#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mka s ASP -37 N 0.00 3.75 -0.12 4.52 -1.08 -1.26 -5.08 116.67 117.40 3mka s ASP -37 Ca 0.00 -0.46 -0.01 0.00 -0.52 0.00 0.00 52.55 51.57 3mka s ASP -37 Cb 0.00 -1.59 -0.02 0.00 -1.46 0.00 0.00 42.92 39.85 3mka s ASP -37 CO 0.00 0.07 -0.09 -0.76 0.52 0.00 0.00 175.17 174.91 3mka s LEU -36 N 0.90 2.98 -1.48 -1.34 1.43 -1.26 -4.97 118.68 114.93 3mka s LEU -36 Ca -0.03 -0.19 -0.12 0.00 -1.03 0.00 0.00 54.13 52.75 3mka s LEU -36 Cb -0.15 -1.67 0.02 0.00 0.03 0.00 0.00 46.19 44.42 3mka s LEU -36 CO -0.01 0.23 2.37 -1.20 0.23 0.00 0.00 176.35 177.97 3mka n SER -35 N 3.13 5.19 -4.19 2.29 7.64 -1.26 -4.80 113.62 121.63 3mka n SER -35 Ca -0.18 -2.81 -0.35 0.00 1.01 0.00 0.00 58.87 56.54 3mka n SER -35 Cb 0.53 -1.61 -0.14 0.00 -1.01 0.00 0.00 64.21 61.97 3mka n SER -35 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3mka s SER -34 N 2.70 4.75 0.48 6.43 0.15 -1.26 -4.32 113.70 122.62 3mka s SER -34 Ca 0.52 -1.15 0.20 0.00 0.70 0.00 0.00 55.95 56.22 3mka s SER -34 Cb 0.15 -1.71 1.22 0.00 -1.71 0.00 0.00 66.02 63.97 3mka s SER -34 CO -0.08 -0.22 1.97 0.15 1.20 0.00 0.00 173.24 176.26 3mka h PHE -33 N 8.01 0.24 -0.01 3.44 3.57 -1.87 0.25 116.94 130.57 3mka h PHE -33 Ca -0.24 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.25 3mka h PHE -33 Cb 1.08 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.74 3mka h PHE -33 CO 0.61 0.10 -0.04 1.15 -2.23 0.00 0.00 178.31 177.90 3mka h THR -32 N 0.21 1.54 -0.98 4.41 2.02 -1.95 -0.87 112.91 117.29 3mka h THR -32 Ca 0.29 -1.64 0.02 0.00 0.77 0.00 0.00 66.41 65.85 3mka h THR -32 Cb 0.87 2.63 -0.05 0.00 -1.74 0.00 0.00 68.15 69.86 3mka h THR -32 CO -0.05 0.43 0.65 -0.78 0.37 0.00 0.00 175.52 176.14 3mka h ASP -31 N -0.64 1.11 -0.70 4.18 1.82 -1.69 -0.18 116.42 120.32 3mka h ASP -31 Ca -0.00 -0.02 -0.05 0.00 -0.39 0.00 0.00 57.03 56.56 3mka h ASP -31 Cb 0.72 -0.27 -0.03 0.00 0.68 0.00 0.00 39.33 40.43 3mka h ASP -31 CO 0.01 0.79 0.23 0.15 -1.61 0.00 0.00 179.24 178.81 3mka h PHE -30 N 1.30 1.12 -0.84 0.28 3.57 -0.51 -2.96 116.94 118.89 3mka h PHE -30 Ca 0.37 -0.11 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 3mka h PHE -30 Cb -0.11 -0.33 -0.04 0.00 2.79 0.00 0.00 35.95 38.27 3mka h PHE -30 CO -0.00 0.89 0.39 1.25 -2.23 0.00 0.00 178.31 178.60 3mka h LEU -29 N 1.02 1.11 -0.45 0.59 5.85 0.29 -1.80 115.31 121.92 3mka h LEU -29 Ca 0.23 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 3mka h LEU -29 Cb 0.28 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 3mka h LEU -29 CO -0.01 0.94 0.22 -0.09 -0.34 0.00 0.00 178.44 179.16 3mka h ARG -28 N 1.20 0.65 -0.47 1.25 2.43 -0.94 2.34 114.38 120.83 3mka h ARG -28 Ca 0.29 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.29 3mka h ARG -28 Cb 0.14 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 3mka h ARG -28 CO -0.03 0.55 0.01 -0.09 -1.51 0.00 0.00 179.97 178.89 3mka h ARG -27 N 0.59 0.82 0.00 0.20 2.43 -1.36 -3.37 114.38 113.70 3mka h ARG -27 Ca 0.16 -0.26 -0.36 0.00 -0.81 0.00 0.00 59.98 58.70 3mka h ARG -27 Cb 0.11 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.52 3mka h ARG -27 CO -0.02 0.87 -2.38 1.04 -1.51 0.00 0.00 179.97 177.97 3mka n GLN -26 N -4.36 0.65 -3.38 0.20 1.13 -0.71 -4.86 117.38 106.05 3mka n GLN -26 Ca 0.00 0.12 -0.26 0.00 -1.94 0.00 0.00 57.00 54.93 3mka n GLN -26 Cb 0.30 -1.49 -0.08 0.00 0.11 0.00 0.00 30.24 29.08 3mka n GLN -26 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3mka n ALA -25 N -3.14 3.10 0.20 -1.58 0.00 0.78 -4.91 120.51 114.96 3mka n ALA -25 Ca -0.42 -3.87 0.05 0.00 0.00 0.00 0.00 53.44 49.21 3mka n ALA -25 Cb 0.98 -0.85 0.44 0.00 0.00 0.00 0.00 19.45 20.02 3mka n ALA -25 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3mka h PRO -24 N 4.53 0.00 -0.87 0.00 0.11 -1.66 -2.92 132.00 131.18 3mka h PRO -24 Ca 0.15 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.27 3mka h PRO -24 Cb 0.81 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.87 3mka h PRO -24 CO 0.58 0.31 0.58 1.05 -0.21 0.00 0.00 178.00 180.31 3mka h GLU -23 N 0.00 1.15 0.00 1.05 9.09 -1.91 -1.97 114.58 122.00 3mka h GLU -23 Ca -0.00 -0.07 -0.02 0.00 0.05 0.00 0.00 59.36 59.31 3mka h GLU -23 Cb 0.63 -0.26 -0.00 0.00 -1.65 0.00 0.00 28.75 27.47 3mka h GLU -23 CO 0.04 0.76 -0.12 -0.07 0.05 0.00 0.00 179.01 179.67 3mka h LEU -22 N 1.18 0.00-10.26 3.06 -0.00 -1.88 -3.44 115.31 103.98 3mka h LEU -22 Ca 0.32 0.00 -0.52 0.00 -0.00 0.00 0.00 57.88 57.68 3mka h LEU -22 Cb -0.14 0.00 0.15 0.00 -0.00 0.00 0.00 40.66 40.67 3mka h LEU -22 CO -0.07 0.12 0.31 -0.76 -0.00 0.00 0.00 178.44 178.04 3mka s LEU -21 N -8.10 3.08 0.28 1.67 1.02 -0.74 -4.93 118.68 110.96 3mka s LEU -21 Ca -0.04 2.06 -0.03 0.00 0.02 0.00 0.00 54.13 56.15 3mka s LEU -21 Cb 0.15 -4.55 0.40 0.00 0.02 0.00 0.00 46.19 42.20 3mka s LEU -21 CO 0.64 -2.35 1.94 -0.65 0.02 0.00 0.00 176.35 175.95 3mka h PRO -20 N -1.03 1.15 0.00 1.29 0.11 -1.85 -3.49 132.00 128.18 3mka h PRO -20 Ca -0.45 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3mka h PRO -20 Cb 1.26 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 32.11 3mka h PRO -20 CO 0.48 0.76 0.00 0.00 -0.21 0.00 0.00 178.00 179.04 3mka n ALA -19 N -2.40 0.00 -2.26 -0.75 0.00 -1.26 -5.05 120.51 108.79 3mka n ALA -19 Ca 0.11 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.47 3mka n ALA -19 Cb 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.42 3mka n ALA -19 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3mka s SER -18 N -1.83 0.35 -0.22 0.00 0.15 -1.26 -4.84 113.70 106.05 3mka s SER -18 Ca 0.00 -0.89 -0.03 0.00 0.70 0.00 0.00 55.95 55.73 3mka s SER -18 Cb 0.00 0.26 0.01 0.00 -1.71 0.00 0.00 66.02 64.58 3mka s SER -18 CO 0.00 -0.66 0.07 0.00 1.20 0.00 0.00 173.24 173.85 3mka n ILE -17 N 0.04-10.25 -2.97 6.45 3.06 -1.26 -5.03 119.36 109.40 3mka n ILE -17 Ca -0.14 1.81 -0.37 0.00 -2.50 0.00 0.00 62.75 61.56 3mka n ILE -17 Cb 0.62 -6.03 -0.06 0.00 0.54 0.00 0.00 39.64 34.71 3mka n ILE -17 CO 0.00 0.00 0.00 -1.10 -2.50 0.00 0.00 176.55 172.95 3mka s GLN -5 N -1.19 4.39 0.00 9.51 -1.52 -1.26 -5.11 119.66 124.48 3mka s GLN -5 Ca -0.08 1.06 -0.11 0.00 -1.95 0.00 0.00 55.36 54.28 3mka s GLN -5 Cb 0.01 -2.87 -0.05 0.00 -0.22 0.00 0.00 33.01 29.88 3mka s GLN -5 CO 0.63 0.36 0.35 -0.51 -0.25 0.00 0.00 175.29 175.87 3mka s LEU -4 N -1.97 4.42 0.27 2.90 1.43 -1.26 -4.97 118.68 119.50 3mka s LEU -4 Ca 0.45 0.80 -0.30 0.00 -1.03 0.00 0.00 54.13 54.05 3mka s LEU -4 Cb -0.18 -2.61 -0.13 0.00 0.03 0.00 0.00 46.19 43.30 3mka s LEU -4 CO 0.22 0.29 1.44 -2.65 0.23 0.00 0.00 176.35 175.89 3mka n PRO -3 N 1.54 2.23 -3.26 1.29 -0.02 -1.26 -4.84 135.00 130.68 3mka n PRO -3 Ca -0.13 0.79 -0.06 0.00 -2.02 0.00 0.00 63.50 62.08 3mka n PRO -3 Cb 0.53 -2.47 0.02 0.00 -0.02 0.00 0.00 33.50 31.56 3mka n PRO -3 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 3mka n HIS -2 N 1.73 -1.96 -0.26 6.00 1.44 -0.96 -1.27 115.22 119.95 3mka n HIS -2 Ca 0.10 -1.42 0.00 0.00 -2.01 0.00 0.00 57.72 54.38 3mka n HIS -2 Cb 0.34 0.71 0.00 0.00 0.12 0.00 0.00 29.99 31.15 3mka n HIS -2 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3mka n GLY -1 N -0.46 -0.03 3.06 -1.39 0.00 -1.15 -1.51 105.19 103.72 3mka n GLY -1 Ca -0.06 -0.60 -0.08 0.00 0.00 0.00 0.00 46.02 45.28 3mka n GLY -1 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mka s ALA 301 N -0.10 0.44 -0.08 4.61 0.00 -1.26 -4.45 121.76 120.92 3mka s ALA 301 Ca 0.00 -1.03 0.04 0.00 0.00 0.00 0.00 51.96 50.97 3mka s ALA 301 Cb 0.00 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.34 3mka s ALA 301 CO 0.00 -0.29 -0.20 0.99 0.00 0.00 0.00 175.76 176.26 3mka s THR 302 N -3.13 1.72 -0.04 0.00 2.01 -1.26 -2.37 115.64 112.56 3mka s THR 302 Ca 0.00 -0.83 0.02 0.00 0.31 0.00 0.00 61.69 61.19 3mka s THR 302 Cb 0.02 -1.49 0.02 0.00 0.01 0.00 0.00 72.50 71.06 3mka s THR 302 CO -0.07 0.48 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.65 3mka s ILE 303 N 0.32 0.70 0.33 1.82 1.01 0.25 -2.45 121.20 123.17 3mka s ILE 303 Ca -0.14 -0.24 0.10 0.00 0.00 0.00 0.00 60.65 60.37 3mka s ILE 303 Cb -0.16 -0.68 -0.06 0.00 0.01 0.00 0.00 42.46 41.57 3mka s ILE 303 CO 0.06 0.25 -0.08 0.68 0.00 0.00 0.00 174.94 175.85 3mka s VAL 304 N 0.71 2.46 -0.26 2.92 -7.23 0.15 -0.98 120.40 118.17 3mka s VAL 304 Ca -0.11 -2.16 -0.19 0.00 -1.81 0.00 0.00 61.98 57.71 3mka s VAL 304 Cb -0.14 -2.63 0.07 0.00 0.56 0.00 0.00 36.38 34.24 3mka s VAL 304 CO 0.01 -0.25 0.66 0.00 -0.31 0.00 0.00 175.10 175.21 3mka s ALA 305 N -2.55 -1.69 0.07 1.32 0.00 -0.58 -1.29 121.76 117.04 3mka s ALA 305 Ca 0.33 2.06 -0.06 0.00 0.00 0.00 0.00 51.96 54.29 3mka s ALA 305 Cb -0.00 -1.21 -0.02 