0.30 -0.03 0.01 0.00 2.79 0.00 0.00 35.95 39.02 1pwv h PHE 741 CO -0.04 -0.11 -0.26 -0.09 -2.23 0.00 0.00 178.31 175.58 1pwv h ARG 742 N 0.28 -0.70 -0.92 1.11 2.43 -0.07 -3.00 114.38 113.51 1pwv h ARG 742 Ca 0.47 0.05 0.15 0.00 -0.81 0.00 0.00 59.98 59.84 1pwv h ARG 742 Cb 0.85 0.16 -0.10 0.00 -0.42 0.00 0.00 29.97 30.47 1pwv h ARG 742 CO -0.55 -0.43 0.52 -0.07 -1.51 0.00 0.00 179.97 177.93 1pwv h LEU 743 N -0.83 0.68 -2.31 3.80 3.38 -0.76 0.41 115.31 119.67 1pwv h LEU 743 Ca -0.07 0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1pwv h LEU 743 Cb 0.60 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 1pwv h LEU 743 CO 0.12 0.29 0.02 0.24 0.09 0.00 0.00 178.44 179.20 1pwv h MET 744 N 0.74 0.00 -0.27 1.13 2.86 -1.23 -2.09 114.93 116.07 1pwv h MET 744 Ca 0.50 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 58.14 1pwv h MET 744 Cb 0.69 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.35 1pwv h MET 744 CO -0.35 0.00 0.00 0.72 1.06 0.00 0.00 176.91 178.34 1pwv n HIS 745 N -4.05 0.98 -1.53 -0.22 8.25 0.08 -4.81 115.22 113.92 1pwv n HIS 745 Ca -0.02 -0.89 -0.34 0.00 -0.26 0.00 0.00 57.72 56.21 1pwv n HIS 745 Cb 0.11 -0.32 0.08 0.00 1.12 0.00 0.00 29.99 30.97 1pwv n HIS 745 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1pwv s SER 746 N -1.92 4.48 0.11 0.41 0.15 -0.78 -4.78 113.70 111.37 1pwv s SER 746 Ca 0.43 2.24 0.24 0.00 0.70 0.00 0.00 55.95 59.55 1pwv s SER 746 Cb 0.35 -2.58 0.93 0.00 -1.71 0.00 0.00 66.02 63.00 1pwv s SER 746 CO 0.09 -2.06 1.73 0.41 1.20 0.00 0.00 173.24 174.61 1pwv n THR 747 N -2.62 0.57 -3.59 6.45 -1.04 -1.26 -4.40 114.28 108.38 1pwv n THR 747 Ca 0.12 0.04 -0.40 0.00 -2.04 0.00 0.00 64.05 61.77 1pwv n THR 747 Cb 0.51 -0.79 -0.09 0.00 -1.82 0.00 0.00 70.33 68.14 1pwv n THR 747 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1pwv s ASP 748 N -3.66 5.62 0.55 8.00 2.15 -1.26 -4.95 116.67 123.12 1pwv s ASP 748 Ca 0.09 -1.93 0.28 0.00 0.43 0.00 0.00 52.55 51.42 1pwv s ASP 748 Cb 0.13 -1.98 1.45 0.00 -0.30 0.00 0.00 42.92 42.22 1pwv s ASP 748 CO 0.45 -0.67 1.95 0.45 -0.17 0.00 0.00 175.17 177.18 1pwv h HIS 749 N 8.38 0.00 -0.97 -5.34 3.86 -1.95 0.25 115.15 119.39 1pwv h HIS 749 Ca -0.20 0.00 0.17 0.00 -1.16 0.00 0.00 60.37 59.18 1pwv h HIS 749 Cb 1.07 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.45 1pwv h HIS 749 CO 0.62 0.00 0.61 0.00 0.86 0.00 0.00 177.93 180.02 1pwv h ALA 750 N 1.62 1.78 0.00 2.45 0.00 -1.96 