#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 -3.76 1.61 2.03 -1.26 -5.13 116.55 110.04 2kg1 n ASP 278 Ca 0.00 -1.00 -0.08 0.00 0.52 0.00 0.00 54.79 54.23 2kg1 n ASP 278 Cb 0.00 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.37 2kg1 n ASP 278 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2kg1 s SER 279 N 0.00 -0.12 0.03 1.67 1.04 -1.26 -5.19 113.70 109.88 2kg1 s SER 279 Ca 0.00 -0.82 -0.22 0.00 0.48 0.00 0.00 55.95 55.39 2kg1 s SER 279 Cb 0.00 0.69 0.05 0.00 0.10 0.00 0.00 66.02 66.86 2kg1 s SER 279 CO 0.00 -1.32 0.50 -0.70 0.98 0.00 0.00 173.24 172.70 2kg1 s GLU 280 N -3.71 0.99 0.00 4.02 2.12 -1.26 -5.07 118.70 115.79 2kg1 s GLU 280 Ca 0.16 -0.20 0.00 0.00 0.36 0.00 0.00 54.97 55.29 2kg1 s GLU 280 Cb -0.04 0.45 0.00 0.00 0.26 0.00 0.00 34.13 34.80 2kg1 s GLU 280 CO 0.09 -0.35 0.06 0.34 -0.54 0.00 0.00 175.26 174.86 2kg1 n PHE 281 N 0.53 0.00 -2.39 5.30 7.35 -1.26 -5.11 117.46 121.87 2kg1 n PHE 281 Ca -0.19 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.20 2kg1 n PHE 281 Cb 0.60 0.01 -0.02 0.00 0.35 0.00 0.00 39.48 40.42 2kg1 n PHE 281 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2kg1 s THR 282 N 0.00 4.70 -0.05 -2.13 -4.23 -1.26 -4.55 115.64 108.12 2kg1 s THR 282 Ca 0.00 0.84 -0.13 0.00 -1.18 0.00 0.00 61.69 61.22 2kg1 s THR 282 Cb 0.00 -3.78 0.02 0.00 1.34 0.00 0.00 72.50 70.08 2kg1 s THR 282 CO 0.00 -0.80 0.30 -0.69 -0.54 0.00 0.00 174.62 172.89 2kg1 s VAL 283 N -2.73 0.04 0.00 2.29 1.01 -1.26 -4.99 120.40 114.76 2kg1 s VAL 283 Ca 0.54 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.18 2kg1 s VAL 283 Cb -0.10 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.72 2kg1 s VAL 283 CO 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 175.10 175.30 2kg1 n GLN 284 N 1.78 0.56 -3.63 2.72 10.64 -1.26 -4.69 117.38 123.49 2kg1 n GLN 284 Ca -0.19 0.00 -0.13 0.00 -1.83 0.00 0.00 57.00 54.85 2kg1 n GLN 284 Cb 0.56 -0.05 -0.07 0.00 -0.86 0.00 0.00 30.24 29.83 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 0.00 -0.76 0.00 2.61 0.15 -1.26 -4.37 113.70 110.07 2kg1 s SER 285 Ca 0.00 1.42 0.00 0.00 0.70 0.00 0.00 55.95 58.07 2kg1 s SER 285 Cb 0.00 1.42 0.00 0.00 -1.71 0.00 0.00 66.02 65.73 2kg1 s SER 285 CO 0.00 -0.24 0.00 1.07 1.20 0.00 0.00 173.24 175.27 2kg1 n THR 286 N 2.92 0.00 -0.02 6.45 5.66 -1.25 -4.98 114.28 123.06 2kg1 n THR 286 Ca -0.15 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.85 2kg1 n THR 286 Cb 0.56 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.34 2kg1 n THR 286 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 2kg1 n THR 287 N 0.00 0.00 -0.33 1.09 -1.04 -1.25 -5.12 114.28 107.62 2kg1 n THR 287 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2kg1 n THR 287 Cb 0.20 0.23 0.00 0.00 -1.82 0.00 0.00 70.33 68.93 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 0.00 2.78 2.99 3.41 0.00 -1.01 -4.26 105.19 109.10 2kg1 n GLY 288 Ca 0.00 -0.08 -0.27 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 1.71 0.32 1.61 3.76 -1.20 -4.63 115.29 116.87 2kg1 s HIS 289 Ca 0.00 -0.82 0.03 0.00 -0.15 0.00 0.00 55.06 54.12 2kg1 s HIS 289 Cb 0.00 -1.30 -0.04 0.00 1.11 0.00 0.00 32.58 32.34 2kg1 s HIS 289 CO 0.00 -0.48 0.11 0.00 -0.85 0.00 0.00 174.74 173.53 2kg1 s VAL 291 N -3.47 0.05 0.15 0.00 1.01 -0.63 -1.99 120.40 115.52 2kg1 s VAL 291 Ca 0.34 -0.43 0.10 0.00 0.00 0.00 0.00 61.98 61.99 