0.00 0.00 0.00 0.00 23.12 21.89 3mka s ALA 305 CO 0.17 -0.34 0.11 -0.48 0.00 0.00 0.00 175.76 175.22 3mka s LEU 306 N 0.92 1.82 -0.16 0.00 0.05 -0.32 -1.05 118.68 119.94 3mka s LEU 306 Ca -0.05 -0.76 -0.08 0.00 0.05 0.00 0.00 54.13 53.30 3mka s LEU 306 Cb -0.05 0.71 -0.04 0.00 -2.05 0.00 0.00 46.19 44.76 3mka s LEU 306 CO -0.08 -0.66 0.12 -0.54 -0.55 0.00 0.00 176.35 174.63 3mka s LYS 307 N -3.76 3.77 0.15 1.48 1.02 -0.01 -0.56 119.74 121.83 3mka s LYS 307 Ca 0.05 -0.21 0.06 0.00 0.02 0.00 0.00 55.97 55.88 3mka s LYS 307 Cb 0.05 -3.25 -0.04 0.00 -0.52 0.00 0.00 37.83 34.07 3mka s LYS 307 CO -0.10 0.52 -0.12 1.52 -0.92 0.00 0.00 175.35 176.25 3mka s TYR 308 N -0.30 1.40 0.16 3.18 -0.85 0.10 -4.96 117.35 116.08 3mka s TYR 308 Ca 0.11 -0.66 -0.32 0.00 -0.52 0.00 0.00 57.07 55.68 3mka s TYR 308 Cb -0.12 -0.70 -0.12 0.00 0.38 0.00 0.00 41.96 41.40 3mka s TYR 308 CO 0.01 0.16 1.74 -2.30 -1.52 0.00 0.00 175.55 173.65 3mka n PRO 309 N -0.03 2.63 -1.00 -3.49 -0.02 -1.26 -0.32 135.00 131.50 3mka n PRO 309 Ca -0.11 0.95 -0.00 0.00 -2.02 0.00 0.00 63.50 62.32 3mka n PRO 309 Cb 0.60 -2.80 -0.00 0.00 -0.02 0.00 0.00 33.50 31.28 3mka n PRO 309 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mka n GLY 310 N 3.97 0.34 3.81 -1.23 0.00 -0.53 -4.73 105.19 106.82 3mka n GLY 310 Ca 0.17 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 3mka n GLY 310 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mka s GLY 311 N -2.01 -0.10 -0.01 -0.02 0.00 0.56 -3.91 107.32 101.84 3mka s GLY 311 Ca 0.00 -0.17 -0.04 0.00 0.00 0.00 0.00 44.72 44.51 3mka s GLY 311 CO 0.00 0.08 0.08 0.54 0.00 0.00 0.00 173.10 173.79 3mka s VAL 312 N -3.40 0.06 0.06 1.40 0.11 -0.39 -0.72 120.40 117.52 3mka s VAL 312 Ca 0.13 -0.49 0.05 0.00 -2.93 0.00 0.00 61.98 58.73 3mka s VAL 312 Cb -0.04 -0.28 -0.03 0.00 -1.53 0.00 0.00 36.38 34.51 3mka s VAL 312 CO 0.05 -0.27 -0.13 0.54 -3.33 0.00 0.00 175.10 171.96 3mka s VAL 313 N -0.87 1.04 -0.01 2.04 0.11 0.28 -1.16 120.40 121.84 3mka s VAL 313 Ca -0.10 -1.20 0.00 0.00 -2.93 0.00 0.00 61.98 57.76 3mka s VAL 313 Cb -0.06 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.80 3mka s VAL 313 CO 0.00 -0.19 -0.00 -0.32 -3.33 0.00 0.00 175.10 171.27 3mka s MET 314 N -1.57 0.07 0.01 1.54 1.75 -0.13 -1.18 119.30 119.81 3mka s MET 314 Ca -0.02 0.02 -0.05 0.00 -1.25 0.00 0.00 55.69 54.38 3mka s MET 314 Cb -0.09 -0.14 -0.01 0.00 2.84 0.00 0.00 34.83 37.43 3mka s MET 314 CO 0.02 -0.03 0.10 0.00 -0.65 0.00 0.00 175.02 174.45 3mka s ALA 315 N 0.28 -0.18 0.04 4.11 0.00 -0.41 -1.04 121.76 124.55 3mka s ALA 315 Ca -0.02 -0.33 -0.04 0.00 0.00 0.00 0.00 51.96 51.57 3mka s ALA 315 Cb -0.04 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 3mka s ALA 315 CO -0.01 -0.23 0.06 0.20 0.00 0.00 0.00 175.76 175.79 3mka s GLY 316 N -1.59 0.22 0.99 0.00 0.00 -0.78 -0.67 107.32 105.49 3mka s GLY 316 Ca -0.13 -0.63 -0.16 0.00 0.00 0.00 0.00 44.72 43.80 3mka s GLY 316 CO -0.00 -0.75 1.31 0.51 0.00 0.00 0.00 173.10 174.16 3mka s ASP 317 N -2.10 2.83 0.00 1.64 1.47 -1.03 -2.31 116.67 117.18 3mka s ASP 317 Ca -0.06 0.29 0.06 0.00 1.18 0.00 0.00 52.55 54.02 3mka s ASP 317 Cb -0.02 -0.34 0.08 0.00 -0.34 0.00 0.00 42.92 42.30 3mka s ASP 317 CO -0.04 -2.91 0.81 0.54 0.68 0.00 0.00 175.17 174.24 3mka n ARG 318 N -3.89 0.64 -2.91 2.11 5.12 -1.26 -4.59 116.66 111.89 3mka n ARG 318 Ca 0.15 -1.10 -0.31 0.00 -1.93 0.00 0.00 57.85 54.65 3mka n ARG 318 Cb 0.59 -1.12 -0.05 0.00 -1.16 0.00 0.00 32.46 30.72 3mka n ARG 318 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 3mka s ARG 319 N -0.63 3.91 -0.02 5.56 3.52 -1.26 -2.19 118.95 127.83 3mka s ARG 319 Ca 0.09 0.64 -0.00 0.00 -0.13 0.00 0.00 55.73 56.32 3mka s ARG 319 Cb 0.05 -2.36 0.03 0.00 -1.56 0.00 0.00 34.95 31.11 3mka s ARG 319 CO 0.08 0.01 0.04 0.45 -0.81 0.00 0.00 175.30 175.07 3mka s SER 320 N -2.76 0.31 0.13 -2.12 0.15 -0.36 -4.60 113.70 104.45 3mka s SER 320 Ca 0.54 0.05 0.08 0.00 0.70 0.00 0.00 55.95 57.32 3mka s SER 320 Cb -0.10 -0.08 -0.04 0.00 -1.71 0.00 0.00 66.02 64.09 3mka s SER 320 CO 0.25 -0.16 -0.18 0.42 1.20 0.00 0.00 173.24 174.77 3mka s THR 321 N 1.33 1.66 -0.37 6.45 -4.23 -0.57 0.75 115.64 120.65 3mka s THR 321 Ca -0.06 -1.71 0.02 0.00 -1.18 0.00 0.00 61.69 58.76 3mka s THR 321 Cb -0.13 -1.64 0.11 0.00 1.34 0.00 0.00 72.50 72.18 3mka s THR 321 CO -0.03 -0.24 0.13 -1.10 -0.54 0.00 0.00 174.62 172.85 3mka s GLN 322 N -2.39 1.24 7.38 3.99 -0.21 0.04 -2.26 119.66 127.45 3mka s GLN 322 Ca 0.10 -1.73 0.00 0.00 0.02 0.00 0.00 55.36 53.75 3mka s GLN 322 Cb -0.07 -2.62 0.00 0.00 1.00 0.00 0.00 33.01 31.32 3mka s GLN 322 CO 0.05 -1.03 0.00 0.41 -2.12 0.00 0.00 175.29 172.60 3mka n GLY 323 N 4.15 2.10 0.03 3.09 0.00 -1.26 -2.40 105.19 110.89 3mka n GLY 323 Ca 0.03 -0.41 0.11 0.00 0.00 0.00 0.00 46.02 45.75 3mka n GLY 323 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3mka n ASN 324 N 7.94 0.52 -4.75 1.61 3.02 -1.26 -4.94 115.26 117.41 3mka n ASN 324 Ca 0.00 -0.23 -0.40 0.00 -0.03 0.00 0.00 54.58 53.91 3mka n ASN 324 Cb 0.00 1.13 -0.05 0.00 -0.61 0.00 0.00 39.78 40.25 3mka n ASN 324 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3mka s MET 325 N -3.27 4.70 -0.27 3.52 -1.94 -1.01 -5.00 119.30 116.03 3mka s MET 325 Ca 0.01 1.64 -0.29 0.00 -1.71 0.00 0.00 55.69 55.34 3mka s MET 325 Cb 0.14 -3.26 0.01 0.00 2.01 0.00 0.00 34.83 33.73 3mka s MET 325 CO 0.84 0.26 1.05 0.42 -0.01 0.00 0.00 175.02 177.59 3mka s ILE 326 N -0.76 4.61 -0.15 2.53 1.01 -1.26 -0.78 121.20 126.41 3mka s ILE 326 Ca 0.45 1.90 0.18 0.00 0.00 0.00 0.00 60.65 63.19 3mka s ILE 326 Cb -0.28 -4.35 -0.26 0.00 0.01 0.00 0.00 42.46 37.58 3mka s ILE 326 CO 0.35 -0.30 0.25 -1.54 0.00 0.00 0.00 174.94 173.71 3mka n SER 327 N 6.53 0.12 -3.87 3.58 3.41 0.23 -4.91 113.62 118.71 3mka n SER 327 Ca 0.12 0.05 -0.11 0.00 -0.26 0.00 0.00 58.87 58.67 3mka n SER 327 Cb 0.46 1.09 -0.11 0.00 -0.26 0.00 0.00 64.21 65.39 3mka n SER 327 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3mka s GLY 328 N -5.20 0.02 0.00 5.00 0.00 -0.42 -4.94 107.32 101.78 3mka s GLY 328 Ca -0.09 -0.00 0.00 0.00 0.00 0.00 0.00 44.72 44.63 3mka s GLY 328 CO 0.85 -0.09 0.40 -0.96 0.00 0.00 0.00 173.10 173.30 3mka n ARG 329 N 2.13 -0.07 0.00 2.90 1.85 -1.25 -1.22 116.66 120.99 3mka n ARG 329 Ca -0.19 -0.47 0.00 0.00 -1.00 0.00 0.00 57.85 56.20 3mka n ARG 329 Cb 0.57 -0.80 0.00 0.00 -1.05 0.00 0.00 32.46 31.18 3mka n ARG 329 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 3mka n ASP 330 N -0.06 0.76 -4.62 2.89 5.75 -1.17 -4.64 116.55 115.46 3mka n ASP 330 Ca 0.00 -0.88 -0.59 0.00 -0.01 0.00 0.00 54.79 53.30 3mka n ASP 330 Cb 0.16 0.23 -0.08 0.00 -1.03 0.00 0.00 41.12 40.40 3mka n ASP 330 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 3mka n VAL 331 N -0.23 0.05 -3.74 2.12 0.31 -0.93 -4.97 118.33 110.94 3mka n VAL 331 Ca 0.00 -0.01 -0.35 0.00 -0.01 0.00 0.00 64.34 63.97 3mka n VAL 331 Cb 0.00 -0.52 -0.08 0.00 -0.91 0.00 0.00 33.84 32.34 3mka n VAL 331 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 3mka s ARG 332 N 1.41 4.13 0.00 5.55 3.52 -1.26 -4.28 118.95 128.02 3mka s ARG 332 Ca 0.94 -0.20 0.00 0.00 -0.13 0.00 0.00 55.73 56.34 3mka s ARG 332 Cb -1.22 -3.40 0.00 0.00 -1.56 0.00 0.00 34.95 28.77 3mka s ARG 332 CO 0.62 0.34 0.17 1.63 -0.81 0.00 0.00 175.30 177.25 3mka n LYS 333 N 3.39 2.79 -4.05 5.12 5.02 -1.26 -4.97 118.16 124.21 3mka n LYS 333 Ca -0.16 -0.17 -0.35 0.00 -2.02 0.00 0.00 58.31 55.61 3mka n LYS 333 Cb 0.52 -0.62 -0.14 0.00 -0.02 0.00 0.00 35.03 34.78 3mka n LYS 333 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3mka s VAL 334 N -0.45 3.30 -0.03 -0.18 1.01 -1.26 -2.43 120.40 120.37 3mka s VAL 334 Ca 0.00 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 61.49 3mka s VAL 334 Cb 0.00 -2.48 -0.00 0.00 0.00 0.00 0.00 36.38 33.89 3mka s VAL 334 CO 0.00 0.44 -0.14 -0.31 0.00 0.00 0.00 175.10 175.10 3mka s TYR 335 N 1.27 1.32 -0.10 5.22 2.02 -0.45 -4.98 117.35 121.65 3mka s TYR 335 Ca 0.03 -0.32 -0.30 0.00 -0.37 0.00 0.00 57.07 56.12 3mka s TYR 335 Cb -0.14 -0.89 -0.03 0.00 -0.40 0.00 0.00 41.96 40.50 3mka s TYR 335 CO -0.02 -0.09 1.30 0.42 -1.57 0.00 0.00 175.55 175.58 3mka s ILE 336 N -0.05 4.13 -0.46 2.71 1.01 -1.26 -0.81 121.20 126.46 3mka s ILE 336 Ca -0.00 1.42 0.21 0.00 0.00 0.00 0.00 60.65 62.28 3mka s ILE 336 Cb -0.08 -3.91 -0.28 0.00 0.01 0.00 0.00 42.46 38.19 3mka s ILE 336 CO 0.01 -0.07 0.65 0.35 0.00 0.00 0.00 174.94 175.88 3mka n THR 337 N 5.03 0.00 -3.88 2.92 -2.24 0.53 -4.93 114.28 111.72 3mka n THR 337 Ca 0.13 -0.27 -0.03 0.00 -2.27 0.00 0.00 64.05 61.61 3mka n THR 337 Cb 0.45 0.46 0.02 0.00 -2.10 0.00 0.00 70.33 69.16 3mka n THR 337 