#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mka s VAL -38 N 0.00 4.94 0.04 0.00 1.01 -1.26 -5.05 120.40 120.08 3mka s VAL -38 Ca 0.00 -0.84 -0.30 0.00 0.00 0.00 0.00 61.98 60.84 3mka s VAL -38 Cb 0.00 -4.34 -0.09 0.00 0.00 0.00 0.00 36.38 31.95 3mka s VAL -38 CO 0.00 -0.89 1.95 -0.62 0.00 0.00 0.00 175.10 175.54 3mka s ASP -37 N 3.08 6.45 0.01 3.32 2.15 -1.26 -4.85 116.67 125.57 3mka s ASP -37 Ca 0.11 2.67 0.22 0.00 0.43 0.00 0.00 52.55 55.98 3mka s ASP -37 Cb -0.23 -2.53 -0.23 0.00 -0.30 0.00 0.00 42.92 39.63 3mka s ASP -37 CO 0.08 -1.05 0.69 0.18 -0.17 0.00 0.00 175.17 174.91 3mka n LEU -36 N 7.41 0.37 -1.49 -1.34 4.32 -1.26 -4.96 117.00 120.05 3mka n LEU -36 Ca 0.20 -0.09 -0.15 0.00 -0.02 0.00 0.00 56.01 55.95 3mka n LEU -36 Cb 0.41 -0.02 -0.03 0.00 -1.62 0.00 0.00 43.42 42.16 3mka n LEU -36 CO 0.68 0.05 -0.17 -1.20 -1.22 0.00 0.00 177.39 175.52 3mka n SER -35 N -2.08 -4.56 -4.55 -1.43 7.64 -1.26 -4.97 113.62 102.40 3mka n SER -35 Ca -0.01 0.11 -0.40 0.00 1.01 0.00 0.00 58.87 59.58 3mka n SER -35 Cb 0.50 -3.60 -0.10 0.00 -1.01 0.00 0.00 64.21 60.00 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 -2.51 6.15 0.21 6.43 0.15 -1.26 -4.28 113.70 118.59 3mka s SER -34 Ca 0.00 -0.23 -0.09 0.00 0.70 0.00 0.00 55.95 56.33 3mka s SER -34 Cb 0.00 -2.18 0.24 0.00 -1.71 0.00 0.00 66.02 62.37 3mka s SER -34 CO 0.00 -0.29 1.81 0.15 1.20 0.00 0.00 173.24 176.11 3mka h PHE -33 N 8.45 0.68 -0.43 3.44 3.57 -1.93 0.11 116.94 130.83 3mka h PHE -33 Ca -0.31 0.02 -0.13 0.00 3.53 0.00 0.00 57.97 61.09 3mka h PHE -33 Cb 1.15 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.67 3mka h PHE -33 CO 0.69 0.33 -0.25 1.79 -2.23 0.00 0.00 178.31 178.64 3mka h THR -32 N 0.69 1.27 -0.27 4.41 1.35 -1.94 -0.48 112.91 117.94 3mka h THR -32 Ca 0.30 -1.41 -0.08 0.00 -0.55 0.00 0.00 66.41 64.67 3mka h THR -32 Cb 0.18 1.20 -0.01 0.00 -1.73 0.00 0.00 68.15 67.79 3mka h THR -32 CO -0.18 0.48 -0.19 -0.78 -0.25 0.00 0.00 175.52 174.60 3mka h ASP -31 N 0.78 0.47 -0.51 5.36 3.58 -1.89 -0.72 116.42 123.49 3mka h ASP -31 Ca 0.10 -0.14 -0.04 0.00 0.42 0.00 0.00 57.03 57.36 3mka h ASP -31 Cb 0.81 -0.13 -0.02 0.00 1.72 0.00 0.00 39.33 41.71 3mka h ASP -31 CO 0.07 0.68 0.16 0.15 -2.88 0.00 0.00 179.24 177.41 3mka h PHE -30 N 0.43 0.81 -0.50 0.28 3.57 -0.39 -2.67 116.94 118.47 3mka h PHE -30 Ca 0.07 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 3mka h PHE -30 Cb 0.58 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 3mka h PHE -30 CO 0.02 0.71 0.24 -0.07 -2.23 0.00 0.00 178.31 176.97 3mka h LEU -29 N 0.69 0.67 -0.78 0.59 3.38 -0.36 0.34 115.31 119.83 3mka h LEU -29 Ca 0.16 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3mka h LEU -29 Cb 0.27 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 3mka h LEU -29 CO -0.01 0.62 0.42 0.03 0.09 0.00 0.00 178.44 179.59 3mka h ARG -28 N 0.67 1.10 -0.43 1.13 3.08 -1.14 0.27 114.38 119.07 3mka h ARG -28 Ca 0.17 -0.14 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 3mka h ARG -28 Cb 0.13 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 3mka h ARG -28 CO -0.02 0.83 0.15 -0.09 -1.07 0.00 0.00 179.97 179.76 3mka h ARG -27 N 1.09 0.65 0.00 0.04 2.43 -1.01 -3.39 114.38 114.20 3mka h ARG -27 Ca 0.27 -0.13 -0.41 0.00 -0.81 0.00 0.00 59.98 58.90 3mka h ARG -27 Cb 0.06 -0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.45 3mka h ARG -27 CO -0.04 0.63 -2.38 1.04 -1.51 0.00 0.00 179.97 177.71 3mka n GLN -26 N -4.59 0.53 -3.47 0.20 1.13 0.04 -4.87 117.38 106.35 3mka n GLN -26 Ca 0.00 0.22 -0.26 0.00 -1.94 0.00 0.00 57.00 55.01 3mka n GLN -26 Cb 0.17 -1.39 -0.09 0.00 0.11 0.00 0.00 30.24 29.03 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 -3.96 3.18 0.28 -1.58 0.00 0.92 -4.94 120.51 114.42 3mka n ALA -25 Ca -0.48 -3.93 0.14 0.00 0.00 0.00 0.00 53.44 49.17 3mka n ALA -25 Cb 0.86 -0.87 0.83 0.00 0.00 0.00 0.00 19.45 20.27 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 4.81 0.00 -0.72 0.00 0.11 -1.69 -2.51 132.00 131.99 3mka h PRO -24 Ca 0.17 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.30 3mka h PRO -24 Cb 0.80 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.87 3mka h PRO -24 CO 0.59 0.06 0.48 1.05 -0.21 0.00 0.00 178.00 179.97 3mka h GLU -23 N 0.00 0.91 0.00 1.05 4.11 -1.92 -1.94 114.58 116.79 3mka h GLU -23 Ca -0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.37 3mka h GLU -23 Cb 0.17 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3mka h GLU -23 CO 0.01 0.60 0.00 -0.07 0.07 0.00 0.00 179.01 179.62 3mka h LEU -22 N 0.93 0.00 -9.99 3.06 3.38 -1.81 -3.44 115.31 107.44 3mka h LEU -22 Ca 0.28 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.73 3mka h LEU -22 Cb -0.03 0.00 0.08 0.00 0.09 0.00 0.00 40.66 40.80 3mka h LEU -22 CO -0.07 0.00 0.54 -0.76 0.09 0.00 0.00 178.44 178.24 3mka s LEU -21 N -5.30 4.06 0.22 1.67 1.02 -0.73 -4.95 118.68 114.65 3mka s LEU -21 Ca 0.04 2.47 -0.07 0.00 0.02 0.00 0.00 54.13 56.58 3mka s LEU -21 Cb 0.09 -4.14 0.17 0.00 0.02 0.00 0.00 46.19 42.34 3mka s LEU -21 CO 0.49 -0.98 1.77 -0.65 0.02 0.00 0.00 176.35 177.00 3mka h PRO -20 N 2.17 1.15 -6.80 1.29 0.11 -1.87 -3.46 132.00 124.58 3mka h PRO -20 Ca -0.50 -0.23 -0.56 0.00 0.11 0.00 0.00 66.00 64.83 3mka h PRO -20 Cb 1.25 -0.17 0.10 0.00 0.11 0.00 0.00 31.00 32.29 3mka h PRO -20 CO 0.61 0.96 0.65 0.00 -0.21 0.00 0.00 178.00 180.01 3mka n ALA -19 N -2.44 1.81 -2.58 -0.75 0.00 -1.26 -5.01 120.51 110.27 3mka n ALA -19 Ca 0.06 0.36 -0.09 0.00 0.00 0.00 0.00 53.44 53.78 3mka n ALA -19 Cb 0.21 -2.34 -0.09 0.00 0.00 0.00 0.00 19.45 17.23 3mka n ALA -19 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3mka s SER -18 N -0.10 0.25 0.00 0.00 0.01 -1.26 -5.11 113.70 107.48 3mka s SER -18 Ca 0.57 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.18 3mka s SER -18 Cb -0.53 0.23 0.00 0.00 0.21 0.00 0.00 66.02 65.92 3mka s SER -18 CO 0.60 -0.54 0.00 -0.38 0.41 0.00 0.00 173.24 173.33 3mka n ILE -17 N 0.57 0.00 -2.33 1.44 5.41 -1.26 -4.74 119.36 118.45 3mka n ILE -17 Ca -0.18 0.00 -0.40 0.00 1.00 0.00 0.00 62.75 63.17 3mka n ILE -17 Cb 0.59 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 39.49 3mka n ILE -17 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 3mka s GLN -5 N 0.00 3.05 0.31 0.38 2.00 -1.26 -5.14 119.66 118.99 3mka s GLN -5 Ca 0.00 0.27 -0.27 0.00 -2.00 0.00 0.00 55.36 53.36 3mka s GLN -5 Cb 0.00 -4.23 -0.09 0.00 0.80 0.00 0.00 33.01 29.49 3mka s GLN -5 CO 0.00 -2.26 1.00 -0.51 -0.50 0.00 0.00 175.29 173.02 3mka s LEU -4 N 6.92 4.43 0.20 3.68 2.01 -1.26 -4.88 118.68 129.78 3mka s LEU -4 Ca 0.51 2.01 -0.32 0.00 0.01 0.00 0.00 54.13 56.34 3mka s LEU -4 Cb -0.11 -3.85 -0.15 0.00 0.01 0.00 0.00 46.19 42.09 3mka s LEU -4 CO 0.20 -0.11 1.27 -2.65 1.01 0.00 0.00 176.35 176.07 3mka n PRO -3 N 0.82 1.53 -3.84 1.29 -0.02 -1.26 -4.85 135.00 128.67 3mka n PRO -3 Ca 0.01 0.55 -0.06 0.00 -2.02 0.00 0.00 63.50 61.98 3mka n PRO -3 Cb 0.48 -2.11 0.02 0.00 -0.02 0.00 0.00 33.50 31.87 3mka n PRO -3 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3mka s HIS -2 N -0.13 0.07 0.00 6.00 -3.43 -0.82 -1.17 115.29 115.80 3mka s HIS -2 Ca 0.71 -0.58 0.00 0.00 -0.80 0.00 0.00 55.06 54.39 3mka s HIS -2 Cb -0.77 0.75 0.00 0.00 -1.43 0.00 0.00 32.58 31.14 3mka s HIS -2 CO 0.51 -1.19 0.00 0.41 -2.00 0.00 0.00 174.74 172.47 3mka n GLY -1 N -0.61 1.19 3.50 -1.38 0.00 -1.20 -1.79 105.19 104.91 3mka n GLY -1 Ca -0.05 -1.24 -0.09 0.00 0.00 0.00 0.00 46.02 44.64 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 -0.02 -1.78 -0.10 4.61 0.00 -1.26 -4.48 121.76 118.74 3mka s ALA 301 Ca 0.00 0.90 0.01 0.00 0.00 0.00 0.00 51.96 52.87 3mka s ALA 301 Cb 0.00 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.64 3mka s ALA 301 CO 0.00 -0.71 -0.12 0.99 0.00 0.00 0.00 175.76 175.92 3mka s THR 302 N -3.23 1.26 -0.05 0.00 2.01 -1.26 -1.61 115.64 112.75 3mka s THR 302 Ca 0.05 -0.49 0.03 0.00 0.31 0.00 0.00 61.69 61.58 3mka s THR 302 Cb -0.01 -1.18 0.01 0.00 0.01 0.00 0.00 72.50 71.33 3mka s THR 302 CO -0.09 0.39 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.47 3mka s ILE 303 N 1.11 1.13 0.22 1.82 1.01 0.05 -2.55 121.20 124.00 3mka s ILE 303 Ca -0.05 -0.51 0.10 0.00 0.00 0.00 0.00 60.65 60.18 3mka s ILE 303 Cb -0.14 -1.01 -0.05 0.00 0.01 0.00 0.00 42.46 41.27 3mka s ILE 303 CO -0.02 0.35 -0.18 0.68 0.00 0.00 0.00 174.94 175.76 3mka s VAL 304 N 0.40 2.07 -0.18 2.92 -7.23 -0.02 -0.98 120.40 