#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 6.84 0.00 4.52 2.15 -1.26 -4.83 116.67 124.10 3mka s ASP -37 Ca 0.00 2.03 0.21 0.00 0.43 0.00 0.00 52.55 55.22 3mka s ASP -37 Cb 0.00 -2.55 0.31 0.00 -0.30 0.00 0.00 42.92 40.38 3mka s ASP -37 CO 0.00 -0.76 1.28 0.18 -0.17 0.00 0.00 175.17 175.70 3mka n LEU -36 N 5.98 3.12 -3.85 -1.34 4.77 -1.26 -4.96 117.00 119.47 3mka n LEU -36 Ca 0.14 -1.33 -0.28 0.00 -0.03 0.00 0.00 56.01 54.50 3mka n LEU -36 Cb 0.44 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.41 3mka n LEU -36 CO 0.59 0.63 0.10 -1.20 -1.33 0.00 0.00 177.39 176.18 3mka n SER -35 N 1.29 -4.50 -4.34 -1.43 7.64 -1.26 -4.96 113.62 106.06 3mka n SER -35 Ca 0.16 -0.76 -0.36 0.00 1.01 0.00 0.00 58.87 58.93 3mka n SER -35 Cb 0.56 -4.05 -0.13 0.00 -1.01 0.00 0.00 64.21 59.57 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 -3.46 4.60 0.42 6.43 0.15 -1.26 -4.40 113.70 116.17 3mka s SER -34 Ca 0.56 -0.40 0.10 0.00 0.70 0.00 0.00 55.95 56.92 3mka s SER -34 Cb -0.28 -1.80 0.94 0.00 -1.71 0.00 0.00 66.02 63.17 3mka s SER -34 CO 0.82 -0.05 2.01 0.15 1.20 0.00 0.00 173.24 177.37 3mka h PHE -33 N 8.15 0.49 0.06 3.44 3.57 -1.93 0.60 116.94 131.33 3mka h PHE -33 Ca -0.39 0.01 -0.14 0.00 3.53 0.00 0.00 57.97 60.98 3mka h PHE -33 Cb 1.16 -0.16 0.01 0.00 2.79 0.00 0.00 35.95 39.75 3mka h PHE -33 CO 0.61 0.27 -0.57 1.15 -2.23 0.00 0.00 178.31 177.54 3mka h THR -32 N 0.50 1.52 -0.25 4.41 2.02 -1.94 -2.23 112.91 116.92 3mka h THR -32 Ca 0.23 -2.27 -0.02 0.00 0.77 0.00 0.00 66.41 65.12 3mka h THR -32 Cb 0.26 2.95 -0.01 0.00 -1.74 0.00 0.00 68.15 69.61 3mka h THR -32 CO -0.06 0.64 0.06 -0.78 0.37 0.00 0.00 175.52 175.75 3mka h ASP -31 N -0.37 0.33 -0.42 4.18 1.82 -1.93 0.04 116.42 120.07 3mka h ASP -31 Ca -0.09 -0.03 -0.08 0.00 -0.39 0.00 0.00 57.03 56.43 3mka h ASP -31 Cb 1.36 -0.08 -0.01 0.00 0.68 0.00 0.00 39.33 41.28 3mka h ASP -31 CO 0.11 0.34 -0.07 0.15 -1.61 0.00 0.00 179.24 178.16 3mka h PHE -30 N 0.36 0.88 -0.57 0.28 3.57 -0.86 -2.91 116.94 117.68 3mka h PHE -30 Ca 0.09 -0.18 -0.05 0.00 3.53 0.00 0.00 57.97 61.36 3mka h PHE -30 Cb 0.14 -0.22 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 3mka h PHE -30 CO 0.00 0.89 0.14 -0.07 -2.23 0.00 0.00 178.31 177.04 3mka h LEU -29 N 0.61 0.82 -1.08 0.59 3.38 -0.75 -2.05 115.31 116.83 3mka h LEU -29 Ca 0.11 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3mka h LEU -29 Cb 0.59 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.08 3mka h LEU -29 CO 0.04 0.80 0.58 -0.09 0.09 0.00 0.00 178.44 179.85 3mka h ARG -28 N 0.85 1.20 -0.00 1.13 2.43 -0.85 0.71 114.38 119.84 3mka h ARG -28 Ca 0.18 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3mka h ARG -28 Cb 0.30 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.59 3mka h ARG -28 CO -0.00 0.81 -0.44 2.89 -1.51 0.00 0.00 179.97 181.72 3mka n ARG -27 N -4.39 0.28 -0.02 0.20 1.85 -1.05 -4.51 116.66 109.03 3mka n ARG -27 Ca 0.10 -0.17 -0.03 0.00 -1.00 0.00 0.00 57.85 56.75 3mka n ARG -27 Cb 0.03 -1.50 -0.01 0.00 -1.05 0.00 0.00 32.46 29.93 3mka n ARG -27 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 3mka n GLN -26 N -1.21 0.08 -3.38 2.89 1.13 -0.60 -4.95 117.38 111.35 3mka n GLN -26 Ca 0.08 0.03 -0.26 0.00 -1.94 0.00 0.00 57.00 54.91 3mka n GLN -26 Cb 0.34 -0.85 -0.09 0.00 0.11 0.00 0.00 30.24 29.75 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 -2.89 2.95 0.07 -1.58 0.00 0.24 -4.93 120.51 114.37 3mka n ALA -25 Ca -0.07 -3.66 0.04 0.00 0.00 0.00 0.00 53.44 49.75 3mka n ALA -25 Cb 0.56 -0.83 0.45 0.00 0.00 0.00 0.00 19.45 19.63 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 4.71 0.38 -0.91 0.00 0.11 -1.75 -2.43 132.00 132.11 3mka h PRO -24 Ca 0.16 -0.04 0.18 0.00 0.11 0.00 0.00 66.00 66.41 3mka h PRO -24 Cb 0.84 -0.08 -0.07 0.00 0.11 0.00 0.00 31.00 31.80 3mka h PRO -24 CO 0.52 0.31 0.59 1.49 -0.21 0.00 0.00 178.00 180.70 3mka h GLU -23 N 0.38 0.54 -0.37 1.05 4.81 -1.91 0.11 114.58 119.18 3mka h GLU -23 Ca 0.10 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.22 3mka h GLU -23 Cb 0.06 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 3mka h GLU -23 CO -0.01 0.36 -0.07 -0.07 -0.73 0.00 0.00 179.01 178.48 3mka h LEU -22 N 0.56 0.61 -9.84 1.64 4.07 -1.81 -3.45 115.31 107.08 3mka h LEU -22 Ca 0.47 -0.15 -0.54 0.00 0.08 0.00 0.00 57.88 57.74 3mka h LEU -22 Cb 0.96 -0.16 0.10 0.00 1.08 0.00 0.00 40.66 42.64 3mka h LEU -22 CO -0.21 0.73 0.77 0.18 -1.08 0.00 0.00 178.44 178.83 3mka n LEU -21 N -4.21 4.38 -0.06 1.67 4.77 0.36 -4.89 117.00 119.02 3mka n LEU -21 Ca 0.01 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 57.18 3mka n LEU -21 Cb 0.31 -1.58 0.29 0.00 -2.33 0.00 0.00 43.42 40.11 3mka n LEU -21 CO 0.41 0.04 1.02 1.55 -1.33 0.00 0.00 177.39 179.09 3mka h PRO -20 N 3.69 0.65 -6.64 3.23 0.13 -1.87 -3.45 132.00 127.74 3mka h PRO -20 Ca -0.48 -0.10 -0.57 0.00 -0.87 0.00 0.00 66.00 63.97 3mka h PRO -20 Cb 1.24 -0.11 0.09 0.00 0.13 0.00 0.00 31.00 32.35 3mka h PRO -20 CO 0.70 0.57 0.61 0.00 -0.23 0.00 0.00 178.00 179.66 3mka n ALA -19 N -2.47 1.29 -2.62 -0.56 0.00 -1.26 -4.99 120.51 109.90 3mka n ALA -19 Ca 0.03 0.40 -0.13 0.00 0.00 0.00 0.00 53.44 53.74 3mka n ALA -19 Cb 0.18 -2.29 -0.11 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 0.18 1.02 0.25 0.00 0.01 -1.26 -5.09 113.70 108.80 3mka s SER -18 Ca 0.65 -0.71 -0.18 0.00 1.31 0.00 0.00 55.95 57.02 3mka s SER -18 Cb -0.62 0.05 0.01 0.00 0.21 0.00 0.00 66.02 65.68 3mka s SER -18 CO 0.52 -0.28 0.59 -0.51 0.41 0.00 0.00 173.24 173.97 3mka s ILE -17 N -2.13 0.01 0.00 1.44 2.07 -1.26 -4.13 121.20 117.19 3mka s ILE -17 Ca -0.02 -1.07 0.00 0.00 -1.41 0.00 0.00 60.65 58.15 3mka s ILE -17 Cb -0.05 -1.96 0.00 0.00 0.13 0.00 0.00 42.46 40.58 3mka s ILE -17 CO -0.01 -0.03 0.00 -0.24 -1.91 0.00 0.00 174.94 172.75 3mka n SER -16 N -0.41 0.00 -4.28 4.50 2.88 -1.26 -5.16 113.62 109.89 3mka n SER -16 Ca -0.05 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.32 3mka n SER -16 Cb 0.61 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.97 3mka n SER -16 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3mka s GLN -5 N 0.00 1.45 0.57 -1.46 1.03 -1.26 -5.18 119.66 114.82 3mka s GLN -5 Ca 0.00 -1.80 -0.18 0.00 0.04 0.00 0.00 55.36 53.43 3mka s GLN -5 Cb 0.00 -0.28 -0.04 0.00 0.03 0.00 0.00 33.01 32.71 3mka s GLN -5 CO 0.00 -0.31 1.10 -0.51 -2.54 0.00 0.00 175.29 173.03 3mka s LEU -4 N -3.33 3.63 0.39 2.60 1.02 -1.26 -4.85 118.68 116.87 3mka s LEU -4 Ca 0.37 2.03 -0.27 0.00 0.02 0.00 0.00 54.13 56.28 3mka s LEU -4 Cb 0.07 -4.56 -0.10 0.00 0.02 0.00 0.00 46.19 41.63 3mka s LEU -4 CO 0.14 -1.24 1.39 -2.84 0.02 0.00 0.00 176.35 173.82 3mka s PRO -3 N -3.62 4.06 0.10 1.29 0.02 -1.26 -4.76 135.00 130.82 3mka s PRO -3 Ca 0.69 2.36 -0.13 0.00 0.02 0.00 0.00 61.00 63.94 3mka s PRO -3 Cb -0.20 -2.89 0.04 0.00 0.02 0.00 0.00 34.50 31.47 3mka s PRO -3 CO 0.31 -0.49 0.61 -2.39 -0.33 0.00 0.00 177.00 174.70 3mka n HIS -2 N 0.35 -0.96 -0.00 6.54 1.44 -0.17 -2.15 115.22 120.26 3mka n HIS -2 Ca 0.02 -0.70 0.00 0.00 -2.01 0.00 0.00 57.72 55.03 3mka n HIS -2 Cb 0.41 0.34 0.00 0.00 0.12 0.00 0.00 29.99 30.86 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 -0.43 1.27 3.57 -1.39 0.00 -1.20 -1.41 105.19 105.60 3mka n GLY -1 Ca -0.01 -1.34 -0.06 0.00 0.00 0.00 0.00 46.02 44.62 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 -0.08 -1.99 -0.06 4.61 0.00 -1.26 -4.58 121.76 118.40 3mka s ALA 301 Ca 0.00 1.40 0.01 0.00 0.00 0.00 0.00 51.96 53.36 3mka s ALA 301 Cb 0.00 0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.20 3mka s ALA 301 CO 0.00 -0.63 -0.05 0.99 0.00 0.00 0.00 175.76 176.07 3mka s THR 302 N -2.65 0.67 -0.07 0.00 2.01 -1.26 -1.76 115.64 112.58 3mka s THR 302 Ca 0.08 -0.16 0.01 0.00 0.31 0.00 0.00 61.69 61.94 3mka s THR 302 Cb -0.01 -0.70 0.02 0.00 0.01 0.00 0.00 72.50 71.81 3mka s THR 302 CO -0.06 0.27 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.41 3mka s ILE 303 N 1.19 1.04 0.27 1.82 1.01 -0.35 -2.43 121.20 123.75 3mka s ILE 303 Ca -0.06 -0.39 0.11 0.00 0.00 0.00 0.00 60.65 60.31 3mka s ILE 303 Cb -0.14 -0.98 -0.05 0.00 0.01 0.00 0.00 42.46 41.30 3mka s ILE 303 CO -0.02 0.34 -0.12 0.68 0.00 0.00 0.00 174.94 175.82 3mka s VAL 304 N 0.95 2.86 -0.18 2.92 -7.23 0.15 -1.28 120.40 118.58 3mka s VAL 304 Ca -0.09 -2.21 -0.14 0.00 -1.81 0.00 0.00 61.98 57.72 3mka s VAL 304 Cb -0.15 -2.51 0.05 0.00 0.56 0.00 0.00 36.38 34.33 3mka s VAL 304 CO 0.00 -0.39 0.46 0.00 -0.31 0.00 0.00 175.10 174.87 3mka s ALA 305 N -2.43 -1.17 0.05 1.32 0.00 -0.50 -1.13 121.76 117.90 3mka s ALA 305 Ca 0.30 1.44 -0.05 0.00 0.00 0.00 0.00 51.96 53.66 3mka s ALA 305 Cb -0.06 -0.85 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 3mka s ALA 305 CO 0.17 -0.24 0.08 -0.48 0.00 0.00 0.00 175.76 175.29 3mka s LEU 306 N 0.65 1.89 -0.13 0.00 0.05 -0.59 -1.11 118.68 119.43 3mka s LEU 306 Ca -0.03 -0.65 -0.12 0.00 0.05 0.00 0.00 54.13 53.38 3mka s LEU 306 Cb -0.05 0.59 -0.05 0.00 -2.05 0.00 0.00 46.19 44.63 3mka s LEU 306 CO -0.04 -0.57 0.25 -0.54 -0.55 0.00 0.00 176.35 174.90 3mka s LYS 307 N -3.10 4.02 0.19 1.48 1.02 0.26 -1.16 119.74 122.44 3mka s LYS 307 Ca -0.01 0.04 0.08 0.00 0.02 0.00 0.00 55.97 56.10 3mka s LYS 307 Cb 0.02 -3.34 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 3mka s LYS 307 CO -0.07 0.44 -0.15 1.52 -0.92 0.00 0.00 175.35 176.16 3mka s TYR 308 N -0.11 1.70 0.11 3.18 -0.85 0.34 -4.96 117.35 116.76 3mka s TYR 308 Ca 0.16 -0.55 -0.32 0.00 -0.52 0.00 0.00 57.07 55.84 3mka s TYR 308 Cb -0.13 -0.81 -0.11 0.00 0.38 0.00 0.00 41.96 41.28 3mka s TYR 308 CO 0.04 0.33 1.80 -2.30 -1.52 0.00 0.00 175.55 173.90 3mka n PRO 309 N -0.12 2.63 -1.00 -3.49 -0.02 -1.26 -0.45 135.00 131.30 3mka n PRO 309 Ca -0.10 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 3mka n PRO 309 Cb 0.59 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.25 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 4.11 0.34 3.80 -1.23 0.00 -1.20 -4.75 105.19 106.26 3mka n GLY 310 Ca 0.18 0.00 -0.08 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 -2.00 -0.16 0.01 -0.02 0.00 0.40 -4.17 107.32 101.39 3mka s GLY 311 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 44.72 44.51 3mka s GLY 311 CO 0.00 -0.06 -0.02 0.54 0.00 0.00 0.00 173.10 173.57 3mka s VAL 312 N -3.90 0.07 0.07 1.40 0.11 -0.61 -0.51 120.40 117.03 3mka s VAL 312 Ca 0.10 -0.41 0.05 0.00 -2.93 0.00 0.00 61.98 58.79 3mka s VAL 312 Cb -0.05 -0.13 -0.03 0.00 -1.53 0.00 0.00 36.38 34.63 3mka s VAL 312 CO 0.04 -0.22 -0.15 0.54 -3.33 0.00 0.00 175.10 171.99 3mka s VAL 313 N -0.65 1.15 -0.04 2.04 0.11 -0.31 -1.08 120.40 121.62 3mka s VAL 313 Ca -0.07 -1.33 -0.03 0.00 -2.93 0.00 0.00 61.98 57.62 3mka s VAL 313 Cb -0.04 -1.11 0.02 0.00 -1.53 0.00 0.00 36.38 33.71 3mka s VAL 313 CO -0.00 -0.22 0.10 -0.32 -3.33 0.00 0.00 175.10 171.33 3mka s MET 314 N -1.76 0.10 0.04 1.54 1.75 -0.31 -1.54 119.30 119.11 3mka s MET 314 Ca -0.01 0.18 -0.06 0.00 -1.25 0.00 0.00 55.69 54.55 3mka s MET 314 Cb -0.10 -0.01 -0.01 0.00 2.84 0.00 0.00 34.83 37.55 3mka s MET 314 CO 0.02 -0.05 0.11 0.00 -0.65 0.00 0.00 175.02 174.45 3mka s ALA 315 N 0.34 -0.11 0.04 4.11 0.00 -0.29 -0.73 121.76 125.13 3mka s ALA 315 Ca -0.02 -0.52 -0.10 0.00 0.00 0.00 0.00 51.96 51.32 3mka s ALA 315 Cb -0.04 0.26 0.00 0.00 0.00 0.00 0.00 23.12 23.35 3mka s ALA 315 CO -0.01 -0.33 0.20 0.20 0.00 0.00 0.00 175.76 175.82 3mka s GLY 316 N -2.15 0.02 0.87 0.00 0.00 -0.64 -0.67 107.32 104.75 3mka s GLY 316 Ca -0.05 -0.26 -0.14 0.00 0.00 0.00 0.00 44.72 44.27 3mka s GLY 316 CO -0.05 -0.44 1.18 2.09 0.00 0.00 0.00 173.10 175.88 3mka n ASP 317 N 0.69 0.19 -0.16 1.64 5.68 -1.02 -2.12 116.55 121.45 3mka n ASP 317 Ca -0.19 -1.49 0.02 0.00 -0.50 0.00 0.00 54.79 52.64 3mka n ASP 317 Cb 0.59 -0.89 0.01 0.00 -1.14 0.00 0.00 41.12 39.69 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 -3.48 0.35 -2.89 0.11 5.12 -1.26 -4.55 116.66 110.05 3mka n ARG 318 Ca 0.15 -0.68 -0.32 0.00 -1.93 0.00 0.00 57.85 55.07 3mka n ARG 318 Cb 0.52 -1.04 -0.05 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 -0.50 4.00 -0.02 5.56 3.52 -1.26 -2.07 118.95 128.17 3mka s ARG 319 Ca 0.05 0.77 0.00 0.00 -0.13 0.00 0.00 55.73 56.43 3mka s ARG 319 Cb 0.04 -2.32 0.02 0.00 -1.56 0.00 0.00 34.95 31.13 3mka s ARG 319 CO 0.07 0.01 -0.00 0.45 -0.81 0.00 0.00 175.30 175.02 3mka s SER 320 N -2.56 0.32 0.10 -2.12 0.15 0.08 -4.67 113.70 105.00 3mka s SER 320 Ca 0.56 -0.02 0.05 0.00 0.70 0.00 0.00 55.95 57.24 3mka s SER 320 Cb -0.10 -0.15 -0.03 0.00 -1.71 0.00 0.00 66.02 64.02 3mka s SER 320 CO 0.21 -0.07 -0.14 0.42 1.20 0.00 0.00 173.24 174.86 3mka s THR 321 N 0.77 1.22 -0.37 6.45 -4.23 -0.50 0.45 115.64 119.44 3mka s THR 321 Ca -0.07 -1.59 0.02 0.00 -1.18 0.00 0.00 61.69 58.87 3mka s THR 321 Cb -0.11 -1.38 0.11 0.00 1.34 0.00 0.00 72.50 72.47 3mka s THR 321 CO -0.02 -0.38 0.13 -1.10 -0.54 0.00 0.00 174.62 172.72 3mka s GLN 322 N -2.41 1.17 6.63 3.99 -0.21 0.12 -1.00 119.66 127.94 3mka s GLN 322 Ca 0.05 -1.66 0.00 0.00 0.02 0.00 0.00 55.36 53.78 3mka s GLN 322 Cb -0.06 -2.53 0.00 0.00 1.00 0.00 0.00 33.01 31.42 3mka s GLN 322 CO 0.02 -1.03 0.00 0.41 -2.12 0.00 0.00 175.29 172.58 3mka n GLY 323 N 4.22 1.31 0.05 3.09 0.00 -1.26 -2.16 105.19 110.44 3mka n GLY 323 Ca 0.03 -0.52 0.11 0.00 0.00 0.00 0.00 46.02 45.65 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 6.47 0.64 -4.75 1.61 3.02 -1.26 -4.91 115.26 116.09 3mka n ASN 324 Ca 0.00 -0.01 -0.40 0.00 -0.03 0.00 0.00 54.58 54.13 3mka n ASN 324 Cb 0.00 0.64 -0.05 0.00 -0.61 0.00 0.00 39.78 39.76 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 -3.24 4.68 -0.32 3.52 -1.94 -0.92 -4.99 119.30 116.10 3mka s MET 325 Ca 0.03 1.69 -0.29 0.00 -1.71 0.00 0.00 55.69 55.41 3mka s MET 325 Cb 0.13 -3.24 0.02 0.00 2.01 0.00 0.00 34.83 33.74 3mka s MET 325 CO 0.79 0.25 1.09 0.42 -0.01 0.00 0.00 175.02 177.56 3mka s ILE 326 N -0.86 4.48 -0.13 2.53 1.01 -1.26 -0.71 121.20 126.27 3mka s ILE 326 Ca 0.45 1.71 0.19 0.00 0.00 0.00 0.00 60.65 63.00 3mka s ILE 326 Cb -0.29 -4.40 -0.25 0.00 0.01 0.00 0.00 42.46 37.52 3mka s ILE 326 CO 0.37 -0.48 0.37 -1.54 0.00 0.00 0.00 174.94 173.65 3mka n SER 327 N 6.92 0.19 -3.82 3.58 3.41 0.17 -4.91 113.62 119.16 3mka n SER 327 Ca 0.12 0.08 -0.12 0.00 -0.26 0.00 0.00 58.87 58.69 3mka n SER 327 Cb 0.47 1.14 -0.10 0.00 -0.26 0.00 0.00 64.21 65.45 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 -5.03 -0.07 0.00 5.00 0.00 -0.55 -4.93 107.32 101.74 3mka s GLY 328 Ca -0.08 0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.87 3mka s GLY 328 CO 0.85 0.09 0.59 -0.96 0.00 0.00 0.00 173.10 173.67 3mka n ARG 329 N 1.93 0.67 0.00 2.90 1.85 -1.26 -0.74 116.66 122.02 3mka n ARG 329 Ca -0.19 -0.75 0.00 0.00 -1.00 0.00 0.00 57.85 55.90 3mka n ARG 329 Cb 0.57 -0.84 0.00 0.00 -1.05 0.00 0.00 32.46 31.14 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 -0.17 0.73 -4.59 2.89 5.75 -1.16 -4.63 116.55 115.36 3mka n ASP 330 Ca 0.00 -0.96 -0.56 0.00 -0.01 0.00 0.00 54.79 53.26 3mka n ASP 330 Cb 0.21 0.05 -0.07 0.00 -1.03 0.00 0.00 41.12 40.27 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 -0.05 0.04 -3.82 2.12 0.31 -0.88 -4.98 118.33 111.08 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 0.05 -0.60 -0.09 0.00 -0.91 0.00 0.00 33.84 32.29 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 0.90 4.10 0.00 5.55 3.52 -1.26 -4.21 118.95 127.55 3mka s ARG 332 Ca 0.90 -0.27 0.00 0.00 -0.13 0.00 0.00 55.73 56.23 3mka s ARG 332 Cb -1.10 -3.36 0.00 0.00 -1.56 0.00 0.00 34.95 28.93 3mka s ARG 332 CO 0.55 0.26 0.39 1.63 -0.81 0.00 0.00 175.30 177.32 3mka n LYS 333 N 3.61 -0.43 -4.51 5.12 5.02 -1.26 -4.97 118.16 120.75 3mka n LYS 333 Ca -0.16 -0.39 -0.32 0.00 -2.02 0.00 0.00 58.31 55.42 3mka n LYS 333 Cb 0.52 -0.88 -0.16 0.00 -0.02 0.00 0.00 35.03 34.48 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 -0.05 1.94 -0.01 -0.18 1.01 -1.26 -2.50 120.40 119.35 3mka s VAL 334 Ca 0.00 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.12 3mka s VAL 334 Cb 0.00 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 3mka s VAL 334 CO 0.00 0.53 -0.12 -0.31 0.00 0.00 0.00 175.10 175.19 3mka s TYR 335 N 0.96 1.11 -0.22 5.22 2.02 -0.54 -4.97 117.35 120.93 3mka s TYR 335 Ca -0.04 -0.22 -0.29 0.00 -0.37 0.00 0.00 57.07 56.14 3mka s TYR 335 Cb -0.15 -0.73 0.00 0.00 -0.40 0.00 0.00 41.96 40.69 3mka s TYR 335 CO -0.04 -0.04 1.15 0.42 -1.57 0.00 0.00 175.55 175.48 3mka s ILE 336 N -0.22 4.46 -0.77 2.71 1.01 -1.26 -0.88 121.20 126.25 3mka s ILE 336 Ca 0.03 1.75 0.21 0.00 0.00 0.00 0.00 60.65 62.65 3mka s ILE 336 Cb -0.05 -4.19 -0.25 0.00 0.01 0.00 0.00 42.46 37.98 3mka s ILE 336 CO -0.00 -0.22 0.81 0.35 0.00 0.00 0.00 174.94 175.88 3mka n THR 337 N 5.48 0.00 -3.82 2.92 -2.24 -0.32 -4.95 114.28 111.36 3mka n THR 337 Ca 0.13 -0.12 -0.05 0.00 -2.27 0.00 0.00 64.05 61.74 3mka n THR 337 Cb 0.46 0.75 0.02 0.00 -2.10 0.00 0.00 70.33 69.46 3mka n THR 337 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3mka n ASP 338 N -1.68 -1.78 0.01 3.42 5.75 -1.12 -4.65 116.55 116.50 3mka n ASP 338 Ca 0.02 -2.05 0.01 0.00 -0.01 0.00 0.00 54.79 52.77 3mka n ASP 338 Cb 0.39 2.92 0.34 0.00 -1.03 0.00 0.00 41.12 43.74 3mka n ASP 338 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3mka h ASP 339 N 1.83 0.45 -0.15 -1.12 3.32 -1.95 -3.20 116.42 115.61 3mka h ASP 339 Ca -0.27 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.70 3mka h ASP 339 Cb 1.12 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 3mka h ASP 339 CO 0.36 0.48 -0.03 -1.22 -1.72 0.00 0.00 179.24 177.11 3mka n TYR 340 N -4.33 0.52 -3.63 4.55 4.01 -1.26 0.25 117.16 117.26 3mka n TYR 340 Ca 0.02 -1.01 -0.13 0.00 -0.16 0.00 0.00 57.90 56.62 3mka n TYR 340 Cb 0.20 -0.26 -0.06 0.00 -0.31 0.00 0.00 39.34 38.91 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 -2.90 0.05 0.03 -0.72 -4.23 -1.21 -1.67 115.64 104.99 3mka s THR 341 Ca 0.38 -0.39 -0.04 0.00 -1.18 0.00 0.00 61.69 60.45 3mka s THR 341 Cb 0.32 -0.98 -0.01 0.00 1.34 0.00 0.00 72.50 73.17 3mka s THR 341 CO 0.05 -0.22 0.07 0.00 -0.54 0.00 0.00 174.62 173.98 3mka s ALA 342 N -2.60 -0.00 0.04 3.99 0.00 0.49 -1.17 121.76 122.50 3mka s ALA 342 Ca -0.04 -0.59 0.05 0.00 0.00 0.00 0.00 51.96 51.38 3mka s ALA 342 Cb -0.01 0.23 -0.02 0.00 0.00 0.00 0.00 23.12 23.32 3mka s ALA 342 CO -0.03 -0.29 -0.15 0.95 0.00 0.00 0.00 175.76 176.24 3mka s THR 343 N -2.48 1.16 -0.06 0.00 -4.23 -0.06 -1.33 115.64 108.64 3mka s THR 343 Ca -0.06 -0.99 0.03 0.00 -1.18 0.00 0.00 61.69 59.49 3mka s THR 343 Cb -0.02 -1.04 0.00 0.00 1.34 0.00 0.00 72.50 72.78 3mka s THR 343 CO -0.04 0.04 -0.17 -0.83 -0.54 0.00 0.00 174.62 173.08 3mka s GLY 344 N -1.09 0.97 -0.03 3.99 0.00 -0.34 -1.47 107.32 109.36 3mka s GLY 344 Ca 0.02 -0.65 0.07 0.00 0.00 0.00 0.00 44.72 44.16 3mka s GLY 344 CO 0.01 -0.16 -0.23 -0.42 0.00 0.00 0.00 173.10 172.30 3mka s ILE 345 N 0.35 1.83 0.32 0.90 1.01 -1.04 -0.30 121.20 124.27 3mka s ILE 345 Ca -0.12 -0.98 0.09 0.00 0.00 0.00 0.00 60.65 59.65 3mka s ILE 345 Cb -0.15 -1.53 -0.05 0.00 0.01 0.00 0.00 42.46 40.74 3mka s ILE 345 CO 0.04 0.52 0.02 0.00 0.00 0.00 0.00 174.94 175.52 3mka s ALA 346 N -0.40 3.23 0.00 9.38 0.00 -0.72 -4.94 121.76 128.31 3mka s ALA 346 Ca 0.05 -1.84 0.00 0.00 0.00 0.00 0.00 51.96 50.17 3mka s ALA 346 Cb -0.10 -0.55 0.00 0.00 0.00 0.00 0.00 23.12 22.47 3mka s ALA 346 CO 0.00 0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.30 3mka n GLY 347 N -0.96 0.01 3.65 0.00 0.00 -1.26 -0.40 105.19 106.23 3mka n GLY 347 Ca -0.05 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 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 0.00 3.19 0.24 2.61 2.01 -0.14 -3.27 115.64 120.28 3mka s THR 348 Ca 0.00 0.22 -0.10 0.00 0.31 0.00 0.00 61.69 62.12 3mka s THR 348 Cb 0.00 -3.16 0.33 0.00 0.01 0.00 0.00 72.50 69.68 3mka s THR 348 CO 0.00 -0.04 1.60 0.00 -0.69 0.00 0.00 174.62 175.49 3mka h ALA 349 N 11.13 0.58 -0.43 7.40 0.00 -1.76 -1.90 119.26 134.28 3mka h ALA 349 Ca -0.45 0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3mka h ALA 349 Cb 1.22 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 19.57 3mka h ALA 349 CO 0.95 -0.41 0.23 0.00 0.00 0.00 0.00 179.25 180.02 3mka h ALA 350 N 1.79 0.55 -0.60 0.00 0.00 -1.92 -2.67 119.26 116.40 3mka h ALA 350 Ca 0.39 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 3mka h ALA 350 Cb 0.62 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3mka h ALA 350 CO -0.80 0.08 0.26 0.28 0.00 0.00 0.00 179.25 179.07 3mka h VAL 351 N 0.55 1.22 -0.51 0.00 2.07 -1.75 -1.66 116.25 116.17 3mka h VAL 351 Ca 0.15 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.98 3mka h VAL 351 Cb 0.06 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.35 3mka h VAL 351 CO -0.02 0.26 0.23 0.00 0.02 0.00 0.00 177.57 178.06 3mka h ALA 352 N 1.10 0.66 -0.56 1.67 0.00 -1.23 -0.09 119.26 120.81 3mka h ALA 352 Ca 0.20 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 3mka h ALA 352 Cb 0.17 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3mka h ALA 352 CO -0.02 0.25 0.17 -0.24 0.00 0.00 0.00 179.25 179.41 3mka h VAL 353 N 0.69 1.24 -0.72 0.00 3.04 -1.31 -0.53 116.25 118.65 3mka h VAL 353 Ca 0.17 -0.82 -0.01 0.00 -1.01 0.00 0.00 66.70 65.04 3mka h VAL 353 Cb 0.15 0.70 -0.03 0.00 -2.01 0.00 0.00 31.29 30.10 3mka h VAL 353 CO -0.02 0.31 0.43 -0.33 -1.01 0.00 0.00 177.57 176.94 3mka h GLU 354 N 0.79 0.99 -0.47 4.17 5.08 -0.91 -1.64 114.58 122.59 3mka h GLU 354 Ca 0.18 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 3mka h GLU 354 Cb 0.29 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3mka h GLU 354 CO -0.00 0.71 0.25 0.74 -1.00 0.00 0.00 179.01 179.71 3mka h PHE 355 N 0.99 0.66 -0.66 4.33 -1.00 -0.55 -2.12 116.94 118.59 3mka h PHE 355 Ca 0.26 -0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.99 3mka h PHE 355 Cb -0.02 -0.21 -0.03 0.00 3.61 0.00 0.00 35.95 39.30 3mka h PHE 355 CO -0.01 0.51 0.31 0.00 -1.61 0.00 0.00 178.31 177.51 3mka h ALA 356 N 1.09 0.86 -0.52 2.45 0.00 -0.65 -0.98 119.26 121.51 3mka h ALA 356 Ca 0.17 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 3mka h ALA 356 Cb 0.07 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3mka h ALA 356 CO -0.02 0.43 0.13 -0.09 0.00 0.00 0.00 179.25 179.69 3mka h ARG 357 N 0.92 0.83 -0.43 0.00 2.43 -1.09 -2.82 114.38 114.22 3mka h ARG 357 Ca 0.23 -0.20 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 3mka h ARG 357 Cb 0.13 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 3mka h ARG 357 CO -0.03 0.79 -0.12 1.25 -1.51 0.00 0.00 179.97 180.35 3mka h LEU 358 N 0.72 0.85 -0.94 3.80 5.85 -1.32 -2.85 115.31 121.42 3mka h LEU 358 Ca 0.16 -0.37 -0.05 0.00 0.84 0.00 0.00 57.88 58.46 3mka h LEU 358 Cb 0.33 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3mka h LEU 358 CO 0.00 1.03 0.20 0.22 -0.34 0.00 0.00 178.44 179.55 3mka h TYR 359 N 0.66 1.00 -0.49 1.25 3.20 -1.14 0.50 116.97 121.96 3mka h TYR 359 Ca 0.11 -0.09 -0.13 0.00 3.14 0.00 0.00 58.73 61.76 3mka h TYR 359 Cb 0.67 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.63 3mka h TYR 359 CO 0.05 0.80 -0.19 0.00 -1.64 0.00 0.00 178.16 177.18 3mka h ALA 360 N 1.27 0.73 -0.33 1.82 0.00 -1.44 -2.07 119.26 119.24 3mka h ALA 360 Ca 0.21 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 3mka h ALA 360 Cb 0.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3mka h ALA 360 CO -0.01 0.67 -0.07 0.28 0.00 0.00 0.00 179.25 180.12 3mka h VAL 361 N 0.86 1.28 -0.92 0.00 2.07 -1.25 -1.78 116.25 116.51 3mka h VAL 361 Ca 0.12 -1.12 0.11 0.00 0.82 0.00 0.00 66.70 66.63 3mka h VAL 361 Cb 0.76 1.33 -0.07 0.00 -1.52 0.00 0.00 31.29 31.80 3mka h VAL 361 CO 0.06 0.36 0.59 -0.08 0.02 0.00 0.00 177.57 178.52 3mka h GLU 362 N 0.41 0.84 0.03 1.57 4.57 -0.71 -0.34 114.58 120.95 3mka h GLU 362 Ca 0.08 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 3mka h GLU 362 Cb 0.56 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 3mka h GLU 362 CO 0.03 0.56 -0.02 -0.07 -1.18 0.00 0.00 179.01 178.33 3mka h LEU 363 N 0.87 -0.04 -1.63 1.64 4.07 -1.06 -2.89 115.31 116.27 3mka h LEU 363 Ca 0.44 -0.50 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 3mka h LEU 363 Cb 0.50 0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.24 3mka h LEU 363 CO -0.20 0.49 -0.21 -0.08 -1.08 0.00 0.00 178.44 177.36 3mka h GLU 364 N -0.58 0.00 -0.21 1.13 4.81 -1.00 -2.66 114.58 116.08 3mka h GLU 364 Ca -0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.17 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 0.01 0.21 -0.08 1.25 -0.73 0.00 0.00 179.01 179.66 3mka h HIS 365 N 0.00 0.49 -0.50 0.92 2.76 -1.06 -1.50 115.15 116.26 3mka h HIS 365 Ca -0.00 -0.12 -0.06 0.00 -2.20 0.00 0.00 60.37 57.99 3mka h HIS 365 Cb 0.45 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.27 3mka h HIS 365 CO 0.00 0.70 0.07 -0.92 -1.30 0.00 0.00 177.93 176.48 3mka h TYR 366 N 0.14 0.82 -0.40 5.26 3.20 -1.31 -1.53 116.97 123.14 3mka h TYR 366 Ca 0.05 -0.09 -0.04 0.00 3.14 0.00 0.00 58.73 61.79 3mka h TYR 366 Cb 0.56 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.58 3mka h TYR 366 CO 0.06 0.72 0.09 1.49 -1.64 