ATOM TYP RES RESID B-PREDICT B-SCALED B-OBS | B-SCALED | B-OBS |
1 CA ALA 27 154.2275 20.0550 34.9500 |  |  |
2 CA TYR 28 127.6876 16.3060 34.2000 |  |  |
3 CA THR 29 119.9922 15.2190 34.3000 |  |  |
4 CA ASN 30 112.0712 14.1001 33.6800 |  |  |
5 CA SER 31 95.2503 11.7240 32.5100 |  |  |
6 CA PHE 32 106.8660 13.3648 32.1800 |  |  |
7 CA THR 33 104.1869 12.9864 31.9800 |  |  |
8 CA ARG 34 93.3420 11.4544 31.1300 |  |  |
9 CA GLY 35 88.4760 10.7671 31.5500 |  |  |
10 CA VAL 36 101.6654 12.6302 32.0900 |  |  |
11 CA TYR 37 114.7550 14.4792 32.4300 |  |  |
12 CA TYR 38 140.8436 18.1644 32.3800 |  |  |
13 CA PRO 39 153.2974 19.9236 32.7100 |  |  |
14 CA ASP 40 186.7761 24.6527 33.2400 |  |  |
15 CA LYS 41 212.2815 28.2556 32.5800 |  |  |
16 CA VAL 42 241.7926 32.4242 34.5100 |  |  |
17 CA PHE 43 245.1513 32.8987 43.6100 |  |  |
18 CA ARG 44 240.9276 32.3021 30.8900 |  |  |
19 CA SER 45 248.4479 33.3644 31.2100 |  |  |
20 CA SER 46 259.1548 34.8768 30.0600 |  |  |
21 CA VAL 47 240.4516 32.2348 29.0200 |  |  |
22 CA LEU 48 209.1327 27.8108 28.6000 |  |  |
23 CA HIS 49 198.0626 26.2470 28.6400 |  |  |
24 CA SER 50 182.2347 24.0112 29.0000 |  |  |
25 CA THR 51 166.5394 21.7941 29.5000 |  |  |
26 CA GLN 52 151.4618 19.6643 30.2000 |  |  |
27 CA ASP 53 134.0053 17.1984 31.4200 |  |  |
28 CA LEU 54 113.1497 14.2524 32.0400 |  |  |
29 CA PHE 55 97.7321 12.0746 32.1300 |  |  |
30 CA LEU 56 86.3604 10.4682 32.2400 |  |  |
31 CA PRO 57 91.0089 11.1249 31.3400 |  |  |
32 CA PHE 58 97.2958 12.0129 30.7400 |  |  |
33 CA PHE 59 103.2690 12.8567 31.5600 |  |  |
34 CA SER 60 94.3543 11.5974 31.9000 |  |  |
35 CA ASN 61 99.7311 12.3569 33.0500 |  |  |
36 CA VAL 62 95.3412 11.7368 33.1100 |  |  |
37 CA THR 63 109.9156 13.7956 34.1000 |  |  |
38 CA TRP 64 123.1292 15.6621 35.0900 |  |  |
39 CA PHE 65 139.3551 17.9541 35.8600 |  |  |
40 CA HIS 66 166.6326 21.8073 36.6100 |  |  |
41 CA ALA 67 195.3219 25.8599 37.8800 |  |  |
42 CA ILE 68 264.0186 35.5638 39.4400 |  |  |
43 CA HIS 69 321.3475 43.6620 39.5000 |  |  |
44 CA ASP 80 182.0959 23.9916 37.7100 |  |  |
45 CA ASN 81 168.3165 22.0452 38.1900 |  |  |
46 CA PRO 82 170.7213 22.3849 38.5500 |  |  |
47 CA VAL 83 164.5873 21.5184 38.9900 |  |  |
48 CA LEU 84 138.4885 17.8317 38.5700 |  |  |
49 CA PRO 85 136.9711 17.6174 39.1800 |  |  |
50 CA PHE 86 126.6699 16.1623 39.2700 |  |  |
51 CA ASN 87 128.9764 16.4881 38.9600 |  |  |
52 CA ASP 88 128.0970 16.3638 38.0300 |  |  |
53 CA GLY 89 112.1599 14.1126 37.2400 |  |  |
54 CA VAL 90 97.6496 12.0629 35.7800 |  |  |
55 CA TYR 91 87.4396 10.6207 34.6500 |  |  |
56 CA PHE 92 91.8172 11.2390 34.3900 |  |  |
57 CA ALA 93 96.0909 11.8427 34.1400 |  |  |
58 CA SER 94 112.3245 14.1359 35.6900 |  |  |
59 CA THR 95 132.4421 16.9776 37.0800 |  |  |
60 CA GLU 96 154.5352 20.0985 38.2600 |  |  |
61 CA LYS 97 189.3045 25.0099 39.5200 |  |  |
62 CA SER 98 200.0351 26.5257 40.6200 |  |  |
63 CA ASN 99 174.3044 22.8910 39.7400 |  |  |
64 CA ILE 100 178.3459 23.4619 40.3500 |  |  |
65 CA ILE 101 152.1367 19.7597 39.3900 |  |  |
66 CA ARG 102 163.4443 21.3569 39.5000 |  |  |
67 CA GLY 103 157.0736 20.4570 39.0500 |  |  |
68 CA TRP 104 150.1094 19.4733 38.5000 |  |  |
69 CA ILE 105 171.1145 22.4404 40.4900 |  |  |
70 CA PHE 106 169.8330 22.2594 41.0300 |  |  |
71 CA GLY 107 200.5336 26.5961 43.3800 |  |  |
72 CA THR 108 219.1712 29.2288 43.9000 |  |  |
73 CA THR 109 248.7837 33.4118 44.7800 |  |  |
74 CA LEU 110 238.2079 31.9179 44.2600 |  |  |
75 CA ASP 111 293.3460 39.7066 45.0300 |  |  |
76 CA SER 112 329.3295 44.7895 44.8100 |  |  |
77 CA LYS 113 347.3237 47.3314 46.3500 |  |  |
78 CA THR 114 308.1190 41.7934 45.9200 |  |  |
79 CA GLN 115 283.2648 38.2825 45.7800 |  |  |
80 CA SER 116 232.2832 31.0810 44.6100 |  |  |
81 CA LEU 117 204.9682 27.2225 42.8700 |  |  |
82 CA LEU 118 199.5099 26.4515 41.6600 |  |  |
83 CA ILE 119 179.6509 23.6463 42.0600 |  |  |
84 CA VAL 120 190.7935 25.2202 42.4400 |  |  |
85 CA ASN 121 196.7842 26.0665 43.3800 |  |  |
86 CA ASN 122 239.0319 32.0343 43.8700 |  |  |
87 CA ALA 123 267.8380 36.1034 45.3100 |  |  |
88 CA THR 124 278.8545 37.6595 45.7100 |  |  |
89 CA ASN 125 263.8380 35.5383 44.2900 |  |  |
90 CA VAL 126 224.1040 29.9256 43.9700 |  |  |
91 CA VAL 127 234.7351 31.4273 43.8900 |  |  |
92 CA ILE 128 224.7484 30.0166 42.9700 |  |  |
93 CA LYS 129 253.5626 34.0869 42.8100 |  |  |
94 CA VAL 130 260.0725 35.0064 42.6600 |  |  |
95 CA CYS 131 304.7335 41.3151 43.5200 |  |  |
96 CA GLU 132 320.5406 43.5480 44.8800 |  |  |
97 CA PHE 133 300.9066 40.7746 43.9900 |  |  |
98 CA GLN 134 323.9262 44.0263 45.5000 |  |  |
99 CA PHE 135 279.3346 37.7274 45.1300 |  |  |
100 CA CYS 136 300.6726 40.7415 43.5700 |  |  |
101 CA ASN 137 322.4431 43.8168 44.6100 |  |  |
102 CA ASP 138 277.6285 37.4864 43.5600 |  |  |
103 CA PRO 139 242.8735 32.5769 42.4600 |  |  |
104 CA PHE 140 238.9938 32.0289 42.5600 |  |  |
105 CA LEU 141 251.7474 33.8304 42.1800 |  |  |
106 CA GLY 142 296.2356 40.1148 42.7300 |  |  |
107 CA VAL 143 301.9124 40.9167 42.7000 |  |  |
108 CA ASN 165 414.8007 56.8630 45.2700 |  |  |
109 CA CYS 166 361.2885 49.3040 45.4200 |  |  |
110 CA THR 167 350.9182 47.8391 45.5600 |  |  |
111 CA PHE 168 311.5377 42.2763 44.5000 |  |  |
112 CA GLU 169 301.7974 40.9004 43.5900 |  |  |
113 CA TYR 170 287.9325 38.9419 43.9400 |  |  |
114 CA VAL 171 291.7174 39.4765 44.3200 |  |  |
115 CA SER 172 292.3670 39.5683 43.9700 |  |  |
116 CA PHE 186 180.7205 23.7973 38.5600 |  |  |
117 CA LYS 187 180.3429 23.7440 38.9800 |  |  |
118 CA ASN 188 149.9553 19.4515 37.7600 |  |  |
119 CA LEU 189 124.1115 15.8009 36.5800 |  |  |
120 CA ARG 190 113.2152 14.2617 34.6700 |  |  |
121 CA GLU 191 98.9338 12.2443 34.2300 |  |  |
122 CA PHE 192 99.4381 12.3155 34.2300 |  |  |
123 CA VAL 193 100.2933 12.4364 35.7400 |  |  |