117.39 3mka s VAL 304 Ca -0.09 -2.21 -0.16 0.00 -1.81 0.00 0.00 61.98 57.71 3mka s VAL 304 Cb -0.13 -2.10 0.05 0.00 0.56 0.00 0.00 36.38 34.75 3mka s VAL 304 CO 0.03 -0.43 0.46 0.00 -0.31 0.00 0.00 175.10 174.85 3mka s ALA 305 N -2.51 -1.15 0.07 1.32 0.00 -0.03 -1.00 121.76 118.45 3mka s ALA 305 Ca 0.24 1.34 -0.09 0.00 0.00 0.00 0.00 51.96 53.45 3mka s ALA 305 Cb -0.04 -0.78 -0.00 0.00 0.00 0.00 0.00 23.12 22.30 3mka s ALA 305 CO 0.10 -0.22 0.18 -0.48 0.00 0.00 0.00 175.76 175.33 3mka s LEU 306 N 0.34 1.46 -0.16 0.00 0.05 -0.46 -0.55 118.68 119.35 3mka s LEU 306 Ca -0.01 -0.57 -0.10 0.00 0.05 0.00 0.00 54.13 53.51 3mka s LEU 306 Cb -0.04 0.96 -0.05 0.00 -2.05 0.00 0.00 46.19 45.02 3mka s LEU 306 CO -0.00 -0.66 0.16 -0.54 -0.55 0.00 0.00 176.35 174.76 3mka s LYS 307 N -3.41 3.97 0.16 1.48 1.02 0.18 -1.10 119.74 122.04 3mka s LYS 307 Ca 0.01 -0.13 0.07 0.00 0.02 0.00 0.00 55.97 55.95 3mka s LYS 307 Cb 0.03 -3.35 -0.04 0.00 -0.52 0.00 0.00 37.83 33.95 3mka s LYS 307 CO -0.08 0.45 -0.16 1.52 -0.92 0.00 0.00 175.35 176.15 3mka s TYR 308 N -0.08 1.66 0.13 3.18 -0.85 -0.09 -4.96 117.35 116.34 3mka s TYR 308 Ca 0.12 -0.53 -0.33 0.00 -0.52 0.00 0.00 57.07 55.81 3mka s TYR 308 Cb -0.12 -0.82 -0.12 0.00 0.38 0.00 0.00 41.96 41.27 3mka s TYR 308 CO 0.01 0.28 1.71 -2.30 -1.52 0.00 0.00 175.55 173.73 3mka n PRO 309 N 0.18 2.43 -1.02 -3.49 -0.02 -1.26 -0.27 135.00 131.54 3mka n PRO 309 Ca -0.12 0.88 -0.01 0.00 -2.02 0.00 0.00 63.50 62.23 3mka n PRO 309 Cb 0.58 -2.70 -0.00 0.00 -0.02 0.00 0.00 33.50 31.35 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 3.85 0.40 3.82 -1.23 0.00 -0.80 -4.74 105.19 106.50 3mka n GLY 310 Ca 0.18 -0.08 -0.06 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.11 -0.13 -0.01 -0.02 0.00 0.63 -4.09 107.32 101.60 3mka s GLY 311 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 44.72 44.52 3mka s GLY 311 CO 0.00 -0.03 0.07 0.54 0.00 0.00 0.00 173.10 173.68 3mka s VAL 312 N -3.62 0.06 0.06 1.40 0.11 -0.73 -0.91 120.40 116.76 3mka s VAL 312 Ca 0.12 -0.48 0.04 0.00 -2.93 0.00 0.00 61.98 58.72 3mka s VAL 312 Cb -0.04 -0.27 -0.03 0.00 -1.53 0.00 0.00 36.38 34.51 3mka s VAL 312 CO 0.05 -0.26 -0.11 0.54 -3.33 0.00 0.00 175.10 171.99 3mka s VAL 313 N -0.85 0.82 -0.05 2.04 0.11 -0.26 -1.05 120.40 121.17 3mka s VAL 313 Ca -0.09 -1.18 -0.03 0.00 -2.93 0.00 0.00 61.98 57.74 3mka s VAL 313 Cb -0.06 -0.83 0.02 0.00 -1.53 0.00 0.00 36.38 33.98 3mka s VAL 313 CO 0.00 -0.30 0.12 -0.32 -3.33 0.00 0.00 175.10 171.27 3mka s MET 314 N -1.64 0.10 0.02 1.54 1.75 -0.45 -1.36 119.30 119.27 3mka s MET 314 Ca -0.06 0.22 -0.05 0.00 -1.25 0.00 0.00 55.69 54.55 3mka s MET 314 Cb -0.10 -0.04 -0.01 0.00 2.84 0.00 0.00 34.83 37.53 3mka s MET 314 CO 0.01 -0.07 0.08 0.00 -0.65 0.00 0.00 175.02 174.39 3mka s ALA 315 N 0.48 -0.10 0.04 4.11 0.00 -0.17 -0.75 121.76 125.37 3mka s ALA 315 Ca -0.03 -0.44 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 3mka s ALA 315 Cb -0.05 0.19 -0.02 0.00 0.00 0.00 0.00 23.12 23.23 3mka s ALA 315 CO -0.02 -0.25 0.02 0.20 0.00 0.00 0.00 175.76 175.71 3mka s GLY 316 N -1.78 0.29 0.96 0.00 0.00 -0.56 -0.84 107.32 105.39 3mka s GLY 316 Ca -0.10 -0.80 -0.15 0.00 0.00 0.00 0.00 44.72 43.67 3mka s GLY 316 CO -0.02 -0.91 1.30 2.09 0.00 0.00 0.00 173.10 175.56 3mka n ASP 317 N 0.72 0.19 -0.24 1.64 5.68 -1.06 -1.88 116.55 121.60 3mka n ASP 317 Ca -0.18 -1.52 0.03 0.00 -0.50 0.00 0.00 54.79 52.61 3mka n ASP 317 Cb 0.59 -0.99 0.03 0.00 -1.14 0.00 0.00 41.12 39.61 3mka n ASP 317 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3mka n ARG 318 N -3.74 0.23 -2.85 0.11 5.12 -1.26 -4.51 116.66 109.76 3mka n ARG 318 Ca 0.17 -0.97 -0.31 0.00 -1.93 0.00 0.00 57.85 54.81 3mka n ARG 318 Cb 0.58 -1.11 -0.03 0.00 -1.16 0.00 0.00 32.46 30.73 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 -0.55 3.81 -0.04 5.56 3.52 -1.26 -1.99 118.95 127.99 3mka s ARG 319 Ca 0.07 0.51 -0.02 0.00 -0.13 0.00 0.00 55.73 56.17 3mka s ARG 319 Cb 0.05 -2.38 0.03 0.00 -1.56 0.00 0.00 34.95 31.09 3mka s ARG 319 CO 0.07 -0.03 0.09 0.45 -0.81 0.00 0.00 175.30 175.07 3mka s SER 320 N -3.08 -0.03 0.08 -2.12 0.15 -0.16 -4.67 113.70 103.87 3mka s SER 320 Ca 0.52 0.18 0.06 0.00 0.70 0.00 0.00 55.95 57.42 3mka s SER 320 Cb -0.10 0.07 -0.03 0.00 -1.71 0.00 0.00 66.02 64.25 3mka s SER 320 CO 0.30 -0.14 -0.17 0.42 1.20 0.00 0.00 173.24 174.85 3mka s THR 321 N 1.11 1.39 -0.35 6.45 -4.23 -0.74 0.77 115.64 120.04 3mka s THR 321 Ca -0.09 -1.36 0.03 0.00 -1.18 0.00 0.00 61.69 59.09 3mka s THR 321 Cb -0.12 -1.28 0.10 0.00 1.34 0.00 0.00 72.50 72.54 3mka s THR 321 CO -0.05 -0.11 0.08 -1.10 -0.54 0.00 0.00 174.62 172.91 3mka s GLN 322 N -1.71 1.37 6.99 3.99 -0.21 0.21 -1.95 119.66 128.35 3mka s GLN 322 Ca 0.02 -1.79 0.00 0.00 0.02 0.00 0.00 55.36 53.61 3mka s GLN 322 Cb -0.10 -2.97 0.00 0.00 1.00 0.00 0.00 33.01 30.94 3mka s GLN 322 CO 0.03 -0.97 0.00 0.41 -2.12 0.00 0.00 175.29 172.64 3mka n GLY 323 N 4.26 1.86 0.03 3.09 0.00 -1.26 -1.99 105.19 111.17 3mka n GLY 323 Ca 0.03 -0.42 0.12 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 6.57 0.63 -4.76 1.61 3.02 -1.26 -4.92 115.26 116.15 3mka n ASN 324 Ca 0.00 -0.17 -0.39 0.00 -0.03 0.00 0.00 54.58 53.99 3mka n ASN 324 Cb 0.00 0.49 -0.06 0.00 -0.61 0.00 0.00 39.78 39.60 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 -3.13 4.76 -0.29 3.52 -1.94 -0.84 -5.00 119.30 116.39 3mka s MET 325 Ca 0.06 1.44 -0.26 0.00 -1.71 0.00 0.00 55.69 55.23 3mka s MET 325 Cb 0.15 -3.11 0.01 0.00 2.01 0.00 0.00 34.83 33.88 3mka s MET 325 CO 0.76 0.43 0.91 0.42 -0.01 0.00 0.00 175.02 177.53 3mka s ILE 326 N -1.33 4.71 -0.15 2.53 1.01 -1.26 -0.62 121.20 126.09 3mka s ILE 326 Ca 0.44 1.54 0.17 0.00 0.00 0.00 0.00 60.65 62.81 3mka s ILE 326 Cb -0.24 -4.24 -0.24 0.00 0.01 0.00 0.00 42.46 37.75 3mka s ILE 326 CO 0.29 -0.27 0.27 -1.54 0.00 0.00 0.00 174.94 173.70 3mka n SER 327 N 6.37 0.24 -3.90 3.58 3.41 0.23 -4.91 113.62 118.64 3mka n SER 327 Ca 0.08 0.11 -0.11 0.00 -0.26 0.00 0.00 58.87 58.69 3mka n SER 327 Cb 0.47 0.79 -0.11 0.00 -0.26 0.00 0.00 64.21 65.10 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 -5.30 0.08 0.00 5.00 0.00 -0.21 -4.94 107.32 101.94 3mka s GLY 328 Ca -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 44.72 44.46 3mka s GLY 328 CO 0.83 -0.26 0.53 -0.96 0.00 0.00 0.00 173.10 173.24 3mka n ARG 329 N 1.96 0.44 0.00 2.90 1.85 -1.25 -0.98 116.66 121.57 3mka n ARG 329 Ca -0.20 -0.66 0.00 0.00 -1.00 0.00 0.00 57.85 55.99 3mka n ARG 329 Cb 0.56 -0.81 0.00 0.00 -1.05 0.00 0.00 32.46 31.16 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 -0.13 0.70 -4.58 2.89 5.75 -1.16 -4.66 116.55 115.36 3mka n ASP 330 Ca 0.00 -0.91 -0.55 0.00 -0.01 0.00 0.00 54.79 53.32 3mka n ASP 330 Cb 0.20 0.12 -0.07 0.00 -1.03 0.00 0.00 41.12 40.34 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 -0.12 0.03 -3.73 2.12 0.31 -0.84 -4.97 118.33 111.12 3mka n VAL 331 Ca 0.00 -0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.97 3mka n VAL 331 Cb 0.04 -0.61 -0.09 0.00 -0.91 0.00 0.00 33.84 32.26 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 0.69 4.06 0.00 5.55 3.52 -1.26 -4.19 118.95 127.32 3mka s ARG 332 Ca 0.88 -0.28 0.01 0.00 -0.13 0.00 0.00 55.73 56.21 3mka s ARG 332 Cb -1.07 -3.45 0.00 0.00 -1.56 0.00 0.00 34.95 28.87 3mka s ARG 332 CO 0.52 0.14 0.39 1.63 -0.81 0.00 0.00 175.30 177.17 3mka n LYS 333 N 4.02 1.32 -4.39 5.12 5.02 -1.26 -4.97 118.16 123.02 3mka n LYS 333 Ca -0.16 -0.40 -0.34 0.00 -2.02 0.00 0.00 58.31 55.40 3mka n LYS 333 Cb 0.52 -0.88 -0.15 0.00 -0.02 0.00 0.00 35.03 34.50 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 -0.37 2.85 -0.02 -0.18 1.01 -1.26 -2.38 120.40 120.04 3mka s VAL 334 Ca 0.01 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.33 3mka s VAL 334 Cb 0.01 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.16 3mka s VAL 334 CO 0.02 0.50 -0.13 -0.31 0.00 0.00 0.00 175.10 175.17 3mka s TYR 335 N 0.92 1.25 -0.08 5.22 2.02 -0.49 -4.98 117.35 121.22 3mka s TYR 335 Ca -0.03 -0.28 -0.30 0.00 -0.37 0.00 0.00 57.07 56.09 3mka s TYR 335 Cb -0.15 -0.83 -0.03 0.00 -0.40 0.00 0.00 41.96 40.55 3mka s TYR 335 CO -0.01 -0.07 1.21 0.42 -1.57 0.00 0.00 175.55 175.53 3mka s ILE 336 N -0.13 4.27 -0.72 2.71 1.01 -1.26 -0.92 121.20 126.16 3mka s ILE 336 Ca 0.01 1.58 0.18 0.00 0.00 0.00 0.00 60.65 62.43 3mka s ILE 336 Cb -0.07 -4.02 -0.21 0.00 0.01 0.00 0.00 42.46 38.17 3mka s ILE 