#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 3.51 0.06 0.00 1.01 -1.26 -5.03 120.40 118.69 3mka s VAL -38 Ca 0.00 1.22 -0.12 0.00 0.00 0.00 0.00 61.98 63.08 3mka s VAL -38 Cb 0.00 -3.78 -0.06 0.00 0.00 0.00 0.00 36.38 32.54 3mka s VAL -38 CO 0.00 0.17 0.42 -0.62 0.00 0.00 0.00 175.10 175.06 3mka s ASP -37 N 0.42 6.71 0.00 3.32 -1.08 -1.26 -4.96 116.67 119.83 3mka s ASP -37 Ca 0.56 0.88 0.00 0.00 -0.52 0.00 0.00 52.55 53.46 3mka s ASP -37 Cb -0.34 -2.21 0.00 0.00 -1.46 0.00 0.00 42.92 38.91 3mka s ASP -37 CO 0.35 0.22 0.77 0.18 0.52 0.00 0.00 175.17 177.21 3mka n LEU -36 N 1.21 1.30 -3.96 -1.34 4.77 -1.26 -5.00 117.00 112.72 3mka n LEU -36 Ca -0.10 -1.30 -0.29 0.00 -0.03 0.00 0.00 56.01 54.29 3mka n LEU -36 Cb 0.52 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.62 3mka n LEU -36 CO 0.40 0.32 -0.01 -1.20 -1.33 0.00 0.00 177.39 175.58 3mka n SER -35 N -0.29 -3.04 -4.40 -1.43 7.64 -1.26 -4.93 113.62 105.91 3mka n SER -35 Ca 0.00 -0.88 -0.34 0.00 1.01 0.00 0.00 58.87 58.65 3mka n SER -35 Cb 0.28 -3.50 -0.13 0.00 -1.01 0.00 0.00 64.21 59.84 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 -3.67 4.53 0.30 6.43 0.15 -1.26 -4.25 113.70 115.93 3mka s SER -34 Ca 0.45 -0.27 -0.01 0.00 0.70 0.00 0.00 55.95 56.83 3mka s SER -34 Cb -0.23 -1.76 0.47 0.00 -1.71 0.00 0.00 66.02 62.79 3mka s SER -34 CO 0.86 0.07 1.92 0.15 1.20 0.00 0.00 173.24 177.43 3mka h PHE -33 N 7.46 0.89 -0.53 3.44 3.57 -1.92 -2.39 116.94 127.47 3mka h PHE -33 Ca -0.35 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.10 3mka h PHE -33 Cb 1.18 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 3mka h PHE -33 CO 0.57 0.64 0.26 1.15 -2.23 0.00 0.00 178.31 178.71 3mka h THR -32 N 0.91 1.19 -0.75 4.41 2.02 -1.95 -0.45 112.91 118.30 3mka h THR -32 Ca 0.23 -0.54 -0.05 0.00 0.77 0.00 0.00 66.41 66.82 3mka h THR -32 Cb 0.07 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 3mka h THR -32 CO -0.03 0.22 0.26 0.44 0.37 0.00 0.00 175.52 176.77 3mka h ASP -31 N 0.71 1.06 -0.63 4.18 3.45 -1.89 0.35 116.42 123.65 3mka h ASP -31 Ca 0.18 -0.18 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3mka h ASP -31 Cb 0.10 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.56 3mka h ASP -31 CO -0.02 0.97 0.40 0.15 -1.57 0.00 0.00 179.24 179.17 3mka h PHE -30 N 1.10 0.81 -0.65 4.55 3.57 -0.92 0.14 116.94 125.54 3mka h PHE -30 Ca 0.24 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.72 3mka h PHE -30 Cb 0.27 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 3mka h PHE -30 CO 0.02 0.53 0.27 -0.07 -2.23 0.00 0.00 178.31 176.83 3mka h LEU -29 N 0.86 0.89 -0.37 0.59 4.07 -0.27 0.25 115.31 121.33 3mka h LEU -29 Ca 0.23 -0.16 -0.01 0.00 0.08 0.00 0.00 57.88 58.01 3mka h LEU -29 Cb -0.06 -0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.43 3mka h LEU -29 CO -0.05 0.81 0.18 0.03 -1.08 0.00 0.00 178.44 178.34 3mka h ARG -28 N 0.91 0.53 -0.41 1.13 3.08 0.16 0.86 114.38 120.64 3mka h ARG -28 Ca 0.22 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 60.12 3mka h ARG -28 Cb 0.19 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 3mka h ARG -28 CO -0.02 0.47 -0.02 0.00 -1.07 0.00 0.00 179.97 179.33 3mka h ARG -27 N 0.46 0.74 0.00 0.04 -0.00 -0.78 -3.38 114.38 111.46 3mka h ARG -27 Ca 0.13 -0.24 0.00 0.00 -0.50 0.00 0.00 59.98 59.36 3mka h ARG -27 Cb 0.11 -0.06 0.00 0.00 0.00 0.00 0.00 29.97 30.02 3mka h ARG -27 CO -0.02 0.83 -0.89 1.04 0.00 0.00 0.00 179.97 180.94 3mka n GLN -26 N -4.41 1.57 -3.16 0.04 6.02 0.06 -4.86 117.38 112.63 3mka n GLN -26 Ca -0.01 -0.02 -0.20 0.00 -0.01 0.00 0.00 57.00 56.76 3mka n GLN -26 Cb 0.30 -0.96 -0.04 0.00 1.02 0.00 0.00 30.24 30.56 3mka n GLN -26 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3mka n ALA -25 N -1.47 1.99 0.28 -1.58 0.00 0.29 -4.94 120.51 115.08 3mka n ALA -25 Ca -0.00 -3.28 0.14 0.00 0.00 0.00 0.00 53.44 50.30 3mka n ALA -25 Cb 0.07 -0.90 0.80 0.00 0.00 0.00 0.00 19.45 19.42 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 3.46 0.00 -0.58 0.00 0.11 -1.44 -2.49 132.00 131.05 3mka h PRO -24 Ca 0.07 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.16 3mka h PRO -24 Cb 0.94 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 3mka h PRO -24 CO 0.47 0.07 0.28 1.49 -0.21 0.00 0.00 178.00 180.10 3mka h GLU -23 N 0.00 0.81 -0.49 1.05 4.81 -1.92 -2.55 114.58 116.29 3mka h GLU -23 Ca -0.00 -0.10 -0.06 0.00 -0.13 0.00 0.00 59.36 59.07 3mka h GLU -23 Cb 0.21 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 3mka h GLU -23 CO 0.01 0.63 0.04 -0.07 -0.73 0.00 0.00 179.01 178.89 3mka h LEU -22 N 0.81 0.75 -9.95 1.64 3.38 -1.81 -3.44 115.31 106.69 3mka h LEU -22 Ca 0.20 -0.16 -0.54 0.00 0.09 0.00 0.00 57.88 57.47 3mka h LEU -22 Cb 0.08 -0.20 0.11 0.00 0.09 0.00 0.00 40.66 40.74 3mka h LEU -22 CO -0.03 0.79 0.75 -0.76 0.09 0.00 0.00 178.44 179.28 3mka s LEU -21 N -9.22 4.28 0.48 1.67 1.02 -0.96 -4.97 118.68 110.98 3mka s LEU -21 Ca -0.09 3.00 -0.22 0.00 0.02 0.00 0.00 54.13 56.83 3mka s LEU -21 Cb 0.15 -3.72 -0.07 0.00 0.02 0.00 0.00 46.19 42.57 3mka s LEU -21 CO 0.80 -0.91 1.17 -2.16 0.02 0.00 0.00 176.35 175.27 3mka s PRO -20 N -2.15 3.66 0.00 1.29 0.04 -1.26 -5.05 135.00 131.52 3mka s PRO -20 Ca 0.54 1.76 0.00 0.00 0.04 0.00 0.00 61.00 63.35 3mka s PRO -20 Cb -0.45 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 31.76 3mka s PRO -20 CO 0.61 -0.63 0.00 0.00 0.04 0.00 0.00 177.00 177.01 3mka n ALA -19 N -0.66 0.00 -2.63 8.56 0.00 -1.26 -5.08 120.51 119.43 3mka n ALA -19 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.48 3mka n ALA -19 Cb 0.48 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.90 3mka n ALA -19 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3mka n PRO -3 N 0.00 -4.30 -3.83 0.00 -0.02 -1.25 -5.12 135.00 120.47 3mka n PRO -3 Ca 0.00 3.28 -0.09 0.00 -2.02 0.00 0.00 63.50 64.67 3mka n PRO -3 Cb 0.00 -5.21 -0.04 0.00 -0.02 0.00 0.00 33.50 28.24 3mka n PRO -3 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3mka s HIS -2 N -0.98 -0.02 0.00 6.00 -3.43 -0.98 -1.34 115.29 114.54 3mka s HIS -2 Ca -0.20 -0.36 0.00 0.00 -0.80 0.00 0.00 55.06 53.70 3mka s HIS -2 Cb 0.01 0.42 0.00 0.00 -1.43 0.00 0.00 32.58 31.58 3mka s HIS -2 CO 0.80 -1.02 0.00 0.41 -2.00 0.00 0.00 174.74 172.93 3mka n GLY -1 N -0.38 0.85 3.56 -1.38 0.00 -1.24 -3.53 105.19 103.07 3mka n GLY -1 Ca -0.06 -0.94 -0.10 0.00 0.00 0.00 0.00 46.02 44.91 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 -1.49 -0.07 4.61 0.00 -1.26 -4.56 121.76 118.99 3mka s ALA 301 Ca 0.00 0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.25 3mka s ALA 301 Cb 0.00 0.87 -0.00 0.00 0.00 0.00 0.00 23.12 23.99 3mka s ALA 301 CO 0.00 -0.85 -0.22 0.99 0.00 0.00 0.00 175.76 175.68 3mka s THR 302 N -3.79 1.86 -0.03 0.00 2.01 -1.26 -1.48 115.64 112.95 3mka s THR 302 Ca 0.04 -0.93 0.02 0.00 0.31 0.00 0.00 61.69 61.13 3mka s THR 302 Cb -0.03 -1.60 0.01 0.00 0.01 0.00 0.00 72.50 70.89 3mka s THR 302 CO -0.07 0.52 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.68 3mka s ILE 303 N 0.15 0.64 0.21 1.82 1.01 -0.34 -2.25 121.20 122.45 3mka s ILE 303 Ca -0.11 -0.26 0.08 0.00 0.00 0.00 0.00 60.65 60.36 3mka s ILE 303 Cb -0.15 -0.60 -0.05 0.00 0.01 0.00 0.00 42.46 41.67 3mka s ILE 303 CO 0.06 0.22 -0.16 0.68 0.00 0.00 0.00 174.94 175.74 3mka s VAL 304 N 0.37 1.86 -0.21 2.92 -7.23 0.23 -1.22 120.40 117.13 3mka s VAL 304 Ca -0.05 -2.22 -0.16 0.00 -1.81 0.00 0.00 61.98 57.74 3mka s VAL 304 Cb -0.09 -2.07 0.06 0.00 0.56 0.00 0.00 36.38 34.83 3mka s VAL 304 CO 0.00 -0.54 0.53 0.00 -0.31 0.00 0.00 175.10 174.78 3mka s ALA 305 N -2.83 -1.35 0.05 1.32 0.00 -0.50 -0.94 121.76 117.52 3mka s ALA 305 Ca 0.23 1.67 -0.09 0.00 0.00 0.00 0.00 51.96 53.77 3mka s ALA 305 Cb -0.02 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 22.12 3mka s ALA 305 CO 0.08 -0.28 0.19 -0.48 0.00 0.00 0.00 175.76 175.27 3mka s LEU 306 N 0.79 1.41 -0.16 0.00 0.05 -0.14 -1.07 118.68 119.56 3mka s LEU 306 Ca -0.04 -0.44 -0.10 0.00 0.05 0.00 0.00 54.13 53.60 3mka s LEU 306 Cb -0.05 0.95 -0.05 0.00 -2.05 0.00 0.00 46.19 44.99 3mka s LEU 306 CO -0.06 -0.59 0.17 -0.54 -0.55 0.00 0.00 176.35 174.78 3mka s LYS 307 N -2.84 3.94 0.19 1.48 1.02 -0.10 -0.91 119.74 122.52 3mka s LYS 307 Ca -0.03 -0.11 0.08 0.00 0.02 