NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 R 4.3347 8.2549 119.0691 55.2466 31.9796 174.8393 21 I 4.4293 7.5719 116.5956 59.5237 39.7096 174.5291 22 K 4.2722 9.5831 132.5789 54.9744 33.4486 172.7080 23 K 4.5048 9.2449 125.3440 53.6452 34.5557 175.3519 24 I 4.8542 7.8656 126.0991 59.2982 40.7952 174.5579 25 S 5.2571 8.6308 119.3955 56.7074 65.3132 172.7262 26 I 4.9270 9.4403 128.6586 60.4293 37.9270 174.6609 27 E 5.2810 9.7884 127.3522 54.3198 32.6615 175.6777 28 G 4.1479 8.4514 110.0724 46.2082 0.0000 171.9798 29 N 4.7982 7.9210 119.5606 52.4897 40.0141 173.9899 30 I 4.0532 9.3918 122.3625 62.5672 36.6557 176.4734 31 A 3.7806 9.1177 125.6689 52.7430 16.0892 179.1049 32 A 4.0667 7.8472 122.3115 55.6267 18.6910 178.5789 33 G 3.8003 7.9409 102.0514 45.5606 0.0000 175.7553 34 K 3.9126 8.5097 120.7366 60.7465 31.9728 178.6165 35 S 4.1299 8.0386 116.0276 61.1481 62.5516 176.7970 36 T 3.8823 8.0251 117.8088 66.4102 68.1300 176.3443 37 F 4.4569 8.5047 125.1724 61.8830 39.6518 178.1438 38 V 3.2894 7.9118 119.2865 66.2373 31.0875 179.8666 39 N 4.4994 8.1441 116.1968 56.1998 38.4827 177.2509 40 I 3.8287 7.1331 119.3276 64.2625 37.2187 178.1625 41 L 4.2199 7.5022 121.2404 57.1062 41.5314 178.6488 42 K 3.7115 7.1162 119.2539 54.9084 31.7804 177.8813 *48 W 5.1216 8.5835 125.8661 56.4712 30.1089 175.1071 49 E 5.0522 8.6495 120.7834 54.6959 33.6350 171.3343 50 V 5.0345 8.3098 116.9297 62.3931 35.3869 175.3981 51 V 4.3600 8.7860 126.3651 60.0170 32.2075 172.9586 52 P 4.7967 0.0000 0.0000 61.8384 32.4092 175.8021 53 E 3.9733 8.7412 122.7128 55.6999 30.3062 176.7540 54 P 4.4180 0.0000 0.0000 62.0607 31.3626 179.2200 55 V 2.9096 6.9292 114.4986 64.8006 31.7110 177.2580 56 A 4.0772 7.9177 122.0956 56.1179 18.1521 180.2351 57 R 4.1236 7.8670 117.6379 60.9422 29.0136 181.2398 58 W 5.0349 8.0571 117.2871 60.4939 28.6485 177.7245 59 C 4.6792 8.4501 115.0690 59.8766 28.6466 172.5512 60 N 5.0137 7.6215 117.5510 51.0147 38.5138 172.3607 61 V 4.0764 8.6048 121.8762 61.1196 31.9290 174.8978 62 Q 3.5748 8.9430 128.3083 56.8852 25.7984 173.6759 63 S 3.8257 7.9619 103.4509 59.1758 62.9128 172.6768 64 T 4.3107 7.2050 107.9773 60.2374 71.8170 172.5082 *80 N 4.9466 8.7346 121.9623 53.5659 39.6287 175.3030 81 V 3.7307 7.9772 128.3455 63.8770 31.6696 178.1643 82 L 3.0578 7.8041 121.2781 57.9180 42.1204 178.2977 83 Q 4.0314 7.7652 118.1359 59.5063 28.8968 178.0307 84 M 3.8957 8.3291 120.1339 58.4590 31.7048 178.5121 85 M 4.0849 7.4936 118.4473 58.8936 32.2176 177.9930 86 Y 4.0327 7.4105 115.3938 60.9191 38.0153 177.9905 87 E 4.2736 8.1308 119.1078 58.0668 31.2615 177.5292 88 K 4.6944 8.0142 119.0667 53.6211 33.0111 174.0044 89 P 4.4917 0.0000 0.0000 64.9846 31.4506 178.7042 90 E 4.3163 8.1461 112.5294 56.4241 29.4344 176.7414 91 R 4.0934 8.1072 119.6742 56.4184 32.2240 176.5627 92 W 4.7528 7.7363 114.3040 56.0607 29.9734 177.3929 93 S 4.1785 8.1255 117.0889 61.8649 62.3032 175.8497 94 F 4.0492 8.3404 122.4196 61.8659 39.0471 176.7549 95 T 3.7724 8.2616 114.3835 66.9342 68.3116 176.0997 96 F 4.0411 8.9359 122.4459 61.3924 39.5060 177.2164 97 Q 3.5878 8.2551 117.9444 58.7206 28.4084 178.7528 98 T 3.2839 7.5487 117.0228 66.4922 68.4268 175.9017 99 Y 3.9723 7.6447 120.9914 60.6191 38.7939 177.8243 100 A 3.3700 7.3723 121.7951 55.2793 18.2666 179.2218 101 C 4.1091 7.8211 116.2672 62.5270 31.7568 174.9740 102 L 4.1055 8.1779 122.1836 58.5363 41.5180 178.8544 103 S 3.9603 7.9270 113.6741 61.6506 62.6886 176.3097 104 R 3.8174 8.0342 122.3874 59.2020 29.7081 178.4082 105 I 3.5536 7.7909 119.3176 64.2754 37.0529 178.6373 106 R 3.7102 7.8258 118.4555 59.1898 29.8875 178.7969 107 A 3.9306 8.0014 120.5558 55.5414 18.2219 179.7627 108 Q 3.7793 8.0372 116.3203 58.5042 28.4439 178.6034 109 L 