0.24 119.26 123.40 1pwv h ALA 750 Ca 0.29 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 55.06 1pwv h ALA 750 Cb 1.24 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1pwv h ALA 750 CO -0.00 -0.09 -0.87 0.93 0.00 0.00 0.00 179.25 179.22 1pwv h GLU 751 N 0.73 0.04 -0.63 0.00 5.08 -0.81 -3.00 114.58 115.99 1pwv h GLU 751 Ca 0.52 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.76 1pwv h GLU 751 Cb 0.84 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.08 1pwv h GLU 751 CO -0.29 0.89 0.10 0.00 -1.00 0.00 0.00 179.01 178.71 1pwv h ARG 752 N 0.02 1.02 -0.65 2.33 3.08 -0.52 -2.84 114.38 116.82 1pwv h ARG 752 Ca -0.02 -0.26 -0.07 0.00 0.07 0.00 0.00 59.98 59.70 1pwv h ARG 752 Cb 1.53 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 31.43 1pwv h ARG 752 CO 0.12 0.94 0.12 -0.07 -1.07 0.00 0.00 179.97 180.01 1pwv h LEU 753 N 0.96 1.01 -0.86 3.04 -0.00 -0.92 -3.06 115.31 115.47 1pwv h LEU 753 Ca 0.19 -0.25 0.18 0.00 -0.00 0.00 0.00 57.88 58.00 1pwv h LEU 753 Cb 0.42 -0.27 -0.11 0.00 -0.00 0.00 0.00 40.66 40.70 1pwv h LEU 753 CO 0.01 1.00 0.41 0.11 -0.00 0.00 0.00 178.44 179.97 1pwv h LYS 754 N 0.98 0.49 -0.31 1.13 1.57 -1.36 0.49 116.57 119.56 1pwv h LYS 754 Ca 0.20 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.85 1pwv h LYS 754 Cb 0.41 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1pwv h LYS 754 CO 0.01 0.33 -0.18 0.28 -0.57 0.00 0.00 179.45 179.32 1pwv h VAL 755 N 0.51 1.29 -0.98 0.50 2.07 -1.56 -2.39 116.25 115.69 1pwv h VAL 755 Ca 0.50 -1.30 0.02 0.00 0.82 0.00 0.00 66.70 66.74 1pwv h VAL 755 Cb 0.84 1.47 -0.05 0.00 -1.52 0.00 0.00 31.29 32.02 1pwv h VAL 755 CO -0.44 0.42 0.65 -0.61 0.02 0.00 0.00 177.57 177.61 1pwv h GLN 756 N 0.43 1.26 -0.79 1.57 4.15 -0.99 0.39 115.11 121.12 1pwv h GLN 756 Ca 0.07 -0.08 -0.50 0.00 0.77 0.00 0.00 58.65 58.91 1pwv h GLN 756 Cb 0.72 -0.28 -0.28 0.00 0.21 0.00 0.00 27.48 27.84 1pwv h GLN 756 CO 0.05 0.83 0.25 0.36 -1.93 0.00 0.00 178.83 178.40 1pwv n LYS 757 N -4.42 2.59 0.00 1.69 2.85 -0.01 -3.80 118.16 117.05 1pwv n LYS 757 Ca 0.12 -3.40 0.00 0.00 -1.05 0.00 0.00 58.31 53.98 1pwv n LYS 757 Cb 0.05 -2.15 0.00 0.00 -0.65 0.00 0.00 35.03 32.27 1pwv n LYS 757 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1pwv n ASN 758 N -0.97 0.00 -2.70 -5.58 4.13 -0.91 -4.95 115.26 104.29 1pwv n ASN 758 Ca 0.51 0.00 -0.07 0.00 1.68 0.00 0.00 54.58 56.70 1pwv n ASN 758 Cb 1.01 0.00 0.04 0.00 -1.54 0.00 0.00 