#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 3.83 0.26 0.00 1.01 -1.26 -5.08 120.40 119.16 3mka s VAL -38 Ca 0.00 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 3mka s VAL -38 Cb 0.00 -2.74 -0.09 0.00 0.00 0.00 0.00 36.38 33.55 3mka s VAL -38 CO 0.00 0.42 1.21 -0.62 0.00 0.00 0.00 175.10 176.10 3mka s ASP -37 N 1.20 7.04 0.00 3.32 3.68 -1.26 -4.93 116.67 125.72 3mka s ASP -37 Ca 0.03 2.40 0.00 0.00 2.13 0.00 0.00 52.55 57.11 3mka s ASP -37 Cb -0.15 -2.63 0.00 0.00 -1.45 0.00 0.00 42.92 38.70 3mka s ASP -37 CO 0.01 -0.35 0.42 0.18 0.13 0.00 0.00 175.17 175.55 3mka n LEU -36 N 1.57 0.83 -1.23 -1.34 4.77 -1.26 -4.98 117.00 115.36 3mka n LEU -36 Ca 0.01 -0.91 -0.12 0.00 -0.03 0.00 0.00 56.01 54.96 3mka n LEU -36 Cb 0.44 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.50 3mka n LEU -36 CO 0.56 0.21 -0.14 -1.20 -1.33 0.00 0.00 177.39 175.49 3mka n SER -35 N -0.15 -4.19 -4.53 -1.43 7.64 -1.26 -4.96 113.62 104.74 3mka n SER -35 Ca 0.00 0.12 -0.37 0.00 1.01 0.00 0.00 58.87 59.63 3mka n SER -35 Cb 0.00 -3.13 -0.12 0.00 -1.01 0.00 0.00 64.21 59.95 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 -2.62 5.59 0.18 6.43 0.15 -1.26 -4.10 113.70 118.07 3mka s SER -34 Ca 0.00 -0.09 -0.10 0.00 0.70 0.00 0.00 55.95 56.45 3mka s SER -34 Cb 0.00 -2.02 0.09 0.00 -1.71 0.00 0.00 66.02 62.39 3mka s SER -34 CO 0.00 -0.03 1.73 0.15 1.20 0.00 0.00 173.24 176.29 3mka h PHE -33 N 8.18 1.02 -0.68 3.44 3.57 -1.92 -1.97 116.94 128.58 3mka h PHE -33 Ca -0.37 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 60.99 3mka h PHE -33 Cb 1.18 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.59 3mka h PHE -33 CO 0.70 0.82 0.22 1.79 -2.23 0.00 0.00 178.31 179.61 3mka h THR -32 N 0.93 1.25 -0.74 4.41 1.35 -1.94 -0.83 112.91 117.34 3mka h THR -32 Ca 0.21 -0.86 -0.03 0.00 -0.55 0.00 0.00 66.41 65.19 3mka h THR -32 Cb 0.26 0.53 -0.03 0.00 -1.73 0.00 0.00 68.15 67.17 3mka h THR -32 CO -0.01 0.33 0.35 -0.78 -0.25 0.00 0.00 175.52 175.17 3mka h ASP -31 N 0.99 0.97 -0.71 5.36 3.58 -1.94 -2.32 116.42 122.35 3mka h ASP -31 Ca 0.22 -0.14 -0.06 0.00 0.42 0.00 0.00 57.03 57.47 3mka h ASP -31 Cb 0.29 -0.25 -0.03 0.00 1.72 0.00 0.00 39.33 41.06 3mka h ASP -31 CO -0.01 0.84 0.20 0.15 -2.88 0.00 0.00 179.24 177.53 3mka h PHE -30 N 1.04 1.17 -0.70 0.28 3.57 -0.99 -2.97 116.94 118.34 3mka h PHE -30 Ca 0.25 -0.13 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 3mka h PHE -30 Cb 0.12 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 38.50 3mka h PHE -30 CO 0.01 0.94 0.39 -0.07 -2.23 0.00 0.00 178.31 177.35 3mka h LEU -29 N 1.06 0.87 -0.59 0.59 3.38 -0.64 -1.06 115.31 118.92 3mka h LEU -29 Ca 0.23 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 3mka h LEU -29 Cb 0.34 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.85 3mka h LEU -29 CO -0.00 0.72 0.19 0.08 0.09 0.00 0.00 178.44 179.51 3mka h ARG -28 N 0.96 0.92 -0.45 1.13 0.11 -1.38 1.85 114.38 117.53 3mka h ARG -28 Ca 0.25 -0.19 -0.04 0.00 0.10 0.00 0.00 59.98 60.10 3mka h ARG -28 Cb 0.03 -0.13 -0.02 0.00 1.11 0.00 0.00 29.97 30.96 3mka h ARG -28 CO -0.04 0.82 0.14 -0.09 0.10 0.00 0.00 179.97 180.89 3mka h ARG -27 N 0.84 0.69 0.00 0.08 2.43 -1.30 -3.30 114.38 113.82 3mka h ARG -27 Ca 0.19 -0.15 -0.19 0.00 -0.81 0.00 0.00 59.98 59.02 3mka h ARG -27 Cb 0.28 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 3mka h ARG -27 CO -0.01 0.67 -1.72 1.04 -1.51 0.00 0.00 179.97 178.45 3mka n GLN -26 N -4.55 2.23 -3.38 0.20 1.13 -0.44 -4.83 117.38 107.74 3mka n GLN -26 Ca 0.01 -0.00 -0.26 0.00 -1.94 0.00 0.00 57.00 54.80 3mka n GLN -26 Cb 0.19 -1.27 -0.09 0.00 0.11 0.00 0.00 30.24 29.18 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 -2.40 3.07 -0.10 -1.58 0.00 0.61 -4.93 120.51 115.17 3mka n ALA -25 Ca -0.17 -3.84 -0.01 0.00 0.00 0.00 0.00 53.44 49.42 3mka n ALA -25 Cb 0.84 -0.85 0.24 0.00 0.00 0.00 0.00 19.45 19.68 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 4.56 0.76 -0.77 0.00 0.11 -1.15 -2.91 132.00 132.60 3mka h PRO -24 Ca 0.15 -0.13 0.03 0.00 0.11 0.00 0.00 66.00 66.17 3mka h PRO -24 Cb 0.81 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 31.75 3mka h PRO -24 CO 0.57 0.65 0.51 0.93 -0.21 0.00 0.00 178.00 180.45 3mka h GLU -23 N 0.75 0.92 -0.46 1.05 3.07 -1.92 -1.01 114.58 116.98 3mka h GLU -23 Ca 0.18 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 58.97 3mka h GLU -23 Cb 0.20 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 3mka h GLU -23 CO -0.01 0.61 0.23 -0.07 -1.40 0.00 0.00 179.01 178.37 3mka h LEU -22 N 0.95 0.57 -9.94 1.33 3.38 -1.84 -3.42 115.31 106.34 3mka h LEU -22 Ca 0.30 -0.05 -0.53 0.00 0.09 0.00 0.00 57.88 57.69 3mka h LEU -22 Cb 0.03 -0.15 0.10 0.00 0.09 0.00 0.00 40.66 40.73 3mka h LEU -22 CO -0.09 0.49 0.72 -0.76 0.09 0.00 0.00 178.44 178.90 3mka s LEU -21 N -9.43 4.31 0.27 1.67 1.02 -0.38 -4.96 118.68 111.17 3mka s LEU -21 Ca -0.09 2.92 -0.02 0.00 0.02 0.00 0.00 54.13 56.97 3mka s LEU -21 Cb 0.17 -3.72 0.36 0.00 0.02 0.00 0.00 46.19 43.02 3mka s LEU -21 CO 0.76 -0.83 1.79 -0.65 0.02 0.00 0.00 176.35 177.43 3mka h PRO -20 N 2.97 0.83 -5.99 1.29 0.11 -1.84 -3.50 132.00 125.87 3mka h PRO -20 Ca -0.50 -0.19 -0.65 0.00 0.11 0.00 0.00 66.00 64.76 3mka h PRO -20 Cb 1.24 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3mka h PRO -20 CO 0.64 0.78 1.43 0.00 -0.21 0.00 0.00 178.00 180.64 3mka n ALA -19 N -2.47 1.25 -0.74 -0.75 0.00 -1.26 -5.18 120.51 111.37 3mka n ALA -19 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3mka n ALA -19 Cb 0.26 -2.64 0.00 0.00 0.00 0.00 0.00 19.45 17.07 3mka n ALA -19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mka n ALA -6 N 10.23 0.00 -4.05 0.00 0.00 -1.26 -5.09 120.51 120.34 3mka n ALA -6 Ca 0.38 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.65 3mka n ALA -6 Cb 0.29 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.69 3mka n ALA -6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mka n GLN -5 N 0.00 0.51 -2.79 0.00 10.64 -1.26 -4.78 117.38 119.70 3mka n GLN -5 Ca 0.00 -2.81 -0.29 0.00 -1.83 0.00 0.00 57.00 52.07 3mka n GLN -5 Cb 0.00 2.49 -0.02 0.00 -0.86 0.00 0.00 30.24 31.85 3mka n GLN -5 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3mka s LEU -4 N 0.00 3.76 0.11 2.61 2.01 -1.26 -4.95 118.68 120.95 3mka s LEU -4 Ca 0.32 1.01 -0.31 0.00 0.01 0.00 0.00 54.13 55.16 3mka s LEU -4 Cb 0.00 -3.92 -0.10 0.00 0.01 0.00 0.00 46.19 42.18 3mka s LEU -4 CO 0.22 -0.46 1.76 -2.84 1.01 0.00 0.00 176.35 176.04 3mka s PRO -3 N -4.22 4.16 0.29 1.29 0.02 -1.26 -4.77 135.00 130.51 3mka s PRO -3 Ca 0.49 2.51 -0.10 0.00 0.02 0.00 0.00 61.00 63.92 3mka s PRO -3 Cb -0.10 -3.56 0.00 0.00 0.02 0.00 0.00 34.50 30.86 3mka s PRO -3 CO 0.37 -0.80 0.51 -3.38 -0.33 0.00 0.00 177.00 173.37 3mka s HIS -2 N 2.59 0.54 0.00 6.54 -3.43 -0.66 -0.88 115.29 119.98 3mka s HIS -2 Ca 0.78 -0.90 0.00 0.00 -0.80 0.00 0.00 55.06 54.14 3mka s HIS -2 Cb -0.44 0.18 0.00 0.00 -1.43 0.00 0.00 32.58 30.89 3mka s HIS -2 CO 0.35 -1.10 0.00 0.41 -2.00 0.00 0.00 174.74 172.40 3mka n GLY -1 N -0.45 1.69 3.44 -1.38 0.00 -1.17 -1.27 105.19 106.06 3mka n GLY -1 Ca -0.02 -1.16 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 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 0.00 -1.66 -0.04 4.61 0.00 -1.26 -4.51 121.76 118.90 3mka s ALA 301 Ca 0.00 0.66 0.03 0.00 0.00 0.00 0.00 51.96 52.65 3mka s ALA 301 Cb 0.00 0.72 0.01 0.00 0.00 0.00 0.00 23.12 23.84 3mka s ALA 301 CO 0.00 -0.72 -0.11 0.99 0.00 0.00 0.00 175.76 175.92 3mka s THR 302 N -3.40 0.99 -0.01 0.00 2.01 -1.26 -1.27 115.64 112.70 3mka s THR 302 Ca 0.01 -0.44 0.01 0.00 0.31 0.00 0.00 61.69 61.57 3mka s THR 302 Cb -0.01 -0.89 0.01 0.00 0.01 0.00 0.00 72.50 71.62 3mka s THR 302 CO -0.10 0.31 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.48 3mka s ILE 303 N 0.36 0.25 0.18 1.82 1.01 -0.21 -2.44 121.20 122.17 3mka s ILE 303 Ca -0.07 -0.09 0.07 0.00 0.00 0.00 0.00 60.65 60.56 3mka s ILE 303 Cb -0.12 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.06 3mka s ILE 303 CO 0.02 0.10 -0.15 0.68 0.00 0.00 0.00 174.94 175.59 3mka s VAL 304 N 0.23 1.64 -0.21 2.92 -7.23 -0.21 -0.77 120.40 116.78 3mka s VAL 304 Ca -0.02 -2.07 -0.15 0.00 -1.81 0.00 0.00 61.98 57.92 3mka s VAL 304 Cb -0.05 -1.91 0.06 0.00 0.56 0.00 0.00 36.38 35.04 3mka s VAL 304 CO -0.01 -0.53 0.53 0.00 -0.31 0.00 0.00 175.10 174.78 3mka