#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whs s TYR 265 N 0.00 3.21 -0.23 0.66 5.04 -1.26 -5.04 117.35 119.72 1whs s TYR 265 Ca 0.00 1.63 -0.03 0.00 -2.44 0.00 0.00 57.07 56.22 1whs s TYR 265 Cb 0.00 -3.15 0.08 0.00 0.35 0.00 0.00 41.96 39.24 1whs s TYR 265 CO 0.00 -0.72 0.08 0.34 -1.34 0.00 0.00 175.55 173.91 1whs s ASP 266 N -1.58 3.13 0.08 4.32 -1.08 -1.26 -5.01 116.67 115.27 1whs s ASP 266 Ca 0.59 -1.03 0.12 0.00 -0.52 0.00 0.00 52.55 51.71 1whs s ASP 266 Cb -0.22 -0.51 0.54 0.00 -1.46 0.00 0.00 42.92 41.27 1whs s ASP 266 CO 0.28 -0.37 1.37 -0.81 0.52 0.00 0.00 175.17 176.16 1whs n PRO 267 N 5.11 0.05 -0.23 4.34 -0.04 -1.26 -3.13 135.00 139.84 1whs n PRO 267 Ca -0.07 0.41 0.08 0.00 -0.04 0.00 0.00 63.50 63.89 1whs n PRO 267 Cb 0.45 -1.61 0.23 0.00 -0.04 0.00 0.00 33.50 32.53 1whs n PRO 267 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1whs h THR 271 N 2.85 0.41 0.00 0.00 1.35 -2.00 0.31 112.91 115.83 1whs h THR 271 Ca 0.00 -0.13 -0.03 0.00 -0.55 0.00 0.00 66.41 65.69 1whs h THR 271 Cb 0.65 -0.02 -0.00 0.00 -1.73 0.00 0.00 68.15 67.05 1whs h THR 271 CO 0.00 0.07 -0.17 -0.33 -0.25 0.00 0.00 175.52 174.84 1whs h GLU 272 N 0.39 0.00 -0.65 4.72 5.08 -1.90 -2.01 114.58 120.20 1whs h GLU 272 Ca 0.68 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 59.02 1whs h GLU 272 Cb 1.61 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.83 1whs h GLU 272 CO -0.46 0.17 0.33 0.00 -1.00 0.00 0.00 179.01 178.04 1whs h ARG 273 N 0.00 0.93 -0.02 2.33 -0.00 -0.73 -2.40 114.38 114.49 1whs h ARG 273 Ca -0.00 -0.13 -0.00 0.00 -0.50 0.00 0.00 59.98 59.35 1whs h ARG 273 Cb 0.45 -0.17 -0.00 0.00 0.00 0.00 0.00 29.97 30.25 1whs h ARG 273 CO 0.02 0.73 -0.00 1.88 0.00 0.00 0.00 179.97 182.60 1whs h TYR 274 N 0.90 0.04 0.21 3.04 0.05 -1.36 -2.44 116.97 117.40 1whs h TYR 274 Ca 0.23 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 59.01 1whs h TYR 274 Cb 0.09 -0.01 -0.04 0.00 1.01 0.00 0.00 36.73 37.78 1whs h TYR 274 CO -0.00 0.39 -0.46 0.77 -1.05 0.00 0.00 178.16 177.80 1whs h SER 275 N -0.32 -1.35 -1.03 3.88 0.02 -1.43 0.32 113.55 113.65 1whs h SER 275 Ca 0.01 0.14 0.27 0.00 -0.84 0.00 0.00 61.79 61.36 1whs h SER 275 Cb 0.37 0.49 -0.08 0.00 0.14 0.00 0.00 62.40 63.32 1whs h SER 275 CO 0.00 -0.55 0.68 0.74 -1.14 0.00 0.00 176.83 176.57 1whs h THR 276 N -0.76 0.53 0.48 -2.27 2.02 -1.46 0.59 112.91 112.04 1whs h THR 276 Ca -0.00 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.04 1whs h THR 276 Cb 0.74 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1whs h THR 276 CO -0.21 0.06 -0.23 0.00 0.37 0.00 0.00 175.52 175.51 1whs h ALA 277 N 1.58 -0.71 -0.75 6.16 0.00 -0.68 -2.98 119.26 121.88 1whs h ALA 277 Ca 0.56 -0.14 0.16 0.00 0.00 0.00 0.00 54.91 55.50 1whs h ALA 277 Cb 1.58 0.25 -0.11 0.00 0.00 0.00 0.00 17.79 19.51 1whs h ALA 277 CO -0.22 -0.66 0.17 -0.92 0.00 0.00 0.00 179.25 177.62 1whs h TYR 278 N -1.05 0.27 0.00 0.00 3.20 0.19 -1.13 116.97 118.45 1whs h TYR 278 Ca -0.07 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 1whs h TYR 278 Cb 0.49 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.76 1whs h TYR 278 CO 0.02 -0.10 -0.00 1.88 -1.64 0.00 0.00 178.16 178.31 1whs h TYR 279 N 0.26 0.00 0.00 -3.82 0.05 -0.02 -2.77 116.97 110.67 1whs h TYR 279 Ca 0.42 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.20 1whs h TYR 279 Cb 0.73 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.47 1whs h TYR 279 CO -0.27 0.00 -0.00 0.09 -1.05 0.00 0.00 178.16 176.93 1whs n ASN 280 N -3.09 0.55 -4.75 3.88 3.02 -0.43 -4.66 115.26 109.78 1whs n ASN 280 Ca 0.01 0.55 -0.42 0.00 -0.03 0.00 0.00 54.58 54.70 1whs n ASN 280 Cb 0.35 -0.69 -0.02 0.00 -0.61 0.00 0.00 39.78 38.80 1whs n ASN 280 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1whs s ARG 281 N -3.07 4.13 0.32 3.52 0.52 -1.05 -4.94 118.95 118.38 1whs s ARG 281 Ca 0.12 2.56 0.12 0.00 -0.52 0.00 0.00 55.73 58.01 1whs s ARG 281 Cb 0.15 -3.04 0.51 0.00 0.52 0.00 0.00 34.95 33.09 1whs s ARG 281 CO 0.58 -0.64 1.69 0.00 0.02 0.00 0.00 175.30 176.95 1whs h ARG 282 N 5.16 0.00 -0.40 3.54 -0.00 -1.90 -2.24 114.38 118.54 1whs h ARG 282 Ca -0.46 0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 58.88 1whs h ARG 282 Cb 1.22 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.18 1whs h ARG 282 CO 0.82 0.52 -0.31 0.38 0.00 0.00 0.00 179.97 181.37 1whs h ASP 283 N 0.00 0.94 -0.29 7.04 3.04 -1.95 -1.26 116.42 123.94 1whs h ASP 283 Ca -0.01 -0.39 -0.12 0.00 -3.24 0.00 0.00 57.03 53.28 1whs h ASP 283 Cb 0.94 -0.26 -0.00 0.00 -1.04 0.00 0.00 39.33 38.96 1whs h ASP 283 CO 0.07 1.16 -0.28 -0.37 -2.04 0.00 0.00 179.24 177.78 1whs h VAL 284 N 0.75 1.30 -0.76 4.15 -1.51 -1.82 -1.23 116.25 117.14 1whs h VAL 284 Ca 0.08 -1.44 0.06 0.00 -1.23 0.00 0.00 66.70 64.17 1whs h VAL 284 Cb 0.88 1.58 -0.05 0.00 -2.13 0.00 0.00 31.29 31.57 1whs h VAL 284 CO 0.08 0.46 0.50 1.56 -1.23 0.00 0.00 177.57 178.94 1whs h GLN 285 N 0.44 0.78 0.32 5.19 4.20 -1.35 -0.89 115.11 123.81 1whs h GLN 285 Ca 0.05 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1whs h GLN 285 Cb 0.85 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1whs h GLN 285 CO 0.07 0.52 -0.15 0.52 -0.67 0.00 0.00 178.83 179.11 1whs