0.00 0.00 55.97 55.94 3mka s LYS 307 Cb 0.00 -3.33 -0.04 0.00 -0.52 0.00 0.00 37.83 33.93 3mka s LYS 307 CO -0.05 0.47 -0.16 1.52 -0.92 0.00 0.00 175.35 176.20 3mka s TYR 308 N -0.15 1.78 0.12 3.18 -0.85 -0.28 -4.95 117.35 116.19 3mka s TYR 308 Ca 0.12 -0.51 -0.33 0.00 -0.52 0.00 0.00 57.07 55.83 3mka s TYR 308 Cb -0.12 -0.85 -0.12 0.00 0.38 0.00 0.00 41.96 41.25 3mka s TYR 308 CO 0.02 0.37 1.72 -2.30 -1.52 0.00 0.00 175.55 173.83 3mka n PRO 309 N -0.10 2.45 -1.02 -3.49 -0.02 -1.26 -0.56 135.00 131.00 3mka n PRO 309 Ca -0.10 0.89 -0.01 0.00 -2.02 0.00 0.00 63.50 62.26 3mka n PRO 309 Cb 0.59 -2.72 -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 3.89 0.37 3.84 -1.23 0.00 -0.77 -4.71 105.19 106.57 3mka n GLY 310 Ca 0.18 -0.05 -0.07 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.07 -0.07 -0.01 -0.02 0.00 0.27 -4.12 107.32 101.30 3mka s GLY 311 Ca 0.00 -0.32 -0.04 0.00 0.00 0.00 0.00 44.72 44.36 3mka s GLY 311 CO 0.00 -0.11 0.08 0.54 0.00 0.00 0.00 173.10 173.61 3mka s VAL 312 N -3.92 0.05 0.04 1.40 0.11 -0.76 -1.13 120.40 116.20 3mka s VAL 312 Ca 0.11 -0.45 0.03 0.00 -2.93 0.00 0.00 61.98 58.74 3mka s VAL 312 Cb -0.06 -0.27 -0.02 0.00 -1.53 0.00 0.00 36.38 34.51 3mka s VAL 312 CO 0.07 -0.25 -0.10 0.54 -3.33 0.00 0.00 175.10 172.03 3mka s VAL 313 N -0.80 0.72 -0.03 2.04 0.11 -0.09 -1.27 120.40 121.09 3mka s VAL 313 Ca -0.09 -1.03 -0.02 0.00 -2.93 0.00 0.00 61.98 57.91 3mka s VAL 313 Cb -0.05 -0.73 0.01 0.00 -1.53 0.00 0.00 36.38 34.08 3mka s VAL 313 CO 0.00 -0.25 0.07 -0.32 -3.33 0.00 0.00 175.10 171.28 3mka s MET 314 N -1.40 0.06 0.03 1.54 1.75 -0.38 -0.97 119.30 119.93 3mka s MET 314 Ca -0.06 0.14 -0.05 0.00 -1.25 0.00 0.00 55.69 54.48 3mka s MET 314 Cb -0.09 -0.04 -0.01 0.00 2.84 0.00 0.00 34.83 37.53 3mka s MET 314 CO 0.01 -0.06 0.09 0.00 -0.65 0.00 0.00 175.02 174.41 3mka s ALA 315 N 0.36 -0.08 0.05 4.11 0.00 -0.11 -0.80 121.76 125.28 3mka s ALA 315 Ca -0.03 -0.50 -0.06 0.00 0.00 0.00 0.00 51.96 51.37 3mka s ALA 315 Cb -0.04 0.22 -0.01 0.00 0.00 0.00 0.00 23.12 23.29 3mka s ALA 315 CO -0.01 -0.29 0.12 0.20 0.00 0.00 0.00 175.76 175.78 3mka s GLY 316 N -1.97 0.16 0.94 0.00 0.00 -0.62 -0.60 107.32 105.23 3mka s GLY 316 Ca -0.07 -0.60 -0.14 0.00 0.00 0.00 0.00 44.72 43.91 3mka s GLY 316 CO -0.03 -0.75 1.29 0.51 0.00 0.00 0.00 173.10 174.12 3mka s ASP 317 N -2.39 3.15 0.00 1.64 1.47 -0.96 -2.05 116.67 117.54 3mka s ASP 317 Ca -0.01 0.13 0.03 0.00 1.18 0.00 0.00 52.55 53.88 3mka s ASP 317 Cb 0.01 -0.17 0.06 0.00 -0.34 0.00 0.00 42.92 42.48 3mka s ASP 317 CO -0.07 -2.70 0.84 0.54 0.68 0.00 0.00 175.17 174.47 3mka n ARG 318 N -3.68 1.18 -3.16 2.11 5.12 -1.26 -4.54 116.66 112.43 3mka n ARG 318 Ca 0.16 -1.18 -0.30 0.00 -1.93 0.00 0.00 57.85 54.60 3mka n ARG 318 Cb 0.59 -1.07 -0.03 0.00 -1.16 0.00 0.00 32.46 30.79 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 -0.64 3.72 -0.04 5.56 3.52 -1.26 -1.97 118.95 127.85 3mka s ARG 319 Ca 0.06 0.23 -0.01 0.00 -0.13 0.00 0.00 55.73 55.87 3mka s ARG 319 Cb 0.03 -2.54 0.03 0.00 -1.56 0.00 0.00 34.95 30.91 3mka s ARG 319 CO 0.05 0.13 0.07 0.45 -0.81 0.00 0.00 175.30 175.18 3mka s SER 320 N -3.05 0.06 0.11 -2.12 0.15 -0.08 -4.71 113.70 104.05 3mka s SER 320 Ca 0.47 0.13 0.07 0.00 0.70 0.00 0.00 55.95 57.32 3mka s SER 320 Cb -0.11 0.02 -0.04 0.00 -1.71 0.00 0.00 66.02 64.19 3mka s SER 320 CO 0.29 -0.14 -0.17 0.42 1.20 0.00 0.00 173.24 174.84 3mka s THR 321 N 1.17 1.51 -0.33 6.45 -4.23 -1.23 0.99 115.64 119.97 3mka s THR 321 Ca -0.08 -1.62 0.02 0.00 -1.18 0.00 0.00 61.69 58.83 3mka s THR 321 Cb -0.12 -1.51 0.10 0.00 1.34 0.00 0.00 72.50 72.31 3mka s THR 321 CO -0.04 -0.24 0.07 -1.10 -0.54 0.00 0.00 174.62 172.77 3mka s GLN 322 N -2.26 1.15 7.34 3.99 -0.21 0.20 -2.31 119.66 127.56 3mka s GLN 322 Ca 0.07 -1.54 0.00 0.00 0.02 0.00 0.00 55.36 53.91 3mka s GLN 322 Cb -0.08 -2.68 0.00 0.00 1.00 0.00 0.00 33.01 31.25 3mka s GLN 322 CO 0.04 -0.96 0.00 0.41 -2.12 0.00 0.00 175.29 172.66 3mka n GLY 323 N 4.49 2.38 0.04 3.09 0.00 -1.26 -2.22 105.19 111.70 3mka n GLY 323 Ca 0.01 -0.33 0.11 0.00 0.00 0.00 0.00 46.02 45.82 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 7.16 0.61 -4.77 1.61 3.02 -1.26 -4.92 115.26 116.71 3mka n ASN 324 Ca 0.00 -0.13 -0.38 0.00 -0.03 0.00 0.00 54.58 54.04 3mka n ASN 324 Cb 0.00 0.77 -0.06 0.00 -0.61 0.00 0.00 39.78 39.88 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 -3.22 4.57 -0.34 3.52 -1.94 -0.94 -5.00 119.30 115.95 3mka s MET 325 Ca 0.03 1.47 -0.25 0.00 -1.71 0.00 0.00 55.69 55.23 3mka s MET 325 Cb 0.14 -2.91 0.01 0.00 2.01 0.00 0.00 34.83 34.07 3mka s MET 325 CO 0.80 0.24 0.87 0.42 -0.01 0.00 0.00 175.02 177.34 3mka s ILE 326 N -1.46 4.68 -0.13 2.53 1.01 -1.26 -0.63 121.20 125.95 3mka s ILE 326 Ca 0.49 1.21 0.17 0.00 0.00 0.00 0.00 60.65 62.52 3mka s ILE 326 Cb -0.23 -4.25 -0.23 0.00 0.01 0.00 0.00 42.46 37.76 3mka s ILE 326 CO 0.29 -0.40 0.45 -1.54 0.00 0.00 0.00 174.94 173.74 3mka n SER 327 N 6.50 0.40 -3.85 3.58 3.41 0.28 -4.92 113.62 119.02 3mka n SER 327 Ca 0.06 0.18 -0.12 0.00 -0.26 0.00 0.00 58.87 58.73 3mka n SER 327 Cb 0.48 0.73 -0.11 0.00 -0.26 0.00 0.00 64.21 65.05 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 -5.07 -0.02 0.00 5.00 0.00 -0.49 -4.94 107.32 101.79 3mka s GLY 328 Ca -0.07 0.11 0.00 0.00 0.00 0.00 0.00 44.72 44.76 3mka s GLY 328 CO 0.84 0.01 0.57 -0.96 0.00 0.00 0.00 173.10 173.55 3mka n ARG 329 N 2.10 0.61 0.00 2.90 1.85 -1.25 -0.90 116.66 121.97 3mka n ARG 329 Ca -0.18 -0.72 0.00 0.00 -1.00 0.00 0.00 57.85 55.94 3mka n ARG 329 Cb 0.57 -0.82 0.00 0.00 -1.05 0.00 0.00 32.46 31.16 3mka n ARG 329 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 3mka n ASP 330 N -0.16 0.68 -4.60 2.89 5.75 -1.11 -4.66 116.55 115.35 3mka n ASP 330 Ca 0.00 -0.91 -0.56 0.00 -0.01 0.00 0.00 54.79 53.30 3mka n ASP 330 Cb 0.21 0.12 -0.07 0.00 -1.03 0.00 0.00 41.12 40.35 3mka n ASP 330 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 3mka n VAL 331 N -0.12 0.05 -3.76 2.12 0.31 -0.83 -4.96 118.33 111.14 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 0.04 -0.61 -0.08 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 1.05 4.03 0.00 5.55 3.52 -1.26 -4.21 118.95 127.63 3mka s ARG 332 Ca 0.90 -0.19 0.00 0.00 -0.13 0.00 0.00 55.73 56.31 3mka s ARG 332 Cb -1.12 -3.37 0.00 0.00 -1.56 0.00 0.00 34.95 28.90 3mka s ARG 332 CO 0.56 0.40 0.34 1.63 -0.81 0.00 0.00 175.30 177.42 3mka n LYS 333 N 3.19 0.30 -4.66 5.12 5.02 -1.26 -4.98 118.16 120.89 3mka n LYS 333 Ca -0.17 -0.34 -0.33 0.00 -2.02 0.00 0.00 58.31 55.45 3mka n LYS 333 Cb 0.53 -0.82 -0.16 0.00 -0.02 0.00 0.00 35.03 34.55 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 -0.14 2.39 -0.01 -0.18 1.01 -1.26 -2.25 120.40 119.95 3mka s VAL 334 Ca 0.00 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.14 3mka s VAL 334 Cb 0.00 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 3mka s VAL 334 CO 0.00 0.53 -0.09 -0.31 0.00 0.00 0.00 175.10 175.23 3mka s TYR 335 N 0.75 0.83 -0.11 5.22 2.02 -0.47 -4.98 117.35 120.60 3mka s TYR 335 Ca -0.08 -0.16 -0.30 0.00 -0.37 0.00 0.00 57.07 56.17 3mka s TYR 335 Cb -0.16 -0.54 -0.02 0.00 -0.40 0.00 0.00 41.96 40.84 3mka s TYR 335 CO 0.00 -0.02 1.21 0.42 -1.57 0.00 0.00 175.55 175.59 3mka s ILE 336 N -0.19 4.31 -0.74 2.71 1.01 -1.26 -0.46 121.20 126.59 3mka s ILE 336 Ca 0.03 1.61 0.19 0.00 0.00 0.00 0.00 60.65 62.48 3mka s ILE 336 Cb -0.04 -4.04 -0.22 0.00 0.01 0.00 0.00 42.46 38.17 3mka s ILE 336 CO -0.00 -0.07 0.73 0.35 0.00 0.00 0.00 174.94 175.95 3mka n THR 337 N 4.97 0.00 -3.90 2.92 -2.24 0.17 -4.93 114.28 111.27 3mka n THR 337 Ca 0.12 -0.12 -0.01 0.00 -2.27 0.00 0.00 64.05 61.76 3mka n THR 337 Cb 0.46 0.84 0.02 0.00 -2.10 0.00 0.00 70.33 69.54 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 -3.00 -0.00 0.64 3.42 1.47 -1.15 -4.58 116.67 113.47 3mka s ASP 338 Ca 0.05 -0.53 0.39 0.00 1.18 0.00 0.00 52.55 53.64 3mka s ASP 338 Cb 0.14 0.39 2.20 0.00 -0.34 0.00 0.00 42.92 45.31 3mka s ASP 338 CO 0.77 -0.78 2.32 0.44 0.68 0.00 0.00 175.17 178.60 3mka h ASP 339 N 2.00 0.00 0.00 2.11 3.32 -1.95 -3.06 116.42 118.84 3mka h ASP 339 Ca -0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3mka h ASP 339 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 3mka h ASP 339 CO 0.34 