#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 -0.17 0.31 1.61 2.15 -1.26 -5.19 116.67 114.12 2kg1 s ASP 278 Ca 0.00 -0.51 -0.16 0.00 0.43 0.00 0.00 52.55 52.31 2kg1 s ASP 278 Cb 0.00 0.50 0.02 0.00 -0.30 0.00 0.00 42.92 43.14 2kg1 s ASP 278 CO 0.00 -0.93 0.66 -0.55 -0.17 0.00 0.00 175.17 174.17 2kg1 s SER 279 N -2.87 -0.04 0.19 -0.34 0.15 -1.26 -5.19 113.70 104.34 2kg1 s SER 279 Ca 0.08 -0.91 -0.16 0.00 0.70 0.00 0.00 55.95 55.66 2kg1 s SER 279 Cb 0.01 0.72 0.02 0.00 -1.71 0.00 0.00 66.02 65.07 2kg1 s SER 279 CO -0.06 -1.39 0.47 -1.83 1.20 0.00 0.00 173.24 171.64 2kg1 s GLU 280 N -3.44 1.32 0.29 5.44 -1.05 -1.26 -5.19 118.70 114.81 2kg1 s GLU 280 Ca 0.17 -0.91 -0.02 0.00 -0.15 0.00 0.00 54.97 54.06 2kg1 s GLU 280 Cb -0.04 0.49 -0.02 0.00 -0.44 0.00 0.00 34.13 34.13 2kg1 s GLU 280 CO 0.10 -0.55 0.34 -0.06 0.95 0.00 0.00 175.26 176.05 2kg1 s PHE 281 N -3.89 1.10 0.09 4.83 0.08 -1.26 -5.19 117.98 113.75 2kg1 s PHE 281 Ca 0.10 -1.29 -0.03 0.00 0.12 0.00 0.00 56.93 55.83 2kg1 s PHE 281 Cb -0.00 -0.29 -0.03 0.00 -0.57 0.00 0.00 43.02 42.13 2kg1 s PHE 281 CO -0.03 -0.92 0.07 0.95 -0.10 0.00 0.00 175.22 175.19 2kg1 s THR 282 N -3.60 0.15 -0.70 0.64 -4.23 -1.26 -5.04 115.64 101.60 2kg1 s THR 282 Ca 0.33 -1.68 0.24 0.00 -1.18 0.00 0.00 61.69 59.41 2kg1 s THR 282 Cb 0.02 -1.68 0.25 0.00 1.34 0.00 0.00 72.50 72.43 2kg1 s THR 282 CO 0.18 -0.70 1.74 0.52 -0.54 0.00 0.00 174.62 175.81 2kg1 n VAL 283 N -0.02 0.65 -0.96 2.29 0.31 -1.26 -4.89 118.33 114.45 2kg1 n VAL 283 Ca -0.11 -0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.21 2kg1 n VAL 283 Cb 0.62 -0.84 -0.00 0.00 -0.91 0.00 0.00 33.84 32.71 2kg1 n VAL 283 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kg1 n GLN 284 N -2.09 -1.08 -3.84 5.55 10.64 -1.16 -4.80 117.38 120.61 2kg1 n GLN 284 Ca 0.04 0.05 -0.07 0.00 -1.83 0.00 0.00 57.00 55.19 2kg1 n GLN 284 Cb 0.32 -3.97 -0.01 0.00 -0.86 0.00 0.00 30.24 25.71 2kg1 n GLN 284 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2kg1 s SER 285 N -1.01 -0.20 0.01 2.61 0.15 -1.26 -5.06 113.70 108.94 2kg1 s SER 285 Ca 0.00 -0.69 -0.07 0.00 0.70 0.00 0.00 55.95 55.88 2kg1 s SER 285 Cb 0.00 0.73 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 2kg1 s SER 285 CO 0.00 -1.37 0.13 -0.89 1.20 0.00 0.00 173.24 172.31 2kg1 s THR 286 N -3.53 0.09 -0.01 6.45 2.01 -1.26 -4.72 115.64 114.66 2kg1 s THR 286 Ca 0.12 -0.72 0.21 0.00 0.31 0.00 0.00 61.69 61.62 2kg1 s THR 286 Cb -0.05 -0.45 0.36 0.00 0.01 0.00 0.00 72.50 72.36 2kg1 s THR 286 CO 0.07 -0.39 1.14 0.41 -0.69 0.00 0.00 174.62 175.16 2kg1 n THR 287 N 1.41 0.03 -1.16 -0.82 -1.04 -1.26 -2.13 114.28 109.31 2kg1 n THR 287 Ca -0.23 -0.87 -0.22 0.00 -2.04 0.00 0.00 64.05 60.69 2kg1 n THR 287 Cb 0.56 0.92 0.18 0.00 -1.82 0.00 0.00 70.33 70.17 2kg1 n THR 287 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kg1 n GLY 288 N 0.37 4.37 3.63 3.41 0.00 -1.26 -4.62 105.19 111.10 2kg1 n GLY 288 Ca -0.00 -1.06 -0.34 0.00 0.00 0.00 0.00 46.02 44.62 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 -3.19 3.06 0.18 1.61 3.76 -1.20 -3.75 115.29 115.76 2kg1 s HIS 289 Ca 0.55 0.10 -0.00 0.00 -0.15 0.00 0.00 55.06 55.57 2kg1 s HIS 289 Cb 0.47 -1.76 -0.04 0.00 1.11 0.00 0.00 32.58 32.35 2kg1 s HIS 289 CO 0.11 0.39 0.07 0.00 -0.85 0.00 0.00 174.74 174.46 2kg1 s VAL 291 N -3.94 0.05 0.66 0.00 1.01 -0.95 -1.70 120.40 115.53 2kg1 s VAL 291 Ca 0.30 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.78 