#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kg1 n ASP 278 N 0.00 0.00 -4.06 1.61 2.03 -1.26 -5.13 116.55 109.75 2kg1 n ASP 278 Ca 0.00 -1.00 -0.10 0.00 0.52 0.00 0.00 54.79 54.21 2kg1 n ASP 278 Cb 0.00 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.33 2kg1 n ASP 278 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2kg1 s SER 279 N 0.00 -0.01 0.19 1.67 0.01 -1.26 -5.19 113.70 109.11 2kg1 s SER 279 Ca 0.00 -1.06 -0.09 0.00 1.31 0.00 0.00 55.95 56.10 2kg1 s SER 279 Cb 0.00 0.52 -0.01 0.00 0.21 0.00 0.00 66.02 66.74 2kg1 s SER 279 CO 0.00 -1.04 0.32 -1.61 0.41 0.00 0.00 173.24 171.33 2kg1 s GLU 280 N -4.06 1.26 0.91 12.44 2.02 -1.26 -5.17 118.70 124.84 2kg1 s GLU 280 Ca 0.27 -1.22 -0.12 0.00 0.02 0.00 0.00 54.97 53.91 2kg1 s GLU 280 Cb 0.02 0.39 0.14 0.00 0.10 0.00 0.00 34.13 34.78 2kg1 s GLU 280 CO 0.09 -0.48 1.13 0.12 0.02 0.00 0.00 175.26 176.14 2kg1 s PHE 281 N -3.99 2.50 0.19 1.61 5.36 -1.26 -5.09 117.98 117.28 2kg1 s PHE 281 Ca 0.20 0.90 -0.06 0.00 -0.96 0.00 0.00 56.93 57.01 2kg1 s PHE 281 Cb 0.03 -3.35 -0.02 0.00 -0.34 0.00 0.00 43.02 39.33 2kg1 s PHE 281 CO 0.03 -2.37 0.23 0.95 -1.46 0.00 0.00 175.22 172.60 2kg1 s THR 282 N -3.23 0.04 0.31 0.12 -4.23 -1.26 -5.14 115.64 102.25 2kg1 s THR 282 Ca 0.64 -1.68 0.05 0.00 -1.18 0.00 0.00 61.69 59.52 2kg1 s THR 282 Cb -0.15 -2.16 -0.03 0.00 1.34 0.00 0.00 72.50 71.50 2kg1 s THR 282 CO 0.54 -0.18 0.28 0.68 -0.54 0.00 0.00 174.62 175.40 2kg1 s VAL 283 N -4.05 0.00 -1.38 2.29 -7.23 -1.26 -5.03 120.40 103.74 2kg1 s VAL 283 Ca 0.26 -1.96 0.00 0.00 -1.81 0.00 0.00 61.98 58.47 2kg1 s VAL 283 Cb 0.04 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.47 2kg1 s VAL 283 CO 0.06 0.00 0.25 0.00 -0.31 0.00 0.00 175.10 175.10 2kg1 n GLN 284 N -0.57 0.36 0.00 4.82 6.02 -1.26 -2.11 117.38 124.65 2kg1 n GLN 284 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 2kg1 n GLN 284 Cb 0.63 -1.11 0.00 0.00 1.02 0.00 0.00 30.24 30.77 2kg1 n GLN 284 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2kg1 n SER 285 N 0.01 0.11 0.04 1.08 3.41 -1.26 -3.37 113.62 113.64 2kg1 n SER 285 Ca 0.00 -0.83 0.09 0.00 -0.26 0.00 0.00 58.87 57.87 2kg1 n SER 285 Cb 0.06 0.02 0.38 0.00 -0.26 0.00 0.00 64.21 64.41 2kg1 n SER 285 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2kg1 n THR 286 N -0.02 0.88 0.89 6.66 -1.04 -0.89 -3.13 114.28 117.63 2kg1 n THR 286 Ca 0.00 0.22 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 2kg1 n THR 286 Cb 0.18 -1.00 0.00 0.00 -1.82 0.00 0.00 70.33 67.69 2kg1 n THR 286 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2kg1 n THR 287 N -1.71 0.06 -3.93 12.58 -1.04 -1.26 -4.72 114.28 114.25 2kg1 n THR 287 Ca 0.03 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.94 2kg1 n THR 287 Cb 0.20 -0.48 -0.11 0.00 -1.82 0.00 0.00 70.33 68.13 2kg1 n THR 287 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2kg1 s GLY 288 N -0.04 0.14 -0.07 3.41 0.00 -1.18 -4.47 107.32 105.11 2kg1 s GLY 288 Ca 0.00 -0.35 -0.12 0.00 0.00 0.00 0.00 44.72 44.25 2kg1 s GLY 288 CO 0.00 -0.45 0.30 0.30 0.00 0.00 0.00 173.10 173.25 2kg1 s HIS 289 N -1.33 -0.26 0.32 1.90 3.76 -1.02 -4.06 115.29 114.60 2kg1 s HIS 289 Ca -0.14 0.58 0.08 0.00 -0.15 0.00 0.00 55.06 55.43 2kg1 s HIS 289 Cb -0.08 0.10 -0.06 0.00 1.11 0.00 0.00 32.58 33.64 2kg1 s HIS 289 CO 0.00 -0.25 -0.07 0.00 -0.85 0.00 0.00 174.74 173.58 2kg1 s VAL 291 N -2.81 