h MET 286 N 0.81 -0.42 -0.02 1.46 2.86 -0.87 0.64 114.93 119.39 1whs h MET 286 Ca 0.33 0.03 0.01 0.00 -2.06 0.00 0.00 59.70 58.00 1whs h MET 286 Cb 0.24 0.09 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 1whs h MET 286 CO -0.11 -0.14 0.11 0.00 1.06 0.00 0.00 176.91 177.83 1whs h ALA 287 N -0.09 1.20 0.00 6.32 0.00 -0.57 0.18 119.26 126.29 1whs h ALA 287 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1whs h ALA 287 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1whs h ALA 287 CO 0.07 -0.12 -0.92 1.28 0.00 0.00 0.00 179.25 179.56 1whs n LEU 288 N -3.14 0.63 -0.89 0.00 4.77 -0.40 -4.93 117.00 113.04 1whs n LEU 288 Ca -0.02 0.04 -0.08 0.00 -0.03 0.00 0.00 56.01 55.91 1whs n LEU 288 Cb 0.18 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 1whs n LEU 288 CO 0.19 0.02 -0.10 1.41 -1.33 0.00 0.00 177.39 177.58 1whs n HIS 289 N -1.99 -0.34 -3.99 -1.77 8.25 0.64 -4.98 115.22 111.04 1whs n HIS 289 Ca 0.02 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.15 1whs n HIS 289 Cb 0.43 -2.10 -0.06 0.00 1.12 0.00 0.00 29.99 29.39 1whs n HIS 289 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1whs s ALA 290 N -2.39 3.78 -1.21 -1.41 0.00 0.21 -4.40 121.76 116.34 1whs s ALA 290 Ca 0.00 -0.81 -0.21 0.00 0.00 0.00 0.00 51.96 50.94 1whs s ALA 290 Cb 0.00 -1.75 0.01 0.00 0.00 0.00 0.00 23.12 21.38 1whs s ALA 290 CO 0.00 0.72 0.68 -1.71 0.00 0.00 0.00 175.76 175.45 1whs n ASN 291 N 1.09 -4.03 -0.05 0.00 5.15 -1.26 -4.29 115.26 111.87 1whs n ASN 291 Ca -0.12 -1.11 -0.08 0.00 -0.60 0.00 0.00 54.58 52.67 1whs n ASN 291 Cb 0.53 -2.76 -0.01 0.00 -0.53 0.00 0.00 39.78 37.00 1whs n ASN 291 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1whs h VAL 292 N -2.11 0.57 -0.01 3.44 2.07 -1.91 -2.82 116.25 115.48 1whs h VAL 292 Ca -0.68 0.00 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1whs h VAL 292 Cb 1.38 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1whs h VAL 292 CO 0.52 0.00 0.00 0.35 0.02 0.00 0.00 177.57 178.46 1whs n THR 293 N -5.31 0.01 -0.93 2.57 -2.24 -1.26 -4.90 114.28 102.22 1whs n THR 293 Ca -0.01 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1whs n THR 293 Cb 0.22 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 1whs n THR 293 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1whs n GLY 294 N 1.05 0.22 0.23 3.38 0.00 -1.07 -4.87 105.19 104.14 1whs n GLY 294 Ca 0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.15 1whs n GLY 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1whs h ALA 295 N 0.00 0.66 -1.25 4.61 0.00 -1.90 -3.40 119.26 117.97 1whs h ALA 295 Ca 0.00 -0.17 -0.33 0.00 0.00 0.00 0.00 54.91 54.41 1whs h ALA 295 Cb 0.49 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.09 1whs h ALA 295 CO 0.00 0.29 1.17 -1.64 0.00 0.00 0.00 179.25 179.07 1whs s MET 296 N -5.49 1.95 -0.43 0.00 -1.94 -1.26 -4.75 119.30 107.38 1whs s MET 296 Ca -0.13 1.14 -0.01 0.00 -1.71 0.00 0.00 55.69 54.98 1whs s MET 296 Cb 0.12 -4.64 0.32 0.00 2.01 0.00 0.00 34.83 32.64 1whs s MET 296 CO 0.78 -3.62 1.96 0.27 -0.01 0.00 0.00 175.02 174.40 1whs n ASN 297 N 16.73 6.42 -3.85 3.03 0.23 -1.26 -4.85 115.26 131.71 1whs n ASN 297 Ca 0.40 -3.30 -0.11 0.00 -0.53 0.00 0.00 54.58 51.04 1whs n ASN 297 Cb 0.52 -0.98 -0.10 0.00 -2.08 0.00 0.00 39.78 37.13 1whs n ASN 297 CO 0.00 0.00 0.00 -0.72 -0.93 0.00 0.00 177.26 175.61 1whs s TYR 298 N -2.51 0.01 0.43 -2.53 -0.85 -1.26 -5.15 117.35 105.48 1whs s TYR 298 Ca 0.43 -0.06 -0.23 0.00 -0.52 0.00 0.00 57.07 56.68 1whs s TYR 298 Cb 0.34 -0.03 -0.08 0.00 0.38 0.00 0.00 41.96 42.57 1whs s TYR 298 CO 0.01 -0.30 1.10 0.99 -1.52 0.00 0.00 175.55 175.83 1whs s THR 299 N -1.34 3.47 0.20 -3.49 2.01 -1.26 -4.99 115.64 110.23 1whs s THR 299 Ca -0.14 1.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.66 1whs s THR 299 Cb -0.07 -3.56 -0.09 0.00 0.01 0.00 0.00 72.50 68.79 1whs s THR 299 CO 0.02 -0.01 1.31 0.86 -0.69 0.00 0.00 174.62 176.11 1whs s TRP 300 N -1.62 3.25 0.17 4.92 -0.00 -1.26 -5.04 118.94 119.36 1whs s TRP 300 Ca 0.60 1.22 0.06 0.00 -0.00 0.00 0.00 56.10 57.98 1whs s TRP 300 Cb -0.25 -3.61 -0.05 0.00 -0.00 0.00 0.00 33.47 29.57 1whs s TRP 300 CO 0.30 -1.90 -0.12 0.00 -0.00 0.00 0.00 176.95 175.23 1whs s ALA 301 N 0.12 1.72 0.32 5.86 0.00 -1.26 -4.87 121.76 123.66 1whs s ALA 301 Ca 0.57 -1.57 0.18 0.00 0.00 0.00 0.00 51.96 51.14 1whs s ALA 301 Cb -0.37 -0.02 0.87 0.00 0.00 0.00 0.00 23.12 23.61 1whs s ALA 301 CO 0.38 -0.01 1.86 1.79 0.00 0.00 0.00 175.76 179.77 1whs h THR 302 N 2.69 1.00 -4.19 0.00 1.35 -1.96 -3.45 112.91 108.35 1whs h THR 302 Ca -0.37 -1.18 -0.13 0.00 -0.55 0.00 0.00 66.41 64.18 1whs h THR 302 Cb 1.21 1.68 -0.15 0.00 -1.73 0.00 0.00 68.15 69.16 1whs h THR 302 CO 0.62 0.31 -0.61 0.00 -0.25 0.00 0.00 175.52 175.60 1whs s SER 303 N -2.94 5.70 0.41 0.00 0.15 -1.26 -4.96 113.70 110.80 1whs s SER 303 Ca 0.11 -0.83 0.11 0.00 0.70 0.00 0.00 55.95 56.03 1whs s SER 303 Cb 0.07 -2.03 0.86 0.00 -1.71 0.00 0.00 66.02 63.22 1whs s SER 303 CO -0.07 -0.33 1.96 0.44 1.20 0.00 0.00 173.24 176.43 1whs h ASP 303 N 8.42 0.18 0.30 5.45 3.32 -2.00 -0.69 116.42 131.40 1whs h ASP 303 Ca -0.28 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.73 1whs h ASP 303 Cb 1.12 