124 CA PHE 194 114.4629 14.4379 36.7400 |  |  |
125 CA LYS 195 129.3772 16.5447 38.4600 |  |  |
126 CA ASN 196 163.0462 21.3007 41.2100 |  |  |
127 CA ILE 197 192.6094 25.4767 43.1300 |  |  |
128 CA ASP 198 243.2994 32.6371 45.1900 |  |  |
129 CA GLY 199 239.6599 32.1230 44.6000 |  |  |
130 CA TYR 200 212.8687 28.3385 44.1200 |  |  |
131 CA PHE 201 174.3290 22.8945 40.6800 |  |  |
132 CA LYS 202 154.1859 20.0491 39.0900 |  |  |
133 CA ILE 203 133.9809 17.1950 36.9700 |  |  |
134 CA TYR 204 120.9438 15.3534 35.3900 |  |  |
135 CA SER 205 114.1724 14.3969 34.4700 |  |  |
136 CA LYS 206 117.3095 14.8400 34.4900 |  |  |
137 CA HIS 207 127.6847 16.3056 35.7600 |  |  |
138 CA THR 208 138.8939 17.8890 37.1600 |  |  |
139 CA PRO 209 162.2336 21.1859 38.0300 |  |  |
140 CA ILE 210 164.6886 21.5327 38.5700 |  |  |
141 CA ASN 211 196.4929 26.0253 38.9600 |  |  |
142 CA LEU 212 186.1586 24.5655 38.6900 |  |  |
143 CA VAL 213 189.8270 25.0837 38.7000 |  |  |
144 CA ARG 214 189.6951 25.0651 37.2800 |  |  |
145 CA ASP 215 163.9356 21.4263 36.2800 |  |  |
146 CA LEU 216 123.4373 15.7056 36.0200 |  |  |
147 CA PRO 217 136.1672 17.5038 35.4300 |  |  |
148 CA GLN 218 134.1471 17.2185 34.5300 |  |  |
149 CA GLY 219 132.9463 17.0489 35.0500 |  |  |
150 CA PHE 220 123.3866 15.6985 33.1200 |  |  |
151 CA SER 221 120.6573 15.3129 32.6000 |  |  |
152 CA ALA 222 118.6313 15.0267 32.4800 |  |  |
153 CA LEU 223 115.1804 14.5393 33.3100 |  |  |
154 CA GLU 224 137.1338 17.6404 33.6000 |  |  |
155 CA PRO 225 147.2125 19.0641 35.2300 |  |  |
156 CA LEU 226 162.5843 21.2355 35.7400 |  |  |
157 CA VAL 227 176.0548 23.1383 37.4600 |  |  |
158 CA ASP 228 195.0837 25.8262 40.5200 |  |  |
159 CA LEU 229 217.1361 28.9413 43.2600 |  |  |
160 CA PRO 230 258.9054 34.8416 45.6500 |  |  |
161 CA ILE 231 254.6809 34.2448 45.1000 |  |  |
162 CA GLY 232 271.3480 36.5992 44.5600 |  |  |
163 CA ILE 233 243.1848 32.6209 44.8900 |  |  |
164 CA ASN 234 227.8995 30.4617 45.2400 |  |  |
165 CA ILE 235 183.9451 24.2528 44.5700 |  |  |
166 CA THR 236 171.5855 22.5069 43.0800 |  |  |
167 CA ARG 237 160.2077 20.8997 40.8600 |  |  |
168 CA PHE 238 148.3013 19.2179 39.6200 |  |  |
169 CA GLN 239 153.1058 19.8965 39.6700 |  |  |
170 CA THR 240 147.3321 19.0810 39.8800 |  |  |
171 CA LEU 241 170.9534 22.4177 40.7200 |  |  |
172 CA LEU 242 182.5444 24.0550 40.7500 |  |  |
173 CA ALA 243 214.0161 28.5006 41.4300 |  |  |
174 CA LEU 244 258.5415 34.7902 42.1700 |  |  |
175 CA HIS 245 309.9094 42.0463 42.3600 |  |  |
176 CA ALA 263 161.6723 21.1066 36.8700 |  |  |
177 CA ALA 264 142.0348 18.3327 36.2700 |  |  |
178 CA TYR 265 116.4220 14.7147 34.8200 |  |  |
179 CA TYR 266 101.1194 12.5531 34.7700 |  |  |
180 CA VAL 267 94.9359 11.6796 34.4300 |  |  |
181 CA GLY 268 87.3930 10.6141 33.8200 |  |  |
182 CA TYR 269 90.5464 11.0595 34.3000 |  |  |
183 CA LEU 270 93.7823 11.5166 33.5200 |  |  |
184 CA GLN 271 104.0369 12.9652 32.4700 |  |  |
185 CA PRO 272 123.7708 15.7527 31.3400 |  |  |
186 CA ARG 273 117.5597 14.8754 30.5900 |  |  |
187 CA THR 274 135.9848 17.4781 29.6600 |  |  |
188 CA PHE 275 132.5012 16.9860 29.1400 |  |  |
189 CA LEU 276 155.2311 20.1968 28.5600 |  |  |
190 CA LEU 277 154.0566 20.0308 29.1300 |  |  |
191 CA LYS 278 175.9845 23.1283 28.9600 |  |  |
192 CA TYR 279 193.7506 25.6379 29.5100 |  |  |
193 CA ASN 280 218.9100 29.1919 30.5700 |  |  |
194 CA GLU 281 261.5340 35.2129 30.9500 |  |  |
195 CA ASN 282 241.9797 32.4507 31.2600 |  |  |
196 CA GLY 283 215.8007 28.7527 31.7800 |  |  |
197 CA THR 284 179.7350 23.6581 31.3800 |  |  |
198 CA ILE 285 155.5089 20.2360 30.6800 |  |  |
199 CA THR 286 157.7021 20.5458 30.5800 |  |  |
200 CA ASP 287 145.7183 18.8530 29.6200 |  |  |
201 CA ALA 288 133.3970 17.1125 28.8100 |  |  |
202 CA VAL 289 133.6783 17.1523 28.0400 |  |  |
203 CA ASP 290 117.5482 14.8737 27.9700 |  |  |
204 CA CYS 291 134.7597 17.3050 26.9600 |  |  |
205 CA ALA 292 123.6580 15.7368 26.2200 |  |  |
206 CA LEU 293 118.2942 14.9791 25.8700 |  |  |
207 CA ASP 294 137.3647 17.6730 24.7100 |  |  |
208 CA PRO 295 161.9384 21.1442 23.1500 |  |  |
209 CA LEU 296 171.9873 22.5637 23.0900 |  |  |
210 CA SER 297 151.9570 19.7343 23.5600 |  |  |
211 CA GLU 298 160.5614 20.9497 23.6500 |  |  |
212 CA THR 299 190.5437 25.1849 23.3900 |  |  |
213 CA LYS 300 186.3392 24.5910 23.4900 |  |  |
214 CA CYS 301 176.7341 23.2342 24.6700 |  |  |
215 CA THR 302 204.7561 27.1925 23.6500 |  |  |
216 CA LEU 303 231.4142 30.9582 23.8300 |  |  |
217 CA LYS 304 216.6890 28.8782 24.6400 |  |  |
218 CA SER 305 216.0761 28.7916 25.5400 |  |  |
219 CA PHE 306 196.0220 25.9588 25.6000 |  |  |
220 CA THR 307 227.5937 30.4185 24.4900 |  |  |
221 CA VAL 308 237.4277 31.8077 23.6500 |  |  |
222 CA GLU 309 275.6762 37.2106 22.8000 |  |  |
223 CA LYS 310 287.3326 38.8571 21.7400 |  |  |
224 CA GLY 311 285.2125 38.5577 20.7200 |  |  |
225 CA ILE 312 263.2546 35.4559 20.0700 |  |  |
226 CA TYR 313 242.1680 32.4773 20.7700 |  |  |
227 CA GLN 314 229.7502 30.7232 20.5800 |  |  |
228 CA THR 315 200.2149 26.5511 21.1400 |  |  |
229 CA SER 316 186.5752 24.6244 20.7100 |  |  |
230 CA ASN 317 187.8223 24.8005 21.0900 |  |  |
231 CA PHE 318 177.4745 23.3388 22.9900 |  |  |
232 CA ARG 319 159.8671 20.8516 24.3000 |  |  |
233 CA VAL 320 154.0534 20.0304 27.5300 |  |  |
234 CA GLN 321 133.4963 17.1265 29.4700 |  |  |
235 CA PRO 322 129.9977 16.6323 32.4500 |  |  |
236 CA THR 323 132.7167 17.0164 34.1300 |  |  |
237 CA GLU 324 112.8741 14.2135 35.0100 |  |  |
238 CA SER 325 94.3981 11.6036 35.5300 |  |  |
239 CA ILE 326 90.7644 11.0903 37.3600 |  |  |
240 CA VAL 327 77.3852 9.2004 37.8900 |  |  |
241 CA ARG 328 76.3049 9.0478 38.6800 |  |  |
242 CA PHE 329 66.9515 7.7266 40.6600 |  |  |
243 CA PRO 330 68.4343 7.9360 42.0900 |  |  |