0.05 0.27 0.00 1.01 -1.00 -1.62 120.40 116.31 2kg1 s VAL 291 Ca 0.32 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 61.94 2kg1 s VAL 291 Cb 0.04 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 2kg1 s VAL 291 CO 0.15 -0.24 0.15 -1.00 0.00 0.00 0.00 175.10 174.16 2kg1 s HIS 292 N -2.20 2.95 -0.09 5.22 0.09 -0.38 -1.55 115.29 119.33 2kg1 s HIS 292 Ca -0.07 -0.18 -0.22 0.00 -0.00 0.00 0.00 55.06 54.59 2kg1 s HIS 292 Cb -0.01 -1.41 0.05 0.00 -0.00 0.00 0.00 32.58 31.20 2kg1 s HIS 292 CO -0.00 0.49 0.52 1.41 -0.00 0.00 0.00 174.74 177.16 2kg1 s MET 293 N -3.82 0.81 0.22 1.40 0.00 -0.72 -1.83 119.30 115.36 2kg1 s MET 293 Ca 0.34 0.27 -0.09 0.00 0.00 0.00 0.00 55.69 56.21 2kg1 s MET 293 Cb -0.07 0.38 0.03 0.00 0.00 0.00 0.00 34.83 35.17 2kg1 s MET 293 CO 0.24 -0.21 0.45 -2.13 0.00 0.00 0.00 175.02 173.37 2kg1 n ARG 294 N 1.59 0.63 -0.99 4.11 0.63 -0.94 -2.74 116.66 118.96 2kg1 n ARG 294 Ca -0.18 -1.24 0.00 0.00 -0.92 0.00 0.00 57.85 55.51 2kg1 n ARG 294 Cb 0.56 1.55 0.00 0.00 0.45 0.00 0.00 32.46 35.03 2kg1 n ARG 294 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2kg1 n GLY 295 N -0.31 0.65 1.31 5.14 0.00 -1.26 -0.96 105.19 109.76 2kg1 n GLY 295 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2kg1 n GLY 295 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2kg1 n LEU 296 N 0.00 0.12 0.00 0.99 -0.00 -1.26 -4.87 117.00 111.99 2kg1 n LEU 296 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2kg1 n LEU 296 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.44 2kg1 n LEU 296 CO 0.00 -0.17 0.13 -2.65 -0.00 0.00 0.00 177.39 174.70 2kg1 n PRO 297 N -2.74 0.00 -1.11 1.96 -0.02 -1.26 -1.32 135.00 130.50 2kg1 n PRO 297 Ca 0.00 0.02 0.02 0.00 -2.02 0.00 0.00 63.50 61.51 2kg1 n PRO 297 Cb 0.29 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.21 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 -0.70 0.00 0.00 6.00 0.18 -1.26 -4.74 117.16 116.64 2kg1 n TYR 298 Ca 0.00 -0.33 0.00 0.00 1.88 0.00 0.00 57.90 59.45 2kg1 n TYR 298 Cb 0.07 -0.03 0.00 0.00 -0.38 0.00 0.00 39.34 38.99 2kg1 n TYR 298 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 2kg1 n LYS 299 N 0.28 2.56 -1.09 -3.48 4.81 -0.44 -5.00 118.16 115.80 2kg1 n LYS 299 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2kg1 n LYS 299 Cb 0.94 -0.26 0.00 0.00 0.02 0.00 0.00 35.03 35.73 2kg1 n LYS 299 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kg1 n ALA 300 N -0.17 0.00 -2.31 3.14 0.00 -1.18 -5.15 120.51 114.84 2kg1 n ALA 300 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2kg1 n ALA 300 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 -2.78 0.00 0.58 0.00 -4.23 -1.26 -4.65 115.64 103.30 2kg1 s THR 301 Ca 0.00 -1.96 0.29 0.00 -1.18 0.00 0.00 61.69 58.84 2kg1 s THR 301 Cb 0.00 -2.50 0.40 0.00 1.34 0.00 0.00 72.50 71.74 2kg1 s THR 301 CO 0.00 0.00 1.86 1.05 -0.54 0.00 0.00 174.62 176.99 2kg1 h GLU 302 N 2.30 0.00 0.00 3.99 4.11 -1.99 -0.78 114.58 122.21 2kg1 h GLU 302 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.14 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 0.42 0.00 0.00 0.27 0.07 0.00 0.00 179.01 179.77 2kg1 n ASN 303 N -3.79 0.39 -0.00 3.06 2.04 -1.26 -1.40 115.26 114.30 2kg1 n ASN 303 Ca 0.11 0.68 0.00 0.00 -0.44 0.00 0.00 54.58 54.94 2kg1 n ASN 303 Cb 0.79 -0.73 -0.00 0.00 -2.53 0.00 0.00 39.78 37.30 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 -2.02 1.16 0.05 0.53 2.03 -0.31 -4.59 116.55 113.40 2kg1 n ASP 304 Ca -0.01 -0.39 -0.13 0.00 0.52 0.00 0.00 54.79 54.78 2kg1 n ASP 304 Cb 0.03 1.01 -0.09 0.00 -0.72 0.00 0.00 41.12 41.35 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 1.06 0.00 5.18 2.04 -1.13 0.61 117.51 125.27 2kg1 h ILE 305 Ca 0.00 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 64.90 2kg1 h ILE 305 Cb 0.02 1.