0.00 0.00 178.16 178.88 3mka h GLU 367 N 0.75 0.65 -0.53 1.82 4.81 -1.25 -0.04 114.58 120.79 3mka h GLU 367 Ca 0.16 -0.16 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 3mka h GLU 367 Cb 0.35 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 3mka h GLU 367 CO 0.01 0.68 0.04 0.87 -0.73 0.00 0.00 179.01 179.87 3mka h LYS 368 N 0.51 0.92 -0.32 1.92 1.57 -1.08 1.20 116.57 121.29 3mka h LYS 368 Ca 0.12 -0.27 -0.14 0.00 -1.87 0.00 0.00 60.65 58.50 3mka h LYS 368 Cb 0.33 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3mka h LYS 368 CO 0.00 0.92 -0.35 -0.07 -0.57 0.00 0.00 179.45 179.38 3mka h LEU 369 N 0.79 0.75 -1.55 2.94 3.38 -1.16 -3.29 115.31 117.18 3mka h LEU 369 Ca 0.16 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3mka h LEU 369 Cb 0.48 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3mka h LEU 369 CO 0.02 1.03 -0.04 -0.62 0.09 0.00 0.00 178.44 178.92 3mka n GLU 370 N -4.06 1.36 -0.77 1.13 -0.58 -0.04 -4.98 120.64 112.70 3mka n GLU 370 Ca -0.01 -1.40 0.00 0.00 -0.42 0.00 0.00 57.16 55.32 3mka n GLU 370 Cb 0.50 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 30.06 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 0.34 3.03 0.62 0.00 0.41 -4.93 105.19 105.62 3mka n GLY 371 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.99 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 -1.96 0.02 0.76 1.61 0.11 -1.14 -4.99 120.40 114.81 3mka s VAL 372 Ca 0.00 -0.18 -0.11 0.00 -2.93 0.00 0.00 61.98 58.76 3mka s VAL 372 Cb 0.00 -0.25 0.05 0.00 -1.53 0.00 0.00 36.38 34.65 3mka s VAL 372 CO 0.00 -0.10 1.09 -2.16 -3.33 0.00 0.00 175.10 170.60 3mka s PRO 373 N -0.29 2.33 0.56 1.54 0.04 -1.26 -4.18 135.00 133.74 3mka s PRO 373 Ca -0.04 1.14 -0.20 0.00 0.04 0.00 0.00 61.00 61.95 3mka s PRO 373 Cb -0.03 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.56 3mka s PRO 373 CO 0.00 -1.58 1.20 -0.51 0.04 0.00 0.00 177.00 176.15 3mka s LEU 374 N -5.88 3.75 0.86 -3.56 1.02 -1.26 -5.01 118.68 108.61 3mka s LEU 374 Ca 0.61 2.36 -0.11 0.00 0.02 0.00 0.00 54.13 57.01 3mka s LEU 374 Cb -0.17 -4.52 0.11 0.00 0.02 0.00 0.00 46.19 41.63 3mka s LEU 374 CO 0.56 -1.41 1.10 0.42 0.02 0.00 0.00 176.35 177.03 3mka s THR 375 N -1.60 2.79 0.18 5.49 -4.23 -1.26 -4.77 115.64 112.23 3mka s THR 375 Ca 0.74 0.26 -0.13 0.00 -1.18 0.00 0.00 61.69 61.38 3mka s THR 375 Cb -0.29 -2.63 0.08 0.00 1.34 0.00 0.00 72.50 71.00 3mka s THR 375 CO 0.33 -0.33 1.77 0.15 -0.54 0.00 0.00 174.62 175.99 3mka h PHE 376 N -1.50 0.40 -0.98 3.99 3.57 -1.98 -0.67 116.94 119.78 3mka h PHE 376 Ca -0.47 0.02 0.10 0.00 3.53 0.00 0.00 57.97 61.16 3mka h PHE 376 Cb 1.26 -0.11 -0.08 0.00 2.79 0.00 0.00 35.95 39.82 3mka h PHE 376 CO 0.49 0.17 0.63 0.00 -2.23 0.00 0.00 178.31 177.38 3mka h ALA 377 N 1.29 1.51 -0.30 2.41 0.00 -2.00 -0.44 119.26 121.74 3mka h ALA 377 Ca 0.23 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 3mka h ALA 377 Cb 0.18 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3mka h ALA 377 CO -0.19 0.28 -0.24 0.78 0.00 0.00 0.00 179.25 179.88 3mka h GLY 378 N 1.03 0.63 1.46 0.00 0.00 -1.52 -1.44 103.07 103.22 3mka h GLY 378 Ca 0.46 -0.52 -0.09 0.00 0.00 0.00 0.00 47.33 47.18 3mka h GLY 378 CO -0.22 0.47 -0.16 0.50 0.00 0.00 0.00 176.54 177.13 3mka h LYS 379 N 0.51 0.64 0.14 4.80 1.57 0.20 -1.89 116.57 122.54 3mka h LYS 379 Ca 0.07 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 3mka h LYS 379 Cb 0.69 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3mka h LYS 379 CO 0.05 0.77 -0.07 0.82 -0.57 0.00 0.00 179.45 180.46 3mka h ILE 380 N 0.58 0.99 -0.43 1.86 2.04 -1.04 -2.42 117.51 119.10 3mka h ILE 380 Ca 0.09 -0.57 0.07 0.00 1.00 0.00 0.00 64.86 65.45 3mka h ILE 380 Cb 0.61 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 3mka h ILE 380 CO 0.04 0.14 0.29 -1.13 0.00 0.00 0.00 178.15 177.49 3mka h ASN 381 N -0.46 0.26 -0.11 1.72 -0.73 -1.11 -0.88 115.58 114.28 3mka h ASN 381 Ca -0.02 0.00 -0.10 0.00 1.87 0.00 0.00 56.30 58.06 3mka h ASN 381 Cb 0.36 -0.06 0.00 0.00 0.27 0.00 0.00 38.32 38.90 3mka h ASN 381 CO 0.03 0.17 -0.31 -0.09 -0.37 0.00 0.00 177.43 176.86 3mka h ARG 382 N 0.30 0.40 -0.85 6.67 9.65 -1.16 -2.39 114.38 126.99 3mka h ARG 382 Ca 0.19 -0.29 0.04 0.00 -1.10 0.00 0.00 59.98 58.83 3mka h ARG 382 Cb 0.37 0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 28.95 3mka h ARG 382 CO -0.04 0.90 0.54 1.25 2.80 0.00 0.00 179.97 185.42 3mka h LEU 383 N -0.03 0.88 -1.12 3.80 5.85 -0.90 -2.33 115.31 121.47 3mka h LEU 383 Ca -0.01 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.76 3mka h LEU 383 Cb 0.93 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.71 3mka h LEU 383 CO 0.07 0.59 0.60 0.00 -0.34 0.00 0.00 178.44 179.36 3mka h ALA 384 N 1.37 1.45 -0.41 1.25 0.00 -1.08 -0.10 119.26 121.75 3mka h ALA 384 Ca 0.35 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.12 3mka h ALA 384 Cb 0.06 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3mka h ALA 384 CO -0.14 0.44 -0.15 0.82 0.00 0.00 0.00 179.25 180.22 3mka h ILE 385 N 1.11 1.28 -0.56 0.00 2.04 -0.91 -0.35 117.51 120.11 3mka h ILE 385 Ca 0.38 -1.28 -0.01 0.00 1.00 0.00 0.00 64.86 64.95 3mka h ILE 385 Cb 0.10 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 3mka h ILE 385 CO -0.13 0.43 0.30 0.24 0.00 0.00 0.00 178.15 178.99 3mka h MET 386 N 0.64 0.79 0.99 2.37 2.86 -0.94 -0.66 114.93 120.98 3mka h MET 386 Ca 0.10 -0.10 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 3mka h MET 386 Cb 0.70 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 32.22 3mka h MET 386 CO 0.05 0.61 -0.48 0.28 1.06 0.00 0.00 176.91 178.44 3mka h VAL 387 N 0.76 0.00 -1.01 -2.22 2.07 -0.89 -3.00 116.25 111.96 3mka h VAL 387 Ca 0.20 -0.02 0.22 0.00 0.82 0.00 0.00 66.70 67.91 3mka h VAL 387 Cb 0.05 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.71 3mka h VAL 387 CO -0.03 0.00 0.61 -0.09 0.02 0.00 0.00 177.57 178.08 3mka h ARG 388 N -1.35 0.64 -0.09 1.57 2.43 -0.98 0.17 114.38 116.77 3mka h ARG 388 Ca -0.14 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 3mka h ARG 388 Cb 1.02 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 3mka h ARG 388 CO 0.22 0.42 0.00 0.41 -1.51 0.00 0.00 179.97 179.52 3mka n GLY 389 N -1.33 -0.42 0.00 2.80 0.00 -0.26 -2.18 105.19 103.80 3mka n GLY 389 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.40 0.82 -0.23 1.61 5.15 0.58 -4.80 115.26 117.99 3mka n ASN 390 Ca 0.00 -0.93 0.03 0.00 -0.60 0.00 0.00 54.58 53.09 3mka n ASN 390 Cb 0.02 0.14 0.14 0.00 -0.53 0.00 0.00 39.78 39.55 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 -0.10 -0.52 1.20 5.85 -1.45 0.13 115.31 120.42 3mka h LEU 391 Ca 0.00 0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.90 3mka h LEU 391 Cb 0.02 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 3mka h LEU 391 CO 0.00 -0.06 0.29 0.00 -0.34 0.00 0.00 178.44 178.32 3mka h ALA 392 N 1.58 0.66 0.00 1.25 0.00 -1.87 -0.61 119.26 120.27 3mka h ALA 392 Ca 0.37 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 3mka h ALA 392 Cb 0.61 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3mka h ALA 392 CO -0.51 -0.04 -0.35 0.00 0.00 0.00 0.00 179.25 178.36 3mka h ALA 393 N 1.25 1.19 -0.05 0.00 0.00 -1.38 -2.86 119.26 117.41 3mka h ALA 393 Ca 0.22 -0.32 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 3mka h ALA 393 Cb 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3mka h ALA 393 CO -0.13 0.44 -0.46 0.00 0.00 0.00 0.00 179.25 179.11 3mka h ALA 394 N 1.65 1.14 0.00 0.00 0.00 0.62 -1.41 119.26 121.26 3mka h ALA 394 Ca -0.00 -0.43 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 3mka h ALA 394 Cb 0.73 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3mka h ALA 394 CO 0.05 0.60 -0.26 0.52 0.00 0.00 0.00 179.25 180.16 3mka h MET 395 N 0.10 0.00 -0.60 0.00 2.86 -0.96 -2.66 114.93 113.67 3mka h MET 395 Ca 0.01 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.53 3mka h MET 395 Cb 0.85 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.44 3mka h MET 395 CO 0.07 0.26 0.13 1.04 1.06 0.00 0.00 176.91 179.47 3mka n GLN 396 N -3.57 3.88 0.00 1.72 6.02 -0.83 -4.96 117.38 119.65 3mka n GLN 396 Ca -0.01 -3.09 0.00 0.00 -0.01 0.00 0.00 57.00 53.89 3mka n GLN 396 Cb 0.41 -2.16 0.00 0.00 1.02 0.00 0.00 30.24 29.50 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 -0.03 3.22 2.23 1.08 0.00 -1.00 -4.94 105.19 105.76 3mka n GLY 