#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kg1 s ASP 278 N 0.00 -0.16 0.32 1.61 2.15 -1.26 -5.19 116.67 114.14 2kg1 s ASP 278 Ca 0.00 -0.36 -0.08 0.00 0.43 0.00 0.00 52.55 52.55 2kg1 s ASP 278 Cb 0.00 0.44 0.01 0.00 -0.30 0.00 0.00 42.92 43.07 2kg1 s ASP 278 CO 0.00 -0.81 0.52 -0.44 -0.17 0.00 0.00 175.17 174.27 2kg1 s SER 279 N -2.73 0.44 -0.02 -0.34 0.01 -1.26 -5.18 113.70 104.62 2kg1 s SER 279 Ca 0.02 -1.26 -0.06 0.00 1.31 0.00 0.00 55.95 55.97 2kg1 s SER 279 Cb 0.02 0.66 0.01 0.00 0.21 0.00 0.00 66.02 66.92 2kg1 s SER 279 CO -0.11 -1.30 0.13 -1.61 0.41 0.00 0.00 173.24 170.76 2kg1 s GLU 280 N -3.27 0.32 0.30 12.44 2.02 -1.26 -5.17 118.70 124.07 2kg1 s GLU 280 Ca 0.26 -0.13 -0.02 0.00 0.02 0.00 0.00 54.97 55.10 2kg1 s GLU 280 Cb -0.01 0.14 -0.01 0.00 0.10 0.00 0.00 34.13 34.34 2kg1 s GLU 280 CO 0.15 -0.06 0.36 -0.06 0.02 0.00 0.00 175.26 175.67 2kg1 s PHE 281 N -0.69 1.11 0.20 1.61 0.08 -1.26 -5.19 117.98 113.84 2kg1 s PHE 281 Ca -0.08 -1.30 -0.03 0.00 0.12 0.00 0.00 56.93 55.65 2kg1 s PHE 281 Cb -0.05 -0.27 -0.03 0.00 -0.57 0.00 0.00 43.02 42.10 2kg1 s PHE 281 CO 0.01 -0.96 0.18 0.95 -0.10 0.00 0.00 175.22 175.30 2kg1 s THR 282 N -3.52 0.01 0.07 0.64 -4.23 -1.26 -5.00 115.64 102.35 2kg1 s THR 282 Ca 0.33 -1.89 -0.05 0.00 -1.18 0.00 0.00 61.69 58.90 2kg1 s THR 282 Cb 0.02 -2.40 -0.02 0.00 1.34 0.00 0.00 72.50 71.44 2kg1 s THR 282 CO 0.18 -0.05 0.08 -0.69 -0.54 0.00 0.00 174.62 173.60 2kg1 s VAL 283 N -4.12 0.18 -0.31 2.29 1.01 -1.26 -5.07 120.40 113.12 2kg1 s VAL 283 Ca 0.35 -1.47 0.18 0.00 0.00 0.00 0.00 61.98 61.04 2kg1 s VAL 283 Cb 0.06 -1.38 0.47 0.00 0.00 0.00 0.00 36.38 35.53 2kg1 s VAL 283 CO 0.10 -0.81 1.05 0.00 0.00 0.00 0.00 175.10 175.44 2kg1 n GLN 284 N 0.10 1.30 -2.71 2.72 10.64 -1.26 -4.94 117.38 123.24 2kg1 n GLN 284 Ca -0.15 -3.13 -0.22 0.00 -1.83 0.00 0.00 57.00 51.68 2kg1 n GLN 284 Cb 0.61 -1.17 0.01 0.00 -0.86 0.00 0.00 30.24 28.83 2kg1 n GLN 284 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2kg1 n SER 285 N -0.29 -6.02 0.00 2.61 7.64 -1.26 -4.86 113.62 111.44 2kg1 n SER 285 Ca 0.07 -0.15 0.01 0.00 1.01 0.00 0.00 58.87 59.81 2kg1 n SER 285 Cb 0.82 -4.93 0.05 0.00 -1.01 0.00 0.00 64.21 59.13 2kg1 n SER 285 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2kg1 n THR 286 N -4.26 1.20 -1.55 0.44 -1.04 -1.26 -4.65 114.28 103.16 2kg1 n THR 286 Ca -0.18 0.30 -0.34 0.00 -2.04 0.00 0.00 64.05 61.78 2kg1 n THR 286 Cb 0.65 -1.27 -0.04 0.00 -1.82 0.00 0.00 70.33 67.86 2kg1 n THR 286 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2kg1 n THR 287 N -1.32 -0.08 -3.02 12.58 -2.24 -1.26 -4.71 114.28 114.22 2kg1 n THR 287 Ca 0.01 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.03 2kg1 n THR 287 Cb 0.02 -2.67 0.00 0.00 -2.10 0.00 0.00 70.33 65.57 2kg1 n THR 287 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2kg1 n GLY 288 N 6.08 -0.55 3.55 3.38 0.00 -1.09 -5.04 105.19 111.53 2kg1 n GLY 288 Ca 0.39 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 45.28 2kg1 n GLY 288 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kg1 s HIS 289 N -3.13 2.89 0.20 1.61 3.76 -1.19 -4.57 115.29 114.86 2kg1 s HIS 289 Ca 0.00 -0.05 -0.00 0.00 -0.15 0.00 0.00 55.06 54.86 2kg1 s HIS 289 Cb 0.00 -1.71 -0.04 0.00 1.11 0.00 0.00 32.58 31.94 2kg1 s HIS 289 CO 0.00 0.27 0.10 0.00 -0.85 0.00 0.00 174.74 174.27 2kg1 s VAL 291 N -4.04 0.01 0.69 0.00 1.01 -0.99 -1.73 120.40 115.35 2kg1 s VAL 291 Ca 0.35 -0.08 -0.11 0.00 0.00 0.00 0.00 61.98 62.14 2kg1 s VAL 291 Cb 0.07 -0.66 0.01 0.00 