2kg1 s VAL 291 Cb 0.06 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2kg1 s VAL 291 CO 0.15 -0.24 -0.22 -1.00 0.00 0.00 0.00 175.10 173.79 2kg1 s HIS 292 N -2.88 2.39 -0.03 5.22 3.76 -1.15 -1.36 115.29 121.24 2kg1 s HIS 292 Ca -0.03 -0.33 -0.15 0.00 -0.15 0.00 0.00 55.06 54.40 2kg1 s HIS 292 Cb -0.00 -1.24 0.03 0.00 1.11 0.00 0.00 32.58 32.48 2kg1 s HIS 292 CO -0.05 0.42 0.33 0.00 -0.85 0.00 0.00 174.74 174.59 2kg1 s MET 293 N -2.35 0.66 0.10 1.40 0.23 -0.61 -0.43 119.30 118.30 2kg1 s MET 293 Ca 0.18 -0.10 -0.32 0.00 -1.03 0.00 0.00 55.69 54.42 2kg1 s MET 293 Cb -0.09 0.29 -0.12 0.00 -1.53 0.00 0.00 34.83 33.38 2kg1 s MET 293 CO 0.09 -0.17 1.78 -2.13 -2.03 0.00 0.00 175.02 172.55 2kg1 n ARG 294 N 1.43 2.52 -2.10 3.16 0.63 0.65 -3.11 116.66 119.85 2kg1 n ARG 294 Ca -0.21 0.92 -0.27 0.00 -0.92 0.00 0.00 57.85 57.37 2kg1 n ARG 294 Cb 0.56 -2.77 0.07 0.00 0.45 0.00 0.00 32.46 30.78 2kg1 n ARG 294 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2kg1 s GLY 295 N 2.43 1.65 0.17 5.14 0.00 -1.26 -4.17 107.32 111.28 2kg1 s GLY 295 Ca 0.83 -0.81 -0.15 0.00 0.00 0.00 0.00 44.72 44.58 2kg1 s GLY 295 CO 0.40 -0.38 1.75 1.41 0.00 0.00 0.00 173.10 176.27 2kg1 h LEU 296 N -0.75 0.14 -1.69 0.66 3.38 -1.91 -3.46 115.31 111.67 2kg1 h LEU 296 Ca -0.45 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2kg1 h LEU 296 Cb 1.32 0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.11 2kg1 h LEU 296 CO 0.62 0.11 0.00 -0.81 0.09 0.00 0.00 178.44 178.46 2kg1 n PRO 297 N -5.02 2.09 0.00 1.13 -0.04 -1.26 -4.54 135.00 127.36 2kg1 n PRO 297 Ca 0.03 -1.66 0.04 0.00 -0.04 0.00 0.00 63.50 61.86 2kg1 n PRO 297 Cb 0.16 -1.43 0.02 0.00 -0.04 0.00 0.00 33.50 32.21 2kg1 n PRO 297 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2kg1 n TYR 298 N 0.87 0.00 -1.08 0.54 4.01 -1.26 -4.75 117.16 115.49 2kg1 n TYR 298 Ca 0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 2kg1 n TYR 298 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.47 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 0.08 0.00 -0.95 -0.72 5.02 -1.26 -5.13 118.16 115.20 2kg1 n LYS 299 Ca 0.04 -0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.25 2kg1 n LYS 299 Cb 0.18 -0.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.72 2kg1 n LYS 299 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kg1 n ALA 300 N 0.00 0.00 -2.40 7.82 0.00 -1.26 -5.18 120.51 119.49 2kg1 n ALA 300 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2kg1 n ALA 300 Cb 0.29 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.66 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 -2.90 0.00 0.60 0.00 -4.23 -1.26 -4.96 115.64 102.88 2kg1 s THR 301 Ca 0.00 -1.90 0.31 0.00 -1.18 0.00 0.00 61.69 58.92 2kg1 s THR 301 Cb 0.00 -2.49 0.36 0.00 1.34 0.00 0.00 72.50 71.71 2kg1 s THR 301 CO 0.00 0.00 2.22 1.05 -0.54 0.00 0.00 174.62 177.35 2kg1 h GLU 302 N 2.36 0.00 0.00 3.99 4.11 -1.99 -1.11 114.58 121.93 2kg1 h GLU 302 Ca -0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.13 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 0.00 0.27 0.07 0.00 0.00 179.01 179.79 2kg1 n ASN 303 N -3.76 0.23 -0.00 3.06 2.04 -1.26 -1.48 115.26 114.09 2kg1 n ASN 303 Ca -0.02 0.60 0.02 0.00 -0.44 0.00 0.00 54.58 54.74 2kg1 n ASN 303 Cb 0.15 -0.63 -0.03 0.00 -2.53 0.00 0.00 39.78 36.74 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 -1.80 