397 Ca 0.34 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.06 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 7.42 -4.76 0.99 4.77 -0.59 -4.63 117.00 120.21 3mka n LEU 398 Ca 0.00 -4.00 -0.40 0.00 -0.03 0.00 0.00 56.01 51.58 3mka n LEU 398 Cb 0.00 -1.48 -0.06 0.00 -2.33 0.00 0.00 43.42 39.55 3mka n LEU 398 CO 0.00 1.93 0.61 -0.22 -1.33 0.00 0.00 177.39 178.38 3mka s LEU 399 N -0.19 4.63 -0.28 2.23 2.96 -1.26 -3.88 118.68 122.89 3mka s LEU 399 Ca 0.67 1.87 -0.03 0.00 -0.22 0.00 0.00 54.13 56.42 3mka s LEU 399 Cb 0.24 -3.53 0.09 0.00 0.50 0.00 0.00 46.19 43.50 3mka s LEU 399 CO -0.05 0.17 0.11 0.00 -1.32 0.00 0.00 176.35 175.27 3mka s ALA 400 N -1.16 0.82 -0.47 5.97 0.00 -1.26 -0.97 121.76 124.69 3mka s ALA 400 Ca 0.40 -1.12 -0.13 0.00 0.00 0.00 0.00 51.96 51.11 3mka s ALA 400 Cb -0.25 -1.40 0.09 0.00 0.00 0.00 0.00 23.12 21.56 3mka s ALA 400 CO 0.30 -1.59 0.37 -1.17 0.00 0.00 0.00 175.76 173.68 3mka s LEU 401 N 1.99 5.59 0.41 0.00 2.96 0.47 -4.93 118.68 125.17 3mka s LEU 401 Ca 0.08 -1.54 -0.06 0.00 -0.22 0.00 0.00 54.13 52.39 3mka s LEU 401 Cb -0.16 -2.11 -0.05 0.00 0.50 0.00 0.00 46.19 44.38 3mka s LEU 401 CO -0.30 -0.66 0.71 -2.16 -1.32 0.00 0.00 176.35 172.62 3mka s PRO 402 N 1.53 3.61 -0.08 0.98 0.04 -1.26 -1.76 135.00 138.06 3mka s PRO 402 Ca 0.04 0.17 0.02 0.00 0.04 0.00 0.00 61.00 61.27 3mka s PRO 402 Cb -0.25 -2.46 0.01 0.00 0.04 0.00 0.00 34.50 31.84 3mka s PRO 402 CO 0.04 -0.05 -0.15 -1.17 0.04 0.00 0.00 177.00 175.71 3mka s LEU 403 N -4.27 1.72 -0.13 -3.56 2.96 0.59 -3.46 118.68 112.54 3mka s LEU 403 Ca 0.47 -0.36 -0.01 0.00 -0.22 0.00 0.00 54.13 54.01 3mka s LEU 403 Cb -0.10 -0.97 -0.02 0.00 0.50 0.00 0.00 46.19 45.60 3mka s LEU 403 CO 0.38 0.05 -0.11 -0.22 -1.32 0.00 0.00 176.35 175.13 3mka s LEU 404 N 0.67 2.83 -0.05 -0.68 2.96 0.31 -1.19 118.68 123.53 3mka s LEU 404 Ca -0.14 -0.27 0.05 0.00 -0.22 0.00 0.00 54.13 53.54 3mka s LEU 404 Cb -0.16 -1.64 -0.00 0.00 0.50 0.00 0.00 46.19 44.88 3mka s LEU 404 CO 0.04 0.18 -0.19 0.00 -1.32 0.00 0.00 176.35 175.06 3mka s ALA 405 N 0.25 1.68 0.19 5.97 0.00 -0.44 -0.63 121.76 128.78 3mka s ALA 405 Ca -0.08 -0.78 -0.18 0.00 0.00 0.00 0.00 51.96 50.93 3mka s ALA 405 Cb -0.15 -0.54 0.03 0.00 0.00 0.00 0.00 23.12 22.45 3mka s ALA 405 CO 0.05 0.31 0.53 0.20 0.00 0.00 0.00 175.76 176.84 3mka s GLY 406 N -0.01 -0.12 -0.11 0.00 0.00 -0.66 -0.38 107.32 106.04 3mka s GLY 406 Ca -0.04 -0.18 0.02 0.00 0.00 0.00 0.00 44.72 44.53 3mka s GLY 406 CO 0.03 -0.24 -0.20 -0.47 0.00 0.00 0.00 173.10 172.22 3mka s TYR 407 N -3.87 2.65 -0.33 1.90 5.04 -0.67 0.64 117.35 122.73 3mka s TYR 407 Ca 0.09 -0.86 -0.11 0.00 -2.44 0.00 0.00 57.07 53.74 3mka s TYR 407 Cb -0.01 -1.76 -0.01 0.00 0.35 0.00 0.00 41.96 40.54 3mka s TYR 407 CO -0.04 -0.32 0.19 0.34 -1.34 0.00 0.00 175.55 174.38 3mka s ASP 408 N 0.30 5.73 0.25 4.32 2.15 -0.84 -4.85 116.67 123.74 3mka s ASP 408 Ca -0.15 -0.53 -0.03 0.00 0.43 0.00 0.00 52.55 52.27 3mka s ASP 408 Cb -0.17 -2.05 0.30 0.00 -0.30 0.00 0.00 42.92 40.70 3mka s ASP 408 CO 0.07 -0.22 1.75 0.16 -0.17 0.00 0.00 175.17 176.76 3mka h ILE 409 N 5.62 1.24 -0.00 4.11 3.07 -1.98 -2.87 117.51 126.71 3mka h ILE 409 Ca -0.31 -0.99 0.00 0.00 1.55 0.00 0.00 64.86 65.11 3mka h ILE 409 Cb 1.15 0.81 0.00 0.00 -0.27 0.00 0.00 36.82 38.51 3mka h ILE 409 CO 0.63 0.36 -0.03 1.41 -1.05 0.00 0.00 178.15 179.46 3mka n HIS 410 N -4.22 0.00 -1.94 0.16 8.25 -1.26 -4.86 115.22 111.35 3mka n HIS 410 Ca 0.03 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.10 3mka n HIS 410 Cb 0.29 -0.15 0.01 0.00 1.12 0.00 0.00 29.99 31.27 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 -2.32 3.14 0.23 -1.41 0.00 -1.08 -4.92 121.76 115.39 3mka s ALA 411 Ca 0.36 1.29 -0.07 0.00 0.00 0.00 0.00 51.96 53.54 3mka s ALA 411 Cb 0.21 -3.52 0.21 0.00 0.00 0.00 0.00 23.12 20.01 3mka s ALA 411 CO 0.43 -1.03 1.84 0.66 0.00 0.00 0.00 175.76 177.66 3mka h SER 412 N 2.26 1.12 -3.39 0.00 4.64 -1.90 -3.42 113.55 112.88 3mka h SER 412 Ca -0.50 -0.12 -0.66 0.00 -0.47 0.00 0.00 61.79 60.04 3mka h SER 412 Cb 1.26 -0.29 -0.28 0.00 -0.31 0.00 0.00 62.40 62.79 3mka h SER 412 CO 0.61 0.92 -0.79 -0.62 -0.87 0.00 0.00 176.83 176.07 3mka s ASP 413 N -6.27 3.80 0.21 4.97 -1.08 -1.26 -5.02 116.67 112.01 3mka s ASP 413 Ca -0.13 -0.37 -0.08 0.00 -0.52 0.00 0.00 52.55 51.45 3mka s ASP 413 Cb 0.17 -1.50 0.16 0.00 -1.46 0.00 0.00 42.92 40.28 3mka s ASP 413 CO 0.83 0.18 1.80 1.55 0.52 0.00 0.00 175.17 180.05 3mka h PRO 414 N 6.60 1.15 -0.67 4.34 0.13 -1.94 -1.70 132.00 139.91 3mka h PRO 414 Ca -0.26 -0.18 -0.05 0.00 -0.87 0.00 0.00 66.00 64.64 3mka h PRO 414 Cb 1.21 -0.20 -0.03 0.00 0.13 0.00 0.00 31.00 32.11 3mka h PRO 414 CO 0.53 0.90 0.21 1.96 -0.23 0.00 0.00 178.00 181.38 3mka h GLN 415 N 1.13 1.03 -0.07 0.86 1.08 -1.95 -2.46 115.11 114.72 3mka h GLN 415 Ca 0.27 -0.21 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 3mka h GLN 415 Cb 0.14 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.42 3mka h GLN 415 CO -0.03 0.88 0.00 -1.13 -0.95 0.00 0.00 178.83 177.60 3mka n SER 416 N -4.27 1.08 -0.14 1.46 3.41 -1.04 -3.26 113.62 110.86 3mka n SER 416 Ca 0.05 -1.50 0.01 0.00 -0.26 0.00 0.00 58.87 57.17 3mka n SER 416 Cb 0.22 -0.04 0.28 0.00 -0.26 0.00 0.00 64.21 64.40 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 4.04 1.47 -2.96 7.33 0.00 -0.81 -3.44 119.26 124.88 3mka h ALA 417 Ca 0.00 -0.08 -0.54 0.00 0.00 0.00 0.00 54.91 54.29 3mka h ALA 417 Cb 0.33 -0.25 0.11 0.00 0.00 0.00 0.00 17.79 17.98 3mka h ALA 417 CO 0.00 0.45 0.69 0.20 0.00 0.00 0.00 179.25 180.59 3mka s GLY 418 N -3.50 2.92 0.03 0.00 0.00 -1.26 -1.99 107.32 103.52 3mka s GLY 418 Ca -0.10 1.43 0.03 0.00 0.00 0.00 0.00 44.72 46.08 3mka s GLY 418 CO 0.77 2.04 -0.10 0.50 0.00 0.00 0.00 173.10 176.31 3mka s ARG 419 N -2.40 0.71 -0.06 2.90 1.81 0.21 -4.93 118.95 117.19 3mka s ARG 419 Ca 0.60 -0.61 0.01 0.00 -1.72 0.00 0.00 55.73 54.00 3mka s ARG 419 Cb -0.43 -0.65 0.02 0.00 -0.45 0.00 0.00 34.95 33.44 3mka s ARG 419 CO 0.55 0.16 -0.06 0.42 -0.68 0.00 0.00 175.30 175.69 3mka s ILE 420 N -0.80 0.67 -0.06 1.52 1.01 -1.26 -1.65 121.20 120.64 3mka s ILE 420 Ca -0.01 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.47 3mka s ILE 420 Cb -0.07 -0.69 0.02 0.00 0.01 0.00 0.00 42.46 41.73 3mka s ILE 420 CO 0.01 0.27 -0.09 -0.69 0.00 0.00 0.00 174.94 174.44 3mka s VAL 421 N 1.05 0.89 0.21 2.92 1.01 0.20 -1.70 120.40 124.99 3mka s VAL 421 Ca -0.09 -0.32 0.08 0.00 0.00 0.00 0.00 61.98 61.66 3mka s VAL 421 Cb -0.14 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 3mka s VAL 421 CO -0.01 0.31 0.00 -0.94 0.00 0.00 0.00 175.10 174.46 3mka s SER 422 N 0.87 4.69 -0.03 3.32 1.04 -0.39 -0.53 113.70 122.67 3mka s SER 422 Ca -0.11 -0.49 0.04 0.00 0.48 0.00 0.00 55.95 55.86 3mka s SER 422 Cb -0.15 -0.95 -0.00 0.00 0.10 0.00 0.00 66.02 65.02 3mka s SER 422 CO 0.01 0.05 -0.13 -0.36 0.98 0.00 0.00 173.24 173.79 3mka s PHE 423 N -1.96 1.32 0.62 5.02 0.08 -1.22 -0.88 117.98 120.96 3mka s PHE 423 Ca 0.29 -0.34 -0.02 0.00 0.12 0.00 0.00 56.93 56.98 3mka s PHE 423 Cb -0.08 -0.90 0.05 0.00 -0.57 0.00 0.00 43.02 41.52 3mka s PHE 423 CO 0.19 -0.11 0.89 0.16 -0.10 0.00 0.00 175.22 176.25 3mka s ASP 424 N 0.02 5.06 0.33 1.36 1.47 0.03 -4.66 116.67 120.28 3mka s ASP 424 Ca -0.01 0.20 0.23 0.00 1.18 0.00 0.00 52.55 54.14 3mka s ASP 424 Cb -0.09 -0.98 1.22 0.00 -0.34 0.00 0.00 42.92 42.73 3mka s ASP 424 CO 0.01 -1.35 1.69 0.00 0.68 0.00 0.00 175.17 176.20 3mka h ALA 425 N -0.24 1.00 -0.12 2.11 0.00 -1.94 -1.31 119.26 118.77 3mka h ALA 425 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.48 3mka h ALA 425 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 3mka h ALA 425 CO 0.56 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.81 3mka n ALA 426 N -1.79 2.49 -0.06 0.00 0.00 -1.26 -4.35 120.51 115.54 3mka n ALA 426 Ca -0.01 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.77 3mka n ALA 426 Cb 0.05 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.54 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 1.30 0.63 3.70 0.00 0.00 -0.49 -4.41 105.19 105.93 3mka n GLY 427 Ca 0.17 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 3.35 -0.02 0.00 -1.26 -4.74 105.19 101.44 3mka n GLY 428 Ca 0.00 0.43 -0.25 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.34 2.00 -0.03 1.61 1.48 -1.26 -0.79 118.94 121.61 3mka s