2kg1 s VAL 291 Cb 0.07 -0.64 0.02 0.00 0.00 0.00 0.00 36.38 35.84 2kg1 s VAL 291 CO 0.07 -0.23 1.00 -1.00 0.00 0.00 0.00 175.10 174.94 2kg1 s HIS 292 N -1.25 3.21 -0.20 5.22 3.76 -0.49 -0.88 115.29 124.66 2kg1 s HIS 292 Ca -0.13 0.76 -0.10 0.00 -0.15 0.00 0.00 55.06 55.44 2kg1 s HIS 292 Cb -0.05 -2.97 0.07 0.00 1.11 0.00 0.00 32.58 30.74 2kg1 s HIS 292 CO 0.04 -1.10 0.47 1.41 -0.85 0.00 0.00 174.74 174.71 2kg1 s MET 293 N -5.19 0.43 0.11 1.40 0.00 -0.58 -2.78 119.30 112.69 2kg1 s MET 293 Ca 0.57 0.95 -0.11 0.00 0.00 0.00 0.00 55.69 57.10 2kg1 s MET 293 Cb -0.11 0.12 0.01 0.00 0.00 0.00 0.00 34.83 34.85 2kg1 s MET 293 CO 0.48 -0.18 0.26 1.03 0.00 0.00 0.00 175.02 176.61 2kg1 s ARG 294 N 1.79 0.96 0.00 4.11 0.52 -0.22 -2.48 118.95 123.63 2kg1 s ARG 294 Ca -0.08 -0.94 0.00 0.00 -0.52 0.00 0.00 55.73 54.20 2kg1 s ARG 294 Cb -0.09 0.38 0.00 0.00 0.52 0.00 0.00 34.95 35.76 2kg1 s ARG 294 CO -0.14 -0.33 0.00 0.41 0.02 0.00 0.00 175.30 175.25 2kg1 n GLY 295 N -0.13 1.97 3.62 -3.53 0.00 -1.26 -0.71 105.19 105.15 2kg1 n GLY 295 Ca -0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 2kg1 n GLY 295 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2kg1 n LEU 296 N 0.00 2.93 -0.32 0.99 4.77 -1.26 -4.62 117.00 119.49 2kg1 n LEU 296 Ca 0.00 0.99 0.00 0.00 -0.03 0.00 0.00 56.01 56.97 2kg1 n LEU 296 Cb 0.00 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 39.72 2kg1 n LEU 296 CO 0.00 -1.50 0.00 -2.65 -1.33 0.00 0.00 177.39 171.91 2kg1 n PRO 297 N -0.09 0.00 -1.09 3.23 -0.02 -1.26 -4.68 135.00 131.09 2kg1 n PRO 297 Ca 0.10 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.50 2kg1 n PRO 297 Cb 0.41 -0.93 -0.03 0.00 -0.02 0.00 0.00 33.50 32.92 2kg1 n PRO 297 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2kg1 n TYR 298 N 0.11 -0.13 -2.19 6.00 4.01 -1.26 -4.69 117.16 119.01 2kg1 n TYR 298 Ca 0.00 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.75 2kg1 n TYR 298 Cb 0.00 -2.22 0.00 0.00 -0.31 0.00 0.00 39.34 36.81 2kg1 n TYR 298 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2kg1 n LYS 299 N -0.64 0.00 -4.35 -0.72 5.02 -1.26 -4.82 118.16 111.40 2kg1 n LYS 299 Ca -0.08 -1.27 -0.19 0.00 -2.02 0.00 0.00 58.31 54.75 2kg1 n LYS 299 Cb 0.44 -0.17 -0.09 0.00 -0.02 0.00 0.00 35.03 35.19 2kg1 n LYS 299 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kg1 s ALA 300 N 0.00 2.04 0.34 7.82 0.00 -1.26 -5.18 121.76 125.51 2kg1 s ALA 300 Ca 0.13 -1.74 -0.00 0.00 0.00 0.00 0.00 51.96 50.35 2kg1 s ALA 300 Cb 0.15 1.15 -0.00 0.00 0.00 0.00 0.00 23.12 24.41 2kg1 s ALA 300 CO -0.06 -0.51 0.43 0.95 0.00 0.00 0.00 175.76 176.57 2kg1 s THR 301 N -3.55 0.00 0.58 0.00 -4.23 -1.26 -4.96 115.64 102.22 2kg1 s THR 301 Ca 0.35 -1.69 0.29 0.00 -1.18 0.00 0.00 61.69 59.46 2kg1 s THR 301 Cb 0.04 -2.61 0.40 0.00 1.34 0.00 0.00 72.50 71.68 2kg1 s THR 301 CO 0.18 0.00 1.86 1.05 -0.54 0.00 0.00 174.62 177.17 2kg1 h GLU 302 N 2.12 0.00 0.00 3.99 4.11 -1.99 -1.18 114.58 121.64 2kg1 h GLU 302 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 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 0.38 0.00 0.12 0.27 0.07 0.00 0.00 179.01 179.85 2kg1 n ASN 303 N -3.78 0.21 -0.00 3.06 2.04 -1.26 -1.11 115.26 114.42 2kg1 n ASN 303 Ca 0.11 0.53 0.00 0.00 -0.44 0.00 0.00 54.58 54.78 2kg1 n ASN 303 Cb 0.78 -0.53 -0.00 0.00 -2.53 0.00 0.00 39.78 37.50 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 -1.76 4.20 0.27 0.53 -0.08 -0.45 -4.55 116.55 114.71 2kg1 n ASP 304 Ca -0.01 -0.08 -0.16 0.00 -1.51 0.00 0.00 54.79 53.03 2kg1 n ASP 304 Cb 0.13 1.00 -0.08 0.00 2.34 0.00 0.00 41.12 44.51 2kg1 n ASP 304 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2kg1 h ILE 305 N 0.00 0.52 -0.09 5.18 2.04 -1.07 -2.23 117.51 121.86 2kg1 h ILE 305 Ca 0.00 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.80 2kg1 h ILE 305 Cb 0.00 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2kg1 h ILE 305 CO 0.00 0.01 0.00 0.00 0.00 0.00 0.00 178.15 178.16 2kg1 n TYR 306 N -5.36 0.12 0.62 1.37 4.11 -1.07 -2.54 117.16 114.41 2kg1 n TYR 306 Ca -0.12 -0.06 0.06 0.00 -0.00 0.00 0.00 57.90 57.79 2kg1 n TYR 306 Cb 0.28 0.00 -0.05 0.00 -0.00 0.00 0.00 39.34 39.57 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 -0.26 0.90 -0.00 9.48 5.15 -1.05 -4.40 115.26 125.07 2kg1 n ASN 307 Ca 0.10 -0.95 0.02 0.00 -0.60 0.00 0.00 54.58 53.15 2kg1 n ASN 307 Cb 0.14 0.83 -0.03 0.00 -0.53 0.00 0.00 39.78 40.19 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 -0.94 0.00 0.29 1.20 -1.74 -0.87 -4.83 117.46 110.57 2kg1 n PHE 308 Ca 0.04 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.81 2kg1 n PHE 308 Cb 0.23 -0.05 -0.05 0.00 1.52 0.00 0.00 39.48 41.13 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 -0.67 -2.25 2.97 3.04 -1.70 -3.49 116.94 114.84 2kg1 h PHE 309 Ca 0.00 -0.02 0.17 0.00 3.98 0.00 0.00 57.97 62.11 2kg1 h PHE 309 Cb 0.15 0.22 -0.10 0.00 2.56 0.00 0.00 35.95 38.78 2kg1 h PHE 309 CO 0.00 -0.42 0.52 -1.12 -2.02 0.00 0.00 178.31 175.27 2kg1 s SER 310 N -3.07 -0.22 0.00 0.41 0.01 -1.26 -4.81 113.70 104.75 2kg1 s SER 310 Ca -0.11 -0.27 0.16 0.00 1.31 0.00 0.00 55.95 57.04 2kg1 s SER 310 Cb 0.01 0.43 0.90 0.00 0.21 0.00 0.00 66.02 67.58 2kg1 s SER 310 CO 0.32 -0.77 1.38 -0.81 0.41 0.00 0.00 173.24 173.76 2kg1 n PRO 311 N -0.41 0.42 -1.24 12.44 -0.04 -1.26 -4.83 135.00 140.09 2kg1 n PRO 311 Ca -0.07 0.04 -0.36 0.00 -0.04 0.00 0.00 63.50 63.07 2kg1 n PRO 311 Cb 0.61 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.64 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 -1.08 0.31 -4.80 1.53 4.32 -1.26 -4.98 117.00 111.05 2kg1 n LEU 312 Ca 0.11 0.58 -0.33 0.00 -0.02 0.00 0.00 56.01 56.35 2kg1 n LEU 312 Cb 0.07 -1.18 0.02 0.00 -1.62 0.00 0.00 43.42 40.72 2kg1 n LEU 312 CO 0.10 -3.32 0.72 0.20 -1.22 0.00 0.00 177.39 173.87 2kg1 s ASN 313 N -1.44 5.61 -0.43 -1.43 0.01 -1.26 -4.94 114.94 111.06 2kg1 s ASN 313 Ca 0.64 1.85 -0.28 0.00 -0.71 0.00 0.00 52.86 54.36 2kg1 s ASN 313 Cb -0.35 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 38.78 2kg1 s ASN 313 CO 0.59 -1.29 1.55 -2.16 -1.51 0.00 0.00 177.10 174.28 2kg1 s PRO 314 N -4.12 3.39 0.00 -0.60 0.04 -1.26 -4.66 135.00 127.79 2kg1 s PRO 314 Ca 0.64 0.95 0.00 0.00 0.04 0.00 0.00 61.00 62.64 2kg1 s PRO 314 Cb -0.17 -4.11 0.00 0.00 0.04 0.00 0.00 34.50 30.26 2kg1 s PRO 314 CO 0.39 -1.80 0.38 1.33 0.04 0.00 0.00 177.00 177.34 2kg1 n VAL 315 N 7.14 0.00 -2.74 -0.36 0.24 -1.26 -5.02 118.33 116.33 2kg1 n VAL 315 Ca 0.18 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.32 2kg1 n VAL 315 Cb 0.48 0.43 0.01 0.00 -1.47 0.00 0.00 33.84 33.29 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 0.00 1.69 -3.90 7.34 1.85 -1.25 -4.19 116.66 118.21 2kg1 n ARG 316 Ca 0.00 -3.62 -0.14 0.00 -1.00 0.00 0.00 57.85 53.08 2kg1 n ARG 316 Cb 0.53 -1.59 -0.15 0.00 -1.05 0.00 0.00 32.46 30.20 2kg1 n ARG 316 