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3mka s ASP 338 N -3.77 -0.01 0.62 3.42 1.47 -1.16 -4.60 116.67 112.65 3mka s ASP 338 Ca -0.01 -0.66 0.34 0.00 1.18 0.00 0.00 52.55 53.41 3mka s ASP 338 Cb 0.15 0.50 1.95 0.00 -0.34 0.00 0.00 42.92 45.17 3mka s ASP 338 CO 0.87 -0.98 2.21 0.44 0.68 0.00 0.00 175.17 178.39 3mka h ASP 339 N 2.00 0.00 0.00 2.11 3.32 -1.96 -3.01 116.42 118.89 3mka h ASP 339 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3mka h ASP 339 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.77 3mka h ASP 339 CO 0.35 0.00 -0.11 -1.22 -1.72 0.00 0.00 179.24 176.54 3mka n TYR 340 N -3.47 0.00 -3.73 4.55 4.01 -1.26 -0.53 117.16 116.72 3mka n TYR 340 Ca -0.02 -0.73 -0.13 0.00 -0.16 0.00 0.00 57.90 56.86 3mka n TYR 340 Cb 0.19 -0.12 -0.08 0.00 -0.31 0.00 0.00 39.34 39.02 3mka n TYR 340 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 3mka s THR 341 N -2.08 0.06 0.03 -0.72 -4.23 -1.14 -1.64 115.64 105.93 3mka s THR 341 Ca 0.22 -0.50 0.01 0.00 -1.18 0.00 0.00 61.69 60.25 3mka s THR 341 Cb 0.20 -0.76 -0.02 0.00 1.34 0.00 0.00 72.50 73.25 3mka s THR 341 CO 0.02 -0.27 -0.05 0.00 -0.54 0.00 0.00 174.62 173.78 3mka s ALA 342 N -1.77 0.37 -0.01 3.99 0.00 0.57 -0.35 121.76 124.57 3mka s ALA 342 Ca -0.10 -0.74 0.06 0.00 0.00 0.00 0.00 51.96 51.17 3mka s ALA 342 Cb -0.03 0.12 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 3mka s ALA 342 CO 0.02 -0.12 -0.19 0.95 0.00 0.00 0.00 175.76 176.42 3mka s THR 343 N -1.72 1.48 -0.12 0.00 -4.23 0.01 -0.94 115.64 110.11 3mka s THR 343 Ca -0.11 -0.85 0.03 0.00 -1.18 0.00 0.00 61.69 59.58 3mka s THR 343 Cb -0.08 -1.24 0.00 0.00 1.34 0.00 0.00 72.50 72.52 3mka s THR 343 CO -0.01 0.37 -0.22 -0.83 -0.54 0.00 0.00 174.62 173.39 3mka s GLY 344 N -0.55 1.37 -0.09 3.99 0.00 -0.30 -1.34 107.32 110.39 3mka s GLY 344 Ca 0.07 -1.02 0.04 0.00 0.00 0.00 0.00 44.72 43.81 3mka s GLY 344 CO -0.00 -0.17 -0.21 -0.42 0.00 0.00 0.00 173.10 172.30 3mka s ILE 345 N 0.57 1.81 0.08 0.90 1.01 -1.02 -0.28 121.20 124.27 3mka s ILE 345 Ca -0.13 -0.88 0.07 0.00 0.00 0.00 0.00 60.65 59.72 3mka s ILE 345 Cb -0.17 -1.58 -0.04 0.00 0.01 0.00 0.00 42.46 40.68 3mka s ILE 345 CO 0.04 0.51 -0.13 0.00 0.00 0.00 0.00 174.94 175.35 3mka s ALA 346 N 0.42 2.82 0.00 9.38 0.00 -0.98 -4.93 121.76 128.47 3mka s ALA 346 Ca -0.18 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 50.55 3mka s ALA 346 Cb -0.17 -0.83 0.00 0.00 0.00 0.00 0.00 23.12 22.12 3mka s ALA 346 CO 0.08 0.61 0.00 0.41 0.00 0.00 0.00 175.76 176.86 3mka n GLY 347 N 1.00 0.31 3.72 0.00 0.00 -1.26 -0.58 105.19 108.38 3mka n GLY 347 Ca -0.15 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 3mka n GLY 347 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mka s THR 348 N -2.24 3.87 0.14 2.61 2.01 0.41 -2.94 115.64 119.49 3mka s THR 348 Ca 0.00 1.44 -0.16 0.00 0.31 0.00 0.00 61.69 63.28 3mka s THR 348 Cb 0.00 -3.92 -0.00 0.00 0.01 0.00 0.00 72.50 68.59 3mka s THR 348 CO 0.00 0.17 1.70 0.00 -0.69 0.00 0.00 174.62 175.80 3mka h ALA 349 N 6.11 0.52 -0.21 7.40 0.00 -1.50 -0.51 119.26 131.08 3mka h ALA 349 Ca -0.43 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 3mka h ALA 349 Cb 1.21 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3mka h ALA 349 CO 0.78 0.10 0.10 0.00 0.00 0.00 0.00 179.25 180.23 3mka h ALA 350 N 1.03 0.27 -0.68 0.00 0.00 -1.93 -0.63 119.26 117.32 3mka h ALA 350 Ca 0.14 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3mka h ALA 350 Cb 0.15 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3mka h ALA 350 CO -0.01 -0.17 0.32 0.28 0.00 0.00 0.00 179.25 179.66 3mka h VAL 351 N 0.21 1.23 -0.51 0.00 2.07 -1.88 -0.91 116.25 116.45 3mka h VAL 351 Ca 0.07 -0.65 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 3mka h VAL 351 Cb 0.12 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 3mka h VAL 351 CO -0.01 0.27 0.25 0.00 0.02 0.00 0.00 177.57 178.10 3mka h ALA 352 N 1.15 0.66 -0.74 1.67 0.00 -0.68 -0.22 119.26 121.11 3mka h ALA 352 Ca 0.23 -0.12 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 3mka h ALA 352 Cb 0.13 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3mka h ALA 352 CO -0.03 0.22 0.24 -0.24 0.00 0.00 0.00 179.25 179.44 3mka h VAL 353 N 0.69 1.26 -0.72 0.00 3.04 -0.72 -0.94 116.25 118.86 3mka h VAL 353 Ca 0.18 -0.89 -0.07 0.00 -1.01 0.00 0.00 66.70 64.91 3mka h VAL 353 Cb 0.11 0.44 -0.03 0.00 -2.01 0.00 0.00 31.29 29.80 3mka h VAL 353 CO -0.02 0.35 0.17 -0.33 -1.01 0.00 0.00 177.57 176.73 3mka h GLU 354 N 1.09 1.15 -0.76 4.17 4.39 -0.81 -1.33 114.58 122.48 3mka h GLU 354 Ca 0.24 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 3mka h GLU 354 Cb 0.29 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 28.76 3mka h GLU 354 CO -0.01 1.01 0.44 0.74 -1.16 0.00 0.00 179.01 180.03 3mka h PHE 355 N 1.09 1.03 -0.45 4.33 -1.00 -0.62 -1.09 116.94 120.22 3mka h PHE 355 Ca 0.22 -0.01 -0.04 0.00 2.81 0.00 0.00 57.97 60.95 3mka h PHE 355 Cb 0.38 -0.33 -0.02 0.00 3.61 0.00 0.00 35.95 39.59 3mka h PHE 355 CO 0.03 0.70 0.13 0.00 -1.61 0.00 0.00 178.31 177.57 3mka h ALA 356 N 1.23 0.60 -0.38 2.45 0.00 -0.64 -1.74 119.26 120.77 3mka h ALA 356 Ca 0.27 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 3mka h ALA 356 Cb -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3mka h ALA 356 CO -0.05 0.26 0.02 -0.09 0.00 0.00 0.00 179.25 179.39 3mka h ARG 357 N 0.60 0.67 -0.15 0.00 2.43 -0.77 -3.04 114.38 114.12 3mka h ARG 357 Ca 0.15 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3mka h ARG 357 Cb 0.28 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 3mka h ARG 357 CO -0.00 0.76 0.09 1.25 -1.51 0.00 0.00 179.97 180.55 3mka h LEU 358 N 0.50 0.18 -1.27 3.80 5.85 -1.19 -2.61 115.31 120.57 3mka h LEU 358 Ca 0.11 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3mka h LEU 358 Cb 0.44 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 3mka h LEU 358 CO 0.02 0.19 0.32 0.22 -0.34 0.00 0.00 178.44 178.85 3mka h TYR 359 N 0.16 0.80 -0.30 1.25 3.20 -1.36 -0.33 116.97 120.38 3mka h TYR 359 Ca 0.05 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.77 3mka h TYR 359 Cb 0.05 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 3mka h TYR 359 CO -0.05 0.56 -0.38 0.00 -1.64 0.00 0.00 178.16 176.65 3mka h ALA 360 N 1.53 0.76 -0.29 1.82 0.00 -1.39 -1.65 119.26 120.04 3mka h ALA 360 Ca 0.21 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 3mka h ALA 360 Cb 0.03 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3mka h ALA 360 CO -0.03 0.66 -0.15 0.28 0.00 0.00 0.00 179.25 180.00 3mka h VAL 361 N 0.58 1.30 -0.65 0.00 2.07 -1.13 -2.15 116.25 116.27 3mka h VAL 361 Ca 0.05 -1.25 0.09 0.00 0.82 0.00 0.00 66.70 66.41 3mka h VAL 361 Cb 0.91 1.50 -0.07 0.00 -1.52 0.00 0.00 31.29 32.11 3mka h VAL 361 CO 0.08 0.40 0.29 -0.08 0.02 0.00 0.00 177.57 178.28 3mka h GLU 362 N 0.35 0.49 -0.43 1.57 4.57 -0.91 0.22 114.58 120.43 3mka h GLU 362 Ca 0.06 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.14 3mka h GLU 362 Cb 0.67 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.14 3mka h GLU 362 CO 0.04 0.32 -0.03 -0.07 -1.18 0.00 0.00 179.01 178.10 3mka h LEU 363 N 0.50 0.77 -0.53 1.64 4.07 -1.16 -2.76 115.31 117.84 3mka h LEU 363 Ca 0.32 -0.32 -0.06 0.00 0.08 0.00 0.00 57.88 57.89 3mka h LEU 363 Cb 0.36 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 3mka h LEU 363 CO -0.28 0.91 -0.29 -0.08 -1.08 0.00 0.00 178.44 177.62 3mka h GLU 364 N 0.61 0.00 -0.31 1.13 4.81 -0.99 -2.96 114.58 116.87 3mka h GLU 364 Ca 0.12 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 3mka h GLU 364 Cb 0.53 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 3mka h GLU 364 CO 0.03 0.29 -0.14 1.25 -0.73 0.00 0.00 179.01 179.71 3mka h HIS 365 N 0.00 0.74 -0.49 0.92 2.76 -0.43 -1.90 115.15 116.74 3mka h HIS 365 Ca -0.00 -0.18 -0.07 0.00 -2.20 0.00 0.00 60.37 57.91 3mka h HIS 365 Cb 1.02 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 29.79 3mka h HIS 365 CO 0.00 0.86 0.01 -0.92 -1.30 0.00 0.00 177.93 176.59 3mka h TYR 366 N 0.40 0.86 -0.50 5.26 3.20 -1.47 -1.41 116.97 123.31 3mka h TYR 366 Ca 0.07 -0.12 -0.08 0.00 3.14 0.00 0.00 58.73 61.75 3mka h TYR 366 Cb 0.66 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 3mka h TYR 366 CO 0.06 0.79 0.02 1.49 -1.64 0.00 0.00 178.16 178.88 3mka h GLU 367 N 0.76 0.88 -0.34 1.82 4.81 -1.35 0.44 114.58 121.60 3mka h GLU 367 Ca 0.15 -0.27 -0.14 0.00 -0.13 0.00 0.00 59.36 58.98 3mka h GLU 367 Cb 0.44 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 3mka h GLU 367 CO 0.02 0.90 -0.33 0.87 -0.73 0.00 0.00 179.01 179.74 3mka h LYS 368 N 0.74 0.76 -0.19 1.92 1.57 -1.17 0.69 116.57 120.89 3mka h LYS 368 