0.00 0.00 0.00 36.38 35.79 2kg1 s VAL 291 CO 0.10 -0.04 1.06 -1.00 0.00 0.00 0.00 175.10 175.22 2kg1 s HIS 292 N -0.13 3.20 -0.20 5.22 0.09 -0.59 -1.13 115.29 121.75 2kg1 s HIS 292 Ca -0.03 1.32 -0.09 0.00 -0.00 0.00 0.00 55.06 56.26 2kg1 s HIS 292 Cb -0.03 -2.90 0.08 0.00 -0.00 0.00 0.00 32.58 29.73 2kg1 s HIS 292 CO 0.02 -1.19 0.47 1.41 -0.00 0.00 0.00 174.74 175.44 2kg1 s MET 293 N -5.11 0.42 0.27 1.40 -2.45 -0.46 -2.73 119.30 110.63 2kg1 s MET 293 Ca 0.58 0.98 -0.07 0.00 -1.25 0.00 0.00 55.69 55.92 2kg1 s MET 293 Cb -0.13 0.18 -0.01 0.00 1.25 0.00 0.00 34.83 36.12 2kg1 s MET 293 CO 0.54 -0.19 0.41 1.03 1.05 0.00 0.00 175.02 177.86 2kg1 s ARG 294 N 1.94 1.59 0.00 4.11 0.52 -0.22 -2.55 118.95 124.35 2kg1 s ARG 294 Ca -0.07 -1.48 0.00 0.00 -0.52 0.00 0.00 55.73 53.66 2kg1 s ARG 294 Cb -0.09 0.42 0.00 0.00 0.52 0.00 0.00 34.95 35.80 2kg1 s ARG 294 CO -0.14 -0.64 0.00 0.41 0.02 0.00 0.00 175.30 174.95 2kg1 n GLY 295 N -0.41 1.77 0.00 -3.53 0.00 -1.26 -1.78 105.19 99.98 2kg1 n GLY 295 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2kg1 n GLY 295 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2kg1 n LEU 296 N 0.00 0.00 0.00 0.99 -0.00 -1.26 -4.92 117.00 111.81 2kg1 n LEU 296 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 56.01 55.98 2kg1 n LEU 296 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2kg1 n LEU 296 CO 0.00 0.00 0.26 -2.65 -0.00 0.00 0.00 177.39 175.00 2kg1 n PRO 297 N -0.07 0.00 -1.09 1.47 -0.02 -1.26 -0.41 135.00 133.62 2kg1 n PRO 297 Ca 0.00 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.50 2kg1 n PRO 297 Cb 0.00 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 2kg1 n PRO 297 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2kg1 n TYR 298 N -0.73 0.00 -0.00 6.00 0.18 -1.26 -2.08 117.16 119.27 2kg1 n TYR 298 Ca 0.00 -0.32 0.00 0.00 1.88 0.00 0.00 57.90 59.46 2kg1 n TYR 298 Cb 0.26 -0.04 0.00 0.00 -0.38 0.00 0.00 39.34 39.19 2kg1 n TYR 298 CO 0.00 0.00 0.00 0.36 -2.08 0.00 0.00 176.86 175.14 2kg1 n LYS 299 N 0.27 0.48 -2.07 -3.48 2.85 0.46 -4.98 118.16 111.68 2kg1 n LYS 299 Ca 0.01 -0.00 -0.04 0.00 -1.05 0.00 0.00 58.31 57.23 2kg1 n LYS 299 Cb 0.93 -0.04 0.00 0.00 -0.65 0.00 0.00 35.03 35.28 2kg1 n LYS 299 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2kg1 n ALA 300 N -0.07 -0.41 -2.51 0.58 0.00 -0.90 -5.12 120.51 112.09 2kg1 n ALA 300 Ca 0.00 -0.46 -0.14 0.00 0.00 0.00 0.00 53.44 52.85 2kg1 n ALA 300 Cb 0.00 0.37 -0.08 0.00 0.00 0.00 0.00 19.45 19.74 2kg1 n ALA 300 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2kg1 s THR 301 N -2.65 0.00 0.55 0.00 -4.23 -1.26 -4.53 115.64 103.51 2kg1 s THR 301 Ca 0.07 -1.83 0.33 0.00 -1.18 0.00 0.00 61.69 59.08 2kg1 s THR 301 Cb -0.01 -2.47 0.50 0.00 1.34 0.00 0.00 72.50 71.85 2kg1 s THR 301 CO 0.05 0.00 1.83 1.05 -0.54 0.00 0.00 174.62 177.01 2kg1 h GLU 302 N 2.36 0.00 0.00 3.99 4.11 -1.98 -0.87 114.58 122.19 2kg1 h GLU 302 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.12 2kg1 h GLU 302 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2kg1 h GLU 302 CO 0.44 0.00 0.05 0.27 0.07 0.00 0.00 179.01 179.84 2kg1 n ASN 303 N -4.11 0.27 -0.00 3.06 2.04 -1.26 -1.30 115.26 113.95 2kg1 n ASN 303 Ca 0.20 0.60 0.01 0.00 -0.44 0.00 0.00 54.58 54.95 2kg1 n ASN 303 Cb 1.06 -0.62 -0.01 0.00 -2.53 0.00 0.00 39.78 37.68 2kg1 n ASN 303 CO 0.00 0.00 0.00 -0.67 -0.44 0.00 0.00 177.26 176.15 2kg1 n ASP 304 N -1.85 3.96 0.36 0.53 2.03 -0.34 -4.58 116.55 116.65 2kg1 n ASP 304 Ca -0.01 -0.07 -0.17 0.00 0.52 0.00 0.00 54.79 