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 177.63 177.76 2kg1 s VAL 317 N -3.56 0.08 0.01 8.89 -7.23 -1.26 -4.49 120.40 112.84 2kg1 s VAL 317 Ca 0.35 0.04 -0.28 0.00 -1.81 0.00 0.00 61.98 60.29 2kg1 s VAL 317 Cb 0.42 -0.13 0.09 0.00 0.56 0.00 0.00 36.38 37.32 2kg1 s VAL 317 CO -0.04 0.07 0.78 -2.28 -0.31 0.00 0.00 175.10 173.32 2kg1 s HIS 318 N 0.47 -0.47 0.02 2.82 5.04 -0.66 -4.88 115.29 117.64 2kg1 s HIS 318 Ca -0.04 0.48 -0.06 0.00 -1.54 0.00 0.00 55.06 53.90 2kg1 s HIS 318 Cb -0.07 0.51 -0.01 0.00 0.04 0.00 0.00 32.58 33.06 2kg1 s HIS 318 CO -0.01 -0.62 0.11 0.42 -2.34 0.00 0.00 174.74 172.30 2kg1 s ILE 319 N -2.66 0.11 -0.41 0.89 1.01 -1.26 -2.47 121.20 116.40 2kg1 s ILE 319 Ca -0.00 -0.91 0.07 0.00 0.00 0.00 0.00 60.65 59.81 2kg1 s ILE 319 Cb -0.01 -0.66 0.22 0.00 0.01 0.00 0.00 42.46 42.02 2kg1 s ILE 319 CO -0.05 -0.50 0.52 1.21 0.00 0.00 0.00 174.94 176.12 2kg1 n GLU 320 N 1.10 0.55 -4.19 2.79 2.13 -0.50 -4.95 120.64 117.56 2kg1 n GLU 320 Ca -0.21 -2.97 -0.14 0.00 0.66 0.00 0.00 57.16 54.50 2kg1 n GLU 320 Cb 0.57 -1.39 -0.11 0.00 0.27 0.00 0.00 31.44 30.79 2kg1 n GLU 320 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2kg1 s ILE 321 N -0.49 0.94 1.01 6.31 -1.09 -1.26 -1.89 121.20 124.74 2kg1 s ILE 321 Ca 0.34 -1.75 -0.15 0.00 -2.23 0.00 0.00 60.65 56.86 2kg1 s ILE 321 Cb 0.13 -1.48 0.20 0.00 -1.58 0.00 0.00 42.46 39.73 2kg1 s ILE 321 CO -0.15 -0.63 1.18 -0.83 -1.23 0.00 0.00 174.94 173.28 2kg1 s GLY 322 N -2.64 1.64 0.00 6.18 0.00 -1.26 -4.92 107.32 106.32 2kg1 s GLY 322 Ca 0.08 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 43.96 2kg1 s GLY 322 CO -0.01 -0.13 0.73 -1.55 0.00 0.00 0.00 173.10 172.15 2kg1 n PRO 323 N -4.05 0.72 0.00 2.90 -0.04 -1.26 -2.57 135.00 130.70 2kg1 n PRO 323 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2kg1 n PRO 323 Cb 0.59 -1.01 0.00 0.00 -0.04 0.00 0.00 33.50 33.04 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 -0.51 0.12 -0.23 3.54 2.03 -1.26 -5.03 116.55 115.22 2kg1 n ASP 324 Ca 0.00 -0.27 -0.02 0.00 0.52 0.00 0.00 54.79 55.02 2kg1 n ASP 324 Cb 0.00 0.57 -0.01 0.00 -0.72 0.00 0.00 41.12 40.96 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 0.61 0.20 3.63 0.27 0.00 -1.06 -4.97 105.19 103.87 2kg1 n GLY 325 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2kg1 n GLY 325 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kg1 s ARG 326 N -1.56 -0.52 -0.58 1.61 3.00 -1.26 -4.83 118.95 114.81 2kg1 s ARG 326 Ca 0.00 0.18 -0.26 0.00 0.00 0.00 0.00 55.73 55.65 2kg1 s ARG 326 Cb 0.00 -1.66 -0.07 0.00 0.00 0.00 0.00 34.95 33.22 2kg1 s ARG 326 CO 0.00 -3.29 2.29 0.08 0.00 0.00 0.00 175.30 174.38 2kg1 s VAL 327 N -2.99 3.09 0.00 3.52 1.01 -1.26 -4.43 120.40 119.34 2kg1 s VAL 327 Ca 0.68 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.69 2kg1 s VAL 327 Cb -0.14 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.01 2kg1 s VAL 327 CO 0.57 -0.22 0.08 1.07 0.00 0.00 0.00 175.10 176.59 2kg1 n THR 328 N 7.97 0.00 -3.02 3.92 5.66 -1.26 -5.13 114.28 122.41 2kg1 n THR 328 Ca 0.35 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.35 2kg1 n THR 328 Cb 0.52 0.40 0.00 0.00 -1.55 0.00 0.00 70.33 69.71 2kg1 n THR 328 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kg1 n GLY 329 N 0.00 1.15 0.00 1.09 0.00 -1.26 -4.83 105.19 101.34 2kg1 n GLY 329 Ca 0.00 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 0.00 -4.29 1.61 0.28 -0.79 -4.96 120.64 112.49 2kg1 n GLU 330 