2.57 0.05 0.53 2.03 -0.43 -4.61 116.55 114.90 2kg1 n ASP 304 Ca -0.00 -0.23 -0.13 0.00 0.52 0.00 0.00 54.79 54.95 2kg1 n ASP 304 Cb 0.04 1.11 -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 1.11 0.00 5.18 2.04 -1.14 -0.43 117.51 124.26 2kg1 h ILE 305 Ca 0.00 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 64.98 2kg1 h ILE 305 Cb 0.14 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 2kg1 h ILE 305 CO 0.00 0.21 0.00 0.00 0.00 0.00 0.00 178.15 178.36 2kg1 n TYR 306 N -4.96 0.00 0.03 1.37 0.18 -0.96 -1.64 117.16 111.18 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 0.23 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.18 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 -0.80 2.57 0.11 9.48 5.15 -1.12 -4.49 115.26 126.16 2kg1 n ASN 307 Ca 0.07 -0.24 0.04 0.00 -0.60 0.00 0.00 54.58 53.85 2kg1 n ASN 307 Cb 0.03 1.04 0.00 0.00 -0.53 0.00 0.00 39.78 40.32 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 0.44 1.20 3.04 -0.11 -3.38 116.94 118.12 2kg1 h PHE 308 Ca 0.00 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.93 2kg1 h PHE 308 Cb 0.05 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.57 2kg1 h PHE 308 CO 0.00 0.38 -0.21 0.74 -2.02 0.00 0.00 178.31 177.20 2kg1 h PHE 309 N 0.00 -0.55 -2.03 0.41 0.04 -1.75 -3.50 116.94 109.56 2kg1 h PHE 309 Ca -0.06 -0.01 0.27 0.00 2.80 0.00 0.00 57.97 60.97 2kg1 h PHE 309 Cb 1.34 0.18 -0.05 0.00 2.20 0.00 0.00 35.95 39.62 2kg1 h PHE 309 CO 0.00 -0.30 0.73 0.45 -0.60 0.00 0.00 178.31 178.58 2kg1 n SER 310 N -5.17 -1.05 -1.39 2.17 2.88 -1.26 -4.80 113.62 105.00 2kg1 n SER 310 Ca -0.08 -1.27 -0.07 0.00 -1.33 0.00 0.00 58.87 56.12 2kg1 n SER 310 Cb 0.25 1.65 0.04 0.00 -0.75 0.00 0.00 64.21 65.40 2kg1 n SER 310 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2kg1 n PRO 311 N -0.75 1.33 0.00 -1.46 -0.04 -1.26 -4.50 135.00 128.32 2kg1 n PRO 311 Ca 0.03 -0.76 0.00 0.00 -0.04 0.00 0.00 63.50 62.73 2kg1 n PRO 311 Cb 0.48 -1.30 0.00 0.00 -0.04 0.00 0.00 33.50 32.65 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 0.26 0.00 -3.84 1.53 4.77 -1.26 -5.10 117.00 113.36 2kg1 n LEU 312 Ca 0.15 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 56.01 2kg1 n LEU 312 Cb 0.74 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.72 2kg1 n LEU 312 CO 0.16 0.00 -0.18 0.54 -1.33 0.00 0.00 177.39 176.58 2kg1 s ASN 313 N -1.59 -0.08 0.00 -1.43 2.20 -1.26 -5.05 114.94 107.73 2kg1 s ASN 313 Ca 0.00 0.09 0.05 0.00 -0.94 0.00 0.00 52.86 52.06 2kg1 s ASN 313 Cb 0.00 0.28 0.32 0.00 -2.00 0.00 0.00 41.25 39.85 2kg1 s ASN 313 CO 0.00 -0.20 1.00 -0.81 -2.94 0.00 0.00 177.10 174.16 2kg1 n PRO 314 N 2.31 0.77 0.00 3.55 -0.04 -1.26 -4.10 135.00 136.23 2kg1 n PRO 314 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2kg1 n PRO 314 Cb 0.57 -1.11 0.01 0.00 -0.04 0.00 0.00 33.50 32.94 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 -0.61 0.00 -0.01 0.52 0.24 -1.26 -3.61 118.33 113.60 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 0.02 -0.71 0.00 0.00 -1.47 0.00 0.00 33.84 31.68 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 -0.73 1.47 -2.31 7.34 1.85 -1.26 -4.84 116.66 118.19 2kg1 n ARG 316 Ca 0.00 -0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.49 2kg1 n ARG 316 Cb 0.00 -0.11 -0.01 0.00 -1.05 0.00 0.00 32.46 31.28 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 -0.21 3.23 