Ca 0.15 -0.36 -0.18 0.00 -1.87 0.00 0.00 60.65 58.38 3mka h LYS 368 Cb 0.49 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.79 3mka h LYS 368 CO 0.02 0.98 -0.61 -0.07 -0.57 0.00 0.00 179.45 179.21 3mka h LEU 369 N 0.64 0.74 -1.88 2.94 3.38 -1.04 -3.29 115.31 116.80 3mka h LEU 369 Ca 0.07 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3mka h LEU 369 Cb 0.87 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3mka h LEU 369 CO 0.08 1.18 0.00 -0.62 0.09 0.00 0.00 178.44 179.16 3mka n GLU 370 N -3.95 1.62 -0.82 1.13 -0.58 0.13 -4.97 120.64 113.20 3mka n GLU 370 Ca -0.04 -1.66 0.00 0.00 -0.42 0.00 0.00 57.16 55.04 3mka n GLU 370 Cb 0.65 -1.34 0.00 0.00 -0.57 0.00 0.00 31.44 30.18 3mka n GLU 370 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3mka n GLY 371 N 0.96 0.24 3.19 0.62 0.00 0.24 -4.92 105.19 105.52 3mka n GLY 371 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 3mka n GLY 371 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mka s VAL 372 N -1.64 0.01 0.66 1.61 0.11 -1.16 -4.99 120.40 115.00 3mka s VAL 372 Ca 0.00 -0.08 -0.15 0.00 -2.93 0.00 0.00 61.98 58.82 3mka s VAL 372 Cb 0.00 -0.45 -0.00 0.00 -1.53 0.00 0.00 36.38 34.40 3mka s VAL 372 CO 0.00 -0.04 1.11 -2.16 -3.33 0.00 0.00 175.10 170.68 3mka s PRO 373 N -0.07 2.80 0.64 1.54 0.04 -1.26 -4.20 135.00 134.50 3mka s PRO 373 Ca -0.02 1.41 -0.17 0.00 0.04 0.00 0.00 61.00 62.26 3mka s PRO 373 Cb -0.03 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.56 3mka s PRO 373 CO 0.01 -1.25 1.22 -1.17 0.04 0.00 0.00 177.00 175.85 3mka s LEU 374 N -4.83 3.54 0.86 -3.56 2.96 -1.26 -5.00 118.68 111.39 3mka s LEU 374 Ca 0.67 2.41 -0.11 0.00 -0.22 0.00 0.00 54.13 56.88 3mka s LEU 374 Cb -0.21 -4.60 0.11 0.00 0.50 0.00 0.00 46.19 41.99 3mka s LEU 374 CO 0.41 -1.86 1.09 0.42 -1.32 0.00 0.00 176.35 175.10 3mka s THR 375 N -1.69 2.82 0.13 3.68 -4.23 -1.26 -4.79 115.64 110.30 3mka s THR 375 Ca 0.77 0.26 -0.19 0.00 -1.18 0.00 0.00 61.69 61.36 3mka s THR 375 Cb -0.31 -2.81 -0.02 0.00 1.34 0.00 0.00 72.50 70.70 3mka s THR 375 CO 0.38 -0.35 1.74 0.15 -0.54 0.00 0.00 174.62 176.00 3mka h PHE 376 N -1.40 0.10 -0.43 3.99 3.57 -1.98 0.06 116.94 120.84 3mka h PHE 376 Ca -0.48 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.12 3mka h PHE 376 Cb 1.27 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.98 3mka h PHE 376 CO 0.45 0.04 0.30 0.00 -2.23 0.00 0.00 178.31 176.86 3mka h ALA 377 N 1.17 2.15 -0.08 2.41 0.00 -2.00 0.07 119.26 122.99 3mka h ALA 377 Ca 0.11 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 3mka h ALA 377 Cb 0.10 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3mka h ALA 377 CO -0.14 -0.26 -0.68 0.78 0.00 0.00 0.00 179.25 178.95 3mka h GLY 378 N 0.19 0.40 0.97 0.00 0.00 -1.37 -2.00 103.07 101.26 3mka h GLY 378 Ca 0.20 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 3mka h GLY 378 CO -0.03 0.49 0.19 0.50 0.00 0.00 0.00 176.54 177.68 3mka h LYS 379 N 0.26 0.73 0.26 4.80 1.57 0.09 -1.41 116.57 122.86 3mka h LYS 379 Ca -0.02 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 3mka h LYS 379 Cb 1.24 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 3mka h LYS 379 CO 0.11 0.66 -0.15 0.82 -0.57 0.00 0.00 179.45 180.32 3mka h ILE 380 N 0.64 0.68 -0.46 1.86 2.04 -1.23 -1.70 117.51 119.35 3mka h ILE 380 Ca 0.16 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.07 3mka h ILE 380 Cb 0.21 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 3mka h ILE 380 CO -0.01 0.00 0.31 -1.13 0.00 0.00 0.00 178.15 177.31 3mka h ASN 381 N -0.40 0.36 -0.09 1.72 -0.73 -1.18 -0.81 115.58 114.46 3mka h ASN 381 Ca -0.03 -0.00 -0.24 0.00 1.87 0.00 0.00 56.30 57.91 3mka h ASN 381 Cb 0.33 -0.08 0.01 0.00 0.27 0.00 0.00 38.32 38.85 3mka h ASN 381 CO 0.03 0.24 -0.86 -0.09 -0.37 0.00 0.00 177.43 176.39 3mka h ARG 382 N 0.42 0.76 -0.53 6.67 9.65 -1.01 -2.44 114.38 127.90 3mka h ARG 382 Ca 0.19 -0.67 -0.03 0.00 -1.10 0.00 0.00 59.98 58.38 3mka h ARG 382 Cb 0.24 0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 28.96 3mka h ARG 382 CO -0.05 1.27 0.23 1.25 2.80 0.00 0.00 179.97 185.47 3mka h LEU 383 N 0.49 0.71 -1.28 3.80 5.85 -0.41 -2.83 115.31 121.65 3mka h LEU 383 Ca -0.07 -0.15 0.10 0.00 0.84 0.00 0.00 57.88 58.59 3mka h LEU 383 Cb 1.49 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 42.28 3mka h LEU 383 CO 0.17 0.67 0.55 0.00 -0.34 0.00 0.00 178.44 179.49 3mka h ALA 384 N 1.07 1.72 -0.31 1.25 0.00 -1.10 -0.19 119.26 121.69 3mka h ALA 384 Ca 0.18 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 3mka h ALA 384 Cb 0.17 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3mka h ALA 384 CO -0.02 0.10 -0.45 0.82 0.00 0.00 0.00 179.25 179.71 3mka h ILE 385 N 0.79 1.28 -0.56 0.00 2.04 -1.20 -0.41 117.51 119.46 3mka h ILE 385 Ca 0.40 -1.63 -0.01 0.00 1.00 0.00 0.00 64.86 64.61 3mka h ILE 385 Cb 0.46 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 3mka h ILE 385 CO -0.16 0.53 0.31 0.24 0.00 0.00 0.00 178.15 179.07 3mka h MET 386 N 0.62 0.77 0.70 2.37 2.86 -1.14 -0.67 114.93 120.45 3mka h MET 386 Ca 0.03 -0.09 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 3mka h MET 386 Cb 1.05 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 32.56 3mka h MET 386 CO 0.10 0.58 -0.33 0.28 1.06 0.00 0.00 176.91 178.60 3mka h VAL 387 N 0.75 0.00 -1.09 -2.22 2.07 -0.93 -3.05 116.25 111.77 3mka h VAL 387 Ca 0.20 -0.08 0.30 0.00 0.82 0.00 0.00 66.70 67.94 3mka h VAL 387 Cb 0.03 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.70 3mka h VAL 387 CO -0.03 0.00 0.71 -0.09 0.02 0.00 0.00 177.57 178.17 3mka h ARG 388 N -1.01 0.31 -0.27 1.57 2.43 -1.01 0.33 114.38 116.73 3mka h ARG 388 Ca -0.10 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3mka h ARG 388 Cb 0.72 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.20 3mka h ARG 388 CO 0.16 0.20 0.00 0.41 -1.51 0.00 0.00 179.97 179.23 3mka n GLY 389 N -1.49 -0.17 0.00 2.80 0.00 -0.26 -2.57 105.19 103.50 3mka n GLY 389 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.29 3mka n GLY 389 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3mka n ASN 390 N -0.31 0.56 -0.25 1.61 5.15 0.12 -4.80 115.26 117.34 3mka n ASN 390 Ca 0.00 -0.80 0.06 0.00 -0.60 0.00 0.00 54.58 53.24 3mka n ASN 390 Cb 0.07 0.31 0.17 0.00 -0.53 0.00 0.00 39.78 39.80 3mka n ASN 390 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3mka h LEU 391 N 0.00 -0.18 0.29 1.20 5.85 -1.52 0.26 115.31 121.21 3mka h LEU 391 Ca 0.00 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.90 3mka h LEU 391 Cb 0.04 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 3mka h LEU 391 CO 0.00 -0.12 -0.42 0.00 -0.34 0.00 0.00 178.44 177.56 3mka h ALA 392 N 1.67 -0.85 -0.99 1.25 0.00 -1.87 -2.06 119.26 116.41 3mka h ALA 392 Ca 0.42 -0.12 0.15 0.00 0.00 0.00 0.00 54.91 55.36 3mka h ALA 392 Cb 0.74 0.65 -0.09 0.00 0.00 0.00 0.00 17.79 19.08 3mka h ALA 392 CO -0.60 -1.03 0.61 0.00 0.00 0.00 0.00 179.25 178.24 3mka h ALA 393 N -0.37 1.56 0.00 0.00 0.00 -1.63 -1.38 119.26 117.43 3mka h ALA 393 Ca -0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3mka h ALA 393 Cb 0.72 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 3mka h ALA 393 CO -0.14 0.10 -0.07 0.00 0.00 0.00 0.00 179.25 179.14 3mka h ALA 394 N 1.58 1.09 0.00 0.00 0.00 -0.42 -0.76 119.26 120.76 3mka h ALA 394 Ca 0.53 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.31 3mka h ALA 394 Cb 0.66 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3mka h ALA 394 CO -0.32 0.09 -0.31 0.52 0.00 0.00 0.00 179.25 179.23 3mka h MET 395 N 0.00 0.00 -0.63 0.00 2.86 -0.58 -2.96 114.93 113.62 3mka h MET 395 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3mka h MET 395 Cb 0.39 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.05 3mka h MET 395 CO 0.01 0.31 0.00 1.04 1.06 0.00 0.00 176.91 179.33 3mka n GLN 396 N -3.24 4.11 0.00 1.72 6.02 -0.32 -4.94 117.38 120.72 3mka n GLN 396 Ca 0.02 -2.75 0.00 0.00 -0.01 0.00 0.00 57.00 54.26 3mka n GLN 396 Cb 0.60 -2.05 0.00 0.00 1.02 0.00 0.00 30.24 29.81 3mka n GLN 396 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3mka n GLY 397 N 0.78 3.32 2.19 1.08 0.00 -1.12 -4.95 105.19 106.49 3mka n GLY 397 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 3mka n GLY 397 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mka n LEU 398 N 0.00 7.21 -4.80 0.99 4.77 -1.01 -4.77 117.00 119.40 3mka n LEU 398 Ca 0.00 -3.83 -0.35 0.00 -0.03 0.00 0.00 56.01 51.80 3mka n LEU 398 Cb 0.00 -1.49 -0.05 0.00 -2.33 0.00 0.00 43.42 39.55 3mka n LEU 398 CO 0.00 1.89 0.68 -0.22 -1.33 0.00 0.00 177.39 178.41 3mka s LEU 399 N 0.10 4.02 -0.30 2.23 2.96 -1.26 -3.98 118.68 122.44 3mka s LEU 