TRP 429 Ca 0.63 -0.42 -0.02 0.00 -1.06 0.00 0.00 56.10 55.24 3mka s TRP 429 Cb -0.58 -1.03 0.02 0.00 -1.16 0.00 0.00 33.47 30.72 3mka s TRP 429 CO 0.53 0.35 0.07 1.21 -4.06 0.00 0.00 176.95 175.04 3mka s ASN 430 N -2.41 -0.03 -0.32 -2.66 2.47 -0.06 -4.97 114.94 106.97 3mka s ASN 430 Ca 0.15 0.13 -0.16 0.00 0.42 0.00 0.00 52.86 53.39 3mka s ASN 430 Cb -0.08 0.08 -0.02 0.00 -1.45 0.00 0.00 41.25 39.78 3mka s ASN 430 CO 0.07 -0.08 0.43 -0.63 -3.72 0.00 0.00 177.10 173.17 3mka s ILE 431 N 0.55 5.11 -0.35 -5.21 1.01 -1.26 -1.26 121.20 119.79 3mka s ILE 431 Ca -0.04 0.35 -0.29 0.00 0.00 0.00 0.00 60.65 60.66 3mka s ILE 431 Cb -0.06 -3.84 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 3mka s ILE 431 CO -0.02 -0.05 1.48 -1.61 0.00 0.00 0.00 174.94 174.74 3mka s GLU 432 N 2.18 3.64 0.08 2.79 0.41 -0.69 -4.91 118.70 122.21 3mka s GLU 432 Ca 0.16 1.19 0.24 0.00 -0.41 0.00 0.00 54.97 56.14 3mka s GLU 432 Cb -0.16 -4.02 0.35 0.00 -1.78 0.00 0.00 34.13 28.52 3mka s GLU 432 CO 0.12 -1.48 1.31 0.39 -0.49 0.00 0.00 175.26 175.11 3mka n GLU 433 N 7.91 0.22 0.27 1.61 -0.58 -1.26 -4.06 120.64 124.75 3mka n GLU 433 Ca 0.17 0.05 0.17 0.00 -0.42 0.00 0.00 57.16 57.14 3mka n GLU 433 Cb 0.47 -1.63 0.76 0.00 -0.57 0.00 0.00 31.44 30.47 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 0.00 0.00 0.00 3.49 5.08 -2.00 -3.46 114.58 117.69 3mka h GLU 434 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3mka h GLU 434 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 3mka h GLU 434 CO 0.00 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.42 3mka n GLY 435 N -0.20 2.58 3.53 -3.84 0.00 -1.26 -5.04 105.19 100.95 3mka n GLY 435 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.56 -0.21 0.15 1.61 -0.85 -1.26 -0.57 117.35 113.65 3mka s TYR 436 Ca 0.00 -0.11 -0.24 0.00 -0.52 0.00 0.00 57.07 56.19 3mka s TYR 436 Cb 0.00 0.45 0.07 0.00 0.38 0.00 0.00 41.96 42.86 3mka s TYR 436 CO 0.00 -0.93 0.77 -1.14 -1.52 0.00 0.00 175.55 172.73 3mka s GLN 437 N -3.85 1.27 0.11 -3.49 2.00 -0.27 -4.98 119.66 110.45 3mka s GLN 437 Ca 0.07 -0.58 -0.15 0.00 -2.00 0.00 0.00 55.36 52.70 3mka s GLN 437 Cb -0.01 0.51 0.03 0.00 0.80 0.00 0.00 33.01 34.33 3mka s GLN 437 CO -0.04 -0.57 0.38 0.00 -0.50 0.00 0.00 175.29 174.56 3mka s ALA 438 N -3.54 -0.86 0.05 1.58 0.00 -1.26 -1.40 121.76 116.33 3mka s ALA 438 Ca 0.06 -0.08 -0.07 0.00 0.00 0.00 0.00 51.96 51.87 3mka s ALA 438 Cb -0.02 0.64 -0.01 0.00 0.00 0.00 0.00 23.12 23.73 3mka s ALA 438 CO -0.05 -0.61 0.13 0.14 0.00 0.00 0.00 175.76 175.37 3mka s VAL 439 N -3.70 0.14 0.00 0.00 -7.23 -0.41 -4.92 120.40 104.28 3mka s VAL 439 Ca 0.02 -1.15 0.00 0.00 -1.81 0.00 0.00 61.98 59.04 3mka s VAL 439 Cb 0.02 -1.09 0.00 0.00 0.56 0.00 0.00 36.38 35.87 3mka s VAL 439 CO -0.11 -0.64 0.00 0.61 -0.31 0.00 0.00 175.10 174.65 3mka n GLY 440 N 0.46 0.99 0.29 2.32 0.00 -1.26 -1.21 105.19 106.78 3mka n GLY 440 Ca -0.17 -2.23 0.15 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 -1.73 -2.32 113.55 115.42 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 -1.05 3.31 0.28 -0.77 0.00 -1.26 -4.69 105.19 101.01 3mka n GLY 442 Ca -0.03 -0.69 0.08 0.00 0.00 0.00 0.00 46.02 45.38 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 2.08 0.10 -0.15 1.61 4.64 -1.64 -1.36 113.55 118.83 3mka h SER 443 Ca 0.00 -0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 3mka h SER 443 Cb 1.09 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3mka h SER 443 CO 0.11 0.07 -0.07 -0.07 -0.87 0.00 0.00 176.83 176.00 3mka h LEU 444 N 0.12 0.32 -0.64 5.97 4.07 -1.84 0.73 115.31 124.05 3mka h LEU 444 Ca 0.06 -0.42 0.02 0.00 0.08 0.00 0.00 57.88 57.62 3mka h LEU 444 Cb 0.08 -0.09 -0.04 0.00 1.08 0.00 0.00 40.66 41.69 3mka h LEU 444 CO -0.01 0.67 0.41 -0.26 -1.08 0.00 0.00 178.44 178.17 3mka h PHE 445 N -0.02 0.77 -0.45 1.13 0.04 -1.79 -1.11 116.94 115.51 3mka h PHE 445 Ca 0.03 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.79 3mka h PHE 445 Cb 0.55 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.42 3mka h PHE 445 CO 0.07 0.46 0.15 0.00 -0.60 0.00 0.00 178.31 178.38 3mka h ALA 446 N 1.26 0.58 -0.63 2.45 0.00 -1.11 -1.14 119.26 120.67 3mka h ALA 446 Ca 0.25 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 3mka h ALA 446 Cb -0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3mka h ALA 446 CO -0.08 0.23 0.27 0.87 0.00 0.00 0.00 179.25 180.54 3mka h LYS 447 N 0.58 0.90 -0.16 0.00 1.57 -0.67 -1.06 116.57 117.73 3mka h LYS 447 Ca 0.14 -0.13 -0.15 0.00 -1.87 0.00 0.00 60.65 58.64 3mka h LYS 447 Cb 0.25 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 3mka h LYS 447 CO -0.01 0.72 -0.55 0.77 -0.57 0.00 0.00 179.45 179.81 3mka h SER 448 N 0.89 0.52 0.04 0.86 0.02 -0.81 -1.09 113.55 113.98 3mka h SER 448 Ca 0.22 -0.28 -0.00 0.00 -0.84 0.00 0.00 61.79 60.89 3mka h SER 448 Cb 0.14 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.53 3mka h SER 448 CO -0.02 0.97 -0.02 -1.28 -1.14 0.00 0.00 176.83 175.33 3mka h SER 449 N 0.36 -0.04 -0.28 3.07 0.87 -0.97 -2.94 113.55 113.62 3mka h SER 449 Ca 0.01 -0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.41 3mka h SER 449 Cb 1.07 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 63.03 3mka h SER 449 CO 0.10 0.10 0.10 0.24 -0.53 0.00 0.00 176.83 176.84 3mka h MET 450 N -0.19 0.51 -0.88 2.24 2.07 -1.06 -1.22 114.93 116.40 3mka h MET 450 Ca -0.01 -0.08 0.13 0.00 -2.07 0.00 0.00 59.70 57.68 3mka h MET 450 Cb 0.17 -0.09 -0.07 0.00 -1.87 0.00 0.00 31.60 29.74 3mka h MET 450 CO 0.01 0.46 0.57 -0.22 1.07 0.00 0.00 176.91 178.80 3mka h LYS 451 N 0.51 0.70 0.16 1.72 3.64 -1.02 0.17 116.57 122.45 3mka h LYS 451 Ca 0.12 -0.04 -0.25 0.00 -1.27 0.00 0.00 60.65 59.21 3mka h LYS 451 Cb 0.18 -0.16 0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3mka h LYS 451 CO -0.01 0.47 -1.18 0.87 -2.27 0.00 0.00 179.45 177.33 3mka h LYS 452 N 0.72 0.33 0.00 1.90 1.79 -1.17 -3.38 116.57 116.77 3mka h LYS 452 Ca 0.44 -0.57 0.00 0.00 -2.18 0.00 0.00 60.65 58.34 3mka h LYS 452 Cb 0.65 0.21 0.00 0.00 -1.58 0.00 0.00 32.23 31.51 3mka h LYS 452 CO -0.20 1.27 0.00 -0.07 -1.08 0.00 0.00 179.45 179.38 3mka h LEU 453 N -0.23 0.00 -0.89 2.94 3.38 -0.86 -3.39 115.31 116.26 3mka h LEU 453 Ca -0.23 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.85 3mka h LEU 453 Cb 1.80 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 42.48 3mka h LEU 453 CO 0.15 0.00 0.53 0.22 0.09 0.00 0.00 178.44 179.42 3mka h TYR 454 N 0.00 0.95 -0.08 1.13 3.20 -0.84 -1.27 116.97 120.05 3mka h TYR 454 Ca 0.00 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.93 3mka h TYR 454 Cb 0.66 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.64 3mka h TYR 454 CO 0.00 0.38 0.22 0.66 -1.64 0.00 0.00 178.16 177.78 3mka h SER 455 N 0.86 0.00 0.02 -2.11 4.64 -1.85 0.17 113.55 115.28 3mka h SER 455 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 3mka h SER 455 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3mka h SER 455 CO -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.70 3mka n GLN 456 N -3.28 0.95 -3.08 4.77 6.02 -0.48 -4.76 117.38 117.52 3mka n GLN 456 Ca -0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.58 3mka n GLN 456 Cb 0.30 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 30.01 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 -2.02 4.99 0.00 5.09 1.01 0.59 -4.74 120.40 125.33 3mka s VAL 457 Ca 0.46 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.69 3mka s VAL 457 Cb 0.21 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.62 3mka s VAL 457 CO 0.36 0.09 0.04 0.35 0.00 0.00 0.00 175.10 175.94 3mka n THR 458 N 4.74 0.00 -3.86 3.92 -2.24 -1.26 -4.93 114.28 110.66 3mka n THR 458 Ca -0.00 -0.21 -0.04 0.00 -2.27 0.00 0.00 64.05 61.53 3mka n THR 458 Cb 0.49 1.11 0.01 0.00 -2.10 0.00 0.00 70.33 69.85 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 -0.35 -0.02 0.53 3.42 1.47 -1.26 -4.64 116.67 115.83 3mka s ASP 459 Ca 0.00 -0.67 0.19 0.00 1.18 0.00 0.00 52.55 53.25 3mka s ASP 459 Cb 0.00 0.52 1.38 0.00 -0.34 0.00 0.00 42.92 44.49 3mka s ASP 459 CO 0.00 -1.03 2.17 1.23 0.68 0.00 0.00 175.17 178.22 3mka h GLY 460 N 2.00 0.00 0.93 2.12 0.00 -1.94 -0.84 103.07 105.35 3mka h GLY 460 Ca -0.27 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 46.87 3mka h GLY 460 CO 0.35 0.00 -0.72 -0.55 0.00 0.00 0.00 176.54 175.62 3mka h ASP 461 N 0.00 0.67 -0.32 0.19 3.32 -1.99 -1.51 116.42 116.79 3mka h ASP 461 Ca 0.01 -0.73 -0.10 0.00 0.02 0.00 0.00 57.03 56.23 3mka h ASP 461 Cb 0.03 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3mka h ASP 461 CO -0.00 1.31 -0.18 0.77 -1.72 0.00 0.00 179.24 179.42 3mka h SER 462 N 0.10 0.71 -0.78 6.45 4.64 -1.85 -2.33 113.55 120.50 3mka h SER 462 Ca -0.08 -0.42 0.06 0.00 -0.47 0.00 0.00 61.79 60.88 3mka h SER 462 Cb 1.40 -0.20 -0.06 0.00 -0.31 0.00 0.00 62.40 63.24 3mka h SER 462 CO 0.14 0.97 0.46 1.23 -0.87 0.00 0.00 176.83 178.77 3mka h GLY 463 N 0.44 1.16 2.00 -0.77 0.00 -1.18 -0.25 103.07 104.47 3mka h GLY 463 Ca 0.07 -0.33 -0.05 0.00 0.00 0.00 0.00 47.33 47.01 3mka h GLY 463 CO 0.05 0.22 -0.26 -2.00 0.00 0.00 0.00 176.54 174.56 3mka h LEU 464 N 0.85 0.00 -0.11 3.11 5.85 -1.16 -1.73 115.31 122.11 3mka h LEU 464 Ca 0.34 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.98 3mka h LEU 464 Cb 0.