0.21 8.89 -7.23 -1.24 -1.11 120.40 122.95 2kg1 s VAL 317 Ca 0.00 0.88 -0.20 0.00 -1.81 0.00 0.00 61.98 60.85 2kg1 s VAL 317 Cb 0.00 -3.42 0.03 0.00 0.56 0.00 0.00 36.38 33.55 2kg1 s VAL 317 CO 0.00 -0.06 0.60 -2.28 -0.31 0.00 0.00 175.10 173.05 2kg1 s HIS 318 N -1.64 -0.22 0.04 2.82 5.04 -0.82 -4.91 115.29 115.61 2kg1 s HIS 318 Ca 0.65 -0.13 -0.06 0.00 -1.54 0.00 0.00 55.06 53.99 2kg1 s HIS 318 Cb -0.26 0.51 -0.01 0.00 0.04 0.00 0.00 32.58 32.86 2kg1 s HIS 318 CO 0.31 -1.00 0.10 0.42 -2.34 0.00 0.00 174.74 172.24 2kg1 s ILE 319 N -3.86 0.13 0.09 0.89 1.01 -1.26 -2.85 121.20 115.34 2kg1 s ILE 319 Ca 0.08 -1.06 0.01 0.00 0.00 0.00 0.00 60.65 59.68 2kg1 s ILE 319 Cb -0.02 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.54 2kg1 s ILE 319 CO -0.02 -0.58 -0.04 -0.70 0.00 0.00 0.00 174.94 173.60 2kg1 s GLU 320 N -2.54 0.79 0.07 2.79 2.12 -0.23 -4.91 118.70 116.79 2kg1 s GLU 320 Ca -0.05 -1.32 0.01 0.00 0.36 0.00 0.00 54.97 53.96 2kg1 s GLU 320 Cb -0.02 -0.04 -0.04 0.00 0.26 0.00 0.00 34.13 34.30 2kg1 s GLU 320 CO -0.04 -0.08 -0.06 0.42 -0.54 0.00 0.00 175.26 174.96 2kg1 s ILE 321 N -3.76 0.52 1.00 -3.70 -1.09 -1.26 -1.37 121.20 111.53 2kg1 s ILE 321 Ca 0.12 -1.70 -0.15 0.00 -2.23 0.00 0.00 60.65 56.69 2kg1 s ILE 321 Cb 0.06 -1.38 0.19 0.00 -1.58 0.00 0.00 42.46 39.76 2kg1 s ILE 321 CO -0.05 -0.80 1.19 -0.83 -1.23 0.00 0.00 174.94 173.21 2kg1 s GLY 322 N -2.68 1.64 0.00 6.18 0.00 -1.26 -4.92 107.32 106.28 2kg1 s GLY 322 Ca 0.05 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 43.93 2kg1 s GLY 322 CO -0.05 -0.14 0.70 -1.55 0.00 0.00 0.00 173.10 172.06 2kg1 n PRO 323 N -4.02 0.72 0.00 2.90 -0.04 -1.26 -2.52 135.00 130.79 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 -1.02 0.00 0.00 -0.04 0.00 0.00 33.50 33.03 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 -0.46 0.18 -2.93 3.54 2.03 -1.26 -5.03 116.55 112.63 2kg1 n ASP 324 Ca 0.00 -0.52 -0.12 0.00 0.52 0.00 0.00 54.79 54.67 2kg1 n ASP 324 Cb 0.01 0.33 -0.01 0.00 -0.72 0.00 0.00 41.12 40.73 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 0.33 -0.48 3.36 0.27 0.00 -1.05 -4.96 105.19 102.66 2kg1 n GLY 325 Ca 0.00 0.03 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.99 -3.48 0.00 1.61 0.63 -1.26 -4.82 116.66 106.35 2kg1 n ARG 326 Ca -0.01 -1.01 0.00 0.00 -0.92 0.00 0.00 57.85 55.91 2kg1 n ARG 326 Cb 0.52 -2.05 0.00 0.00 0.45 0.00 0.00 32.46 31.39 2kg1 n ARG 326 CO 0.00 0.00 0.00 1.55 -2.51 0.00 0.00 177.63 176.67 2kg1 n VAL 327 N -5.34 1.21 -0.52 5.15 3.14 -1.26 -4.70 118.33 116.01 2kg1 n VAL 327 Ca 0.06 0.33 -0.29 0.00 -2.96 0.00 0.00 64.34 61.48 2kg1 n VAL 327 Cb 0.56 -1.33 0.23 0.00 -1.06 0.00 0.00 33.84 32.25 2kg1 n VAL 327 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 2kg1 n THR 328 N -1.29 0.00 0.00 1.55 5.66 -1.26 -4.84 114.28 114.10 2kg1 n THR 328 Ca 0.00 -0.37 0.00 0.00 -3.05 0.00 0.00 64.05 60.63 2kg1 n THR 328 Cb 0.03 -0.83 0.00 0.00 -1.55 0.00 0.00 70.33 67.97 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 1.56 0.58 3.42 1.09 0.00 -1.26 -4.71 105.19 105.86 2kg1 n GLY 329 Ca 0.02 -0.91 -0.14 0.00 0.00 0.00 0.00 46.02 44.99 2kg1 n GLY 329 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2kg1 s GLU 330 N -2.00 1.68 0.08 1.61 2.02 -0.47 -4.64 118.70 116.98 2kg1 s GLU 330 Ca 0.00 -1.67 -0.02 0.00 0.02 0.00 0.00 54.97 53.29 2kg1 s GLU 330 Cb 0.00 0.40 -0.03 