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 2kg1 h ILE 305 CO 0.00 0.22 0.00 0.00 0.00 0.00 0.00 178.15 178.37 2kg1 n TYR 306 N -4.96 0.00 -0.01 1.37 0.18 -0.97 -1.83 117.16 110.95 2kg1 n TYR 306 Ca -0.09 0.00 0.01 0.00 1.88 0.00 0.00 57.90 59.70 2kg1 n TYR 306 Cb 0.25 0.00 -0.04 0.00 -0.38 0.00 0.00 39.34 39.17 2kg1 n TYR 306 CO 0.00 0.00 0.00 -1.71 -2.08 0.00 0.00 176.86 173.07 2kg1 n ASN 307 N -0.68 3.91 0.17 9.48 5.15 -1.16 -4.38 115.26 127.75 2kg1 n ASN 307 Ca 0.06 0.00 0.04 0.00 -0.60 0.00 0.00 54.58 54.08 2kg1 n ASN 307 Cb 0.03 0.97 0.23 0.00 -0.53 0.00 0.00 39.78 40.48 2kg1 n ASN 307 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 2kg1 h PHE 308 N 0.00 0.00 -1.45 1.20 3.57 -0.25 -3.32 116.94 116.69 2kg1 h PHE 308 Ca -0.05 0.00 -0.65 0.00 3.53 0.00 0.00 57.97 60.80 2kg1 h PHE 308 Cb 0.65 0.00 -0.20 0.00 2.79 0.00 0.00 35.95 39.19 2kg1 h PHE 308 CO 0.00 0.46 1.05 1.19 -2.23 0.00 0.00 178.31 178.78 2kg1 n PHE 309 N -3.47 2.27 -0.95 0.41 3.72 -0.76 -4.96 117.46 113.71 2kg1 n PHE 309 Ca 0.00 -2.29 0.12 0.00 -0.05 0.00 0.00 57.45 55.24 2kg1 n PHE 309 Cb 0.59 -1.41 -0.05 0.00 -0.94 0.00 0.00 39.48 37.68 2kg1 n PHE 309 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2kg1 n SER 310 N 0.61 -5.66 -0.08 4.37 7.64 -1.25 -3.94 113.62 115.30 2kg1 n SER 310 Ca 0.53 0.72 0.00 0.00 1.01 0.00 0.00 58.87 61.13 2kg1 n SER 310 Cb 0.38 -3.12 0.00 0.00 -1.01 0.00 0.00 64.21 60.46 2kg1 n SER 310 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2kg1 n PRO 311 N -3.68 0.22 -1.20 1.43 -0.04 -1.26 -4.27 135.00 126.20 2kg1 n PRO 311 Ca -0.03 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.08 2kg1 n PRO 311 Cb 0.45 -1.02 0.09 0.00 -0.04 0.00 0.00 33.50 32.98 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 -0.36 2.03 -4.75 1.53 4.32 -1.25 -4.97 117.00 113.55 2kg1 n LEU 312 Ca 0.00 0.58 -0.32 0.00 -0.02 0.00 0.00 56.01 56.25 2kg1 n LEU 312 Cb 0.01 -1.32 0.09 0.00 -1.62 0.00 0.00 43.42 40.58 2kg1 n LEU 312 CO 0.00 -2.65 0.71 0.20 -1.22 0.00 0.00 177.39 174.44 2kg1 s ASN 313 N -1.69 4.44 -0.01 -1.43 0.01 -1.26 -4.76 114.94 110.23 2kg1 s ASN 313 Ca 0.68 1.95 0.03 0.00 -0.71 0.00 0.00 52.86 54.81 2kg1 s ASN 313 Cb -0.32 -2.54 0.11 0.00 0.41 0.00 0.00 41.25 38.91 2kg1 s ASN 313 CO 0.56 -2.08 0.93 -0.81 -1.51 0.00 0.00 177.10 174.19 2kg1 n PRO 314 N -3.27 1.41 0.00 -0.60 -0.04 -1.26 -4.43 135.00 126.81 2kg1 n PRO 314 Ca 0.10 -0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.11 2kg1 n PRO 314 Cb 0.52 -1.30 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 -0.06 0.00 -0.53 0.52 0.24 -1.26 -3.50 118.33 113.74 2kg1 n VAL 315 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 2kg1 n VAL 315 Cb 0.22 -0.57 0.00 0.00 -1.47 0.00 0.00 33.84 32.01 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 -0.53 0.00 -2.60 7.34 1.85 -1.26 -4.85 116.66 116.60 2kg1 n ARG 316 Ca 0.00 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.51 2kg1 n ARG 316 Cb 0.00 -0.10 -0.04 0.00 -1.05 