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.20 3mka h LEU 464 CO -0.17 0.26 -0.23 -0.09 -0.34 0.00 0.00 178.44 177.86 3mka h ARG 465 N 0.00 0.36 -0.86 1.25 2.43 -0.53 -2.21 114.38 114.82 3mka h ARG 465 Ca -0.00 -0.23 -0.01 0.00 -0.81 0.00 0.00 59.98 58.93 3mka h ARG 465 Cb 0.62 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 3mka h ARG 465 CO 0.03 0.83 0.49 0.28 -1.51 0.00 0.00 179.97 180.09 3mka h VAL 466 N -0.07 1.25 -0.48 0.20 2.07 -1.05 -0.09 116.25 118.07 3mka h VAL 466 Ca 0.00 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.93 3mka h VAL 466 Cb 0.81 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 3mka h VAL 466 CO 0.05 0.27 0.23 0.00 0.02 0.00 0.00 177.57 178.14 3mka h ALA 467 N 1.27 0.62 0.00 1.67 0.00 -1.30 0.19 119.26 121.71 3mka h ALA 467 Ca 0.30 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3mka h ALA 467 Cb -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3mka h ALA 467 CO -0.05 0.19 -0.39 0.28 0.00 0.00 0.00 179.25 179.28 3mka h VAL 468 N 0.64 1.15 -0.01 0.00 2.07 -1.10 -2.23 116.25 116.76 3mka h VAL 468 Ca 0.17 -1.38 -0.21 0.00 0.82 0.00 0.00 66.70 66.09 3mka h VAL 468 Cb 0.12 1.77 0.02 0.00 -1.52 0.00 0.00 31.29 31.68 3mka h VAL 468 CO -0.02 0.38 -0.83 -0.08 0.02 0.00 0.00 177.57 177.04 3mka h GLU 469 N 0.00 0.58 -0.62 1.57 4.81 -0.22 -2.02 114.58 118.67 3mka h GLU 469 Ca -0.00 -0.61 0.03 0.00 -0.13 0.00 0.00 59.36 58.64 3mka h GLU 469 Cb 0.74 0.17 -0.03 0.00 0.63 0.00 0.00 28.75 30.26 3mka h GLU 469 CO 0.05 1.22 0.41 0.00 -0.73 0.00 0.00 179.01 179.97 3mka h ALA 470 N 0.37 1.63 0.00 2.92 0.00 -0.53 0.11 119.26 123.77 3mka h ALA 470 Ca -0.10 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 3mka h ALA 470 Cb 1.51 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 3mka h ALA 470 CO 0.16 0.31 -0.54 1.25 0.00 0.00 0.00 179.25 180.43 3mka h LEU 471 N 0.77 0.00 -0.13 0.00 5.85 -1.38 -1.57 115.31 118.84 3mka h LEU 471 Ca 0.24 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.90 3mka h LEU 471 Cb 0.03 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 3mka h LEU 471 CO -0.06 0.54 -0.17 0.22 -0.34 0.00 0.00 178.44 178.63 3mka h TYR 472 N 0.00 0.42 -0.36 1.25 3.20 -0.24 -2.21 116.97 119.04 3mka h TYR 472 Ca -0.01 -0.14 -0.01 0.00 3.14 0.00 0.00 58.73 61.72 3mka h TYR 472 Cb 1.08 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.25 3mka h TYR 472 CO 0.00 0.77 0.17 -0.44 -1.64 0.00 0.00 178.16 177.02 3mka h ASP 473 N -0.05 0.44 -0.25 -2.11 3.32 -0.73 -1.86 116.42 115.18 3mka h ASP 473 Ca 0.02 -0.03 -0.15 0.00 0.02 0.00 0.00 57.03 56.89 3mka h ASP 473 Cb 0.72 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 3mka h ASP 473 CO 0.04 0.38 -0.38 0.00 -1.72 0.00 0.00 179.24 177.56 3mka h ALA 474 N 1.70 0.70 0.00 3.45 0.00 -1.18 -2.91 119.26 121.02 3mka h ALA 474 Ca 0.13 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.52 3mka h ALA 474 Cb 0.05 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3mka h ALA 474 CO -0.02 0.66 -0.33 0.00 0.00 0.00 0.00 179.25 179.56 3mka h ALA 475 N 0.92 1.30 -0.48 0.00 0.00 -0.79 -1.93 119.26 118.29 3mka h ALA 475 Ca 0.06 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 3mka h ALA 475 Cb 0.93 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3mka h ALA 475 CO 0.09 0.41 -0.07 0.22 0.00 0.00 0.00 179.25 179.90 3mka h ASP 476 N 0.00 0.83 -0.01 0.00 3.58 -1.16 -3.29 116.42 116.36 3mka h ASP 476 Ca -0.00 -0.24 0.00 0.00 0.42 0.00 0.00 57.03 57.21 3mka h ASP 476 Cb 0.65 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.47 3mka h ASP 476 CO 0.04 0.94 -0.21 0.47 -2.88 0.00 0.00 179.24 177.60 3mka n ASP 477 N -4.17 1.72 -3.91 2.28 8.00 -1.13 -4.93 116.55 114.42 3mka n ASP 477 Ca 0.02 -1.36 -0.25 0.00 0.71 0.00 0.00 54.79 53.90 3mka n ASP 477 Cb 0.35 0.33 -0.17 0.00 -0.02 0.00 0.00 41.12 41.61 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 -1.59 1.95 0.12 -2.24 2.15 -0.74 -5.01 116.67 111.31 3mka s ASP 478 Ca 0.13 -0.26 0.22 0.00 0.43 0.00 0.00 52.55 53.08 3mka s ASP 478 Cb 0.12 -0.76 0.89 0.00 -0.30 0.00 0.00 42.92 42.87 3mka s ASP 478 CO 0.31 -0.10 1.69 -1.54 -0.17 0.00 0.00 175.17 175.36 3mka n SER 479 N 4.72 0.36 0.09 -0.34 3.41 -1.26 -2.62 113.62 117.97 3mka n SER 479 Ca -0.14 0.57 0.12 0.00 -0.26 0.00 0.00 58.87 59.15 3mka n SER 479 Cb 0.50 -0.65 0.21 0.00 -0.26 0.00 0.00 64.21 64.02 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 2.53 0.71 -3.06 7.33 0.00 -1.94 -3.43 119.26 121.40 3mka h ALA 480 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 3mka h ALA 480 Cb 0.43 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.07 3mka h ALA 480 CO 0.00 0.00 -0.52 0.99 0.00 0.00 0.00 179.25 179.72 3mka s THR 481 N -3.17 5.28 0.04 0.00 2.01 -1.08 -4.49 115.64 114.23 3mka s THR 481 Ca 0.07 0.15 -0.18 0.00 0.31 0.00 0.00 61.69 62.04 3mka s THR 481 Cb 0.12 -3.47 -0.06 0.00 0.01 0.00 0.00 72.50 69.10 3mka s THR 481 CO 0.69 0.34 0.51 -0.83 -0.69 0.00 0.00 174.62 174.64 3mka s GLY 482 N 1.16 2.60 0.34 4.40 0.00 -1.26 -4.42 107.32 110.14 3mka s GLY 482 Ca 0.07 -0.06 0.03 0.00 0.00 0.00 0.00 44.72 44.77 3mka s GLY 482 CO 0.05 0.37 0.47 0.61 0.00 0.00 0.00 173.10 174.60 3mka n GLY 483 N 1.81 1.45 3.67 0.20 0.00 -1.26 -4.45 105.19 106.62 3mka n GLY 483 Ca -0.11 -2.11 -0.46 0.00 0.00 0.00 0.00 46.02 43.34 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 -1.80 2.44 -2.95 1.61 -0.04 -1.26 -4.93 135.00 128.07 3mka n PRO 484 Ca 0.09 0.89 -0.44 0.00 -0.04 0.00 0.00 63.50 64.00 3mka n PRO 484 Cb 0.32 -2.77 -0.03 0.00 -0.04 0.00 0.00 33.50 30.97 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 3.94 6.34 0.49 3.54 -1.08 -0.30 -4.90 116.67 124.70 3mka s ASP 485 Ca 0.90 -1.48 0.28 0.00 -0.52 0.00 0.00 52.55 51.74 3mka s ASP 485 Cb -0.60 -2.38 1.03 0.00 -1.46 0.00 0.00 42.92 39.51 3mka s ASP 485 CO 0.47 -1.22 1.86 -0.07 0.52 0.00 0.00 175.17 176.72 3mka h LEU 486 N 10.65 0.00 -0.06 -1.34 4.07 -1.92 0.40 115.31 127.12 3mka h LEU 486 Ca -0.13 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.57 3mka h LEU 486 Cb 1.06 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.82 3mka h LEU 486 CO 1.13 0.08 -0.97 0.58 -1.08 0.00 0.00 178.44 178.18 3mka h VAL 487 N 0.00 1.29 0.00 1.22 2.07 -1.97 -3.30 116.25 115.56 3mka h VAL 487 Ca -0.00 -2.20 0.00 0.00 0.82 0.00 0.00 66.70 65.32 3mka h VAL 487 Cb 0.69 2.