Ca 0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.84 2kg1 n GLU 330 Cb 0.00 0.00 -0.10 0.00 1.43 0.00 0.00 31.44 32.77 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 -1.35 1.61 0.25 -1.84 0.00 -1.03 -1.42 121.76 117.99 2kg1 s ALA 331 Ca 0.00 -1.66 -0.14 0.00 0.00 0.00 0.00 51.96 50.16 2kg1 s ALA 331 Cb 0.00 0.40 -0.00 0.00 0.00 0.00 0.00 23.12 23.52 2kg1 s ALA 331 CO 0.00 -0.23 0.51 0.16 0.00 0.00 0.00 175.76 176.20 2kg1 s ASP 332 N -3.24 -0.10 0.31 0.00 -4.77 -1.03 -1.53 116.67 106.32 2kg1 s ASP 332 Ca 0.25 -0.90 0.06 0.00 -3.30 0.00 0.00 52.55 48.65 2kg1 s ASP 332 Cb 0.05 0.61 -0.03 0.00 -1.09 0.00 0.00 42.92 42.46 2kg1 s ASP 332 CO 0.06 -1.18 0.27 0.68 0.70 0.00 0.00 175.17 175.70 2kg1 s VAL 333 N -3.97 0.00 0.06 2.11 -7.23 -0.06 -1.66 120.40 109.65 2kg1 s VAL 333 Ca 0.21 -1.97 0.00 0.00 -1.81 0.00 0.00 61.98 58.41 2kg1 s VAL 333 Cb -0.01 -2.51 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 2kg1 s VAL 333 CO 0.09 0.00 -0.04 -0.70 -0.31 0.00 0.00 175.10 174.14 2kg1 s GLU 334 N -3.51 0.61 0.08 4.82 2.12 -1.26 -2.23 118.70 119.32 2kg1 s GLU 334 Ca 0.40 -1.11 -0.10 0.00 0.36 0.00 0.00 54.97 54.51 2kg1 s GLU 334 Cb 0.03 0.06 0.01 0.00 0.26 0.00 0.00 34.13 34.48 2kg1 s GLU 334 CO 0.25 -0.07 0.23 -0.06 -0.54 0.00 0.00 175.26 175.08 2kg1 s PHE 335 N -3.26 0.06 -0.56 5.30 0.08 0.96 -3.77 117.98 116.78 2kg1 s PHE 335 Ca 0.03 -0.41 -0.23 0.00 0.12 0.00 0.00 56.93 56.45 2kg1 s PHE 335 Cb 0.03 0.01 0.05 0.00 -0.57 0.00 0.00 43.02 42.54 2kg1 s PHE 335 CO -0.07 -0.54 0.89 0.00 -0.10 0.00 0.00 175.22 175.40 2kg1 s ALA 336 N -3.49 3.20 0.44 5.36 0.00 -1.26 -3.21 121.76 122.79 2kg1 s ALA 336 Ca 0.02 -1.44 0.00 0.00 0.00 0.00 0.00 51.96 50.54 2kg1 s ALA 336 Cb 0.03 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.46 2kg1 s ALA 336 CO -0.09 -2.38 0.00 0.25 0.00 0.00 0.00 175.76 173.54 2kg1 n THR 337 N 6.04 -0.05 0.27 0.00 -2.24 -0.91 -3.13 114.28 114.27 2kg1 n THR 337 Ca -0.01 0.45 0.16 0.00 -2.27 0.00 0.00 64.05 62.39 2kg1 n THR 337 Cb 0.47 -0.89 0.71 0.00 -2.10 0.00 0.00 70.33 68.52 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 -1.23 0.00 -0.36 4.78 2.76 -1.91 -2.89 115.15 116.30 2kg1 h HIS 338 Ca -0.08 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 57.92 2kg1 h HIS 338 Cb 1.20 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.16 2kg1 h HIS 338 CO 0.01 0.04 -0.42 0.93 -1.30 0.00 0.00 177.93 177.19 2kg1 h GLU 339 N 0.00 0.91 -0.00 5.26 5.08 -1.94 -0.17 114.58 123.73 2kg1 h GLU 339 Ca -0.00 -0.50 -0.16 0.00 -1.00 0.00 0.00 59.36 57.70 2kg1 h GLU 339 Cb 0.49 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2kg1 h GLU 339 CO 0.01 1.15 -0.76 1.49 -1.00 0.00 0.00 179.01 179.89 2kg1 h GLU 340 N 0.74 0.05 -0.59 2.33 4.81 -1.49 -2.59 114.58 117.83 2kg1 h GLU 340 Ca 0.05 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 2kg1 h GLU 340 Cb 1.02 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.39 2kg1 h GLU 340 CO 0.10 0.79 0.06 0.00 -0.73 0.00 0.00 179.01 179.22 2kg1 h ALA 341 N 1.20 0.78 0.00 2.92 0.00 -1.25 -2.27 119.26 120.64 2kg1 h ALA 341 Ca -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2kg1 h ALA 341 Cb 1.34 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2kg1 h ALA 341 CO 0.10 0.57 -0.12 -0.39 0.00 0.00 0.00 179.25 179.42 2kg1 h VAL 342 N 0.89 0.22 0.00 0.00 -1.51 -1.08 -1.85 116.25 112.94 2kg1 h VAL 342 Ca 0.17 -1.11 0.00 0.00 -1.23 0.00 0.00 66.70 64.53 2kg1 h VAL 