55.06 2kg1 n ASP 304 Cb 0.07 1.08 -0.09 0.00 -0.72 0.00 0.00 41.12 41.46 2kg1 n ASP 304 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 2kg1 h ILE 305 N 0.00 0.31 0.00 5.18 2.04 -1.11 -1.78 117.51 122.15 2kg1 h ILE 305 Ca 0.00 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2kg1 h ILE 305 Cb 0.08 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2kg1 h ILE 305 CO 0.00 0.02 0.00 0.00 0.00 0.00 0.00 178.15 178.17 2kg1 n TYR 306 N -5.44 0.00 0.28 1.37 4.11 -1.09 -2.46 117.16 113.93 2kg1 n TYR 306 Ca -0.13 0.00 0.03 0.00 -0.00 0.00 0.00 57.90 57.80 2kg1 n TYR 306 Cb 0.37 -0.00 -0.01 0.00 -0.00 0.00 0.00 39.34 39.70 2kg1 n TYR 306 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 2kg1 n ASN 307 N -0.48 0.80 -0.00 9.48 5.15 -0.99 -4.56 115.26 124.66 2kg1 n ASN 307 Ca 0.00 -0.90 0.02 0.00 -0.60 0.00 0.00 54.58 53.10 2kg1 n ASN 307 Cb 0.01 0.59 -0.03 0.00 -0.53 0.00 0.00 39.78 39.81 2kg1 n ASN 307 CO 0.00 0.00 0.00 2.22 1.40 0.00 0.00 177.26 180.88 2kg1 n PHE 308 N -0.52 0.00 0.16 1.20 -1.74 -0.70 -4.81 117.46 111.05 2kg1 n PHE 308 Ca 0.02 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 56.78 2kg1 n PHE 308 Cb 0.12 -0.08 -0.08 0.00 1.52 0.00 0.00 39.48 40.96 2kg1 n PHE 308 CO 0.00 0.00 0.00 0.35 -0.56 0.00 0.00 176.76 176.55 2kg1 h PHE 309 N 0.00 -0.39 -1.78 2.97 3.04 -1.72 -3.49 116.94 115.56 2kg1 h PHE 309 Ca 0.00 -0.01 0.25 0.00 3.98 0.00 0.00 57.97 62.19 2kg1 h PHE 309 Cb 0.19 0.13 -0.13 0.00 2.56 0.00 0.00 35.95 38.70 2kg1 h PHE 309 CO 0.00 -0.06 0.70 -1.54 -2.02 0.00 0.00 178.31 175.39 2kg1 s SER 310 N -5.07 -0.14 0.00 0.41 1.04 -1.26 -4.82 113.70 103.86 2kg1 s SER 310 Ca -0.14 -0.17 0.16 0.00 0.48 0.00 0.00 55.95 56.28 2kg1 s SER 310 Cb 0.02 0.27 0.94 0.00 0.10 0.00 0.00 66.02 67.35 2kg1 s SER 310 CO 0.53 -0.49 1.36 -0.81 0.98 0.00 0.00 173.24 174.82 2kg1 n PRO 311 N -0.38 0.56 -0.78 4.02 -0.04 -1.26 -4.73 135.00 132.39 2kg1 n PRO 311 Ca -0.06 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.07 2kg1 n PRO 311 Cb 0.61 -1.44 0.13 0.00 -0.04 0.00 0.00 33.50 32.76 2kg1 n PRO 311 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2kg1 n LEU 312 N -0.94 0.15 -4.76 1.53 4.32 -1.26 -5.00 117.00 111.04 2kg1 n LEU 312 Ca 0.12 0.34 -0.31 0.00 -0.02 0.00 0.00 56.01 56.14 2kg1 n LEU 312 Cb 0.05 -1.24 0.10 0.00 -1.62 0.00 0.00 43.42 40.72 2kg1 n LEU 312 CO 0.09 -3.47 0.69 0.20 -1.22 0.00 0.00 177.39 173.68 2kg1 s ASN 313 N -2.09 4.33 -0.04 -1.43 0.01 -1.26 -4.93 114.94 109.52 2kg1 s ASN 313 Ca 0.58 1.65 0.01 0.00 -0.71 0.00 0.00 52.86 54.38 2kg1 s ASN 313 Cb -0.21 -2.37 0.08 0.00 0.41 0.00 0.00 41.25 39.16 2kg1 s ASN 313 CO 0.66 -2.12 0.91 -0.81 -1.51 0.00 0.00 177.10 174.24 2kg1 n PRO 314 N -3.56 1.27 0.00 -0.60 -0.04 -1.26 -4.43 135.00 126.37 2kg1 n PRO 314 Ca 0.08 -0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.19 2kg1 n PRO 314 Cb 0.54 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.68 2kg1 n PRO 314 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2kg1 n VAL 315 N 0.21 0.16 -2.47 0.52 0.24 -1.26 -4.74 118.33 110.99 2kg1 n VAL 315 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.35 2kg1 n VAL 315 Cb 0.52 -0.43 0.00 0.00 -1.47 0.00 0.00 33.84 32.46 2kg1 n VAL 315 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2kg1 n ARG 316 N 0.65 0.00 -1.54 7.34 1.85 -1.26 -4.50 116.66 119.20 2kg1 n ARG 316 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2kg1 n ARG 316 Cb 0.11 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.52 2kg1 n ARG 316 