s ALA 305 N -2.71 -1.34 0.05 1.32 0.00 -0.41 -1.61 121.76 117.06 3mka s ALA 305 Ca 0.19 1.68 -0.07 0.00 0.00 0.00 0.00 51.96 53.75 3mka s ALA 305 Cb -0.02 -0.99 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 3mka s ALA 305 CO 0.06 -0.28 0.14 -0.48 0.00 0.00 0.00 175.76 175.20 3mka s LEU 306 N 0.86 1.61 -0.15 0.00 0.05 -0.45 -1.20 118.68 119.40 3mka s LEU 306 Ca -0.05 -0.54 -0.10 0.00 0.05 0.00 0.00 54.13 53.49 3mka s LEU 306 Cb -0.05 0.80 -0.05 0.00 -2.05 0.00 0.00 46.19 44.84 3mka s LEU 306 CO -0.07 -0.59 0.19 -0.54 -0.55 0.00 0.00 176.35 174.79 3mka s LYS 307 N -3.01 3.94 0.19 1.48 1.02 0.00 -0.48 119.74 122.87 3mka s LYS 307 Ca -0.02 -0.07 0.08 0.00 0.02 0.00 0.00 55.97 55.98 3mka s LYS 307 Cb 0.01 -3.33 -0.04 0.00 -0.52 0.00 0.00 37.83 33.95 3mka s LYS 307 CO -0.06 0.48 -0.15 1.52 -0.92 0.00 0.00 175.35 176.21 3mka s TYR 308 N -0.19 1.69 0.14 3.18 -0.85 0.21 -4.95 117.35 116.58 3mka s TYR 308 Ca 0.13 -0.55 -0.33 0.00 -0.52 0.00 0.00 57.07 55.81 3mka s TYR 308 Cb -0.12 -0.81 -0.12 0.00 0.38 0.00 0.00 41.96 41.28 3mka s TYR 308 CO 0.02 0.33 1.71 -2.30 -1.52 0.00 0.00 175.55 173.79 3mka n PRO 309 N -0.13 2.48 -0.99 -3.49 -0.02 -1.26 -0.38 135.00 131.22 3mka n PRO 309 Ca -0.10 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3mka n PRO 309 Cb 0.59 -2.73 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 0.36 3.82 -1.23 0.00 -1.11 -4.79 105.19 106.10 3mka n GLY 310 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.14 0.02 -0.02 0.00 0.49 -4.05 107.32 101.62 3mka s GLY 311 Ca 0.00 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.57 3mka s GLY 311 CO 0.00 -0.06 -0.04 0.54 0.00 0.00 0.00 173.10 173.54 3mka s VAL 312 N -3.71 0.23 0.10 1.40 0.11 -0.70 -0.62 120.40 117.20 3mka s VAL 312 Ca 0.11 -0.64 0.05 0.00 -2.93 0.00 0.00 61.98 58.57 3mka s VAL 312 Cb -0.04 -0.30 -0.03 0.00 -1.53 0.00 0.00 36.38 34.47 3mka s VAL 312 CO 0.05 -0.27 -0.13 0.54 -3.33 0.00 0.00 175.10 171.96 3mka s VAL 313 N -0.91 1.16 -0.08 2.04 0.11 0.37 -1.42 120.40 121.66 3mka s VAL 313 Ca -0.08 -1.52 -0.06 0.00 -2.93 0.00 0.00 61.98 57.38 3mka s VAL 313 Cb -0.07 -1.30 0.03 0.00 -1.53 0.00 0.00 36.38 33.52 3mka s VAL 313 CO -0.00 -0.36 0.21 -0.32 -3.33 0.00 0.00 175.10 171.30 3mka s MET 314 N -2.28 0.22 0.03 1.54 1.75 -0.25 -1.34 119.30 118.96 3mka s MET 314 Ca 0.03 0.36 -0.06 0.00 -1.25 0.00 0.00 55.69 54.78 3mka s MET 314 Cb -0.07 0.03 -0.01 0.00 2.84 0.00 0.00 34.83 37.62 3mka s MET 314 CO 0.02 -0.08 0.11 0.00 -0.65 0.00 0.00 175.02 174.42 3mka s ALA 315 N 0.52 -0.16 0.07 4.11 0.00 -0.63 -0.60 121.76 125.07 3mka s ALA 315 Ca -0.03 -0.40 -0.07 0.00 0.00 0.00 0.00 51.96 51.45 3mka s ALA 315 Cb -0.05 0.20 -0.01 0.00 0.00 0.00 0.00 23.12 23.27 3mka s ALA 315 CO -0.03 -0.28 0.15 0.20 0.00 0.00 0.00 175.76 175.81 3mka s GLY 316 N -1.84 0.14 0.99 0.00 0.00 -0.69 -1.04 107.32 104.87 3mka s GLY 316 Ca -0.09 -0.62 -0.16 0.00 0.00 0.00 0.00 44.72 43.85 3mka s GLY 316 CO -0.02 -0.79 1.34 2.09 0.00 0.00 0.00 173.10 175.73 3mka n ASP 317 N 0.21 0.16 -0.10 1.64 5.68 -1.02 -1.93 116.55 121.19 3mka n ASP 317 Ca -0.16 -1.52 0.01 0.00 -0.50 0.00 0.00 54.79 52.62 3mka n ASP 317 Cb 0.61 -1.02 0.02 0.00 -1.14 0.00 0.00 41.12 39.59 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 -3.83 0.85 -3.10 0.11 5.12 -1.26 -4.58 116.66 109.97 3mka n ARG 318 Ca 0.17 -1.04 -0.31 0.00 -1.93 0.00 0.00 57.85 54.73 3mka n ARG 318 Cb 0.59 -1.05 -0.05 0.00 -1.16 0.00 0.00 32.46 30.80 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 -0.53 3.88 -0.03 5.56 3.52 -1.26 -2.20 118.95 127.89 3mka s ARG 319 Ca 0.03 0.51 -0.00 0.00 -0.13 0.00 0.00 55.73 56.14 3mka s ARG 319 Cb 0.02 -2.46 0.03 0.00 -1.56 0.00 0.00 34.95 30.98 3mka s ARG 319 CO 0.03 0.12 0.02 0.45 -0.81 0.00 0.00 175.30 175.11 3mka s SER 320 N -2.62 0.55 0.16 -2.12 0.15 0.44 -4.66 113.70 105.60 3mka s SER 320 Ca 0.52 0.01 0.09 0.00 0.70 0.00 0.00 55.95 57.27 3mka s SER 320 Cb -0.10 -0.18 -0.04 0.00 -1.71 0.00 0.00 66.02 63.98 3mka s SER 320 CO 0.23 -0.14 -0.21 0.42 1.20 0.00 0.00 173.24 174.74 3mka s THR 321 N 1.32 1.99 -0.41 6.45 -4.23 -0.39 0.69 115.64 121.06 3mka s THR 321 Ca -0.06 -1.87 0.02 0.00 -1.18 0.00 0.00 61.69 58.61 3mka s THR 321 Cb -0.13 -1.88 0.12 0.00 1.34 0.00 0.00 72.50 71.95 3mka s THR 321 CO -0.03 -0.18 0.17 -1.10 -0.54 0.00 0.00 174.62 172.95 3mka s GLN 322 N -2.53 1.33 7.03 3.99 -0.21 0.17 -1.66 119.66 127.77 3mka s GLN 322 Ca 0.15 -1.89 0.00 0.00 0.02 0.00 0.00 55.36 53.64 3mka s GLN 322 Cb -0.08 -2.61 0.00 0.00 1.00 0.00 0.00 33.01 31.32 3mka s GLN 322 CO 0.07 -1.07 0.00 0.41 -2.12 0.00 0.00 175.29 172.58 3mka n GLY 323 N 3.89 1.55 0.05 3.09 0.00 -1.26 -2.50 105.19 110.02 3mka n GLY 323 Ca 0.05 -0.51 0.11 0.00 0.00 0.00 0.00 46.02 45.67 3mka n GLY 323 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3mka n ASN 324 N 7.67 0.58 -4.76 1.61 3.02 -1.26 -4.92 115.26 117.19 3mka n ASN 324 Ca 0.00 -0.02 -0.40 0.00 -0.03 0.00 0.00 54.58 54.13 3mka n ASN 324 Cb 0.00 0.89 -0.05 0.00 -0.61 0.00 0.00 39.78 40.01 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 -3.30 4.69 -0.34 3.52 -1.94 -1.04 -4.99 119.30 115.89 3mka s MET 325 Ca 0.01 1.71 -0.28 0.00 -1.71 0.00 0.00 55.69 55.41 3mka s MET 325 Cb 0.13 -3.19 0.02 0.00 2.01 0.00 0.00 34.83 33.80 3mka s MET 325 CO 0.82 0.29 1.05 0.42 -0.01 0.00 0.00 175.02 177.58 3mka s ILE 326 N -1.19 4.50 -0.13 2.53 1.01 -1.26 -0.66 121.20 126.01 3mka s ILE 326 Ca 0.44 1.59 0.18 0.00 0.00 0.00 0.00 60.65 62.85 3mka s ILE 326 Cb -0.30 -4.41 -0.23 0.00 0.01 0.00 0.00 42.46 37.53 3mka s ILE 326 CO 0.38 -0.54 0.46 -1.54 0.00 0.00 0.00 174.94 173.70 3mka n SER 327 N 6.94 0.39 -3.81 3.58 3.41 0.22 -4.91 113.62 119.42 3mka n SER 327 Ca 0.11 0.18 -0.12 0.00 -0.26 0.00 0.00 58.87 58.77 3mka n SER 327 Cb 0.47 0.76 -0.10 0.00 -0.26 0.00 0.00 64.21 65.08 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 -5.06 -0.07 0.00 5.00 0.00 -0.09 -4.93 107.32 102.17 3mka s GLY 328 Ca -0.07 0.20 0.00 0.00 0.00 0.00 0.00 44.72 44.85 3mka s GLY 328 CO 0.84 0.05 0.30 -0.96 0.00 0.00 0.00 173.10 173.32 3mka n ARG 329 N 1.70 -0.04 0.00 2.90 1.85 -1.25 -0.42 116.66 121.39 3mka n ARG 329 Ca -0.20 -0.30 0.01 0.00 -1.00 0.00 0.00 57.85 56.36 3mka n ARG 329 Cb 0.56 -0.78 0.00 0.00 -1.05 0.00 0.00 32.46 31.20 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 -0.08 0.88 -4.62 2.89 5.75 -1.17 -4.59 116.55 115.61 3mka n ASP 330 Ca 0.00 -0.94 -0.59 0.00 -0.01 0.00 0.00 54.79 53.25 3mka n ASP 330 Cb 0.07 0.28 -0.08 0.00 -1.03 0.00 0.00 41.12 40.37 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 -0.20 0.06 -3.72 2.12 0.31 -0.93 -4.97 118.33 110.99 3mka n VAL 331 Ca 0.01 -0.01 -0.35 0.00 -0.01 0.00 0.00 64.34 63.98 3mka n VAL 331 Cb 0.05 -0.56 -0.08 0.00 -0.91 0.00 0.00 33.84 32.34 3mka n VAL 331 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 3mka s ARG 332 N 1.53 4.17 0.00 5.55 3.52 -1.26 -4.21 118.95 128.25 3mka s ARG 332 Ca 0.94 -0.19 0.00 0.00 -0.13 0.00 0.00 55.73 56.36 3mka s ARG 332 Cb -1.21 -3.41 0.00 0.00 -1.56 0.00 0.00 34.95 28.77 3mka s ARG 332 CO 0.62 0.31 0.32 1.63 -0.81 0.00 0.00 175.30 177.37 3mka n LYS 333 N 3.47 0.38 -4.70 5.12 5.02 -1.26 -4.97 118.16 121.23 3mka n LYS 333 Ca -0.16 -0.32 -0.33 0.00 -2.02 0.00 0.00 58.31 55.48 3mka n LYS 333 Cb 0.52 -0.80 -0.16 0.00 -0.02 0.00 0.00 35.03 34.57 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 -0.15 2.37 0.01 -0.18 1.01 -1.26 -2.44 120.40 119.76 3mka s VAL 334 Ca 0.00 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.14 3mka s VAL 334 Cb 0.00 -1.97 -0.01 0.00 0.00 0.00 0.00 36.38 34.40 3mka s VAL 334 CO 0.00 0.54 -0.12 -0.31 0.00 0.00 0.00 175.10 175.20 3mka s TYR 335 N 0.72 1.11 -0.15 5.22 2.02 -0.65 -4.98 117.35 120.63 3mka s TYR 335 Ca -0.08 -0.26 -0.29 0.00 -0.37 0.00 0.00 57.07 56.07 3mka s TYR 335 Cb -0.16 -0.69 -0.01 0.00 -0.40 0.00 0.00 41.96 40.70 3mka s TYR 335 CO 0.01 -0.00 1.08 0.42 -1.57 0.00 0.00 175.55 175.48 3mka s ILE 336 N -0.48 4.61 -0.68 2.71 1.01 -1.26 -0.83 121.20 126.28 3mka s ILE 336 Ca 0.03 1.91 0.21 0.00 0.00 0.00 0.00 60.65 62.81 3mka s ILE 336 Cb -0.06 -4.23 -0.26 0.00 0.01 0.00 0.00 42.46 37.92 3mka s ILE 336 CO 0.00 -0.08 0.76 0.35 0.00 0.00 0.00 174.94 175.97 3mka n THR 337 N 4.95 0.00 -3.90 2.92 -2.24 0.55 -4.92 114.28 111.63 3mka n THR 337 Ca 0.11 -0.17 -0.02 0.00 -2.27 0.00 0.00 64.05 61.70 3mka n THR 337 Cb 0.47 