0.00 0.10 0.00 0.00 34.13 34.60 2kg1 s GLU 330 CO 0.00 -0.67 0.04 0.00 0.02 0.00 0.00 175.26 174.65 2kg1 s ALA 331 N -3.50 0.48 0.18 5.21 0.00 -1.18 -1.07 121.76 121.88 2kg1 s ALA 331 Ca 0.32 -1.19 -0.14 0.00 0.00 0.00 0.00 51.96 50.96 2kg1 s ALA 331 Cb 0.01 0.50 0.01 0.00 0.00 0.00 0.00 23.12 23.64 2kg1 s ALA 331 CO 0.18 -0.44 0.42 0.16 0.00 0.00 0.00 175.76 176.08 2kg1 s ASP 332 N -2.95 -0.12 0.13 0.00 -4.77 -1.13 -1.57 116.67 106.26 2kg1 s ASP 332 Ca 0.12 -0.67 -0.00 0.00 -3.30 0.00 0.00 52.55 48.69 2kg1 s ASP 332 Cb 0.07 0.52 -0.04 0.00 -1.09 0.00 0.00 42.92 42.38 2kg1 s ASP 332 CO -0.06 -0.99 0.04 0.68 0.70 0.00 0.00 175.17 175.54 2kg1 s VAL 333 N -3.92 0.23 -0.43 2.11 -7.23 -0.46 -1.94 120.40 108.76 2kg1 s VAL 333 Ca 0.13 -1.92 0.06 0.00 -1.81 0.00 0.00 61.98 58.44 2kg1 s VAL 333 Cb 0.01 -2.03 0.20 0.00 0.56 0.00 0.00 36.38 35.12 2kg1 s VAL 333 CO -0.01 -0.50 0.43 1.21 -0.31 0.00 0.00 175.10 175.92 2kg1 n GLU 334 N -0.11 0.59 -1.57 4.82 2.13 -0.26 -1.61 120.64 124.63 2kg1 n GLU 334 Ca -0.06 -3.35 -0.40 0.00 0.66 0.00 0.00 57.16 54.00 2kg1 n GLU 334 Cb 0.63 -1.58 0.02 0.00 0.27 0.00 0.00 31.44 30.78 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 2.18 0.61 -2.29 4.31 3.72 0.80 -4.39 117.46 122.39 2kg1 n PHE 335 Ca 0.26 0.53 -0.42 0.00 -0.05 0.00 0.00 57.45 57.78 2kg1 n PHE 335 Cb 0.49 -2.14 -0.03 0.00 -0.94 0.00 0.00 39.48 36.86 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 -1.40 2.78 0.52 4.37 0.00 -1.26 -3.23 121.76 123.55 2kg1 s ALA 336 Ca 0.66 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.15 2kg1 s ALA 336 Cb -0.53 -4.09 0.00 0.00 0.00 0.00 0.00 23.12 18.50 2kg1 s ALA 336 CO 0.55 -2.91 0.00 0.25 0.00 0.00 0.00 175.76 173.65 2kg1 n THR 337 N 7.01 -0.65 0.33 0.00 -2.24 -1.26 -3.25 114.28 114.23 2kg1 n THR 337 Ca 0.15 0.75 0.13 0.00 -2.27 0.00 0.00 64.05 62.81 2kg1 n THR 337 Cb 0.49 -1.18 0.57 0.00 -2.10 0.00 0.00 70.33 68.12 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 -1.25 0.00 -0.31 4.78 2.76 -1.86 -2.90 115.15 116.37 2kg1 h HIS 338 Ca -0.15 0.00 -0.12 0.00 -2.20 0.00 0.00 60.37 57.89 2kg1 h HIS 338 Cb 1.21 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.17 2kg1 h HIS 338 CO 0.03 0.00 -0.29 0.93 -1.30 0.00 0.00 177.93 177.30 2kg1 h GLU 339 N 0.00 0.74 0.00 5.26 5.08 -1.96 -0.82 114.58 122.89 2kg1 h GLU 339 Ca 0.00 -0.39 -0.11 0.00 -1.00 0.00 0.00 59.36 57.87 2kg1 h GLU 339 Cb 0.29 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2kg1 h GLU 339 CO 0.00 1.01 -0.51 0.93 -1.00 0.00 0.00 179.01 179.44 2kg1 h GLU 340 N 0.50 0.00 -0.42 2.33 4.39 -1.49 -1.24 114.58 118.65 2kg1 h GLU 340 Ca 0.05 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.70 2kg1 h GLU 340 Cb 0.87 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.50 2kg1 h GLU 340 CO 0.07 0.51 0.08 0.00 -1.16 0.00 0.00 179.01 178.52 2kg1 h ALA 341 N 1.49 0.56 0.00 3.43 0.00 -1.33 -2.51 119.26 120.90 2kg1 h ALA 341 Ca -0.01 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 2kg1 h ALA 341 Cb 0.95 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2kg1 h ALA 341 CO 0.07 0.26 -0.22 -0.39 0.00 0.00 0.00 179.25 178.97 2kg1 h VAL 342 N 0.55 0.39 0.00 0.00 -1.51 -1.14 -1.81 116.25 112.72 2kg1 h VAL 342 Ca 0.13 -1.47 0.00 0.00 -1.23 0.00 0.00 66.70 64.13 2kg1 h VAL 342 Cb 0.35 2.12 0.00 0.00 -2.13 0.00 0.00 31.29 31.64 2kg1 h VAL 342 CO 0.01 0.21 0.00 