0.00 0.00 32.46 31.27 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 0.00 3.92 0.10 8.89 -7.23 -1.23 -0.76 120.40 124.09 2kg1 s VAL 317 Ca 0.00 1.20 -0.23 0.00 -1.81 0.00 0.00 61.98 61.14 2kg1 s VAL 317 Cb 0.00 -3.48 0.06 0.00 0.56 0.00 0.00 36.38 33.52 2kg1 s VAL 317 CO 0.00 -0.26 0.57 -2.28 -0.31 0.00 0.00 175.10 172.82 2kg1 s HIS 318 N -2.02 -0.48 0.03 2.82 5.04 -0.82 -4.82 115.29 115.04 2kg1 s HIS 318 Ca 0.66 0.41 -0.09 0.00 -1.54 0.00 0.00 55.06 54.51 2kg1 s HIS 318 Cb -0.15 0.45 0.00 0.00 0.04 0.00 0.00 32.58 32.92 2kg1 s HIS 318 CO 0.18 -0.75 0.17 0.42 -2.34 0.00 0.00 174.74 172.43 2kg1 s ILE 319 N -3.11 0.10 0.02 0.89 1.01 -1.26 -2.72 121.20 116.13 2kg1 s ILE 319 Ca -0.02 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.78 2kg1 s ILE 319 Cb -0.00 -0.80 -0.01 0.00 0.01 0.00 0.00 42.46 41.65 2kg1 s ILE 319 CO -0.07 -0.48 -0.04 -0.70 0.00 0.00 0.00 174.94 173.65 2kg1 s GLU 320 N -2.28 0.33 0.27 2.79 2.12 -0.08 -4.97 118.70 116.88 2kg1 s GLU 320 Ca -0.07 -0.47 0.01 0.00 0.36 0.00 0.00 54.97 54.79 2kg1 s GLU 320 Cb -0.03 -0.11 -0.03 0.00 0.26 0.00 0.00 34.13 34.23 2kg1 s GLU 320 CO -0.02 0.01 0.25 0.42 -0.54 0.00 0.00 175.26 175.38 2kg1 s ILE 321 N -0.95 0.00 0.00 -3.70 -1.09 -1.26 -1.64 121.20 112.56 2kg1 s ILE 321 Ca -0.08 -1.90 0.00 0.00 -2.23 0.00 0.00 60.65 56.43 2kg1 s ILE 321 Cb -0.07 -2.49 0.00 0.00 -1.58 0.00 0.00 42.46 38.32 2kg1 s ILE 321 CO -0.00 0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.32 2kg1 n GLY 322 N -0.44 3.83 0.71 6.18 0.00 -1.26 -5.00 105.19 109.20 2kg1 n GLY 322 Ca 0.04 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.55 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 0.53 0.00 1.61 -0.04 -1.26 -2.29 135.00 133.56 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 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.21 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 0.44 2.04 -2.64 3.54 -0.08 -1.26 -5.05 116.55 113.54 2kg1 n ASP 324 Ca 0.00 0.00 -0.06 0.00 -1.51 0.00 0.00 54.79 53.22 2kg1 n ASP 324 Cb 0.19 0.07 -0.01 0.00 2.34 0.00 0.00 41.12 43.71 2kg1 n ASP 324 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2kg1 n GLY 325 N 2.24 -0.44 0.00 0.27 0.00 -0.97 -4.59 105.19 101.70 2kg1 n GLY 325 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2kg1 n GLY 325 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2kg1 n ARG 326 N -2.52 3.42 0.00 1.61 1.85 -1.26 -4.96 116.66 114.81 2kg1 n ARG 326 Ca 0.02 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.87 2kg1 n ARG 326 Cb 0.45 -0.29 0.00 0.00 -1.05 0.00 0.00 32.46 31.57 2kg1 n ARG 326 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2kg1 n VAL 327 N 0.00 0.00 0.44 8.89 0.31 -1.26 -4.84 118.33 121.87 2kg1 n VAL 327 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.38 2kg1 n VAL 327 Cb 0.00 0.00 0.24 0.00 -0.91 0.00 0.00 33.84 33.17 2kg1 n VAL 327 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 2kg1 n THR 328 N -0.29 0.88 -1.17 2.52 5.66 -1.26 -4.87 114.28 115.75 2kg1 n THR 328 Ca 0.00 0.22 -0.34 0.00 -3.05 0.00 0.00 64.05 60.88 2kg1 n THR 328 Cb 0.00 -1.06 0.11 0.00 -1.55 0.00 0.00 70.33 67.83 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 -0.47 -0.44 3.33 1.09 0.00 -1.26 -4.71 105.19 102.73 2kg1 n GLY 329 Ca 0.04 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.49 2kg1 n GLY 329 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kg1 