0.67 0.02 0.00 -2.10 0.00 0.00 70.33 69.39 3mka n THR 337 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3mka s ASP 338 N -3.49 0.01 0.64 3.42 1.47 -1.17 -4.59 116.67 112.96 3mka s ASP 338 Ca 0.03 -0.62 0.38 0.00 1.18 0.00 0.00 52.55 53.52 3mka s ASP 338 Cb 0.15 0.45 2.15 0.00 -0.34 0.00 0.00 42.92 45.33 3mka s ASP 338 CO 0.88 -0.90 2.29 0.44 0.68 0.00 0.00 175.17 178.56 3mka h ASP 339 N 2.00 0.00 0.00 2.11 3.32 -1.95 -3.01 116.42 118.89 3mka h ASP 339 Ca -0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3mka h ASP 339 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3mka h ASP 339 CO 0.36 0.00 -0.17 -1.22 -1.72 0.00 0.00 179.24 176.49 3mka n TYR 340 N -3.35 0.00 -3.77 4.55 4.01 -1.26 -0.63 117.16 116.71 3mka n TYR 340 Ca -0.03 -0.65 -0.13 0.00 -0.16 0.00 0.00 57.90 56.93 3mka n TYR 340 Cb 0.11 -0.12 -0.08 0.00 -0.31 0.00 0.00 39.34 38.94 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 -1.88 0.07 0.05 -0.72 -4.23 -1.14 -0.93 115.64 106.85 3mka s THR 341 Ca 0.21 -0.55 0.02 0.00 -1.18 0.00 0.00 61.69 60.18 3mka s THR 341 Cb 0.18 -0.68 -0.03 0.00 1.34 0.00 0.00 72.50 73.32 3mka s THR 341 CO 0.02 -0.30 -0.06 0.00 -0.54 0.00 0.00 174.62 173.73 3mka s ALA 342 N -1.62 0.53 -0.01 3.99 0.00 0.76 -0.33 121.76 125.07 3mka s ALA 342 Ca -0.12 -0.83 0.05 0.00 0.00 0.00 0.00 51.96 51.06 3mka s ALA 342 Cb -0.04 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.16 3mka s ALA 342 CO 0.02 -0.10 -0.17 0.95 0.00 0.00 0.00 175.76 176.46 3mka s THR 343 N -1.84 1.37 -0.11 0.00 -4.23 -0.01 -1.45 115.64 109.37 3mka s THR 343 Ca -0.07 -0.76 0.03 0.00 -1.18 0.00 0.00 61.69 59.71 3mka s THR 343 Cb -0.07 -1.14 -0.00 0.00 1.34 0.00 0.00 72.50 72.63 3mka s THR 343 CO -0.01 0.37 -0.23 -0.83 -0.54 0.00 0.00 174.62 173.38 3mka s GLY 344 N -0.46 1.35 -0.04 3.99 0.00 -0.36 -1.64 107.32 110.16 3mka s GLY 344 Ca 0.07 -0.97 0.06 0.00 0.00 0.00 0.00 44.72 43.87 3mka s GLY 344 CO -0.01 -0.29 -0.22 -0.42 0.00 0.00 0.00 173.10 172.16 3mka s ILE 345 N 0.39 1.81 0.20 0.90 1.01 -1.02 -0.31 121.20 124.17 3mka s ILE 345 Ca -0.17 -0.95 0.10 0.00 0.00 0.00 0.00 60.65 59.63 3mka s ILE 345 Cb -0.18 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.72 3mka s ILE 345 CO 0.08 0.51 -0.14 0.00 0.00 0.00 0.00 174.94 175.39 3mka s ALA 346 N -0.23 2.84 0.00 9.38 0.00 -0.88 -4.93 121.76 127.93 3mka s ALA 346 Ca 0.00 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 50.38 3mka s ALA 346 Cb -0.12 -0.58 0.00 0.00 0.00 0.00 0.00 23.12 22.43 3mka s ALA 346 CO 0.02 0.41 0.00 0.41 0.00 0.00 0.00 175.76 176.60 3mka n GLY 347 N -0.08 0.47 3.67 0.00 0.00 -1.26 0.08 105.19 108.08 3mka n GLY 347 Ca -0.10 -1.90 -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 -1.56 3.31 0.24 2.61 2.01 0.09 -3.05 115.64 119.29 3mka s THR 348 Ca 0.00 0.50 -0.05 0.00 0.31 0.00 0.00 61.69 62.45 3mka s THR 348 Cb 0.00 -3.32 0.22 0.00 0.01 0.00 0.00 72.50 69.41 3mka s THR 348 CO 0.00 -0.03 1.69 0.00 -0.69 0.00 0.00 174.62 175.59 3mka h ALA 349 N 9.41 0.93 -0.04 7.40 0.00 -1.34 -1.49 119.26 134.13 3mka h ALA 349 Ca -0.42 0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.65 3mka h ALA 349 Cb 1.20 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 3mka h ALA 349 CO 0.94 -0.33 -0.01 0.00 0.00 0.00 0.00 179.25 179.86 3mka h ALA 350 N 1.59 0.03 -0.03 0.00 0.00 -1.90 -2.25 119.26 116.71 3mka h ALA 350 Ca 0.40 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.28 3mka h ALA 350 Cb 0.67 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3mka h ALA 350 CO -0.49 -0.49 -0.21 0.28 0.00 0.00 0.00 179.25 178.34 3mka h VAL 351 N 0.01 1.16 0.00 0.00 2.07 -1.79 -2.38 116.25 115.32 3mka h VAL 351 Ca 0.02 -0.77 -0.11 0.00 0.82 0.00 0.00 66.70 66.65 3mka h VAL 351 Cb 0.03 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 3mka h VAL 351 CO -0.04 0.22 -0.53 0.00 0.02 0.00 0.00 177.57 177.25 3mka h ALA 352 N 1.75 0.88 0.00 1.67 0.00 -0.81 -2.64 119.26 120.11 3mka h ALA 352 Ca 0.01 -0.48 -0.25 0.00 0.00 0.00 0.00 54.91 54.18 3mka h ALA 352 Cb 0.39 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3mka h ALA 352 CO 0.03 0.66 -1.33 -0.24 0.00 0.00 0.00 179.25 178.37 3mka h VAL 353 N 0.00 1.31 -0.69 0.00 3.04 -1.09 -3.06 116.25 115.76 3mka h VAL 353 Ca -0.01 -3.08 -0.08 0.00 -1.01 0.00 0.00 66.70 62.52 3mka h VAL 353 Cb 1.11 2.65 -0.03 0.00 -2.01 0.00 0.00 31.29 33.02 3mka h VAL 353 CO 0.07 0.75 0.12 -0.33 -1.01 0.00 0.00 177.57 177.17 3mka h GLU 354 N 0.00 1.13 -0.62 4.17 5.08 -1.45 -3.07 114.58 119.82 3mka h GLU 354 Ca -0.14 -0.30 -0.08 0.00 -1.00 0.00 0.00 59.36 57.85 3mka h GLU 354 Cb 1.89 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.98 3mka h GLU 354 CO 0.11 1.02 0.09 0.74 -1.00 0.00 0.00 179.01 179.97 3mka h PHE 355 N 1.06 1.11 -0.63 4.33 -1.00 -1.48 -2.54 116.94 117.79 3mka h PHE 355 Ca 0.21 -0.16 -0.08 0.00 2.81 0.00 0.00 57.97 60.75 3mka h PHE 355 Cb 0.43 -0.30 -0.02 0.00 3.61 0.00 0.00 35.95 39.66 3mka h PHE 355 CO 0.03 0.95 0.07 0.00 -1.61 0.00 0.00 178.31 177.75 3mka h ALA 356 N 1.02 0.84 0.18 2.45 0.00 -1.45 -1.45 119.26 120.85 3mka h ALA 356 Ca 0.19 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3mka h ALA 356 Cb 0.44 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3mka h ALA 356 CO 0.01 0.62 -0.09 -0.09 0.00 0.00 0.00 179.25 179.71 3mka h ARG 357 N 0.97 -0.24 -0.20 0.00 2.43 -1.47 -2.11 114.38 113.75 3mka h ARG 357 Ca 0.19 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.41 3mka h ARG 357 Cb 0.47 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 3mka h ARG 357 CO 0.02 0.05 -0.00 1.25 -1.51 0.00 0.00 179.97 179.78 3mka h LEU 358 N -0.52 -0.08 -1.77 3.80 5.85 -1.50 -1.53 115.31 119.55 3mka h LEU 358 Ca -0.02 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 3mka h LEU 358 Cb 0.39 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3mka h LEU 358 CO 0.04 -0.02 0.07 0.22 -0.34 0.00 0.00 178.44 178.41 3mka h TYR 359 N 0.06 0.21 -0.15 1.25 3.20 -1.21 0.11 116.97 120.44 3mka h TYR 359 Ca 0.10 0.00 -0.22 0.00 3.14 0.00 0.00 58.73 61.74 3mka h TYR 359 Cb 0.12 -0.07 0.01 0.00 1.54 0.00 0.00 36.73 38.33 3mka h TYR 359 CO -0.18 0.17 -0.78 0.00 -1.64 0.00 0.00 178.16 175.73 3mka h ALA 360 N 1.86 0.32 -0.32 1.82 0.00 -0.74 -2.49 119.26 119.70 3mka h ALA 360 Ca 0.06 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.32 3mka h ALA 360 Cb 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3mka h ALA 360 CO -0.01 0.69 0.03 0.28 0.00 0.00 0.00 179.25 180.24 3mka h VAL 361 N 0.54 1.25 -0.80 0.00 2.07 -0.68 -1.49 116.25 117.13 3mka h VAL 361 Ca -0.05 -0.88 0.10 0.00 0.82 0.00 0.00 66.70 66.69 3mka h VAL 361 Cb 1.41 1.19 -0.06 0.00 -1.52 0.00 0.00 31.29 32.32 3mka h VAL 361 CO 0.16 0.29 0.52 -0.08 0.02 0.00 0.00 177.57 178.48 3mka h GLU 362 N 0.37 0.69 -0.07 1.57 4.57 -0.74 0.11 114.58 121.07 3mka h GLU 362 Ca 0.10 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 58.14 3mka h GLU 362 Cb 0.39 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 3mka h GLU 362 CO 0.01 0.46 -0.33 -0.07 -1.18 0.00 0.00 179.01 177.90 3mka h LEU 363 N 0.71 0.42 -0.99 1.64 4.07 -1.07 -2.99 115.31 117.10 3mka h LEU 363 Ca 0.37 -0.64 -0.09 0.00 0.08 0.00 0.00 57.88 57.60 3mka h LEU 363 Cb 0.50 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.10 3mka h LEU 363 CO -0.15 0.99 -0.43 -0.08 -1.08 0.00 0.00 178.44 177.70 3mka h GLU 364 N -0.13 0.00 -0.26 1.13 4.81 -0.72 -2.84 114.58 116.57 3mka h GLU 364 Ca -0.02 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.18 3mka h GLU 364 Cb 0.98 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 3mka h GLU 364 CO 0.07 0.43 0.05 1.25 -0.73 0.00 0.00 179.01 180.08 3mka h HIS 365 N 0.00 0.46 -0.08 0.92 2.76 -0.83 -1.81 115.15 116.57 3mka h HIS 365 Ca -0.00 -0.06 -0.05 0.00 -2.20 0.00 0.00 60.37 58.06 3mka h HIS 365 Cb 0.88 -0.13 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 3mka h HIS 365 CO 0.00 0.53 -0.17 -0.92 -1.30 0.00 0.00 177.93 176.07 3mka h TYR 366 N 0.25 0.14 -0.16 5.26 3.20 -1.41 -1.46 116.97 122.79 3mka h TYR 366 Ca 0.08 -0.02 -0.19 0.00 3.14 0.00 0.00 58.73 61.74 3mka h TYR 366 Cb 0.31 -0.04 0.01 0.00 1.54 0.00 0.00 36.73 38.55 3mka h TYR 366 CO 0.02 0.30 -0.65 1.49 -1.64 0.00 0.00 178.16 177.68 3mka h GLU 367 N 0.12 0.72 -0.22 1.82 4.81 -1.23 -1.42 114.58 119.18 3mka h GLU 367 Ca 0.02 -0.56 -0.12 0.00 -0.13 0.00 0.00 59.36 58.57 3mka h GLU 367 Cb 0.39 