399 Ca 0.68 1.84 0.00 0.00 -0.22 0.00 0.00 54.13 56.43 3mka s LEU 399 Cb 0.24 -4.39 0.14 0.00 0.50 0.00 0.00 46.19 42.67 3mka s LEU 399 CO -0.03 -0.44 0.32 0.00 -1.32 0.00 0.00 176.35 174.87 3mka s ALA 400 N -1.94 -0.50 -0.45 5.97 0.00 -1.26 -0.44 121.76 123.14 3mka s ALA 400 Ca 0.61 -0.41 -0.14 0.00 0.00 0.00 0.00 51.96 52.02 3mka s ALA 400 Cb -0.15 -1.86 0.07 0.00 0.00 0.00 0.00 23.12 21.18 3mka s ALA 400 CO 0.19 -1.79 0.34 -1.17 0.00 0.00 0.00 175.76 173.33 3mka s LEU 401 N 2.20 5.42 0.37 0.00 2.96 0.25 -4.93 118.68 124.95 3mka s LEU 401 Ca 0.11 -1.33 -0.10 0.00 -0.22 0.00 0.00 54.13 52.59 3mka s LEU 401 Cb -0.14 -2.12 -0.07 0.00 0.50 0.00 0.00 46.19 44.36 3mka s LEU 401 CO -0.28 -0.59 0.72 -2.16 -1.32 0.00 0.00 176.35 172.72 3mka s PRO 402 N 1.58 3.78 -0.08 0.98 0.04 -1.26 -2.33 135.00 137.71 3mka s PRO 402 Ca 0.04 0.40 0.03 0.00 0.04 0.00 0.00 61.00 61.51 3mka s PRO 402 Cb -0.23 -2.45 0.01 0.00 0.04 0.00 0.00 34.50 31.86 3mka s PRO 402 CO 0.06 0.05 -0.18 -1.17 0.04 0.00 0.00 177.00 175.79 3mka s LEU 403 N -3.64 1.87 -0.10 -3.56 2.96 0.61 -3.27 118.68 113.54 3mka s LEU 403 Ca 0.50 -0.42 0.02 0.00 -0.22 0.00 0.00 54.13 54.01 3mka s LEU 403 Cb -0.10 -1.10 -0.01 0.00 0.50 0.00 0.00 46.19 45.47 3mka s LEU 403 CO 0.29 0.10 -0.17 -0.22 -1.32 0.00 0.00 176.35 175.03 3mka s LEU 404 N 0.45 2.49 -0.04 -0.68 2.96 -0.00 -1.15 118.68 122.70 3mka s LEU 404 Ca -0.15 -0.39 0.05 0.00 -0.22 0.00 0.00 54.13 53.42 3mka s LEU 404 Cb -0.16 -1.53 -0.01 0.00 0.50 0.00 0.00 46.19 44.99 3mka s LEU 404 CO 0.06 0.20 -0.19 0.00 -1.32 0.00 0.00 176.35 175.09 3mka s ALA 405 N 0.15 1.68 0.16 5.97 0.00 -0.12 -0.79 121.76 128.81 3mka s ALA 405 Ca -0.09 -0.78 -0.17 0.00 0.00 0.00 0.00 51.96 50.91 3mka s ALA 405 Cb -0.15 -0.54 0.04 0.00 0.00 0.00 0.00 23.12 22.46 3mka s ALA 405 CO 0.06 0.32 0.47 0.20 0.00 0.00 0.00 175.76 176.81 3mka s GLY 406 N -0.04 -0.23 -0.13 0.00 0.00 -0.39 -0.32 107.32 106.22 3mka s GLY 406 Ca -0.03 -0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.63 3mka s GLY 406 CO 0.02 -0.24 -0.17 -0.47 0.00 0.00 0.00 173.10 172.24 3mka s TYR 407 N -3.83 2.73 -0.35 1.90 5.04 -0.65 0.18 117.35 122.37 3mka s TYR 407 Ca 0.06 -0.87 -0.14 0.00 -2.44 0.00 0.00 57.07 53.68 3mka s TYR 407 Cb 0.00 -1.81 -0.01 0.00 0.35 0.00 0.00 41.96 40.49 3mka s TYR 407 CO -0.08 -0.34 0.30 0.34 -1.34 0.00 0.00 175.55 174.42 3mka s ASP 408 N 0.46 6.11 0.23 4.32 2.15 -0.99 -4.87 116.67 124.09 3mka s ASP 408 Ca -0.12 -0.37 -0.06 0.00 0.43 0.00 0.00 52.55 52.43 3mka s ASP 408 Cb -0.16 -2.16 0.22 0.00 -0.30 0.00 0.00 42.92 40.52 3mka s ASP 408 CO 0.05 -0.29 1.76 0.16 -0.17 0.00 0.00 175.17 176.68 3mka h ILE 409 N 5.52 1.25 -0.00 4.11 3.07 -1.98 -2.43 117.51 127.05 3mka h ILE 409 Ca -0.30 -0.91 0.00 0.00 1.55 0.00 0.00 64.86 65.20 3mka h ILE 409 Cb 1.15 0.55 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 3mka h ILE 409 CO 0.66 0.35 -0.02 1.41 -1.05 0.00 0.00 178.15 179.50 3mka n HIS 410 N -4.25 0.00 -1.91 0.16 8.25 -1.26 -4.83 115.22 111.38 3mka n HIS 410 Ca 0.05 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.12 3mka n HIS 410 Cb 0.24 -0.10 0.01 0.00 1.12 0.00 0.00 29.99 31.26 3mka n HIS 410 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3mka s ALA 411 N -2.23 3.19 0.21 -1.41 0.00 -0.92 -4.92 121.76 115.68 3mka s ALA 411 Ca 0.39 1.34 -0.09 0.00 0.00 0.00 0.00 51.96 53.60 3mka s ALA 411 Cb 0.21 -3.54 0.15 0.00 0.00 0.00 0.00 23.12 19.94 3mka s ALA 411 CO 0.41 -1.06 1.79 0.66 0.00 0.00 0.00 175.76 177.57 3mka h SER 412 N 2.34 1.04 -3.33 0.00 4.64 -1.88 -3.42 113.55 112.94 3mka h SER 412 Ca -0.50 -0.14 -0.65 0.00 -0.47 0.00 0.00 61.79 60.02 3mka h SER 412 Cb 1.26 -0.27 -0.27 0.00 -0.31 0.00 0.00 62.40 62.82 3mka h SER 412 CO 0.61 0.89 -0.74 -0.62 -0.87 0.00 0.00 176.83 176.10 3mka s ASP 413 N -6.24 4.17 0.20 4.97 2.15 -1.26 -5.01 116.67 115.65 3mka s ASP 413 Ca -0.13 -0.33 -0.09 0.00 0.43 0.00 0.00 52.55 52.44 3mka s ASP 413 Cb 0.15 -1.67 0.14 0.00 -0.30 0.00 0.00 42.92 41.25 3mka s ASP 413 CO 0.82 0.11 1.78 1.55 -0.17 0.00 0.00 175.17 179.26 3mka h PRO 414 N 7.12 1.12 -0.69 4.34 0.13 -1.94 -1.96 132.00 140.11 3mka h PRO 414 Ca -0.31 -0.19 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 3mka h PRO 414 Cb 1.19 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 32.10 3mka h PRO 414 CO 0.58 0.90 0.22 1.96 -0.23 0.00 0.00 178.00 181.43 3mka h GLN 415 N 1.08 1.06 -0.59 0.86 1.08 -1.94 -2.82 115.11 113.85 3mka h GLN 415 Ca 0.26 -0.21 0.00 0.00 -1.45 0.00 0.00 58.65 57.24 3mka h GLN 415 Cb 0.18 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 3mka h GLN 415 CO -0.03 0.90 0.00 -1.13 -0.95 0.00 0.00 178.83 177.63 3mka n SER 416 N -4.26 3.38 -0.20 1.46 3.41 -1.09 -1.45 113.62 114.87 3mka n SER 416 Ca 0.06 -2.20 -0.01 0.00 -0.26 0.00 0.00 58.87 56.46 3mka n SER 416 Cb 0.22 -0.45 0.22 0.00 -0.26 0.00 0.00 64.21 63.94 3mka n SER 416 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mka h ALA 417 N 3.85 1.36 -2.97 7.33 0.00 -1.09 -3.46 119.26 124.29 3mka h ALA 417 Ca 0.00 -0.11 -0.54 0.00 0.00 0.00 0.00 54.91 54.26 3mka h ALA 417 Cb 0.98 -0.28 0.11 0.00 0.00 0.00 0.00 17.79 18.61 3mka h ALA 417 CO 0.11 0.52 0.73 0.20 0.00 0.00 0.00 179.25 180.81 3mka s GLY 418 N -3.44 2.93 0.01 0.00 0.00 -1.26 -2.35 107.32 103.21 3mka s GLY 418 Ca -0.11 1.50 0.05 0.00 0.00 0.00 0.00 44.72 46.16 3mka s GLY 418 CO 0.79 2.14 -0.14 0.50 0.00 0.00 0.00 173.10 176.38 3mka s ARG 419 N -2.32 1.08 -0.05 2.90 1.81 0.47 -4.93 118.95 117.90 3mka s ARG 419 Ca 0.58 -0.62 0.01 0.00 -1.72 0.00 0.00 55.73 53.98 3mka s ARG 419 Cb -0.45 -1.07 0.02 0.00 -0.45 0.00 0.00 34.95 33.01 3mka s ARG 419 CO 0.59 0.28 -0.05 0.42 -0.68 0.00 0.00 175.30 175.86 3mka s ILE 420 N -0.55 0.62 -0.04 1.52 1.01 -1.26 -1.26 121.20 121.24 3mka s ILE 420 Ca 0.04 -0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.55 3mka s ILE 420 Cb -0.06 -0.65 0.01 0.00 0.01 0.00 0.00 42.46 41.77 3mka s ILE 420 CO 0.00 0.25 -0.08 -0.69 0.00 0.00 0.00 174.94 174.42 3mka s VAL 421 N 1.01 0.78 0.18 2.92 1.01 0.03 -1.44 120.40 124.90 3mka s VAL 421 Ca -0.09 -0.30 0.09 0.00 0.00 0.00 0.00 61.98 61.68 3mka s VAL 421 Cb -0.14 -0.74 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 3mka s VAL 421 CO -0.00 0.27 -0.11 -0.94 0.00 0.00 0.00 175.10 174.32 3mka s SER 422 N 0.62 4.19 -0.05 3.32 1.04 -0.28 -0.82 113.70 121.72 3mka s SER 422 Ca -0.10 -0.61 0.04 0.00 0.48 0.00 0.00 55.95 55.76 3mka s SER 422 Cb -0.13 -0.68 -0.00 0.00 0.10 0.00 0.00 66.02 65.30 3mka s SER 422 CO 0.01 0.10 -0.17 -0.36 0.98 0.00 0.00 173.24 173.80 3mka s PHE 423 N -1.72 1.77 0.60 5.02 0.08 -1.20 -0.85 117.98 121.67 3mka s PHE 423 Ca 0.25 -0.54 -0.04 0.00 0.12 0.00 0.00 56.93 56.72 3mka s PHE 423 Cb -0.09 -1.20 0.03 0.00 -0.57 0.00 0.00 43.02 41.20 3mka s PHE 423 CO 0.15 -0.19 0.88 0.16 -0.10 0.00 0.00 175.22 176.12 3mka s ASP 424 N 0.10 5.31 0.42 1.36 1.47 -0.10 -4.65 116.67 120.58 3mka s ASP 424 Ca -0.06 0.42 0.26 0.00 1.18 0.00 0.00 52.55 54.36 3mka s ASP 424 Cb -0.12 -1.32 1.43 0.00 -0.34 0.00 0.00 42.92 42.57 3mka s ASP 424 CO 0.03 -1.20 1.79 0.00 0.68 0.00 0.00 175.17 176.47 3mka h ALA 425 N -0.18 1.04 -0.22 2.11 0.00 -1.95 -1.48 119.26 118.58 3mka h ALA 425 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3mka h ALA 425 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3mka h ALA 425 CO 0.58 -0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.79 3mka n ALA 426 N -1.83 2.48 0.00 0.00 0.00 -1.26 -4.41 120.51 115.49 3mka n ALA 426 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.72 3mka n ALA 426 Cb 0.10 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.56 3mka n ALA 426 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mka n GLY 427 N 1.29 0.50 3.68 0.00 0.00 -0.56 -4.41 105.19 105.69 3mka n GLY 427 Ca 0.17 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.74 3mka n GLY 427 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mka n GLY 428 N -2.00 1.02 3.44 -0.02 0.00 -1.26 -4.74 105.19 101.64 3mka n GLY 428 Ca 0.00 0.58 -0.28 0.00 0.00 0.00 0.00 46.02 46.33 3mka n GLY 428 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3mka s TRP 429 N 0.51 2.37 -0.04 1.61 1.48 -1.26 -0.92 118.94 122.69 3mka s TRP 429 Ca 0.74 -0.34 -0.04 0.00 -1.06 0.00 0.00 56.10 55.41 3mka s TRP 429 Cb -0.65 -1.21 0.01 0.00 -1.16 0.00 0.00 33.47 30.46 3mka s TRP 429 CO 0.43 0.45 0.11 1.21 -4.06 0.00 0.00 176.95 175.09 3mka s ASN 430 N -2.48 -0.11 -0.34 -2.66 2.47 -0.03 -4.96 114.94 106.82 3mka s ASN 430 Ca 0.19 0.22 -0.13 0.00 0.42 0.00 0.00 52.86 53.57 3mka s ASN 430 Cb -0.09 0.21 -0.02 0.00 -1.45 0.00 0.00 41.25 39.91 3mka s ASN 430 CO 0.10 -0.05 0.24 -0.63 -3.72 0.00 0.00 177.10 173.03 3mka s ILE 431 N 0.19 5.25 0.42 -5.21 1.01 -1.26 -1.12 121.20 120.47 3mka s ILE 431 Ca -0.01 -0.23 -0.25 0.00 0.00 0.00 0.00 60.65 60.16 3mka s ILE 431 Cb -0.02 -3.70 -0.08 0.00 0.01 0.00 0.00 42.46 38.67 3mka s ILE 431 CO -0.01 -0.01 1.25 -1.61 0.00 0.00 0.00 174.94 174.57 3mka s GLU 432 N 1.72 3.93 0.00 2.79 0.41 -0.52 -4.89 118.70 122.13 3mka s GLU 432 Ca 0.06 2.03 0.04 0.00 -0.41 0.00 0.00 54.97 56.70 3mka s GLU 432 Cb -0.17 -2.68 -0.02 0.00 -1.78 0.00 0.00 34.13 29.48 3mka s GLU 432 CO 0.10 -0.48 0.31 0.39 -0.49 0.00 0.00 175.26 175.09 3mka n GLU 433 N 0.00 3.95 0.17 1.61 -0.58 -1.26 -4.50 120.64 120.04 3mka n GLU 433 Ca 0.05 -0.22 0.03 0.00 -0.42 0.00 0.00 57.16 56.59 3mka n GLU 433 Cb 0.45 -0.81 0.29 0.00 -0.57 0.00 0.00 31.44 30.80 3mka n GLU 433 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 3mka h GLU 434 N 0.26 0.00 0.00 3.49 4.39 -1.99 -3.47 114.58 117.26 3mka h GLU 434 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3mka h GLU 434 Cb 0.