244 CA ASN 331 69.2423 8.0502 43.8100 |  |  |
245 CA ILE 332 63.9014 7.2957 47.4500 |  |  |
246 CA THR 333 70.9001 8.2843 49.4300 |  |  |
247 CA ASN 334 71.7570 8.4054 50.2200 |  |  |
248 CA LEU 335 79.8398 9.5471 52.0000 |  |  |
249 CA CYS 336 87.9676 10.6953 54.0900 |  |  |
250 CA PRO 337 111.6375 14.0388 57.4900 |  |  |
251 CA PHE 338 133.6153 17.1433 58.6800 |  |  |
252 CA GLY 339 157.4958 20.5167 61.3300 |  |  |
253 CA GLU 340 161.4876 21.0805 60.9600 |  |  |
254 CA VAL 341 179.4591 23.6191 62.3900 |  |  |
255 CA PHE 342 205.0017 27.2273 63.1800 |  |  |
256 CA ASN 343 227.2370 30.3682 64.6200 |  |  |
257 CA ALA 344 234.5685 31.4038 66.5400 |  |  |
258 CA THR 345 291.5054 39.4466 69.0000 |  |  |
259 CA ARG 346 309.1521 41.9393 69.2700 |  |  |
260 CA PHE 347 300.4323 40.7076 68.5500 |  |  |
261 CA ALA 348 323.5844 43.9780 68.4000 |  |  |
262 CA SER 349 389.7771 53.3282 69.6200 |  |  |
263 CA VAL 350 395.8662 54.1884 69.2400 |  |  |
264 CA TYR 351 438.2792 60.1795 70.1500 |  |  |
265 CA ALA 352 371.8035 50.7893 68.8800 |  |  |
266 CA TRP 353 313.6020 42.5679 66.1000 |  |  |
267 CA ASN 354 252.4797 33.9339 63.7300 |  |  |
268 CA ARG 355 211.8275 28.1915 59.3500 |  |  |
269 CA LYS 356 166.0410 21.7237 57.4200 |  |  |
270 CA ARG 357 136.5912 17.5637 54.0800 |  |  |
271 CA ILE 358 107.9198 13.5137 52.5600 |  |  |
272 CA SER 359 89.3985 10.8974 50.2600 |  |  |
273 CA ASN 360 74.1542 8.7440 49.8800 |  |  |
274 CA CYS 361 69.1130 8.0319 49.5300 |  |  |
275 CA VAL 362 68.5313 7.9497 50.3500 |  |  |
276 CA ALA 363 81.6573 9.8039 50.6200 |  |  |
277 CA ASP 364 93.1936 11.4335 51.5600 |  |  |
278 CA TYR 365 114.1290 14.3908 52.5400 |  |  |
279 CA SER 366 129.3897 16.5464 54.8200 |  |  |
280 CA VAL 367 146.2669 18.9305 56.9700 |  |  |
281 CA LEU 368 162.9681 21.2897 58.4000 |  |  |
282 CA TYR 369 175.3363 23.0368 58.3900 |  |  |
283 CA ASN 370 194.6716 25.7680 59.5300 |  |  |
284 CA SER 371 219.9352 29.3367 61.5300 |  |  |
285 CA ALA 372 279.6078 37.7660 63.1800 |  |  |
286 CA SER 373 292.5185 39.5897 63.7500 |  |  |
287 CA PHE 374 282.6403 38.1943 64.1900 |  |  |
288 CA SER 375 339.3991 46.2119 64.5300 |  |  |
289 CA THR 376 303.2565 41.1065 63.1700 |  |  |
290 CA PHE 377 244.2275 32.7682 59.9800 |  |  |
291 CA LYS 378 255.2299 34.3224 57.5100 |  |  |
292 CA CYS 379 218.1241 29.0809 55.3000 |  |  |
293 CA TYR 380 243.3009 32.6373 54.4200 |  |  |
294 CA GLY 381 200.5894 26.6040 50.8000 |  |  |
295 CA VAL 382 167.1879 21.8857 43.7600 |  |  |
296 CA SER 383 166.4877 21.7868 45.2200 |  |  |
297 CA PRO 384 153.4996 19.9522 46.4500 |  |  |
298 CA THR 385 135.0128 17.3408 45.8100 |  |  |
299 CA LYS 386 115.4029 14.5707 42.6200 |  |  |
300 CA LEU 387 104.9538 13.0947 45.4600 |  |  |
301 CA ASN 388 88.2563 10.7360 46.7300 |  |  |
302 CA ASP 389 80.7500 9.6757 44.4200 |  |  |
303 CA LEU 390 88.3348 10.7471 44.0600 |  |  |
304 CA CYS 391 84.0021 10.1351 45.5200 |  |  |
305 CA PHE 392 98.7724 12.2215 46.4300 |  |  |
306 CA THR 393 109.4659 13.7321 46.7000 |  |  |
307 CA ASN 394 115.3092 14.5575 48.9500 |  |  |
308 CA VAL 395 123.5934 15.7277 51.3100 |  |  |
309 CA TYR 396 154.8558 20.1437 53.4400 |  |  |
310 CA ALA 397 174.5478 22.9254 57.2000 |  |  |
311 CA ASP 398 226.2830 30.2334 60.3800 |  |  |
312 CA SER 399 248.1282 33.3192 63.6900 |  |  |
313 CA PHE 400 312.2801 42.3812 68.3200 |  |  |
314 CA VAL 401 373.4215 51.0179 69.0600 |  |  |
315 CA ILE 402 431.5700 59.2318 70.2300 |  |  |
316 CA ARG 403 503.3337 69.3690 72.8500 |  |  |
317 CA GLY 404 488.8679 67.3256 71.3400 |  |  |
318 CA ASP 405 542.0353 74.8359 71.2000 |  |  |
319 CA GLU 406 493.3721 67.9618 69.4700 |  |  |
320 CA VAL 407 413.5284 56.6833 68.4800 |  |  |
321 CA ARG 408 437.5278 60.0734 67.6800 |  |  |
322 CA GLN 409 447.4106 61.4694 65.4800 |  |  |
323 CA ILE 410 366.9455 50.1031 63.7100 |  |  |
324 CA ALA 411 348.9382 47.5594 60.4600 |  |  |
325 CA PRO 412 355.2572 48.4520 58.6700 |  |  |
326 CA GLY 413 432.4002 59.3491 56.0100 |  |  |
327 CA GLN 414 470.3899 64.7154 60.1900 |  |  |
328 CA THR 415 545.0806 75.2661 62.0700 |  |  |
329 CA GLY 416 595.9001 82.4447 63.6800 |  |  |
330 CA LYS 417 614.3149 85.0460 67.2000 |  |  |
331 CA ILE 418 514.1005 70.8899 68.6600 |  |  |
332 CA ALA 419 474.5460 65.3025 66.1700 |  |  |
333 CA ASP 420 537.8256 74.2413 66.6000 |  |  |
334 CA TYR 421 553.4328 76.4459 68.7200 |  |  |
335 CA ASN 422 474.0976 65.2392 68.5400 |  |  |
336 CA TYR 423 400.7598 54.8796 66.4800 |  |  |
337 CA LYS 424 395.4999 54.1366 63.4800 |  |  |
338 CA LEU 425 336.9126 45.8607 60.7200 |  |  |
339 CA PRO 426 336.5896 45.8151 59.5500 |  |  |
340 CA ASP 427 363.0760 49.5565 58.2100 |  |  |
341 CA ASP 428 303.3290 41.1168 58.2500 |  |  |
342 CA PHE 429 261.7834 35.2481 56.9400 |  |  |
343 CA THR 430 206.7166 27.4695 54.5500 |  |  |
344 CA GLY 431 186.4090 24.6009 54.3900 |  |  |
345 CA CYS 432 201.8750 26.7856 56.5700 |  |  |
346 CA VAL 433 245.0324 32.8819 58.6800 |  |  |
347 CA ILE 434 241.8117 32.4269 61.1800 |  |  |
348 CA ALA 435 293.8674 39.7802 64.3500 |  |  |
349 CA TRP 436 329.6439 44.8339 67.3200 |  |  |
350 CA ASN 437 396.8057 54.3211 69.2000 |  |  |
351 CA SER 438 403.6519 55.2882 71.6400 |  |  |
352 CA ASN 439 488.1126 67.2189 70.5900 |  |  |
353 CA ASN 440 477.4476 65.7124 74.2200 |  |  |
354 CA LEU 441 427.9275 58.7173 74.2100 |  |  |
355 CA ASP 442 442.7085 60.8052 74.4200 |  |  |
356 CA SER 443 530.1092 73.1513 73.4200 |  |  |
357 CA LYS 444 598.3260 82.7874 76.8100 |  |  |
358 CA GLY 447 663.7588 92.0303 77.1700 |  |  |
359 CA ASN 448 567.2649 78.3998 77.5500 |  |  |
360 CA TYR 449 587.7891 81.2990 74.9400 |  |  |
361 CA ASN 450 501.9011 69.1666 75.1900 |  |  |
362 CA TYR 451 482.4521 66.4193 73.6300 |  |  |
363 CA LEU 452 518.4186 71.4999 73.0600 |  |  |
364 CA TYR 453 522.2472 72.0407 71.9400 |  |  |