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.62 1whs h ASP 303 CO 0.65 0.31 -0.15 0.74 -1.72 0.00 0.00 179.24 179.08 1whs h THR 304 N 0.19 0.72 -0.68 0.35 2.02 -1.97 0.18 112.91 113.72 1whs h THR 304 Ca 0.04 -0.17 0.01 0.00 0.77 0.00 0.00 66.41 67.06 1whs h THR 304 Cb 0.31 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 1whs h THR 304 CO 0.02 0.04 0.45 0.40 0.37 0.00 0.00 175.52 176.79 1whs h ILE 305 N -0.50 1.17 -0.99 3.11 2.04 -1.87 0.19 117.51 120.67 1whs h ILE 305 Ca -0.04 -0.32 0.14 0.00 1.00 0.00 0.00 64.86 65.65 1whs h ILE 305 Cb 0.37 0.17 -0.09 0.00 -0.74 0.00 0.00 36.82 36.53 1whs h ILE 305 CO 0.07 0.17 0.62 -1.13 0.00 0.00 0.00 178.15 177.88 1whs h ASN 306 N 0.92 0.85 0.07 1.72 -0.73 -0.79 -2.09 115.58 115.52 1whs h ASN 306 Ca 0.25 0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.48 1whs h ASN 306 Cb -0.10 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 38.39 1whs h ASN 306 CO -0.06 0.41 -0.42 0.35 -0.37 0.00 0.00 177.43 177.35 1whs n THR 307 N -4.64 0.00 -2.08 -3.57 -2.24 0.61 -4.31 114.28 98.05 1whs n THR 307 Ca 0.20 -0.21 -0.24 0.00 -2.27 0.00 0.00 64.05 61.53 1whs n THR 307 Cb 0.43 0.98 0.02 0.00 -2.10 0.00 0.00 70.33 69.66 1whs n THR 307 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1whs n HIS 308 N -0.25 2.78 -2.97 4.78 8.25 0.60 -5.05 115.22 123.36 1whs n HIS 308 Ca 0.10 -2.30 -0.40 0.00 -0.26 0.00 0.00 57.72 54.86 1whs n HIS 308 Cb 0.43 -0.31 -0.05 0.00 1.12 0.00 0.00 29.99 31.17 1whs n HIS 308 CO 0.00 0.00 0.00 -0.46 0.64 0.00 0.00 176.34 176.52 1whs s TRP 308 N -3.60 3.82 0.00 4.41 -0.11 -1.15 -4.91 118.94 117.40 1whs s TRP 308 Ca 0.50 1.57 0.00 0.00 1.22 0.00 0.00 56.10 59.39 1whs s TRP 308 Cb 0.41 -2.81 0.00 0.00 -1.50 0.00 0.00 33.47 29.57 1whs s TRP 308 CO 0.02 0.38 0.00 0.72 -4.62 0.00 0.00 176.95 173.45 1whs n HIS 308 N 2.26 0.00 -1.67 5.86 8.25 -1.26 -5.04 115.22 123.62 1whs n HIS 308 Ca -0.04 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.01 1whs n HIS 308 Cb 0.49 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.61 1whs n HIS 308 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1whs n ASP 308 N 0.00 2.18 -2.71 0.41 5.75 -1.26 -5.00 116.55 115.93 1whs n ASP 308 Ca 0.00 1.11 -0.04 0.00 -0.01 0.00 0.00 54.79 55.85 1whs n ASP 308 Cb 0.00 -1.45 0.03 0.00 -1.03 0.00 0.00 41.12 38.68 1whs n ASP 308 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1whs n ALA 309 N -0.15 -2.96 -1.01 2.12 0.00 -1.26 -5.17 120.51 112.09 1whs n ALA 309 Ca 0.07 -0.45 -0.32 0.00 0.00 0.00 0.00 53.44 52.74 1whs n ALA 309 Cb 0.38 -2.55 0.01 0.00 0.00 0.00 0.00 19.45 17.30 1whs n ALA 309 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1whs n PRO 310 N 2.49 0.00 0.06 0.00 -0.04 -1.26 -4.89 135.00 131.36 1whs n PRO 310 Ca 0.12 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.43 1whs n PRO 310 Cb 0.63 -0.82 -0.06 0.00 -0.04 0.00 0.00 33.50 33.20 1whs n PRO 310 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1whs h ARG 311 N -0.08 0.48 -5.75 0.54 2.47 -2.05 -3.45 114.38 106.53 1whs h ARG 311 Ca -0.34 -0.51 -0.52 0.00 -1.26 0.00 0.00 59.98 57.35 1whs h ARG 311 Cb 1.18 0.15 -0.25 0.00 -1.65 0.00 0.00 29.97 29.40 1whs h ARG 311 CO 0.33 1.16 -0.82 0.45 0.56 0.00 0.00 179.97 181.65 1whs s SER 312 N -7.13 2.12 -0.00 7.04 0.15 -1.26 -4.97 113.70 109.65 1whs s SER 312 Ca -0.07 -0.51 0.20 0.00 0.70 0.00 0.00 55.95 56.28 1whs s SER 312 Cb 0.08 -0.16 -0.23 0.00 -1.71 0.00 0.00 66.02 64.00 1whs s SER 312 CO 0.88 0.10 0.83 0.23 1.20 0.00 0.00 173.24 176.48 1whs n MET 313 N 1.81 0.26 -0.33 5.44 2.81 -1.26 -4.62 117.12 121.23 1whs n MET 313 Ca -0.18 -0.02 0.21 0.00 -1.81 0.00 0.00 57.70 55.91 1whs n MET 313 Cb 0.54 -1.47 0.43 0.00 -0.71 0.00 0.00 33.22 32.01 1whs n MET 313 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1whs h LEU 314 N 0.00 0.47 -0.59 4.03 3.38 -1.97 -0.26 115.31 120.38 1whs h LEU 314 Ca 0.00 0.18 -0.13 0.00 0.09 0.00 0.00 57.88 58.02 1whs h LEU 314 Cb 0.53 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1whs h LEU 314 CO 0.00 -0.09 -0.26 -0.65 0.09 0.00 0.00 178.44 177.52 1whs h PRO 315 N 0.36 0.84 -0.69 1.13 0.11 -1.99 0.35 132.00 132.11 1whs h PRO 315 Ca 0.69 -0.37 -0.06 0.00 0.11 0.00 0.00 66.00 66.38 1whs h PRO 315 Cb 1.51 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.57 1whs h PRO 315 CO -0.59 1.00 0.21 0.82 -0.21 0.00 0.00 178.00 179.23 1whs h ILE 316 N 0.72 1.25 -0.22 4.15 2.04 -1.41 0.28 117.51 124.32 1whs h ILE 316 Ca 0.09 -0.88 -0.00 0.00 1.00 0.00 0.00 64.86 65.07 1whs h ILE 316 Cb 0.80 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1whs h ILE 316 CO 0.07 0.34 0.13 1.88 0.00 0.00 0.00 178.15 180.57 1whs h TYR 317 N 1.02 0.30 -0.77 1.37 -1.99 -0.59 0.13 116.97 116.43 1whs h TYR 317 Ca 0.22 -0.00 0.02 0.00 2.00 0.00 0.00 58.73 60.97 1whs h TYR 317 Cb 0.30 -0.10 -0.04 0.00 2.00 0.00 0.00 36.73 38.89 1whs h TYR 317 CO 0.02 0.24 0.49 0.00 -0.00 0.00 0.00 178.16 178.92 1whs h ARG 318 N 0.26 0.95 0.61 4.88 3.08 0.39 0.25 114.38 124.80 1whs h ARG 318 Ca 0.08 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.05 1whs h ARG 318 Cb 0.04 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1whs h ARG 318 CO -0.01 0.63 -0.41 1.49 -1.07 0.00 0.00 