s GLU 330 N -3.72 1.04 0.03 1.61 2.12 -0.65 -4.85 118.70 114.28 2kg1 s GLU 330 Ca 0.71 -0.54 -0.02 0.00 0.36 0.00 0.00 54.97 55.48 2kg1 s GLU 330 Cb -0.31 0.46 -0.02 0.00 0.26 0.00 0.00 34.13 34.52 2kg1 s GLU 330 CO 0.53 -0.39 0.02 0.00 -0.54 0.00 0.00 175.26 174.87 2kg1 s ALA 331 N -3.25 0.15 0.18 6.30 0.00 -1.11 -0.91 121.76 123.13 2kg1 s ALA 331 Ca -0.01 -0.74 -0.07 0.00 0.00 0.00 0.00 51.96 51.15 2kg1 s ALA 331 Cb 0.01 0.22 -0.02 0.00 0.00 0.00 0.00 23.12 23.33 2kg1 s ALA 331 CO -0.08 -0.28 0.26 0.16 0.00 0.00 0.00 175.76 175.82 2kg1 s ASP 332 N -2.10 0.07 0.13 0.00 -4.77 -1.10 -1.75 116.67 107.15 2kg1 s ASP 332 Ca -0.06 -1.03 -0.01 0.00 -3.30 0.00 0.00 52.55 48.16 2kg1 s ASP 332 Cb -0.02 0.43 -0.04 0.00 -1.09 0.00 0.00 42.92 42.21 2kg1 s ASP 332 CO -0.05 -0.91 0.04 0.68 0.70 0.00 0.00 175.17 175.64 2kg1 s VAL 333 N -4.03 0.19 -0.46 2.11 -7.23 -0.60 -1.94 120.40 108.45 2kg1 s VAL 333 Ca 0.23 -1.92 0.06 0.00 -1.81 0.00 0.00 61.98 58.54 2kg1 s VAL 333 Cb 0.04 -2.03 0.20 0.00 0.56 0.00 0.00 36.38 35.14 2kg1 s VAL 333 CO 0.04 -0.49 0.45 1.21 -0.31 0.00 0.00 175.10 176.00 2kg1 n GLU 334 N -0.11 0.72 -1.42 4.82 2.13 0.06 -2.37 120.64 124.47 2kg1 n GLU 334 Ca -0.06 -3.46 -0.36 0.00 0.66 0.00 0.00 57.16 53.94 2kg1 n GLU 334 Cb 0.63 -1.65 0.07 0.00 0.27 0.00 0.00 31.44 30.77 2kg1 n GLU 334 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2kg1 n PHE 335 N 2.14 0.51 -2.46 4.31 3.72 0.59 -4.42 117.46 121.85 2kg1 n PHE 335 Ca 0.26 0.40 -0.42 0.00 -0.05 0.00 0.00 57.45 57.64 2kg1 n PHE 335 Cb 0.47 -2.08 -0.03 0.00 -0.94 0.00 0.00 39.48 36.91 2kg1 n PHE 335 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2kg1 s ALA 336 N -1.74 2.85 0.42 4.37 0.00 -1.26 -2.44 121.76 123.96 2kg1 s ALA 336 Ca 0.73 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.89 2kg1 s ALA 336 Cb -0.37 -4.10 0.00 0.00 0.00 0.00 0.00 23.12 18.65 2kg1 s ALA 336 CO 0.50 -2.90 0.00 0.25 0.00 0.00 0.00 175.76 173.61 2kg1 n THR 337 N 6.75 -0.62 0.33 0.00 -2.24 -1.26 -3.32 114.28 113.93 2kg1 n THR 337 Ca 0.10 0.64 0.14 0.00 -2.27 0.00 0.00 64.05 62.65 2kg1 n THR 337 Cb 0.49 -0.96 0.59 0.00 -2.10 0.00 0.00 70.33 68.35 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 -0.96 0.00 -0.26 4.78 2.76 -1.88 -2.91 115.15 116.68 2kg1 h HIS 338 Ca -0.13 0.00 -0.15 0.00 -2.20 0.00 0.00 60.37 57.89 2kg1 h HIS 338 Cb 0.94 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.90 2kg1 h HIS 338 CO 0.03 0.00 -0.42 0.93 -1.30 0.00 0.00 177.93 177.17 2kg1 h GLU 339 N 0.00 0.74 0.00 5.26 5.08 -1.96 -0.99 114.58 122.71 2kg1 h GLU 339 Ca 0.00 -0.45 -0.11 0.00 -1.00 0.00 0.00 59.36 57.80 2kg1 h GLU 339 Cb 0.32 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.60 2kg1 h GLU 339 CO 0.00 1.08 -0.52 0.93 -1.00 0.00 0.00 179.01 179.49 2kg1 h GLU 340 N 0.47 0.00 -0.53 2.33 4.39 -1.52 -2.04 114.58 117.68 2kg1 h GLU 340 Ca 0.02 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.65 2kg1 h GLU 340 Cb 1.02 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.65 2kg1 h GLU 340 CO 0.10 0.52 0.06 0.00 -1.16 0.00 0.00 179.01 178.53 2kg1 h ALA 341 N 1.48 0.70 0.00 3.43 0.00 -1.29 -2.19 119.26 121.39 2kg1 h ALA 341 Ca -0.01 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 2kg1 h ALA 341 Cb 1.