3.8776 7.8001 120.8722 58.1100 42.5965 178.6480 110 A 4.1154 8.0521 120.4089 54.8873 18.0753 178.6557 111 S 4.0811 7.5684 111.2503 61.8317 62.3250 175.3492 112 L 4.5920 7.6965 120.8489 55.5340 42.0649 177.3735 113 N 4.8233 7.6855 117.9212 52.8366 38.7099 174.7533 *118 D 4.4781 7.9329 114.3811 52.6370 42.3320 176.7983 119 A 4.7265 7.8417 126.8185 52.4533 21.5198 177.9711 120 E 4.1379 9.0158 113.6770 59.3305 30.1692 174.2619 121 K 4.5882 7.5779 121.0211 51.5072 32.1086 173.8696 122 P 4.6028 0.0000 0.0000 62.5628 32.6727 176.2408 123 V 4.6952 8.5578 124.8470 60.6278 34.6977 173.6369 124 L 4.8363 8.6062 129.7265 53.2586 44.9616 174.6989 125 F 4.8562 8.9463 125.3154 56.0696 40.9930 174.7527 126 F 5.3085 9.3554 123.6779 56.3026 40.9970 175.0937 127 E 4.5955 8.8404 125.0580 55.6061 28.7725 175.0688 128 R 4.6705 9.3670 126.9648 55.7693 31.6202 174.9317 129 S 4.8642 8.8307 115.5422 55.8204 66.3868 175.0386 130 V 3.9431 7.7498 111.5687 63.0975 30.9450 177.7838 131 Y 4.5180 7.0712 116.8626 60.6889 38.3378 177.6221 132 S 4.1371 8.3228 114.5618 61.7951 62.8164 176.1571 133 D 4.6222 8.3531 122.3179 57.1087 40.4770 178.3569 134 R 4.3825 7.6033 117.4750 58.5928 30.2870 177.0177 135 Y 4.8232 7.9703 113.5253 58.5643 38.4732 175.1583 136 I 4.2875 7.4145 118.4873 62.5961 40.1726 177.6842 137 F 4.2554 8.3381 118.9882 60.6034 39.4254 177.5164 138 A 4.1137 8.2837 120.1674 55.3633 18.2522 179.1456 139 S 3.4716 7.9521 111.2463 61.8306 61.9807 176.0400 140 N 4.1979 7.9740 118.7096 56.7902 38.6132 176.6999 141 L 3.8538 7.8100 120.2092 57.9493 41.5284 178.8584 142 Y 4.1723 7.4744 118.9765 60.1780 38.4662 176.3707 143 E 4.0101 7.4005 116.8121 56.4485 29.5050 176.9396 144 S 4.5376 6.6941 113.3524 57.7519 63.9794 174.2897 145 E 3.7749 7.9427 118.0378 57.5626 27.3794 174.9923 146 C 4.6714 8.0692 115.1778 59.6438 28.0540 173.3858 147 M 5.2443 7.6832 115.9550 54.3375 36.2002 175.3237 148 N 4.8505 8.6476 122.0213 51.9042 40.5668 175.7831 149 E 4.0135 8.7016 118.9117 59.7451 29.3711 179.7252 150 T 3.8135 7.8938 115.2828 66.7705 68.6293 176.0604 151 E 3.5845 9.0834 120.6665 59.1299 29.5344 178.9808 152 W 4.6460 8.2096 128.1123 61.1613 30.6047 178.2239 153 T 3.6350 8.0608 115.2708 66.6660 67.9148 176.6381 154 I 3.7338 7.8109 121.6056 64.6149 37.0600 177.4113 155 Y 4.2778 8.7564 120.5616 61.2910 38.5010 178.2632 156 Q 3.5628 7.7999 118.3897 58.8572 28.9023 178.5702 157 D 4.2816 8.0421 118.7948 57.1291 41.1734 178.1181 158 W 4.1598 8.5930 128.9966 60.8716 30.6694 177.0408 159 H 3.2175 8.9014 118.7083 59.2521 28.8893 176.7012 160 D 4.4472 8.0999 119.5144 57.1178 40.9625 178.2173 161 W 4.1852 7.9763 128.3624 60.8440 30.8570 177.4622 162 M 3.5897 7.8080 118.7654 58.6176 31.2072 178.2215 163 N 4.5690 7.4841 115.5610 55.0378 39.1345 177.1081 164 N 4.5237 7.7730 120.0109 53.9036 38.0628 181.0129 165 Q 3.8509 7.1027 115.4728 56.8806 28.2338 178.3620 166 F 4.5900 6.7765 118.0309 55.8150 37.5642 175.9053 167 G 4.0573 7.4984 111.4864 46.8406 0.0000 172.4730 168 Q 3.8390 8.1661 120.8387 58.7270 29.1121 178.0668 169 S 4.2537 7.9884 110.7234 59.9505 63.5254 174.5279 170 L 4.6218 8.3399 123.0125 54.9171 41.5355 176.9433 171 E 4.1073 7.5961 115.9802 56.0000 29.9137 181.2565 172 L 4.5745 8.9201 124.2633 54.2057 42.3699 176.6861 173 D 4.8575 8.7315 120.3272 54.3011 42.5935 176.0798 174 G 4.2994 7.5146 104.4810 46.1570 0.0000 172.3273 175 I 5.2725 8.2794 119.6274 59.6850 41.8997 174.5393 176 I 4.5603 9.1936 127.8346 59.7651 39.4437 173.8736 177 Y 5.0551 9.3330 130.1799 56.2978 40.2817 174.5929 178 L 4.3384 9.0613 128.8582 53.3471 41.6977 175.6078 179 Q 3.7361 8.0206 125.7251 55.3813 30.2050 174.3487 180 A 5.0814 8.0556 125.9078 50.7935 22.3866 176.1364 181 T 3.9172 9.2660 111.7202 60.7863 69.7506 173.9913 182 