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 3mka h GLU 367 CO 0.03 1.18 -0.37 0.87 -0.73 0.00 0.00 179.01 179.98 3mka h LYS 368 N 0.42 0.49 -0.21 1.92 1.57 -1.05 0.57 116.57 120.28 3mka h LYS 368 Ca -0.04 -0.23 -0.18 0.00 -1.87 0.00 0.00 60.65 58.33 3mka h LYS 368 Cb 1.28 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.59 3mka h LYS 368 CO 0.14 0.79 -0.55 -0.07 -0.57 0.00 0.00 179.45 179.18 3mka h LEU 369 N 0.41 0.86 -2.29 2.94 3.38 -1.22 -3.29 115.31 116.10 3mka h LEU 369 Ca 0.04 -0.57 0.00 0.00 0.09 0.00 0.00 57.88 57.44 3mka h LEU 369 Cb 0.84 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.34 3mka h LEU 369 CO 0.07 1.28 0.00 -0.62 0.09 0.00 0.00 178.44 179.26 3mka n GLU 370 N -4.08 2.30 -1.02 1.13 -0.58 -0.54 -4.95 120.64 112.89 3mka n GLU 370 Ca -0.06 -2.11 -0.01 0.00 -0.42 0.00 0.00 57.16 54.56 3mka n GLU 370 Cb 0.63 -1.44 -0.00 0.00 -0.57 0.00 0.00 31.44 30.05 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 1.25 0.07 3.28 0.62 0.00 0.20 -4.92 105.19 105.70 3mka n GLY 371 Ca 0.17 -0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 -1.08 0.00 0.68 1.61 0.11 -1.18 -5.00 120.40 115.55 3mka s VAL 372 Ca 0.00 -0.03 -0.14 0.00 -2.93 0.00 0.00 61.98 58.88 3mka s VAL 372 Cb 0.00 -0.56 0.01 0.00 -1.53 0.00 0.00 36.38 34.30 3mka s VAL 372 CO 0.00 -0.02 1.10 -2.16 -3.33 0.00 0.00 175.10 170.70 3mka s PRO 373 N 0.10 2.72 0.66 1.54 0.04 -1.26 -4.27 135.00 134.53 3mka s PRO 373 Ca -0.01 1.33 -0.16 0.00 0.04 0.00 0.00 61.00 62.19 3mka s PRO 373 Cb -0.03 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.57 3mka s PRO 373 CO 0.01 -1.30 1.18 -0.51 0.04 0.00 0.00 177.00 176.42 3mka s LEU 374 N -5.07 3.47 0.79 -3.56 1.02 -1.26 -5.00 118.68 109.06 3mka s LEU 374 Ca 0.65 2.29 -0.11 0.00 0.02 0.00 0.00 54.13 56.98 3mka s LEU 374 Cb -0.19 -4.58 0.06 0.00 0.02 0.00 0.00 46.19 41.50 3mka s LEU 374 CO 0.44 -1.86 1.09 0.42 0.02 0.00 0.00 176.35 176.46 3mka s THR 375 N -1.92 3.26 0.12 5.49 -4.23 -1.26 -4.77 115.64 112.34 3mka s THR 375 Ca 0.74 0.41 -0.27 0.00 -1.18 0.00 0.00 61.69 61.39 3mka s THR 375 Cb -0.28 -3.05 -0.07 0.00 1.34 0.00 0.00 72.50 70.45 3mka s THR 375 CO 0.40 -0.54 1.63 0.15 -0.54 0.00 0.00 174.62 175.72 3mka h PHE 376 N -1.11 -0.78 -0.85 3.99 3.57 -1.98 0.12 116.94 119.90 3mka h PHE 376 Ca -0.46 0.02 0.24 0.00 3.53 0.00 0.00 57.97 61.30 3mka h PHE 376 Cb 1.25 0.34 -0.04 0.00 2.79 0.00 0.00 35.95 40.29 3mka h PHE 376 CO 0.52 -0.39 0.61 0.00 -2.23 0.00 0.00 178.31 176.82 3mka h ALA 377 N 0.27 2.74 0.04 2.41 0.00 -2.00 0.18 119.26 122.89 3mka h ALA 377 Ca 0.05 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.70 3mka h ALA 377 Cb 0.53 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 3mka h ALA 377 CO -0.21 -0.98 -1.01 0.78 0.00 0.00 0.00 179.25 177.83 3mka h GLY 378 N 0.04 0.35 1.28 0.00 0.00 -1.40 -2.00 103.07 101.34 3mka h GLY 378 Ca 0.41 -0.70 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 3mka h GLY 378 CO -0.02 0.61 0.08 0.50 0.00 0.00 0.00 176.54 177.71 3mka h LYS 379 N 0.15 0.89 -0.00 4.80 1.57 0.11 -1.64 116.57 122.45 3mka h LYS 379 Ca -0.09 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 58.48 3mka h LYS 379 Cb 1.67 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 33.87 3mka h LYS 379 CO 0.17 0.84 0.00 0.82 -0.57 0.00 0.00 179.45 180.71 3mka h ILE 380 N 0.85 1.23 -0.40 1.86 2.04 -1.22 -2.36 117.51 119.51 3mka h ILE 380 Ca 0.17 -0.67 0.02 0.00 1.00 0.00 0.00 64.86 65.38 3mka h ILE 380 Cb 0.38 1.68 -0.02 0.00 -0.74 0.00 0.00 36.82 38.12 3mka h ILE 380 CO 0.01 0.18 0.27 -1.13 0.00 0.00 0.00 178.15 177.47 3mka h ASN 381 N -0.28 0.40 -0.29 1.72 -0.73 -1.21 -0.99 115.58 114.20 3mka h ASN 381 Ca 0.00 -0.01 -0.14 0.00 1.87 0.00 0.00 56.30 58.03 3mka h ASN 381 Cb 0.29 -0.10 -0.00 0.00 0.27 0.00 0.00 38.32 38.78 3mka h ASN 381 CO 0.00 0.28 -0.35 -0.09 -0.37 0.00 0.00 177.43 176.91 3mka h ARG 382 N 0.47 0.75 -0.73 6.67 9.65 -1.18 -2.48 114.38 127.54 3mka h ARG 382 Ca 0.16 -0.42 -0.07 0.00 -1.10 0.00 0.00 59.98 58.55 3mka h ARG 382 Cb 0.05 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.63 3mka h ARG 382 CO -0.04 1.04 0.20 1.25 2.80 0.00 0.00 179.97 185.22 3mka h LEU 383 N 0.51 1.09 -1.15 3.80 5.85 -0.80 -2.61 115.31 122.00 3mka h LEU 383 Ca 0.04 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.57 3mka h LEU 383 Cb 0.93 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.62 3mka h LEU 383 CO 0.08 1.03 0.58 0.00 -0.34 0.00 0.00 178.44 179.80 3mka h ALA 384 N 1.10 1.45 -0.46 1.25 0.00 -1.15 -0.54 119.26 120.90 3mka h ALA 384 Ca 0.23 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 3mka h ALA 384 Cb 0.35 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3mka h ALA 384 CO -0.00 0.46 -0.17 0.82 0.00 0.00 0.00 179.25 180.36 3mka h ILE 385 N 1.10 1.27 -0.23 0.00 2.04 -1.09 -0.77 117.51 119.83 3mka h ILE 385 Ca 0.35 -1.31 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 3mka h ILE 385 Cb 0.03 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.26 3mka h ILE 385 CO -0.11 0.45 0.13 0.24 0.00 0.00 0.00 178.15 178.86 3mka h MET 386 N 0.76 0.32 0.63 2.37 2.86 -1.03 -1.33 114.93 119.51 3mka h MET 386 Ca 0.11 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.69 3mka h MET 386 Cb 0.73 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.33 3mka h MET 386 CO 0.06 0.28 -0.39 0.28 1.06 0.00 0.00 176.91 178.20 3mka h VAL 387 N 0.26 0.00 -1.04 -2.22 2.07 -1.06 -2.89 116.25 111.37 3mka h VAL 387 Ca 0.08 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.87 3mka h VAL 387 Cb 0.06 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.72 3mka h VAL 387 CO -0.01 0.00 0.64 -0.09 0.02 0.00 0.00 177.57 178.13 3mka h ARG 388 N -0.96 0.44 0.00 1.57 2.43 -1.12 0.48 114.38 117.22 3mka h ARG 388 Ca -0.09 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3mka h ARG 388 Cb 0.77 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.22 3mka h ARG 388 CO 0.09 0.29 0.00 0.41 -1.51 0.00 0.00 179.97 179.24 3mka n GLY 389 N -1.40 -0.73 0.04 2.80 0.00 -0.51 -2.18 105.19 103.22 3mka n GLY 389 Ca 0.27 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 46.29 3mka n GLY 389 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3mka n ASN 390 N -0.52 1.20 -0.21 1.61 5.15 0.17 -4.76 115.26 117.90 3mka n ASN 390 Ca 0.01 -1.15 0.02 0.00 -0.60 0.00 0.00 54.58 52.85 3mka n ASN 390 Cb 0.00 -0.00 0.12 0.00 -0.53 0.00 0.00 39.78 39.38 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 0.20 -0.09 0.18 1.20 5.85 -1.46 0.93 115.31 122.13 3mka h LEU 391 Ca 0.00 0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.86 3mka h LEU 391 Cb 0.10 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 3mka h LEU 391 CO 0.00 -0.04 -0.24 0.00 -0.34 0.00 0.00 178.44 177.81 3mka h ALA 392 N 1.54 -0.46 -0.61 1.25 0.00 -1.85 -1.70 119.26 117.43 3mka h ALA 392 Ca 0.34 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.24 3mka h ALA 392 Cb 0.55 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 3mka h ALA 392 CO -0.47 -0.80 0.40 0.00 0.00 0.00 0.00 179.25 178.39 3mka h ALA 393 N 0.22 1.75 -0.03 0.00 0.00 -1.65 -2.05 119.26 117.51 3mka h ALA 393 Ca 0.01 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3mka h ALA 393 Cb 0.48 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3mka h ALA 393 CO -0.09 0.17 -0.40 0.00 0.00 0.00 0.00 179.25 178.93 3mka h ALA 394 N 1.66 1.29 -0.09 0.00 0.00 -0.20 -2.00 119.26 119.92 3mka h ALA 394 Ca 0.25 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 3mka h ALA 394 Cb 0.19 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3mka h ALA 394 CO -0.07 0.52 -0.26 0.52 0.00 0.00 0.00 179.25 179.96 3mka h MET 395 N 0.05 0.15 -0.71 0.00 2.86 -0.58 -2.28 114.93 114.42 3mka h MET 395 Ca 0.00 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.58 3mka h MET 395 Cb 0.73 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 3mka h MET 395 CO 0.05 0.41 0.02 1.04 1.06 0.00 0.00 176.91 179.49 3mka n GLN 396 N -4.18 3.74 0.00 1.72 6.02 -0.95 -4.93 117.38 118.80 3mka n GLN 396 Ca -0.01 -2.27 0.00 0.00 -0.01 0.00 0.00 57.00 54.70 3mka n GLN 396 Cb 0.35 -2.05 0.00 0.00 1.02 0.00 0.00 30.24 29.56 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 0.40 1.44 2.46 1.08 0.00 -0.86 -4.95 105.19 104.75 3mka n GLY 397 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 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 