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2kg1 h ALA 341 CO 0.07 0.47 -0.27 -0.39 0.00 0.00 0.00 179.25 179.13 2kg1 h VAL 342 N 0.77 0.48 0.00 0.00 -1.51 -1.19 -1.77 116.25 113.03 2kg1 h VAL 342 Ca 0.16 -1.55 0.00 0.00 -1.23 0.00 0.00 66.70 64.07 2kg1 h VAL 342 Cb 0.45 2.13 0.00 0.00 -2.13 0.00 0.00 31.29 31.74 2kg1 h VAL 342 CO 0.02 0.26 0.00 0.00 -1.23 0.00 0.00 177.57 176.62 2kg1 n ALA 343 N -2.18 1.89 0.28 5.19 0.00 -0.77 -2.38 120.51 122.54 2kg1 n ALA 343 Ca 0.02 -0.07 0.03 0.00 0.00 0.00 0.00 53.44 53.42 2kg1 n ALA 343 Cb 0.60 -1.29 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 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 -1.42 2.79 -2.14 0.00 0.00 -0.86 -4.77 120.51 114.12 2kg1 n ALA 344 Ca 0.06 -0.17 -0.42 0.00 0.00 0.00 0.00 53.44 52.91 2kg1 n ALA 344 Cb 0.19 -0.22 -0.00 0.00 0.00 0.00 0.00 19.45 19.41 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 -1.14 2.94 -0.78 0.00 0.00 -0.69 -4.13 117.12 113.31 2kg1 n MET 345 Ca 0.01 -2.90 0.00 0.00 0.00 0.00 0.00 57.70 54.81 2kg1 n MET 345 Cb 0.09 -3.39 -0.00 0.00 0.00 0.00 0.00 33.22 29.92 2kg1 n MET 345 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 2kg1 n SER 346 N 7.53 0.14 -0.64 6.12 3.41 -1.26 -4.90 113.62 124.02 2kg1 n SER 346 Ca 0.50 -1.80 0.04 0.00 -0.26 0.00 0.00 58.87 57.35 2kg1 n SER 346 Cb 0.43 -0.13 0.07 0.00 -0.26 0.00 0.00 64.21 64.32 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 0.12 0.58 -1.36 4.33 4.76 -1.26 -4.97 118.16 120.36 2kg1 n LYS 347 Ca -0.01 -2.00 -0.54 0.00 -2.87 0.00 0.00 58.31 52.88 2kg1 n LYS 347 Cb 0.77 -0.82 -0.10 0.00 -1.84 0.00 0.00 35.03 33.04 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 -0.43 1.43 -2.79 4.39 5.75 -1.26 -0.57 116.55 123.06 2kg1 n ASP 348 Ca 0.08 0.50 -0.11 0.00 -0.01 0.00 0.00 54.79 55.26 2kg1 n ASP 348 Cb 0.79 -1.09 -0.02 0.00 -1.03 0.00 0.00 41.12 39.76 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 7.92 -2.11 0.00 0.11 1.85 -1.26 -4.94 116.66 118.23 2kg1 n ARG 349 Ca 0.48 0.04 0.00 0.00 -1.00 0.00 0.00 57.85 57.37 2kg1 n ARG 349 Cb 0.11 -3.91 0.00 0.00 -1.05 0.00 0.00 32.46 27.61 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 -2.57 0.00 -2.57 2.89 0.00 0.26 -4.40 120.51 114.12 2kg1 n ALA 350 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.21 2kg1 n ALA 350 Cb 0.41 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.78 2kg1 n ALA 350 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2kg1 s ASN 351 N -1.36 3.10 0.00 0.00 4.22 -1.26 -0.88 114.94 118.76 2kg1 s ASN 351 Ca 0.00 -1.58 0.00 0.00 -2.14 0.00 0.00 52.86 49.14 2kg1 s ASN 351 Cb 0.00 0.31 0.00 0.00 1.28 0.00 0.00 41.25 42.84 2kg1 s ASN 351 CO 0.00 -0.81 0.00 0.80 -2.04 0.00 0.00 177.10 175.05 2kg1 n MET 352 N -0.95 0.86 0.00 3.55 1.56 -1.23 -4.93 117.12 115.97 2kg1 n MET 352 Ca -0.08 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.35 2kg1 n MET 352 Cb 0.66 -0.70 0.00 0.00 2.15 0.00 0.00 33.22 35.33 2kg1 n MET 352 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2kg1 n GLN 353 N -1.45 0.10 0.00 2.12 10.64 -1.26 -5.02 117.38 122.50 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 0.20 -0.11 0.00 0.00 -0.86 0.00 0.00 30.24 29.47 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 -0.46 0.00 -3.91 2.61 1.44 -1.26 -5.16 115.22 108.48 2kg1 n HIS 354 Ca 0.00 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.63 2kg1 n HIS 354 Cb 0.00 0.01 -0.03 0.00 0.12 0.00 0.00 29.99 30.09 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 1.75 0.57 -1.40 6.06 -1.26 -5.14 118.95 119.53 2kg1 s ARG 355 Ca 0.00 -1.13 -0.19 0.00 -2.50 0.00 0.00 55.73 51.91 2kg1 s ARG 355 Cb 0.00 0.56 -0.07 0.00 0.06 0.00 0.00 34.95 35.51 2kg1 s ARG 355 CO 0.00 -0.78 0.86 0.98 -2.50 0.00 0.00 175.30 173.86 2kg1 n TYR 356 N -0.44 0.49 -3.99 5.12 9.36 -1.26 -3.58 117.16 122.85 2kg1 n TYR 356 Ca -0.03 0.45 -0.09 0.00 3.32 0.00 0.00 57.90 61.55 2kg1 n TYR 356 Cb 0.60 -2.10 -0.10 0.00 -0.63 0.00 0.00 39.34 37.10 2kg1 n TYR 356 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 2kg1 s ILE 357 N -1.53 0.14 -0.03 2.97 -1.09 -0.06 -4.91 121.20 116.68 2kg1 s ILE 357 Ca 0.72 -1.17 -0.02 0.00 -2.23 0.00 0.00 60.65 57.95 2kg1 s ILE 357 Cb -0.44 -0.76 -0.04 0.00 -1.58 0.00 0.00 42.46 39.64 2kg1 s ILE 357 CO 0.50 -0.65 0.11 -1.61 -1.23 0.00 0.00 174.94 172.06 2kg1 s GLU 358 N -2.39 3.21 -0.03 2.79 2.02 -0.14 -4.12 118.70 120.04 2kg1 s GLU 358 Ca -0.07 -0.38 -0.30 0.00 0.02 0.00 0.00 54.97 54.24 2kg1 s GLU 358 Cb -0.03 -2.97 0.07 0.00 0.10 0.00 0.00 34.13 31.30 2kg1 s GLU 358 CO -0.04 0.68 0.67 -0.48 0.02 0.00 0.00 175.26 176.11 2kg1 s LEU 359 N -1.58 -0.63 -0.20 1.80 -0.00 -1.26 -2.22 118.68 114.59 2kg1 s LEU 359 Ca 0.22 0.65 -0.14 0.00 -0.00 0.00 0.00 54.13 54.86 2kg1 s LEU 359 Cb -0.12 2.53 0.06 0.00 -0.00 0.00 0.00 46.19 48.66 2kg1 s LEU 359 CO 0.12 -0.64 0.51 0.12 -0.00 0.00 0.00 176.35 176.46 2kg1 s PHE 360 N -1.41 -0.68 0.64 3.48 2.19 -0.76 -4.78 117.98 116.67 2kg1 s PHE 360 Ca -0.10 1.49 -0.18 0.00 0.33 0.00 0.00 56.93 58.46 2kg1 s PHE 360 Cb -0.00 0.31 -0.01 0.00 -1.31 0.00 0.00 43.02 42.00 2kg1 s PHE 360 CO 0.08 -0.35 1.29 -0.11 1.83 0.00 0.00 175.22 177.96 2kg1 n LEU 361 N 3.67 5.97 -2.72 6.12 0.00 -1.26 -1.25 117.00 127.53 2kg1 n LEU 361 Ca -0.19 0.83 -0.04 0.00 0.00 0.00 0.00 56.01 56.62 2kg1 n LEU 361 Cb 0.56 -1.55 0.09 0.00 0.00 0.00 0.00 43.42 42.52 2kg1 n LEU 361 CO 0.07 -1.01 0.28 -3.20 0.00 0.00 0.00 177.39 173.53 2kg1 n ASN 362 N -1.84 -0.10 -3.21 1.96 2.85 -0.64 -4.75 115.26 109.53 2kg1 n ASN 362 Ca 0.16 -2.30 -0.06 0.00 -0.11 0.00 0.00 54.58 52.26 2kg1 n ASN 362 Cb 0.48 0.18 0.02 0.00 1.24 0.00 0.00 39.78 41.69 2kg1 n ASN 362 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 2kg1 s SER 363 N -2.32 -0.03 0.18 1.20 1.04 -1.12 -3.14 113.70 109.52 2kg1 s SER 363 Ca 0.20 -0.89 -0.11 0.00 0.48 0.00 0.00 55.95 55.64 2kg1 s SER 363 Cb 0.40 0.69 -0.00 0.00 0.10 0.00 0.00 66.02 67.21 2kg1 s SER 363 CO -0.06 -1.36 0.35 0.28 0.98 0.00 0.00 173.24 173.43 2kg1 s THR 364 N -2.43 0.05 -1.74 2.02 -1.32 -1.09 -4.96 115.64 106.17 2kg1 s THR 364 Ca 0.17 -1.28 0.00 0.00 -1.21 0.00 0.00 61.69 59.37 2kg1 s THR 364 Cb -0.04 -1.85 0.00 0.00 -1.51 0.00 0.00 72.50 69.10 2kg1 s THR 364 CO 0.08 -0.22 0.44 1.07 -2.21 0.00 0.00 174.62 173.78 2kg1 n THR 365 N -0.26 0.00 -1.34 5.08 5.66 -1.26 -2.70 114.28 119.46 2kg1 n THR 365 Ca -0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 2kg1 n THR 365 Cb 0.63 -0.25 0.00 0.00 -1.55 0.00 0.00 70.33 69.16 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 0.07 -0.11 3.51 1.09 0.00 -1.26 -4.98 105.19 103.51 2kg1 n GLY 366 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.76 0.32 4.61 0.00 -1.10 -5.04 121.76 118.79 2kg1 s ALA 367 Ca 0.00 1.26 -0.00 0.00 0.00 0.00 0.00 51.96 53.22 2kg1 s ALA 367 Cb 0.00 0.05 0.52 0.00 0.00 0.00 0.00 23.12 23.69 2kg1 s ALA 367 CO 0.00 -0.40 1.98 0.77 0.00 0.00 0.00 175.76 