336 CO 0.00 -0.03 0.71 0.35 0.00 0.00 0.00 174.94 175.97 3mka n THR 337 N 4.75 0.00 -3.83 2.92 -2.24 0.03 -4.93 114.28 110.99 3mka n THR 337 Ca 0.11 -0.13 -0.01 0.00 -2.27 0.00 0.00 64.05 61.75 3mka n THR 337 Cb 0.46 0.85 0.01 0.00 -2.10 0.00 0.00 70.33 69.55 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 -2.94 -0.04 0.65 3.42 1.47 -1.20 -4.56 116.67 113.47 3mka s ASP 338 Ca 0.05 -0.43 0.36 0.00 1.18 0.00 0.00 52.55 53.70 3mka s ASP 338 Cb 0.13 0.37 1.96 0.00 -0.34 0.00 0.00 42.92 45.05 3mka s ASP 338 CO 0.75 -0.71 2.15 0.44 0.68 0.00 0.00 175.17 178.47 3mka h ASP 339 N 2.00 0.00 0.00 2.11 3.32 -1.96 -3.00 116.42 118.89 3mka h ASP 339 Ca -0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3mka h ASP 339 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3mka h ASP 339 CO 0.32 0.00 -0.13 -1.22 -1.72 0.00 0.00 179.24 176.49 3mka n TYR 340 N -3.18 0.00 -3.81 4.55 4.01 -1.26 -0.53 117.16 116.93 3mka n TYR 340 Ca -0.02 -0.61 -0.10 0.00 -0.16 0.00 0.00 57.90 57.01 3mka n TYR 340 Cb 0.24 -0.10 -0.07 0.00 -0.31 0.00 0.00 39.34 39.10 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 -1.70 0.11 0.02 -0.72 -4.23 -1.14 -1.31 115.64 106.67 3mka s THR 341 Ca 0.17 -0.92 -0.07 0.00 -1.18 0.00 0.00 61.69 59.69 3mka s THR 341 Cb 0.15 -1.08 -0.00 0.00 1.34 0.00 0.00 72.50 72.91 3mka s THR 341 CO 0.02 -0.51 0.12 0.00 -0.54 0.00 0.00 174.62 173.71 3mka s ALA 342 N -3.09 -0.24 0.03 3.99 0.00 0.61 -0.78 121.76 122.27 3mka s ALA 342 Ca -0.01 -0.27 0.06 0.00 0.00 0.00 0.00 51.96 51.74 3mka s ALA 342 Cb 0.01 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.27 3mka s ALA 342 CO -0.07 -0.24 -0.17 0.95 0.00 0.00 0.00 175.76 176.23 3mka s THR 343 N -1.78 1.37 -0.08 0.00 -4.23 -0.10 -1.21 115.64 109.61 3mka s THR 343 Ca -0.12 -1.02 0.03 0.00 -1.18 0.00 0.00 61.69 59.40 3mka s THR 343 Cb -0.06 -1.20 0.01 0.00 1.34 0.00 0.00 72.50 72.59 3mka s THR 343 CO -0.00 0.15 -0.16 -0.83 -0.54 0.00 0.00 174.62 173.23 3mka s GLY 344 N -1.01 1.00 -0.06 3.99 0.00 -0.40 -1.39 107.32 109.44 3mka s GLY 344 Ca 0.05 -0.63 0.05 0.00 0.00 0.00 0.00 44.72 44.19 3mka s GLY 344 CO 0.01 -0.02 -0.20 -0.42 0.00 0.00 0.00 173.10 172.47 3mka s ILE 345 N 0.59 1.70 -0.09 0.90 1.01 -1.00 -0.50 121.20 123.80 3mka s ILE 345 Ca -0.15 -0.86 0.03 0.00 0.00 0.00 0.00 60.65 59.66 3mka s ILE 345 Cb -0.16 -1.46 -0.01 0.00 0.01 0.00 0.00 42.46 40.83 3mka s ILE 345 CO 0.05 0.48 -0.17 0.00 0.00 0.00 0.00 174.94 175.30 3mka s ALA 346 N 0.03 2.47 0.00 9.38 0.00 -0.94 -4.92 121.76 127.78 3mka s ALA 346 Ca -0.06 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 50.95 3mka s ALA 346 Cb -0.13 -0.99 0.00 0.00 0.00 0.00 0.00 23.12 22.00 3mka s ALA 346 CO 0.04 0.36 0.00 0.41 0.00 0.00 0.00 175.76 176.56 3mka n GLY 347 N 3.14 0.74 3.75 0.00 0.00 -1.26 0.15 105.19 111.71 3mka n GLY 347 Ca -0.18 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 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 -3.40 2.08 0.19 2.61 2.01 0.02 -3.22 115.64 115.94 3mka s THR 348 Ca 0.00 0.07 -0.10 0.00 0.31 0.00 0.00 61.69 61.96 3mka s THR 348 Cb 0.00 -3.04 0.12 0.00 0.01 0.00 0.00 72.50 69.58 3mka s THR 348 CO 0.00 0.01 1.78 0.00 -0.69 0.00 0.00 174.62 175.72 3mka h ALA 349 N 5.10 0.88 -0.54 7.40 0.00 -1.47 -1.89 119.26 128.74 3mka h ALA 349 Ca -0.46 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.31 3mka h ALA 349 Cb 1.22 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.71 3mka h ALA 349 CO 0.81 0.45 0.34 0.00 0.00 0.00 0.00 179.25 180.86 3mka h ALA 350 N 1.15 0.68 -0.37 0.00 0.00 -1.90 -1.37 119.26 117.46 3mka h ALA 350 Ca 0.23 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 3mka h ALA 350 Cb 0.13 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3mka h ALA 350 CO -0.03 0.09 0.02 0.28 0.00 0.00 0.00 179.25 179.61 3mka h VAL 351 N 0.70 1.25 -0.61 0.00 2.07 -1.87 -2.99 116.25 114.80 3mka h VAL 351 Ca 0.20 -0.95 -0.04 0.00 0.82 0.00 0.00 66.70 66.74 3mka h VAL 351 Cb -0.05 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.84 3mka h VAL 351 CO -0.06 0.32 0.23 0.00 0.02 0.00 0.00 177.57 178.07 3mka h ALA 352 N 0.88 0.79 -0.68 1.67 0.00 -1.06 -2.10 119.26 118.75 3mka h ALA 352 Ca 0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3mka h ALA 352 Cb 0.43 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3mka h ALA 352 CO 0.02 0.42 0.29 -0.24 0.00 0.00 0.00 179.25 179.74 3mka h VAL 353 N 0.85 1.24 -0.63 0.00 3.04 -1.28 -2.66 116.25 116.80 3mka h VAL 353 Ca 0.20 -0.72 -0.05 0.00 -1.01 0.00 0.00 66.70 65.12 3mka h VAL 353 Cb 0.23 0.44 -0.03 0.00 -2.01 0.00 0.00 31.29 29.92 3mka h VAL 353 CO -0.01 0.29 0.20 -0.33 -1.01 0.00 0.00 177.57 176.71 3mka h GLU 354 N 0.96 0.98 -0.55 4.17 5.08 -1.39 -3.03 114.58 120.79 3mka h GLU 354 Ca 0.23 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 3mka h GLU 354 Cb 0.17 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 3mka h GLU 354 CO -0.02 0.86 0.22 0.74 -1.00 0.00 0.00 179.01 179.81 3mka h PHE 355 N 0.91 0.84 -0.66 4.33 -1.00 -1.15 -2.54 116.94 117.67 3mka h PHE 355 Ca 0.20 -0.06 -0.04 0.00 2.81 0.00 0.00 57.97 60.88 3mka h PHE 355 Cb 0.29 -0.25 -0.03 0.00 3.61 0.00 0.00 35.95 39.57 3mka h PHE 355 CO 0.02 0.68 0.25 0.00 -1.61 0.00 0.00 178.31 177.65 3mka h ALA 356 N 1.07 0.85 -0.19 2.45 0.00 -1.45 -0.20 119.26 121.79 3mka h ALA 356 Ca 0.18 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3mka h ALA 356 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3mka h ALA 356 CO -0.02 0.49 -0.04 -0.09 0.00 0.00 0.00 179.25 179.59 3mka h ARG 357 N 0.93 0.36 -0.77 0.00 2.43 -1.49 -2.65 114.38 113.19 3mka h ARG 357 Ca 0.22 -0.13 -0.05 0.00 -0.81 0.00 0.00 59.98 59.20 3mka h ARG 357 Cb 0.23 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 3mka h ARG 357 CO -0.02 0.61 0.27 1.25 -1.51 0.00 0.00 179.97 180.58 3mka h LEU 358 N 0.08 1.10 -0.90 3.80 5.85 -1.41 -2.31 115.31 121.52 3mka h LEU 358 Ca 0.05 -0.19 -0.09 0.00 0.84 0.00 0.00 57.88 58.49 3mka h LEU 358 Cb 0.47 -0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 3mka h LEU 358 CO 0.02 1.00 -0.12 0.22 -0.34 0.00 0.00 178.44 179.21 3mka h TYR 359 N 1.14 0.74 -0.31 1.25 3.20 -0.98 0.98 116.97 122.98 3mka h TYR 359 Ca 0.25 -0.13 -0.12 0.00 3.14 0.00 0.00 58.73 61.88 3mka h TYR 359 Cb 0.27 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 3mka h TYR 359 CO 0.02 0.77 -0.29 0.00 -1.64 0.00 0.00 178.16 177.02 3mka h ALA 360 N 1.25 0.90 -0.04 1.82 0.00 -1.21 -1.26 119.26 120.73 3mka h ALA 360 Ca 0.11 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 3mka h ALA 360 Cb 0.56 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3mka h ALA 360 CO 0.04 0.62 -0.05 0.28 0.00 0.00 0.00 179.25 180.14 3mka h VAL 361 N 0.56 1.39 -0.99 0.00 2.07 -1.08 -2.21 116.25 115.99 3mka h VAL 361 Ca 0.07 -1.24 0.19 0.00 0.82 0.00 0.00 66.70 66.54 3mka h VAL 361 Cb 0.79 2.14 -0.10 0.00 -1.52 0.00 0.00 31.29 32.60 3mka h VAL 361 CO 0.06 0.34 0.61 -0.08 0.02 0.00 0.00 177.57 178.52 3mka h GLU 362 N -0.38 0.69 -0.02 1.57 4.57 -0.60 0.98 114.58 121.40 3mka h GLU 362 Ca 0.01 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 3mka h GLU 362 Cb 0.57 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 29.00 3mka h GLU 362 CO 0.01 0.46 -0.01 -0.07 -1.18 0.00 0.00 179.01 178.21 3mka h LEU 363 N 0.71 0.04 -1.48 1.64 4.07 -1.08 -2.80 115.31 116.42 3mka h LEU 363 Ca 0.56 -0.46 -0.05 0.00 0.08 0.00 0.00 57.88 58.00 3mka h LEU 363 Cb 0.94 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.66 3mka h LEU 363 CO -0.34 0.50 -0.24 -0.08 -1.08 0.00 0.00 178.44 177.21 3mka h GLU 364 N -0.41 0.00 -0.27 1.13 4.81 -0.90 -2.71 114.58 116.23 3mka h GLU 364 Ca 0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 3mka h GLU 364 Cb 0.49 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3mka h GLU 364 CO 0.00 0.24 -0.08 1.25 -0.73 0.00 0.00 179.01 179.70 3mka h HIS 365 N 0.00 0.59 -0.21 0.92 2.76 -0.76 -1.61 115.15 116.84 3mka h HIS 365 Ca -0.00 -0.13 -0.09 0.00 -2.20 0.00 0.00 60.37 57.95 3mka h HIS 365 Cb 0.56 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.36 3mka h HIS 365 CO 0.00 0.74 -0.24 -0.92 -1.30 0.00 0.00 177.93 176.21 3mka h TYR 366 N 0.27 0.43 -0.52 5.26 3.20 -1.32 -1.56 116.97 122.73 3mka h TYR 366 Ca 0.07 -0.08 -0.10 0.00 3.14 0.00 0.00 58.73 61.76 3mka h TYR 366 Cb 0.56 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 3mka h TYR 366 CO 0.05 0.61 -0.05 1.49 -1.64 0.00 0.00 178.16 178.62 