7.04 -4.77 0.99 4.77 -0.79 -4.67 117.00 119.57 3mka n LEU 398 Ca 0.00 -4.33 -0.38 0.00 -0.03 0.00 0.00 56.01 51.26 3mka n LEU 398 Cb 0.00 -1.30 -0.05 0.00 -2.33 0.00 0.00 43.42 39.75 3mka n LEU 398 CO 0.00 1.86 0.73 -0.22 -1.33 0.00 0.00 177.39 178.43 3mka s LEU 399 N -2.00 4.39 -0.22 2.23 2.96 -1.26 -4.04 118.68 120.73 3mka s LEU 399 Ca 0.58 2.08 -0.04 0.00 -0.22 0.00 0.00 54.13 56.52 3mka s LEU 399 Cb 0.30 -3.88 0.08 0.00 0.50 0.00 0.00 46.19 43.19 3mka s LEU 399 CO -0.16 -0.22 0.12 0.00 -1.32 0.00 0.00 176.35 174.77 3mka s ALA 400 N -1.41 0.44 -0.43 5.97 0.00 -1.26 -0.73 121.76 124.34 3mka s ALA 400 Ca 0.50 -0.58 -0.08 0.00 0.00 0.00 0.00 51.96 51.80 3mka s ALA 400 Cb -0.26 -1.21 0.10 0.00 0.00 0.00 0.00 23.12 21.76 3mka s ALA 400 CO 0.32 -1.38 0.27 -1.17 0.00 0.00 0.00 175.76 173.81 3mka s LEU 401 N 2.14 5.32 0.37 0.00 2.96 0.11 -4.94 118.68 124.65 3mka s LEU 401 Ca 0.05 -1.74 -0.11 0.00 -0.22 0.00 0.00 54.13 52.11 3mka s LEU 401 Cb -0.16 -1.95 -0.07 0.00 0.50 0.00 0.00 46.19 44.51 3mka s LEU 401 CO -0.21 -0.58 0.74 -2.16 -1.32 0.00 0.00 176.35 172.81 3mka s PRO 402 N 1.34 3.80 -0.08 0.98 0.04 -1.26 -2.07 135.00 137.75 3mka s PRO 402 Ca 0.05 0.45 0.03 0.00 0.04 0.00 0.00 61.00 61.56 3mka s PRO 402 Cb -0.24 -2.43 0.01 0.00 0.04 0.00 0.00 34.50 31.88 3mka s PRO 402 CO -0.00 0.03 -0.17 -1.17 0.04 0.00 0.00 177.00 175.73 3mka s LEU 403 N -3.65 1.83 -0.09 -3.56 2.96 0.57 -3.23 118.68 113.51 3mka s LEU 403 Ca 0.51 -0.40 0.02 0.00 -0.22 0.00 0.00 54.13 54.04 3mka s LEU 403 Cb -0.10 -1.06 -0.02 0.00 0.50 0.00 0.00 46.19 45.51 3mka s LEU 403 CO 0.29 0.09 -0.16 -0.22 -1.32 0.00 0.00 176.35 175.02 3mka s LEU 404 N 0.50 2.56 -0.06 -0.68 2.96 0.47 -1.23 118.68 123.21 3mka s LEU 404 Ca -0.16 -0.34 0.04 0.00 -0.22 0.00 0.00 54.13 53.45 3mka s LEU 404 Cb -0.16 -1.54 0.00 0.00 0.50 0.00 0.00 46.19 44.99 3mka s LEU 404 CO 0.06 0.23 -0.17 0.00 -1.32 0.00 0.00 176.35 175.14 3mka s ALA 405 N -0.03 1.58 0.12 5.97 0.00 -0.53 -0.38 121.76 128.50 3mka s ALA 405 Ca -0.04 -0.67 -0.15 0.00 0.00 0.00 0.00 51.96 51.09 3mka s ALA 405 Cb -0.14 -0.57 0.03 0.00 0.00 0.00 0.00 23.12 22.43 3mka s ALA 405 CO 0.04 0.24 0.38 0.20 0.00 0.00 0.00 175.76 176.62 3mka s GLY 406 N 0.24 -0.20 -0.16 0.00 0.00 -0.34 -0.17 107.32 106.69 3mka s GLY 406 Ca -0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 44.72 44.46 3mka s GLY 406 CO 0.04 -0.39 -0.09 -0.47 0.00 0.00 0.00 173.10 172.20 3mka s TYR 407 N -3.82 2.90 -0.37 1.90 5.04 -0.11 0.11 117.35 123.00 3mka s TYR 407 Ca 0.04 -0.66 -0.15 0.00 -2.44 0.00 0.00 57.07 53.85 3mka s TYR 407 Cb 0.02 -1.94 -0.00 0.00 0.35 0.00 0.00 41.96 40.39 3mka s TYR 407 CO -0.11 -0.27 0.35 0.34 -1.34 0.00 0.00 175.55 174.52 3mka s ASP 408 N 0.68 6.15 0.23 4.32 2.15 -0.61 -4.85 116.67 124.74 3mka s ASP 408 Ca -0.05 -0.46 -0.06 0.00 0.43 0.00 0.00 52.55 52.42 3mka s ASP 408 Cb -0.15 -2.19 0.22 0.00 -0.30 0.00 0.00 42.92 40.51 3mka s ASP 408 CO 0.02 -0.40 1.77 0.16 -0.17 0.00 0.00 175.17 176.56 3mka h ILE 409 N 5.59 1.25 0.00 4.11 3.07 -1.97 -2.72 117.51 126.84 3mka h ILE 409 Ca -0.29 -0.89 0.00 0.00 1.55 0.00 0.00 64.86 65.23 3mka h ILE 409 Cb 1.13 0.52 0.00 0.00 -0.27 0.00 0.00 36.82 38.21 3mka h ILE 409 CO 0.71 0.34 0.00 1.41 -1.05 0.00 0.00 178.15 179.57 3mka n HIS 410 N -4.25 0.00 -1.85 0.16 8.25 -1.26 -4.83 115.22 111.43 3mka n HIS 410 Ca 0.05 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.12 3mka n HIS 410 Cb 0.23 -0.50 0.02 0.00 1.12 0.00 0.00 29.99 30.86 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 -3.00 3.09 0.23 -1.41 0.00 -1.03 -4.91 121.76 114.74 3mka s ALA 411 Ca 0.10 1.36 -0.07 0.00 0.00 0.00 0.00 51.96 53.35 3mka s ALA 411 Cb 0.13 -3.56 0.20 0.00 0.00 0.00 0.00 23.12 19.89 3mka s ALA 411 CO 0.36 -1.18 1.85 0.66 0.00 0.00 0.00 175.76 177.46 3mka h SER 412 N 2.08 1.12 -3.45 0.00 4.64 -1.90 -3.42 113.55 112.62 3mka h SER 412 Ca -0.51 -0.11 -0.67 0.00 -0.47 0.00 0.00 61.79 60.04 3mka h SER 412 Cb 1.27 -0.29 -0.29 0.00 -0.31 0.00 0.00 62.40 62.79 3mka h SER 412 CO 0.60 0.90 -0.82 -0.62 -0.87 0.00 0.00 176.83 176.03 3mka s ASP 413 N -6.23 3.61 0.26 4.97 -1.08 -1.26 -5.02 116.67 111.91 3mka s ASP 413 Ca -0.13 -0.41 -0.04 0.00 -0.52 0.00 0.00 52.55 51.45 3mka s ASP 413 Cb 0.17 -1.41 0.31 0.00 -1.46 0.00 0.00 42.92 40.53 3mka s ASP 413 CO 0.83 0.18 1.85 1.55 0.52 0.00 0.00 175.17 180.10 3mka h PRO 414 N 6.54 1.06 -0.81 4.34 0.13 -1.94 -2.14 132.00 139.18 3mka h PRO 414 Ca -0.25 -0.16 -0.02 0.00 -0.87 0.00 0.00 66.00 64.70 3mka h PRO 414 Cb 1.21 -0.19 -0.04 0.00 0.13 0.00 0.00 31.00 32.12 3mka h PRO 414 CO 0.51 0.84 0.43 1.96 -0.23 0.00 0.00 178.00 181.51 3mka h GLN 415 N 1.05 1.14 -0.42 0.86 1.08 -1.94 -1.49 115.11 115.39 3mka h GLN 415 Ca 0.25 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.31 3mka h GLN 415 Cb 0.14 -0.22 0.00 0.00 -0.05 0.00 0.00 27.48 27.35 3mka h GLN 415 CO -0.03 0.85 0.00 -1.13 -0.95 0.00 0.00 178.83 177.57 3mka n SER 416 N -4.33 2.47 -0.16 1.46 3.41 -1.08 -2.76 113.62 112.63 3mka n SER 416 Ca 0.08 -1.95 0.00 0.00 -0.26 0.00 0.00 58.87 56.74 3mka n SER 416 Cb 0.11 -0.28 0.27 0.00 -0.26 0.00 0.00 64.21 64.05 3mka n SER 416 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mka h ALA 417 N 3.95 1.45 -2.95 7.33 0.00 -0.60 -3.44 119.26 125.00 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 0.64 -0.26 0.11 0.00 0.00 0.00 0.00 17.79 18.28 3mka h ALA 417 CO 0.00 0.47 0.66 0.20 0.00 0.00 0.00 179.25 180.57 3mka s GLY 418 N -3.49 2.91 0.02 0.00 0.00 -1.26 -1.57 107.32 103.92 3mka s GLY 418 Ca -0.10 1.37 0.03 0.00 0.00 0.00 0.00 44.72 46.01 3mka s GLY 418 CO 0.78 1.95 -0.08 0.50 0.00 0.00 0.00 173.10 176.25 3mka s ARG 419 N -2.47 0.59 -0.05 2.90 1.81 0.30 -4.92 118.95 117.12 3mka s ARG 419 Ca 0.61 -0.47 0.01 0.00 -1.72 0.00 0.00 55.73 54.17 3mka s ARG 419 Cb -0.41 -0.52 0.02 0.00 -0.45 0.00 0.00 34.95 33.59 3mka s ARG 419 CO 0.52 0.13 -0.05 0.42 -0.68 0.00 0.00 175.30 175.64 3mka s ILE 420 N -0.62 0.59 -0.04 1.52 1.01 -1.26 -1.19 121.20 121.21 3mka s ILE 420 Ca -0.01 -0.14 0.01 0.00 0.00 0.00 0.00 60.65 60.51 3mka s ILE 420 Cb -0.06 -0.61 0.02 0.00 0.01 0.00 0.00 42.46 41.82 3mka s ILE 420 CO 0.00 0.24 -0.06 -0.69 0.00 0.00 0.00 174.94 174.43 3mka s VAL 421 N 0.95 0.60 0.17 2.92 1.01 0.49 -1.59 120.40 124.96 3mka s VAL 421 Ca -0.11 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 61.76 3mka s VAL 421 Cb -0.14 -0.60 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 3mka s VAL 421 CO 0.00 0.23 -0.02 -0.94 0.00 0.00 0.00 175.10 174.37 3mka s SER 422 N 0.68 4.69 -0.02 3.32 1.04 -0.49 -0.39 113.70 122.52 3mka s SER 422 Ca -0.10 -0.42 0.05 0.00 0.48 0.00 0.00 55.95 55.97 3mka s SER 422 Cb -0.13 -0.97 -0.01 0.00 0.10 0.00 0.00 66.02 65.01 3mka s SER 422 CO 0.01 0.09 -0.18 -0.36 0.98 0.00 0.00 173.24 173.78 3mka s PHE 423 N -1.71 1.69 0.58 5.02 0.08 -1.20 -1.24 117.98 121.21 3mka s PHE 423 Ca 0.27 -0.38 -0.02 0.00 0.12 0.00 0.00 56.93 56.92 3mka s PHE 423 Cb -0.09 -1.11 0.03 0.00 -0.57 0.00 0.00 43.02 41.28 3mka s PHE 423 CO 0.18 -0.08 0.84 0.16 -0.10 0.00 0.00 175.22 176.22 3mka s ASP 424 N -0.27 5.24 0.47 1.36 1.47 -0.15 -4.68 116.67 120.11 3mka s ASP 424 Ca 0.03 0.21 0.29 0.00 1.18 0.00 0.00 52.55 54.26 3mka s ASP 424 Cb -0.09 -1.08 1.56 0.00 -0.34 0.00 0.00 42.92 42.97 3mka s ASP 424 CO 0.00 -1.21 1.87 0.00 0.68 0.00 0.00 175.17 176.52 3mka h ALA 425 N -0.09 1.06 -0.26 2.11 0.00 -1.93 -1.41 119.26 118.73 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 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 3mka h ALA 425 CO 0.56 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.75 3mka n ALA 426 N -1.86 2.46 0.00 0.00 0.00 -1.26 -4.44 120.51 115.42 3mka n ALA 426 Ca -0.02 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.65 3mka n ALA 426 Cb 0.11 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 1.35 1.12 3.66 0.00 0.00 -0.53 -4.43 105.19 106.36 3mka n GLY 427 Ca 0.18 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.75 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 0.76 3.41 -0.02 0.00 -1.26 -4.72 105.19 101.36 3mka n GLY 428 Ca 0.00 0.51 -0.28 0.00 0.00 0.00 0.00 46.02 46.26 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 0.01 2.29 -0.02 1.61 1.48 -1.26 -0.97 118.94 122.07 3mka s TRP 429 Ca 0.69 -0.37 -0.01 0.00 -1.06 0.00 0.00 56.10 55.35 3mka s TRP 429 Cb -0.66 -1.18 0.02 0.00 -1.16 