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 2kg1 n VAL 317 N 0.00 -3.28 -3.53 8.89 0.24 -1.26 -4.83 118.33 114.56 2kg1 n VAL 317 Ca 0.00 1.51 -0.10 0.00 -2.04 0.00 0.00 64.34 63.71 2kg1 n VAL 317 Cb 0.00 -2.03 -0.02 0.00 -1.47 0.00 0.00 33.84 30.32 2kg1 n VAL 317 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2kg1 s HIS 318 N -2.70 -0.44 0.03 6.34 2.46 -0.25 -4.89 115.29 115.84 2kg1 s HIS 318 Ca 0.00 0.18 -0.01 0.00 0.47 0.00 0.00 55.06 55.70 2kg1 s HIS 318 Cb 0.00 0.59 -0.02 0.00 -0.13 0.00 0.00 32.58 33.02 2kg1 s HIS 318 CO 0.00 -0.91 -0.02 0.42 -2.47 0.00 0.00 174.74 171.76 2kg1 s ILE 319 N -3.72 0.14 -0.44 0.89 1.01 -1.26 -1.86 121.20 115.95 2kg1 s ILE 319 Ca 0.04 -1.14 0.08 0.00 0.00 0.00 0.00 60.65 59.62 2kg1 s ILE 319 Cb -0.02 -0.61 0.26 0.00 0.01 0.00 0.00 42.46 42.10 2kg1 s ILE 319 CO -0.08 -0.63 0.59 1.21 0.00 0.00 0.00 174.94 176.03 2kg1 n GLU 320 N 1.18 1.17 -1.67 2.79 2.13 -0.41 -4.97 120.64 120.87 2kg1 n GLU 320 Ca -0.21 -3.57 0.00 0.00 0.66 0.00 0.00 57.16 54.03 2kg1 n GLU 320 Cb 0.57 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.79 2kg1 n GLU 320 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2kg1 n ILE 321 N 1.16 -5.52 0.00 6.31 5.41 -1.26 -2.62 119.36 122.84 2kg1 n ILE 321 Ca 0.23 2.51 0.00 0.00 1.00 0.00 0.00 62.75 66.50 2kg1 n ILE 321 Cb 0.51 -3.45 0.00 0.00 -0.71 0.00 0.00 39.64 35.99 2kg1 n ILE 321 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kg1 n GLY 322 N -0.79 -1.29 0.00 7.39 0.00 -1.26 -3.18 105.19 106.06 2kg1 n GLY 322 Ca 0.00 0.50 0.03 0.00 0.00 0.00 0.00 46.02 46.55 2kg1 n GLY 322 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2kg1 n PRO 323 N 0.00 0.51 0.00 1.61 -0.04 -0.88 -1.36 135.00 134.84 2kg1 n PRO 323 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2kg1 n PRO 323 Cb 0.00 -1.16 0.00 0.00 -0.04 0.00 0.00 33.50 32.30 2kg1 n PRO 323 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2kg1 n ASP 324 N -0.66 0.00 0.00 3.54 2.03 -1.26 -4.78 116.55 115.42 2kg1 n ASP 324 Ca 0.04 -0.98 0.00 0.00 0.52 0.00 0.00 54.79 54.37 2kg1 n ASP 324 Cb 0.02 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.42 2kg1 n ASP 324 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kg1 n GLY 325 N 0.00 -1.13 4.81 0.27 0.00 -1.09 -5.03 105.19 103.02 2kg1 n GLY 325 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2kg1 n GLY 325 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2kg1 n ARG 326 N -0.03 0.00 -2.90 1.61 3.00 -0.46 -3.97 116.66 113.90 2kg1 n ARG 326 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.85 57.72 2kg1 n ARG 326 Cb 0.03 -0.56 0.04 0.00 0.00 0.00 0.00 32.46 31.97 2kg1 n ARG 326 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2kg1 n VAL 327 N 0.00 -0.09 -4.00 5.15 0.31 -1.26 -4.76 118.33 113.69 2kg1 n VAL 327 Ca 0.00 -2.62 -0.10 0.00 -0.01 0.00 0.00 64.34 61.61 2kg1 n VAL 327 Cb 0.00 0.77 -0.04 0.00 -0.91 0.00 0.00 33.84 33.66 2kg1 n VAL 327 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2kg1 s THR 328 N -0.64 0.00 0.00 2.52 -1.32 -1.25 -5.10 115.64 109.85 2kg1 s THR 328 Ca 0.29 -1.41 0.00 0.00 -1.21 0.00 0.00 61.69 59.36 2kg1 s THR 328 Cb 0.30 -2.37 0.00 0.00 -1.51 0.00 0.00 72.50 68.92 2kg1 s THR 328 CO -0.08 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 172.94 2kg1 n GLY 329 N -0.44 0.83 0.55 6.08 0.00 -1.25 -3.98 105.19 106.97 2kg1 n GLY 329 Ca -0.02 -0.84 -0.02 0.00 0.00 0.00 0.00 46.02 45.14 2kg1 n GLY 329 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2kg1 n GLU 330 N 0.00 0.15 -4.28 1.61 0.28 -1.08 -4.94 120.64 112.39 2kg1 n GLU 330 Ca 0.00 -0.37 -0.15 0.00 -0.16 0.00 0.00 57.16 56.48 2kg1 n GLU 330 Cb 0.00 0.42 -0.10 0.00 1.43 0.00 0.00 31.44 33.18 2kg1 n GLU 330 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2kg1 s ALA 331 N -1.38 1.54 0.29 -1.84 0.00 -1.06 -1.28 121.76 118.03 2kg1 s ALA 331 Ca 0.03 -1.71 -0.07 0.00 0.00 0.00 0.00 51.96 50.21 2kg1 s ALA 331 Cb -0.01 0.71 -0.00 0.00 0.00 0.00 0.00 23.12 23.83 2kg1 s ALA 331 CO 0.02 -0.36 0.46 0.16 0.00 0.00 0.00 175.76 176.04 2kg1 s ASP 332 N -3.24 0.41 0.25 0.00 -4.77 -0.78 -1.36 116.67 107.18 2kg1 s ASP 332 Ca 0.29 -1.25 0.01 0.00 -3.30 0.00 0.00 52.55 48.31 2kg1 s ASP 332 Cb 0.07 0.61 -0.05 0.00 -1.09 0.00 0.00 42.92 42.46 2kg1 s ASP 332 CO 0.08 -1.21 0.12 0.68 0.70 0.00 0.00 175.17 175.53 2kg1 s VAL 333 N -3.50 0.36 0.16 2.11 -7.23 -0.28 -1.09 120.40 110.93 2kg1 s VAL 333 Ca 0.28 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.47 2kg1 s VAL 333 Cb 0.00 -2.58 -0.05 0.00 0.56 0.00 0.00 36.38 34.31 2kg1 s VAL 333 CO 0.15 0.00 -0.04 -1.61 -0.31 0.00 0.00 175.10 173.28 2kg1 s GLU 334 N -4.04 1.08 0.00 4.82 2.02 -1.26 -2.35 118.70 118.97 2kg1 s GLU 334 Ca 0.38 -1.50 -0.14 0.00 0.02 0.00 0.00 54.97 53.73 2kg1 s GLU 334 Cb 0.07 -0.42 0.02 0.00 0.10 0.00 0.00 34.13 33.90 2kg1 s GLU 334 CO 0.14 -0.04 0.30 -0.06 0.02 0.00 0.00 175.26 175.61 2kg1 s PHE 335 N -3.51 -0.15 -0.57 1.61 0.08 0.59 -4.42 117.98 111.61 2kg1 s PHE 335 Ca 0.20 0.16 -0.27 0.00 0.12 0.00 0.00 56.93 57.14 2kg1 s PHE 335 Cb 0.05 0.09 0.03 0.00 -0.57 0.00 0.00 43.02 42.62 2kg1 s PHE 335 CO 0.02 -0.42 1.13 0.00 -0.10 0.00 0.00 175.22 175.85 2kg1 s ALA 336 N -1.68 3.04 0.49 5.36 0.00 -1.26 -3.17 121.76 124.54 2kg1 s ALA 336 Ca -0.11 -0.93 0.00 0.00 0.00 0.00 0.00 51.96 50.92 2kg1 s ALA 336 Cb -0.04 -3.96 0.00 0.00 0.00 0.00 0.00 23.12 19.12 2kg1 s ALA 336 CO 0.02 -2.59 0.00 0.25 0.00 0.00 0.00 175.76 173.44 2kg1 n THR 337 N 6.55 -0.23 0.34 0.00 -2.24 -1.26 -3.21 114.28 114.22 2kg1 n THR 337 Ca 0.07 0.57 0.13 0.00 -2.27 0.00 0.00 64.05 62.54 2kg1 n THR 337 Cb 0.49 -1.02 0.55 0.00 -2.10 0.00 0.00 70.33 68.25 2kg1 n THR 337 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 2kg1 h HIS 338 N -1.30 0.00 -0.37 4.78 2.76 -1.89 -2.93 115.15 116.21 2kg1 h HIS 338 Ca -0.11 0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 57.92 2kg1 h HIS 338 Cb 1.27 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.22 2kg1 h HIS 338 CO 0.02 0.00 -0.34 0.93 -1.30 0.00 0.00 177.93 177.24 2kg1 h GLU 339 N 0.00 0.88 0.00 5.26 5.08 -1.96 -0.89 114.58 122.95 2kg1 h GLU 339 Ca 0.00 -0.46 -0.13 0.00 -1.00 0.00 0.00 59.36 57.78 2kg1 h GLU 339 Cb 0.30 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2kg1 h GLU 339 CO 0.00 1.10 -0.60 0.93 -1.00 0.00 0.00 179.01 179.44 2kg1 h GLU 340 N 0.69 0.00 -0.67 2.33 5.08 -1.49 -2.50 114.58 118.02 2kg1 h GLU 340 Ca 0.06 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 2kg1 h GLU 340 Cb 0.93 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 2kg1 h GLU 340 CO 0.09 0.60 0.16 0.00 -1.00 0.00 0.00 179.01 178.86 2kg1 h ALA 341 N 1.40 0.89 0.00 3.43 0.00 -1.29 -2.17 119.26 121.51 2kg1 h ALA 341 Ca -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 2kg1 h ALA 341 Cb 1.18 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2kg1 h ALA 341 CO 0.08 0.61 -0.15 -0.39 0.00 0.00 0.00 179.25 179.39 2kg1 h VAL 342 N 1.00 0.28 0.00 0.00 -1.51 -1.22 -2.31 116.25 112.50 2kg1 h VAL 342 Ca 0.21 -1.