P 4.2197 0.0000 0.0000 65.9486 31.4242 178.7765 183 E 3.9583 8.1448 116.8527 59.7253 29.2826 179.4730 184 T 3.9474 7.5682 115.5600 66.7373 68.6248 176.7005 185 C 4.1413 8.1190 118.7249 62.6839 27.6601 175.8840 186 L 3.9783 8.1933 122.1383 58.5714 41.5486 178.6244 187 H 3.9707 8.2106 117.7132 58.9305 29.8042 176.8232 188 R 4.0657 8.2572 119.9437 58.2188 29.9196 178.3855 189 I 3.7921 7.6089 122.0735 65.4966 36.8675 178.4557 *190 Y 4.1546 7.3141 122.7216 62.4940 36.7944 180.1291 191 L 4.3012 7.3422 123.4200 59.3918 40.4610 181.0593 192 R 4.3575 8.3087 118.9694 56.3876 29.9787 176.6565 193 G 3.8684 7.9305 108.5909 46.7655 0.0000 174.2760 194 R 4.0747 7.4789 117.4225 55.8990 30.2825 179.9257 195 N 4.3753 9.1376 121.2694 54.9180 37.5895 173.5795 196 E 3.9954 8.1889 118.1625 59.2338 29.7935 178.9877 197 E 3.3165 7.6183 116.3645 58.1425 29.2846 178.5337 198 Q 4.2796 7.3982 116.4190 57.1633 28.7493 176.7142 199 G 3.8221 7.1118 107.9832 45.4363 0.0000 174.2081 200 I 3.5319 7.2277 121.1973 61.1136 37.5057 174.2984 201 P 4.6271 0.0000 0.0000 61.6256 32.8981 177.0126 202 L 3.9376 8.6284 120.2047 58.6869 41.7578 178.6881 203 E 4.1157 8.3723 116.4530 59.9496 29.5323 178.6723 204 Y 4.2591 7.9289 118.9120 60.5729 39.0159 177.3021 205 L 3.9149 8.1540 119.3161 58.0379 41.7883 179.0029 206 E 3.6395 8.5959 119.1692 59.1592 29.5028 179.0725 207 K 3.7274 7.6786 118.1515 59.4584 32.1705 179.0301 208 L 3.7457 7.5979 118.5840 58.1707 41.4686 178.8152 209 H 4.1542 8.6039 118.1354 59.8884 29.6562 176.8839 210 Y 4.4443 7.6931 118.1961 61.0450 37.6395 178.5877 211 K 4.0743 8.1592 119.4801 59.5618 32.0104 179.1203 212 H 4.2326 8.2447 116.5984 58.9045 28.6737 177.3890 213 E 3.9189 8.3887 120.2574 59.7154 29.3790 179.2849 214 S 4.1685 8.4415 113.2392 61.4464 62.1400 176.0574 215 W 4.3863 8.1430 129.3488 59.6159 30.6708 177.2655 216 L 3.7751 8.1415 117.4378 54.9406 41.9704 177.3845 217 L 4.2044 7.2825 118.9067 57.2241 42.7578 177.1392 218 H 4.4078 8.0554 113.8946 56.2705 29.3548 175.4221 219 R 3.7992 7.9217 117.0843 58.0785 27.0141 176.2564 220 T 4.3987 8.2506 103.8012 61.0655 69.9877 174.2412 221 L 4.3531 7.8533 127.0799 53.9246 41.4845 176.3600 222 K 4.1803 8.2160 127.2838 54.3243 32.5231 174.3178 223 T 4.3283 7.7334 110.1470 60.2906 71.4879 173.6515 224 N 4.6239 8.3585 119.2414 53.3100 38.4981 175.9063 225 F 4.7647 7.8625 121.9223 55.5107 39.6226 175.7714 226 D 4.4130 8.5407 124.8763 56.0227 40.3270 177.9624 227 Y 4.3268 8.4160 117.1069 60.5830 37.6416 178.4717 228 L 3.7874 6.8946 122.9845 58.2205 41.3715 180.0363 229 Q 4.1575 8.1177 121.8156 59.7865 28.0917 181.7948 230 E 4.6395 8.2149 116.0141 58.1100 30.8513 181.5720 231 V 4.1152 6.9558 118.0003 62.9692 32.5937 174.1124 232 P 4.6213 0.0000 0.0000 62.5238 32.7493 175.0441 233 I 4.7930 8.3620 124.2011 59.3750 39.8478 174.5361 234 L 4.3343 8.6617 130.0068 53.7715 43.3823 174.9713 235 T 5.0108 8.3670 123.5827 62.1889 70.1259 174.3360 236 L 4.6275 8.5894 126.1972 52.7233 45.3959 175.3727 237 D 4.3317 8.6588 123.3820 53.4567 41.3751 175.7543 238 V 4.3348 8.0322 120.5197 61.2927 32.3474 178.3465 239 N 4.2705 8.6305 122.9080 55.7676 39.0991 176.0454 240 E 4.0486 7.5454 115.0886 57.3765 30.9477 181.8983 *246 Y 4.6244 8.5446 116.8757 57.1795 39.4021 178.5464 247 E 4.7910 7.8016 114.2016 55.7582 32.6281 181.2439 248 S 4.4196 8.0524 109.9719 60.5586 62.5823 175.4189 249 L 4.2024 7.7478 121.2000 57.8681 41.9287 178.7616 250 V 3.8617 8.0399 120.2117 66.7646 30.9211 177.9782 251 E 4.1068 8.0634 119.9827 61.8112 29.5547 182.5812 252 K 4.2496 7.8897 122.9301 59.5957 31.8104 181.1265 253 V 4.0268 8.0939 122.2509 66.7356 31.3596 178.8085 254 K 4.2606 8.2751 124.9086 60.7944 31.3929 181.2957 255 E 4.3005 7.7649 117.2814 60.8739 29.6348 180.7440 256 