3mka h GLU 367 N 0.35 0.96 -0.37 1.82 4.81 -1.23 -0.94 114.58 119.98 3mka h GLU 367 Ca 0.05 -0.33 -0.13 0.00 -0.13 0.00 0.00 59.36 58.83 3mka h GLU 367 Cb 0.62 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.91 3mka h GLU 367 CO 0.04 0.99 -0.28 0.87 -0.73 0.00 0.00 179.01 179.91 3mka h LYS 368 N 0.82 0.77 -0.21 1.92 1.57 -1.03 0.46 116.57 120.88 3mka h LYS 368 Ca 0.14 -0.34 -0.18 0.00 -1.87 0.00 0.00 60.65 58.40 3mka h LYS 368 Cb 0.59 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.89 3mka h LYS 368 CO 0.04 0.96 -0.57 -0.07 -0.57 0.00 0.00 179.45 179.23 3mka h LEU 369 N 0.66 0.88 -1.98 2.94 3.38 -1.19 -3.30 115.31 116.69 3mka h LEU 369 Ca 0.08 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3mka h LEU 369 Cb 0.80 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3mka h LEU 369 CO 0.07 1.29 0.00 -0.62 0.09 0.00 0.00 178.44 179.27 3mka n GLU 370 N -4.06 2.07 -0.88 1.13 -0.58 -0.37 -4.96 120.64 112.98 3mka n GLU 370 Ca -0.06 -1.89 0.00 0.00 -0.42 0.00 0.00 57.16 54.79 3mka n GLU 370 Cb 0.64 -1.42 0.00 0.00 -0.57 0.00 0.00 31.44 30.09 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 1.23 0.16 3.18 0.62 0.00 0.16 -4.93 105.19 105.61 3mka n GLY 371 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.38 -0.00 0.80 1.61 0.11 -1.13 -4.99 120.40 115.41 3mka s VAL 372 Ca 0.00 0.01 -0.11 0.00 -2.93 0.00 0.00 61.98 58.95 3mka s VAL 372 Cb 0.00 -0.42 0.07 0.00 -1.53 0.00 0.00 36.38 34.51 3mka s VAL 372 CO 0.00 0.00 1.11 -2.16 -3.33 0.00 0.00 175.10 170.72 3mka s PRO 373 N 0.20 1.98 0.59 1.54 0.04 -1.26 -4.23 135.00 133.86 3mka s PRO 373 Ca -0.00 1.31 -0.18 0.00 0.04 0.00 0.00 61.00 62.16 3mka s PRO 373 Cb -0.02 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 3mka s PRO 373 CO -0.00 -1.87 1.13 -1.17 0.04 0.00 0.00 177.00 175.13 3mka s LEU 374 N -5.98 3.63 0.69 -3.56 2.96 -1.26 -5.00 118.68 110.16 3mka s LEU 374 Ca 0.64 2.15 -0.14 0.00 -0.22 0.00 0.00 54.13 56.56 3mka s LEU 374 Cb -0.19 -4.57 0.02 0.00 0.50 0.00 0.00 46.19 41.94 3mka s LEU 374 CO 0.55 -1.40 1.11 0.42 -1.32 0.00 0.00 176.35 175.71 3mka s THR 375 N -1.93 3.22 0.19 3.68 -4.23 -1.26 -4.78 115.64 110.54 3mka s THR 375 Ca 0.72 0.52 -0.16 0.00 -1.18 0.00 0.00 61.69 61.58 3mka s THR 375 Cb -0.24 -3.03 0.16 0.00 1.34 0.00 0.00 72.50 70.74 3mka s THR 375 CO 0.32 -0.40 1.63 0.15 -0.54 0.00 0.00 174.62 175.78 3mka h PHE 376 N -0.30 -0.41 -0.71 3.99 3.57 -1.97 0.23 116.94 121.34 3mka h PHE 376 Ca -0.46 0.05 0.11 0.00 3.53 0.00 0.00 57.97 61.20 3mka h PHE 376 Cb 1.24 0.26 -0.05 0.00 2.79 0.00 0.00 35.95 40.20 3mka h PHE 376 CO 0.55 -0.27 0.47 0.00 -2.23 0.00 0.00 178.31 176.83 3mka h ALA 377 N 1.40 1.94 -0.16 2.41 0.00 -2.00 -0.14 119.26 122.70 3mka h ALA 377 Ca 0.25 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.00 3mka h ALA 377 Cb 0.43 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3mka h ALA 377 CO -0.56 -0.10 -0.53 0.78 0.00 0.00 0.00 179.25 178.84 3mka h GLY 378 N 0.53 0.51 1.05 0.00 0.00 -0.94 -1.71 103.07 102.52 3mka h GLY 378 Ca 0.33 -0.58 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 3mka h GLY 378 CO -0.11 0.52 0.35 0.50 0.00 0.00 0.00 176.54 177.80 3mka h LYS 379 N 0.36 1.21 -0.13 4.80 1.57 0.22 -1.55 116.57 123.04 3mka h LYS 379 Ca 0.01 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 3mka h LYS 379 Cb 1.04 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.14 3mka h LYS 379 CO 0.09 0.96 0.04 0.82 -0.57 0.00 0.00 179.45 180.79 3mka h ILE 380 N 1.18 1.19 -0.22 1.86 2.04 -1.10 -1.97 117.51 120.50 3mka h ILE 380 Ca 0.28 -0.60 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 3mka h ILE 380 Cb 0.18 1.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 3mka h ILE 380 CO -0.03 0.18 0.05 -1.13 0.00 0.00 0.00 178.15 177.22 3mka h ASN 381 N 0.02 0.27 -0.05 1.72 -0.73 -1.06 -0.54 115.58 115.21 3mka h ASN 381 Ca 0.04 -0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.16 3mka h ASN 381 Cb 0.25 -0.07 -0.00 0.00 0.27 0.00 0.00 38.32 38.77 3mka h ASN 381 CO -0.00 0.29 -0.08 -0.09 -0.37 0.00 0.00 177.43 177.17 3mka h ARG 382 N 0.30 0.15 -1.00 6.67 9.65 -0.96 -2.48 114.38 126.72 3mka h ARG 382 Ca 0.07 -0.09 0.06 0.00 -1.10 0.00 0.00 59.98 58.92 3mka h ARG 382 Cb 0.13 0.01 -0.07 0.00 -1.39 0.00 0.00 29.97 28.65 3mka h ARG 382 CO -0.00 0.65 0.64 1.25 2.80 0.00 0.00 179.97 185.31 3mka h LEU 383 N -0.33 1.04 -0.93 3.80 5.85 -0.75 -1.91 115.31 122.08 3mka h LEU 383 Ca 0.00 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.75 3mka h LEU 383 Cb 0.63 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 3mka h LEU 383 CO 0.02 0.67 0.61 0.00 -0.34 0.00 0.00 178.44 179.41 3mka h ALA 384 N 1.44 1.20 -0.60 1.25 0.00 -1.02 -1.01 119.26 120.52 3mka h ALA 384 Ca 0.42 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.19 3mka h ALA 384 Cb 0.13 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 3mka h ALA 384 CO -0.16 0.54 0.02 0.82 0.00 0.00 0.00 179.25 180.47 3mka h ILE 385 N 1.23 1.26 -0.44 0.00 2.04 -0.88 -0.13 117.51 120.59 3mka h ILE 385 Ca 0.35 -1.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.07 3mka h ILE 385 Cb -0.09 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 3mka h ILE 385 CO -0.09 0.41 0.21 0.24 0.00 0.00 0.00 178.15 178.92 3mka h MET 386 N 0.94 0.64 0.91 2.37 2.86 -1.04 -1.03 114.93 120.58 3mka h MET 386 Ca 0.17 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.67 3mka h MET 386 Cb 0.53 -0.11 0.01 0.00 0.06 0.00 0.00 31.60 32.09 3mka h MET 386 CO 0.03 0.55 -0.44 0.28 1.06 0.00 0.00 176.91 178.39 3mka h VAL 387 N 0.57 0.00 -1.01 -2.22 2.07 -1.00 -2.95 116.25 111.71 3mka h VAL 387 Ca 0.15 -0.07 0.26 0.00 0.82 0.00 0.00 66.70 67.87 3mka h VAL 387 Cb 0.12 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.82 3mka h VAL 387 CO -0.02 0.00 0.68 -0.09 0.02 0.00 0.00 177.57 178.16 3mka h ARG 388 N -1.28 0.25 0.00 1.57 2.43 -0.97 0.21 114.38 116.59 3mka h ARG 388 Ca -0.12 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.03 3mka h ARG 388 Cb 0.93 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.43 3mka h ARG 388 CO 0.20 0.17 0.00 0.41 -1.51 0.00 0.00 179.97 179.24 3mka n GLY 389 N -1.58 -0.86 0.00 2.80 0.00 -0.40 -2.46 105.19 102.70 3mka n GLY 389 Ca 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.53 1.36 -0.37 1.61 5.15 0.74 -4.76 115.26 118.46 3mka n ASN 390 Ca 0.01 -1.42 0.05 0.00 -0.60 0.00 0.00 54.58 52.62 3mka n ASN 390 Cb 0.00 0.00 0.21 0.00 -0.53 0.00 0.00 39.78 39.46 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 0.99 0.24 1.20 5.85 -1.52 -0.20 115.31 121.87 3mka h LEU 391 Ca 0.00 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3mka h LEU 391 Cb 0.25 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.11 3mka h LEU 391 CO 0.00 0.58 -0.12 0.00 -0.34 0.00 0.00 178.44 178.56 3mka h ALA 392 N 1.50 -0.32 0.00 1.25 0.00 -1.86 -2.32 119.26 117.51 3mka h ALA 392 Ca 0.47 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.26 3mka h ALA 392 Cb 0.33 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3mka h ALA 392 CO -0.22 -0.63 -0.04 0.00 0.00 0.00 0.00 179.25 178.36 3mka h ALA 393 N 0.31 1.52 -0.10 0.00 0.00 -1.71 -2.52 119.26 116.76 3mka h ALA 393 Ca -0.03 -0.03 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 3mka h ALA 393 Cb 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3mka h ALA 393 CO 0.05 0.05 -0.66 0.00 0.00 0.00 0.00 179.25 178.69 3mka h ALA 394 N 1.96 0.67 0.00 0.00 0.00 -0.58 -1.11 119.26 120.21 3mka h ALA 394 Ca -0.00 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.31 3mka h ALA 394 Cb 0.09 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3mka h ALA 394 CO 0.00 0.74 -0.16 0.52 0.00 0.00 0.00 179.25 180.35 3mka h MET 395 N 0.29 0.00 -0.77 0.00 2.86 -0.97 -1.67 114.93 114.67 3mka h MET 395 Ca -0.02 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.42 3mka h MET 395 Cb 1.21 0.00 -0.12 0.00 0.06 0.00 0.00 31.60 32.75 3mka h MET 395 CO 0.11 0.16 0.26 1.04 1.06 0.00 0.00 176.91 179.55 3mka n GLN 396 N -3.87 3.70 0.00 1.72 6.02 -1.03 -4.94 117.38 118.97 3mka n GLN 396 Ca -0.02 -2.98 0.00 0.00 -0.01 0.00 0.00 57.00 53.99 3mka n GLN 396 Cb 0.25 -2.20 0.00 0.00 1.02 0.00 0.00 30.24 29.32 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 -0.10 3.07 2.12 1.08 0.00 -0.63 -4.93 105.19 105.80 3mka n GLY 397 Ca 0.40 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.22 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 