179.97 180.60 1whs h GLU 319 N 0.98 -0.92 0.00 0.04 4.81 -0.43 -0.42 114.58 118.62 1whs h GLU 319 Ca 0.30 0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.57 1whs h GLU 319 Cb -0.03 0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.56 1whs h GLU 319 CO -0.10 -0.62 -0.13 -0.07 -0.73 0.00 0.00 179.01 177.37 1whs h LEU 320 N -0.96 0.00 -0.58 1.64 3.38 -0.63 0.22 115.31 118.38 1whs h LEU 320 Ca -0.08 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1whs h LEU 320 Cb 0.78 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 1whs h LEU 320 CO 0.06 0.13 0.06 0.40 0.09 0.00 0.00 178.44 179.18 1whs h ILE 321 N 0.00 1.26 -0.28 1.22 2.04 -0.17 -0.92 117.51 120.66 1whs h ILE 321 Ca -0.00 -1.05 -0.13 0.00 1.00 0.00 0.00 64.86 64.68 1whs h ILE 321 Cb 0.22 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.09 1whs h ILE 321 CO 0.02 0.38 -0.38 0.00 0.00 0.00 0.00 178.15 178.17 1whs h ALA 322 N 0.99 0.81 0.00 1.87 0.00 0.31 -2.22 119.26 121.02 1whs h ALA 322 Ca 0.17 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1whs h ALA 322 Cb 0.47 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1whs h ALA 322 CO 0.02 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1whs n ALA 323 N -2.51 1.34 -0.82 0.00 0.00 0.64 -4.86 120.51 114.29 1whs n ALA 323 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1whs n ALA 323 Cb 0.51 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1whs n ALA 323 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1whs n GLY 324 N -0.73 0.54 3.77 0.00 0.00 -0.64 -5.04 105.19 103.09 1whs n GLY 324 Ca 0.01 -0.46 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 1whs n GLY 324 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1whs s LEU 328 N 0.00 3.38 -0.11 0.99 1.43 -0.45 -4.99 118.68 118.94 1whs s LEU 328 Ca 0.00 1.98 -0.29 0.00 -1.03 0.00 0.00 54.13 54.79 1whs s LEU 328 Cb 0.00 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.66 1whs s LEU 328 CO 0.00 -1.62 0.98 -0.60 0.23 0.00 0.00 176.35 175.35 1whs s ARG 329 N -4.13 4.41 -0.14 1.70 3.52 -1.26 -4.78 118.95 118.27 1whs s ARG 329 Ca 0.66 1.34 -0.00 0.00 -0.13 0.00 0.00 55.73 57.61 1whs s ARG 329 Cb -0.20 -3.54 0.03 0.00 -1.56 0.00 0.00 34.95 29.68 1whs s ARG 329 CO 0.42 -0.30 -0.08 0.42 -0.81 0.00 0.00 175.30 174.95 1whs s ILE 330 N 1.98 1.14 -0.01 4.11 1.01 -1.26 -5.12 121.20 123.05 1whs s ILE 330 Ca 0.47 -0.47 0.07 0.00 0.00 0.00 0.00 60.65 60.72 1whs s ILE 330 Cb -0.18 -1.21 -0.02 0.00 0.01 0.00 0.00 42.46 41.07 1whs s ILE 330 CO 0.18 0.29 -0.22 0.26 0.00 0.00 0.00 174.94 175.45 1whs s TRP 331 N 1.64 1.94 -0.07 3.97 0.52 -1.26 -1.53 118.94 124.15 1whs s TRP 331 Ca 0.03 -0.37 0.03 0.00 0.02 0.00 0.00 56.10 55.81 1whs s TRP 331 Cb -0.14 -1.24 0.01 0.00 -1.15 0.00 0.00 33.47 30.96 1whs s TRP 331 CO -0.08 -0.02 -0.15 0.08 0.02 0.00 0.00 176.95 176.80 1whs s VAL 332 N -0.54 1.30 0.24 4.03 1.01 -0.73 -4.98 120.40 120.73 1whs s VAL 332 Ca 0.08 -0.59 0.05 0.00 0.00 0.00 0.00 61.98 61.53 1whs s VAL 332 Cb -0.08 -1.16 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 1whs s VAL 332 CO -0.01 0.39 -0.05 0.72 0.00 0.00 0.00 175.10 176.15 1whs s PHE 333 N 0.52 1.73 -0.20 5.22 -0.71 -1.26 -1.68 117.98 121.60 1whs s PHE 333 Ca -0.14 -0.76 -0.08 0.00 -1.04 0.00 0.00 56.93 54.91 1whs s PHE 333 Cb -0.15 -0.96 0.09 0.00 -1.21 0.00 0.00 43.02 40.78 1whs s PHE 333 CO 0.04 0.16 0.45 0.45 -1.34 0.00 0.00 175.22 174.98 1whs s SER 334 N -3.36 -0.41 -0.24 1.98 0.15 -0.38 -4.97 113.70 106.48 1whs s SER 334 Ca 0.27 1.04 -0.29 0.00 0.70 0.00 0.00 55.95 57.67 1whs s SER 334 Cb 0.04 1.30 -0.00 0.00 -1.71 0.00 0.00 66.02 65.64 1whs s SER 334 CO 0.09 -0.22 1.21 -0.83 1.20 0.00 0.00 173.24 174.68 1whs s GLY 335 N 2.33 1.57 0.00 9.45 0.00 -1.26 -1.26 107.32 118.14 1whs s GLY 335 Ca -0.04 0.23 0.13 0.00 0.00 0.00 0.00 44.72 45.03 1whs s GLY 335 CO -0.14 2.43 1.40 2.09 0.00 0.00 0.00 173.10 178.88 1whs n ASP 336 N 6.89 0.00 -0.98 1.64 5.68 -0.92 -2.97 116.55 125.89 1whs n ASP 336 Ca 0.13 0.48 0.04 0.00 -0.50 0.00 0.00 54.79 54.94 1whs n ASP 336 Cb 0.46 -0.49 0.24 0.00 -1.14 0.00 0.00 41.12 40.19 1whs n ASP 336 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1whs n THR 337 N -1.49 2.38 -3.39 2.12 -2.24 -0.49 -4.86 114.28 106.32 1whs n THR 337 Ca 0.03 -2.13 -0.37 0.00 -2.27 0.00 0.00 64.05 59.30 1whs n THR 337 Cb 0.14 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.03 1whs n THR 337 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1whs s ASP 338 N -2.11 6.90 -0.00 3.42 2.15 -1.16 -4.66 116.67 121.21 1whs s ASP 338 Ca 0.43 1.09 0.08 0.00 0.43 0.00 0.00 52.55 54.58 1whs s ASP 338 Cb 0.36 -2.30 -0.09 0.00 -0.30 0.00 0.00 42.92 40.60 1whs s ASP 338 CO 0.06 0.25 0.32 0.00 -0.17 0.00 0.00 175.17 175.63 1whs n ALA 339 N 1.52 2.94 0.04 3.66 0.00 -1.26 -4.31 120.51 123.10 1whs n ALA 339 Ca -0.10 -0.22 -0.12 0.00 0.00 0.00 0.00 53.44 52.99 1whs n ALA 339 Cb 0.52 -0.29 -0.09 0.00 0.00 0.00 0.00 19.45 19.59 1whs n ALA 339 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1whs h VAL 340 N 0.00 1.10 -2.45 0.00 2.07 -1.99 -3.37 116.25 111.62 1whs h VAL 340 Ca 0.00 -1.06 -0.59 0.00 0.82 0.00 0.00 66.70 65.87 1whs h VAL 340 Cb 0.21 1.75 -0.40 0.00 -1.52 0.00 0.00 31.29 