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.37 2kg1 h VAL 342 Cb 0.37 2.06 0.00 0.00 -2.13 0.00 0.00 31.29 31.59 2kg1 h VAL 342 CO 0.00 0.15 0.00 0.00 -1.23 0.00 0.00 177.57 176.49 2kg1 n ALA 343 N -2.14 1.89 0.34 5.19 0.00 -0.87 -2.40 120.51 122.52 2kg1 n ALA 343 Ca 0.03 -0.07 0.05 0.00 0.00 0.00 0.00 53.44 53.45 2kg1 n ALA 343 Cb 0.56 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.65 2kg1 n ALA 343 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kg1 n ALA 344 N -1.46 3.03 -2.09 0.00 0.00 -0.87 -4.81 120.51 114.30 2kg1 n ALA 344 Ca 0.05 -0.26 -0.38 0.00 0.00 0.00 0.00 53.44 52.85 2kg1 n ALA 344 Cb 0.21 -0.34 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 2kg1 n ALA 344 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2kg1 n MET 345 N -1.36 2.41 -0.50 0.00 0.00 -0.89 -4.20 117.12 112.59 2kg1 n MET 345 Ca 0.01 -2.72 0.00 0.00 0.00 0.00 0.00 57.70 54.99 2kg1 n MET 345 Cb 0.17 -3.46 0.00 0.00 0.00 0.00 0.00 33.22 29.93 2kg1 n MET 345 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 2kg1 n SER 346 N 9.80 0.00 -0.75 6.12 7.64 -1.26 -4.91 113.62 130.26 2kg1 n SER 346 Ca 0.48 -1.69 0.02 0.00 1.01 0.00 0.00 58.87 58.69 2kg1 n SER 346 Cb 0.44 -0.14 0.02 0.00 -1.01 0.00 0.00 64.21 63.52 2kg1 n SER 346 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2kg1 n LYS 347 N 0.00 0.10 -1.34 1.43 4.76 -1.26 -5.00 118.16 116.86 2kg1 n LYS 347 Ca 0.00 -1.40 -0.56 0.00 -2.87 0.00 0.00 58.31 53.49 2kg1 n LYS 347 Cb 0.64 -0.44 -0.10 0.00 -1.84 0.00 0.00 35.03 33.29 2kg1 n LYS 347 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2kg1 n ASP 348 N 0.04 1.28 -3.22 4.39 5.75 -1.26 -0.82 116.55 122.70 2kg1 n ASP 348 Ca 0.03 0.55 -0.19 0.00 -0.01 0.00 0.00 54.79 55.16 2kg1 n ASP 348 Cb 0.82 -1.05 -0.04 0.00 -1.03 0.00 0.00 41.12 39.83 2kg1 n ASP 348 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2kg1 n ARG 349 N 7.82 -1.73 0.00 0.11 1.85 -1.24 -4.93 116.66 118.54 2kg1 n ARG 349 Ca 0.50 0.06 0.00 0.00 -1.00 0.00 0.00 57.85 57.41 2kg1 n ARG 349 Cb 0.07 -4.03 0.00 0.00 -1.05 0.00 0.00 32.46 27.46 2kg1 n ARG 349 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2kg1 n ALA 350 N -2.91 0.00 -2.24 2.89 0.00 -0.00 -4.49 120.51 113.75 2kg1 n ALA 350 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.28 2kg1 n ALA 350 Cb 0.41 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.84 2kg1 n ALA 350 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2kg1 s ASN 351 N -1.43 4.97 0.00 0.00 0.01 -1.26 -0.04 114.94 117.19 2kg1 s ASN 351 Ca 0.00 -0.83 0.00 0.00 -0.71 0.00 0.00 52.86 51.32 2kg1 s ASN 351 Cb 0.00 -0.41 0.00 0.00 0.41 0.00 0.00 41.25 41.25 2kg1 s ASN 351 CO 0.00 -0.73 0.00 0.80 -1.51 0.00 0.00 177.10 175.66 2kg1 n MET 352 N -1.59 0.00 0.00 -0.60 0.00 -1.24 -4.77 117.12 108.92 2kg1 n MET 352 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.73 2kg1 n MET 352 Cb 0.62 -0.17 0.00 0.00 0.00 0.00 0.00 33.22 33.68 2kg1 n MET 352 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2kg1 n GLN 353 N -1.01 0.00 0.00 2.12 10.64 -1.26 -5.02 117.38 122.85 2kg1 n GLN 353 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2kg1 n GLN 353 Cb 0.00 -0.01 0.00 0.00 -0.86 0.00 0.00 30.24 29.37 2kg1 n GLN 353 CO 0.00 0.00 0.00 1.58 -1.83 0.00 0.00 177.06 176.81 2kg1 n HIS 354 N -0.79 0.00 -4.10 2.61 -0.00 -1.26 -5.15 115.22 106.53 2kg1 n HIS 354 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.60 2kg1 n HIS 354 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 29.99 29.92 2kg1 n HIS 354 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2kg1 s ARG 355 