6.15 -4.70 0.99 4.77 -0.45 -4.71 117.00 119.05 3mka n LEU 398 Ca 0.00 -3.46 -0.42 0.00 -0.03 0.00 0.00 56.01 52.10 3mka n LEU 398 Cb 0.00 -1.42 -0.03 0.00 -2.33 0.00 0.00 43.42 39.65 3mka n LEU 398 CO 0.00 1.72 0.85 -0.22 -1.33 0.00 0.00 177.39 178.42 3mka s LEU 399 N 0.05 4.34 -0.22 2.23 2.96 -1.26 -4.19 118.68 122.59 3mka s LEU 399 Ca 0.65 1.85 -0.01 0.00 -0.22 0.00 0.00 54.13 56.40 3mka s LEU 399 Cb 0.26 -3.57 0.06 0.00 0.50 0.00 0.00 46.19 43.45 3mka s LEU 399 CO -0.02 -0.45 -0.00 0.00 -1.32 0.00 0.00 176.35 174.56 3mka s ALA 400 N 1.42 1.52 -0.38 5.97 0.00 -1.26 -0.80 121.76 128.23 3mka s ALA 400 Ca 0.56 -1.09 -0.04 0.00 0.00 0.00 0.00 51.96 51.38 3mka s ALA 400 Cb -0.26 -1.34 0.09 0.00 0.00 0.00 0.00 23.12 21.62 3mka s ALA 400 CO 0.26 -1.22 0.17 -1.17 0.00 0.00 0.00 175.76 173.80 3mka s LEU 401 N 1.61 4.90 0.42 0.00 2.96 0.12 -4.97 118.68 123.72 3mka s LEU 401 Ca -0.03 -1.71 -0.07 0.00 -0.22 0.00 0.00 54.13 52.10 3mka s LEU 401 Cb -0.18 -1.84 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 3mka s LEU 401 CO -0.08 -0.47 0.74 -2.16 -1.32 0.00 0.00 176.35 173.05 3mka s PRO 402 N 1.24 3.65 -0.09 0.98 0.04 -1.26 -2.21 135.00 137.35 3mka s PRO 402 Ca 0.04 0.26 0.02 0.00 0.04 0.00 0.00 61.00 61.35 3mka s PRO 402 Cb -0.22 -2.43 0.01 0.00 0.04 0.00 0.00 34.50 31.90 3mka s PRO 402 CO -0.02 -0.06 -0.13 -1.17 0.04 0.00 0.00 177.00 175.66 3mka s LEU 403 N -4.19 1.62 -0.12 -3.56 2.96 0.34 -3.27 118.68 112.47 3mka s LEU 403 Ca 0.48 -0.35 -0.01 0.00 -0.22 0.00 0.00 54.13 54.04 3mka s LEU 403 Cb -0.10 -0.93 -0.02 0.00 0.50 0.00 0.00 46.19 45.64 3mka s LEU 403 CO 0.37 0.01 -0.10 -0.22 -1.32 0.00 0.00 176.35 175.09 3mka s LEU 404 N 0.89 2.94 -0.09 -0.68 2.96 0.35 -1.28 118.68 123.77 3mka s LEU 404 Ca -0.10 -0.21 0.03 0.00 -0.22 0.00 0.00 54.13 53.64 3mka s LEU 404 Cb -0.15 -1.66 0.01 0.00 0.50 0.00 0.00 46.19 44.88 3mka s LEU 404 CO 0.01 0.22 -0.20 0.00 -1.32 0.00 0.00 176.35 175.06 3mka s ALA 405 N 0.04 1.84 0.10 5.97 0.00 -0.35 -0.04 121.76 129.32 3mka s ALA 405 Ca -0.03 -0.77 -0.13 0.00 0.00 0.00 0.00 51.96 51.03 3mka s ALA 405 Cb -0.14 -0.73 0.02 0.00 0.00 0.00 0.00 23.12 22.27 3mka s ALA 405 CO 0.04 0.20 0.31 0.20 0.00 0.00 0.00 175.76 176.51 3mka s GLY 406 N 0.49 -0.11 -0.14 0.00 0.00 -0.01 -0.28 107.32 107.27 3mka s GLY 406 Ca -0.17 -0.27 0.00 0.00 0.00 0.00 0.00 44.72 44.29 3mka s GLY 406 CO 0.06 -0.50 -0.15 -0.47 0.00 0.00 0.00 173.10 172.05 3mka s TYR 407 N -3.71 2.78 -0.34 1.90 5.04 -0.43 0.22 117.35 122.81 3mka s TYR 407 Ca 0.03 -0.83 -0.13 0.00 -2.44 0.00 0.00 57.07 53.70 3mka s TYR 407 Cb 0.03 -1.85 -0.02 0.00 0.35 0.00 0.00 41.96 40.47 3mka s TYR 407 CO -0.11 -0.33 0.25 0.34 -1.34 0.00 0.00 175.55 174.36 3mka s ASP 408 N 0.54 6.07 0.22 4.32 -1.08 -0.95 -4.86 116.67 120.94 3mka s ASP 408 Ca -0.09 -0.37 -0.06 0.00 -0.52 0.00 0.00 52.55 51.50 3mka s ASP 408 Cb -0.16 -2.14 0.20 0.00 -1.46 0.00 0.00 42.92 39.36 3mka s ASP 408 CO 0.04 -0.24 1.74 0.16 0.52 0.00 0.00 175.17 177.39 3mka h ILE 409 N 5.49 1.25 -0.01 4.11 3.07 -1.98 -2.89 117.51 126.56 3mka h ILE 409 Ca -0.31 -0.98 0.00 0.00 1.55 0.00 0.00 64.86 65.12 3mka h ILE 409 Cb 1.16 0.65 0.00 0.00 -0.27 0.00 0.00 36.82 38.35 3mka h ILE 409 CO 0.64 0.37 -0.02 1.41 -1.05 0.00 0.00 178.15 179.49 3mka n HIS 410 N -4.23 0.00 -1.93 0.16 8.25 -1.26 -4.86 115.22 111.35 3mka n HIS 410 Ca 0.04 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.11 3mka n HIS 410 Cb 0.27 -0.03 0.01 0.00 1.12 0.00 0.00 29.99 31.36 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 -2.08 3.22 0.20 -1.41 0.00 -1.09 -4.92 121.76 115.67 3mka s ALA 411 Ca 0.40 1.33 -0.10 0.00 0.00 0.00 0.00 51.96 53.59 3mka s ALA 411 Cb 0.21 -3.53 0.12 0.00 0.00 0.00 0.00 23.12 19.92 3mka s ALA 411 CO 0.37 -1.01 1.80 0.66 0.00 0.00 0.00 175.76 177.58 3mka h SER 412 N 2.44 0.89 -3.33 0.00 4.64 -1.90 -3.41 113.55 112.88 3mka h SER 412 Ca -0.50 -0.11 -0.65 0.00 -0.47 0.00 0.00 61.79 60.05 3mka h SER 412 Cb 1.26 -0.23 -0.27 0.00 -0.31 0.00 0.00 62.40 62.85 3mka h SER 412 CO 0.62 0.75 -0.74 -0.62 -0.87 0.00 0.00 176.83 175.97 3mka s ASP 413 N -6.06 4.20 0.22 4.97 -1.08 -1.26 -5.01 116.67 112.65 3mka s ASP 413 Ca -0.13 -0.34 -0.07 0.00 -0.52 0.00 0.00 52.55 51.50 3mka s ASP 413 Cb 0.14 -1.68 0.18 0.00 -1.46 0.00 0.00 42.92 40.11 3mka s ASP 413 CO 0.80 0.09 1.78 -0.65 0.52 0.00 0.00 175.17 177.71 3mka h PRO 414 N 7.27 1.16 -0.68 4.34 0.11 -1.94 -1.70 132.00 140.57 3mka h PRO 414 Ca -0.33 -0.22 -0.04 0.00 0.11 0.00 0.00 66.00 65.52 3mka h PRO 414 Cb 1.19 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.08 3mka h PRO 414 CO 0.59 0.95 0.27 1.96 -0.21 0.00 0.00 178.00 181.56 3mka h GLN 415 N 1.13 1.00 -0.61 1.05 1.08 -1.94 -2.41 115.11 114.39 3mka h GLN 415 Ca 0.25 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.29 3mka h GLN 415 Cb 0.24 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 3mka h GLN 415 CO -0.02 0.81 0.00 -1.13 -0.95 0.00 0.00 178.83 177.55 3mka n SER 416 N -4.30 3.38 -0.18 1.46 3.41 -1.12 -1.90 113.62 114.38 3mka n SER 416 Ca 0.06 -2.06 -0.01 0.00 -0.26 0.00 0.00 58.87 56.60 3mka n SER 416 Cb 0.18 -0.43 0.23 0.00 -0.26 0.00 0.00 64.21 63.93 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 4.07 1.37 -2.95 7.33 0.00 -0.78 -3.45 119.26 124.86 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 0.89 -0.27 0.11 0.00 0.00 0.00 0.00 17.79 18.52 3mka h ALA 417 CO 0.03 0.51 0.73 0.20 0.00 0.00 0.00 179.25 180.73 3mka s GLY 418 N -3.48 2.94 0.01 0.00 0.00 -1.26 -2.23 107.32 103.30 3mka s GLY 418 Ca -0.10 1.50 0.05 0.00 0.00 0.00 0.00 44.72 46.17 3mka s GLY 418 CO 0.79 2.15 -0.15 0.50 0.00 0.00 0.00 173.10 176.39 3mka s ARG 419 N -2.23 1.10 -0.09 2.90 1.81 0.60 -4.93 118.95 118.11 3mka s ARG 419 Ca 0.56 -0.64 0.02 0.00 -1.72 0.00 0.00 55.73 53.95 3mka s ARG 419 Cb -0.45 -1.09 0.01 0.00 -0.45 0.00 0.00 34.95 32.97 3mka s ARG 419 CO 0.59 0.29 -0.14 0.42 -0.68 0.00 0.00 175.30 175.78 3mka s ILE 420 N -0.56 1.37 -0.03 1.52 1.01 -1.26 -0.83 121.20 122.43 3mka s ILE 420 Ca 0.04 -0.58 0.03 0.00 0.00 0.00 0.00 60.65 60.14 3mka s ILE 420 Cb -0.07 -1.25 0.00 0.00 0.01 0.00 0.00 42.46 41.15 3mka s ILE 420 CO 0.00 0.41 -0.11 -0.69 0.00 0.00 0.00 174.94 174.56 3mka s VAL 421 N 0.89 0.92 0.19 2.92 1.01 0.95 -1.26 120.40 126.01 3mka s VAL 421 Ca -0.09 -0.44 0.10 0.00 0.00 0.00 0.00 61.98 61.55 3mka s VAL 421 Cb -0.15 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 3mka s VAL 421 CO 0.01 0.28 -0.14 -0.94 0.00 0.00 0.00 175.10 174.31 3mka s SER 422 N 0.15 4.01 -0.02 3.32 1.04 -0.39 -0.50 113.70 121.31 3mka s SER 422 Ca -0.03 -0.67 0.05 0.00 0.48 0.00 0.00 55.95 55.78 3mka s SER 422 Cb -0.09 -0.58 -0.01 0.00 0.10 0.00 0.00 66.02 65.44 3mka s SER 422 CO 0.01 0.10 -0.18 -0.36 0.98 0.00 0.00 173.24 173.79 3mka s PHE 423 N -1.73 1.65 0.55 5.02 0.08 -1.20 -1.03 117.98 121.31 3mka s PHE 423 Ca 0.24 -0.34 0.02 0.00 0.12 0.00 0.00 56.93 56.97 3mka s PHE 423 Cb -0.08 -1.07 0.04 0.00 -0.57 0.00 0.00 43.02 41.33 3mka s PHE 423 CO 0.14 -0.05 0.77 0.16 -0.10 0.00 0.00 175.22 176.14 3mka s ASP 424 N -0.36 5.26 0.66 1.36 1.47 -0.07 -4.69 116.67 120.30 3mka s ASP 424 Ca 0.05 -0.06 0.40 0.00 1.18 0.00 0.00 52.55 54.12 3mka s ASP 424 Cb -0.08 -0.82 2.19 0.00 -0.34 0.00 0.00 42.92 43.88 3mka s ASP 424 CO -0.00 -1.15 2.27 0.00 0.68 0.00 0.00 175.17 176.97 3mka h ALA 425 N 0.09 1.16 -0.50 2.11 0.00 -1.93 -0.89 119.26 119.29 3mka h ALA 425 Ca -0.42 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3mka h ALA 425 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3mka h ALA 425 CO 0.51 -0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.68 3mka n ALA 426 N -2.08 2.42 -0.21 0.00 0.00 -1.26 -4.46 120.51 114.92 3mka n ALA 426 Ca -0.03 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.51 3mka n ALA 426 Cb 0.15 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.63 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 1.34 1.21 3.70 0.00 0.00 -0.34 -4.51 105.19 106.58 3mka n GLY 427 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 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 0.92 3.36 -0.02 0.00 -1.26 -4.74 105.19 101.46 3mka n GLY 428 Ca 0.00 0.46 -0.25 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.22 2.03 -0.04 1.61 1.48 -1.26 -0.90 118.94 121.65 3mka s TRP 429 Ca 0.65 -0.41 -0.02 0.00 -1.06 0.00 0.00 56.10 55.26 3mka s TRP 429 Cb -0.59 -1.03 0.03 0.00 -1.16 0.00 0.00 33.47 30.72 3mka s