0.00 -0.14 -1.22 -1.72 0.00 0.00 179.24 176.51 3mka n TYR 340 N -3.35 0.00 -3.70 4.55 4.01 -1.26 -0.45 117.16 116.95 3mka n TYR 340 Ca -0.03 -0.66 -0.13 0.00 -0.16 0.00 0.00 57.90 56.92 3mka n TYR 340 Cb 0.09 -0.11 -0.07 0.00 -0.31 0.00 0.00 39.34 38.93 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 0.06 0.03 -0.72 -4.23 -1.16 -1.45 115.64 106.29 3mka s THR 341 Ca 0.20 -0.47 -0.01 0.00 -1.18 0.00 0.00 61.69 60.23 3mka s THR 341 Cb 0.18 -0.84 -0.03 0.00 1.34 0.00 0.00 72.50 73.15 3mka s THR 341 CO 0.02 -0.26 -0.02 0.00 -0.54 0.00 0.00 174.62 173.81 3mka s ALA 342 N -2.00 0.24 0.01 3.99 0.00 0.61 -0.65 121.76 123.97 3mka s ALA 342 Ca -0.08 -0.80 0.04 0.00 0.00 0.00 0.00 51.96 51.12 3mka s ALA 342 Cb -0.02 0.19 -0.01 0.00 0.00 0.00 0.00 23.12 23.28 3mka s ALA 342 CO 0.01 -0.24 -0.12 0.95 0.00 0.00 0.00 175.76 176.36 3mka s THR 343 N -2.35 0.94 -0.08 0.00 -4.23 0.39 -1.33 115.64 108.97 3mka s THR 343 Ca -0.08 -0.73 0.03 0.00 -1.18 0.00 0.00 61.69 59.74 3mka s THR 343 Cb -0.03 -0.83 0.00 0.00 1.34 0.00 0.00 72.50 72.98 3mka s THR 343 CO -0.04 0.10 -0.19 -0.83 -0.54 0.00 0.00 174.62 173.12 3mka s GLY 344 N -0.71 1.09 -0.06 3.99 0.00 -0.32 -1.37 107.32 109.93 3mka s GLY 344 Ca 0.02 -0.73 0.04 0.00 0.00 0.00 0.00 44.72 44.05 3mka s GLY 344 CO 0.00 -0.16 -0.19 -0.42 0.00 0.00 0.00 173.10 172.32 3mka s ILE 345 N 0.43 1.65 -0.11 0.90 1.01 -0.96 -0.07 121.20 124.05 3mka s ILE 345 Ca -0.16 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.69 3mka s ILE 345 Cb -0.17 -1.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.87 3mka s ILE 345 CO 0.06 0.47 -0.16 0.00 0.00 0.00 0.00 174.94 175.31 3mka s ALA 346 N 0.17 2.50 0.00 9.38 0.00 -0.73 -4.92 121.76 128.16 3mka s ALA 346 Ca -0.09 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 50.95 3mka s ALA 346 Cb -0.14 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 21.90 3mka s ALA 346 CO 0.04 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.51 3mka n GLY 347 N 3.38 0.80 3.74 0.00 0.00 -1.26 -0.28 105.19 111.57 3mka n GLY 347 Ca -0.18 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.74 3mka n GLY 347 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mka s THR 348 N -3.66 2.01 0.17 2.61 2.01 -1.12 -3.68 115.64 113.98 3mka s THR 348 Ca 0.00 0.01 -0.12 0.00 0.31 0.00 0.00 61.69 61.88 3mka s THR 348 Cb 0.00 -3.00 0.08 0.00 0.01 0.00 0.00 72.50 69.59 3mka s THR 348 CO 0.00 0.00 1.76 0.00 -0.69 0.00 0.00 174.62 175.69 3mka h ALA 349 N 5.29 0.77 -0.28 7.40 0.00 -1.59 -0.96 119.26 129.89 3mka h ALA 349 Ca -0.46 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 3mka h ALA 349 Cb 1.22 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3mka h ALA 349 CO 0.83 0.34 0.13 0.00 0.00 0.00 0.00 179.25 180.56 3mka h ALA 350 N 1.12 0.36 -0.51 0.00 0.00 -1.89 -0.27 119.26 118.06 3mka h ALA 350 Ca 0.21 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3mka h ALA 350 Cb 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3mka h ALA 350 CO -0.03 -0.07 0.28 0.28 0.00 0.00 0.00 179.25 179.71 3mka h VAL 351 N 0.32 1.18 -0.49 0.00 2.07 -1.90 -1.13 116.25 116.30 3mka h VAL 351 Ca 0.10 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 3mka h VAL 351 Cb 0.12 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3mka h VAL 351 CO -0.01 0.19 0.26 0.00 0.02 0.00 0.00 177.57 178.03 3mka h ALA 352 N 1.11 0.62 -0.47 1.67 0.00 -0.73 -1.55 119.26 119.91 3mka h ALA 352 Ca 0.18 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3mka h ALA 352 Cb 0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3mka h ALA 352 CO -0.03 0.15 0.14 -0.24 0.00 0.00 0.00 179.25 179.27 3mka h VAL 353 N 0.64 1.22 -0.92 0.00 3.04 -0.65 -2.13 116.25 117.45 3mka h VAL 353 Ca 0.17 -0.75 -0.01 0.00 -1.01 0.00 0.00 66.70 65.10 3mka h VAL 353 Cb 0.05 0.83 -0.04 0.00 -2.01 0.00 0.00 31.29 30.12 3mka h VAL 353 CO -0.03 0.27 0.55 -0.33 -1.01 0.00 0.00 177.57 177.02 3mka h GLU 354 N 0.62 1.26 -0.56 4.17 5.08 -0.96 -2.60 114.58 121.58 3mka h GLU 354 Ca 0.15 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3mka h GLU 354 Cb 0.27 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 3mka h GLU 354 CO -0.00 0.88 0.32 0.35 -1.00 0.00 0.00 179.01 179.56 3mka h PHE 355 N 1.27 0.77 0.07 4.33 3.57 -0.92 -1.94 116.94 124.09 3mka h PHE 355 Ca 0.33 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.81 3mka h PHE 355 Cb -0.04 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 38.45 3mka h PHE 355 CO 0.00 0.55 -0.04 0.00 -2.23 0.00 0.00 178.31 176.60 3mka h ALA 356 N 1.15 -0.10 -0.81 2.41 0.00 -1.01 -0.66 119.26 120.24 3mka h ALA 356 Ca 0.20 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.08 3mka h ALA 356 Cb 0.03 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.80 3mka h ALA 356 CO -0.03 -0.48 0.49 -0.09 0.00 0.00 0.00 179.25 179.14 3mka h ARG 357 N -0.24 0.88 -0.68 0.00 2.43 -1.47 -1.51 114.38 113.78 3mka h ARG 357 Ca -0.01 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.07 3mka h ARG 357 Cb 0.20 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 3mka h ARG 357 CO 0.02 0.58 0.29 1.25 -1.51 0.00 0.00 179.97 180.60 3mka h LEU 358 N 0.90 0.93 -0.91 3.80 5.85 -1.21 -1.79 115.31 122.88 3mka h LEU 358 Ca 0.36 -0.16 -0.10 0.00 0.84 0.00 0.00 57.88 58.81 3mka h LEU 358 Cb 0.17 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 3mka h LEU 358 CO -0.17 0.83 -0.31 0.22 -0.34 0.00 0.00 178.44 178.67 3mka h TYR 359 N 0.96 0.50 -0.31 1.25 3.20 -0.69 -0.38 116.97 121.50 3mka h TYR 359 Ca 0.23 -0.12 -0.13 0.00 3.14 0.00 0.00 58.73 61.86 3mka h TYR 359 Cb 0.18 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.32 3mka h TYR 359 CO 0.01 0.70 -0.30 0.00 -1.64 0.00 0.00 178.16 176.93 3mka h ALA 360 N 1.30 0.46 -0.31 1.82 0.00 -0.99 -2.01 119.26 119.52 3mka h ALA 360 Ca 0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 3mka h ALA 360 Cb 0.73 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3mka h ALA 360 CO 0.06 0.48 0.10 0.28 0.00 0.00 0.00 179.25 180.17 3mka h VAL 361 N 0.51 1.20 -1.01 0.00 2.07 -1.15 -1.96 116.25 115.92 3mka h VAL 361 Ca 0.05 -0.65 0.14 0.00 0.82 0.00 0.00 66.70 67.06 3mka h VAL 361 Cb 0.87 1.05 -0.09 0.00 -1.52 0.00 0.00 31.29 31.60 3mka h VAL 361 CO 0.07 0.22 0.63 -0.08 0.02 0.00 0.00 177.57 178.43 3mka h GLU 362 N 0.34 0.91 -0.07 1.57 4.57 -0.97 0.48 114.58 121.41 3mka h GLU 362 Ca 0.10 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.20 3mka h GLU 362 Cb 0.24 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 3mka h GLU 362 CO -0.00 0.60 -0.05 -0.07 -1.18 0.00 0.00 179.01 178.31 3mka h LEU 363 N 0.94 0.17 -1.22 1.64 4.07 -1.06 -2.81 115.31 117.02 3mka h LEU 363 Ca 0.52 -0.45 -0.06 0.00 0.08 0.00 0.00 57.88 57.98 3mka h LEU 363 Cb 0.60 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.29 3mka h LEU 363 CO -0.30 0.58 -0.27 -0.08 -1.08 0.00 0.00 178.44 177.29 3mka h GLU 364 N -0.25 0.00 -0.25 1.13 4.81 -1.08 -2.79 114.58 116.16 3mka h GLU 364 Ca 0.01 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.19 3mka h GLU 364 Cb 0.53 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 3mka h GLU 364 CO 0.01 0.27 -0.04 1.25 -0.73 0.00 0.00 179.01 179.77 3mka h HIS 365 N 0.00 0.52 -0.32 0.92 2.76 -0.88 -1.93 115.15 116.22 3mka h HIS 365 Ca -0.00 -0.11 -0.07 0.00 -2.20 0.00 0.00 60.37 57.99 3mka h HIS 365 Cb 0.71 -0.13 -0.02 0.00 1.55 0.00 0.00 27.41 29.52 3mka h HIS 365 CO 0.00 0.68 -0.11 -0.92 -1.30 0.00 0.00 177.93 176.28 3mka h TYR 366 N 0.22 0.58 -0.58 5.26 3.20 -1.40 -1.36 116.97 122.90 3mka h TYR 366 Ca 0.06 -0.09 -0.10 0.00 3.14 0.00 0.00 58.73 61.75 3mka h TYR 366 Cb 0.50 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 3mka h TYR 366 CO 0.05 0.63 -0.03 1.49 -1.64 0.00 0.00 178.16 178.66 3mka h GLU 367 N 0.50 1.04 -0.12 1.82 4.81 -1.30 -0.39 114.58 120.94 3mka h GLU 367 Ca 0.09 -0.35 -0.16 0.00 -0.13 0.00 0.00 59.36 58.82 3mka h GLU 367 Cb 0.49 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 3mka h GLU 367 CO 0.03 1.04 -0.61 0.87 -0.73 0.00 0.00 179.01 179.61 3mka h LYS 368 N 0.93 0.42 -0.05 1.92 1.57 -1.08 0.63 116.57 120.91 3mka h LYS 368 Ca 0.16 -0.29 -0.22 0.00 -1.87 0.00 0.00 60.65 58.43 3mka h LYS 368 Cb 0.59 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3mka h LYS 368 CO 0.04 0.90 -0.86 -0.07 -0.57 0.00 0.00 179.45 178.89 3mka h LEU 369 N 0.31 0.62 -1.35 2.94 3.38 -1.08 -3.31 115.31 116.83 3mka h LEU 369 Ca -0.01 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3mka h LEU 369 Cb 1.15 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.71 3mka h LEU 369 CO 0.11 1.24 -0.19 -0.62 0.09 0.00 0.00 178.44 179.06 3mka n GLU 370 N -3.81 1.61 -0.80 1.13 -0.58 -0.17 -4.96 120.64 113.05 3mka n GLU 370 Ca -0.07 -1.28 0.00 0.00 -0.42 0.00 0.00 57.16 55.40 3mka n GLU 370 Cb 0.79 -1.36 0.00 0.00 -0.57 0.00 0.00 31.44 30.30 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 1.17 0.41 3.07 0.62 0.00 0.22 -4.95 105.19 105.73 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 -2.18 0.00 0.81 1.61 0.11 -1.17 -4.99 120.40 114.59 3mka s VAL 372 Ca 0.00 -0.03 -0.11 0.00 -2.93 0.00 0.00 61.98 58.91 3mka s VAL 372 Cb 0.00 -0.28 0.08 0.00 -1.53 0.00 0.00 36.38 34.65 3mka s VAL 372 CO 0.00 -0.02 1.11 -2.16 -3.33 0.00 0.00 175.10 170.70 3mka s PRO 373 N 0.03 1.95 0.57 1.54 0.04 -1.26 -4.23 135.00 133.63 3mka s PRO 373 Ca -0.01 1.29 -0.19 0.00 0.04 0.00 0.00 61.00 62.13 3mka s PRO 373 Cb -0.02 -1.85 -0.05 0.00 0.04 0.00 0.00 34.50 32.62 3mka s PRO 373 CO 0.00 -1.89 1.12 -1.17 0.04 0.00 0.00 177.00 175.10 3mka s LEU 374 N -6.05 3.68 0.78 -3.56 2.96 -1.26 -5.01 118.68 110.21 3mka s LEU 374 Ca 0.63 2.13 -0.11 0.00 -0.22 0.00 0.00 54.13 56.56 3mka s LEU 374 Cb -0.19 -4.57 0.06 0.00 0.50 0.00 0.00 46.19 41.99 3mka s LEU 374 CO 0.56 -1.29 1.10 0.42 -1.32 0.00 0.00 176.35 175.82 3mka s THR 375 N -1.90 3.13 0.15 3.68 -4.23 -1.26 -4.76 115.64 110.45 3mka s THR 375 Ca 0.71 0.39 -0.18 0.00 -1.18 0.00 0.00 61.69 61.43 3mka s THR 375 Cb -0.23 -2.82 0.06 0.00 1.34 0.00 0.00 72.50 70.85 3mka s THR 375 CO 0.30 -0.46 1.68 0.15 -0.54 0.00 0.00 174.62 175.75 3mka h PHE 376 N -1.09 -0.18 -0.77 3.99 3.57 -1.98 0.57 116.94 121.05 3mka h PHE 376 Ca -0.44 0.03 0.16 0.00 3.53 0.00 0.00 57.97 61.25 3mka h PHE 376 Cb 1.24 0.13 -0.05 0.00 2.79 0.00 0.00 35.95 40.06 3mka h PHE 376 CO 0.56 -0.15 0.52 0.00 -2.23 0.00 0.00 178.31 177.01 3mka h ALA 377 N 1.34 2.14 -0.09 2.41 0.00 -2.00 0.12 119.26 123.17 3mka h ALA 377 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 3mka h ALA 377 Cb 0.25 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3mka h ALA 377 CO -0.35 -0.35 -0.72 0.78 0.00 0.00 0.00 179.25 178.61 3mka h GLY 378 N 0.41 0.49 1.61 0.00 0.00 -1.30 -1.55 103.07 102.74 3mka h GLY 378 Ca 0.38 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.96 3mka h GLY 378 CO -0.12 0.61 -0.13 0.50 0.00 0.00 0.00 176.54 177.39 3mka h LYS 379 N 0.31 0.47 0.12 4.80 1.57 0.70 -1.67 116.57 122.87 3mka h LYS 379 Ca -0.03 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 3mka h LYS 379 Cb 1.29 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.56 3mka h LYS 379 CO 0.13 0.60 -0.06 0.82 -0.57 0.00 0.00 179.45 180.37 3mka h ILE 380 N 0.43 1.07 -0.25 1.86 2.04 -1.22 -2.45 117.51 118.98 3mka h ILE 380 Ca 0.08 -0.86 0.07 0.00 1.00 0.00 0.00 64.86 65.15 3mka h ILE 380 Cb 0.50 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 3mka h ILE 380 CO 0.03 0.20 0.18 -1.13 0.00 0.00 0.00 178.15 177.43 3mka h ASN 381 N -0.57 0.00 -0.04 1.72 -0.73 -1.11 -0.43 115.58 114.41 3mka h ASN 381 Ca -0.02 0.00 -0.18 0.00 1.87 0.00 0.00 56.30 57.97 3mka h ASN 381 Cb 0.45 -0.00 0.01 0.00 0.27 0.00 0.00 38.32 39.06 3mka h ASN 381 CO 0.03 0.00 -0.68 -0.09 -0.37 0.00 0.00 177.43 176.32 3mka h ARG 382 N 0.00 0.54 -0.86 6.67 9.65 -1.18 -2.63 114.38 126.57 3mka h ARG 382 Ca 0.12 -0.52 -0.02 0.00 -1.10 0.00 0.00 59.98 58.47 3mka h ARG 382 Cb 0.48 0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 29.15 3mka h ARG 382 CO -0.00 1.15 0.48 1.25 2.80 0.00 0.00 179.97 185.65 3mka h LEU 383 N 0.12 1.07 -1.05 3.80 5.85 -0.84 -2.27 115.31 121.99 3mka h LEU 383 Ca -0.07 -0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.60 3mka h LEU 383 Cb 1.35 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 42.05 3mka h LEU 383 CO 0.14 0.86 0.64 0.00 -0.34 0.00 0.00 178.44 179.73 3mka h ALA 384 N 1.26 1.40 -0.46 1.25 0.00 -1.08 -0.31 119.26 121.33 3mka h ALA 384 Ca 0.30 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 3mka h ALA 384 Cb 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3mka h ALA 384 CO -0.05 0.48 -0.21 0.82 0.00 0.00 0.00 179.25 180.29 3mka h ILE 385 N 1.18 1.27 -0.42 0.00 2.04 -1.03 0.33 117.51 120.88 3mka h ILE 385 Ca 0.40 -1.37 -0.01 0.00 1.00 0.00 0.00 64.86 64.89 3mka h ILE 385 Cb 0.09 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 3mka h ILE 385 CO -0.14 0.47 0.21 0.24 0.00 0.00 0.00 178.15 178.93 3mka h MET 386 N 0.79 0.59 0.50 2.37 2.86 -0.99 -1.16 114.93 119.90 3mka h MET 386 Ca 0.10 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 3mka h MET 386 Cb 0.78 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.34 3mka h MET 386 CO 0.06 0.50 -0.24 0.28 1.06 0.00 0.00 176.91 178.57 3mka h VAL 387 N 0.54 0.51 -0.70 -2.22 2.07 -0.93 -2.97 116.25 112.55 3mka h VAL 387 Ca 0.14 -0.05 0.08 0.00 0.82 0.00 0.00 66.70 67.70 3mka h VAL 387 Cb 0.09 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 3mka h VAL 387 CO -0.02 0.01 0.46 -0.09 0.02 0.00 0.00 177.57 177.95 3mka h ARG 388 N -0.70 0.62 -0.09 1.57 2.43 -0.78 0.40 114.38 117.84 3mka h ARG 388 Ca -0.07 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.06 3mka h ARG 388 Cb 0.53 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 3mka h ARG 388 CO 0.11 0.41 0.00 0.41 -1.51 0.00 0.00 179.97 179.40 3mka n GLY 389 N -1.47 -0.47 0.00 2.80 0.00 -0.45 -2.11 105.19 103.50 3mka n GLY 389 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -0.42 0.94 -0.34 1.61 5.15 0.14 -4.80 115.26 117.54 3mka n ASN 390 Ca 0.00 -1.07 0.11 0.00 -0.60 0.00 0.00 54.58 53.02 3mka n ASN 390 Cb 0.02 0.00 0.31 0.00 -0.53 0.00 0.00 39.78 39.58 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 0.80 -0.45 1.20 5.85 -1.46 0.13 115.31 121.38 3mka h LEU 391 Ca 0.00 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.71 3mka h LEU 391 Cb 0.11 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 3mka h LEU 391 CO 0.00 0.35 -0.04 0.00 -0.34 0.00 0.00 178.44 178.40 3mka h ALA 392 N 1.60 0.61 -0.20 1.25 0.00 -1.87 -2.31 119.26 118.34 3mka h ALA 392 Ca 0.53 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 3mka h ALA 392 Cb 0.77 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3mka h ALA 392 CO -0.31 0.44 -0.24 0.00 0.00 0.00 0.00 179.25 179.14 3mka h ALA 393 N 0.89 1.21 -0.02 0.00 0.00 -1.63 -2.88 119.26 116.84 3mka h ALA 393 Ca 0.12 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 3mka h ALA 393 Cb 0.56 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3mka h ALA 393 CO 0.03 0.51 -0.45 0.00 0.00 0.00 0.00 179.25 179.34 3mka h ALA 394 N 1.41 1.21 0.00 0.00 0.00 -0.78 -1.31 119.26 119.79 3mka h ALA 394 Ca 0.05 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.49 3mka h ALA 394 Cb 0.61 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3mka h ALA 394 CO 0.04 0.58 -0.25 0.52 0.00 0.00 0.00 179.25 180.14 3mka h MET 395 N 0.04 0.00 -0.59 0.00 2.86 -1.20 -2.33 114.93 113.72 3mka h MET 395 Ca -0.00 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 3mka h MET 395 Cb 0.82 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.45 3mka h MET 395 CO 0.06 0.25 0.06 1.04 1.06 0.00 0.00 176.91 179.38 3mka n GLN 396 N -3.74 4.49 0.00 1.72 6.02 -0.63 -4.97 117.38 120.25 3mka n GLN 396 Ca -0.01 -3.13 0.00 0.00 -0.01 0.00 0.00 57.00 53.84 3mka n GLN 396 Cb 0.36 -2.23 0.00 0.00 1.02 0.00 0.00 30.24 29.39 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 0.35 3.18 2.23 1.08 0.00 -0.88 -4.93 105.19 106.21 3mka n GLY 397 Ca 0.30 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.08 3mka n GLY 397 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mka n LEU 398 N 0.00 6.55 -4.70 0.99 4.77 -0.59 -4.78 117.00 119.25 3mka n LEU 398 Ca 0.00 -3.81 -0.42 0.00 -0.03 0.00 0.00 56.01 51.75 3mka n LEU 398 Cb 0.00 -1.40 -0.03 0.00 -2.33 0.00 0.00 43.42 39.66 3mka n LEU 398 CO 0.00 1.82 0.77 -0.22 -1.33 0.00 0.00 177.39 178.44 3mka s LEU 399 N -0.68 4.29 -0.21 2.23 2.96 -1.26 -4.00 118.68 122.00 3mka s LEU 399 Ca 0.64 1.61 0.00 0.00 -0.22 0.00 0.00 54.13 56.17 3mka s LEU 399 Cb 0.29 -3.56 0.05 0.00 0.50 0.00 0.00 46.19 43.47 3mka s LEU 399 CO -0.07 -0.40 -0.06 0.00 -1.32 0.00 0.00 176.35 174.50 3mka s ALA 400 N 1.67 1.83 -0.37 5.97 0.00 -1.26 -2.80 121.76 126.81 3mka s ALA 400 Ca 0.50 -1.