365 CA ARG 454 569.4871 78.7137 72.4300 |  |  |
366 CA LYS 462 451.2557 62.0126 62.3400 |  |  |
367 CA PRO 463 369.7003 50.4922 61.9600 |  |  |
368 CA PHE 464 324.0355 44.0417 62.3700 |  |  |
369 CA GLU 465 382.3591 52.2804 63.4300 |  |  |
370 CA ARG 466 380.4294 52.0078 65.9500 |  |  |
371 CA ASP 467 462.5729 63.6112 68.5500 |  |  |
372 CA ILE 468 456.0170 62.6851 69.7200 |  |  |
373 CA TYR 489 949.4215 132.3824 81.6700 |  |  |
374 CA PHE 490 812.2295 113.0030 78.8300 |  |  |
375 CA PRO 491 729.4958 101.3162 76.7300 |  |  |
376 CA LEU 492 663.5898 92.0065 75.5700 |  |  |
377 CA GLN 493 669.6700 92.8653 73.4100 |  |  |
378 CA SER 494 618.9936 85.7069 73.6100 |  |  |
379 CA TYR 495 616.6602 85.3773 75.3400 |  |  |
380 CA GLY 496 652.2496 90.4046 76.8900 |  |  |
381 CA PHE 497 595.1015 82.3319 75.8100 |  |  |
382 CA GLN 498 647.8038 89.7766 77.8100 |  |  |
383 CA PRO 499 628.2092 87.0087 75.6300 |  |  |
384 CA THR 500 725.3088 100.7248 76.8200 |  |  |
385 CA ASN 501 701.5975 97.3753 75.8800 |  |  |
386 CA VAL 503 596.2145 82.4892 74.6900 |  |  |
387 CA GLY 504 595.3044 82.3606 73.1900 |  |  |
388 CA TYR 505 622.2974 86.1736 74.3900 |  |  |
389 CA GLN 506 546.9083 75.5243 72.3500 |  |  |
390 CA PRO 507 468.9984 64.5189 71.3400 |  |  |
391 CA TYR 508 394.1094 53.9402 73.1100 |  |  |
392 CA ARG 509 324.0518 44.0440 67.5600 |  |  |
393 CA VAL 510 291.0542 39.3828 64.3200 |  |  |
394 CA VAL 511 233.0070 31.1832 61.8200 |  |  |
395 CA VAL 512 224.4062 29.9683 58.9000 |  |  |
396 CA LEU 513 175.8263 23.1060 55.0500 |  |  |
397 CA SER 514 179.0143 23.5563 53.4000 |  |  |
398 CA PHE 515 147.0811 19.0455 50.5900 |  |  |
399 CA GLU 516 149.3640 19.3680 47.3000 |  |  |
400 CA LEU 517 138.5274 17.8372 44.9800 |  |  |
401 CA LEU 518 160.9704 21.0075 43.6500 |  |  |
402 CA HIS 519 145.5415 18.8280 40.1200 |  |  |
403 CA ALA 520 135.4935 17.4087 39.9700 |  |  |
404 CA PRO 521 108.0285 13.5290 41.6500 |  |  |
405 CA ALA 522 88.4090 10.7576 45.2200 |  |  |
406 CA THR 523 79.4172 9.4874 47.6800 |  |  |
407 CA VAL 524 76.7080 9.1047 48.2400 |  |  |
408 CA CYS 525 68.6924 7.9725 47.5400 |  |  |
409 CA GLY 526 71.6060 8.3840 47.3900 |  |  |
410 CA PRO 527 73.7142 8.6819 46.9500 |  |  |
411 CA LYS 528 70.4944 8.2270 44.5300 |  |  |
412 CA LYS 529 73.9749 8.7187 43.0000 |  |  |
413 CA SER 530 75.0195 8.8662 40.7400 |  |  |
414 CA THR 531 90.8560 11.1033 39.1200 |  |  |
415 CA ASN 532 111.9041 14.0765 38.5300 |  |  |
416 CA LEU 533 117.9852 14.9355 37.9400 |  |  |
417 CA VAL 534 140.9191 18.1751 36.9200 |  |  |
418 CA LYS 535 165.9816 21.7154 35.5800 |  |  |
419 CA ASN 536 191.8770 25.3733 34.6500 |  |  |
420 CA LYS 537 169.5395 22.2179 34.4800 |  |  |
421 CA CYS 538 148.3286 19.2217 33.6700 |  |  |
422 CA VAL 539 120.2045 15.2490 33.4300 |  |  |
423 CA ASN 540 102.6072 12.7632 33.3500 |  |  |
424 CA PHE 541 95.0518 11.6960 34.7600 |  |  |
425 CA ASN 542 84.0383 10.1402 35.7500 |  |  |
426 CA PHE 543 85.6056 10.3616 36.5000 |  |  |
427 CA ASN 544 78.8266 9.4040 39.5100 |  |  |
428 CA GLY 545 83.9581 10.1289 38.8800 |  |  |
429 CA LEU 546 99.8224 12.3698 35.8100 |  |  |
430 CA THR 547 99.8955 12.3802 34.2200 |  |  |
431 CA GLY 548 115.0336 14.5185 33.0700 |  |  |
432 CA THR 549 123.3671 15.6957 32.7200 |  |  |
433 CA GLY 550 144.0222 18.6134 31.8100 |  |  |
434 CA VAL 551 160.0897 20.8831 32.7900 |  |  |
435 CA LEU 552 153.6641 19.9754 33.4800 |  |  |
436 CA THR 553 190.1153 25.1244 33.9100 |  |  |
437 CA GLU 554 209.8508 27.9122 34.6100 |  |  |
438 CA SER 555 230.8296 30.8756 34.6000 |  |  |
439 CA ASN 556 272.5512 36.7692 34.6500 |  |  |
440 CA LYS 557 252.0884 33.8786 34.1300 |  |  |
441 CA LYS 558 261.1230 35.1548 34.4600 |  |  |
442 CA PHE 559 216.9703 28.9179 33.7300 |  |  |
443 CA LEU 560 227.2838 30.3748 35.2000 |  |  |
444 CA PRO 561 194.3354 25.7206 35.3000 |  |  |
445 CA PHE 562 182.7487 24.0838 34.9200 |  |  |
446 CA GLN 563 175.8837 23.1141 36.8300 |  |  |
447 CA GLN 564 140.2333 18.0782 36.1900 |  |  |
448 CA PHE 565 153.2026 19.9102 34.4100 |  |  |
449 CA GLY 566 192.8711 25.5137 31.7400 |  |  |
450 CA ARG 567 219.0170 29.2070 30.6500 |  |  |
451 CA ASP 568 260.6468 35.0876 26.4300 |  |  |
452 CA ILE 569 326.7995 44.4322 23.1500 |  |  |
453 CA ALA 570 300.6257 40.7349 20.3300 |  |  |
454 CA ASP 571 257.6506 34.6643 23.4600 |  |  |
455 CA THR 572 212.3634 28.2671 25.8200 |  |  |
456 CA THR 573 171.4516 22.4880 29.5600 |  |  |
457 CA ASP 574 194.3782 25.7266 30.8400 |  |  |
458 CA ALA 575 170.4772 22.3504 32.5900 |  |  |
459 CA VAL 576 138.5107 17.8349 35.0800 |  |  |
460 CA ARG 577 130.9658 16.7691 36.3000 |  |  |
461 CA ASP 578 109.4023 13.7231 37.2300 |  |  |
462 CA PRO 579 89.8984 10.9680 38.8000 |  |  |
463 CA GLN 580 91.0204 11.1265 39.4300 |  |  |
464 CA THR 581 118.8738 15.0610 38.9100 |  |  |
465 CA LEU 582 134.8440 17.3169 37.9700 |  |  |
466 CA GLU 583 158.6733 20.6830 36.9700 |  |  |
467 CA ILE 584 168.4577 22.0651 35.7100 |  |  |
468 CA LEU 585 162.3994 21.2093 34.0500 |  |  |
469 CA ASP 586 185.3460 24.4507 33.4500 |  |  |
470 CA ILE 587 168.3226 22.0460 31.9100 |  |  |
471 CA THR 588 193.1095 25.5474 29.9900 |  |  |
472 CA PRO 589 176.6608 23.2239 28.7700 |  |  |
473 CA CYS 590 170.1206 22.3000 28.2300 |  |  |
474 CA SER 591 193.6030 25.6171 24.8400 |  |  |
475 CA PHE 592 196.4751 26.0228 22.7900 |  |  |
476 CA GLY 593 212.4371 28.2776 21.6300 |  |  |
477 CA GLY 594 215.5674 28.7197 20.6900 |  |  |
478 CA VAL 595 199.1862 26.4058 20.9500 |  |  |
479 CA SER 596 216.7669 28.8892 20.6900 |  |  |
480 CA VAL 597 211.1280 28.0926 20.4600 |  |  |
481 CA ILE 598 238.2118 31.9184 19.9100 |  |  |
482 CA THR 599 240.7254 32.2735 20.5400 |  |  |
483 CA PRO 600 269.7880 36.3788 21.7500 |  |  |
484 CA GLY 601 268.0377 36.1316 22.4100 |  |  |