TRP 429 CO 0.51 0.38 0.08 1.21 -4.06 0.00 0.00 176.95 175.07 3mka s ASN 430 N -2.50 -0.03 -0.07 -2.66 2.47 -0.20 -4.97 114.94 106.99 3mka s ASN 430 Ca 0.16 0.16 -0.20 0.00 0.42 0.00 0.00 52.86 53.40 3mka s ASN 430 Cb -0.08 0.08 -0.04 0.00 -1.45 0.00 0.00 41.25 39.76 3mka s ASN 430 CO 0.07 -0.11 0.57 -0.63 -3.72 0.00 0.00 177.10 173.28 3mka s ILE 431 N 0.85 5.07 -0.47 -5.21 1.01 -1.26 -1.27 121.20 119.91 3mka s ILE 431 Ca -0.07 1.16 -0.28 0.00 0.00 0.00 0.00 60.65 61.46 3mka s ILE 431 Cb -0.09 -3.90 0.03 0.00 0.01 0.00 0.00 42.46 38.50 3mka s ILE 431 CO -0.03 0.34 1.07 -1.61 0.00 0.00 0.00 174.94 174.70 3mka s GLU 432 N 0.38 3.65 0.21 2.79 0.41 -0.39 -4.92 118.70 120.83 3mka s GLU 432 Ca 0.30 0.42 0.10 0.00 -0.41 0.00 0.00 54.97 55.37 3mka s GLU 432 Cb -0.17 -3.92 0.12 0.00 -1.78 0.00 0.00 34.13 28.38 3mka s GLU 432 CO 0.14 -1.34 1.47 0.93 -0.49 0.00 0.00 175.26 175.97 3mka h GLU 433 N 9.19 0.00 0.00 1.61 4.39 -1.94 -3.34 114.58 124.49 3mka h GLU 433 Ca -0.23 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.41 3mka h GLU 433 Cb 1.07 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.71 3mka h GLU 433 CO 1.10 0.77 -0.29 0.93 -1.16 0.00 0.00 179.01 180.35 3mka h GLU 434 N 0.00 0.00 0.00 2.33 4.39 -2.00 -3.47 114.58 115.83 3mka h GLU 434 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3mka h GLU 434 Cb 1.39 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.04 3mka h GLU 434 CO 0.10 0.29 0.00 0.41 -1.16 0.00 0.00 179.01 178.65 3mka n GLY 435 N -0.57 2.13 3.60 -3.84 0.00 -1.26 -5.06 105.19 100.20 3mka n GLY 435 Ca -0.02 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 -2.20 -0.28 0.10 1.61 -0.85 -1.26 -0.65 117.35 113.82 3mka s TYR 436 Ca 0.00 -0.05 -0.26 0.00 -0.52 0.00 0.00 57.07 56.24 3mka s TYR 436 Cb 0.00 0.55 0.08 0.00 0.38 0.00 0.00 41.96 42.97 3mka s TYR 436 CO 0.00 -1.00 0.83 -1.14 -1.52 0.00 0.00 175.55 172.72 3mka s GLN 437 N -3.85 1.12 0.07 -3.49 2.00 0.29 -4.99 119.66 110.81 3mka s GLN 437 Ca 0.07 -0.51 -0.16 0.00 -2.00 0.00 0.00 55.36 52.76 3mka s GLN 437 Cb -0.03 0.46 0.03 0.00 0.80 0.00 0.00 33.01 34.27 3mka s GLN 437 CO -0.03 -0.50 0.37 0.00 -0.50 0.00 0.00 175.29 174.63 3mka s ALA 438 N -3.39 -0.87 0.05 1.58 0.00 -1.26 -0.85 121.76 117.02 3mka s ALA 438 Ca 0.07 0.10 -0.05 0.00 0.00 0.00 0.00 51.96 52.08 3mka s ALA 438 Cb -0.02 0.44 -0.01 0.00 0.00 0.00 0.00 23.12 23.52 3mka s ALA 438 CO -0.05 -0.50 0.08 0.14 0.00 0.00 0.00 175.76 175.43 3mka s VAL 439 N -2.90 0.15 0.00 0.00 -7.23 -0.15 -4.90 120.40 105.36 3mka s VAL 439 Ca -0.03 -1.21 0.00 0.00 -1.81 0.00 0.00 61.98 58.93 3mka s VAL 439 Cb 0.00 -1.03 0.00 0.00 0.56 0.00 0.00 36.38 35.91 3mka s VAL 439 CO -0.05 -0.67 0.00 0.61 -0.31 0.00 0.00 175.10 174.68 3mka n GLY 440 N 0.59 0.98 0.30 2.32 0.00 -1.26 -0.77 105.19 107.35 3mka n GLY 440 Ca -0.18 -2.23 0.17 0.00 0.00 0.00 0.00 46.02 43.78 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 -0.33 1.61 4.64 -1.69 -2.03 113.55 115.75 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 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 176.61 3mka n GLY 442 N -0.91 3.27 0.34 -0.77 0.00 -1.26 -4.70 105.19 101.16 3mka n GLY 442 Ca -0.02 -0.66 0.10 0.00 0.00 0.00 0.00 46.02 45.44 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 2.04 0.35 -0.42 1.61 4.64 -1.60 -1.70 113.55 118.46 3mka h SER 443 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 3mka h SER 443 Cb 1.05 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.06 3mka h SER 443 CO 0.10 0.22 -0.10 -0.07 -0.87 0.00 0.00 176.83 176.11 3mka h LEU 444 N 0.39 0.82 -0.28 5.97 4.07 -1.84 -0.11 115.31 124.34 3mka h LEU 444 Ca 0.23 -0.36 -0.03 0.00 0.08 0.00 0.00 57.88 57.80 3mka h LEU 444 Cb 0.40 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.90 3mka h LEU 444 CO -0.06 1.00 0.07 -0.26 -1.08 0.00 0.00 178.44 178.11 3mka h PHE 445 N 0.64 0.47 -0.71 1.13 0.04 -1.75 -1.02 116.94 115.74 3mka h PHE 445 Ca 0.11 -0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 3mka h PHE 445 Cb 0.64 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.62 3mka h PHE 445 CO 0.05 0.51 0.41 0.00 -0.60 0.00 0.00 178.31 178.68 3mka h ALA 446 N 0.90 0.91 -0.50 2.45 0.00 -1.24 -1.85 119.26 119.94 3mka h ALA 446 Ca 0.09 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3mka h ALA 446 Cb 0.28 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3mka h ALA 446 CO -0.00 0.40 0.02 0.87 0.00 0.00 0.00 179.25 180.55 3mka h LYS 447 N 0.98 0.82 -0.04 0.00 1.57 -0.76 -1.13 116.57 118.01 3mka h LYS 447 Ca 0.25 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.68 3mka h LYS 447 Cb 0.00 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 3mka h LYS 447 CO -0.04 0.81 -0.60 0.77 -0.57 0.00 0.00 179.45 179.82 3mka h SER 448 N 0.77 0.14 0.02 0.86 0.02 -0.82 -1.31 113.55 113.22 3mka h SER 448 Ca 0.15 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3mka h SER 448 Cb 0.44 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.93 3mka h SER 448 CO 0.02 0.70 -0.01 -1.28 -1.14 0.00 0.00 176.83 175.12 3mka h SER 449 N 0.09 -0.02 -0.43 3.07 0.87 -1.08 -3.04 113.55 113.01 3mka h SER 449 Ca -0.01 -0.43 0.01 0.00 -1.23 0.00 0.00 61.79 60.14 3mka h SER 449 Cb 1.08 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.02 3mka h SER 449 CO 0.09 0.42 0.29 0.24 -0.53 0.00 0.00 176.83 177.34 3mka h MET 450 N -0.46 0.55 -0.72 2.24 2.07 -1.08 0.19 114.93 117.73 3mka h MET 450 Ca -0.00 -0.03 0.15 0.00 -2.07 0.00 0.00 59.70 57.74 3mka h MET 450 Cb 0.44 -0.12 -0.04 0.00 -1.87 0.00 0.00 31.60 30.01 3mka h MET 450 CO 0.00 0.36 0.48 -0.22 1.07 0.00 0.00 176.91 178.61 3mka h LYS 451 N 0.56 0.34 0.06 1.72 3.64 -1.12 0.17 116.57 121.94 3mka h LYS 451 Ca 0.16 -0.02 -0.24 0.00 -1.27 0.00 0.00 60.65 59.28 3mka h LYS 451 Cb -0.03 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 3mka h LYS 451 CO -0.04 0.22 -1.27 0.87 -2.27 0.00 0.00 179.45 176.97 3mka h LYS 452 N 0.35 0.14 0.00 1.90 1.79 -0.98 -3.37 116.57 116.39 3mka h LYS 452 Ca 0.35 -0.23 0.00 0.00 -2.18 0.00 0.00 60.65 58.59 3mka h LYS 452 Cb 0.88 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.61 3mka h LYS 452 CO -0.10 1.11 0.00 1.28 -1.08 0.00 0.00 179.45 180.66 3mka n LEU 453 N -4.13 0.09 -0.32 2.94 4.77 -0.55 -4.31 117.00 115.49 3mka n LEU 453 Ca -0.27 0.51 -0.00 0.00 -0.03 0.00 0.00 56.01 56.23 3mka n LEU 453 Cb 0.80 -0.49 0.17 0.00 -2.33 0.00 0.00 43.42 41.56 3mka n LEU 453 CO 0.33 -0.15 1.27 0.22 -1.33 0.00 0.00 177.39 177.73 3mka h TYR 454 N 0.00 1.14 0.00 -1.77 3.20 -0.83 -2.15 116.97 116.56 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 0.40 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 38.28 3mka h TYR 454 CO 0.00 0.70 0.08 0.66 -1.64 0.00 0.00 178.16 177.96 3mka h SER 455 N 1.21 0.00 -0.02 -2.11 4.64 -1.85 0.61 113.55 116.03 3mka h SER 455 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 3mka h SER 455 Cb -0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 3mka h SER 455 CO -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.87 3mka n GLN 456 N -2.98 1.22 -3.18 4.77 6.02 -0.81 -4.76 117.38 117.67 3mka n GLN 456 Ca -0.03 -0.33 -0.40 0.00 -0.01 0.00 0.00 57.00 56.24 3mka n GLN 456 Cb 0.15 -1.43 -0.07 0.00 1.02 0.00 0.00 30.24 29.91 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 -1.97 5.04 0.00 5.09 1.01 0.20 -4.71 120.40 125.06 3mka s VAL 457 Ca 0.39 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.38 3mka s VAL 457 Cb 0.19 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.69 3mka s VAL 457 CO 0.31 0.08 0.00 0.35 0.00 0.00 0.00 175.10 175.83 3mka n THR 458 N 5.05 0.00 -3.83 3.92 -2.24 -1.26 -4.93 114.28 110.99 3mka n THR 458 Ca -0.03 -0.20 -0.06 0.00 -2.27 0.00 0.00 64.05 61.49 3mka n THR 458 Cb 0.49 0.86 0.01 0.00 -2.10 0.00 0.00 70.33 69.59 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 -0.60 -0.05 0.45 3.42 1.47 -1.26 -4.54 116.67 115.56 3mka s ASP 459 Ca 0.00 -0.83 0.29 0.00 1.18 0.00 0.00 52.55 53.19 3mka s ASP 459 Cb 0.00 0.68 1.58 0.00 -0.34 0.00 0.00 42.92 44.84 3mka s ASP 459 CO 0.00 -1.32 1.88 1.23 0.68 0.00 0.00 175.17 177.64 3mka h GLY 460 N 2.00 0.00 0.66 2.12 0.00 -1.93 0.18 103.07 106.10 3mka h GLY 460 Ca -0.28 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 46.69 3mka h GLY 460 CO 0.35 0.00 -1.96 1.22 0.00 0.00 0.00 176.54 176.15 3mka n ASP 461 N -2.55 1.96 0.04 0.19 9.92 -1.26 -2.52 116.55 122.33 3mka n ASP 461 Ca -0.02 0.24 -0.13 0.00 -0.53 0.00 0.00 54.79 54.34 3mka n ASP 461 Cb 0.09 -0.76 -0.02 0.00 -0.64 0.00 0.00 41.12 39.78 3mka n ASP 461 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 3mka h SER 462 N 0.06 0.64 0.17 -2.24 4.64 -1.72 -2.46 113.55 112.64 3mka h SER 462 Ca -0.41 -0.45 -0.12 0.00 -0.47 0.00 0.00 61.79 60.35 3mka h SER 462 Cb 2.03 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 63.92 3mka h SER 462 CO 0.09 1.22 -0.43 1.23 -0.87 0.00 0.00 176.83 178.07 3mka h GLY 463 N 1.03 0.36 1.56 -0.77 0.00 -0.80 -2.06 103.07 102.40 3mka h GLY 463 Ca -0.05 -0.36 -0.16 0.00 0.00 0.00 0.00 47.33 46.76 3mka h GLY 463 CO 0.15 0.33 -0.58 -2.00 0.00 0.00 0.00 176.54 174.43 3mka h LEU 464 N 0.28 0.51 -0.28 3.11 5.85 -1.41 -2.37 115.31 120.99 3mka h LEU 464 Ca 0.02 -0.28 -0.11 0.00 0.84 0.00 0.00 57.88 58.35 3mka h LEU 464 Cb 0.88 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 41.75 3mka h LEU 464 CO 0.07 0.98 -0.25 -0.09 -0.34 0.00 0.00 178.44 178.81 3mka h ARG 465 N 0.34 0.67 0.00 1.25 2.43 -1.28 -2.12 114.38 115.67 3mka h ARG 465 Ca -0.00 -0.34 -0.02 0.00 -0.81 0.00 0.00 59.98 58.81 3mka h ARG 465 Cb 1.11 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.67 3mka h ARG 465 CO 0.10 0.95 -0.08 0.28 -1.51 0.00 0.00 179.97 179.71 3mka h VAL 466 N 0.41 0.55 0.03 0.20 2.07 -1.31 -1.06 116.25 117.15 3mka h VAL 466 Ca 0.05 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 3mka h VAL 466 Cb 0.81 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 3mka h VAL 466 CO 0.06 0.08 -0.01 0.00 0.02 0.00 0.00 177.57 177.72 3mka h ALA 467 N 1.92 -0.04 0.00 1.67 0.00 -1.08 -2.82 119.26 118.91 3mka h ALA 467 Ca -0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.52 3mka h ALA 467 Cb 0.22 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 3mka h ALA 467 CO 0.01 -0.09 -0.15 0.28 0.00 0.00 0.00 179.25 179.30 3mka h VAL 468 N -0.91 0.96 -0.25 0.00 2.07 -1.21 -2.12 116.25 114.80 3mka h VAL 468 Ca -0.00 -0.55 -0.19 0.00 0.82 0.00 0.00 66.70 66.77 3mka h VAL 468 Cb 0.72 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 3mka h VAL 468 CO 0.01 0.15 -0.61 -0.08 0.02 0.00 0.00 177.57 177.06 3mka h GLU 469 N 0.00 0.82 -0.24 1.57 4.81 -1.27 -1.48 114.58 118.80 3mka h GLU 469 Ca -0.00 -0.56 -0.06 0.00 -0.13 0.00 0.00 59.36 58.61 3mka h GLU 469 Cb 0.30 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 3mka h GLU 469 CO 0.02 1.18 -0.13 0.00 -0.73 0.00 0.00 179.01 179.35 3mka h ALA 470 N 0.69 1.34 0.00 2.92 0.00 -1.14 -0.45 119.26 122.62 3mka h ALA 470 Ca -0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 3mka h ALA 470 Cb 1.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 3mka h ALA 470 CO 0.13 0.45 -0.40 1.25 0.00 0.00 0.00 179.25 180.68 3mka h LEU 471 N 0.36 0.00 -0.09 0.00 5.85 -1.24 -2.10 115.31 118.10 3mka h LEU 471 Ca 0.07 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 3mka h LEU 471 Cb 0.45 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.49 3mka h LEU 471 CO 0.03 0.40 -0.28 0.22 -0.34 0.00 0.00 178.44 178.46 3mka h TYR 472 N 0.00 0.45 -0.46 1.25 3.20 -0.28 -2.49 116.97 118.63 3mka h TYR 472 Ca -0.00 -0.18 -0.02 0.00 3.14 0.00 0.00 58.73 61.66 3mka h TYR 472 Cb 1.11 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 3mka h TYR 472 CO 0.00 0.90 0.20 -0.44 -1.64 0.00 0.00 178.16 177.17 3mka h ASP 473 N -0.13 0.59 -0.38 -2.11 3.32 -1.01 -1.49 116.42 115.22 3mka h ASP 473 Ca -0.01 -0.06 -0.15 0.00 0.02 0.00 0.00 57.03 56.83 3mka h ASP 473 Cb 0.91 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 3mka h ASP 473 CO 0.06 0.53 -0.32 0.00 -1.72 0.00 0.00 179.24 177.79 3mka h ALA 474 N 1.56 0.66 0.00 3.45 0.00 -1.36 -2.50 119.26 121.08 3mka h ALA 474 Ca 0.16 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 3mka h ALA 474 Cb 0.11 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3mka h ALA 474 CO -0.02 0.67 -0.29 0.00 0.00 0.00 0.00 179.25 179.61 3mka h ALA 475 N 0.86 1.27 -0.35 0.00 0.00 -0.90 -1.81 119.26 118.33 3mka h ALA 475 Ca 0.08 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 3mka h ALA 475 Cb 0.89 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3mka h ALA 475 CO 0.08 0.37 -0.15 0.22 0.00 0.00 0.00 179.25 179.77 3mka h ASP 476 N 0.00 0.62 -0.01 0.00 3.58 -0.85 -3.29 116.42 116.46 3mka h ASP 476 Ca -0.00 -0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.26 3mka h ASP 476 Cb 0.61 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 41.49 3mka h ASP 476 CO 0.04 0.79 -0.12 0.47 -2.88 0.00 0.00 179.24 177.53 3mka n ASP 477 N -4.17 1.78 -3.84 2.28 8.00 -1.10 -4.93 116.55 114.58 3mka n ASP 477 Ca 0.01 -1.39 -0.24 0.00 0.71 0.00 0.00 54.79 53.87 3mka n ASP 477 Cb 0.36 0.22 -0.17 0.00 -0.02 0.00 0.00 41.12 41.51 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 -1.35 1.77 0.32 -2.24 2.15 -0.70 -5.00 116.67 111.62 3mka s ASP 478 Ca 0.13 -0.17 0.26 0.00 0.43 0.00 0.00 52.55 53.20 3mka s ASP 478 Cb 0.11 -0.60 0.95 0.00 -0.30 0.00 0.00 42.92 43.08 3mka s ASP 478 CO 0.24 -0.15 1.77 0.77 -0.17 0.00 0.00 175.17 177.63 3mka h SER 479 N 8.16 0.00 1.44 -0.34 4.64 -1.87 -2.79 113.55 122.79 3mka h SER 479 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 3mka h SER 479 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3mka h SER 479 CO 0.33 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.29 3mka h ALA 480 N 2.25 1.00 -3.09 5.18 0.00 -1.94 -3.43 119.26 119.23 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 0.55 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 18.16 3mka h ALA 480 CO 0.00 0.00 -0.58 0.99 0.00 0.00 0.00 179.25 179.66 3mka s THR 481 N -3.17 4.69 0.04 0.00 2.01 -1.05 -4.50 115.64 113.66 3mka s THR 481 Ca 0.09 -0.05 -0.19 0.00 0.31 0.00 0.00 61.69 61.85 3mka s THR 481 Cb 0.11 -3.17 -0.06 0.00 0.01 0.00 0.00 72.50 69.39 3mka s THR 481 CO 0.58 0.38 0.55 -0.83 -0.69 0.00 0.00 174.62 174.61 3mka s GLY 482 N 1.07 2.63 0.20 4.40 0.00 -1.26 -4.46 107.32 109.90 3mka s GLY 482 Ca 0.05 -0.00 0.02 0.00 0.00 0.00 0.00 44.72 44.79 3mka s GLY 482 CO 0.03 0.50 0.28 0.61 0.00 0.00 0.00 173.10 174.53 3mka n GLY 483 N 1.94 1.67 3.67 0.20 0.00 -1.26 -4.44 105.19 106.97 3mka n GLY 483 Ca -0.10 -2.12 -0.43 0.00 0.00 0.00 0.00 46.02 43.37 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 -1.46 2.75 -2.98 1.61 -0.04 -1.26 -4.93 135.00 128.68 3mka n PRO 484 Ca 0.05 1.00 -0.44 0.00 -0.04 0.00 0.00 63.50 64.08 3mka n PRO 484 Cb 0.20 -2.92 -0.04 0.00 -0.04 0.00 0.00 33.50 30.70 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 3.68 6.28 0.50 3.54 -1.08 -0.53 -4.90 116.67 124.16 3mka s ASP 485 Ca 0.87 -1.40 0.29 0.00 -0.52 0.00 0.00 52.55 51.78 3mka s ASP 485 Cb -0.49 -2.37 0.97 0.00 -1.46 0.00 0.00 42.92 39.58 3mka s ASP 485 CO 0.41 -1.23 1.84 -0.07 0.52 0.00 0.00 175.17 176.65 3mka h LEU 486 N 10.57 0.00 -0.03 -1.34 4.07 -1.92 0.28 115.31 126.94 3mka h LEU 486 Ca -0.19 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 57.54 3mka h LEU 486 Cb 1.07 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.82 3mka h LEU 486 CO 1.13 0.02 -0.87 0.58 -1.08 0.00 0.00 178.44 178.22 3mka h VAL 487 N 0.00 1.32 0.00 1.22 2.07 -1.96 -3.30 116.25 115.59 3mka h VAL 487 Ca -0.00 -2.14 0.00 0.00 0.82 0.00 0.00 66.70 65.38 3mka h VAL 487 Cb 0.70 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 3mka h VAL 487 CO 0.00 0.65 -1.14 0.54 0.02 0.00 0.00 177.57 177.65 3mka n ARG 488 N -3.98 0.24 -2.61 1.57 1.74 -1.22 -5.00 116.66 107.41 3mka n ARG 488 Ca -0.10 -0.03 -0.06 0.00 -0.77 0.00 0.00 57.85 56.88 3mka n ARG 488 Cb 0.80 -1.55 0.03 0.00 -1.02 0.00 0.00 32.46 30.72 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 1.40 0.31 3.42 -0.13 0.00 0.90 -5.04 105.19 106.06 3mka n GLY 489 Ca 0.02 -0.34 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 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 -3.11 3.35 0.23 -0.61 1.01 -0.77 -5.00 121.20 116.31 3mka s ILE 490 Ca 0.08 -0.56 0.02 0.00 0.00 0.00 0.00 60.65 60.19 3mka s ILE 490 Cb -0.03 -2.43 -0.05 0.00 0.01 0.00 0.00 42.46 39.96 3mka s ILE 490 CO 0.23 0.52 0.04 -0.36 0.00 0.00 0.00 174.94 175.37 3mka s PHE 491 N 0.27 1.49 0.90 3.97 0.08 -1.26 -1.45 117.98 121.98 3mka s PHE 491 Ca -0.07 -1.05 -0.12 0.00 0.12 0.00 0.00 56.93 55.81 3mka s PHE 491 Cb -0.15 -0.88 0.09 0.00 -0.57 0.00 0.00 43.02 41.52 3mka s PHE 491 CO 0.05 -0.20 0.89 -2.30 -0.10 0.00 0.00 175.22 173.55 3mka n PRO 492 N -0.41 -0.26 -4.22 0.24 -0.02 -1.26 -4.80 135.00 