N -0.05 1.54 0.85 1.57 6.06 -1.26 -5.16 118.95 122.50 2kg1 s ARG 355 Ca 0.00 -1.54 -0.11 0.00 -2.50 0.00 0.00 55.73 51.58 2kg1 s ARG 355 Cb 0.00 0.39 0.10 0.00 0.06 0.00 0.00 34.95 35.51 2kg1 s ARG 355 CO 0.00 -0.60 1.09 1.52 -2.50 0.00 0.00 175.30 174.81 2kg1 s TYR 356 N -3.79 2.35 0.02 5.12 -0.85 -1.26 -3.64 117.35 115.30 2kg1 s TYR 356 Ca 0.31 1.43 -0.04 0.00 -0.52 0.00 0.00 57.07 58.25 2kg1 s TYR 356 Cb 0.02 -3.12 -0.01 0.00 0.38 0.00 0.00 41.96 39.23 2kg1 s TYR 356 CO 0.14 -2.20 0.06 0.42 -1.52 0.00 0.00 175.55 172.44 2kg1 s ILE 357 N -2.89 0.11 0.02 -3.49 -1.09 0.94 -4.84 121.20 109.96 2kg1 s ILE 357 Ca 0.63 -0.93 -0.04 0.00 -2.23 0.00 0.00 60.65 58.08 2kg1 s ILE 357 Cb -0.18 -0.54 -0.01 0.00 -1.58 0.00 0.00 42.46 40.15 2kg1 s ILE 357 CO 0.57 -0.51 0.05 -1.83 -1.23 0.00 0.00 174.94 171.99 2kg1 s GLU 358 N -1.84 0.43 -0.16 2.79 4.04 -0.73 -2.12 118.70 121.12 2kg1 s GLU 358 Ca -0.12 -0.57 -0.14 0.00 0.04 0.00 0.00 54.97 54.18 2kg1 s GLU 358 Cb -0.06 0.17 0.04 0.00 0.02 0.00 0.00 34.13 34.30 2kg1 s GLU 358 CO -0.01 -0.09 0.41 -0.48 -1.84 0.00 0.00 175.26 173.25 2kg1 s LEU 359 N -1.58 0.35 -0.03 1.83 -0.00 -1.26 -1.06 118.68 116.92 2kg1 s LEU 359 Ca -0.13 0.84 0.01 0.00 -0.00 0.00 0.00 54.13 54.85 2kg1 s LEU 359 Cb -0.07 1.42 0.02 0.00 -0.00 0.00 0.00 46.19 47.56 2kg1 s LEU 359 CO -0.01 -0.15 -0.03 0.12 -0.00 0.00 0.00 176.35 176.28 2kg1 s PHE 360 N 0.37 0.53 0.38 3.48 2.19 -1.10 -4.67 117.98 119.17 2kg1 s PHE 360 Ca -0.01 -0.11 -0.27 0.00 0.33 0.00 0.00 56.93 56.88 2kg1 s PHE 360 Cb -0.04 -0.51 -0.11 0.00 -1.31 0.00 0.00 43.02 41.05 2kg1 s PHE 360 CO -0.01 -0.14 1.22 -0.11 1.83 0.00 0.00 175.22 178.01 2kg1 n LEU 361 N 3.93 3.47 -2.71 6.12 0.00 -1.26 -1.54 117.00 125.01 2kg1 n LEU 361 Ca -0.25 1.15 -0.06 0.00 0.00 0.00 0.00 56.01 56.85 2kg1 n LEU 361 Cb 0.51 -1.46 0.06 0.00 0.00 0.00 0.00 43.42 42.54 2kg1 n LEU 361 CO 0.23 -0.75 0.12 -3.20 0.00 0.00 0.00 177.39 173.79 2kg1 n ASN 362 N 0.56 0.44 -3.37 1.96 5.15 -0.71 -4.81 115.26 114.48 2kg1 n ASN 362 Ca 0.06 -2.46 -0.08 0.00 -0.60 0.00 0.00 54.58 51.50 2kg1 n ASN 362 Cb 0.37 -0.05 0.00 0.00 -0.53 0.00 0.00 39.78 39.57 2kg1 n ASN 362 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2kg1 s SER 363 N -2.64 -0.12 0.17 1.20 1.04 -1.17 -3.17 113.70 109.01 2kg1 s SER 363 Ca 0.24 -0.90 -0.15 0.00 0.48 0.00 0.00 55.95 55.63 2kg1 s SER 363 Cb 0.42 0.79 0.02 0.00 0.10 0.00 0.00 66.02 67.35 2kg1 s SER 363 CO -0.02 -1.53 0.42 0.28 0.98 0.00 0.00 173.24 173.37 2kg1 s THR 364 N -3.07 0.05 -1.35 2.02 -1.32 -1.26 -5.01 115.64 105.69 2kg1 s THR 364 Ca 0.13 -0.90 0.00 0.00 -1.21 0.00 0.00 61.69 59.71 2kg1 s THR 364 Cb -0.06 -1.54 0.00 0.00 -1.51 0.00 0.00 72.50 69.39 2kg1 s THR 364 CO 0.09 -0.23 0.43 1.07 -2.21 0.00 0.00 174.62 173.77 2kg1 n THR 365 N -0.27 0.00 -1.93 5.08 5.66 -1.26 -3.27 114.28 118.30 2kg1 n THR 365 Ca -0.11 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.89 2kg1 n THR 365 Cb 0.63 -0.27 0.00 0.00 -1.55 0.00 0.00 70.33 69.14 2kg1 n THR 365 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kg1 n GLY 366 N 0.17 0.54 3.26 1.09 0.00 -1.26 -4.99 105.19 103.99 2kg1 n GLY 366 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2kg1 n GLY 366 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kg1 s ALA 367 N 0.00 -0.65 0.00 4.61 0.00 -1.20 -5.03 121.76 119.49 2kg1 s ALA 367 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 51.82 2kg1 s ALA 367 Cb 0.00 0.44 0.00 0.00 0.00 0.00 0.00 23.12 23.56 2kg1 s ALA 367 CO 0.00 -0.49 0.00 0.45 0.00 0.00 