485 CA THR 602 238.9095 32.0170 23.3600 |  |  |
486 CA ASN 603 272.5894 36.7745 24.1700 |  |  |
487 CA THR 604 280.1535 37.8430 23.4900 |  |  |
488 CA SER 605 244.0571 32.7441 22.7200 |  |  |
489 CA ASN 606 207.4419 27.5719 21.9700 |  |  |
490 CA GLN 607 211.2937 28.1160 21.0600 |  |  |
491 CA VAL 608 207.9017 27.6369 20.6500 |  |  |
492 CA ALA 609 215.6505 28.7315 20.0300 |  |  |
493 CA VAL 610 202.0678 26.8128 20.0800 |  |  |
494 CA LEU 611 220.7124 29.4465 19.8800 |  |  |
495 CA TYR 612 210.0513 27.9405 20.0600 |  |  |
496 CA GLN 613 235.9112 31.5935 20.0800 |  |  |
497 CA ASP 614 254.8567 34.2697 21.0500 |  |  |
498 CA VAL 615 233.5803 31.2642 21.5800 |  |  |
499 CA ASN 616 242.9124 32.5824 21.9400 |  |  |
500 CA CYS 617 230.8932 30.8846 22.5200 |  |  |
501 CA THR 618 215.7198 28.7413 22.9900 |  |  |
502 CA GLU 619 192.1649 25.4139 23.2600 |  |  |
503 CA VAL 620 185.8891 24.5274 22.9700 |  |  |
504 CA ASN 641 249.8639 33.5644 20.1800 |  |  |
505 CA VAL 642 244.8642 32.8581 20.3500 |  |  |
506 CA PHE 643 271.7946 36.6623 19.9600 |  |  |
507 CA GLN 644 277.0176 37.4001 19.8600 |  |  |
508 CA THR 645 298.4304 40.4248 19.1300 |  |  |
509 CA ARG 646 312.2058 42.3707 18.6800 |  |  |
510 CA ALA 647 289.0296 39.0969 18.3300 |  |  |
511 CA GLY 648 255.0438 34.2961 19.7600 |  |  |
512 CA CYS 649 236.0151 31.6081 20.7100 |  |  |
513 CA LEU 650 237.1506 31.7685 19.9800 |  |  |
514 CA ILE 651 216.7242 28.8831 19.8800 |  |  |
515 CA GLY 652 221.8745 29.6107 20.3000 |  |  |
516 CA ALA 653 256.2204 34.4623 19.8200 |  |  |
517 CA GLU 654 288.8292 39.0685 19.5000 |  |  |
518 CA HIS 655 319.7622 43.4381 18.9100 |  |  |
519 CA VAL 656 363.8279 49.6627 19.0200 |  |  |
520 CA ASN 657 413.3345 56.6559 18.9300 |  |  |
521 CA ASN 658 438.0408 60.1459 17.8300 |  |  |
522 CA SER 659 437.2977 60.0409 16.7400 |  |  |
523 CA TYR 660 434.3048 59.6181 16.5400 |  |  |
524 CA GLU 661 440.1260 60.4404 16.7700 |  |  |
525 CA CYS 662 395.4764 54.1333 16.8700 |  |  |
526 CA ASP 663 360.9642 49.2582 17.5200 |  |  |
527 CA ILE 664 319.0470 43.3371 17.6000 |  |  |
528 CA PRO 665 329.3905 44.7981 16.5500 |  |  |
529 CA ILE 666 301.0540 40.7954 15.9500 |  |  |
530 CA GLY 667 330.0507 44.8914 14.3200 |  |  |
531 CA ALA 668 357.5752 48.7795 14.1200 |  |  |
532 CA GLY 669 383.5804 52.4529 14.4500 |  |  |
533 CA ILE 670 344.3399 46.9099 15.4900 |  |  |
534 CA CYS 671 336.5731 45.8128 16.7500 |  |  |
535 CA ALA 672 308.5698 41.8571 18.3700 |  |  |
536 CA SER 673 316.5637 42.9863 19.0000 |  |  |
537 CA TYR 674 305.1325 41.3715 20.0000 |  |  |
538 CA GLN 675 341.3148 46.4825 20.4400 |  |  |
539 CA THR 676 359.8767 49.1046 20.8200 |  |  |
540 CA SER 689 328.4775 44.6692 21.1900 |  |  |
541 CA GLN 690 309.1364 41.9371 21.1500 |  |  |
542 CA SER 691 278.9047 37.6666 20.6200 |  |  |
543 CA ILE 692 272.2894 36.7322 19.9200 |  |  |
544 CA ILE 693 302.4363 40.9907 19.2800 |  |  |
545 CA ALA 694 313.4682 42.5490 18.7500 |  |  |
546 CA TYR 695 357.2628 48.7353 17.2100 |  |  |
547 CA THR 696 390.5324 53.4349 15.8400 |  |  |
548 CA MET 697 413.1903 56.6355 14.8100 |  |  |
549 CA SER 698 468.6516 64.4699 13.4700 |  |  |
550 CA LEU 699 501.8004 69.1524 11.2400 |  |  |
551 CA GLY 700 535.3425 73.8905 10.6300 |  |  |
552 CA ALA 701 591.8969 81.8793 9.6200 |  |  |
553 CA GLU 702 701.8016 97.4042 9.5200 |  |  |
554 CA ASN 703 819.4569 114.0239 9.1300 |  |  |
555 CA SER 704 797.8568 110.9727 8.5000 |  |  |
556 CA VAL 705 359.0755 48.9914 8.2600 |  |  |
557 CA ALA 706 293.0949 39.6711 8.0200 |  |  |
558 CA TYR 707 315.3310 42.8121 8.4200 |  |  |
559 CA SER 708 317.6880 43.1451 8.4400 |  |  |
560 CA ASN 709 391.6845 53.5977 8.5200 |  |  |
561 CA ASN 710 363.3740 49.5986 8.5600 |  |  |
562 CA SER 711 333.8906 45.4338 8.0700 |  |  |
563 CA ILE 712 291.8426 39.4942 7.8400 |  |  |
564 CA ALA 713 269.2896 36.3084 7.5700 |  |  |
565 CA ILE 714 231.3222 30.9452 7.6800 |  |  |
566 CA PRO 715 209.7929 27.9040 7.5200 |  |  |
567 CA THR 716 206.8966 27.4949 7.5400 |  |  |
568 CA ASN 717 184.5439 24.3374 7.6100 |  |  |
569 CA PHE 718 160.7449 20.9756 7.0600 |  |  |
570 CA THR 719 145.8224 18.8677 7.1900 |  |  |
571 CA ILE 720 116.4198 14.7144 7.2500 |  |  |
572 CA SER 721 119.2484 15.1139 7.2900 |  |  |
573 CA VAL 722 100.7213 12.4968 7.6600 |  |  |
574 CA THR 723 111.2226 13.9802 7.7900 |  |  |
575 CA THR 724 100.9944 12.5354 8.1900 |  |  |
576 CA GLU 725 108.0215 13.5280 8.2200 |  |  |
577 CA ILE 726 103.6587 12.9117 8.8800 |  |  |
578 CA LEU 727 108.8467 13.6446 8.8400 |  |  |
579 CA PRO 728 110.0270 13.8113 9.0800 |  |  |
580 CA VAL 729 99.5328 12.3289 9.1900 |  |  |
581 CA SER 730 103.4498 12.8822 9.7100 |  |  |
582 CA MET 731 116.2665 14.6927 10.1100 |  |  |
583 CA THR 732 110.9080 13.9358 10.7100 |  |  |
584 CA LYS 733 119.5518 15.1568 11.8100 |  |  |
585 CA THR 734 137.8640 17.7435 12.4700 |  |  |
586 CA SER 735 157.4721 20.5133 13.4900 |  |  |
587 CA VAL 736 183.8305 24.2367 14.2000 |  |  |
588 CA ASP 737 204.3459 27.1346 14.3600 |  |  |
589 CA CYS 738 241.3288 32.3587 14.1400 |  |  |
590 CA THR 739 260.2339 35.0292 14.4900 |  |  |
591 CA MET 740 229.8517 30.7375 15.2400 |  |  |
592 CA TYR 741 228.4249 30.5360 15.2400 |  |  |
593 CA ILE 742 271.0267 36.5538 15.4800 |  |  |
594 CA CYS 743 279.9382 37.8126 17.0000 |  |  |
595 CA GLY 744 244.7125 32.8367 17.3300 |  |  |
596 CA ASP 745 257.7171 34.6737 18.6300 |  |  |
597 CA SER 746 298.2864 40.4045 18.1600 |  |  |
598 CA THR 747 336.7782 45.8417 17.7200 |  |  |
599 CA GLU 748 369.8989 50.5203 17.8900 |  |  |
600 CA CYS 749 345.1900 47.0299 17.5700 |  |  |
601 CA SER 750 334.9398 45.5820 16.8800 |  |  |
602 CA ASN 751 388.4036 53.1342 16.5800 |  |  |
603 CA LEU 752 402.0225 55.0580 16.7800 |  |  |
604 CA LEU 753 362.7951 49.5168 16.1000 |  |  |
605 CA LEU 754 388.0837 53.0890 15.9400 |  |  |