0.00 0.00 33.47 30.49 3mka s TRP 429 CO 0.49 0.44 0.05 1.21 -4.06 0.00 0.00 176.95 175.08 3mka s ASN 430 N -2.44 -0.01 -0.28 -2.66 2.47 -0.37 -4.97 114.94 106.67 3mka s ASN 430 Ca 0.18 0.10 -0.16 0.00 0.42 0.00 0.00 52.86 53.40 3mka s ASN 430 Cb -0.09 0.04 -0.03 0.00 -1.45 0.00 0.00 41.25 39.72 3mka s ASN 430 CO 0.08 -0.08 0.43 -0.63 -3.72 0.00 0.00 177.10 173.18 3mka s ILE 431 N 0.58 5.13 -0.12 -5.21 1.01 -1.26 -1.40 121.20 119.93 3mka s ILE 431 Ca -0.05 0.58 -0.30 0.00 0.00 0.00 0.00 60.65 60.88 3mka s ILE 431 Cb -0.07 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.61 3mka s ILE 431 CO -0.02 0.07 1.22 -1.61 0.00 0.00 0.00 174.94 174.60 3mka s GLU 432 N 2.17 4.29 0.00 2.79 0.41 -0.62 -4.89 118.70 122.85 3mka s GLU 432 Ca 0.17 1.65 0.25 0.00 -0.41 0.00 0.00 54.97 56.63 3mka s GLU 432 Cb -0.16 -3.66 0.78 0.00 -1.78 0.00 0.00 34.13 29.31 3mka s GLU 432 CO 0.10 -0.58 1.59 0.39 -0.49 0.00 0.00 175.26 176.27 3mka n GLU 433 N 5.94 1.86 0.10 1.61 -0.58 -1.26 -4.23 120.64 124.08 3mka n GLU 433 Ca 0.12 -1.27 -0.24 0.00 -0.42 0.00 0.00 57.16 55.36 3mka n GLU 433 Cb 0.46 -1.46 -0.15 0.00 -0.57 0.00 0.00 31.44 29.71 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 2.92 0.45 0.00 3.49 4.39 -2.00 -3.48 114.58 120.35 3mka h GLU 434 Ca 0.00 -0.76 0.00 0.00 0.34 0.00 0.00 59.36 58.94 3mka h GLU 434 Cb 0.63 0.28 0.00 0.00 -0.10 0.00 0.00 28.75 29.56 3mka h GLU 434 CO 0.00 1.37 0.00 0.41 -1.16 0.00 0.00 179.01 179.63 3mka n GLY 435 N 1.77 1.71 3.64 -3.84 0.00 -1.26 -5.07 105.19 102.14 3mka n GLY 435 Ca -0.20 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.43 -0.07 0.05 1.61 -0.85 -1.26 -0.82 117.35 114.58 3mka s TYR 436 Ca 0.00 -0.30 -0.27 0.00 -0.52 0.00 0.00 57.07 55.97 3mka s TYR 436 Cb 0.00 0.46 0.09 0.00 0.38 0.00 0.00 41.96 42.89 3mka s TYR 436 CO 0.00 -1.03 0.94 -1.14 -1.52 0.00 0.00 175.55 172.79 3mka s GLN 437 N -3.91 0.94 0.13 -3.49 2.00 -0.34 -4.99 119.66 109.99 3mka s GLN 437 Ca 0.12 -0.43 -0.17 0.00 -2.00 0.00 0.00 55.36 52.88 3mka s GLN 437 Cb -0.03 0.38 0.04 0.00 0.80 0.00 0.00 33.01 34.20 3mka s GLN 437 CO 0.02 -0.42 0.42 0.00 -0.50 0.00 0.00 175.29 174.80 3mka s ALA 438 N -3.15 -0.98 0.05 1.58 0.00 -1.26 -1.29 121.76 116.72 3mka s ALA 438 Ca 0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 51.96 51.96 3mka s ALA 438 Cb -0.01 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.81 3mka s ALA 438 CO -0.04 -0.65 0.13 0.14 0.00 0.00 0.00 175.76 175.34 3mka s VAL 439 N -3.80 0.14 0.00 0.00 -7.23 0.05 -4.93 120.40 104.63 3mka s VAL 439 Ca 0.03 -1.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.05 3mka s VAL 439 Cb 0.02 -1.09 0.00 0.00 0.56 0.00 0.00 36.38 35.86 3mka s VAL 439 CO -0.12 -0.63 0.00 0.61 -0.31 0.00 0.00 175.10 174.65 3mka n GLY 440 N 0.44 1.13 0.26 2.32 0.00 -1.26 -1.04 105.19 107.04 3mka n GLY 440 Ca -0.17 -2.23 0.06 0.00 0.00 0.00 0.00 46.02 43.68 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 0.13 -0.66 1.61 4.64 -1.57 -2.08 113.55 115.61 3mka h SER 441 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3mka h SER 441 Cb 0.00 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 3mka h SER 441 CO 0.00 0.15 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 3mka n GLY 442 N -1.34 2.74 0.28 -0.77 0.00 -1.26 -4.63 105.19 100.21 3mka n GLY 442 Ca -0.01 -0.86 0.11 0.00 0.00 0.00 0.00 46.02 45.26 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 4.15 0.00 -0.23 1.61 4.64 -1.61 -1.74 113.55 120.38 3mka h SER 443 Ca 0.00 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.14 3mka h SER 443 Cb 1.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 3mka h SER 443 CO 0.22 0.01 -0.56 -0.07 -0.87 0.00 0.00 176.83 175.57 3mka h LEU 444 N 0.00 0.88 -0.39 5.97 4.07 -1.82 -0.55 115.31 123.47 3mka h LEU 444 Ca -0.00 -0.57 -0.03 0.00 0.08 0.00 0.00 57.88 57.36 3mka h LEU 444 Cb 0.02 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.49 3mka h LEU 444 CO 0.00 1.29 0.11 -0.26 -1.08 0.00 0.00 178.44 178.50 3mka h PHE 445 N 0.51 0.64 -0.37 1.13 0.04 -1.77 -0.91 116.94 116.21 3mka h PHE 445 Ca -0.01 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.66 3mka h PHE 445 Cb 1.17 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 39.12 3mka h PHE 445 CO 0.08 0.60 0.09 0.00 -0.60 0.00 0.00 178.31 178.49 3mka h ALA 446 N 0.96 0.48 -0.87 2.45 0.00 -1.28 -1.59 119.26 119.41 3mka h ALA 446 Ca 0.12 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3mka h ALA 446 Cb 0.27 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 3mka h ALA 446 CO -0.00 0.15 0.54 0.87 0.00 0.00 0.00 179.25 180.81 3mka h LYS 447 N 0.44 1.17 -0.11 0.00 1.57 -0.96 -1.52 116.57 117.16 3mka h LYS 447 Ca 0.12 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.71 3mka h LYS 447 Cb 0.30 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 3mka h LYS 447 CO 0.00 0.80 -0.36 0.77 -0.57 0.00 0.00 179.45 180.09 3mka h SER 448 N 1.19 0.24 0.16 0.86 0.02 -0.82 -0.79 113.55 114.41 3mka h SER 448 Ca 0.31 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 3mka h SER 448 Cb -0.08 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.39 3mka h SER 448 CO -0.06 0.59 -0.08 -1.28 -1.14 0.00 0.00 176.83 174.86 3mka h SER 449 N 0.20 -0.18 -0.09 3.07 0.87 -1.04 -3.00 113.55 113.38 3mka h SER 449 Ca 0.02 -0.24 -0.00 0.00 -1.23 0.00 0.00 61.79 60.34 3mka h SER 449 Cb 0.74 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.74 3mka h SER 449 CO 0.06 0.16 0.05 0.24 -0.53 0.00 0.00 176.83 176.81 3mka h MET 450 N -0.54 0.13 -0.25 2.24 2.07 -0.99 0.44 114.93 118.02 3mka h MET 450 Ca -0.02 -0.01 0.06 0.00 -2.07 0.00 0.00 59.70 57.66 3mka h MET 450 Cb 0.42 -0.03 -0.01 0.00 -1.87 0.00 0.00 31.60 30.11 3mka h MET 450 CO 0.04 0.10 0.18 -0.22 1.07 0.00 0.00 176.91 178.07 3mka h LYS 451 N 0.13 0.06 0.07 1.72 3.64 -1.01 0.47 116.57 121.65 3mka h LYS 451 Ca 0.04 -0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 59.08 3mka h LYS 451 Cb 0.00 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 3mka h LYS 451 CO -0.01 0.04 -1.84 1.63 -2.27 0.00 0.00 179.45 177.01 3mka n LYS 452 N -4.47 0.68 0.06 1.90 4.76 0.05 -4.34 118.16 116.79 3mka n LYS 452 Ca 0.03 0.36 0.11 0.00 -2.87 0.00 0.00 58.31 55.94 3mka n LYS 452 Cb 0.29 -1.69 0.45 0.00 -1.84 0.00 0.00 35.03 32.24 3mka n LYS 452 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 3mka n LEU 453 N -3.83 0.39 -0.28 -0.35 4.77 -0.61 -4.38 117.00 112.72 3mka n LEU 453 Ca -0.35 0.57 -0.02 0.00 -0.03 0.00 0.00 56.01 56.18 3mka n LEU 453 Cb 0.91 -0.48 0.10 0.00 -2.33 0.00 0.00 43.42 41.62 3mka n LEU 453 CO 0.31 -0.28 1.17 0.22 -1.33 0.00 0.00 177.39 177.47 3mka h TYR 454 N 0.00 0.91 0.00 -1.77 3.20 -1.10 -2.09 116.97 116.12 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 0.44 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.42 3mka h TYR 454 CO 0.00 0.50 0.24 0.66 -1.64 0.00 0.00 178.16 177.91 3mka h SER 455 N 0.93 0.00 0.32 -2.11 4.64 -1.86 0.24 113.55 115.71 3mka h SER 455 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 3mka h SER 455 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3mka h SER 455 CO -0.13 0.00 -0.08 0.00 -0.87 0.00 0.00 176.83 175.75 3mka n GLN 456 N -2.76 0.75 -2.88 4.77 6.02 -0.78 -4.73 117.38 117.76 3mka n GLN 456 Ca -0.02 -0.23 -0.42 0.00 -0.01 0.00 0.00 57.00 56.31 3mka n GLN 456 Cb 0.28 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 30.00 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 -2.41 4.63 0.00 5.09 1.01 0.85 -4.75 120.40 124.82 3mka s VAL 457 Ca 0.31 0.96 0.00 0.00 0.00 0.00 0.00 61.98 63.25 3mka s VAL 457 Cb 0.20 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.29 3mka s VAL 457 CO 0.45 -0.55 0.11 0.35 0.00 0.00 0.00 175.10 175.47 3mka n THR 458 N 5.97 0.00 -3.89 3.92 -2.24 -1.26 -4.90 114.28 111.88 3mka n THR 458 Ca 0.05 -0.40 -0.03 0.00 -2.27 0.00 0.00 64.05 61.40 3mka n THR 458 Cb 0.48 1.06 0.02 0.00 -2.10 0.00 0.00 70.33 69.79 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 -0.57 0.01 0.58 3.42 1.47 -1.26 -4.64 116.67 115.67 3mka s ASP 459 Ca 0.00 -0.66 0.28 0.00 1.18 0.00 0.00 52.55 53.35 3mka s ASP 459 Cb 0.00 0.49 1.72 0.00 -0.34 0.00 0.00 42.92 44.79 3mka s ASP 459 CO 0.00 -0.96 2.20 1.23 0.68 0.00 0.00 175.17 178.31 3mka h GLY 460 N 2.00 0.00 1.09 2.12 0.00 -1.94 0.33 103.07 106.67 3mka h GLY 460 Ca -0.27 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 46.76 3mka h GLY 460 CO 0.36 0.00 -1.64 -0.55 0.00 0.00 0.00 176.54 174.71 3mka h ASP 461 N 0.00 0.17 0.04 0.19 3.32 -1.99 -2.34 116.42 115.81 3mka h ASP 461 Ca 0.03 -0.31 -0.26 0.00 0.02 0.00 0.00 57.03 56.51 3mka h ASP 461 Cb 0.17 -0.06 0.02 0.00 0.22 0.00 0.00 39.33 39.68 3mka h ASP 461 CO -0.00 1.27 -1.01 0.77 -1.72 0.00 0.00 179.24 178.55 3mka h SER 462 N 0.03 0.87 -0.35 6.45 4.64 -1.79 -2.35 113.55 121.05 3mka h SER 462 Ca -0.27 -0.68 -0.03 0.00 -0.47 0.00 0.00 61.79 60.34 3mka h SER 462 Cb 1.99 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 63.80 3mka h SER 462 CO 0.11 1.48 0.12 1.23 -0.87 0.00 0.00 176.83 178.90 3mka h GLY 463 N 0.54 0.66 2.00 -0.77 0.00 -0.44 -0.45 103.07 104.60 3mka h GLY 463 Ca -0.12 -0.34 -0.12 0.00 0.00 0.00 0.00 47.33 46.76 3mka h GLY 463 CO 0.20 0.32 -0.55 -2.00 0.00 0.00 0.00 176.54 174.51 3mka h LEU 464 N 0.60 0.00 0.42 3.11 5.85 -1.32 -2.65 115.31 121.33 3mka h LEU 464 Ca 0.14 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 3mka h LEU 464 Cb 0.