39.78 39.29 1pwv n ASN 758 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pwv n ALA 759 N -0.37 3.13 -0.16 5.41 0.00 0.13 -4.79 120.51 123.87 1pwv n ALA 759 Ca 0.00 -2.93 -0.03 0.00 0.00 0.00 0.00 53.44 50.48 1pwv n ALA 759 Cb 0.00 -0.93 0.04 0.00 0.00 0.00 0.00 19.45 18.56 1pwv n ALA 759 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1pwv h PRO 760 N 2.84 0.00 -0.53 0.00 0.13 -1.64 0.67 132.00 133.48 1pwv h PRO 760 Ca -0.12 -0.00 0.15 0.00 -0.87 0.00 0.00 66.00 65.16 1pwv h PRO 760 Cb 1.21 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1pwv h PRO 760 CO 0.40 0.00 0.45 -0.22 -0.23 0.00 0.00 178.00 178.40 1pwv h LYS 761 N 0.00 0.00 0.01 0.86 3.11 -1.91 0.16 116.57 118.80 1pwv h LYS 761 Ca 0.24 0.00 -0.14 0.00 -2.81 0.00 0.00 60.65 57.94 1pwv h LYS 761 Cb 0.37 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.58 1pwv h LYS 761 CO -0.51 0.00 -0.76 1.15 -2.81 0.00 0.00 179.45 176.52 1pwv h THR 762 N 0.00 1.29 -0.81 1.00 2.02 -0.30 -2.79 112.91 113.32 1pwv h THR 762 Ca 0.25 -2.27 0.20 0.00 0.77 0.00 0.00 66.41 65.36 1pwv h THR 762 Cb 1.15 2.75 -0.05 0.00 -1.74 0.00 0.00 68.15 70.26 1pwv h THR 762 CO -0.00 0.47 0.55 0.15 0.37 0.00 0.00 175.52 177.06 1pwv h PHE 763 N -0.94 0.32 0.13 3.16 3.57 0.11 0.31 116.94 123.60 1pwv h PHE 763 Ca -0.20 0.01 -0.28 0.00 3.53 0.00 0.00 57.97 61.03 1pwv h PHE 763 Cb 1.22 -0.10 0.01 0.00 2.79 0.00 0.00 35.95 39.87 1pwv h PHE 763 CO 0.18 0.10 -1.23 0.37 -2.23 0.00 0.00 178.31 175.49 1pwv h GLN 764 N 0.25 0.38 0.86 1.11 5.75 -0.84 -2.96 115.11 119.66 1pwv h GLN 764 Ca 0.40 -0.58 -0.04 0.00 -0.15 0.00 0.00 58.65 58.28 1pwv h GLN 764 Cb 1.19 0.21 0.01 0.00 1.07 0.00 0.00 27.48 29.95 1pwv h GLN 764 CO -0.10 1.26 -0.41 0.35 -2.65 0.00 0.00 178.83 177.27 1pwv h PHE 765 N 0.13 -1.07 -0.90 3.99 3.57 -0.21 -1.51 116.94 120.94 1pwv h PHE 765 Ca -0.15 -0.03 0.21 0.00 3.53 0.00 0.00 57.97 61.53 1pwv h PHE 765 Cb 1.94 0.35 -0.12 0.00 2.79 0.00 0.00 35.95 40.91 1pwv h PHE 765 CO 0.08 -0.67 0.42 0.82 -2.23 0.00 0.00 178.31 176.74 1pwv h ILE 766 N -1.25 0.54 0.00 1.41 5.03 -1.03 0.25 117.51 122.46 1pwv h ILE 766 Ca -0.12 -0.16 -0.06 0.00 -0.12 0.00 0.00 64.86 64.40 1pwv h ILE 766 Cb 0.88 0.03 -0.01 0.00 -3.03 0.00 0.00 36.82 34.69 1pwv h ILE 766 CO 0.19 0.09 -0.30 0.78 -0.68 0.00 0.00 178.15 178.23 1pwv h ASN 767 N 0.47 0.00 0.39 1.72 -0.26 -1.39 -1.07 115.58 115.45 1pwv h ASN 767 Ca 0.55 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 