606 CA GLN 755 440.4855 60.4912 16.3300 |  |  |
607 CA TYR 756 411.2367 56.3596 15.2400 |  |  |
608 CA GLY 757 406.5752 55.7011 14.7900 |  |  |
609 CA SER 758 361.6567 49.3560 13.5800 |  |  |
610 CA PHE 759 345.5980 47.0876 13.1200 |  |  |
611 CA CYS 760 299.8818 40.6298 12.8900 |  |  |
612 CA THR 761 283.8474 38.3648 12.7000 |  |  |
613 CA GLN 762 289.4663 39.1585 12.2500 |  |  |
614 CA LEU 763 257.3083 34.6160 11.9700 |  |  |
615 CA ASN 764 227.2116 30.3646 11.8800 |  |  |
616 CA ARG 765 233.6322 31.2715 11.4800 |  |  |
617 CA ALA 766 228.4761 30.5432 11.3000 |  |  |
618 CA LEU 767 192.5249 25.4648 10.6300 |  |  |
619 CA THR 768 179.3765 23.6075 9.9300 |  |  |
620 CA GLY 769 186.5160 24.6160 9.4500 |  |  |
621 CA ILE 770 166.7293 21.8210 9.6300 |  |  |
622 CA ALA 771 139.5464 17.9812 9.8600 |  |  |
623 CA VAL 772 139.0471 17.9106 9.3900 |  |  |
624 CA GLU 773 138.7821 17.8732 8.8300 |  |  |
625 CA GLN 774 115.8505 14.6339 9.1100 |  |  |
626 CA ASP 775 98.9494 12.2465 9.4700 |  |  |
627 CA LYS 776 109.6838 13.7628 8.9600 |  |  |
628 CA ASN 777 105.0569 13.1093 8.7000 |  |  |
629 CA THR 778 80.5544 9.6481 8.9800 |  |  |
630 CA GLN 779 77.6524 9.2381 8.7000 |  |  |
631 CA GLU 780 87.5547 10.6369 8.3300 |  |  |
632 CA VAL 781 76.1730 9.0292 8.3700 |  |  |
633 CA PHE 782 56.7565 6.2864 8.8400 |  |  |
634 CA ALA 783 57.0104 6.3223 9.0600 |  |  |
635 CA GLN 784 57.7380 6.4251 8.2700 |  |  |
636 CA VAL 785 44.8114 4.5991 8.6200 |  |  |
637 CA LYS 786 50.5867 5.4149 8.6800 |  |  |
638 CA GLN 787 39.3669 3.8300 9.8500 |  |  |
639 CA ILE 788 30.7296 2.6099 9.7100 |  |  |
640 CA TYR 789 24.4716 1.7259 8.8800 |  |  |
641 CA LYS 790 22.3687 1.4289 9.7400 |  |  |
642 CA THR 791 23.6990 1.6168 9.5000 |  |  |
643 CA PRO 792 31.4755 2.7153 9.1900 |  |  |
644 CA PRO 793 42.6440 4.2929 9.3200 |  |  |
645 CA ILE 794 52.8714 5.7376 8.9600 |  |  |
646 CA LYS 795 43.5561 4.4218 8.8800 |  |  |
647 CA ASP 796 47.2492 4.9435 8.6800 |  |  |
648 CA PHE 797 42.0380 4.2073 8.5600 |  |  |
649 CA GLY 798 55.8826 6.1630 8.5400 |  |  |
650 CA GLY 799 66.4403 7.6543 9.0100 |  |  |
651 CA PHE 800 57.9930 6.4611 9.5500 |  |  |
652 CA ASN 801 54.2862 5.9375 11.0700 |  |  |
653 CA PHE 802 42.5207 4.2755 11.3700 |  |  |
654 CA SER 803 40.6771 4.0151 12.5000 |  |  |
655 CA GLN 804 45.8713 4.7488 12.5900 |  |  |
656 CA ILE 805 39.2642 3.8155 12.1200 |  |  |
657 CA LEU 806 29.2487 2.4007 12.7500 |  |  |
658 CA PRO 807 26.0465 1.9484 14.0200 |  |  |
659 CA ASP 808 29.5032 2.4367 15.3500 |  |  |
660 CA PRO 809 35.1433 3.2334 16.6100 |  |  |
661 CA SER 810 44.5341 4.5599 16.7800 |  |  |
662 CA LYS 811 38.0058 3.6378 16.4500 |  |  |
663 CA PRO 812 40.5056 3.9909 16.8300 |  |  |
664 CA SER 813 31.9985 2.7892 16.1700 |  |  |
665 CA LYS 814 26.3553 1.9920 15.4000 |  |  |
666 CA ARG 815 29.0294 2.3698 14.1200 |  |  |
667 CA SER 816 32.8976 2.9162 13.1500 |  |  |
668 CA PHE 817 42.9183 4.3317 13.1900 |  |  |
669 CA ILE 818 51.6572 5.5661 12.9200 |  |  |
670 CA GLU 819 44.7266 4.5871 12.6000 |  |  |
671 CA ASP 820 45.0210 4.6287 13.2100 |  |  |
672 CA LEU 821 60.7943 6.8568 13.3100 |  |  |
673 CA LEU 822 64.5666 7.3897 12.9400 |  |  |
674 CA PHE 823 56.6626 6.2732 12.9500 |  |  |
675 CA ASN 824 64.5615 7.3889 13.3600 |  |  |
676 CA LYS 825 83.7314 10.0969 13.5300 |  |  |
677 CA VAL 826 86.4002 10.4738 13.1400 |  |  |
678 CA THR 827 88.1841 10.7258 12.8100 |  |  |
679 CA LYS 854 148.4572 19.2399 21.6300 |  |  |
680 CA PHE 855 163.0751 21.3048 21.2000 |  |  |
681 CA ASN 856 185.9944 24.5423 18.5400 |  |  |
682 CA GLY 857 180.6541 23.7880 16.8300 |  |  |
683 CA LEU 858 160.0714 20.8805 15.6500 |  |  |
684 CA THR 859 133.9430 17.1896 14.3200 |  |  |
685 CA VAL 860 114.0537 14.3801 13.5600 |  |  |
686 CA LEU 861 106.9739 13.3800 13.7500 |  |  |
687 CA PRO 862 86.5725 10.4982 13.7200 |  |  |
688 CA PRO 863 83.1205 10.0106 12.9000 |  |  |
689 CA LEU 864 79.4076 9.4861 13.0200 |  |  |
690 CA LEU 865 60.4319 6.8056 12.6100 |  |  |
691 CA THR 866 50.4175 5.3910 12.6900 |  |  |
692 CA ASP 867 43.1828 4.3690 12.1200 |  |  |
693 CA GLU 868 34.3840 3.1261 12.0400 |  |  |
694 CA MET 869 38.7359 3.7409 11.0600 |  |  |
695 CA ILE 870 40.9487 4.0535 11.1600 |  |  |
696 CA ALA 871 31.5004 2.7188 11.2400 |  |  |
697 CA GLN 872 28.6038 2.3097 10.5700 |  |  |
698 CA TYR 873 34.5825 3.1542 10.0500 |  |  |
699 CA THR 874 34.0368 3.0771 9.6800 |  |  |
700 CA SER 875 25.5416 1.8771 9.9500 |  |  |
701 CA ALA 876 26.2708 1.9801 9.4300 |  |  |
702 CA LEU 877 32.3376 2.8371 9.0900 |  |  |
703 CA LEU 878 29.7480 2.4713 8.9200 |  |  |
704 CA ALA 879 23.4947 1.5879 8.9300 |  |  |
705 CA GLY 880 26.0631 1.9508 8.3500 |  |  |
706 CA THR 881 32.3693 2.8416 8.1800 |  |  |
707 CA ILE 882 29.5525 2.4437 8.3300 |  |  |
708 CA THR 883 24.7777 1.7692 8.0500 |  |  |
709 CA SER 884 26.7291 2.0448 7.8500 |  |  |
710 CA GLY 885 34.7634 3.1797 7.3500 |  |  |
711 CA TRP 886 42.2597 4.2386 6.8500 |  |  |
712 CA THR 887 37.6380 3.5858 6.9400 |  |  |
713 CA PHE 888 35.6325 3.3025 7.0200 |  |  |
714 CA GLY 889 47.7697 5.0170 6.7900 |  |  |
715 CA ALA 890 55.1096 6.0538 6.1500 |  |  |
716 CA GLY 891 49.3761 5.2439 6.3100 |  |  |
717 CA ALA 892 38.9089 3.7653 6.7000 |  |  |
718 CA ALA 893 29.5228 2.4395 7.4600 |  |  |
719 CA LEU 894 27.9389 2.2157 7.2900 |  |  |
720 CA GLN 895 25.1019 1.8150 7.4900 |  |  |
721 CA ILE 896 28.5610 2.3036 7.5200 |  |  |
722 CA PRO 897 34.2343 3.1050 8.0000 |  |  |
723 CA PHE 898 38.3050 3.6800 7.9900 |  |  |
724 CA ALA 899 51.5379 5.5493 7.4900 |  |  |
725 CA MET 900 46.7651 4.8751 7.4800 |  |  |
726 CA GLN 901 43.2728 4.3818 7.1700 |  |  |
727 CA MET 902 57.6200 6.4084 7.1200 |  |  |
728 CA ALA 903 64.4615 7.3748 6.9200 |  |  |
729 CA TYR 904 60.6882 6.8418 6.4300 |  |  |
730 CA ARG 905 69.0277 8.0198 6.4200 |  |  |
731 CA PHE 906 86.1190 10.4341 6.3700 |  |  |