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.22 3mka s ALA 400 Cb -0.20 -1.34 0.08 0.00 0.00 0.00 0.00 23.12 21.66 3mka s ALA 400 CO 0.22 -1.05 0.14 -1.17 0.00 0.00 0.00 175.76 173.90 3mka s LEU 401 N 1.46 4.71 0.32 0.00 2.96 0.62 -4.96 118.68 123.79 3mka s LEU 401 Ca -0.04 -1.58 -0.10 0.00 -0.22 0.00 0.00 54.13 52.20 3mka s LEU 401 Cb -0.18 -1.83 -0.07 0.00 0.50 0.00 0.00 46.19 44.61 3mka s LEU 401 CO -0.07 -0.43 0.66 -2.16 -1.32 0.00 0.00 176.35 173.03 3mka s PRO 402 N 1.27 3.80 -0.10 0.98 0.04 -1.26 -1.78 135.00 137.94 3mka s PRO 402 Ca 0.02 0.36 0.03 0.00 0.04 0.00 0.00 61.00 61.45 3mka s PRO 402 Cb -0.21 -2.52 0.01 0.00 0.04 0.00 0.00 34.50 31.81 3mka s PRO 402 CO -0.01 0.14 -0.21 -1.17 0.04 0.00 0.00 177.00 175.79 3mka s LEU 403 N -3.36 1.99 -0.12 -3.56 2.96 0.90 -3.17 118.68 114.32 3mka s LEU 403 Ca 0.49 -0.52 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 3mka s LEU 403 Cb -0.11 -1.30 -0.02 0.00 0.50 0.00 0.00 46.19 45.27 3mka s LEU 403 CO 0.26 0.11 -0.13 -0.22 -1.32 0.00 0.00 176.35 175.05 3mka s LEU 404 N 0.55 2.75 -0.08 -0.68 2.96 0.56 -1.18 118.68 123.57 3mka s LEU 404 Ca -0.15 -0.29 0.04 0.00 -0.22 0.00 0.00 54.13 53.51 3mka s LEU 404 Cb -0.17 -1.61 0.00 0.00 0.50 0.00 0.00 46.19 44.92 3mka s LEU 404 CO 0.05 0.20 -0.19 0.00 -1.32 0.00 0.00 176.35 175.09 3mka s ALA 405 N 0.14 1.78 0.15 5.97 0.00 -0.44 -0.30 121.76 129.06 3mka s ALA 405 Ca -0.06 -0.76 -0.18 0.00 0.00 0.00 0.00 51.96 50.96 3mka s ALA 405 Cb -0.15 -0.67 0.04 0.00 0.00 0.00 0.00 23.12 22.34 3mka s ALA 405 CO 0.05 0.25 0.47 0.20 0.00 0.00 0.00 175.76 176.72 3mka s GLY 406 N 0.34 -0.29 -0.15 0.00 0.00 -0.28 -0.28 107.32 106.65 3mka s GLY 406 Ca -0.14 0.00 -0.01 0.00 0.00 0.00 0.00 44.72 44.58 3mka s GLY 406 CO 0.06 -0.21 -0.11 -0.47 0.00 0.00 0.00 173.10 172.36 3mka s TYR 407 N -3.81 2.85 -0.40 1.90 6.04 -0.53 0.19 117.35 123.59 3mka s TYR 407 Ca 0.04 -0.71 -0.15 0.00 0.04 0.00 0.00 57.07 56.29 3mka s TYR 407 Cb 0.01 -1.90 0.01 0.00 -1.04 0.00 0.00 41.96 39.04 3mka s TYR 407 CO -0.10 -0.28 0.32 0.34 -1.54 0.00 0.00 175.55 174.29 3mka s ASP 408 N 0.57 6.12 0.21 4.32 2.15 -0.98 -4.88 116.67 124.18 3mka s ASP 408 Ca -0.07 -0.77 -0.08 0.00 0.43 0.00 0.00 52.55 52.06 3mka s ASP 408 Cb -0.15 -2.17 0.14 0.00 -0.30 0.00 0.00 42.92 40.44 3mka s ASP 408 CO 0.03 -0.44 1.73 0.16 -0.17 0.00 0.00 175.17 176.48 3mka h ILE 409 N 5.63 1.26 0.00 4.11 3.07 -1.98 -2.70 117.51 126.90 3mka h ILE 409 Ca -0.28 -0.96 0.00 0.00 1.55 0.00 0.00 64.86 65.18 3mka h ILE 409 Cb 1.12 0.51 0.00 0.00 -0.27 0.00 0.00 36.82 38.18 3mka h ILE 409 CO 0.73 0.37 0.00 1.41 -1.05 0.00 0.00 178.15 179.61 3mka n HIS 410 N -4.24 0.50 -1.86 0.16 8.25 -1.26 -4.82 115.22 111.95 3mka n HIS 410 Ca 0.05 0.18 -0.40 0.00 -0.26 0.00 0.00 57.72 57.30 3mka n HIS 410 Cb 0.25 -0.79 0.01 0.00 1.12 0.00 0.00 29.99 30.58 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 -3.16 3.23 0.21 -1.41 0.00 -1.02 -4.92 121.76 114.68 3mka s ALA 411 Ca 0.07 1.41 -0.09 0.00 0.00 0.00 0.00 51.96 53.35 3mka s ALA 411 Cb 0.11 -3.57 0.16 0.00 0.00 0.00 0.00 23.12 19.82 3mka s ALA 411 CO 0.40 -1.12 1.82 0.66 0.00 0.00 0.00 175.76 177.52 3mka h SER 412 N 2.36 0.99 -3.41 0.00 4.64 -1.89 -3.41 113.55 112.84 3mka h SER 412 Ca -0.51 -0.11 -0.65 0.00 -0.47 0.00 0.00 61.79 60.06 3mka h SER 412 Cb 1.26 -0.25 -0.25 0.00 -0.31 0.00 0.00 62.40 62.86 3mka h SER 412 CO 0.61 0.81 -0.69 -0.62 -0.87 0.00 0.00 176.83 176.08 3mka s ASP 413 N -6.13 4.61 0.21 4.97 2.15 -1.26 -5.00 116.67 116.22 3mka s ASP 413 Ca -0.13 -0.26 -0.08 0.00 0.43 0.00 0.00 52.55 52.52 3mka s ASP 413 Cb 0.15 -1.78 0.16 0.00 -0.30 0.00 0.00 42.92 41.15 3mka s ASP 413 CO 0.81 0.06 1.77 1.55 -0.17 0.00 0.00 175.17 179.19 3mka h PRO 414 N 7.54 1.19 -0.78 4.34 0.13 -1.94 -1.31 132.00 141.17 3mka h PRO 414 Ca -0.36 -0.23 -0.04 0.00 -0.87 0.00 0.00 66.00 64.50 3mka h PRO 414 Cb 1.18 -0.19 -0.04 0.00 0.13 0.00 0.00 31.00 32.09 3mka h PRO 414 CO 0.60 0.97 0.33 1.96 -0.23 0.00 0.00 178.00 181.63 3mka h GLN 415 N 1.15 1.15 -0.59 0.86 1.08 -1.94 -2.53 115.11 114.29 3mka h GLN 415 Ca 0.26 -0.20 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 3mka h GLN 415 Cb 0.25 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 27.48 3mka h GLN 415 CO -0.02 0.92 0.00 -1.13 -0.95 0.00 0.00 178.83 177.65 3mka n SER 416 N -4.29 3.20 -0.23 1.46 3.41 -1.13 -1.85 113.62 114.19 3mka n SER 416 Ca 0.07 -2.03 -0.02 0.00 -0.26 0.00 0.00 58.87 56.64 3mka n SER 416 Cb 0.17 -0.40 0.18 0.00 -0.26 0.00 0.00 64.21 63.90 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 4.06 1.30 -2.97 7.33 0.00 -0.78 -3.45 119.26 124.75 3mka h ALA 417 Ca 0.00 -0.12 -0.54 0.00 0.00 0.00 0.00 54.91 54.25 3mka h ALA 417 Cb 0.82 -0.30 0.12 0.00 0.00 0.00 0.00 17.79 18.43 3mka h ALA 417 CO 0.01 0.56 0.66 0.20 0.00 0.00 0.00 179.25 180.69 3mka s GLY 418 N -3.40 2.91 0.03 0.00 0.00 -1.26 -2.31 107.32 103.29 3mka s GLY 418 Ca -0.11 1.39 0.04 0.00 0.00 0.00 0.00 44.72 46.05 3mka s GLY 418 CO 0.80 1.98 -0.13 0.50 0.00 0.00 0.00 173.10 176.25 3mka s ARG 419 N -2.55 0.85 -0.08 2.90 1.81 0.51 -4.91 118.95 117.47 3mka s ARG 419 Ca 0.63 -0.70 0.01 0.00 -1.72 0.00 0.00 55.73 53.95 3mka s ARG 419 Cb -0.42 -0.83 0.02 0.00 -0.45 0.00 0.00 34.95 33.27 3mka s ARG 419 CO 0.53 0.20 -0.10 0.42 -0.68 0.00 0.00 175.30 175.67 3mka s ILE 420 N -0.83 1.09 -0.05 1.52 1.01 -1.26 -1.13 121.20 121.55 3mka s ILE 420 Ca 0.00 -0.41 0.02 0.00 0.00 0.00 0.00 60.65 60.27 3mka s ILE 420 Cb -0.08 -1.04 0.01 0.00 0.01 0.00 0.00 42.46 41.37 3mka s ILE 420 CO 0.01 0.36 -0.10 -0.69 0.00 0.00 0.00 174.94 174.52 3mka s VAL 421 N 1.05 0.91 0.16 2.92 1.01 0.59 -0.31 120.40 126.74 3mka s VAL 421 Ca -0.07 -0.38 0.08 0.00 0.00 0.00 0.00 61.98 61.61 3mka s VAL 421 Cb -0.15 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 3mka s VAL 421 CO -0.01 0.30 -0.07 -0.94 0.00 0.00 0.00 175.10 174.37 3mka s SER 422 N 0.54 4.41 -0.02 3.32 1.04 -0.36 -0.32 113.70 122.31 3mka s SER 422 Ca -0.10 -0.49 0.06 0.00 0.48 0.00 0.00 55.95 55.90 3mka s SER 422 Cb -0.13 -0.82 -0.01 0.00 0.10 0.00 0.00 66.02 65.16 3mka s SER 422 CO 0.02 0.12 -0.21 -0.36 0.98 0.00 0.00 173.24 173.79 3mka s PHE 423 N -1.59 1.92 0.59 5.02 0.08 -1.19 -1.33 117.98 121.48 3mka s PHE 423 Ca 0.25 -0.41 -0.01 0.00 0.12 0.00 0.00 56.93 56.88 3mka s PHE 423 Cb -0.09 -1.25 0.04 0.00 -0.57 0.00 0.00 43.02 41.15 3mka s PHE 423 CO 0.16 -0.07 0.84 0.16 -0.10 0.00 0.00 175.22 176.20 3mka s ASP 424 N -0.39 5.15 0.63 1.36 1.47 0.24 -4.69 116.67 120.44 3mka s ASP 424 Ca 0.05 0.09 0.42 0.00 1.18 0.00 0.00 52.55 54.30 3mka s ASP 424 Cb -0.09 -0.91 2.28 0.00 -0.34 0.00 0.00 42.92 43.85 3mka s ASP 424 CO 0.00 -1.26 2.28 0.00 0.68 0.00 0.00 175.17 176.87 3mka h ALA 425 N -0.10 1.01 -0.22 2.11 0.00 -1.93 -0.98 119.26 119.14 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 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3mka h ALA 425 CO 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.78 3mka n ALA 426 N -2.04 2.49 -0.02 0.00 0.00 -1.26 -4.38 120.51 115.31 3mka n ALA 426 Ca -0.03 -0.66 0.00 0.00 0.00 0.00 0.00 53.44 52.76 3mka n ALA 426 Cb 0.07 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 1.24 0.69 3.72 0.00 0.00 -0.37 -4.52 105.19 105.94 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 0.98 3.36 -0.02 0.00 -1.26 -4.73 105.19 101.53 3mka n GLY 428 Ca 0.00 0.42 -0.26 0.00 0.00 0.00 0.00 46.02 46.18 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 -0.40 2.08 -0.05 1.61 1.48 -1.26 -0.59 118.94 121.81 3mka s TRP 429 Ca 0.62 -0.40 -0.02 0.00 -1.06 0.00 0.00 56.10 55.24 3mka s TRP 429 Cb -0.56 -1.09 0.03 0.00 -1.16 0.00 0.00 33.47 30.70 3mka s TRP 429 CO 0.54 0.34 0.10 1.21 -4.06 0.00 0.00 176.95 175.08 3mka s ASN 430 N -2.28 -0.06 0.02 -2.66 2.47 -0.44 -4.97 114.94 107.02 3mka s ASN 430 Ca 0.14 0.21 -0.21 0.00 0.42 0.00 0.00 52.86 53.41 3mka s ASN 430 Cb -0.09 0.12 -0.06 0.00 -1.45 0.00 0.00 41.25 39.77 3mka s ASN 430 CO 0.07 -0.12 0.62 -0.63 -3.72 0.00 0.00 177.10 173.32 3mka s ILE 431 N 0.91 4.84 -0.50 -5.21 1.01 -1.26 -1.22 121.20 119.77 3mka s ILE 431 Ca -0.07 1.30 -0.28 0.00 0.00 0.00 0.00 60.65 61.60 3mka s ILE 431 Cb -0.10 -3.96 0.03 0.00 0.01 0.00 0.00 42.46 38.45 3mka s ILE 431 CO -0.04 0.44 1.10 -1.61 0.00 0.00 0.00 174.94 174.83 3mka s GLU 432 N -0.35 3.63 0.05 2.79 0.41 0.58 -4.93 118.70 120.86 3mka s GLU 432 Ca 0.32 0.39 0.08 0.00 -0.41 0.00 0.00 54.97 55.35 3mka s GLU 432 Cb -0.19 -3.94 -0.22 0.00 -1.78 0.00 0.00 34.13 28.00 3mka s GLU 432 CO 0.18 -1.42 1.00 0.93 -0.49 0.00 0.00 175.26 175.47 3mka h GLU 433 N 9.27 0.02 0.00 1.61 4.39 -1.92 -3.30 114.58 124.65 3mka h GLU 433 Ca -0.24 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.42 3mka h GLU 433 Cb 1.06 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 3mka h GLU 433 CO 1.12 0.81 0.00 0.93 -1.16 0.00 0.00 179.01 180.72 3mka h GLU 434 N 0.01 0.00 0.00 2.33 5.08 -2.01 -3.45 114.58 116.54 3mka h GLU 434 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3mka h GLU 434 Cb 1.