0.00 -1.23 0.00 0.00 177.57 176.56 2kg1 n ALA 343 N -2.16 1.83 -0.10 5.19 0.00 -0.47 -2.59 120.51 122.20 2kg1 n ALA 343 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2kg1 n ALA 343 Cb 0.59 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.44 2.06 -2.17 0.00 0.00 -0.97 -4.85 120.51 113.15 2kg1 n ALA 344 Ca 0.05 -0.33 -0.30 0.00 0.00 0.00 0.00 53.44 52.86 2kg1 n ALA 344 Cb 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.58 2kg1 n ALA 344 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2kg1 s MET 345 N -0.21 2.79 0.00 0.00 0.00 -0.70 -4.24 119.30 116.95 2kg1 s MET 345 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 55.69 54.81 2kg1 s MET 345 Cb 0.00 -5.21 0.00 0.00 0.00 0.00 0.00 34.83 29.62 2kg1 s MET 345 CO 0.00 -3.36 0.57 -1.13 0.00 0.00 0.00 175.02 171.11 2kg1 n SER 346 N 13.00 0.00 -0.31 1.11 3.41 -1.26 -4.93 113.62 124.64 2kg1 n SER 346 Ca 0.42 -1.28 0.01 0.00 -0.26 0.00 0.00 58.87 57.76 2kg1 n SER 346 Cb 0.47 -0.06 0.01 0.00 -0.26 0.00 0.00 64.21 64.38 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 0.00 0.27 0.00 4.33 4.76 -1.26 -4.93 118.16 121.33 2kg1 n LYS 347 Ca 0.00 -1.06 0.00 0.00 -2.87 0.00 0.00 58.31 54.38 2kg1 n LYS 347 Cb 0.56 -0.63 0.00 0.00 -1.84 0.00 0.00 35.03 33.12 2kg1 n LYS 347 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2kg1 n ASP 348 N -0.17 0.00 -2.72 4.39 2.03 -1.26 -1.21 116.55 117.61 2kg1 n ASP 348 Ca 0.02 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.28 2kg1 n ASP 348 Cb 0.62 0.00 0.09 0.00 -0.72 0.00 0.00 41.12 41.11 2kg1 n ASP 348 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 2kg1 n ARG 349 N -2.95 1.37 0.00 -0.67 1.85 -1.26 -1.56 116.66 113.45 2kg1 n ARG 349 Ca 0.00 -2.40 0.00 0.00 -1.00 0.00 0.00 57.85 54.45 2kg1 n ARG 349 Cb 0.00 -0.58 0.00 0.00 -1.05 0.00 0.00 32.46 30.83 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 -0.76 0.00 -2.36 2.89 0.00 -0.35 -4.71 120.51 115.22 2kg1 n ALA 350 Ca -0.02 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.24 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 -0.80 0.00 0.00 0.00 177.50 176.70 2kg1 s ASN 351 N -1.70 2.10 0.00 0.00 -0.87 -1.26 -2.45 114.94 110.76 2kg1 s ASN 351 Ca 0.00 -1.22 0.00 0.00 -1.57 0.00 0.00 52.86 50.07 2kg1 s ASN 351 Cb 0.00 -0.04 0.00 0.00 -0.02 0.00 0.00 41.25 41.19 2kg1 s ASN 351 CO 0.00 -0.47 0.00 0.80 -2.57 0.00 0.00 177.10 174.86 2kg1 n MET 352 N -0.48 0.00 -3.60 -0.60 1.56 -1.26 -4.77 117.12 107.98 2kg1 n MET 352 Ca -0.05 0.00 -0.10 0.00 -0.27 0.00 0.00 57.70 57.28 2kg1 n MET 352 Cb 0.64 -0.01 -0.06 0.00 2.15 0.00 0.00 33.22 35.95 2kg1 n MET 352 CO 0.00 0.00 0.00 1.14 -0.73 0.00 0.00 175.97 176.38 2kg1 s GLN 353 N -1.95 0.55 0.00 2.12 -2.07 -1.26 -5.01 119.66 112.04 2kg1 s GLN 353 Ca 0.00 0.26 0.00 0.00 -1.82 0.00 0.00 55.36 53.80 2kg1 s GLN 353 Cb 0.00 0.26 0.00 0.00 -1.09 0.00 0.00 33.01 32.18 2kg1 s GLN 353 CO 0.00 -0.14 0.00 1.58 -1.32 0.00 0.00 175.29 175.41 2kg1 n HIS 354 N 1.14 0.00 -2.01 9.60 -0.00 -1.26 -4.61 115.22 118.09 2kg1 n HIS 354 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.61 2kg1 n HIS 354 Cb 0.57 -0.88 0.00 0.00 -0.00 0.00 0.00 29.99 29.69 2kg1 n HIS 354 CO 0.00 0.00 0.00 -2.13 -0.00 0.00 0.00 176.34 174.21 2kg1 n ARG 355 N -0.95 0.00 -3.46 1.57 3.00 -1.26 -5.09 116.66 110.47 2kg1 n ARG 355 Ca 0.00 0.00 -0.29 0.00 -0.00 0.00 0.00 57.85 57.56 2kg1 n ARG 355 