31.33 1whs h VAL 340 CO 0.00 0.25 -0.84 0.52 0.02 0.00 0.00 177.57 177.52 1whs n VAL 341 N -4.92 0.22 -1.66 2.57 0.31 -1.26 -5.12 118.33 108.46 1whs n VAL 341 Ca -0.08 -4.22 -0.31 0.00 -0.01 0.00 0.00 64.34 59.72 1whs n VAL 341 Cb 0.26 -1.93 0.05 0.00 -0.91 0.00 0.00 33.84 31.31 1whs n VAL 341 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1whs s PRO 342 N -1.02 2.88 0.24 5.55 0.04 -1.26 -4.88 135.00 136.55 1whs s PRO 342 Ca 0.32 0.80 -0.08 0.00 0.04 0.00 0.00 61.00 62.08 1whs s PRO 342 Cb 0.06 -2.00 0.37 0.00 0.04 0.00 0.00 34.50 32.98 1whs s PRO 342 CO -0.14 -1.10 1.36 -0.11 0.04 0.00 0.00 177.00 177.06 1whs n LEU 343 N -3.10 -0.36 0.07 -3.56 7.94 -1.26 0.10 117.00 116.82 1whs n LEU 343 Ca 0.07 1.51 0.04 0.00 -1.11 0.00 0.00 56.01 56.52 1whs n LEU 343 Cb 0.55 -0.44 0.43 0.00 0.53 0.00 0.00 43.42 44.49 1whs n LEU 343 CO 0.57 -1.43 1.05 0.74 -1.11 0.00 0.00 177.39 177.20 1whs h THR 344 N 0.00 1.12 0.43 1.96 2.02 -1.97 0.06 112.91 116.53 1whs h THR 344 Ca 0.40 -0.39 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 1whs h THR 344 Cb 0.62 0.81 -0.00 0.00 -1.74 0.00 0.00 68.15 67.84 1whs h THR 344 CO -0.90 0.14 -0.24 0.00 0.37 0.00 0.00 175.52 174.90 1whs h ALA 345 N 1.72 -0.62 -0.95 6.16 0.00 -0.70 -1.15 119.26 123.72 1whs h ALA 345 Ca 0.10 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1whs h ALA 345 Cb 0.11 0.28 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 1whs h ALA 345 CO -0.01 -0.86 0.62 1.15 0.00 0.00 0.00 179.25 180.15 1whs h THR 346 N -0.62 1.17 0.01 0.00 2.02 -1.00 -0.84 112.91 113.66 1whs h THR 346 Ca -0.05 -0.41 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 1whs h THR 346 Cb 0.50 -0.14 0.00 0.00 -1.74 0.00 0.00 68.15 66.77 1whs h THR 346 CO 0.07 0.22 -0.01 0.03 0.37 0.00 0.00 175.52 176.20 1whs h ARG 347 N 1.21 -0.02 -0.50 6.66 3.08 -0.86 -0.90 114.38 123.05 1whs h ARG 347 Ca 0.37 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.38 1whs h ARG 347 Cb -0.02 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 1whs h ARG 347 CO -0.12 -0.00 0.14 1.88 -1.07 0.00 0.00 179.97 180.80 1whs h TYR 348 N -0.02 0.83 0.23 3.04 0.05 -0.92 -1.61 116.97 118.57 1whs h TYR 348 Ca -0.00 -0.09 -0.01 0.00 0.05 0.00 0.00 58.73 58.68 1whs h TYR 348 Cb 0.02 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 37.52 1whs h TYR 348 CO -0.08 0.73 -0.13 0.77 -1.05 0.00 0.00 178.16 178.40 1whs h SER 349 N 0.69 -0.33 -0.62 3.88 0.02 -0.91 -1.53 113.55 114.74 1whs h SER 349 Ca 0.16 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1whs h SER 349 Cb 0.30 0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1whs h SER 349 CO -0.00 -0.22 0.25 0.40 -1.14 0.00 0.00 176.83 176.12 1whs h ILE 350 N -0.35 1.23 -0.06 3.27 1.08 -1.22 -1.26 117.51 120.20 1whs h ILE 350 Ca -0.02 -0.73 0.02 0.00 -0.39 0.00 0.00 64.86 63.74 1whs h ILE 350 Cb 0.28 0.46 -0.00 0.00 -3.07 0.00 0.00 36.82 34.49 1whs h ILE 350 CO 0.03 0.29 0.05 1.23 -0.69 0.00 0.00 178.15 179.06 1whs h GLY 351 N 1.03 0.00 2.00 5.37 0.00 -0.90 0.25 103.07 110.82 1whs h GLY 351 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1whs h GLY 351 CO -0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.52 1whs h ALA 352 N 1.96 1.00 0.00 3.60 0.00 -0.19 -0.13 119.26 125.50 1whs h ALA 352 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1whs h ALA 352 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1whs h ALA 352 CO -0.00 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.18 1whs h LEU 353 N 0.00 0.00 2.88 0.00 3.38 -0.99 -3.47 115.31 117.12 1whs h LEU 353 Ca 0.00 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.55 1whs h LEU 353 Cb 0.29 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1whs h LEU 353 CO 0.00 0.00 -0.53 0.61 0.09 0.00 0.00 178.44 178.61 1whs n GLY 362 N 0.67 -0.36 3.82 0.83 0.00 -0.06 -4.95 105.19 105.13 1whs n GLY 362 Ca 0.03 -0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1whs n GLY 362 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1whs s LEU 363 N -5.96 3.11 0.36 0.99 1.43 -1.26 -5.01 118.68 112.34 1whs s LEU 363 Ca 0.00 1.61 -0.14 0.00 -1.03 0.00 0.00 54.13 54.57 1whs s LEU 363 Cb 0.00 -4.47 -0.08 0.00 0.03 0.00 0.00 46.19 41.67 1whs s LEU 363 CO 0.00 -1.49 0.77 -2.16 0.23 0.00 0.00 176.35 173.71 1whs s PRO 364 N -5.04 3.95 0.02 1.29 0.04 -1.26 -4.87 135.00 129.13 1whs s PRO 364 Ca 0.58 0.66 -0.20 0.00 0.04 0.00 0.00 61.00 62.08 1whs s PRO 364 Cb -0.14 -2.38 -0.06 0.00 0.04 0.00 0.00 34.50 31.96 1whs s PRO 364 CO 0.55 0.07 0.58 0.99 0.04 0.00 0.00 177.00 179.23 1whs s THR 365 N -2.14 4.86 -0.11 1.26 2.01 -1.26 0.12 115.64 120.37 1whs s THR 365 Ca 0.54 1.23 0.11 0.00 0.31 0.00 0.00 61.69 63.88 1whs s THR 365 Cb -0.10 -3.92 -0.16 0.00 0.01 0.00 0.00 72.50 68.34 1whs s THR 365 CO 0.22 0.46 0.07 0.41 -0.69 0.00 0.00 174.62 175.09 1whs n THR 366 N 2.39 0.75 -3.51 -0.82 -1.04 0.42 -4.81 114.28 107.65 1whs n THR 366 Ca -0.08 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.05 61.34 1whs n THR 366 Cb 0.51 -0.58 -0.09 0.00 -1.82 0.00 0.00 70.33 68.35 1whs n THR 366 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1whs s THR 367 N -2.37 -0.60 0.85 12.58 2.01 -0.22 -4.95 115.64 122.96 1whs s THR 367 Ca -0.06 0.07 -0.11 0.00 0.31 0.00 0.00 61.69 61.90 1whs s THR 367 Cb 0.04 -0.71 0.11 0.00 0.01 0.00 0.00 72.50 71.95 1whs s THR 367 CO 0.51 -0.02 1.11 -0.55 -0.69 0.00 0.00 174.62 174.97 1whs s SER 368 N 2.55 3.70 -0.45 3.53 0.15 -1.26 -0.67 113.70 121.25 1whs s SER 368 Ca 0.05 1.88 -0.44 0.00 0.70 0.00 0.00 55.95 58.14 1whs s SER 368 Cb -0.14 -2.48 -0.19 0.00 -1.71 0.00 0.00 66.02 61.51 1whs s SER 368 CO -0.14 -2.56 1.48 1.87 1.20 0.00 0.00 173.24 175.10 1whs n TRP 369 N -3.86 1.61 -3.97 3.44 -0.00 -1.24 -4.69 117.44 108.73 1whs n TRP 369 Ca 0.09 1.08 -0.09 0.00 -0.00 0.00 0.00 57.50 58.59 1whs n TRP 369 Cb 0.53 -2.09 -0.09 0.00 -0.00 0.00 0.00 31.31 29.65 1whs n TRP 369 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 177.69 179.21 1whs s TYR 370 N 2.71 0.29 0.19 5.87 1.13 0.15 -4.91 117.35 122.78 1whs s TYR 370 Ca 0.98 -0.67 -0.30 0.00 -1.41 0.00 0.00 57.07 55.68 1whs s TYR 370 Cb -1.40 -0.21 -0.08 0.00 -1.10 0.00 0.00 41.96 39.17 1whs s TYR 370 CO 0.76 -0.37 0.93 -1.25 -2.51 0.00 0.00 175.55 173.12 1whs s PRO 371 N -2.95 4.78 0.06 -3.49 0.04 -1.26 -0.61 135.00 131.57 1whs s PRO 371 Ca -0.02 1.44 0.04 0.00 0.04 0.00 0.00 61.00 62.50 1whs s PRO 371 Cb 0.01 -3.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.20 1whs s PRO 371 CO -0.06 0.42 -0.00 1.67 0.04 0.00 0.00 177.00 179.06 1whs s TRP 372 N -0.76 3.01 0.10 0.56 1.48 0.23 -4.57 118.94 118.99 1whs s TRP 372 Ca 0.43 -0.00 0.10 0.00 -1.06 0.00 0.00 56.10 55.56 1whs s TRP 372 Cb -0.25 -1.57 -0.04 0.00 -1.16 0.00 0.00 33.47 30.45 1whs s TRP 372 CO 0.31 0.47 -0.25 0.71 -4.06 0.00 0.00 176.95 174.13 1whs s TYR 373 N -1.25 2.15 -0.36 1.66 1.51 0.72 0.32 117.35 122.10 1whs s TYR 373 Ca 0.24 -0.39 0.02 0.00 -1.01 0.00 0.00 57.07 55.93 1whs s TYR 373 Cb -0.12 -1.19 0.11 0.00 -0.11 0.00 0.00 41.96 40.65 1whs s TYR 373 CO 0.16 0.26 0.11 0.34 -1.11 0.00 0.00 175.55 175.31 1whs s ASP 374 N -1.83 4.40 0.52 2.29 2.15 0.55 -4.76 116.67 119.98 1whs s ASP 374 Ca 0.11 -2.17 0.00 0.00 0.43 0.00 0.00 52.55 50.92 1whs s ASP 374 Cb -0.10 -1.36 0.00 0.00 -0.30 0.00 0.00 42.92 41.16 1whs s ASP 374 CO 0.05 -0.36 0.00 0.47 -0.17 0.00 0.00 175.17 175.16 1whs n ASP 375 N 4.20 0.00 -0.15 -0.34 8.00 -1.26 -2.08 116.55 124.91 1whs n ASP 375 Ca 0.03 0.00 0.03 0.00 0.71 0.00 0.00 54.79 55.56 1whs n ASP 375 Cb 0.40 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.50 1whs n ASP 375 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1whs n GLN 375 N 0.00 2.37 -3.87 -1.24 0.00 -1.26 -4.96 117.38 108.42 1whs n GLN 375 Ca 0.00 -0.48 -0.23 0.00 0.00 0.00 0.00 57.00 56.29 1whs n GLN 375 Cb 0.00 -0.98 -0.02 0.00 0.00 0.00 0.00 30.24 29.24 1whs n GLN 375 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.06 175.85 1whs s GLU 376 N -1.10 3.45 -0.28 2.61 2.02 -0.88 -5.05 118.70 119.47 1whs s GLU 376 Ca 0.06 -0.64 -0.29 0.00 0.02 0.00 0.00 54.97 54.12 1whs s GLU 376 Cb 0.06 -2.88 0.01 0.00 0.10 0.00 0.00 34.13 31.42 1whs s GLU 376 CO 0.18 0.42 1.06 0.08 0.02 0.00 0.00 175.26 177.01 1whs s VAL 377 N -1.96 4.59 -0.24 2.63 1.01 -1.26 -0.33 120.40 124.84 1whs s VAL 377 Ca 0.35 1.88 0.19 0.00 0.00 0.00 0.00 61.98 64.40 1whs s VAL 377 Cb -0.10 -4.36 0.09 0.00 0.00 0.00 0.00 36.38 32.01 1whs s VAL 377 CO 0.30 -0.34 1.29 1.23 0.00 0.00 0.00 175.10 177.58 1whs h GLY 378 N 9.79 0.00 0.00 4.51 0.00 -0.46 -3.46 103.07 113.45 1whs h GLY 378 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.13 1whs h GLY 378 CO 1.01 0.00 0.00 0.61 0.00 0.00 0.00 176.54 178.16 1whs n GLY 379 N 1.22 -0.29 3.59 4.60 0.00 -1.24 -0.15 105.19 112.92 1whs n GLY 379 Ca -0.00 -1.25 -0.27 0.00 0.00 0.00 0.00 46.02 44.50 1whs n GLY 379 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1whs s TRP 380 N -2.99 2.43 -0.08 1.61 0.51 -0.98 -0.60 118.94 118.83 1whs s TRP 380 Ca 0.00 -0.69 -0.26 0.00 -2.12 0.00 0.00 56.10 53.03 1whs s TRP 380 Cb 0.00 -1.66 0.06 0.00 -0.81 0.00 0.00 33.47 31.06 1whs s TRP 380 CO 0.00 0.41 0.60 0.45 -0.51 0.00 0.00 176.95 177.89 1whs s SER 381 N -3.67 -0.57 -0.03 2.95 0.15 0.21 -0.26 113.70 112.50 1whs s SER 381 Ca 0.35 0.71 0.01 0.00 0.70 0.00 0.00 55.95 57.72 1whs s SER 381 Cb 0.09 0.65 0.02 0.00 -1.71 0.00 0.00 66.02 65.07 1whs s SER 381 CO 0.17 -0.50 -0.03 -1.58 1.20 0.00 0.00 173.24 172.51 1whs s GLN 382 N -0.90 0.51 -0.24 5.44 0.74 -0.37 -0.67 119.66 124.17 1whs s GLN 382 Ca -0.09 -0.07 -0.07 0.00 0.05 0.00 0.00 55.36 55.17 1whs s GLN 382 Cb -0.02 -0.57 -0.03 0.00 1.10 0.00 0.00 33.01 33.49 1whs s GLN 382 CO 0.07 -0.03 0.07 0.08 -0.55 0.00 0.00 175.29 174.92 1whs s VAL 383 N 0.59 4.38 0.51 1.34 1.01 0.16 -1.22 120.40 127.17 1whs s VAL 383 Ca -0.07 -0.15 0.07 0.00 0.00 0.00 0.00 61.98 61.83 1whs s VAL 383 Cb -0.10 -3.03 0.03 0.00 0.00 0.00 0.00 36.38 33.27 1whs s VAL 383 CO -0.01 0.36 0.49 -0.31 0.00 0.00 0.00 175.10 175.63 1whs s TYR 384 N 1.39 1.96 -0.81 5.22 2.02 0.12 0.16 117.35 127.41 1whs s TYR 384 Ca 0.05 -0.69 -0.26 0.00 -0.37 0.00 0.00 57.07 55.80 1whs s TYR 384 Cb -0.15 -2.08 0.03 0.00 -0.40 0.00 0.00 41.96 39.37 1whs s TYR 384 CO 0.04 -0.51 1.37 0.21 -1.57 0.00 0.00 175.55 175.08 1whs s LYS 385 N -4.32 3.26 0.00 -0.62 2.20 0.31 -3.27 119.74 117.30 1whs s LYS 385 Ca 0.45 -0.44 0.00 0.00 -0.36 0.00 0.00 55.97 55.63 