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 3mka h LEU 464 CO -0.01 0.55 -0.20 -0.09 -0.34 0.00 0.00 178.44 178.35 3mka h ARG 465 N 0.00 -0.54 -0.93 1.25 2.43 -0.64 -2.09 114.38 113.86 3mka h ARG 465 Ca -0.01 0.04 0.22 0.00 -0.81 0.00 0.00 59.98 59.42 3mka h ARG 465 Cb 1.02 0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 30.63 3mka h ARG 465 CO 0.07 -0.23 0.62 0.28 -1.51 0.00 0.00 179.97 179.20 3mka h VAL 466 N -0.91 0.63 -0.24 0.20 2.07 -1.11 -0.52 116.25 116.37 3mka h VAL 466 Ca -0.06 -0.12 -0.09 0.00 0.82 0.00 0.00 66.70 67.25 3mka h VAL 466 Cb 0.56 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 3mka h VAL 466 CO 0.09 0.06 -0.21 0.00 0.02 0.00 0.00 177.57 177.54 3mka h ALA 467 N 1.60 0.34 0.00 1.67 0.00 -1.29 -0.53 119.26 121.06 3mka h ALA 467 Ca 0.49 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 3mka h ALA 467 Cb 1.31 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 3mka h ALA 467 CO -0.17 0.29 -0.19 0.28 0.00 0.00 0.00 179.25 179.46 3mka h VAL 468 N 0.26 0.62 0.16 0.00 2.07 -0.43 -2.30 116.25 116.64 3mka h VAL 468 Ca 0.04 -0.86 -0.24 0.00 0.82 0.00 0.00 66.70 66.47 3mka h VAL 468 Cb 0.76 1.55 0.03 0.00 -1.52 0.00 0.00 31.29 32.11 3mka h VAL 468 CO 0.05 0.19 -1.02 -0.08 0.02 0.00 0.00 177.57 176.73 3mka h GLU 469 N 0.00 0.41 -0.37 1.57 4.81 -0.94 -2.37 114.58 117.69 3mka h GLU 469 Ca -0.00 -0.65 0.01 0.00 -0.13 0.00 0.00 59.36 58.58 3mka h GLU 469 Cb 0.54 0.24 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 3mka h GLU 469 CO 0.02 1.30 0.24 0.00 -0.73 0.00 0.00 179.01 179.85 3mka h ALA 470 N 0.14 1.76 0.00 2.92 0.00 -0.88 0.15 119.26 123.35 3mka h ALA 470 Ca -0.17 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3mka h ALA 470 Cb 1.79 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 19.44 3mka h ALA 470 CO 0.19 0.21 -0.16 1.25 0.00 0.00 0.00 179.25 180.75 3mka h LEU 471 N 0.48 0.00 -0.01 0.00 5.85 -1.38 -2.05 115.31 118.20 3mka h LEU 471 Ca 0.14 0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.78 3mka h LEU 471 Cb -0.02 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.01 3mka h LEU 471 CO -0.03 0.16 -0.32 0.22 -0.34 0.00 0.00 178.44 178.13 3mka h TYR 472 N 0.00 0.34 -0.60 1.25 3.20 -0.25 -2.69 116.97 118.22 3mka h TYR 472 Ca -0.00 -0.18 0.00 0.00 3.14 0.00 0.00 58.73 61.70 3mka h TYR 472 Cb 0.86 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.06 3mka h TYR 472 CO 0.00 0.97 0.39 -0.44 -1.64 0.00 0.00 178.16 177.44 3mka h ASP 473 N -0.40 0.70 -0.08 -2.11 3.32 -0.88 -1.74 116.42 115.23 3mka h ASP 473 Ca -0.04 -0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.83 3mka h ASP 473 Cb 1.05 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.42 3mka h ASP 473 CO 0.06 0.52 -0.50 0.00 -1.72 0.00 0.00 179.24 177.60 3mka h ALA 474 N 1.61 0.69 0.00 3.45 0.00 -1.38 -2.59 119.26 121.04 3mka h ALA 474 Ca 0.22 -0.49 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3mka h ALA 474 Cb -0.08 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3mka h ALA 474 CO -0.05 0.68 -0.09 0.00 0.00 0.00 0.00 179.25 179.79 3mka h ALA 475 N 0.94 1.01 -0.30 0.00 0.00 -1.02 -2.04 119.26 117.85 3mka h ALA 475 Ca 0.02 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 3mka h ALA 475 Cb 1.05 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 3mka h ALA 475 CO 0.10 0.12 -0.48 0.22 0.00 0.00 0.00 179.25 179.21 3mka h ASP 476 N 0.00 0.87 -0.01 0.00 3.58 -0.95 -3.32 116.42 116.60 3mka h ASP 476 Ca -0.00 -0.44 0.00 0.00 0.42 0.00 0.00 57.03 57.01 3mka h ASP 476 Cb 0.63 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.43 3mka h ASP 476 CO 0.01 1.20 -0.25 0.47 -2.88 0.00 0.00 179.24 177.80 3mka n ASP 477 N -4.02 1.88 -3.84 2.28 8.00 -1.13 -4.92 116.55 114.81 3mka n ASP 477 Ca -0.03 -1.44 -0.26 0.00 0.71 0.00 0.00 54.79 53.77 3mka n ASP 477 Cb 0.58 0.34 -0.17 0.00 -0.02 0.00 0.00 41.12 41.85 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 -1.80 2.13 0.28 -2.24 2.15 -0.78 -5.00 116.67 111.41 3mka s ASP 478 Ca 0.16 -0.33 0.24 0.00 0.43 0.00 0.00 52.55 53.05 3mka s ASP 478 Cb 0.14 -0.68 1.00 0.00 -0.30 0.00 0.00 42.92 43.08 3mka s ASP 478 CO 0.36 -0.18 1.73 0.77 -0.17 0.00 0.00 175.17 177.69 3mka h SER 479 N 8.23 0.00 1.57 -0.34 4.64 -1.87 -2.68 113.55 123.10 3mka h SER 479 Ca -0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 3mka h SER 479 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3mka h SER 479 CO 0.34 0.00 -0.22 0.00 -0.87 0.00 0.00 176.83 176.09 3mka h ALA 480 N 2.26 0.88 -3.11 5.18 0.00 -1.93 -3.43 119.26 119.10 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 0.39 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.04 3mka h ALA 480 CO 0.00 0.00 -0.49 0.99 0.00 0.00 0.00 179.25 179.75 3mka s THR 481 N -3.19 5.36 0.02 0.00 2.01 -1.01 -4.56 115.64 114.26 3mka s THR 481 Ca 0.07 0.20 -0.17 0.00 0.31 0.00 0.00 61.69 62.10 3mka s THR 481 Cb 0.09 -3.50 -0.06 0.00 0.01 0.00 0.00 72.50 69.03 3mka s THR 481 CO 0.67 0.36 0.48 -0.83 -0.69 0.00 0.00 174.62 174.61 3mka s GLY 482 N 0.92 2.56 0.37 4.40 0.00 -1.26 -4.44 107.32 109.85 3mka s GLY 482 Ca 0.08 -0.11 0.03 0.00 0.00 0.00 0.00 44.72 44.73 3mka s GLY 482 CO 0.03 0.33 0.51 0.61 0.00 0.00 0.00 173.10 174.58 3mka n GLY 483 N 1.89 1.46 3.75 0.20 0.00 -1.26 -4.44 105.19 106.79 3mka n GLY 483 Ca -0.12 -2.11 -0.41 0.00 0.00 0.00 0.00 46.02 43.37 3mka n GLY 483 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3mka s PRO 484 N -3.69 4.18 -0.37 1.61 0.04 -1.26 -4.94 135.00 130.57 3mka s PRO 484 Ca 0.36 2.47 -0.08 0.00 0.04 0.00 0.00 61.00 63.78 3mka s PRO 484 Cb -0.03 -3.06 0.05 0.00 0.04 0.00 0.00 34.50 31.51 3mka s PRO 484 CO 0.23 -0.54 0.18 0.34 0.04 0.00 0.00 177.00 177.26 3mka s ASP 485 N 0.41 5.53 0.18 6.66 -1.08 -0.30 -4.97 116.67 123.10 3mka s ASP 485 Ca 0.61 -1.23 -0.09 0.00 -0.52 0.00 0.00 52.55 51.32 3mka s ASP 485 Cb -0.45 -1.95 0.07 0.00 -1.46 0.00 0.00 42.92 39.13 3mka s ASP 485 CO 0.47 -0.41 1.65 -0.07 0.52 0.00 0.00 175.17 177.32 3mka h LEU 486 N 8.33 1.07 -0.62 -1.34 4.07 -1.93 -0.54 115.31 124.35 3mka h LEU 486 Ca -0.23 -0.30 -0.04 0.00 0.08 0.00 0.00 57.88 57.39 3mka h LEU 486 Cb 1.09 -0.29 -0.03 0.00 1.08 0.00 0.00 40.66 42.51 3mka h LEU 486 CO 0.67 1.10 0.24 0.58 -1.08 0.00 0.00 178.44 179.95 3mka h VAL 487 N 1.00 1.24 -0.02 1.22 2.07 -1.97 -3.03 116.25 116.75 3mka h VAL 487 Ca 0.18 -0.75 0.00 0.00 0.82 0.00 0.00 66.70 66.95 3mka h VAL 487 Cb 0.54 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 3mka h VAL 487 CO 0.03 0.29 -0.22 0.54 0.02 0.00 0.00 177.57 178.24 3mka n ARG 488 N -4.43 1.59 -3.67 1.57 1.74 -1.23 -4.98 116.66 107.26 3mka n ARG 488 Ca 0.04 -1.23 -0.25 0.00 -0.77 0.00 0.00 57.85 55.64 3mka n ARG 488 Cb 0.18 -1.47 0.07 0.00 -1.02 0.00 0.00 32.46 30.21 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 1.35 -0.52 3.52 -0.13 0.00 -0.27 -4.99 105.19 104.15 3mka n GLY 489 Ca 0.13 0.23 -0.35 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.32 4.26 0.13 -0.61 -1.09 -0.84 -4.99 121.20 114.73 3mka s ILE 490 Ca 0.57 -0.22 0.02 0.00 -2.23 0.00 0.00 60.65 58.80 3mka s ILE 490 Cb -0.26 -2.92 -0.04 0.00 -1.58 0.00 0.00 42.46 37.66 3mka s ILE 490 CO 0.75 0.44 -0.05 -0.36 -1.23 0.00 0.00 174.94 174.49 3mka s PHE 491 N 0.70 1.08 0.94 3.97 0.08 -1.26 -1.15 117.98 122.34 3mka s PHE 491 Ca 0.01 -0.91 -0.12 0.00 0.12 0.00 0.00 56.93 