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 32.38 2kg1 n ARG 355 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.63 180.11 2kg1 n TYR 356 N 0.00 3.53 -1.50 -0.14 4.11 -1.26 -4.16 117.16 117.73 2kg1 n TYR 356 Ca 0.00 -4.06 -0.37 0.00 -0.00 0.00 0.00 57.90 53.47 2kg1 n TYR 356 Cb 0.00 -0.64 0.05 0.00 -0.00 0.00 0.00 39.34 38.75 2kg1 n TYR 356 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.86 175.97 2kg1 n ILE 357 N 1.06 2.95 -3.57 -3.48 2.08 -1.03 -4.56 119.36 112.82 2kg1 n ILE 357 Ca 0.28 -0.48 -0.12 0.00 0.56 0.00 0.00 62.75 62.99 2kg1 n ILE 357 Cb 0.39 -0.93 -0.04 0.00 -0.75 0.00 0.00 39.64 38.31 2kg1 n ILE 357 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 2kg1 s GLU 358 N -2.59 1.09 -0.19 0.38 -6.30 -1.26 -2.78 118.70 107.05 2kg1 s GLU 358 Ca 0.72 -0.49 -0.17 0.00 -2.50 0.00 0.00 54.97 52.53 2kg1 s GLU 358 Cb -0.41 0.49 0.05 0.00 0.00 0.00 0.00 34.13 34.26 2kg1 s GLU 358 CO 0.51 -0.43 0.49 -0.48 0.02 0.00 0.00 175.26 175.38 2kg1 s LEU 359 N -2.48 0.11 -0.19 2.70 -0.00 -0.60 -0.25 118.68 117.97 2kg1 s LEU 359 Ca -0.01 1.00 0.01 0.00 -0.00 0.00 0.00 54.13 55.13 2kg1 s LEU 359 Cb 0.00 1.70 0.04 0.00 -0.00 0.00 0.00 46.19 47.93 2kg1 s LEU 359 CO -0.08 -0.17 -0.11 0.12 -0.00 0.00 0.00 176.35 176.10 2kg1 s PHE 360 N 0.27 2.35 0.36 3.48 2.19 0.43 -4.53 117.98 122.53 2kg1 s PHE 360 Ca -0.00 -1.50 -0.27 0.00 0.33 0.00 0.00 56.93 55.49 2kg1 s PHE 360 Cb -0.03 -1.63 -0.12 0.00 -1.31 0.00 0.00 43.02 39.93 2kg1 s PHE 360 CO 0.01 -0.73 1.11 -0.11 1.83 0.00 0.00 175.22 177.33 2kg1 n LEU 361 N 4.71 2.71 -2.70 6.12 0.00 -1.26 -2.93 117.00 123.64 2kg1 n LEU 361 Ca -0.15 1.14 -0.07 0.00 0.00 0.00 0.00 56.01 56.93 2kg1 n LEU 361 Cb 0.47 -1.38 0.06 0.00 0.00 0.00 0.00 43.42 42.57 2kg1 n LEU 361 CO 0.20 -1.11 0.07 -3.20 0.00 0.00 0.00 177.39 173.35 2kg1 n ASN 362 N 0.80 0.60 -3.51 1.96 5.15 -0.84 -4.87 115.26 114.54 2kg1 n ASN 362 Ca 0.08 -2.53 -0.07 0.00 -0.60 0.00 0.00 54.58 51.46 2kg1 n ASN 362 Cb 0.36 -0.13 -0.00 0.00 -0.53 0.00 0.00 39.78 39.48 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 -2.71 -0.14 0.18 1.20 1.04 -1.15 -3.34 113.70 108.78 2kg1 s SER 363 Ca 0.25 -0.75 -0.16 0.00 0.48 0.00 0.00 55.95 55.77 2kg1 s SER 363 Cb 0.43 0.71 0.02 0.00 0.10 0.00 0.00 66.02 67.28 2kg1 s SER 363 CO -0.01 -1.35 0.48 0.28 0.98 0.00 0.00 173.24 173.63 2kg1 s THR 364 N -3.16 0.03 0.27 2.02 -1.32 -1.26 -5.01 115.64 107.21 2kg1 s THR 364 Ca 0.14 -0.83 -0.30 0.00 -1.21 0.00 0.00 61.69 59.49 2kg1 s THR 364 Cb -0.05 -1.57 -0.11 0.00 -1.51 0.00 0.00 72.50 69.27 2kg1 s THR 364 CO 0.07 -0.16 1.58 0.28 -2.21 0.00 0.00 174.62 174.19 2kg1 s THR 365 N -3.88 2.19 -5.00 5.08 -1.32 -1.26 -4.61 115.64 106.84 2kg1 s THR 365 Ca 0.09 0.15 0.00 0.00 -1.21 0.00 0.00 61.69 60.73 2kg1 s THR 365 Cb -0.00 -3.10 0.00 0.00 -1.51 0.00 0.00 72.50 67.89 2kg1 s THR 365 CO -0.03 0.02 0.00 0.61 -2.21 0.00 0.00 174.62 173.01 2kg1 n GLY 366 N 2.46 -1.15 3.63 6.08 0.00 -1.26 -5.08 105.19 109.87 2kg1 n GLY 366 Ca 0.09 -1.26 -0.29 0.00 0.00 0.00 0.00 46.02 44.57 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 -1.00 0.63 -2.00 4.61 0.00 -1.26 -4.87 121.76 117.87 2kg1 s ALA 367 Ca 0.00 -0.25 0.05 0.00 0.00 0.00 0.00 51.96 51.76 2kg1 s ALA 367 Cb 0.00 -3.16 0.31 0.00 0.00 0.00 0.00 23.12 20.26 2kg1 s ALA 367 CO 0.00 -3.07 0.79 -1.13 0.00 0.00 0.00 175.76 172.35 2kg1 n SER 368 N -4.36 0.00 -3.89 0.00 3.41 -1.26 -4.72 113.62 102.80 2kg1 n SER 368 Ca 0.05 -0.86 -0.10 0.00 -0.26 0.00 0.00 58.87 57.70 2kg1 n SER 368 Cb 0.56 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.42 2kg1 n SER 368 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2kg1 s ASN 369 N -1.65 0.13 0.00 4.04 2.47 -1.26 -2.39 114.94 116.28 2kg1 s ASN 369 Ca 0.08 -0.52 0.00 0.00 0.42 0.00 0.00 52.86 52.84 2kg1 s ASN 369 Cb 0.04 0.27 0.00 0.00 -1.45 0.00 0.00 41.25 40.10 2kg1 s ASN 369 CO 0.06 -0.57 0.00 0.61 -3.72 0.00 0.00 177.10 173.48 2kg1 n GLY 370 N 0.55 0.00 0.36 1.21 0.00 -1.26 -4.99 105.19 101.06 2kg1 n GLY 370 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 1.73 -2.87 4.61 0.00 -1.26 -5.12 120.51 117.60 2kg1 n ALA 371 Ca 0.00 -0.68 -0.16 0.00 0.00 0.00 0.00 53.44 52.60 2kg1 n ALA 371 Cb 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 19.45 19.12 2kg1 n ALA 371 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2kg1 s TYR 372 N 0.00 1.16 0.33 0.00 5.04 -1.26 -5.14 117.35 117.48 2kg1 s TYR 372 Ca 0.00 -1.36 -0.00 0.00 -2.44 0.00 0.00 57.07 53.27 2kg1 s TYR 372 Cb 0.00 -0.12 -0.01 0.00 0.35 0.00 0.00 41.96 42.18 2kg1 s TYR 372 CO 0.00 -1.16 0.40 0.45 -1.34 0.00 0.00 175.55 173.90 2kg1 s SER 373 N -3.27 1.03 -0.02 4.32 0.15 -1.26 -5.07 113.70 109.58 2kg1 s SER 373 Ca 0.31 -1.53 0.03 0.00 0.70 0.00 0.00 55.95 55.47 2kg1 s SER 373 Cb -0.01 0.61 0.05 0.00 -1.71 0.00 0.00 66.02 64.97 2kg1 s SER 373 CO 0.22 -1.20 0.88 -1.54 1.20 0.00 0.00 173.24 172.80 2kg1 n SER 374 N -1.33 1.22 -3.77 5.45 3.41 -1.26 -4.40 113.62 112.93 2kg1 n SER 374 Ca 0.03 -1.90 -0.12 0.00 -0.26 0.00 0.00 58.87 56.61 2kg1 n SER 374 Cb 0.62 -0.10 -0.06 0.00 -0.26 0.00 0.00 64.21 64.40 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 -0.91 1.59 -0.06 4.33 2.00 -1.26 -4.53 119.66 120.81 2kg1 s GLN 375 Ca 0.06 -1.56 0.17 0.00 -2.00 0.00 0.00 55.36 52.02 2kg1 s GLN 375 Cb 0.05 0.40 0.33 0.00 0.80 0.00 0.00 33.01 34.59 2kg1 s GLN 375 CO 0.01 -0.62 1.15 1.55 -0.50 0.00 0.00 175.29 176.87 2kg1 n VAL 376 N -0.43 0.65 -0.86 1.34 3.14 -1.26 -4.72 118.33 116.20 2kg1 n VAL 376 Ca 0.01 -1.41 0.00 0.00 -2.96 0.00 0.00 64.34 59.98 2kg1 n VAL 376 Cb 0.63 0.52 0.00 0.00 -1.06 0.00 0.00 33.84 33.93 2kg1 n VAL 376 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 2kg1 n MET 377 N -0.13 0.02 -0.96 1.45 0.00 -1.26 -5.01 117.12 111.23 2kg1 n MET 377 Ca 0.09 -0.24 -0.06 0.00 0.00 0.00 0.00 57.70 57.49 2kg1 n MET 377 Cb 0.91 -0.57 -0.03 0.00 0.00 0.00 0.00 33.22 33.54 2kg1 n MET 377 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 175.97 177.01 2kg1 n GLN 378 N -0.02 -1.61 -1.26 2.12 1.13 -1.26 -1.71 117.38 114.77 2kg1 n GLN 378 Ca 0.00 0.49 -0.09 0.00 -1.94 0.00 0.00 57.00 55.46 2kg1 n GLN 378 Cb 0.29 -4.41 -0.04 0.00 0.11 0.00 0.00 30.24 26.19 2kg1 n GLN 378 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2kg1 n GLY 379 N 0.15 1.05 3.21 1.08 0.00 -1.26 -4.99 105.19 104.43 2kg1 n GLY 379 Ca -0.06 -0.44 -0.10 0.00 0.00 0.00 0.00 46.02 45.42 2kg1 n GLY 379 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2kg1 s MET 380 N -2.60 0.79 0.00 1.61 0.00 -0.69 -5.26 119.30 113.15 2kg1 s MET 380 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 55.69 54.95 2kg1 s MET 380 Cb 0.00 0.33 0.00 0.00 0.00 0.00 0.00 34.83 35.16 2kg1 s MET 380 CO 0.00 -0.25 0.00 0.41 0.00 0.00 0.00 175.02 175.18