F 4.5647 8.3674 120.5561 61.5902 39.4125 177.3726 257 L 3.7337 8.1437 117.7269 57.5024 41.5082 179.5471 258 S 4.3441 8.1112 114.8742 61.3747 62.8635 175.8784 259 T 4.3346 7.2751 109.8883 61.8932 68.5084 175.0525 260 L 4.1810 7.2819 127.3225 55.2474 41.9666 176.0961 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 20 R 8.25 4.33 0.00 1.85 1.92 0.00 3.18 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.23 0.00 21 I 7.57 4.43 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.19 0.94 0.00 0.00 22 K 9.58 4.27 0.00 1.46 1.70 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.37 1.29 7.81 23 K 9.24 4.50 0.00 1.47 1.10 0.00 1.85 0.00 0.00 1.79 0.00 0.00 3.16 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.20 1.44 7.81 24 I 7.87 4.85 1.15 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.00 1.06 0.00 0.00 25 S 8.63 5.26 0.00 4.16 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 I 9.44 4.93 2.18 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.96 1.14 0.00 0.00 27 E 9.79 5.28 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 28 G 8.45 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 7.92 4.80 0.00 2.73 2.77 0.00 0.00 6.91 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 I 9.39 4.05 2.06 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.02 1.08 0.00 0.00 31 A 9.12 3.78 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.85 4.07 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.94 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.51 3.91 0.00 2.15 2.24 0.00 1.48 0.00 0.00 1.89 0.00 0.00 3.29 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.63 1.75 7.81 35 S 8.04 4.13 0.00 3.92 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.03 3.88 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 37 F 8.50 4.46 0.00 3.13 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 7.91 3.29 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.93 0.00 0.00 39 N 8.14 4.50 0.00 2.66 2.90 0.00 0.00 7.12 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.13 3.83 1.99 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.66 0.95 0.00 0.00 41 L 7.50 4.22 0.00 1.12 1.16 -0.12 -1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 42 K 7.12 3.71 0.00 1.81 1.66 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.40 1.32 7.81 *48 W 8.58 5.12 0.00 3.30 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.65 5.05 0.00 1.57 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 50 V 8.31 5.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.01 0.00 0.00 51 V 8.79 4.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.12 0.00 0.00 52 P 0.00 4.80 0.00 1.93 1.95 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 53 E 8.74 3.97 0.00 2.15 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 54 P 0.00 4.42 0.00 1.92 1.85 0.00 3.45 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 55 V 6.93 2.91 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.78 0.00 0.00 56 A 7.92 4.08 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.87 4.12 0.00 1.83 1.97 0.00 3.25 0.00 0.00 3.34 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.30 0.00 58 W 8.06 5.03 0.00 3.69 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 C 8.45 4.68 0.00 3.19 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 7.62 5.01 0.00 2.71 2.73 0.00 0.00 6.89 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.60 4.