1whs s LYS 385 Cb -0.03 -4.52 0.00 0.00 -1.51 0.00 0.00 37.83 31.76 1whs s LYS 385 CO 0.28 -2.22 0.00 0.41 -0.36 0.00 0.00 175.35 173.46 1whs n GLY 386 N 5.83 0.87 3.57 5.54 0.00 -1.26 -4.70 105.19 115.03 1whs n GLY 386 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.00 1whs n GLY 386 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1whs s LEU 387 N 0.00 -0.58 -0.09 0.99 0.20 -1.20 -4.37 118.68 113.64 1whs s LEU 387 Ca 0.00 0.80 0.04 0.00 0.69 0.00 0.00 54.13 55.66 1whs s LEU 387 Cb 0.00 2.27 0.00 0.00 -0.43 0.00 0.00 46.19 48.03 1whs s LEU 387 CO 0.00 -0.41 -0.21 -0.89 -0.29 0.00 0.00 176.35 174.55 1whs s THR 388 N -0.67 1.79 -0.12 3.68 2.01 -0.58 -0.70 115.64 121.05 1whs s THR 388 Ca -0.05 -0.87 -0.00 0.00 0.31 0.00 0.00 61.69 61.08 1whs s THR 388 Cb -0.02 -1.56 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 1whs s THR 388 CO 0.04 0.50 -0.11 -0.22 -0.69 0.00 0.00 174.62 174.14 1whs s LEU 389 N 0.37 2.83 -0.03 4.42 2.96 -0.36 -1.78 118.68 127.10 1whs s LEU 389 Ca -0.16 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.50 1whs s LEU 389 Cb -0.17 -1.64 0.02 0.00 0.50 0.00 0.00 46.19 44.91 1whs s LEU 389 CO 0.07 0.20 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.58 1whs s VAL 390 N 0.13 0.39 0.05 1.68 1.01 -0.68 -1.24 120.40 121.76 1whs s VAL 390 Ca -0.06 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 61.90 1whs s VAL 390 Cb -0.15 -0.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 1whs s VAL 390 CO 0.04 0.19 0.03 -0.94 0.00 0.00 0.00 175.10 174.42 1whs s SER 391 N 0.85 5.24 -0.36 3.32 1.04 0.65 -1.25 113.70 123.19 1whs s SER 391 Ca -0.10 -0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.28 1whs s SER 391 Cb -0.13 -1.35 0.10 0.00 0.10 0.00 0.00 66.02 64.73 1whs s SER 391 CO -0.00 0.21 0.09 -0.69 0.98 0.00 0.00 173.24 173.83 1whs s VAL 392 N -1.26 2.72 -0.18 5.02 1.01 -0.39 -2.32 120.40 125.00 1whs s VAL 392 Ca 0.25 -2.10 -0.35 0.00 0.00 0.00 0.00 61.98 59.78 1whs s VAL 392 Cb -0.12 -2.88 -0.12 0.00 0.00 0.00 0.00 36.38 33.26 1whs s VAL 392 CO 0.17 -0.55 1.92 -1.14 0.00 0.00 0.00 175.10 175.50 1whs n ARG 393 N 4.43 1.79 -0.62 2.72 0.63 0.79 -2.21 116.66 124.20 1whs n ARG 393 Ca -0.01 0.63 0.00 0.00 -0.92 0.00 0.00 57.85 57.55 1whs n ARG 393 Cb 0.42 -2.53 0.00 0.00 0.45 0.00 0.00 32.46 30.80 1whs n ARG 393 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1whs n GLY 394 N 4.75 0.80 3.83 5.14 0.00 -1.26 -4.85 105.19 113.60 1whs n GLY 394 Ca 0.27 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.91 1whs n GLY 394 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1whs s ALA 395 N -3.19 3.67 1.00 4.61 0.00 -0.94 -4.73 121.76 122.19 1whs s ALA 395 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1whs s ALA 395 Cb 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 23.12 20.69 1whs s ALA 395 CO 0.00 0.47 0.00 0.41 0.00 0.00 0.00 175.76 176.64 1whs n GLY 396 N 1.68 -1.13 0.35 0.00 0.00 -1.26 -1.39 105.19 103.43 1whs n GLY 396 Ca -0.12 -1.59 0.01 0.00 0.00 0.00 0.00 46.02 44.31 1whs n GLY 396 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1whs h HIS 397 N -0.35 1.10 -3.03 1.61 2.76 -1.87 -3.32 115.15 112.05 1whs h HIS 397 Ca 0.00 0.03 -0.75 0.00 -2.20 0.00 0.00 60.37 57.45 1whs h HIS 397 Cb 0.00 -0.36 -0.22 0.00 1.55 0.00 0.00 27.41 28.38 1whs h HIS 397 CO 0.00 0.59 0.60 -1.21 -1.30 0.00 0.00 177.93 176.61 1whs s GLU 398 N -6.07 3.75 0.16 5.26 2.02 -1.26 -4.86 118.70 117.70 1whs s GLU 398 Ca -0.13 -2.32 -0.16 0.00 0.02 0.00 0.00 54.97 52.38 1whs s GLU 398 Cb 0.19 -4.72 0.09 0.00 0.10 0.00 0.00 34.13 29.79 1whs s GLU 398 CO 0.80 -1.53 1.70 0.28 0.02 0.00 0.00 175.26 176.54 1whs h VAL 399 N 5.01 0.74 0.00 2.63 2.07 -1.94 -1.39 116.25 123.37 1whs h VAL 399 Ca 0.17 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.65 1whs h VAL 399 Cb 0.99 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 1whs h VAL 399 CO 0.99 0.02 0.00 -2.65 0.02 0.00 0.00 177.57 175.95 1whs n PRO 400 N -5.17 0.17 -0.05 1.57 -0.02 -1.26 -0.24 135.00 129.99 1whs n PRO 400 Ca 0.02 0.18 -0.20 0.00 -2.02 0.00 0.00 63.50 61.47 1whs n PRO 400 Cb 0.19 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.04 1whs n PRO 400 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1whs n LEU 401 N -1.30 2.73 -0.01 2.45 7.94 -0.59 -3.90 117.00 124.31 1whs n LEU 401 Ca 0.06 0.08 -0.05 0.00 -1.11 0.00 0.00 56.01 55.00 1whs n LEU 401 Cb 0.10 -1.03 -0.12 0.00 0.53 0.00 0.00 43.42 42.90 1whs n LEU 401 CO 0.10 0.86 -0.54 1.41 -1.11 0.00 0.00 177.39 178.11 1whs n HIS 402 N -3.45 0.80 -3.10 1.96 8.25 -0.80 -4.48 115.22 114.40 1whs n HIS 402 Ca -0.38 0.28 -0.20 0.00 -0.26 0.00 0.00 57.72 57.16 1whs n HIS 402 Cb 1.01 -1.09 -0.03 0.00 1.12 0.00 0.00 29.99 31.00 1whs n HIS 402 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1whs n ARG 403 N -2.90 1.51 -0.18 -0.41 5.12 0.67 -4.88 116.66 115.60 1whs n ARG 403 Ca -0.16 -3.71 -0.03 0.00 -1.93 0.00 0.00 57.85 52.02 1whs n ARG 403 Cb 0.96 -1.81 0.04 0.00 -1.16 0.00 0.00 32.46 30.49 1whs n ARG 403 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1whs h PRO 404 N 2.99 -0.05 -0.59 5.56 0.13 -1.68 0.32 132.00 138.68 1whs h PRO 404 Ca 0.10 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.21 