342 Cb 0.48 1.93 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 2kg1 h VAL 342 CO 0.02 0.11 0.00 0.00 -1.23 0.00 0.00 177.57 176.47 2kg1 n ALA 343 N -2.14 1.95 0.32 5.19 0.00 -0.90 -2.14 120.51 122.80 2kg1 n ALA 343 Ca 0.02 -0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.42 2kg1 n ALA 343 Cb 0.50 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 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 -1.38 2.80 -1.27 0.00 0.00 -0.92 -4.76 120.51 114.98 2kg1 n ALA 344 Ca 0.07 -0.28 -0.36 0.00 0.00 0.00 0.00 53.44 52.86 2kg1 n ALA 344 Cb 0.18 -0.25 -0.02 0.00 0.00 0.00 0.00 19.45 19.36 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 -0.77 3.11 -0.29 0.00 1.56 -0.74 -4.09 117.12 115.91 2kg1 n MET 345 Ca 0.02 -2.11 0.00 0.00 -0.27 0.00 0.00 57.70 55.34 2kg1 n MET 345 Cb 0.13 -2.83 0.00 0.00 2.15 0.00 0.00 33.22 32.67 2kg1 n MET 345 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11 2kg1 n SER 346 N 4.38 0.05 -0.68 6.12 3.41 -1.26 -4.82 113.62 120.82 2kg1 n SER 346 Ca 0.66 -1.61 0.02 0.00 -0.26 0.00 0.00 58.87 57.67 2kg1 n SER 346 Cb 0.25 -0.12 0.02 0.00 -0.26 0.00 0.00 64.21 64.10 2kg1 n SER 346 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2kg1 n LYS 347 N -0.02 0.14 0.00 4.33 4.76 -1.26 -4.99 118.16 121.12 2kg1 n LYS 347 Ca 0.00 -1.40 0.00 0.00 -2.87 0.00 0.00 58.31 54.05 2kg1 n LYS 347 Cb 0.61 -0.50 0.00 0.00 -1.84 0.00 0.00 35.03 33.31 2kg1 n LYS 347 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2kg1 n ASP 348 N -0.03 0.00 -2.73 4.39 9.92 -1.26 -1.34 116.55 125.50 2kg1 n ASP 348 Ca 0.03 0.00 -0.04 0.00 -0.53 0.00 0.00 54.79 54.25 2kg1 n ASP 348 Cb 0.79 0.00 0.08 0.00 -0.64 0.00 0.00 41.12 41.35 2kg1 n ASP 348 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 2kg1 n ARG 349 N -3.95 1.40 0.00 -1.24 1.85 -1.26 -2.67 116.66 110.79 2kg1 n ARG 349 Ca 0.00 -2.49 0.00 0.00 -1.00 0.00 0.00 57.85 54.36 2kg1 n ARG 349 Cb 0.00 -0.66 0.00 0.00 -1.05 0.00 0.00 32.46 30.75 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 -0.74 0.00 -2.38 2.89 0.00 -0.45 -4.51 120.51 115.32 2kg1 n ALA 350 Ca -0.01 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.23 2kg1 n ALA 350 Cb 0.84 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.19 2kg1 n ALA 350 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2kg1 s ASN 351 N -1.69 1.81 0.00 0.00 2.47 -1.26 -0.47 114.94 115.80 2kg1 s ASN 351 Ca 0.00 -1.48 0.00 0.00 0.42 0.00 0.00 52.86 51.80 2kg1 s ASN 351 Cb 0.00 0.24 0.00 0.00 -1.45 0.00 0.00 41.25 40.04 2kg1 s ASN 351 CO 0.00 -0.79 0.00 0.80 -3.72 0.00 0.00 177.10 173.39 2kg1 n MET 352 N -0.62 0.00 0.23 0.43 0.00 -1.26 -4.81 117.12 111.09 2kg1 n MET 352 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.69 2kg1 n MET 352 Cb 0.66 -0.38 0.00 0.00 0.00 0.00 0.00 33.22 33.49 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 -0.80 0.00 0.00 2.12 10.64 -1.26 -5.02 117.38 123.06 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 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2kg1 n GLN 353 CO 0.00 0.00 0.00 -2.39 -1.83 0.00 0.00 177.06 172.84 2kg1 n HIS 354 N -3.42 0.00 -3.69 2.61 1.44 -1.26 -5.08 115.22 105.82 2kg1 n HIS 354 Ca 0.00 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.60 2kg1 n HIS 354 Cb 0.00 0.10 -0.11 0.00 0.12 0.00 0.00 29.99 30.10 2kg1 n HIS 354 CO 0.00 0.00 0.00 0.50 -2.81 0.00 0.00 176.34 174.03 2kg1 s ARG 355 N 0.00 0.32 0.97 -1.40 6.06 -1.26 -5.11 118.95 