56.03 3mka s PHE 491 Cb -0.14 -0.60 0.05 0.00 -0.57 0.00 0.00 43.02 41.76 3mka s PHE 491 CO 0.02 -0.11 0.52 -2.30 -0.10 0.00 0.00 175.22 173.25 3mka n PRO 492 N -0.14 -0.29 -4.29 0.24 -0.02 -1.26 -4.85 135.00 124.40 3mka n PRO 492 Ca -0.10 -0.04 -0.32 0.00 -2.02 0.00 0.00 63.50 61.03 3mka n PRO 492 Cb 0.61 -1.93 -0.09 0.00 -0.02 0.00 0.00 33.50 32.07 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 -2.41 3.94 0.10 3.45 -4.23 -0.81 -4.94 115.64 110.74 3mka s THR 493 Ca 0.59 -0.78 -0.00 0.00 -1.18 0.00 0.00 61.69 60.31 3mka s THR 493 Cb -0.22 -2.78 -0.04 0.00 1.34 0.00 0.00 72.50 70.80 3mka s THR 493 CO 0.66 0.30 -0.01 0.00 -0.54 0.00 0.00 174.62 175.03 3mka s ALA 494 N -1.13 0.82 -0.03 3.99 0.00 -1.26 -1.71 121.76 122.44 3mka s ALA 494 Ca 0.21 -1.36 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 3mka s ALA 494 Cb -0.11 0.44 0.02 0.00 0.00 0.00 0.00 23.12 23.47 3mka s ALA 494 CO 0.12 -0.37 0.07 0.08 0.00 0.00 0.00 175.76 175.66 3mka s VAL 495 N -3.86 -0.03 0.07 0.00 1.01 0.23 -1.38 120.40 116.44 3mka s VAL 495 Ca 0.15 0.12 0.09 0.00 0.00 0.00 0.00 61.98 62.34 3mka s VAL 495 Cb 0.07 -0.12 -0.03 0.00 0.00 0.00 0.00 36.38 36.30 3mka s VAL 495 CO -0.04 0.05 -0.24 -0.51 0.00 0.00 0.00 175.10 174.35 3mka s ILE 496 N 0.66 1.99 -0.05 2.22 2.07 -0.18 -1.09 121.20 126.83 3mka s ILE 496 Ca -0.05 -1.44 -0.02 0.00 -1.41 0.00 0.00 60.65 57.73 3mka s ILE 496 Cb -0.07 -1.74 0.03 0.00 0.13 0.00 0.00 42.46 40.81 3mka s ILE 496 CO -0.02 0.22 0.05 -0.63 -1.91 0.00 0.00 174.94 172.65 3mka s ILE 497 N -0.90 -0.04 0.00 2.00 1.01 -0.51 -0.43 121.20 122.34 3mka s ILE 497 Ca 0.11 0.37 0.00 0.00 0.00 0.00 0.00 60.65 61.12 3mka s ILE 497 Cb -0.10 -0.22 0.00 0.00 0.01 0.00 0.00 42.46 42.15 3mka s ILE 497 CO 0.03 0.18 0.00 -0.90 0.00 0.00 0.00 174.94 174.25 3mka n ASP 498 N 5.28 0.97 -0.24 3.58 5.68 -1.13 -1.73 116.55 128.96 3mka n ASP 498 Ca -0.04 -0.98 0.32 0.00 -0.50 0.00 0.00 54.79 53.59 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 2.95 -0.14 2.12 0.00 -1.94 0.12 119.26 123.37 3mka h ALA 499 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3mka h ALA 499 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3mka h ALA 499 CO 0.00 -1.28 0.00 -0.25 0.00 0.00 0.00 179.25 177.72 3mka n ASP 500 N -4.16 1.02 0.00 0.00 8.00 -1.26 -5.03 116.55 115.13 3mka n ASP 500 Ca 0.22 -2.04 0.00 0.00 0.71 0.00 0.00 54.79 53.68 3mka n ASP 500 Cb 1.11 -0.18 0.00 0.00 -0.02 0.00 0.00 41.12 42.02 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 0.62 -4.08 3.73 0.44 0.00 0.41 -4.99 105.19 101.32 3mka n GLY 501 Ca 0.05 -2.06 -0.38 0.00 0.00 0.00 0.00 46.02 43.64 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 -1.04 3.51 0.01 4.61 0.00 0.20 -2.85 121.76 126.19 3mka s ALA 502 Ca 0.00 -0.21 0.01 0.00 0.00 0.00 0.00 51.96 51.77 3mka s ALA 502 Cb 0.00 -2.60 -0.01 0.00 0.00 0.00 0.00 23.12 20.51 3mka s ALA 502 CO 0.00 0.06 -0.04 0.14 0.00 0.00 0.00 175.76 175.92 3mka s VAL 503 N 0.41 0.28 0.09 0.00 -7.23 0.42 -4.98 120.40 109.39 3mka s VAL 503 Ca 0.25 -0.32 -0.31 0.00 -1.81 0.00 0.00 61.98 59.79 3mka s VAL 503 Cb -0.15 -0.27 -0.07 0.00 0.56 0.00 0.00 36.38 36.44 3mka s VAL 503 CO 0.10 -0.03 1.35 -1.81 -0.31 0.00 0.00 175.10 174.40 3mka s ASP 504 N -0.38 6.88 0.30 4.85 1.01 -1.26 -1.01 116.67 127.06 3mka s ASP 504 Ca -0.02 2.24 -0.28 0.00 0.71 0.00 0.00 52.55 55.20 3mka s ASP 504 Cb -0.03 -2.58 -0.09 0.00 1.01 0.00 0.00 42.92 41.22 3mka s ASP 504 CO -0.00 -0.62 1.07 -0.69 0.21 0.00 0.00 175.17 175.14 3mka s VAL 505 N 1.24 3.59 0.10 -1.27 1.01 -0.48 -4.93 120.40 119.67 3mka s VAL 505 Ca 0.63 1.53 -0.31 0.00 0.00 0.00 0.00 61.98 63.84 3mka s VAL 505 Cb -0.35 -3.94 -0.07 0.00 0.00 0.00 0.00 36.38 32.03 3mka s VAL 505 CO 0.30 0.31 1.23 -2.16 0.00 0.00 0.00 175.10 174.77 3mka s PRO 506 N -1.62 4.43 0.16 2.72 0.04 -1.26 -4.72 135.00 134.76 3mka s PRO 506 Ca 0.47 1.84 -0.14 0.00 0.04 0.00 0.00 61.00 63.21 3mka s PRO 506 Cb -0.29 -3.30 0.15 0.00 0.04 0.00 0.00 34.50 31.09 3mka s PRO 506 CO 0.37 -0.23 1.12 -1.91 0.04 0.00 0.00 177.00 176.39 3mka n GLU 507 N 3.54 -0.19 -0.19 4.56 2.13 -1.26 0.18 120.64 129.42 3mka n GLU 507 Ca 0.08 1.11 0.23 0.00 0.66 0.00 0.00 57.16 59.24 3mka n GLU 507 Cb 0.45 -1.65 0.62 0.00 0.27 0.00 0.00 31.44 31.14 3mka n GLU 507 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 3mka h SER 508 N 0.00 0.20 0.35 4.31 4.64 -1.99 0.16 113.55 121.22 3mka h SER 508 Ca 0.24 0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.46 3mka h SER 508 Cb 0.42 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 3mka h SER 508 CO -0.71 0.08 -0.47 -0.09 -0.87 0.00 0.00 176.83 174.76 3mka h ARG 509 N 0.19 0.15 0.03 4.77 9.65 0.15 -2.46 114.38 126.86 3mka h ARG 509 Ca 0.42 -0.08 -0.05 0.00 -1.10 0.00 0.00 59.98 59.17 3mka h ARG 509 Cb 1.36 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.94 3mka h ARG 509 CO -0.09 0.59 -0.26 0.82 2.80 0.00 0.00 179.97 183.84 3mka h ILE 510 N 0.12 1.67 -0.86 1.20 2.04 -0.67 -3.08 117.51 117.92 3mka h ILE 510 Ca 0.01 -2.37 0.21 0.00 1.00 0.00 0.00 64.86 63.70 3mka h ILE 510 Cb 0.88 3.26 -0.12 0.00 -0.74 0.00 0.00 36.82 40.10 3mka h ILE 510 CO 0.07 0.61 0.34 0.00 0.00 0.00 0.00 178.15 179.16 3mka h ALA 511 N -0.03 1.32 0.00 1.87 0.00 -0.79 0.91 119.26 122.55 3mka h ALA 511 Ca -0.06 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3mka h ALA 511 Cb 1.15 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3mka h ALA 511 CO 0.01 -0.35 0.00 -1.91 0.00 0.00 0.00 179.25 177.00 3mka n GLU 512 N -5.08 0.24 0.05 0.00 2.13 -0.93 -1.83 120.64 115.21 3mka n GLU 512 Ca 0.20 0.20 -0.07 0.00 0.66 0.00 0.00 57.16 58.16 3mka n GLU 512 Cb 0.61 -1.78 -0.12 0.00 0.27 0.00 0.00 31.44 30.42 3mka n GLU 512 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3mka h LEU 513 N 0.00 0.00 0.43 4.31 5.85 0.71 -3.03 115.31 123.59 3mka h LEU 513 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 3mka h LEU 513 Cb 0.70 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.74 3mka h LEU 513 CO 0.00 0.99 -0.21 0.00 -0.34 0.00 0.00 178.44 178.88 3mka h ALA 514 N 1.01 -0.86 -0.78 1.25 0.00 0.09 -2.53 119.26 117.44 3mka h ALA 514 Ca -0.04 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 54.93 3mka h ALA 514 Cb 1.79 0.22 -0.13 0.00 0.00 0.00 0.00 17.79 19.68 3mka h ALA 514 CO 0.12 -0.81 0.13 0.00 0.00 0.00 0.00 179.25 178.69 3mka h ARG 515 N -0.76 0.18 -0.68 0.00 3.08 -1.50 0.62 114.38 115.32 3mka h ARG 515 Ca -0.06 -0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.12 3mka h ARG 515 Cb 0.45 -0.04 -0.10 0.00 0.08 0.00 0.00 29.97 30.35 3mka h ARG 515 CO 0.10 0.12 0.11 0.00 -1.07 0.00 0.00 179.97 179.23 3mka h ALA 516 N 1.70 0.80 -0.22 0.04 0.00 -1.47 0.24 119.26 120.34 3mka h ALA 516 Ca 0.45 0.17 -0.08 0.00 0.00 0.00 0.00 54.91 55.46 3mka h ALA 516 Cb 0.83 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 3mka h ALA 516 CO -0.61 -0.35 -0.16 0.82 0.00 0.00 0.00 179.25 178.95 3mka h ILE 517 N 0.22 1.31 0.46 0.00 2.04 0.55 -1.75 117.51 120.34 3mka h ILE 517 Ca 0.37 -1.27 -0.02 0.00 1.00 0.00 0.00 64.86 64.94 3mka h ILE 517 Cb 0.61 1.66 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 3mka h ILE 517 CO -0.50 0.39 -0.41 0.40 0.00 0.00 0.00 178.15 178.03 3mka h ILE 518 N 0.20 0.00 -0.98 -0.67 2.04 0.13 -0.38 117.51 117.84 3mka h ILE 518 Ca 0.04 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.11 3mka h ILE 518 Cb 0.68 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.65 3mka h ILE 518 CO 0.04 0.00 0.57 -0.08 0.00 0.00 0.00 178.15 178.68 3mka h GLU 519 N -0.86 0.63 0.00 2.37 4.57 -0.63 0.19 114.58 120.86 3mka h GLU 519 Ca -0.06 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 3mka h GLU 519 Cb 0.73 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 3mka h GLU 519 CO -0.02 0.42 0.00 1.03 -1.18 0.00 0.00 179.01 179.26 3mka h SER 520 N 0.65 0.00 0.81 1.04 0.87 -0.77 -2.82 113.55 113.33 3mka h SER 520 Ca 0.59 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.97 3mka h SER 520 Cb 1.00 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.93 3mka h SER 520 CO -0.43 0.00 -1.29 0.03 -0.53 0.00 0.00 176.83 174.61 3mka h ARG 521 N 0.00 0.00 0.00 2.24 2.47 0.11 -3.50 114.38 115.69 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 0.47 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.79 3mka h ARG 521 CO 0.00 0.41 0.00 0.43 0.56 0.00 0.00 179.97 181.37