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.14 3mka h GLU 434 CO 0.11 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.53 3mka n GLY 435 N -1.09 0.54 3.65 -3.84 0.00 -1.24 -5.03 105.19 98.18 3mka n GLY 435 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.12 -0.29 0.06 1.61 -0.85 -1.26 -0.92 117.35 113.57 3mka s TYR 436 Ca 0.00 -0.06 -0.27 0.00 -0.52 0.00 0.00 57.07 56.22 3mka s TYR 436 Cb 0.00 0.60 0.09 0.00 0.38 0.00 0.00 41.96 43.03 3mka s TYR 436 CO 0.00 -1.05 0.83 -1.14 -1.52 0.00 0.00 175.55 172.67 3mka s GLN 437 N -3.86 0.99 0.09 -3.49 2.00 -0.23 -4.94 119.66 110.22 3mka s GLN 437 Ca 0.07 -0.40 -0.11 0.00 -2.00 0.00 0.00 55.36 52.92 3mka s GLN 437 Cb -0.03 0.43 0.01 0.00 0.80 0.00 0.00 33.01 34.22 3mka s GLN 437 CO -0.01 -0.44 0.24 0.00 -0.50 0.00 0.00 175.29 174.58 3mka s ALA 438 N -3.29 -0.43 0.06 1.58 0.00 -1.26 -1.41 121.76 117.01 3mka s ALA 438 Ca 0.05 -0.41 -0.07 0.00 0.00 0.00 0.00 51.96 51.54 3mka s ALA 438 Cb -0.01 0.49 -0.01 0.00 0.00 0.00 0.00 23.12 23.59 3mka s ALA 438 CO -0.08 -0.51 0.14 0.14 0.00 0.00 0.00 175.76 175.44 3mka s VAL 439 N -3.60 0.14 0.00 0.00 -7.23 -0.36 -4.91 120.40 104.45 3mka s VAL 439 Ca 0.03 -1.18 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 3mka s VAL 439 Cb 0.03 -1.15 0.00 0.00 0.56 0.00 0.00 36.38 35.82 3mka s VAL 439 CO -0.10 -0.65 0.00 0.61 -0.31 0.00 0.00 175.10 174.65 3mka n GLY 440 N 0.35 1.03 0.29 2.32 0.00 -1.26 -1.20 105.19 106.73 3mka n GLY 440 Ca -0.17 -2.23 0.16 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 -0.38 1.61 4.64 -1.62 -2.04 113.55 115.76 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 0.05 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 3mka n GLY 442 N -0.93 3.20 0.33 -0.77 0.00 -1.26 -4.73 105.19 101.03 3mka n GLY 442 Ca -0.02 -0.71 0.15 0.00 0.00 0.00 0.00 46.02 45.44 3mka n GLY 442 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3mka h SER 443 N 2.40 0.01 -0.20 1.61 4.64 -1.59 -1.59 113.55 118.84 3mka h SER 443 Ca 0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 3mka h SER 443 Cb 1.13 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3mka h SER 443 CO 0.13 0.01 -0.38 -0.07 -0.87 0.00 0.00 176.83 175.64 3mka h LEU 444 N 0.01 0.67 -0.36 5.97 4.07 -1.85 -0.25 115.31 123.58 3mka h LEU 444 Ca 0.14 -0.55 -0.00 0.00 0.08 0.00 0.00 57.88 57.56 3mka h LEU 444 Cb 0.56 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 42.09 3mka h LEU 444 CO -0.00 1.09 0.22 -0.26 -1.08 0.00 0.00 178.44 178.41 3mka h PHE 445 N 0.28 0.47 -0.74 1.13 0.04 -1.80 -0.93 116.94 115.39 3mka h PHE 445 Ca 0.01 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.74 3mka h PHE 445 Cb 0.98 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.94 3mka h PHE 445 CO 0.09 0.34 0.30 0.00 -0.60 0.00 0.00 178.31 178.43 3mka h ALA 446 N 1.10 0.97 -0.60 2.45 0.00 -1.25 -1.65 119.26 120.27 3mka h ALA 446 Ca 0.13 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3mka h ALA 446 Cb -0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 3mka h ALA 446 CO -0.02 0.59 0.11 0.87 0.00 0.00 0.00 179.25 180.79 3mka h LYS 447 N 1.07 0.99 -0.18 0.00 1.57 -0.82 -1.49 116.57 117.71 3mka h LYS 447 Ca 0.25 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.67 3mka h LYS 447 Cb 0.21 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 3mka h LYS 447 CO -0.02 0.93 -0.30 0.77 -0.57 0.00 0.00 179.45 180.26 3mka h SER 448 N 0.89 0.35 -0.13 0.86 0.02 -0.89 -0.41 113.55 114.26 3mka h SER 448 Ca 0.18 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 3mka h SER 448 Cb 0.41 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 3mka h SER 448 CO 0.01 0.65 -0.05 -1.28 -1.14 0.00 0.00 176.83 175.02 3mka h SER 449 N 0.31 0.27 -0.05 3.07 0.87 -1.16 -3.03 113.55 113.82 3mka h SER 449 Ca 0.04 -0.39 -0.05 0.00 -1.23 0.00 0.00 61.79 60.16 3mka h SER 449 Cb 0.69 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.56 3mka h SER 449 CO 0.05 0.60 -0.10 0.24 -0.53 0.00 0.00 176.83 177.09 3mka h MET 450 N -0.07 0.33 -0.77 2.24 2.07 -0.94 -1.42 114.93 116.37 3mka h MET 450 Ca 0.03 -0.07 0.15 0.00 -2.07 0.00 0.00 59.70 57.74 3mka h MET 450 Cb 0.49 -0.05 -0.05 0.00 -1.87 0.00 0.00 31.60 30.12 3mka h MET 450 CO 0.02 0.44 0.52 -0.22 1.07 0.00 0.00 176.91 178.73 3mka h LYS 451 N 0.31 0.43 0.11 1.72 3.64 -0.96 0.21 116.57 122.03 3mka h LYS 451 Ca 0.06 -0.03 -0.27 0.00 -1.27 0.00 0.00 60.65 59.14 3mka h LYS 451 Cb 0.37 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.09 3mka h LYS 451 CO 0.02 0.28 -1.42 0.87 -2.27 0.00 0.00 179.45 176.94 3mka h LYS 452 N 0.44 0.23 0.00 1.90 1.79 -1.27 -3.38 116.57 116.28 3mka h LYS 452 Ca 0.38 -0.39 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 3mka h LYS 452 Cb 0.85 0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.65 3mka h LYS 452 CO -0.13 1.19 0.00 1.28 -1.08 0.00 0.00 179.45 180.71 3mka n LEU 453 N -3.94 0.25 -0.26 2.94 4.77 -0.67 -4.38 117.00 115.71 3mka n LEU 453 Ca -0.25 0.53 -0.02 0.00 -0.03 0.00 0.00 56.01 56.24 3mka n LEU 453 Cb 0.89 -0.46 0.10 0.00 -2.33 0.00 0.00 43.42 41.62 3mka n LEU 453 CO 0.40 -0.11 1.14 0.22 -1.33 0.00 0.00 177.39 177.70 3mka h TYR 454 N 0.00 0.83 -0.32 -1.77 3.20 -0.77 -2.28 116.97 115.86 3mka h TYR 454 Ca 0.00 0.02 0.09 0.00 3.14 0.00 0.00 58.73 61.99 3mka h TYR 454 Cb 0.52 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 3mka h TYR 454 CO 0.00 0.44 0.37 0.66 -1.64 0.00 0.00 178.16 177.98 3mka h SER 455 N 0.84 0.00 0.30 -2.11 4.64 -1.85 0.15 113.55 115.52 3mka h SER 455 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 3mka h SER 455 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3mka h SER 455 CO -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.81 3mka n GLN 456 N -3.69 0.52 -3.04 4.77 6.02 -0.86 -4.75 117.38 116.36 3mka n GLN 456 Ca 0.05 0.03 -0.41 0.00 -0.01 0.00 0.00 57.00 56.67 3mka n GLN 456 Cb 0.52 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 30.23 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 -2.37 4.97 0.00 5.09 1.01 0.52 -4.75 120.40 124.87 3mka s VAL 457 Ca 0.29 1.34 0.00 0.00 0.00 0.00 0.00 61.98 63.61 3mka s VAL 457 Cb 0.17 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.54 3mka s VAL 457 CO 0.35 0.07 0.01 0.35 0.00 0.00 0.00 175.10 175.88 3mka n THR 458 N 4.74 0.00 -3.75 3.92 -2.24 -1.26 -4.94 114.28 110.75 3mka n THR 458 Ca 0.01 -0.10 -0.03 0.00 -2.27 0.00 0.00 64.05 61.66 3mka n THR 458 Cb 0.49 1.05 -0.01 0.00 -2.10 0.00 0.00 70.33 69.76 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 -0.18 -0.17 0.30 3.42 1.47 -1.26 -4.56 116.67 115.69 3mka s ASP 459 Ca 0.00 -0.40 0.06 0.00 1.18 0.00 0.00 52.55 53.39 3mka s ASP 459 Cb 0.00 0.48 0.82 0.00 -0.34 0.00 0.00 42.92 43.88 3mka s ASP 459 CO 0.00 -0.88 1.68 1.23 0.68 0.00 0.00 175.17 177.87 3mka h GLY 460 N 2.00 1.65 1.18 2.12 0.00 -1.93 0.25 103.07 108.35 3mka h GLY 460 Ca -0.24 -0.16 -0.16 0.00 0.00 0.00 0.00 47.33 46.77 3mka h GLY 460 CO 0.26 -0.34 -0.38 -0.55 0.00 0.00 0.00 176.54 175.52 3mka h ASP 461 N 0.35 0.96 -0.28 0.19 3.32 -1.98 0.16 116.42 119.14 3mka h ASP 461 Ca 0.61 -0.44 -0.17 0.00 0.02 0.00 0.00 57.03 57.06 3mka h ASP 461 Cb 1.23 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.51 3mka h ASP 461 CO -0.58 1.22 -0.48 0.77 -1.72 0.00 0.00 179.24 178.46 3mka h SER 462 N 0.74 0.90 -0.79 6.45 4.64 -1.68 -1.91 113.55 121.90 3mka h SER 462 Ca 0.06 -0.53 0.03 0.00 -0.47 0.00 0.00 61.79 60.88 3mka h SER 462 Cb 0.97 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 62.75 3mka h SER 462 CO 0.09 1.26 0.52 1.23 -0.87 0.00 0.00 176.83 179.06 3mka h GLY 463 N 0.57 1.11 2.00 -0.77 0.00 -0.33 0.25 103.07 105.91 3mka h GLY 463 Ca 0.02 -0.40 -0.10 0.00 0.00 0.00 0.00 47.33 46.85 3mka h GLY 463 CO 0.11 0.36 -0.48 -2.00 0.00 0.00 0.00 176.54 174.53 3mka h LEU 464 N 1.01 0.00 -0.06 3.11 5.85 -0.55 -2.66 115.31 122.01 3mka h LEU 464 Ca 0.31 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.90 3mka h LEU 464 Cb -0.02 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.02 3mka h LEU 464 CO -0.08 0.48 -0.44 -0.09 -0.34 0.00 0.00 178.44 177.97 3mka h ARG 465 N 0.00 0.41 -0.07 1.25 2.43 -0.24 -2.66 114.38 115.50 3mka h ARG 465 Ca -0.00 -0.35 0.01 0.00 -0.81 0.00 0.00 59.98 58.82 3mka h ARG 465 Cb 1.09 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.72 3mka h ARG 465 CO 0.06 1.00 0.05 0.28 -1.51 0.00 0.00 179.97 179.85 3mka h VAL 466 N -0.07 0.99 -0.12 0.20 2.07 -0.99 -1.55 116.25 116.77 3mka h VAL 466 Ca -0.04 -0.02 -0.09 0.00 0.82 0.00 0.00 66.70 67.37 3mka h VAL 466 Cb 1.10 0.94 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 3mka h VAL 466 CO 0.09 0.01 -0.29 0.00 0.02 0.00 0.00 177.57 177.40 3mka h ALA 467 N 1.96 0.20 0.00 1.67 0.00 -1.42 -1.81 119.26 119.87 3mka h ALA 467 Ca 0.03 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 3mka h ALA 467 Cb 0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3mka h ALA 467 CO -0.00 0.22 -0.15 0.28 0.00 0.00 0.00 179.25 179.59 3mka h VAL 468 N -0.00 0.41 0.19 0.00 2.07 -1.10 -2.47 116.25 115.35 3mka h VAL 468 Ca -0.00 -0.88 -0.29 0.00 0.82 0.00 0.00 66.70 66.34 3mka h VAL 468 Cb 0.89 1.64 0.03 0.00 -1.52 0.00 0.00 31.29 32.34 3mka h VAL 468 CO 0.06 0.15 -1.27 -0.08 0.02 0.00 0.00 177.57 176.45 3mka h GLU 469 N 0.00 0.52 -0.40 1.57 4.81 -1.20 -2.27 114.58 117.60 3mka h GLU 469 Ca -0.00 -0.82 -0.00 0.00 -0.13 0.00 0.00 59.36 58.41 3mka h GLU 469 Cb 0.63 0.29 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 3mka h GLU 469 CO 0.02 1.38 0.24 0.00 -0.73 0.00 0.00 179.01 179.92 3mka h ALA 470 N 0.18 1.67 0.00 2.92 0.00 -1.17 0.59 119.26 123.44 3mka h ALA 470 Ca -0.21 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 3mka h ALA 470 Cb 1.98 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 3mka h ALA 470 CO 0.24 0.29 -0.38 1.25 0.00 0.00 0.00 179.25 180.65 3mka h LEU 471 N 0.55 0.00 -0.14 0.00 5.85 -1.45 -1.84 115.31 118.28 3mka h LEU 471 Ca 0.15 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.73 3mka h LEU 471 Cb -0.02 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.01 3mka h LEU 471 CO -0.03 0.38 -0.42 0.22 -0.34 0.00 0.00 178.44 178.25 3mka h TYR 472 N 0.00 0.70 -0.61 1.25 3.20 -0.35 -2.40 116.97 118.77 3mka h TYR 472 Ca -0.00 -0.28 -0.06 0.00 3.14 0.00 0.00 58.73 61.53 3mka h TYR 472 Cb 1.13 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.26 3mka h TYR 472 CO 0.00 1.04 0.16 -0.44 -1.64 0.00 0.00 178.16 177.28 3mka h ASP 473 N 0.17 0.88 -0.66 -2.11 3.32 -0.98 -1.74 116.42 115.30 3mka h ASP 473 Ca -0.01 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 56.81 3mka h ASP 473 Cb 1.05 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.34 3mka h ASP 473 CO 0.09 0.85 0.15 0.00 -1.72 0.00 0.00 179.24 178.61 3mka h ALA 474 N 1.26 1.00 0.00 3.45 0.00 -1.30 -2.44 119.26 121.23 3mka h ALA 474 Ca 0.20 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3mka h ALA 474 Cb 0.31 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3mka h ALA 474 CO -0.00 0.65 -0.19 0.00 0.00 0.00 0.00 179.25 179.71 3mka h ALA 475 N 1.14 1.01 -0.29 0.00 0.00 -0.87 -1.85 119.26 118.40 3mka h ALA 475 Ca 0.21 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 3mka h ALA 475 Cb 0.37 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3mka h ALA 475 CO 0.00 0.23 -0.43 0.22 0.00 0.00 0.00 179.25 179.28 3mka h ASP 476 N 0.00 0.77 -0.01 0.00 3.58 -0.85 -3.32 116.42 116.59 3mka h ASP 476 Ca -0.00 -0.36 0.00 0.00 0.42 0.00 0.00 57.03 57.09 3mka h ASP 476 Cb 0.73 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 41.56 3mka h ASP 476 CO 0.02 1.10 -0.25 0.47 -2.88 0.00 0.00 179.24 177.70 3mka n ASP 477 N -4.03 1.80 -3.90 2.28 8.00 -1.09 -4.91 116.55 114.71 3mka n ASP 477 Ca -0.02 -1.40 -0.25 0.00 0.71 0.00 0.00 54.79 53.83 3mka n ASP 477 Cb 0.55 0.35 -0.17 0.00 -0.02 0.00 0.00 41.12 41.83 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 -1.76 1.79 0.19 -2.24 2.15 -0.72 -5.00 116.67 111.08 3mka s ASP 478 Ca 0.15 -0.23 0.24 0.00 0.43 0.00 0.00 52.55 53.13 3mka s ASP 478 Cb 0.13 -0.70 0.91 0.00 -0.30 0.00 0.00 42.92 42.96 3mka s ASP 478 CO 0.35 -0.09 1.73 -1.54 -0.17 0.00 0.00 175.17 175.45 3mka n SER 479 N 4.61 0.59 0.10 -0.34 3.41 -1.26 -2.82 113.62 117.91 3mka n SER 479 Ca -0.16 0.60 0.13 0.00 -0.26 0.00 0.00 58.87 59.18 3mka n SER 479 Cb 0.50 -0.74 0.32 0.00 -0.26 0.00 0.00 64.21 64.03 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 2.45 0.87 -3.18 7.33 0.00 -1.93 -3.43 119.26 121.38 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 0.50 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.14 3mka h ALA 480 CO 0.00 0.00 -0.53 0.99 0.00 0.00 0.00 179.25 179.71 3mka s THR 481 N -3.13 5.11 -0.06 0.00 2.01 -1.13 -4.42 115.64 114.01 3mka s THR 481 Ca 0.09 0.09 -0.12 0.00 0.31 0.00 0.00 61.69 62.06 3mka s THR 481 Cb 0.12 -3.35 -0.05 0.00 0.01 0.00 0.00 72.50 69.24 3mka s THR 481 CO 0.64 0.40 0.30 -0.83 -0.69 0.00 0.00 174.62 174.44 3mka s GLY 482 N 0.73 2.34 0.06 4.40 0.00 -1.26 -4.52 107.32 109.06 3mka s GLY 482 Ca 0.06 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.39 3mka s GLY 482 CO 0.02 0.02 0.08 0.61 0.00 0.00 0.00 173.10 173.82 3mka n GLY 483 N 2.10 1.36 3.66 0.20 0.00 -1.26 -4.40 105.19 106.86 3mka n GLY 483 Ca -0.16 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.39 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 -2.41 4.14 -0.63 1.61 0.04 -1.26 -4.93 135.00 131.56 3mka s PRO 484 Ca 0.05 2.61 -0.21 0.00 0.04 0.00 0.00 61.00 63.49 3mka s PRO 484 Cb -0.00 -4.07 0.08 0.00 0.04 0.00 0.00 34.50 30.54 3mka s PRO 484 CO 0.04 -0.94 0.88 0.34 0.04 0.00 0.00 177.00 177.36 3mka s ASP 485 N 4.17 6.19 0.35 6.66 -1.08 -0.57 -4.89 116.67 127.49 3mka s ASP 485 Ca 0.87 -1.08 0.26 0.00 -0.52 0.00 0.00 52.55 52.09 3mka s ASP 485 Cb -0.43 -2.38 0.82 0.00 -1.46 0.00 0.00 42.92 39.47 3mka s ASP 485 CO 0.41 -1.32 1.76 -0.07 0.52 0.00 0.00 175.17 176.46 3mka h LEU 486 N 10.89 0.00 0.08 -1.34 4.07 -1.92 0.89 115.31 127.98 3mka h LEU 486 Ca -0.29 0.00 -0.29 0.00 0.08 0.00 0.00 57.88 57.39 3mka h LEU 486 Cb 1.08 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.84 3mka h LEU 486 CO 1.15 0.00 -1.21 0.58 -1.08 0.00 0.00 178.44 177.88 3mka h VAL 487 N 0.00 1.34 0.00 1.22 2.07 -1.96 -3.33 116.25 115.59 3mka h VAL 487 Ca 0.00 -2.57 0.00 0.00 0.82 0.00 0.00 66.70 64.95 3mka h VAL 487 Cb 0.70 2.71 0.00 0.00 -1.52 0.00 0.00 31.29 33.17 3mka h VAL 487 CO 0.00 0.77 -1.26 0.54 0.02 0.00 0.00 177.57 177.64 3mka n ARG 488 N -3.74 0.23 -2.62 1.57 1.74 -1.23 -5.00 116.66 107.62 3mka n ARG 488 Ca -0.12 -0.06 -0.07 0.00 -0.77 0.00 0.00 57.85 56.84 3mka n ARG 488 Cb 0.97 -1.52 0.03 0.00 -1.02 0.00 0.00 32.46 30.92 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 1.41 0.25 3.44 -0.13 0.00 0.25 -5.04 105.19 105.37 3mka n GLY 489 Ca 0.01 -0.30 -0.33 0.00 0.00 0.00 0.00 46.02 45.40 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 -3.12 3.22 0.22 -0.61 1.01 -0.85 -5.00 121.20 116.07 3mka s ILE 490 Ca 0.06 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 60.10 3mka s ILE 490 Cb -0.03 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 40.06 3mka s ILE 490 CO 0.25 0.55 0.08 -0.36 0.00 0.00 0.00 174.94 175.46 3mka s PHE 491 N -0.07 1.35 0.92 3.97 0.08 -1.26 -1.51 117.98 121.46 3mka s PHE 491 Ca -0.02 -1.20 -0.10 0.00 0.12 0.00 0.00 56.93 55.73 3mka s PHE 491 Cb -0.14 -0.76 0.15 0.00 -0.57 0.00 0.00 43.02 41.71 3mka s PHE 491 CO 0.04 -0.39 1.14 -2.14 -0.10 0.00 0.00 175.22 173.76 3mka s PRO 492 N -4.04 0.94 0.05 0.24 0.02 -1.26 -4.79 135.00 126.15 3mka s PRO 492 Ca 0.35 1.49 0.03 0.00 0.02 