118.52 2kg1 s ARG 355 Ca 0.00 0.81 -0.11 0.00 -2.50 0.00 0.00 55.73 53.92 2kg1 s ARG 355 Cb 0.00 0.05 0.17 0.00 0.06 0.00 0.00 34.95 35.23 2kg1 s ARG 355 CO 0.00 -0.20 1.09 1.52 -2.50 0.00 0.00 175.30 175.21 2kg1 s TYR 356 N 1.80 1.86 0.06 5.12 1.13 -1.26 -4.21 117.35 121.85 2kg1 s TYR 356 Ca -0.06 1.43 0.03 0.00 -1.41 0.00 0.00 57.07 57.05 2kg1 s TYR 356 Cb -0.10 -3.19 -0.03 0.00 -1.10 0.00 0.00 41.96 37.54 2kg1 s TYR 356 CO -0.12 -2.88 -0.09 0.42 -2.51 0.00 0.00 175.55 170.38 2kg1 s ILE 357 N -2.72 0.67 -0.00 -3.49 -1.09 0.38 -4.55 121.20 110.40 2kg1 s ILE 357 Ca 0.66 -1.27 -0.06 0.00 -2.23 0.00 0.00 60.65 57.75 2kg1 s ILE 357 Cb -0.21 -0.87 -0.00 0.00 -1.58 0.00 0.00 42.46 39.80 2kg1 s ILE 357 CO 0.59 -0.44 0.11 -1.61 -1.23 0.00 0.00 174.94 172.36 2kg1 s GLU 358 N -1.99 0.40 -0.09 2.79 2.02 0.12 -2.15 118.70 119.80 2kg1 s GLU 358 Ca -0.05 -0.34 -0.08 0.00 0.02 0.00 0.00 54.97 54.52 2kg1 s GLU 358 Cb -0.07 0.16 0.02 0.00 0.10 0.00 0.00 34.13 34.34 2kg1 s GLU 358 CO -0.00 -0.09 0.23 -0.48 0.02 0.00 0.00 175.26 174.94 2kg1 s LEU 359 N -1.17 1.09 -0.09 1.80 -0.00 -1.09 -1.06 118.68 118.17 2kg1 s LEU 359 Ca -0.13 0.47 -0.01 0.00 -0.00 0.00 0.00 54.13 54.46 2kg1 s LEU 359 Cb -0.07 0.79 0.03 0.00 -0.00 0.00 0.00 46.19 46.94 2kg1 s LEU 359 CO 0.01 -0.08 -0.03 0.12 -0.00 0.00 0.00 176.35 176.37 2kg1 s PHE 360 N 0.17 0.97 0.31 3.48 2.19 -1.12 -4.64 117.98 119.34 2kg1 s PHE 360 Ca -0.00 -0.38 -0.29 0.00 0.33 0.00 0.00 56.93 56.59 2kg1 s PHE 360 Cb -0.02 -0.96 -0.13 0.00 -1.31 0.00 0.00 43.02 40.61 2kg1 s PHE 360 CO -0.00 -0.39 1.31 -0.11 1.83 0.00 0.00 175.22 177.86 2kg1 n LEU 361 N 5.03 3.37 -2.93 6.12 -0.00 -1.26 -1.39 117.00 125.94 2kg1 n LEU 361 Ca -0.10 1.19 -0.13 0.00 -0.00 0.00 0.00 56.01 56.97 2kg1 n LEU 361 Cb 0.50 -1.46 0.04 0.00 -0.00 0.00 0.00 43.42 42.50 2kg1 n LEU 361 CO 0.13 -0.52 0.10 -3.20 -0.00 0.00 0.00 177.39 173.90 2kg1 n ASN 362 N 1.17 -0.99 0.00 1.96 5.15 -0.69 -4.86 115.26 117.00 2kg1 n ASN 362 Ca 0.07 -3.41 0.00 0.00 -0.60 0.00 0.00 54.58 50.64 2kg1 n ASN 362 Cb 0.35 0.85 0.00 0.00 -0.53 0.00 0.00 39.78 40.44 2kg1 n ASN 362 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2kg1 n SER 363 N 0.33 0.00 -0.00 1.20 3.41 -1.21 -3.10 113.62 114.25 2kg1 n SER 363 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 2kg1 n SER 363 Cb 0.68 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.63 2kg1 n SER 363 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2kg1 n THR 364 N -0.45 0.00 -0.78 6.66 5.66 -1.26 -4.22 114.28 119.89 2kg1 n THR 364 Ca 0.00 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.04 2kg1 n THR 364 Cb 0.00 0.00 0.05 0.00 -1.55 0.00 0.00 70.33 68.83 2kg1 n THR 364 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 2kg1 n THR 365 N -0.00 1.04 -1.58 1.09 5.66 -1.26 -4.46 114.28 114.76 2kg1 n THR 365 Ca 0.00 -1.17 0.05 0.00 -3.05 0.00 0.00 64.05 59.88 2kg1 n THR 365 Cb 0.00 0.31 0.07 0.00 -1.55 0.00 0.00 70.33 69.17 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 -0.69 2.75 3.34 1.09 0.00 -1.26 -5.06 105.19 105.36 2kg1 n GLY 366 Ca 0.06 -0.62 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.47 0.38 0.20 4.61 0.00 -1.26 -5.18 121.76 119.03 2kg1 s ALA 367 Ca 0.18 -1.19 -0.06 0.00 0.00 0.00 0.00 51.96 50.89 2kg1 s ALA 367 Cb 0.16 1.08 0.02 0.00 0.00 0.00 0.00 23.12 24.38 2kg1 s ALA 367 CO 0.00 -0.67 0.37 -1.13 0.00 0.00 0.00 175.76 174.33 2kg1 n SER 368 N -0.26 -1.07 -1.32 