178.11 2kg1 h SER 368 N 2.89 0.87 0.00 0.00 0.02 -1.78 -2.87 113.55 112.67 2kg1 h SER 368 Ca -0.27 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2kg1 h SER 368 Cb 1.16 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.48 2kg1 h SER 368 CO 0.39 0.62 0.00 -3.20 -1.14 0.00 0.00 176.83 173.50 2kg1 n ASN 369 N -4.42 0.00 0.00 3.07 5.15 -1.26 -3.46 115.26 114.34 2kg1 n ASN 369 Ca 0.08 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.06 2kg1 n ASN 369 Cb 0.04 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.29 2kg1 n ASN 369 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2kg1 n GLY 370 N -0.15 -0.05 2.20 8.20 0.00 -1.26 -4.85 105.19 109.28 2kg1 n GLY 370 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.19 -2.81 4.61 0.00 -1.26 -5.16 120.51 115.70 2kg1 n ALA 371 Ca 0.00 -1.07 -0.11 0.00 0.00 0.00 0.00 53.44 52.26 2kg1 n ALA 371 Cb 0.00 0.86 -0.07 0.00 0.00 0.00 0.00 19.45 20.25 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 -3.61 0.73 0.00 0.00 1.13 -1.26 -4.47 117.35 109.87 2kg1 s TYR 372 Ca 0.19 -1.02 0.00 0.00 -1.41 0.00 0.00 57.07 54.83 2kg1 s TYR 372 Cb -0.01 -0.10 0.00 0.00 -1.10 0.00 0.00 41.96 40.75 2kg1 s TYR 372 CO 0.14 -0.89 0.10 0.43 -2.51 0.00 0.00 175.55 172.82 2kg1 n SER 373 N -0.48 0.00 -2.63 -0.18 7.64 -1.26 -5.02 113.62 111.68 2kg1 n SER 373 Ca 0.00 -1.00 -0.12 0.00 1.01 0.00 0.00 58.87 58.76 2kg1 n SER 373 Cb 0.63 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.83 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 -3.26 -3.73 6.43 2.88 -1.26 -4.93 113.62 109.75 2kg1 n SER 374 Ca 0.00 0.14 -0.13 0.00 -1.33 0.00 0.00 58.87 57.55 2kg1 n SER 374 Cb 0.32 -2.79 -0.08 0.00 -0.75 0.00 0.00 64.21 60.91 2kg1 n SER 374 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 2kg1 s GLN 375 N -5.21 0.75 -0.19 -1.46 2.00 -1.22 -4.58 119.66 109.75 2kg1 s GLN 375 Ca 0.08 -0.21 -0.11 0.00 -2.00 0.00 0.00 55.36 53.12 2kg1 s GLN 375 Cb -0.04 0.33 0.06 0.00 0.80 0.00 0.00 33.01 34.16 2kg1 s GLN 375 CO 0.09 -0.22 0.45 0.54 -0.50 0.00 0.00 175.29 175.66 2kg1 s VAL 376 N -1.61 -0.02 0.26 1.34 0.11 -1.24 -4.42 120.40 114.81 2kg1 s VAL 376 Ca -0.11 0.07 -0.11 0.00 -2.93 0.00 0.00 61.98 58.90 2kg1 s VAL 376 Cb -0.04 -0.67 -0.00 0.00 -1.53 0.00 0.00 36.38 34.14 2kg1 s VAL 376 CO 0.03 0.03 0.47 0.00 -3.33 0.00 0.00 175.10 172.30 2kg1 s MET 377 N 1.34 1.58 0.30 1.54 0.23 -1.26 -5.11 119.30 117.92 2kg1 s MET 377 Ca -0.09 -1.32 -0.13 0.00 -1.03 0.00 0.00 55.69 53.12 2kg1 s MET 377 Cb -0.08 0.46 0.01 0.00 -1.53 0.00 0.00 34.83 33.70 2kg1 s MET 377 CO -0.13 -0.66 0.58 1.14 -2.03 0.00 0.00 175.02 173.93 2kg1 s GLN 378 N -3.89 1.79 -0.03 3.16 0.00 -1.26 -5.12 119.66 114.31 2kg1 s GLN 378 Ca 0.24 -1.33 -0.28 0.00 -0.00 0.00 0.00 55.36 53.99 2kg1 s GLN 378 Cb -0.00 0.52 0.09 0.00 0.00 0.00 0.00 33.01 33.62 2kg1 s GLN 378 CO 0.10 -0.78 1.27 0.41 0.00 0.00 0.00 175.29 176.30 2kg1 n GLY 379 N -0.46 0.21 3.37 2.60 0.00 -1.26 -5.19 105.19 104.45 2kg1 n GLY 379 Ca -0.03 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.83 2kg1 n GLY 379 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kg1 s MET 380 N -2.01 1.43 0.00 1.61 -1.94 -1.26 -4.90 119.30 112.23 2kg1 s MET 380 Ca 0.30 -1.54 0.00 0.00 -1.71 0.00 0.00 55.69 52.74 2kg1 s MET 380 Cb -0.01 0.36 0.00 0.00 2.01 0.00 0.00 34.83 37.19 2kg1 s MET 380 CO -0.01 -0.54 0.00 0.41 -0.01 0.00 0.00 175.02 174.87