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 7.80 3.56 0.00 1.80 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.01 1.62 0.00 157 D 8.04 4.28 0.00 2.73 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 W 8.59 4.16 0.00 3.38 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 H 8.90 3.22 0.00 2.66 3.10 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 D 8.10 4.45 0.00 2.90 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 W 7.98 4.19 0.00 3.44 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 M 7.81 3.59 0.00 1.58 1.52 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.70 0.00 163 N 7.48 4.57 0.00 2.78 2.86 0.00 0.00 7.01 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 N 7.77 4.52 0.00 2.82 2.72 0.00 0.00 6.88 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 Q 7.10 3.85 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.35 0.00 0.00 0.00 0.00 0.00 1.18 1.16 0.00 166 F 6.78 4.59 0.00 3.01 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.50 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Q 8.17 3.84 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.25 0.00 169 S 7.99 4.25 0.00 4.03 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.34 4.62 0.00 1.76 1.75 0.82 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 171 E 7.60 4.11 0.00 1.98 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.16 0.00 172 L 8.92 4.57 0.00 2.02 1.82 1.30 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 173 D 8.73 4.86 0.00 2.51 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 G 7.51 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 I 8.28 5.27 1.75 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.65 0.82 0.00 0.00 176 I 9.19 4.56 2.04 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.36 0.90 0.00 0.00 177 Y 9.33 5.06 0.00 2.75 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 L 9.06 4.34 0.00 1.54 1.46 0.96 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.02 3.74 0.00 1.39 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.66 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 180 A 8.06 5.08 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 T 9.27 3.92 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 182 P 0.00 4.22 0.00 2.10 2.07 0.00 3.48 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 183 E 8.14 3.96 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 184 T 7.57 3.95 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 185 C 8.12 4.14 0.00 3.17 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 L 8.19 3.98 0.00 1.86 1.89 0.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 187 H 8.21 3.97 0.00 3.28 3.42 0.00 5.63 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 R 8.26 4.07 0.00 2.13 2.03 0.00 3.53 0.00 0.00 3.19 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 189 I 7.61 3.79 2.05 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.73 0.90 0.00 0.00 *190 Y 7.31 4.15 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 L 7.34 4.30 0.00 1.71 1.62 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 192 R 8.31 4.36 0.00 1.90 1.94 0.00 3.23 0.00 0.00 3.20 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 193 G 7.93 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 R 7.48 4.07 0.00 1.77 1.84 0.00 3.31 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.44 0.00 195 N 9.14 4.38 0.00 2.64 2.89 0.00 0.00 6.90 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 E 8.19 4.00 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 197 E 7.62 3.32 0.00 1.93 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 198 Q 7.40 4.28 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.58 2.47 0.00 199 G 7.11 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 I 7.23 3.53 1.93 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.34 1.12 0.00 0.00 201 P 0.00 4.63 0.00 2.62 2.19 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.96 0.00 202 L 8.63 3.94 0.00 1.79 1.72 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 203 E 8.37 4.12 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 