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 3mka h GLU 434 CO 0.00 0.46 0.00 0.41 -1.16 0.00 0.00 179.01 178.72 3mka n GLY 435 N 0.06 2.21 3.41 -3.84 0.00 -1.26 -5.06 105.19 100.70 3mka n GLY 435 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3mka n GLY 435 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mka s TYR 436 N -2.24 -0.03 0.16 1.61 -0.85 -1.26 -0.83 117.35 113.90 3mka s TYR 436 Ca 0.00 -0.31 -0.24 0.00 -0.52 0.00 0.00 57.07 56.00 3mka s TYR 436 Cb 0.00 0.24 0.06 0.00 0.38 0.00 0.00 41.96 42.64 3mka s TYR 436 CO 0.00 -0.79 0.73 -1.14 -1.52 0.00 0.00 175.55 172.82 3mka s GLN 437 N -3.87 1.30 0.09 -3.49 2.00 -0.22 -4.94 119.66 110.53 3mka s GLN 437 Ca 0.09 -0.58 -0.17 0.00 -2.00 0.00 0.00 55.36 52.69 3mka s GLN 437 Cb 0.01 0.53 0.04 0.00 0.80 0.00 0.00 33.01 34.39 3mka s GLN 437 CO -0.06 -0.58 0.41 0.00 -0.50 0.00 0.00 175.29 174.56 3mka s ALA 438 N -3.61 -0.97 0.07 1.58 0.00 -1.26 -1.53 121.76 116.03 3mka s ALA 438 Ca 0.05 0.10 -0.06 0.00 0.00 0.00 0.00 51.96 52.05 3mka s ALA 438 Cb -0.02 0.56 -0.01 0.00 0.00 0.00 0.00 23.12 23.64 3mka s ALA 438 CO -0.06 -0.57 0.11 0.14 0.00 0.00 0.00 175.76 175.39 3mka s VAL 439 N -3.28 0.16 0.00 0.00 -7.23 -0.15 -4.92 120.40 104.98 3mka s VAL 439 Ca -0.00 -1.33 0.00 0.00 -1.81 0.00 0.00 61.98 58.84 3mka s VAL 439 Cb 0.01 -1.30 0.00 0.00 0.56 0.00 0.00 36.38 35.65 3mka s VAL 439 CO -0.08 -0.74 0.00 0.61 -0.31 0.00 0.00 175.10 174.58 3mka n GLY 440 N 0.15 1.01 0.27 2.32 0.00 -1.26 -0.59 105.19 107.10 3mka n GLY 440 Ca -0.16 -2.20 0.11 0.00 0.00 0.00 0.00 46.02 43.77 3mka n GLY 440 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mka h SER 441 N 0.00 0.00 -0.54 1.61 4.64 -1.84 -2.03 113.55 115.40 3mka h SER 441 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3mka h SER 441 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3mka h SER 441 CO 0.00 0.08 0.00 0.61 -0.87 0.00 0.00 176.83 176.65 3mka n GLY 442 N -1.05 2.88 0.27 -0.77 0.00 -1.26 -4.64 105.19 100.62 3mka n GLY 442 Ca -0.02 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.35 3mka n GLY 442 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mka h SER 443 N 3.29 0.01 -0.22 1.61 4.64 -1.59 -1.08 113.55 120.20 3mka h SER 443 Ca 0.00 -0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 3mka h SER 443 Cb 1.17 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 3mka h SER 443 CO 0.12 0.00 -0.35 -0.07 -0.87 0.00 0.00 176.83 175.66 3mka h LEU 444 N 0.01 0.79 -0.32 5.97 4.07 -1.82 -0.85 115.31 123.15 3mka h LEU 444 Ca 0.02 -0.34 -0.06 0.00 0.08 0.00 0.00 57.88 57.59 3mka h LEU 444 Cb 0.09 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.60 3mka h LEU 444 CO -0.00 1.06 -0.04 -0.26 -1.08 0.00 0.00 178.44 178.12 3mka h PHE 445 N 0.62 0.66 -0.74 1.13 0.04 -1.60 -1.71 116.94 115.34 3mka h PHE 445 Ca 0.06 -0.13 -0.04 0.00 2.80 0.00 0.00 57.97 60.67 3mka h PHE 445 Cb 0.89 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.84 3mka h PHE 445 CO 0.05 0.75 0.33 0.00 -0.60 0.00 0.00 178.31 178.83 3mka h ALA 446 N 0.82 0.96 -0.50 2.45 0.00 -1.18 -1.53 119.26 120.27 3mka h ALA 446 Ca 0.09 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3mka h ALA 446 Cb 0.51 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3mka h ALA 446 CO 0.02 0.55 -0.12 0.87 0.00 0.00 0.00 179.25 180.58 3mka h LYS 447 N 1.05 0.93 -0.11 0.00 1.57 -1.05 -1.31 116.57 117.65 3mka h LYS 447 Ca 0.25 -0.33 -0.11 0.00 -1.87 0.00 0.00 60.65 58.59 3mka h LYS 447 Cb 0.17 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 3mka h LYS 447 CO -0.03 0.99 -0.41 0.77 -0.57 0.00 0.00 179.45 180.20 3mka h SER 448 N 0.83 0.26 -0.02 0.86 0.02 -0.97 -0.72 113.55 113.81 3mka h SER 448 Ca 0.13 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3mka h SER 448 Cb 0.65 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 3mka h SER 448 CO 0.05 0.65 -0.00 -1.28 -1.14 0.00 0.00 176.83 175.10 3mka h SER 449 N 0.21 0.04 -0.42 3.07 0.87 -1.06 -3.09 113.55 113.17 3mka h SER 449 Ca 0.02 -0.37 -0.02 0.00 -1.23 0.00 0.00 61.79 60.19 3mka h SER 449 Cb 0.82 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.75 3mka h SER 449 CO 0.06 0.40 0.21 0.24 -0.53 0.00 0.00 176.83 177.21 3mka h MET 450 N -0.32 0.64 -0.73 2.24 2.07 -1.08 -0.83 114.93 116.92 3mka h MET 450 Ca 0.00 -0.08 0.18 0.00 -2.07 0.00 0.00 59.70 57.73 3mka h MET 450 Cb 0.38 -0.12 -0.04 0.00 -1.87 0.00 0.00 31.60 29.94 3mka h MET 450 CO 0.00 0.51 0.50 -0.22 1.07 0.00 0.00 176.91 178.78 3mka h LYS 451 N 0.65 0.21 0.10 1.72 3.64 -1.05 0.10 116.57 121.95 3mka h LYS 451 Ca 0.16 -0.01 -0.32 0.00 -1.27 0.00 0.00 60.65 59.21 3mka h LYS 451 Cb 0.09 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3mka h LYS 451 CO -0.02 0.14 -1.72 0.87 -2.27 0.00 0.00 179.45 176.45 3mka h LYS 452 N 0.22 0.22 0.00 1.90 1.79 -1.19 -3.39 116.57 116.12 3mka h LYS 452 Ca 0.36 -0.38 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 3mka h LYS 452 Cb 1.09 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 3mka h LYS 452 CO -0.07 1.18 0.00 1.28 -1.08 0.00 0.00 179.45 180.76 3mka n LEU 453 N -3.77 0.49 -0.31 2.94 4.77 -0.59 -4.37 117.00 116.15 3mka n LEU 453 Ca -0.30 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 3mka n LEU 453 Cb 0.95 -0.43 0.13 0.00 -2.33 0.00 0.00 43.42 41.74 3mka n LEU 453 CO 0.38 -0.21 1.20 0.22 -1.33 0.00 0.00 177.39 177.66 3mka h TYR 454 N 0.00 1.01 0.00 -1.77 3.20 -1.00 -2.04 116.97 116.37 3mka h TYR 454 Ca 0.00 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.90 3mka h TYR 454 Cb 0.56 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.50 3mka h TYR 454 CO 0.00 0.54 0.19 0.66 -1.64 0.00 0.00 178.16 177.90 3mka h SER 455 N 1.01 0.00 0.22 -2.11 4.64 -1.86 0.50 113.55 115.95 3mka h SER 455 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 3mka h SER 455 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3mka h SER 455 CO -0.16 0.00 -0.04 0.00 -0.87 0.00 0.00 176.83 175.76 3mka n GLN 456 N -2.87 0.90 -3.05 4.77 6.02 -0.77 -4.77 117.38 117.61 3mka n GLN 456 Ca -0.02 -0.23 -0.42 0.00 -0.01 0.00 0.00 57.00 56.32 3mka n GLN 456 Cb 0.24 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.95 3mka n GLN 456 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3mka s VAL 457 N -2.26 4.86 0.00 5.09 1.01 0.17 -4.77 120.40 124.49 3mka s VAL 457 Ca 0.36 0.86 0.00 0.00 0.00 0.00 0.00 61.98 63.21 3mka s VAL 457 Cb 0.21 -4.09 0.00 0.00 0.00 0.00 0.00 36.38 32.50 3mka s VAL 457 CO 0.42 -0.26 0.06 0.35 0.00 0.00 0.00 175.10 175.66 3mka n THR 458 N 5.55 0.00 -3.72 3.92 -2.24 -1.26 -4.92 114.28 111.61 3mka n THR 458 Ca 0.01 -0.31 -0.05 0.00 -2.27 0.00 0.00 64.05 61.43 3mka n THR 458 Cb 0.48 1.07 -0.02 0.00 -2.10 0.00 0.00 70.33 69.77 3mka n THR 458 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3mka s ASP 459 N -0.50 -0.23 0.41 3.42 1.47 -1.26 -4.70 116.67 115.28 3mka s ASP 459 Ca 0.00 -0.35 0.22 0.00 1.18 0.00 0.00 52.55 53.60 3mka s ASP 459 Cb 0.00 0.50 1.23 0.00 -0.34 0.00 0.00 42.92 44.31 3mka s ASP 459 CO 0.00 -0.91 1.70 1.23 0.68 0.00 0.00 175.17 177.87 3mka h GLY 460 N 2.00 1.37 1.07 2.12 0.00 -1.94 -1.38 103.07 106.31 3mka h GLY 460 Ca -0.24 -0.17 -0.20 0.00 0.00 0.00 0.00 47.33 46.72 3mka h GLY 460 CO 0.26 -0.29 -0.71 -0.55 0.00 0.00 0.00 176.54 175.26 3mka h ASP 461 N 0.26 0.83 -0.11 0.19 3.32 -1.98 -0.73 116.42 118.21 3mka h ASP 461 Ca 0.70 -0.65 -0.14 0.00 0.02 0.00 0.00 57.03 56.97 3mka h ASP 461 Cb 1.94 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 41.24 3mka h ASP 461 CO -0.39 1.34 -0.39 0.77 -1.72 0.00 0.00 179.24 178.85 3mka h SER 462 N 0.37 0.67 -0.27 6.45 4.64 -1.74 -1.74 113.55 121.94 3mka h SER 462 Ca -0.05 -0.30 -0.09 0.00 -0.47 0.00 0.00 61.79 60.88 3mka h SER 462 Cb 1.35 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.23 3mka h SER 462 CO 0.15 0.99 -0.14 1.23 -0.87 0.00 0.00 176.83 178.18 3mka h GLY 463 N 1.01 0.76 2.00 -0.77 0.00 -1.28 -0.56 103.07 104.23 3mka h GLY 463 Ca 0.05 -0.58 -0.04 0.00 0.00 0.00 0.00 47.33 46.75 3mka h GLY 463 CO 0.08 0.53 -0.21 -2.00 0.00 0.00 0.00 176.54 174.95 3mka h LEU 464 N 0.63 0.00 0.07 3.11 5.85 -0.87 -1.89 115.31 122.21 3mka h LEU 464 Ca 0.10 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 3mka h LEU 464 Cb 0.61 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.64 3mka h LEU 464 CO 0.04 0.21 -0.04 -0.09 -0.34 0.00 0.00 178.44 178.22 3mka h ARG 465 N 0.00 -0.10 -0.78 1.25 2.43 -0.48 -3.02 114.38 113.68 3mka h ARG 465 Ca -0.00 0.01 0.17 0.00 -0.81 0.00 0.00 59.98 59.35 3mka h ARG 465 Cb 0.70 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.22 3mka h ARG 465 CO 0.03 0.45 0.53 0.28 -1.51 0.00 0.00 179.97 179.74 3mka h VAL 466 N -0.90 0.74 -0.21 0.20 2.07 -1.08 -1.25 116.25 115.82 3mka h VAL 466 Ca -0.01 -0.12 -0.10 0.00 0.82 0.00 0.00 66.70 67.30 3mka h VAL 466 Cb 0.59 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3mka h VAL 466 CO 0.02 0.06 -0.24 0.00 0.02 0.00 0.00 177.57 177.43 3mka h ALA 467 N 1.64 0.31 0.00 1.67 0.00 -1.40 -1.91 119.26 119.57 3mka h ALA 467 Ca 0.39 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3mka h ALA 467 Cb 1.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3mka h ALA 467 CO -0.11 0.28 -0.18 0.28 0.00 0.00 0.00 179.25 179.52 3mka h VAL 468 N 0.21 0.50 0.14 0.00 2.07 -1.23 -2.42 116.25 115.52 3mka h VAL 468 Ca 0.03 -0.93 -0.30 0.00 0.82 0.00 0.00 66.70 66.31 3mka h VAL 468 Cb 0.81 1.65 0.03 0.00 -1.52 0.00 0.00 31.29 32.25 3mka h VAL 468 CO 0.06 0.18 -1.28 -0.08 0.02 0.00 0.00 177.57 176.47 3mka h GLU 469 N 0.00 0.61 -0.26 1.57 4.81 -1.11 -2.22 114.58 117.97 3mka h GLU 469 Ca -0.00 -0.84 -0.04 0.00 -0.13 0.00 0.00 59.36 58.34 3mka h GLU 469 Cb 0.63 0.28 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 3mka h GLU 469 CO 0.02 1.39 -0.03 0.00 -0.73 0.00 0.00 179.01 179.66 3mka h ALA 470 N 0.28 1.47 0.00 2.92 0.00 -1.13 0.10 119.26 122.91 3mka h ALA 470 Ca -0.20 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 3mka h ALA 470 Cb 1.95 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.61 3mka h ALA 470 CO 0.24 0.38 -0.39 1.25 0.00 0.00 0.00 179.25 180.73 3mka h LEU 471 N 0.39 0.00 -0.05 0.00 5.85 -1.43 -1.97 115.31 118.09 3mka h LEU 471 Ca 0.08 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 3mka h LEU 471 Cb 0.30 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.33 3mka h LEU 471 CO 0.01 0.39 -0.09 0.22 -0.34 0.00 0.00 178.44 178.63 3mka h TYR 472 N 0.00 0.18 -0.30 1.25 3.20 -0.37 -2.51 116.97 118.42 3mka h TYR 472 Ca -0.00 -0.07 0.02 0.00 3.14 0.00 0.00 58.73 61.82 3mka h TYR 472 Cb 1.05 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.27 3mka h TYR 472 CO 0.00 0.68 0.20 -0.44 -1.64 0.00 0.00 178.16 176.96 3mka h ASP 473 N -0.36 0.27 0.06 -2.11 3.32 -0.83 -1.84 116.42 114.94 3mka h ASP 473 Ca 0.00 -0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.82 3mka h ASP 473 Cb 0.67 -0.06 0.01 0.00 0.22 0.00 0.00 39.33 40.16 3mka h ASP 473 CO 0.02 0.19 -0.85 0.00 -1.72 0.00 0.00 179.24 176.88 3mka h ALA 474 N 1.82 0.35 0.00 3.45 0.00 -1.32 -2.95 119.26 120.61 3mka h ALA 474 Ca 0.12 -0.64 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 3mka h ALA 474 Cb 0.10 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3mka h ALA 474 CO -0.03 0.73 -0.04 0.00 0.00 0.00 0.00 179.25 179.91 3mka h ALA 475 N 0.65 1.01 -0.21 0.00 0.00 -0.90 -1.67 119.26 118.14 3mka h ALA 475 Ca -0.07 -0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.61 3mka h ALA 475 Cb 1.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.26 3mka h ALA 475 CO 0.16 0.05 -0.62 0.22 0.00 0.00 0.00 179.25 179.07 3mka h ASP 476 N 0.00 0.83 -0.01 0.00 3.58 -1.20 -3.31 116.42 116.31 3mka h ASP 476 Ca -0.00 -0.48 0.00 0.00 0.42 0.00 0.00 57.03 56.97 3mka h ASP 476 Cb 0.54 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.35 3mka h ASP 476 CO 0.01 1.25 -0.27 0.47 -2.88 0.00 0.00 179.24 177.81 3mka n ASP 477 N -3.96 1.86 -3.86 2.28 8.00 -1.11 -4.91 116.55 114.84 3mka n ASP 477 Ca -0.05 -1.43 -0.26 0.00 0.71 0.00 0.00 54.79 53.76 3mka n ASP 477 Cb 0.66 0.36 -0.17 0.00 -0.02 0.00 0.00 41.12 41.95 3mka n ASP 477 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3mka s ASP 478 N -1.86 2.09 0.25 -2.24 2.15 -0.64 -5.01 116.67 111.41 3mka s ASP 478 Ca 0.16 -0.29 0.23 0.00 0.43 0.00 0.00 52.55 53.07 3mka s ASP 478 Cb 0.14 -0.73 0.97 0.00 -0.30 0.00 0.00 42.92 43.00 3mka s ASP 478 CO 0.38 -0.15 1.69 -1.54 -0.17 0.00 0.00 175.17 175.38 3mka n SER 479 N 5.00 0.62 0.10 -0.34 3.41 -1.26 -2.50 113.62 118.64 3mka n SER 479 Ca -0.11 0.66 0.13 0.00 -0.26 0.00 0.00 58.87 59.29 3mka n SER 479 Cb 0.50 -0.79 0.29 0.00 -0.26 0.00 0.00 64.21 63.94 3mka n SER 479 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mka h ALA 480 N 2.25 0.83 -3.05 7.33 0.00 -1.93 -3.43 119.26 121.26 3mka h ALA 480 Ca 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 3mka h ALA 480 Cb 0.32 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 17.94 3mka h ALA 480 CO 0.00 0.00 -0.55 0.99 0.00 0.00 0.00 179.25 179.69 3mka s THR 481 N -3.14 4.93 0.01 0.00 2.01 -1.04 -4.54 115.64 113.87 3mka s THR 481 Ca 0.08 0.03 -0.17 0.00 0.31 0.00 0.00 61.69 61.94 3mka s THR 481 Cb 0.12 -3.29 -0.06 0.00 0.01 0.00 0.00 72.50 69.28 3mka s THR 481 CO 0.65 0.35 0.48 -0.83 -0.69 0.00 0.00 174.62 174.58 3mka s GLY 482 N 1.21 2.55 0.36 4.40 0.00 -1.26 -4.45 107.32 110.13 3mka s GLY 482 Ca 0.06 -0.11 0.01 0.00 0.00 0.00 0.00 44.72 44.67 3mka s GLY 482 CO 0.05 0.35 0.50 0.61 0.00 0.00 0.00 173.10 174.61 3mka n GLY 483 N 1.96 0.87 3.66 0.20 0.00 -1.26 -4.38 105.19 106.24 3mka n GLY 483 Ca -0.12 -2.02 -0.44 0.00 0.00 0.00 0.00 46.02 43.44 3mka n GLY 483 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3mka n PRO 484 N -1.91 2.60 -2.85 1.61 -0.04 -1.26 -4.94 135.00 128.22 3mka n PRO 484 Ca 0.08 0.94 -0.43 0.00 -0.04 0.00 0.00 63.50 64.06 3mka n PRO 484 Cb 0.30 -2.91 -0.04 0.00 -0.04 0.00 0.00 33.50 30.82 3mka n PRO 484 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3mka s ASP 485 N 4.60 6.26 0.46 3.54 -1.08 -0.31 -4.89 116.67 125.25 3mka s ASP 485 Ca 0.91 -1.18 0.26 0.00 -0.52 0.00 0.00 52.55 52.03 3mka s ASP 485 Cb -0.51 -2.43 0.85 0.00 -1.46 0.00 0.00 42.92 39.37 3mka s ASP 485 CO 0.45 -1.39 1.79 -0.07 0.52 0.00 0.00 175.17 176.46 3mka h LEU 486 N 11.31 0.00 -0.12 -1.34 4.07 -1.92 0.25 115.31 127.56 3mka h LEU 486 Ca -0.19 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.57 3mka h LEU 486 Cb 1.06 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.81 3mka h LEU 486 CO 1.18 0.12 -0.71 0.58 -1.08 0.00 0.00 178.44 178.54 3mka h VAL 487 N 0.00 1.31 0.00 1.22 2.07 -1.97 -3.30 116.25 115.59 3mka h VAL 487 Ca -0.00 -1.96 0.00 0.00 0.82 0.00 0.00 66.70 65.56 3mka h VAL 487 Cb 0.79 2.12 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 3mka h VAL 487 CO 0.02 0.61 -1.23 0.54 0.02 0.00 0.00 177.57 177.52 3mka n ARG 488 N -4.04 0.30 -2.62 1.57 1.74 -1.22 -5.00 116.66 107.39 3mka n ARG 488 Ca -0.08 -0.05 -0.07 0.00 -0.77 0.00 0.00 57.85 56.88 3mka n ARG 488 Cb 0.71 -1.55 0.03 0.00 -1.02 0.00 0.00 32.46 30.63 3mka n ARG 488 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3mka n GLY 489 N 1.38 0.17 3.36 -0.13 0.00 0.82 -5.04 105.19 105.75 3mka n GLY 489 Ca 0.01 -0.26 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 3mka n GLY 489 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mka s ILE 490 N -3.14 3.04 0.31 -0.61 1.01 -0.84 -5.00 121.20 115.97 3mka s ILE 490 Ca 0.04 -0.66 0.03 0.00 0.00 0.00 0.00 60.65 60.05 3mka s ILE 490 Cb -0.02 -2.28 -0.05 0.00 0.01 0.00 0.00 42.46 40.12 3mka s ILE 490 CO 0.28 0.52 0.10 -0.36 0.00 0.00 0.00 174.94 175.48 3mka s PHE 491 N 0.41 1.72 0.83 3.97 0.08 -1.26 -1.16 117.98 122.57 3mka s PHE 491 Ca -0.10 -1.16 -0.12 0.00 0.12 0.00 0.00 56.93 55.67 3mka s PHE 491 Cb -0.16 -1.05 0.10 0.00 -0.57 0.00 0.00 43.02 41.34 3mka s PHE 491 CO 0.05 -0.25 1.17 -2.14 -0.10 0.00 0.00 175.22 173.95 3mka s PRO 492 N -3.91 1.55 0.03 0.24 0.02 -1.26 -4.76 135.00 126.91 3mka s PRO 492 Ca 0.35 1.60 0.01 0.00 0.02 0.00 0.00 61.00 62.99 3mka s PRO 492 Cb 0.07 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.77 3mka s PRO 492 CO 0.15 -2.25 0.06 0.95 -0.33 0.00 0.00 177.00 175.59 3mka s THR 493 N -2.42 4.53 0.06 0.99 -4.23 -0.98 -4.95 115.64 108.64 3mka s THR 493 Ca 0.69 -0.61 -0.01 0.00 -1.18 0.00 