0.00 0.00 61.00 62.88 3mka s PRO 492 Cb 0.07 -1.72 -0.04 0.00 0.02 0.00 0.00 34.50 32.83 3mka s PRO 492 CO 0.11 -2.67 0.01 0.95 -0.33 0.00 0.00 177.00 175.07 3mka s THR 493 N -2.65 4.13 0.07 0.99 -4.23 -0.87 -4.94 115.64 108.14 3mka s THR 493 Ca 0.67 -0.78 -0.02 0.00 -1.18 0.00 0.00 61.69 60.38 3mka s THR 493 Cb -0.23 -2.91 -0.04 0.00 1.34 0.00 0.00 72.50 70.67 3mka s THR 493 CO 0.58 0.24 0.01 0.00 -0.54 0.00 0.00 174.62 174.91 3mka s ALA 494 N -1.21 0.50 -0.01 3.99 0.00 -1.26 -1.60 121.76 122.17 3mka s ALA 494 Ca 0.23 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.99 3mka s ALA 494 Cb -0.12 0.40 0.01 0.00 0.00 0.00 0.00 23.12 23.41 3mka s ALA 494 CO 0.15 -0.41 0.00 0.08 0.00 0.00 0.00 175.76 175.59 3mka s VAL 495 N -3.94 0.04 0.11 0.00 1.01 0.02 -1.27 120.40 116.36 3mka s VAL 495 Ca 0.10 0.03 0.10 0.00 0.00 0.00 0.00 61.98 62.21 3mka s VAL 495 Cb 0.08 -0.07 -0.04 0.00 0.00 0.00 0.00 36.38 36.35 3mka s VAL 495 CO -0.08 0.04 -0.25 -0.51 0.00 0.00 0.00 175.10 174.30 3mka s ILE 496 N 0.30 2.03 -0.07 2.22 2.07 -0.26 -1.25 121.20 126.24 3mka s ILE 496 Ca -0.02 -1.64 -0.03 0.00 -1.41 0.00 0.00 60.65 57.55 3mka s ILE 496 Cb -0.04 -1.81 0.04 0.00 0.13 0.00 0.00 42.46 40.78 3mka s ILE 496 CO -0.01 0.06 0.13 -0.63 -1.91 0.00 0.00 174.94 172.58 3mka s ILE 497 N -1.07 -0.21 0.00 2.00 1.01 -0.39 0.00 121.20 122.54 3mka s ILE 497 Ca 0.11 0.36 0.00 0.00 0.00 0.00 0.00 60.65 61.12 3mka s ILE 497 Cb -0.10 -0.25 0.00 0.00 0.01 0.00 0.00 42.46 42.12 3mka s ILE 497 CO 0.05 0.15 0.00 -0.90 0.00 0.00 0.00 174.94 174.24 3mka n ASP 498 N 5.25 0.86 0.05 3.58 5.68 -1.18 -1.82 116.55 128.97 3mka n ASP 498 Ca -0.06 -0.61 0.21 0.00 -0.50 0.00 0.00 54.79 53.83 3mka n ASP 498 Cb 0.50 0.00 0.74 0.00 -1.14 0.00 0.00 41.12 41.22 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 2.25 -0.15 2.12 0.00 -1.95 -0.68 119.26 121.85 3mka h ALA 499 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3mka h ALA 499 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3mka h ALA 499 CO 0.00 -0.66 0.00 -0.25 0.00 0.00 0.00 179.25 178.34 3mka n ASP 500 N -3.94 0.93 0.00 0.00 8.00 -1.26 -5.03 116.55 115.26 3mka n ASP 500 Ca 0.08 -1.87 0.00 0.00 0.71 0.00 0.00 54.79 53.71 3mka n ASP 500 Cb 0.62 -0.10 0.00 0.00 -0.02 0.00 0.00 41.12 41.62 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 0.84 0.77 3.76 0.44 0.00 -0.26 -5.02 105.19 105.71 3mka n GLY 501 Ca 0.09 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.62 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 -1.34 3.41 -0.02 4.61 0.00 0.41 -3.08 121.76 125.75 3mka s ALA 502 Ca 0.00 0.23 -0.03 0.00 0.00 0.00 0.00 51.96 52.16 3mka s ALA 502 Cb 0.00 -2.92 0.00 0.00 0.00 0.00 0.00 23.12 20.20 3mka s ALA 502 CO 0.00 0.13 0.08 0.14 0.00 0.00 0.00 175.76 176.10 3mka s VAL 503 N -0.26 0.02 0.10 0.00 -7.23 0.10 -4.97 120.40 108.17 3mka s VAL 503 Ca 0.36 -0.20 -0.31 0.00 -1.81 0.00 0.00 61.98 60.03 3mka s VAL 503 Cb -0.20 -0.18 -0.07 0.00 0.56 0.00 0.00 36.38 36.49 3mka s VAL 503 CO 0.22 -0.11 1.27 -1.81 -0.31 0.00 0.00 175.10 174.36 3mka s ASP 504 N -0.32 6.99 0.24 4.85 1.01 -1.26 -1.11 116.67 127.07 3mka s ASP 504 Ca -0.04 2.16 -0.30 0.00 0.71 0.00 0.00 52.55 55.09 3mka s ASP 504 Cb -0.03 -2.59 -0.09 0.00 1.01 0.00 0.00 42.92 41.23 3mka s ASP 504 CO 0.00 -0.52 1.06 -0.69 0.21 0.00 0.00 175.17 175.23 3mka s VAL 505 N 0.89 3.72 0.25 -1.27 1.01 -0.40 -4.92 120.40 119.68 3mka s VAL 505 Ca 0.60 1.66 -0.30 0.00 0.00 0.00 0.00 61.98 63.94 3mka s VAL 505 Cb -0.33 -4.06 -0.09 0.00 0.00 0.00 0.00 36.38 31.91 3mka s VAL 505 CO 0.31 0.36 1.09 -2.16 0.00 0.00 0.00 175.10 174.71 3mka s PRO 506 N -1.09 4.64 0.21 2.72 0.04 -1.26 -4.69 135.00 135.57 3mka s PRO 506 Ca 0.45 1.76 -0.19 0.00 0.04 0.00 0.00 61.00 63.07 3mka s PRO 506 Cb -0.30 -3.22 0.20 0.00 0.04 0.00 0.00 34.50 31.22 3mka s PRO 506 CO 0.37 0.19 1.57 1.49 0.04 0.00 0.00 177.00 180.66 3mka h GLU 507 N 4.22 -0.06 -0.98 4.56 4.81 -1.94 -0.97 114.58 124.23 3mka h GLU 507 Ca -0.46 0.00 0.19 0.00 -0.13 0.00 0.00 59.36 58.97 3mka h GLU 507 Cb 1.21 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.51 3mka h GLU 507 CO 0.69 -0.04 0.61 0.66 -0.73 0.00 0.00 179.01 180.20 3mka h SER 508 N -0.07 0.69 0.56 1.04 4.64 -1.99 0.25 113.55 118.68 3mka h SER 508 Ca 0.30 0.08 -0.02 0.00 -0.47 0.00 0.00 61.79 61.68 3mka h SER 508 Cb 0.58 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.62 3mka h SER 508 CO -0.86 0.26 -0.10 -0.09 -0.87 0.00 0.00 176.83 175.16 3mka h ARG 509 N 0.68 0.00 0.00 4.77 9.65 -1.56 -1.38 114.38 126.54 3mka h ARG 509 Ca 0.54 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 59.24 3mka h ARG 509 Cb 0.96 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.51 3mka h ARG 509 CO -0.31 0.10 -1.02 0.82 2.80 0.00 0.00 179.97 182.36 3mka h ILE 510 N 0.00 1.00 -0.71 1.20 2.04 -0.77 -3.09 117.51 117.18 3mka h ILE 510 Ca -0.00 -2.14 0.15 0.00 1.00 0.00 0.00 64.86 63.87 3mka h ILE 510 Cb 0.41 2.28 -0.11 0.00 -0.74 0.00 0.00 36.82 38.66 3mka h ILE 510 CO 0.01 0.34 0.15 0.00 0.00 0.00 0.00 178.15 178.66 3mka h ALA 511 N -0.44 0.89 0.38 1.87 0.00 -0.56 0.24 119.26 121.64 3mka h ALA 511 Ca -0.28 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3mka h ALA 511 Cb 1.21 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 3mka h ALA 511 CO -0.17 -0.34 -0.47 1.49 0.00 0.00 0.00 179.25 179.76 3mka h GLU 512 N 0.25 -0.83 -0.88 0.00 4.81 -1.39 0.08 114.58 116.61 3mka h GLU 512 Ca 0.40 0.06 0.21 0.00 -0.13 0.00 0.00 59.36 59.90 3mka h GLU 512 Cb 0.67 0.19 -0.06 0.00 0.63 0.00 0.00 28.75 30.18 3mka h GLU 512 CO -0.51 -0.55 0.60 1.25 -0.73 0.00 0.00 179.01 179.07 3mka h LEU 513 N -0.86 0.31 0.47 1.64 5.85 -1.03 -1.23 115.31 120.45 3mka h LEU 513 Ca -0.05 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 3mka h LEU 513 Cb 0.77 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.78 3mka h LEU 513 CO -0.11 0.12 -0.22 0.00 -0.34 0.00 0.00 178.44 177.89 3mka h ALA 514 N 1.61 -0.63 -0.97 1.25 0.00 0.35 -2.70 119.26 118.18 3mka h ALA 514 Ca 0.45 -0.19 0.19 0.00 0.00 0.00 0.00 54.91 55.36 3mka h ALA 514 Cb 1.28 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 19.22 3mka h ALA 514 CO -0.14 -0.68 0.61 0.00 0.00 0.00 0.00 179.25 179.04 3mka h ARG 515 N -0.96 0.63 -0.58 0.00 3.08 0.11 0.76 114.38 117.43 3mka h ARG 515 Ca -0.06 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 3mka h ARG 515 Cb 0.58 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.47 3mka h ARG 515 CO 0.10 0.42 0.24 0.00 -1.07 0.00 0.00 179.97 179.66 3mka h ALA 516 N 1.62 0.75 -0.51 0.04 0.00 -1.26 -1.12 119.26 118.78 3mka h ALA 516 Ca 0.53 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.23 3mka h ALA 516 Cb 0.96 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3mka h ALA 516 CO -0.29 0.36 0.12 0.82 0.00 0.00 0.00 179.25 180.26 3mka h ILE 517 N 0.80 1.24 -0.53 0.00 2.04 -0.56 0.30 117.51 120.80 3mka h ILE 517 Ca 0.19 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 65.15 3mka h ILE 517 Cb 0.19 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 3mka h ILE 517 CO -0.02 0.31 0.17 0.40 0.00 0.00 0.00 178.15 179.02 3mka h ILE 518 N 0.71 1.23 -0.63 -0.67 2.04 -1.04 0.54 117.51 119.70 3mka h ILE 518 Ca 0.16 -0.77 -0.05 0.00 1.00 0.00 0.00 64.86 65.20 3mka h ILE 518 Cb 0.34 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 3mka h ILE 518 CO 0.00 0.29 0.20 -0.08 0.00 0.00 0.00 178.15 178.56 3mka h GLU 519 N 0.72 0.98 -0.80 2.37 4.57 -1.06 -0.38 114.58 120.99 3mka h GLU 519 Ca 0.17 -0.21 -0.05 0.00 -1.18 0.00 0.00 59.36 58.10 3mka h GLU 519 Cb 0.27 -0.14 -0.04 0.00 -0.16 0.00 0.00 28.75 28.68 3mka h GLU 519 CO -0.01 0.86 0.32 1.03 -1.18 0.00 0.00 179.01 180.03 3mka h SER 520 N 0.90 1.10 -0.44 1.04 0.87 -0.57 -0.31 113.55 116.15 3mka h SER 520 Ca 0.20 -0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 3mka h SER 520 Cb 0.28 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 3mka h SER 520 CO -0.01 0.98 0.17 0.03 -0.53 0.00 0.00 176.83 177.47 3mka h ARG 521 N 1.16 0.72 0.00 2.24 2.47 -0.50 -3.51 114.38 116.97 3mka h ARG 521 Ca 0.27 -0.11 0.00 0.00 -1.26 0.00 0.00 59.98 58.87 3mka h ARG 521 Cb 0.22 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.41 3mka h ARG 521 CO -0.02 0.62 0.00 0.45 0.56 0.00 0.00 179.97 181.58