732 CA ASN 907 87.5803 10.6405 6.0400 |  |  |
733 CA GLY 908 90.6747 11.0776 5.7800 |  |  |
734 CA ILE 909 112.8551 14.2108 5.7500 |  |  |
735 CA GLY 910 123.9308 15.7753 5.9000 |  |  |
736 CA VAL 911 117.5764 14.8777 6.2600 |  |  |
737 CA THR 912 105.4083 13.1589 6.5500 |  |  |
738 CA GLN 913 84.9485 10.2688 6.8600 |  |  |
739 CA ASN 914 97.7852 12.0821 7.2600 |  |  |
740 CA VAL 915 112.6045 14.1754 7.3000 |  |  |
741 CA LEU 916 91.5559 11.2021 7.5700 |  |  |
742 CA TYR 917 87.6060 10.6442 7.6100 |  |  |
743 CA GLU 918 113.7228 14.3334 7.3600 |  |  |
744 CA ASN 919 117.0805 14.8077 7.5700 |  |  |
745 CA GLN 920 92.1432 11.2851 7.8900 |  |  |
746 CA LYS 921 104.3626 13.0112 8.0100 |  |  |
747 CA LEU 922 120.9425 15.3532 8.3400 |  |  |
748 CA ILE 923 100.3329 12.4420 8.2500 |  |  |
749 CA ALA 924 83.9515 10.1279 8.6700 |  |  |
750 CA ASN 925 103.7982 12.9314 8.8000 |  |  |
751 CA GLN 926 112.0055 14.0908 8.8800 |  |  |
752 CA PHE 927 87.0880 10.5710 9.0300 |  |  |
753 CA ASN 928 82.9408 9.9852 9.5800 |  |  |
754 CA SER 929 105.9423 13.2343 9.8400 |  |  |
755 CA ALA 930 102.8818 12.8020 10.2700 |  |  |
756 CA ILE 931 80.6065 9.6554 10.6400 |  |  |
757 CA GLY 932 91.4808 11.1915 11.3700 |  |  |
758 CA LYS 933 111.3935 14.0043 11.8000 |  |  |
759 CA ILE 934 94.7250 11.6498 11.5900 |  |  |
760 CA GLN 935 84.9589 10.2703 12.1500 |  |  |
761 CA ASP 936 110.0087 13.8087 12.7900 |  |  |
762 CA SER 937 119.6800 15.1749 13.3800 |  |  |
763 CA LEU 938 97.7580 12.0782 13.3400 |  |  |
764 CA SER 939 96.6823 11.9263 13.8000 |  |  |
765 CA SER 940 125.3007 15.9689 14.3000 |  |  |
766 CA THR 941 136.6821 17.5766 14.0200 |  |  |
767 CA ALA 942 128.3493 16.3995 13.8500 |  |  |
768 CA SER 943 148.7119 19.2759 13.3900 |  |  |
769 CA ALA 944 127.5145 16.2816 13.2900 |  |  |
770 CA LEU 945 111.7567 14.0557 12.7200 |  |  |
771 CA GLY 946 139.2872 17.9445 12.3900 |  |  |
772 CA LYS 947 136.7261 17.5828 11.7400 |  |  |
773 CA LEU 948 111.8843 14.0737 11.6700 |  |  |
774 CA GLN 949 120.4709 15.2866 11.8000 |  |  |
775 CA ASP 950 150.1297 19.4761 11.4600 |  |  |
776 CA VAL 951 138.8473 17.8824 11.3100 |  |  |
777 CA VAL 952 123.0448 15.6502 11.7100 |  |  |
778 CA ASN 953 149.0400 19.3222 11.7000 |  |  |
779 CA GLN 954 173.5859 22.7895 11.3700 |  |  |
780 CA ASN 955 155.5024 20.2351 11.9200 |  |  |
781 CA ALA 956 149.4520 19.3804 12.2100 |  |  |
782 CA GLN 957 184.5497 24.3382 11.9600 |  |  |
783 CA ALA 958 196.1058 25.9706 12.6100 |  |  |
784 CA LEU 959 177.2379 23.3054 12.5600 |  |  |
785 CA ASN 960 186.8774 24.6670 12.8000 |  |  |
786 CA THR 961 224.2478 29.9459 13.5200 |  |  |
787 CA LEU 962 221.4845 29.5556 13.9100 |  |  |
788 CA VAL 963 207.3216 27.5549 15.2300 |  |  |
789 CA LYS 964 235.2853 31.5050 16.0900 |  |  |
790 CA GLN 965 266.1670 35.8673 15.6100 |  |  |
791 CA LEU 966 256.2875 34.4718 16.9900 |  |  |
792 CA SER 967 273.9336 36.9644 18.1700 |  |  |
793 CA SER 968 316.9746 43.0443 17.8300 |  |  |
794 CA ASN 969 354.8827 48.3991 18.3800 |  |  |
795 CA PHE 970 386.1728 52.8191 17.0000 |  |  |
796 CA GLY 971 433.6375 59.5239 17.6800 |  |  |
797 CA ALA 972 403.9729 55.3335 19.3300 |  |  |
798 CA ILE 973 402.9331 55.1866 20.9600 |  |  |
799 CA SER 974 348.7954 47.5392 21.7700 |  |  |
800 CA SER 975 312.1343 42.3606 20.6800 |  |  |
801 CA VAL 976 291.0517 39.3825 23.7700 |  |  |
802 CA LEU 977 303.9844 41.2093 24.6200 |  |  |
803 CA ASN 978 299.8789 40.6294 27.5300 |  |  |
804 CA ASP 979 323.3366 43.9430 28.6300 |  |  |
805 CA ILE 980 358.3589 48.8902 29.4800 |  |  |
806 CA LEU 981 359.8886 49.1062 30.7900 |  |  |
807 CA SER 982 357.1401 48.7180 34.6100 |  |  |
808 CA ARG 983 393.9866 53.9229 38.0100 |  |  |
809 CA LEU 984 430.9741 59.1476 36.7000 |  |  |
810 CA ASP 985 464.4368 63.8745 37.0700 |  |  |
811 CA PRO 986 463.3464 63.7205 33.7300 |  |  |
812 CA PRO 987 518.2074 71.4700 34.8200 |  |  |
813 CA GLU 988 489.6408 67.4348 31.6800 |  |  |
814 CA ALA 989 427.4798 58.6540 28.7600 |  |  |
815 CA GLU 990 438.6510 60.2321 24.8600 |  |  |
816 CA VAL 991 465.4023 64.0109 23.3600 |  |  |
817 CA GLN 992 418.9204 57.4450 22.0500 |  |  |
818 CA ILE 993 380.7480 52.0528 20.6500 |  |  |
819 CA ASP 994 411.2338 56.3592 18.9500 |  |  |
820 CA ARG 995 408.3371 55.9500 18.3400 |  |  |
821 CA LEU 996 350.9047 47.8372 17.7300 |  |  |
822 CA ILE 997 347.6845 47.3823 16.3500 |  |  |
823 CA THR 998 379.1951 51.8335 15.7400 |  |  |
824 CA GLY 999 349.7138 47.6690 15.1800 |  |  |
825 CA ARG 1000 301.2370 40.8212 14.7600 |  |  |
826 CA LEU 1001 314.4086 42.6818 13.8000 |  |  |
827 CA GLN 1002 334.0701 45.4592 12.7300 |  |  |
828 CA SER 1003 290.7033 39.3333 13.1600 |  |  |
829 CA LEU 1004 262.3836 35.3329 12.8100 |  |  |
830 CA GLN 1005 292.1750 39.5412 12.2700 |  |  |
831 CA THR 1006 289.8473 39.2124 11.9800 |  |  |
832 CA TYR 1007 241.3426 32.3607 11.5900 |  |  |
833 CA VAL 1008 236.6881 31.7032 11.1200 |  |  |
834 CA THR 1009 265.9518 35.8369 10.6300 |  |  |
835 CA GLN 1010 243.0420 32.6007 10.0100 |  |  |
836 CA GLN 1011 203.4707 27.0110 9.7900 |  |  |
837 CA LEU 1012 219.5755 29.2859 9.6700 |  |  |
838 CA ILE 1013 235.2015 31.4932 9.5200 |  |  |
839 CA ARG 1014 198.8235 26.3545 9.3800 |  |  |
840 CA ALA 1015 175.6270 23.0778 9.1900 |  |  |
841 CA ALA 1016 195.9497 25.9486 8.7600 |  |  |
842 CA GLU 1017 187.8642 24.8064 8.3300 |  |  |
843 CA ILE 1018 150.2092 19.4874 8.4200 |  |  |
844 CA ARG 1019 150.7780 19.5677 8.0700 |  |  |
845 CA ALA 1020 164.8983 21.5623 7.8100 |  |  |
846 CA SER 1021 140.4547 18.1095 7.8200 |  |  |
847 CA ALA 1022 116.4058 14.7124 7.9700 |  |  |
848 CA ASN 1023 128.7257 16.4527 7.3000 |  |  |
849 CA LEU 1024 128.3979 16.4064 7.1300 |  |  |
850 CA ALA 1025 100.1234 12.4124 7.5000 |  |  |
851 CA ALA 1026 92.3753 11.3179 7.3700 |  |  |