56.27 1pwv h ASN 767 Cb 0.98 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.25 1pwv h ASN 767 CO -0.48 0.30 -0.19 0.44 -1.06 0.00 0.00 177.43 176.44 1pwv h ASP 768 N 0.00 -0.44 -1.14 5.81 3.32 0.52 -2.78 116.42 121.70 1pwv h ASP 768 Ca -0.00 -0.11 0.32 0.00 0.02 0.00 0.00 57.03 57.25 1pwv h ASP 768 Cb 0.60 0.11 -0.08 0.00 0.22 0.00 0.00 39.33 40.19 1pwv h ASP 768 CO 0.04 -0.02 0.77 1.56 -1.72 0.00 0.00 179.24 179.87 1pwv h GLN 769 N -1.00 0.20 -0.39 3.56 7.50 -1.00 0.24 115.11 124.21 1pwv h GLN 769 Ca -0.05 -0.01 -0.08 0.00 0.50 0.00 0.00 58.65 59.01 1pwv h GLN 769 Cb 0.53 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 28.00 1pwv h GLN 769 CO 0.09 0.13 -0.05 0.82 -1.50 0.00 0.00 178.83 178.32 1pwv h ILE 770 N 0.20 1.27 -0.17 2.54 1.08 -1.08 -1.66 117.51 119.70 1pwv h ILE 770 Ca 0.61 -1.10 -0.11 0.00 -0.39 0.00 0.00 64.86 63.87 1pwv h ILE 770 Cb 1.94 1.19 0.00 0.00 -3.07 0.00 0.00 36.82 36.88 1pwv h ILE 770 CO -0.19 0.37 -0.32 0.11 -0.69 0.00 0.00 178.15 177.43 1pwv h LYS 771 N 0.55 0.51 -0.37 2.37 1.57 -0.39 -1.02 116.57 119.78 1pwv h LYS 771 Ca 0.11 -0.33 0.08 0.00 -1.87 0.00 0.00 60.65 58.64 1pwv h LYS 771 Cb 0.55 0.04 -0.08 0.00 0.08 0.00 0.00 32.23 32.81 1pwv h LYS 771 CO 0.03 0.93 -0.22 0.35 -0.57 0.00 0.00 179.45 179.97 1pwv h PHE 772 N 0.15 -0.58 -0.11 -1.35 3.57 -0.77 0.13 116.94 117.97 1pwv h PHE 772 Ca 0.01 0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 1pwv h PHE 772 Cb 0.91 0.31 -0.00 0.00 2.79 0.00 0.00 35.95 39.96 1pwv h PHE 772 CO 0.10 -0.30 0.00 0.82 -2.23 0.00 0.00 178.31 176.70 1pwv h ILE 773 N -0.17 1.24 -0.46 1.41 2.04 -1.30 -0.40 117.51 119.88 1pwv h ILE 773 Ca 0.18 -0.78 0.07 0.00 1.00 0.00 0.00 64.86 65.34 1pwv h ILE 773 Cb 0.45 1.54 -0.06 0.00 -0.74 0.00 0.00 36.82 38.01 1pwv h ILE 773 CO -0.47 0.22 0.10 0.40 0.00 0.00 0.00 178.15 178.40 1pwv h ILE 774 N -0.06 0.76 0.03 -0.67 2.04 -0.60 -3.30 117.51 115.71 1pwv h ILE 774 Ca 0.03 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 1pwv h ILE 774 Cb 0.34 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1pwv h ILE 774 CO 0.00 0.04 -0.01 0.78 0.00 0.00 0.00 178.15 178.97 1pwv h ASN 775 N 0.24 -0.03 0.00 1.72 2.35 -0.76 -3.50 115.58 115.60 1pwv h ASN 775 Ca 0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1pwv h ASN 775 Cb 0.28 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1pwv h ASN 775 CO -0.29 0.05 0.00 -1.20 -1.65 0.00 0.00 177.43 174.34