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.75 3mka h VAL 487 CO 0.01 0.68 -1.40 0.54 0.02 0.00 0.00 177.57 177.43 3mka n ARG 488 N -3.86 0.39 -2.57 1.57 1.74 -1.21 -5.01 116.66 107.71 3mka n ARG 488 Ca -0.10 -0.07 -0.06 0.00 -0.77 0.00 0.00 57.85 56.85 3mka n ARG 488 Cb 0.85 -1.56 0.02 0.00 -1.02 0.00 0.00 32.46 30.75 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 1.34 0.33 3.39 -0.13 0.00 0.13 -5.05 105.19 105.21 3mka n GLY 489 Ca -0.00 -0.35 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 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 -3.10 3.31 0.28 -0.61 1.01 -0.83 -4.99 121.20 116.27 3mka s ILE 490 Ca 0.07 -0.56 0.03 0.00 0.00 0.00 0.00 60.65 60.19 3mka s ILE 490 Cb -0.03 -2.43 -0.06 0.00 0.01 0.00 0.00 42.46 39.96 3mka s ILE 490 CO 0.21 0.50 0.05 -0.36 0.00 0.00 0.00 174.94 175.34 3mka s PHE 491 N 0.54 1.76 0.96 3.97 0.08 -1.26 -1.15 117.98 122.88 3mka s PHE 491 Ca -0.06 -1.00 -0.10 0.00 0.12 0.00 0.00 56.93 55.88 3mka s PHE 491 Cb -0.15 -1.09 0.17 0.00 -0.57 0.00 0.00 43.02 41.38 3mka s PHE 491 CO 0.03 -0.08 1.13 -2.14 -0.10 0.00 0.00 175.22 174.06 3mka s PRO 492 N -3.92 0.67 0.08 0.24 0.02 -1.26 -4.79 135.00 126.04 3mka s PRO 492 Ca 0.35 1.47 0.04 0.00 0.02 0.00 0.00 61.00 62.88 3mka s PRO 492 Cb 0.08 -1.69 -0.04 0.00 0.02 0.00 0.00 34.50 32.86 3mka s PRO 492 CO 0.13 -2.84 0.03 0.95 -0.33 0.00 0.00 177.00 174.94 3mka s THR 493 N -2.61 4.22 0.05 0.99 -4.23 -0.90 -4.95 115.64 108.21 3mka s THR 493 Ca 0.67 -0.86 -0.03 0.00 -1.18 0.00 0.00 61.69 60.29 3mka s THR 493 Cb -0.23 -3.01 -0.02 0.00 1.34 0.00 0.00 72.50 70.58 3mka s THR 493 CO 0.59 0.15 0.04 0.00 -0.54 0.00 0.00 174.62 174.86 3mka s ALA 494 N -1.31 0.17 -0.01 3.99 0.00 -1.26 -1.63 121.76 121.70 3mka s ALA 494 Ca 0.26 -0.82 0.01 0.00 0.00 0.00 0.00 51.96 51.41 3mka s ALA 494 Cb -0.12 0.27 0.01 0.00 0.00 0.00 0.00 23.12 23.28 3mka s ALA 494 CO 0.19 -0.34 -0.03 0.08 0.00 0.00 0.00 175.76 175.66 3mka s VAL 495 N -3.09 0.29 0.06 0.00 1.01 0.09 -1.11 120.40 117.65 3mka s VAL 495 Ca -0.01 -0.10 0.09 0.00 0.00 0.00 0.00 61.98 61.96 3mka s VAL 495 Cb 0.02 -0.29 -0.03 0.00 0.00 0.00 0.00 36.38 36.08 3mka s VAL 495 CO -0.07 0.11 -0.24 -0.51 0.00 0.00 0.00 175.10 174.39 3mka s ILE 496 N 0.26 1.95 -0.06 2.22 2.07 -0.30 -1.17 121.20 126.17 3mka s ILE 496 Ca -0.02 -1.38 -0.01 0.00 -1.41 0.00 0.00 60.65 57.83 3mka s ILE 496 Cb -0.06 -1.69 0.03 0.00 0.13 0.00 0.00 42.46 40.87 3mka s ILE 496 CO -0.00 0.24 0.01 -0.63 -1.91 0.00 0.00 174.94 172.64 3mka s ILE 497 N -0.86 0.28 0.00 2.00 1.01 -0.24 -0.93 121.20 122.46 3mka s ILE 497 Ca 0.10 0.14 0.00 0.00 0.00 0.00 0.00 60.65 60.89 3mka s ILE 497 Cb -0.10 -0.43 0.00 0.00 0.01 0.00 0.00 42.46 41.94 3mka s ILE 497 CO 0.03 0.22 0.00 -0.90 0.00 0.00 0.00 174.94 174.29 3mka n ASP 498 N 4.88 0.73 0.10 3.58 5.68 -1.18 -1.58 116.55 128.76 3mka n ASP 498 Ca -0.12 -0.47 0.18 0.00 -0.50 0.00 0.00 54.79 53.89 3mka n ASP 498 Cb 0.50 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 41.21 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 2.22 -0.11 2.12 0.00 -1.94 -1.18 119.26 121.36 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 -0.48 0.00 -0.25 0.00 0.00 0.00 179.25 178.52 3mka n ASP 500 N -4.18 0.62 0.00 0.00 8.00 -1.26 -5.03 116.55 114.71 3mka n ASP 500 Ca 0.06 -1.91 0.00 0.00 0.71 0.00 0.00 54.79 53.65 3mka n ASP 500 Cb 0.47 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.50 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 0.73 0.53 3.75 0.44 0.00 -0.45 -5.00 105.19 105.19 3mka n GLY 501 Ca 0.06 -2.02 -0.39 0.00 0.00 0.00 0.00 46.02 43.66 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 -1.37 3.41 0.01 4.61 0.00 0.14 -3.11 121.76 125.44 3mka s ALA 502 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.14 3mka s ALA 502 Cb 0.00 -2.90 -0.01 0.00 0.00 0.00 0.00 23.12 20.21 3mka s ALA 502 CO 0.00 0.08 -0.02 0.14 0.00 0.00 0.00 175.76 175.96 3mka s VAL 503 N -0.00 0.08 0.08 0.00 -7.23 -0.11 -4.98 120.40 108.24 3mka s VAL 503 Ca 0.36 -0.52 -0.30 0.00 -1.81 0.00 0.00 61.98 59.70 3mka s VAL 503 Cb -0.19 -0.16 -0.06 0.00 0.56 0.00 0.00 36.38 36.53 3mka s VAL 503 CO 0.20 -0.28 1.16 -1.81 -0.31 0.00 0.00 175.10 174.06 3mka s ASP 504 N -0.83 7.14 0.17 4.85 1.01 -1.26 -1.15 116.67 126.60 3mka s ASP 504 Ca -0.09 2.00 -0.30 0.00 0.71 0.00 0.00 52.55 54.87 3mka s ASP 504 Cb -0.06 -2.58 -0.07 0.00 1.01 0.00 0.00 42.92 41.22 3mka s ASP 504 CO -0.01 -0.40 1.06 -0.69 0.21 0.00 0.00 175.17 175.34 3mka s VAL 505 N 0.77 4.01 0.38 -1.27 1.01 -0.27 -4.92 120.40 120.11 3mka s VAL 505 Ca 0.56 1.74 -0.26 0.00 0.00 0.00 0.00 61.98 64.02 3mka s VAL 505 Cb -0.29 -4.11 -0.09 0.00 0.00 0.00 0.00 36.38 31.89 3mka s VAL 505 CO 0.30 0.31 1.20 -2.16 0.00 0.00 0.00 175.10 174.75 3mka s PRO 506 N -0.39 4.13 0.20 2.72 0.04 -1.26 -4.67 135.00 135.78 3mka s PRO 506 Ca 0.48 1.92 -0.16 0.00 0.04 0.00 0.00 61.00 63.28 3mka s PRO 506 Cb -0.28 -2.78 0.18 0.00 0.04 0.00 0.00 34.50 31.66 3mka s PRO 506 CO 0.34 -0.28 1.62 1.49 0.04 0.00 0.00 177.00 180.21 3mka h GLU 507 N 2.84 -0.07 -0.96 4.56 4.81 -1.95 -1.86 114.58 121.96 3mka h GLU 507 Ca -0.49 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 58.83 3mka h GLU 507 Cb 1.23 0.02 -0.07 0.00 0.63 0.00 0.00 28.75 30.56 3mka h GLU 507 CO 0.63 -0.05 0.61 0.66 -0.73 0.00 0.00 179.01 180.13 3mka h SER 508 N -0.07 0.94 -0.52 1.04 4.64 -1.99 0.90 113.55 118.48 3mka h SER 508 Ca 0.27 0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.62 3mka h SER 508 Cb 0.49 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.38 3mka h SER 508 CO -0.63 0.56 0.35 -0.09 -0.87 0.00 0.00 176.83 176.15 3mka h ARG 509 N 1.05 0.68 0.11 4.77 9.65 -1.72 -1.53 114.38 127.38 3mka h ARG 509 Ca 0.44 -0.04 -0.18 0.00 -1.10 0.00 0.00 59.98 59.10 3mka h ARG 509 Cb 0.28 -0.15 0.02 0.00 -1.39 0.00 0.00 29.97 28.73 3mka h ARG 509 CO -0.21 0.45 -0.78 0.82 2.80 0.00 0.00 179.97 183.06 3mka h ILE 510 N 0.70 1.48 -0.59 1.20 2.04 -1.15 -2.93 117.51 118.27 3mka h ILE 510 Ca 0.19 -2.41 0.08 0.00 1.00 0.00 0.00 64.86 63.72 3mka h ILE 510 Cb -0.07 3.03 -0.06 0.00 -0.74 0.00 0.00 36.82 38.97 3mka h ILE 510 CO -0.04 0.69 0.24 0.00 0.00 0.00 0.00 178.15 179.04 3mka h ALA 511 N 0.15 0.76 -0.53 1.87 0.00 -0.61 0.19 119.26 121.09 3mka h ALA 511 Ca -0.13 0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.87 3mka h ALA 511 Cb 1.57 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.34 3mka h ALA 511 CO 0.15 -0.15 0.33 1.49 0.00 0.00 0.00 179.25 181.06 3mka h GLU 512 N 0.45 0.63 -0.74 0.00 4.81 -1.37 0.02 114.58 118.38 3mka h GLU 512 Ca 0.29 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.43 3mka h GLU 512 Cb 0.31 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.51 3mka h GLU 512 CO -0.26 0.42 0.28 1.25 -0.73 0.00 0.00 179.01 179.97 3mka h LEU 513 N 0.65 1.03 0.17 1.64 5.85 -1.02 -0.80 115.31 122.83 3mka h LEU 513 Ca 0.21 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3mka h LEU 513 Cb -0.01 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 40.75 3mka h LEU 513 CO -0.08 0.93 -0.08 0.00 -0.34 0.00 0.00 178.44 178.87 3mka h ALA 514 N 1.14 -0.23 -0.98 1.25 0.00 -0.18 -1.51 119.26 118.75 3mka h ALA 514 Ca 0.25 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.13 3mka h ALA 514 Cb 0.23 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 3mka h ALA 514 CO -0.02 -0.63 0.65 0.00 0.00 0.00 0.00 179.25 179.25 3mka h ARG 515 N -0.23 1.24 -0.09 0.00 3.08 -0.75 0.14 114.38 117.77 3mka h ARG 515 Ca -0.02 -0.07 0.02 0.00 0.07 0.00 0.00 59.98 59.98 3mka h ARG 515 Cb 0.17 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 3mka h ARG 515 CO 0.04 0.82 -0.05 0.00 -1.07 0.00 0.00 179.97 179.71 3mka h ALA 516 N 1.41 0.03 -0.28 0.04 0.00 -0.70 0.10 119.26 119.86 3mka h ALA 516 Ca 0.38 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.33 3mka h ALA 516 Cb -0.06 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3mka h ALA 516 CO -0.10 -0.52 0.19 0.82 0.00 0.00 0.00 179.25 179.64 3mka h ILE 517 N -0.05 1.07 0.41 0.00 2.04 -0.26 -1.30 117.51 119.43 3mka h ILE 517 Ca 0.06 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 3mka h ILE 517 Cb 0.13 0.67 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 3mka h ILE 517 CO -0.13 0.07 -0.24 0.40 0.00 0.00 0.00 178.15 178.26 3mka h ILE 518 N 0.38 0.50 -0.45 -0.67 2.04 -0.53 -1.57 117.51 117.21 3mka h ILE 518 Ca 0.10 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.04 3mka h ILE 518 Cb -0.04 0.50 -0.10 0.00 -0.74 0.00 0.00 36.82 36.44 3mka h ILE 518 CO -0.02 0.00 -0.37 -0.08 0.00 0.00 0.00 178.15 177.68 3mka h GLU 519 N -0.62 -0.25 -0.16 2.37 4.57 -0.72 0.21 114.58 119.98 3mka h GLU 519 Ca -0.05 0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.20 3mka h GLU 519 Cb 0.50 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.14 3mka h GLU 519 CO 0.05 -0.17 0.18 1.03 -1.18 0.00 0.00 179.01 178.93 3mka h SER 520 N -0.26 0.00 1.48 1.04 0.87 -1.03 -0.44 113.55 115.20 3mka h SER 520 Ca 0.17 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.70 3mka h SER 520 Cb 0.56 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.51 3mka h SER 520 CO -0.59 0.00 -0.53 0.03 -0.53 0.00 0.00 176.83 175.21 3mka h ARG 521 N 0.00 0.00 -0.02 2.24 2.47 0.07 -3.51 114.38 115.63 3mka h ARG 521 Ca 0.08 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 3mka h ARG 521 Cb 0.45 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.77 3mka h ARG 521 CO -0.00 0.11 0.00 0.43 0.56 0.00 0.00 179.97 181.07