852 CA THR 1027 105.3366 13.1488 6.7700 |  |  |
853 CA LYS 1028 93.8505 11.5263 6.7800 |  |  |
854 CA MET 1029 71.1165 8.3149 6.9300 |  |  |
855 CA SER 1030 73.9622 8.7169 6.2400 |  |  |
856 CA GLU 1031 86.1017 10.4317 6.1800 |  |  |
857 CA CYS 1032 77.4123 9.2042 6.6300 |  |  |
858 CA VAL 1033 56.4753 6.2467 6.9100 |  |  |
859 CA LEU 1034 51.9020 5.6007 6.6500 |  |  |
860 CA GLY 1035 62.0157 7.0293 6.2200 |  |  |
861 CA GLN 1036 75.5022 8.9344 5.7900 |  |  |
862 CA SER 1037 99.9343 12.3856 5.5000 |  |  |
863 CA LYS 1038 122.2735 15.5412 5.2400 |  |  |
864 CA ARG 1039 143.0030 18.4694 5.6000 |  |  |
865 CA VAL 1040 163.5373 21.3701 5.7400 |  |  |
866 CA ASP 1041 159.7057 20.8288 5.6500 |  |  |
867 CA PHE 1042 138.4021 17.8195 5.8500 |  |  |
868 CA CYS 1043 112.7367 14.1941 6.3700 |  |  |
869 CA GLY 1044 130.4821 16.7008 6.1600 |  |  |
870 CA LYS 1045 157.4787 20.5143 5.5800 |  |  |
871 CA GLY 1046 150.6480 19.5494 6.0300 |  |  |
872 CA TYR 1047 130.2517 16.6682 6.1900 |  |  |
873 CA HIS 1048 103.9344 12.9507 6.3000 |  |  |
874 CA LEU 1049 81.5490 9.7886 6.4200 |  |  |
875 CA MET 1050 65.0079 7.4520 6.7100 |  |  |
876 CA SER 1051 62.6032 7.1123 7.5600 |  |  |
877 CA PHE 1052 49.9118 5.3196 8.3200 |  |  |
878 CA PRO 1053 50.3604 5.3829 8.9700 |  |  |
879 CA GLN 1054 47.4509 4.9719 10.0400 |  |  |
880 CA SER 1055 48.6963 5.1479 10.4900 |  |  |
881 CA ALA 1056 60.0467 6.7512 11.0800 |  |  |
882 CA PRO 1057 67.0930 7.7466 10.9900 |  |  |
883 CA HIS 1058 80.6106 9.6560 10.2900 |  |  |
884 CA GLY 1059 80.2264 9.6018 9.8100 |  |  |
885 CA VAL 1060 70.8992 8.2842 9.6100 |  |  |
886 CA VAL 1061 72.9765 8.5776 9.3300 |  |  |
887 CA PHE 1062 73.6739 8.6762 8.7000 |  |  |
888 CA LEU 1063 73.8519 8.7013 8.3600 |  |  |
889 CA HIS 1064 86.0093 10.4186 7.6200 |  |  |
890 CA VAL 1065 85.3322 10.3230 7.3400 |  |  |
891 CA THR 1066 107.4005 13.4403 6.7800 |  |  |
892 CA TYR 1067 122.3323 15.5495 6.7800 |  |  |
893 CA VAL 1068 154.7319 20.1262 6.8500 |  |  |
894 CA PRO 1069 177.7279 23.3746 6.9300 |  |  |
895 CA ALA 1070 196.6491 26.0474 6.9900 |  |  |
896 CA GLN 1071 227.8686 30.4574 7.1800 |  |  |
897 CA GLU 1072 249.4359 33.5039 7.2000 |  |  |
898 CA LYS 1073 282.0750 38.1145 7.3900 |  |  |
899 CA ASN 1074 311.4376 42.2622 7.9800 |  |  |
900 CA PHE 1075 301.2674 40.8255 8.3000 |  |  |
901 CA THR 1076 328.0367 44.6069 8.6300 |  |  |
902 CA THR 1077 302.9027 41.0565 8.5100 |  |  |
903 CA ALA 1078 306.7476 41.5997 8.2800 |  |  |
904 CA PRO 1079 289.5794 39.1745 8.1100 |  |  |
905 CA ALA 1080 280.0094 37.8227 8.8900 |  |  |
906 CA ILE 1081 285.5505 38.6054 9.2800 |  |  |
907 CA CYS 1082 309.9637 42.0540 9.9000 |  |  |
908 CA HIS 1083 295.5407 40.0166 9.9500 |  |  |
909 CA ASP 1084 314.4080 42.6818 9.4700 |  |  |
910 CA GLY 1085 336.6540 45.8242 9.2900 |  |  |
911 CA LYS 1086 293.2760 39.6967 9.3400 |  |  |
912 CA ALA 1087 284.0254 38.3900 9.1300 |  |  |
913 CA HIS 1088 244.5319 32.8112 8.8800 |  |  |
914 CA PHE 1089 228.9743 30.6136 8.1900 |  |  |
915 CA PRO 1090 197.9620 26.2328 8.0500 |  |  |
916 CA ARG 1091 173.0378 22.7121 7.7500 |  |  |
917 CA GLU 1092 164.8861 21.5606 7.0800 |  |  |
918 CA GLY 1093 180.7877 23.8068 7.1100 |  |  |
919 CA VAL 1094 215.7129 28.7403 7.5700 |  |  |
920 CA PHE 1095 241.6641 32.4061 8.4400 |  |  |
921 CA VAL 1096 262.8317 35.3962 8.9700 |  |  |
922 CA SER 1097 300.9392 40.7792 9.4500 |  |  |
923 CA ASN 1098 318.7292 43.2922 9.9700 |  |  |
924 CA GLY 1099 371.4511 50.7395 10.0900 |  |  |
925 CA THR 1100 368.9619 50.3879 10.2400 |  |  |
926 CA HIS 1101 315.9612 42.9012 10.2500 |  |  |
927 CA TRP 1102 280.4662 37.8872 9.6300 |  |  |
928 CA PHE 1103 237.1072 31.7624 9.3700 |  |  |
929 CA VAL 1104 206.3388 27.4161 8.6600 |  |  |
930 CA THR 1105 186.7060 24.6428 7.6900 |  |  |
931 CA GLN 1106 165.1375 21.5961 7.0400 |  |  |
932 CA ARG 1107 182.4798 24.0458 6.5400 |  |  |
933 CA ASN 1108 168.9436 22.1337 6.4300 |  |  |
934 CA PHE 1109 170.5113 22.3552 6.9600 |  |  |
935 CA TYR 1110 194.5484 25.7506 7.2300 |  |  |
936 CA GLU 1111 182.7164 24.0793 7.2900 |  |  |
937 CA PRO 1112 205.0946 27.2404 8.0300 |  |  |
938 CA GLN 1113 194.6964 25.7715 8.8100 |  |  |
939 CA ILE 1114 215.3841 28.6938 9.7100 |  |  |
940 CA ILE 1115 214.6658 28.5924 10.5600 |  |  |
941 CA THR 1116 199.4957 26.4495 11.4400 |  |  |
942 CA THR 1117 191.0710 25.2594 11.6300 |  |  |
943 CA ASP 1118 165.4506 21.6403 10.9400 |  |  |
944 CA ASN 1119 170.5679 22.3632 10.1000 |  |  |
945 CA THR 1120 190.7566 25.2150 9.0700 |  |  |
946 CA PHE 1121 199.4308 26.4403 8.5600 |  |  |
947 CA VAL 1122 230.6586 30.8515 8.0800 |  |  |
948 CA SER 1123 259.4030 34.9119 7.6300 |  |  |
949 CA GLY 1124 306.3128 41.5382 7.7400 |  |  |
950 CA ASN 1125 329.7368 44.8471 8.4300 |  |  |
951 CA CYS 1126 359.1671 49.0043 8.7700 |  |  |
952 CA ASP 1127 411.0913 56.3390 8.0800 |  |  |
953 CA VAL 1128 392.1669 53.6658 8.1100 |  |  |
954 CA VAL 1129 363.0408 49.5515 8.3700 |  |  |
955 CA ILE 1130 399.7511 54.7371 8.3400 |  |  |
956 CA GLY 1131 385.3434 52.7019 8.5500 |  |  |
957 CA ILE 1132 349.1414 47.5881 8.9400 |  |  |
958 CA VAL 1133 352.5068 48.0635 9.5400 |  |  |
959 CA ASN 1134 351.9817 47.9893 11.2700 |  |  |
960 CA ASN 1135 316.5267 42.9810 10.7400 |  |  |
961 CA THR 1136 288.4827 39.0196 11.0700 |  |  |
962 CA VAL 1137 245.4256 32.9374 12.0700 |  |  |
963 CA TYR 1138 231.0763 30.9105 13.8400 |  |  |
964 CA ASP 1139 216.6590 28.8739 15.7800 |  |  |
965 CA PRO 1140 210.6590 28.0264 18.0400 |  |  |
966 CA LEU 1141 181.7952 23.9491 20.2200 |  |  |
967 CA GLN 1142 200.9904 26.6606 21.3900 |  |  |
968 CA PRO 1143 233.8800 31.3065 22.7100 |  |  |
969 CA GLU 1144 216.4623 28.8461 23.2400 |  |  |
970 CA LEU 1145 221.4198 29.5464 24.4300 |  |  |
971 CA ASP 1146 271.1675 36.5737 24.7200 |  |  |
972 CA SER 1147 308.7897 41.8881 25.4100 |  |  |