0.00 175.76 175.72 2kg1 n SER 368 N 0.25 0.00 -3.71 0.00 2.88 -1.26 -4.58 113.62 107.20 2kg1 n SER 368 Ca -0.17 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.30 2kg1 n SER 368 Cb 0.61 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.05 2kg1 n SER 368 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 2kg1 s ASN 369 N 0.00 -0.29 0.00 -3.46 2.47 -1.26 -2.67 114.94 109.73 2kg1 s ASN 369 Ca 0.00 -0.37 0.00 0.00 0.42 0.00 0.00 52.86 52.91 2kg1 s ASN 369 Cb 0.00 0.58 0.00 0.00 -1.45 0.00 0.00 41.25 40.38 2kg1 s ASN 369 CO 0.00 -1.04 0.00 0.61 -3.72 0.00 0.00 177.10 172.95 2kg1 n GLY 370 N -0.43 0.00 0.00 1.21 0.00 -1.26 -5.03 105.19 99.69 2kg1 n GLY 370 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2kg1 n GLY 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kg1 n ALA 371 N 0.00 0.33 -3.49 4.61 0.00 -1.26 -5.14 120.51 115.55 2kg1 n ALA 371 Ca 0.00 -0.08 -0.09 0.00 0.00 0.00 0.00 53.44 53.26 2kg1 n ALA 371 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 2kg1 n ALA 371 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2kg1 s TYR 372 N 0.00 0.27 0.00 0.00 1.13 -1.26 -5.07 117.35 112.43 2kg1 s TYR 372 Ca 0.00 -0.73 0.00 0.00 -1.41 0.00 0.00 57.07 54.93 2kg1 s TYR 372 Cb 0.00 0.47 0.00 0.00 -1.10 0.00 0.00 41.96 41.33 2kg1 s TYR 372 CO 0.00 -1.26 0.42 0.43 -2.51 0.00 0.00 175.55 172.63 2kg1 n SER 373 N -0.90 0.00 -1.31 -0.18 7.64 -1.26 -5.01 113.62 112.60 2kg1 n SER 373 Ca -0.04 -1.00 -0.13 0.00 1.01 0.00 0.00 58.87 58.71 2kg1 n SER 373 Cb 0.60 -0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.75 2kg1 n SER 373 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2kg1 n SER 374 N 0.00 -3.77 -0.13 6.43 2.88 -1.26 -4.63 113.62 113.14 2kg1 n SER 374 Ca 0.00 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 2kg1 n SER 374 Cb 0.50 -3.40 0.00 0.00 -0.75 0.00 0.00 64.21 60.56 2kg1 n SER 374 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2kg1 n GLN 375 N -1.75 0.00 0.00 -1.46 -0.06 -1.26 -4.93 117.38 107.92 2kg1 n GLN 375 Ca -0.13 -0.39 0.00 0.00 -2.00 0.00 0.00 57.00 54.48 2kg1 n GLN 375 Cb 0.46 -0.30 0.00 0.00 -4.06 0.00 0.00 30.24 26.33 2kg1 n GLN 375 CO 0.00 0.00 0.00 1.33 -0.20 0.00 0.00 177.06 178.19 2kg1 n VAL 376 N 0.00 0.00 -0.62 1.69 0.24 -1.26 -2.34 118.33 116.04 2kg1 n VAL 376 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2kg1 n VAL 376 Cb 0.53 -0.30 0.00 0.00 -1.47 0.00 0.00 33.84 32.61 2kg1 n VAL 376 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 2kg1 n MET 377 N 0.06 -0.33 -0.11 7.34 0.00 -1.26 -4.81 117.12 118.02 2kg1 n MET 377 Ca 0.00 -0.21 0.00 0.00 -0.00 0.00 0.00 57.70 57.49 2kg1 n MET 377 Cb 0.13 -0.69 0.00 0.00 0.00 0.00 0.00 33.22 32.66 2kg1 n MET 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2kg1 n GLN 378 N -0.01 0.00 -3.87 2.12 10.64 -1.06 -5.14 117.38 120.06 2kg1 n GLN 378 Ca 0.00 -0.23 -0.03 0.00 -1.83 0.00 0.00 57.00 54.90 2kg1 n GLN 378 Cb 0.16 -0.19 0.02 0.00 -0.86 0.00 0.00 30.24 29.37 2kg1 n GLN 378 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 2kg1 s GLY 379 N -0.08 0.11 0.08 2.61 0.00 -0.99 -5.15 107.32 103.90 2kg1 s GLY 379 Ca 0.00 -0.33 -0.17 0.00 0.00 0.00 0.00 44.72 44.22 2kg1 s GLY 379 CO 0.00 2.11 0.41 -0.29 0.00 0.00 0.00 173.10 175.33 2kg1 s MET 380 N -2.25 1.00 0.00 2.90 1.75 -1.26 -4.52 119.30 116.92 2kg1 s MET 380 Ca 0.21 -0.53 0.00 0.00 -1.25 0.00 0.00 55.69 54.12 2kg1 s MET 380 Cb -0.03 0.44 0.00 0.00 2.84 0.00 0.00 34.83 38.08 2kg1 s MET 380 CO 0.05 -0.37 0.00 0.41 -0.65 0.00 0.00 175.02 174.47