1whs h PRO 404 Cb 0.88 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.99 1whs h PRO 404 CO 0.58 -0.03 0.27 -0.09 -0.23 0.00 0.00 178.00 178.50 1whs h ARG 405 N -0.05 0.85 -0.02 0.86 2.43 -1.93 -2.34 114.38 114.18 1whs h ARG 405 Ca 0.26 -0.13 -0.18 0.00 -0.81 0.00 0.00 59.98 59.12 1whs h ARG 405 Cb 0.45 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1whs h ARG 405 CO -0.58 0.70 -0.78 -0.56 -1.51 0.00 0.00 179.97 177.23 1whs h GLN 406 N 0.80 0.20 -0.59 0.20 -0.00 -1.81 -2.98 115.11 110.92 1whs h GLN 406 Ca 0.20 -0.18 -0.04 0.00 -0.00 0.00 0.00 58.65 58.63 1whs h GLN 406 Cb 0.13 0.05 -0.03 0.00 -0.00 0.00 0.00 27.48 27.63 1whs h GLN 406 CO -0.02 0.88 0.20 0.00 -0.00 0.00 0.00 178.83 179.89 1whs h ALA 407 N 1.06 1.24 -0.36 0.06 0.00 -0.28 -1.10 119.26 119.88 1whs h ALA 407 Ca -0.03 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1whs h ALA 407 Cb 1.37 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1whs h ALA 407 CO 0.12 0.54 -0.14 1.25 0.00 0.00 0.00 179.25 181.02 1whs h LEU 408 N 0.86 0.64 -0.35 0.00 5.85 -1.31 -1.60 115.31 119.40 1whs h LEU 408 Ca 0.20 -0.19 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1whs h LEU 408 Cb 0.22 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1whs h LEU 408 CO -0.01 0.80 0.11 0.58 -0.34 0.00 0.00 178.44 179.58 1whs h VAL 409 N 0.58 1.21 -0.07 1.05 2.07 -1.22 -1.21 116.25 118.66 1whs h VAL 409 Ca 0.10 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 66.97 1whs h VAL 409 Cb 0.58 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 31.29 1whs h VAL 409 CO 0.04 0.24 -0.28 0.25 0.02 0.00 0.00 177.57 177.83 1whs h LEU 410 N 0.42 -0.86 -0.51 2.57 5.85 -0.97 -1.55 115.31 120.27 1whs h LEU 410 Ca 0.11 0.12 0.07 0.00 0.84 0.00 0.00 57.88 59.03 1whs h LEU 410 Cb 0.26 0.36 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 1whs h LEU 410 CO -0.00 -0.34 0.18 0.15 -0.34 0.00 0.00 178.44 178.09 1whs h PHE 411 N -0.39 0.32 -0.75 1.25 3.57 -1.06 -1.10 116.94 118.79 1whs h PHE 411 Ca 0.08 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 1whs h PHE 411 Cb 0.51 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1whs h PHE 411 CO -0.35 0.10 0.41 1.96 -2.23 0.00 0.00 178.31 178.20 1whs h GLN 412 N 0.36 1.04 -0.32 1.11 4.20 -0.79 -0.76 115.11 119.95 1whs h GLN 412 Ca 0.25 -0.12 -0.11 0.00 0.06 0.00 0.00 58.65 58.72 1whs h GLN 412 Cb 0.27 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1whs h GLN 412 CO -0.25 0.77 -0.27 1.88 -0.67 0.00 0.00 178.83 180.29 1whs h TYR 413 N 1.03 0.75 0.19 2.96 -1.99 -0.78 -0.83 116.97 118.30 1whs h TYR 413 Ca 0.26 -0.18 -0.01 0.00 2.00 0.00 0.00 58.73 60.81 1whs h TYR 413 Cb 0.03 -0.18 -0.00 0.00 2.00 0.00 0.00 36.73 38.58 1whs h TYR 413 CO -0.00 0.86 -0.12 0.35 -0.00 0.00 0.00 178.16 179.25 1whs h PHE 414 N 0.57 -0.30 -0.92 4.88 3.57 -0.88 0.31 116.94 124.16 1whs h PHE 414 Ca 0.07 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.65 1whs h PHE 414 Cb 0.76 0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.54 1whs h PHE 414 CO 0.03 -0.18 0.59 -0.07 -2.23 0.00 0.00 178.31 176.45 1whs h LEU 415 N -0.30 0.88 -0.09 0.59 3.38 -0.96 0.44 115.31 119.25 1whs h LEU 415 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1whs h LEU 415 Cb 0.25 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1whs h LEU 415 CO 0.02 0.54 -0.07 0.00 0.09 0.00 0.00 178.44 179.02 1whs n GLN 416 N -4.52 0.45 -3.19 1.13 6.02 -0.33 -4.90 117.38 112.04 1whs n GLN 416 Ca 0.15 -0.09 -0.19 0.00 -0.01 0.00 0.00 57.00 56.86 1whs n GLN 416 Cb 0.25 -1.50 0.05 0.00 1.02 0.00 0.00 30.24 30.06 1whs n GLN 416 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1whs n GLY 417 N 1.32 -0.28 3.23 1.08 0.00 0.15 -5.00 105.19 105.69 1whs n GLY 417 Ca 0.13 0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1whs n GLY 417 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1whs s LYS 418 N -5.84 2.48 0.46 1.61 1.02 0.75 -5.02 119.74 115.21 1whs s LYS 418 Ca 0.39 -0.83 -0.24 0.00 0.02 0.00 0.00 55.97 55.30 1whs s LYS 418 Cb -0.17 -2.06 -0.08 0.00 -0.52 0.00 0.00 37.83 35.00 1whs s LYS 418 CO 0.48 0.31 1.29 -2.30 -0.92 0.00 0.00 175.35 174.21 1whs n PRO 419 N 3.12 1.88 -1.70 -1.68 -0.02 -1.26 -4.32 135.00 131.01 1whs n PRO 419 Ca -0.18 0.67 -0.41 0.00 -2.02 0.00 0.00 63.50 61.57 1whs n PRO 419 Cb 0.52 -2.44 0.02 0.00 -0.02 0.00 0.00 33.50 31.58 1whs n PRO 419 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1whs n MET 420 N -0.24 1.85 -2.50 -0.52 2.81 -1.26 -4.91 117.12 112.35 1whs n MET 420 Ca 0.07 0.66 -0.41 0.00 -1.81 0.00 0.00 57.70 56.22 1whs n MET 420 Cb 0.41 -2.37 -0.04 0.00 -0.71 0.00 0.00 33.22 30.51 1whs n MET 420 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1whs s PRO 421 N -2.26 4.63 0.19 0.03 0.04 -1.26 -4.95 135.00 131.42 1whs s PRO 421 Ca 0.62 1.76 -0.01 0.00 0.04 0.00 0.00 61.00 63.41 1whs s PRO 421 Cb -0.50 -3.22 0.04 0.00 0.04 0.00 0.00 34.50 30.86 1whs s PRO 421 CO 0.57 0.18 0.26 0.41 0.04 0.00 0.00 177.00 178.46 1whs n GLY 422 N 1.51 0.04 0.83 0.56 0.00 -1.26 -0.20 105.19 106.67 1whs n GLY 422 Ca 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 46.02 44.15 1whs n GLY 422 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26