124.27 3mka n PRO 492 Ca -0.03 -0.02 -0.31 0.00 -2.02 0.00 0.00 63.50 61.12 3mka n PRO 492 Cb 0.65 -2.19 -0.08 0.00 -0.02 0.00 0.00 33.50 31.85 3mka n PRO 492 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3mka s THR 493 N -2.44 4.08 0.05 3.45 -4.23 -0.79 -4.94 115.64 110.82 3mka s THR 493 Ca 0.65 -0.78 -0.02 0.00 -1.18 0.00 0.00 61.69 60.36 3mka s THR 493 Cb -0.24 -2.88 -0.03 0.00 1.34 0.00 0.00 72.50 70.69 3mka s THR 493 CO 0.60 0.26 -0.00 0.00 -0.54 0.00 0.00 174.62 174.93 3mka s ALA 494 N -1.19 0.36 0.01 3.99 0.00 -1.26 -1.49 121.76 122.18 3mka s ALA 494 Ca 0.22 -1.04 0.01 0.00 0.00 0.00 0.00 51.96 51.16 3mka s ALA 494 Cb -0.12 0.27 -0.01 0.00 0.00 0.00 0.00 23.12 23.26 3mka s ALA 494 CO 0.14 -0.35 -0.04 0.08 0.00 0.00 0.00 175.76 175.59 3mka s VAL 495 N -3.49 0.33 0.08 0.00 1.01 0.07 -1.48 120.40 116.92 3mka s VAL 495 Ca 0.03 -0.38 0.07 0.00 0.00 0.00 0.00 61.98 61.70 3mka s VAL 495 Cb 0.05 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 3mka s VAL 495 CO -0.08 -0.04 -0.20 -0.51 0.00 0.00 0.00 175.10 174.27 3mka s ILE 496 N -0.42 1.60 -0.04 2.22 2.07 0.43 -1.34 121.20 125.73 3mka s ILE 496 Ca -0.02 -1.39 -0.02 0.00 -1.41 0.00 0.00 60.65 57.81 3mka s ILE 496 Cb -0.04 -1.44 0.03 0.00 0.13 0.00 0.00 42.46 41.14 3mka s ILE 496 CO -0.00 -0.00 0.06 -0.63 -1.91 0.00 0.00 174.94 172.46 3mka s ILE 497 N -1.05 -0.11 0.00 2.00 1.01 -0.21 0.04 121.20 122.88 3mka s ILE 497 Ca 0.06 0.40 0.00 0.00 0.00 0.00 0.00 60.65 61.11 3mka s ILE 497 Cb -0.10 -0.15 0.00 0.00 0.01 0.00 0.00 42.46 42.22 3mka s ILE 497 CO 0.03 0.17 0.00 -0.90 0.00 0.00 0.00 174.94 174.24 3mka n ASP 498 N 5.19 0.90 -0.01 3.58 5.68 -1.16 -1.77 116.55 128.97 3mka n ASP 498 Ca -0.06 -0.86 0.23 0.00 -0.50 0.00 0.00 54.79 53.61 3mka n ASP 498 Cb 0.50 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.19 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 2.40 -0.20 2.12 0.00 -1.94 0.32 119.26 122.96 3mka h ALA 499 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3mka h ALA 499 Cb 0.00 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3mka h ALA 499 CO 0.00 -0.87 0.00 -0.25 0.00 0.00 0.00 179.25 178.13 3mka n ASP 500 N -3.84 1.14 0.00 0.00 8.00 -1.26 -5.03 116.55 115.57 3mka n ASP 500 Ca 0.12 -2.01 0.00 0.00 0.71 0.00 0.00 54.79 53.61 3mka n ASP 500 Cb 0.79 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.74 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 0.53 3.71 0.44 0.00 0.10 -5.00 105.19 105.76 3mka n GLY 501 Ca 0.07 -2.08 -0.39 0.00 0.00 0.00 0.00 46.02 43.61 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 -1.18 3.41 0.05 4.61 0.00 0.31 -2.96 121.76 126.00 3mka s ALA 502 Ca 0.00 -0.03 0.07 0.00 0.00 0.00 0.00 51.96 52.00 3mka s ALA 502 Cb 0.00 -2.86 -0.03 0.00 0.00 0.00 0.00 23.12 20.23 3mka s ALA 502 CO 0.00 -0.14 -0.19 0.08 0.00 0.00 0.00 175.76 175.51 3mka s VAL 503 N 0.91 1.51 0.05 0.00 1.01 0.11 -4.96 120.40 119.03 3mka s VAL 503 Ca 0.33 -1.18 -0.30 0.00 0.00 0.00 0.00 61.98 60.82 3mka s VAL 503 Cb -0.17 -1.34 -0.05 0.00 0.00 0.00 0.00 36.38 34.83 3mka s VAL 503 CO 0.14 0.12 1.03 -1.81 0.00 0.00 0.00 175.10 174.57 3mka s ASP 504 N -1.25 7.34 0.20 3.32 1.01 -1.26 -0.42 116.67 125.60 3mka s ASP 504 Ca 0.06 1.79 -0.30 0.00 0.71 0.00 0.00 52.55 54.81 3mka s ASP 504 Cb -0.09 -2.58 -0.08 0.00 1.01 0.00 0.00 42.92 41.18 3mka s ASP 504 CO 0.02 -0.25 1.06 -0.69 0.21 0.00 0.00 175.17 175.51 3mka s VAL 505 N 0.68 3.91 0.27 -1.27 1.01 -0.55 -4.92 120.40 119.53 3mka s VAL 505 Ca 0.52 1.73 -0.29 0.00 0.00 0.00 0.00 61.98 63.93 3mka s VAL 505 Cb -0.24 -4.10 -0.09 0.00 0.00 0.00 0.00 36.38 31.95 3mka s VAL 505 CO 0.29 0.34 1.14 -2.16 0.00 0.00 0.00 175.10 174.71 3mka s PRO 506 N -0.67 4.58 0.23 2.72 0.04 -1.26 -4.68 135.00 135.97 3mka s PRO 506 Ca 0.47 1.88 -0.14 0.00 0.04 0.00 0.00 61.00 63.24 3mka s PRO 506 Cb -0.29 -3.18 0.29 0.00 0.04 0.00 0.00 34.50 31.36 3mka s PRO 506 CO 0.35 0.11 1.57 1.49 0.04 0.00 0.00 177.00 180.56 3mka h GLU 507 N 3.95 -0.03 -0.81 4.56 4.81 -1.94 -1.45 114.58 123.67 3mka h GLU 507 Ca -0.47 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 58.88 3mka h GLU 507 Cb 1.21 0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.54 3mka h GLU 507 CO 0.68 -0.02 0.53 0.66 -0.73 0.00 0.00 179.01 180.12 3mka h SER 508 N -0.03 0.61 0.51 1.04 4.64 -1.98 0.14 113.55 118.47 3mka h SER 508 Ca 0.36 0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.62 3mka h SER 508 Cb 0.61 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 3mka h SER 508 CO -0.89 0.34 -0.41 -0.09 -0.87 0.00 0.00 176.83 174.92 3mka h ARG 509 N 0.66 0.00 0.16 4.77 9.65 -1.64 -1.27 114.38 126.71 3mka h ARG 509 Ca 0.39 0.00 -0.27 0.00 -1.10 0.00 0.00 59.98 59.00 3mka h ARG 509 Cb 0.59 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 29.19 3mka h ARG 509 CO -0.15 0.41 -1.14 0.82 2.80 0.00 0.00 179.97 182.70 3mka h ILE 510 N 0.00 1.36 -0.66 1.20 2.04 -0.91 -2.51 117.51 118.03 3mka h ILE 510 Ca -0.00 -2.52 0.07 0.00 1.00 0.00 0.00 64.86 63.40 3mka h ILE 510 Cb 0.77 2.95 -0.06 0.00 -0.74 0.00 0.00 36.82 39.74 3mka h ILE 510 CO 0.05 0.75 0.35 0.00 0.00 0.00 0.00 178.15 179.30 3mka h ALA 511 N 0.19 0.88 -0.02 1.87 0.00 -0.73 0.26 119.26 121.71 3mka h ALA 511 Ca -0.19 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.76 3mka h ALA 511 Cb 1.87 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.56 3mka h ALA 511 CO 0.22 -0.00 -0.02 1.49 0.00 0.00 0.00 179.25 180.93 3mka h GLU 512 N 0.63 -0.02 -0.18 0.00 4.81 -1.28 -0.13 114.58 118.40 3mka h GLU 512 Ca 0.30 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.50 3mka h GLU 512 Cb 0.24 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3mka h GLU 512 CO -0.21 -0.01 -0.06 1.25 -0.73 0.00 0.00 179.01 179.25 3mka h LEU 513 N -0.02 0.25 0.18 1.64 5.85 -0.85 -2.25 115.31 120.11 3mka h LEU 513 Ca 0.02 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3mka h LEU 513 Cb 0.04 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.01 3mka h LEU 513 CO -0.04 0.35 -0.09 0.00 -0.34 0.00 0.00 178.44 178.33 3mka h ALA 514 N 1.68 -0.24 -0.91 1.25 0.00 -0.04 -2.53 119.26 118.46 3mka h ALA 514 Ca 0.06 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.90 3mka h ALA 514 Cb 0.28 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 3mka h ALA 514 CO 0.01 -0.41 0.59 0.00 0.00 0.00 0.00 179.25 179.43 3mka h ARG 515 N -0.68 0.76 0.15 0.00 3.08 -0.90 0.21 114.38 116.99 3mka h ARG 515 Ca -0.02 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3mka h ARG 515 Cb 0.49 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 3mka h ARG 515 CO 0.04 0.50 -0.08 0.00 -1.07 0.00 0.00 179.97 179.37 3mka h ALA 516 N 1.58 -0.21 -0.03 0.04 0.00 -1.29 -0.34 119.26 119.02 3mka h ALA 516 Ca 0.45 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.32 3mka h ALA 516 Cb 0.62 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 3mka h ALA 516 CO -0.22 -0.62 0.01 0.82 0.00 0.00 0.00 179.25 179.25 3mka h ILE 517 N -0.21 1.00 0.39 0.00 2.04 -0.76 -0.49 117.51 119.47 3mka h ILE 517 Ca -0.02 -0.01 -0.01 0.00 1.00 0.00 0.00 64.86 65.82 3mka h ILE 517 Cb 0.17 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 3mka h ILE 517 CO 0.03 0.01 -0.44 0.40 0.00 0.00 0.00 178.15 178.14 3mka h ILE 518 N 0.03 0.00 -0.65 -0.67 2.04 -0.46 -0.87 117.51 116.93 3mka h ILE 518 Ca 0.01 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.00 3mka h ILE 518 Cb 0.00 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 35.96 3mka h ILE 518 CO -0.01 0.00 -0.13 -0.08 0.00 0.00 0.00 178.15 177.94 3mka h GLU 519 N -0.83 0.02 0.00 2.37 4.57 -1.05 0.36 114.58 120.02 3mka h GLU 519 Ca -0.05 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 3mka h GLU 519 Cb 0.74 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.32 3mka h GLU 519 CO -0.08 0.01 -0.01 1.03 -1.18 0.00 0.00 179.01 178.78 3mka h SER 520 N 0.02 0.00 0.99 1.04 0.87 -0.70 -2.23 113.55 113.54 3mka h SER 520 Ca 0.32 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.70 3mka h SER 520 Cb 0.50 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.44 3mka h SER 520 CO -0.65 0.01 -1.07 0.03 -0.53 0.00 0.00 176.83 174.62 3mka h ARG 521 N 0.00 0.00 -0.02 2.24 2.47 0.12 -3.50 114.38 115.68 3mka h ARG 521 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3mka h ARG 521 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.37 3mka h ARG 521 CO 0.00 0.58 0.00 -1.13 0.56 0.00 0.00 179.97 179.98