0.00 61.69 60.59 3mka s THR 493 Cb -0.25 -3.11 -0.04 0.00 1.34 0.00 0.00 72.50 70.44 3mka s THR 493 CO 0.53 0.26 -0.02 0.00 -0.54 0.00 0.00 174.62 174.84 3mka s ALA 494 N -1.26 0.54 -0.03 3.99 0.00 -1.26 -1.86 121.76 121.87 3mka s ALA 494 Ca 0.25 -1.23 -0.02 0.00 0.00 0.00 0.00 51.96 50.96 3mka s ALA 494 Cb -0.12 0.32 0.02 0.00 0.00 0.00 0.00 23.12 23.34 3mka s ALA 494 CO 0.17 -0.38 0.07 0.08 0.00 0.00 0.00 175.76 175.70 3mka s VAL 495 N -3.93 -0.02 0.04 0.00 1.01 -0.21 -1.11 120.40 116.19 3mka s VAL 495 Ca 0.08 0.07 0.08 0.00 0.00 0.00 0.00 61.98 62.21 3mka s VAL 495 Cb 0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 36.38 36.31 3mka s VAL 495 CO -0.09 0.03 -0.22 -0.51 0.00 0.00 0.00 175.10 174.31 3mka s ILE 496 N 0.41 1.76 -0.04 2.22 2.07 -0.74 -0.95 121.20 125.92 3mka s ILE 496 Ca -0.03 -1.24 -0.01 0.00 -1.41 0.00 0.00 60.65 57.97 3mka s ILE 496 Cb -0.04 -1.52 0.03 0.00 0.13 0.00 0.00 42.46 41.05 3mka s ILE 496 CO -0.01 0.24 0.02 -0.63 -1.91 0.00 0.00 174.94 172.64 3mka s ILE 497 N -0.80 0.16 0.00 2.00 1.01 -0.31 -0.39 121.20 122.87 3mka s ILE 497 Ca 0.08 0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.91 3mka s ILE 497 Cb -0.09 -0.32 0.00 0.00 0.01 0.00 0.00 42.46 42.06 3mka s ILE 497 CO 0.02 0.19 0.00 -0.90 0.00 0.00 0.00 174.94 174.24 3mka n ASP 498 N 4.70 0.53 0.13 3.58 5.68 -1.11 -1.26 116.55 128.79 3mka n ASP 498 Ca -0.15 -0.82 0.19 0.00 -0.50 0.00 0.00 54.79 53.51 3mka n ASP 498 Cb 0.50 0.00 0.77 0.00 -1.14 0.00 0.00 41.12 41.25 3mka n ASP 498 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3mka h ALA 499 N 1.00 2.02 -0.20 2.12 0.00 -1.93 0.26 119.26 122.53 3mka h ALA 499 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3mka h ALA 499 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3mka h ALA 499 CO 0.00 -0.54 0.00 -0.25 0.00 0.00 0.00 179.25 178.46 3mka n ASP 500 N -3.75 1.16 0.00 0.00 8.00 -1.26 -5.03 116.55 115.67 3mka n ASP 500 Ca 0.06 -2.02 0.00 0.00 0.71 0.00 0.00 54.79 53.54 3mka n ASP 500 Cb 0.53 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.47 3mka n ASP 500 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3mka n GLY 501 N 0.79 0.39 3.71 0.44 0.00 0.08 -4.99 105.19 105.60 3mka n GLY 501 Ca 0.07 -2.10 -0.39 0.00 0.00 0.00 0.00 46.02 43.60 3mka n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mka s ALA 502 N -1.01 3.43 -0.02 4.61 0.00 0.31 -2.74 121.76 126.34 3mka s ALA 502 Ca 0.00 -0.08 0.02 0.00 0.00 0.00 0.00 51.96 51.90 3mka s ALA 502 Cb 0.00 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.30 3mka s ALA 502 CO 0.00 -0.15 -0.07 0.14 0.00 0.00 0.00 175.76 175.68 3mka s VAL 503 N 0.95 0.65 0.16 0.00 -7.23 0.47 -4.98 120.40 110.42 3mka s VAL 503 Ca 0.31 -0.29 -0.31 0.00 -1.81 0.00 0.00 61.98 59.87 3mka s VAL 503 Cb -0.16 -0.59 -0.09 0.00 0.56 0.00 0.00 36.38 36.10 3mka s VAL 503 CO 0.13 0.21 1.46 -1.81 -0.31 0.00 0.00 175.10 174.78 3mka s ASP 504 N 0.19 6.71 0.22 4.85 1.01 -1.26 -1.79 116.67 126.59 3mka s ASP 504 Ca -0.02 2.49 -0.30 0.00 0.71 0.00 0.00 52.55 55.43 3mka s ASP 504 Cb -0.07 -2.60 -0.08 0.00 1.01 0.00 0.00 42.92 41.17 3mka s ASP 504 CO 0.00 -0.71 1.08 -0.69 0.21 0.00 0.00 175.17 175.06 3mka s VAL 505 N 0.85 3.76 0.28 -1.27 1.01 -0.26 -4.92 120.40 119.85 3mka s VAL 505 Ca 0.65 1.62 -0.29 0.00 0.00 0.00 0.00 61.98 63.96 3mka s VAL 505 Cb -0.40 -4.03 -0.10 0.00 0.00 0.00 0.00 36.38 31.85 3mka s VAL 505 CO 0.33 0.32 1.15 -2.16 0.00 0.00 0.00 175.10 174.74 3mka s PRO 506 N -0.79 4.58 0.22 2.72 0.04 -1.26 -4.64 135.00 135.85 3mka s PRO 506 Ca 0.47 1.89 -0.20 0.00 0.04 0.00 0.00 61.00 63.20 3mka s PRO 506 Cb -0.30 -3.17 0.19 0.00 0.04 0.00 0.00 34.50 31.26 3mka s PRO 506 CO 0.37 0.12 1.56 1.49 0.04 0.00 0.00 177.00 180.57 3mka h GLU 507 N 3.84 -0.03 -0.64 4.56 4.81 -1.94 0.93 114.58 126.10 3mka h GLU 507 Ca -0.47 0.00 0.15 0.00 -0.13 0.00 0.00 59.36 58.91 3mka h GLU 507 Cb 1.21 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.57 3mka h GLU 507 CO 0.67 -0.02 0.44 0.66 -0.73 0.00 0.00 179.01 180.03 3mka h SER 508 N -0.03 0.22 0.64 1.04 4.64 -1.99 0.18 113.55 118.25 3mka h SER 508 Ca 0.31 0.01 -0.09 0.00 -0.47 0.00 0.00 61.79 61.55 3mka h SER 508 Cb 0.57 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.62 3mka h SER 508 CO -0.94 0.12 -0.44 -0.09 -0.87 0.00 0.00 176.83 174.61 3mka h ARG 509 N 0.24 0.00 0.01 4.77 9.65 -1.19 -2.18 114.38 125.67 3mka h ARG 509 Ca 0.31 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 59.16 3mka h ARG 509 Cb 0.89 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.47 3mka h ARG 509 CO -0.06 0.44 -0.17 0.82 2.80 0.00 0.00 179.97 183.80 3mka h ILE 510 N 0.00 1.70 -0.65 1.20 2.04 -0.68 -2.89 117.51 118.23 3mka h ILE 510 Ca -0.00 -2.35 0.14 0.00 1.00 0.00 0.00 64.86 63.64 3mka h ILE 510 Cb 0.88 3.28 -0.11 0.00 -0.74 0.00 0.00 36.82 40.13 3mka h ILE 510 CO 0.06 0.59 -0.06 0.00 0.00 0.00 0.00 178.15 178.75 3mka h ALA 511 N -0.04 0.57 -0.72 1.87 0.00 -0.91 0.31 119.26 120.35 3mka h ALA 511 Ca -0.04 0.22 0.02 0.00 0.00 0.00 0.00 54.91 55.11 3mka h ALA 511 Cb 1.07 0.40 -0.04 0.00 0.00 0.00 0.00 17.79 19.22 3mka h ALA 511 CO -0.01 -0.41 0.47 1.49 0.00 0.00 0.00 179.25 180.79 3mka h GLU 512 N 0.07 0.89 -0.09 0.00 4.81 -1.47 -1.09 114.58 117.69 3mka h GLU 512 Ca 0.33 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 59.34 3mka h GLU 512 Cb 0.54 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.71 3mka h GLU 512 CO -0.60 0.59 -0.66 1.25 -0.73 0.00 0.00 179.01 178.86 3mka h LEU 513 N 0.92 0.44 0.39 1.64 5.85 -0.43 -2.75 115.31 121.36 3mka h LEU 513 Ca 0.28 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3mka h LEU 513 Cb -0.02 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.88 3mka h LEU 513 CO -0.07 0.98 -0.19 0.00 -0.34 0.00 0.00 178.44 178.82 3mka h ALA 514 N 1.02 -0.93 -1.23 1.25 0.00 0.17 -2.37 119.26 117.18 3mka h ALA 514 Ca -0.02 -0.11 0.38 0.00 0.00 0.00 0.00 54.91 55.16 3mka h ALA 514 Cb 1.21 0.20 -0.12 0.00 0.00 0.00 0.00 17.79 19.08 3mka h ALA 514 CO 0.11 -0.89 0.79 0.00 0.00 0.00 0.00 179.25 179.26 3mka h ARG 515 N -0.62 0.17 0.09 0.00 3.08 -1.32 0.26 114.38 116.04 3mka h ARG 515 Ca -0.05 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 3mka h ARG 515 Cb 0.40 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.41 3mka h ARG 515 CO 0.09 0.11 -0.05 0.00 -1.07 0.00 0.00 179.97 179.06 3mka h ALA 516 N 1.60 -0.13 -0.08 0.04 0.00 -1.32 0.15 119.26 119.53 3mka h ALA 516 Ca 0.74 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.56 3mka h ALA 516 Cb 2.23 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 20.07 3mka h ALA 516 CO -0.37 -0.50 0.04 0.82 0.00 0.00 0.00 179.25 179.24 3mka h ILE 517 N -0.27 1.08 0.53 0.00 2.04 -0.07 0.02 117.51 120.83 3mka h ILE 517 Ca -0.01 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 3mka h ILE 517 Cb 0.23 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 3mka h ILE 517 CO 0.02 0.07 -0.51 0.40 0.00 0.00 0.00 178.15 178.13 3mka h ILE 518 N 0.04 0.00 -0.63 -0.67 2.04 -0.86 -0.26 117.51 117.17 3mka h ILE 518 Ca 0.03 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.00 3mka h ILE 518 Cb 0.07 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.03 3mka h ILE 518 CO -0.00 0.00 -0.34 -0.08 0.00 0.00 0.00 178.15 177.73 3mka h GLU 519 N -1.03 -0.14 -0.04 2.37 4.57 -0.68 0.15 114.58 119.78 3mka h GLU 519 Ca -0.07 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.13 3mka h GLU 519 Cb 0.89 0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 29.51 3mka h GLU 519 CO -0.05 -0.09 0.08 1.03 -1.18 0.00 0.00 179.01 178.80 3mka h SER 520 N -0.14 0.00 1.53 1.04 0.87 -0.50 -1.23 113.55 115.11 3mka h SER 520 Ca 0.24 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 3mka h SER 520 Cb 0.55 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.51 3mka h SER 520 CO -0.71 0.00 -0.34 0.03 -0.53 0.00 0.00 176.83 175.28 3mka h ARG 521 N 0.00 0.00 0.00 2.24 2.47 0.11 -3.39 114.38 115.81 3mka h ARG 521 Ca 0.02 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.73 3mka h ARG 521 Cb 0.18 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.50 3mka h ARG 521 CO -0.00 0.00 -0.08 0.77 0.56 0.00 0.00 179.97 181.22 3mka h SER 522 N 0.00 0.00 0.00 7.04 0.02 -0.98 -3.49 113.55 116.14 3mka h SER 522 Ca 0.00 -0.69 0.00 0.00 -0.84 0.00 0.00 61.79 60.26 3mka h SER 522 Cb 0.93 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.47 3mka h SER 522 CO 0.00 0.89 0.00 0.61 -1.14 0.00 0.00 176.83 177.19 3mka n GLY 523 N 1.65 0.54 0.00 -3.77 0.00 -1.21 -5.16 105.19 97.23 3mka n GLY 523 Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3mka n GLY 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32