0.00 3.41 -1.26 -4.94 113.62 108.18 2kg1 n SER 368 Ca -0.03 -1.84 0.01 0.00 -0.26 0.00 0.00 58.87 56.76 2kg1 n SER 368 Cb 0.64 1.81 -0.00 0.00 -0.26 0.00 0.00 64.21 66.40 2kg1 n SER 368 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2kg1 n ASN 369 N -1.39 0.50 -4.84 4.04 5.15 -1.25 -4.99 115.26 112.50 2kg1 n ASN 369 Ca -0.04 -1.98 -0.31 0.00 -0.60 0.00 0.00 54.58 51.65 2kg1 n ASN 369 Cb 0.30 -0.16 -0.04 0.00 -0.53 0.00 0.00 39.78 39.34 2kg1 n ASN 369 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2kg1 s GLY 370 N -1.69 2.80 -0.09 8.20 0.00 -1.26 -4.88 107.32 110.40 2kg1 s GLY 370 Ca 0.24 -0.56 0.12 0.00 0.00 0.00 0.00 44.72 44.53 2kg1 s GLY 370 CO -0.12 -2.11 1.15 0.00 0.00 0.00 0.00 173.10 172.02 2kg1 n ALA 371 N -1.51 3.07 -0.95 3.20 0.00 -1.26 -4.93 120.51 118.14 2kg1 n ALA 371 Ca -0.13 -1.47 0.03 0.00 0.00 0.00 0.00 53.44 51.87 2kg1 n ALA 371 Cb 0.66 -0.59 0.04 0.00 0.00 0.00 0.00 19.45 19.55 2kg1 n ALA 371 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2kg1 n TYR 372 N -0.17 0.00 -3.32 0.00 0.18 -1.26 -5.06 117.16 107.53 2kg1 n TYR 372 Ca -0.12 -0.42 -0.16 0.00 1.88 0.00 0.00 57.90 59.08 2kg1 n TYR 372 Cb 0.87 -0.07 0.00 0.00 -0.38 0.00 0.00 39.34 39.77 2kg1 n TYR 372 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 2kg1 n SER 373 N -0.54 -2.99 0.00 9.48 7.64 -1.26 -4.55 113.62 121.40 2kg1 n SER 373 Ca 0.04 -0.62 0.00 0.00 1.01 0.00 0.00 58.87 59.31 2kg1 n SER 373 Cb 0.51 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.72 2kg1 n SER 373 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2kg1 n SER 374 N -1.46 0.00 -3.79 6.43 3.41 -1.26 -4.55 113.62 112.39 2kg1 n SER 374 Ca -0.21 0.26 -0.13 0.00 -0.26 0.00 0.00 58.87 58.54 2kg1 n SER 374 Cb 0.44 -0.26 -0.10 0.00 -0.26 0.00 0.00 64.21 64.02 2kg1 n SER 374 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2kg1 s GLN 375 N -2.52 0.43 0.00 4.33 2.00 -1.26 -2.99 119.66 119.66 2kg1 s GLN 375 Ca 0.00 0.09 0.00 0.00 -2.00 0.00 0.00 55.36 53.45 2kg1 s GLN 375 Cb 0.00 0.20 0.00 0.00 0.80 0.00 0.00 33.01 34.01 2kg1 s GLN 375 CO 0.00 -0.09 0.31 1.55 -0.50 0.00 0.00 175.29 176.56 2kg1 n VAL 376 N 2.24 0.00 -1.17 1.34 3.14 -1.26 -4.91 118.33 117.71 2kg1 n VAL 376 Ca -0.17 0.00 0.07 0.00 -2.96 0.00 0.00 64.34 61.28 2kg1 n VAL 376 Cb 0.57 0.20 0.09 0.00 -1.06 0.00 0.00 33.84 33.65 2kg1 n VAL 376 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 2kg1 n MET 377 N 0.00 1.12 -0.15 1.45 2.81 -1.26 -3.38 117.12 117.71 2kg1 n MET 377 Ca 0.00 -2.09 0.00 0.00 -1.81 0.00 0.00 57.70 53.81 2kg1 n MET 377 Cb 0.52 -1.21 0.01 0.00 -0.71 0.00 0.00 33.22 31.82 2kg1 n MET 377 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2kg1 n GLN 378 N -1.01 0.34 0.00 0.03 6.02 -1.26 -4.72 117.38 116.78 2kg1 n GLN 378 Ca 0.11 -0.84 0.00 0.00 -0.01 0.00 0.00 57.00 56.26 2kg1 n GLN 378 Cb 0.61 -0.59 0.00 0.00 1.02 0.00 0.00 30.24 31.28 2kg1 n GLN 378 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kg1 n GLY 379 N -0.11 0.44 0.00 1.08 0.00 -1.26 -4.96 105.19 100.37 2kg1 n GLY 379 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2kg1 n GLY 379 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2kg1 n MET 380 N 0.00 0.00 0.00 1.61 2.81 -1.26 -5.12 117.12 115.17 2kg1 n MET 380 Ca 0.00 -0.35 0.00 0.00 -1.81 0.00 0.00 57.70 55.54 2kg1 n MET 380 Cb 0.11 -0.42 0.00 0.00 -0.71 0.00 0.00 33.22 32.20 2kg1 n MET 380 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89