204 Y 7.93 4.26 0.00 3.08 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 L 8.15 3.91 0.00 1.84 1.75 1.02 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 206 E 8.60 3.64 0.00 1.99 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 2.17 0.00 207 K 7.68 3.73 0.00 1.73 1.84 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.59 7.81 208 L 7.60 3.75 0.00 1.72 1.57 1.06 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 209 H 8.60 4.15 0.00 3.20 3.27 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 Y 7.69 4.44 0.00 3.14 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 K 8.16 4.07 0.00 1.90 1.81 0.00 1.87 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.56 7.81 212 H 8.24 4.23 0.00 3.57 3.55 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 E 8.39 3.92 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 214 S 8.44 4.17 0.00 3.92 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 8.14 4.39 0.00 3.20 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 L 8.14 3.78 0.00 0.32 0.84 0.34 -0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.28 4.20 0.00 1.53 1.49 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 218 H 8.06 4.41 0.00 3.34 3.31 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 R 7.92 3.80 0.00 1.91 1.94 0.00 3.29 0.00 0.00 3.11 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 220 T 8.25 4.40 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 221 L 7.85 4.35 0.00 1.64 1.74 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 222 K 8.22 4.18 0.00 1.82 1.58 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.36 0.99 7.81 223 T 7.73 4.33 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 224 N 8.36 4.62 0.00 2.22 2.50 0.00 0.00 6.77 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 F 7.86 4.76 0.00 2.94 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 D 8.54 4.41 0.00 2.60 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 Y 8.42 4.33 0.00 3.24 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 L 6.89 3.79 0.00 1.43 1.55 0.17 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 229 Q 8.12 4.16 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 230 E 8.21 4.64 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.16 0.00 231 V 6.96 4.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.06 0.00 0.00 232 P 0.00 4.62 0.00 2.40 2.09 0.00 3.78 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 233 I 8.36 4.79 1.76 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.62 0.75 0.00 0.00 234 L 8.66 4.33 0.00 0.57 0.84 0.87 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 235 T 8.37 5.01 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 236 L 8.59 4.63 0.00 1.25 1.31 0.60 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 237 D 8.66 4.33 0.00 2.61 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 V 8.03 4.33 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.88 0.00 0.00 239 N 8.63 4.27 0.00 2.83 2.84 0.00 0.00 6.58 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 E 7.55 4.05 0.00 1.93 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.09 0.00 *246 Y 8.54 4.62 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 E 7.80 4.79 0.00 1.82 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.83 0.00 248 S 8.05 4.42 0.00 3.89 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 249 L 7.75 4.20 0.00 1.80 1.61 0.82 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 250 V 8.04 3.86 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.04 0.00 0.00 251 E 8.06 4.11 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.21 0.00 252 K 7.89 4.25 0.00 1.84 1.86 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.33 7.81 253 V 8.09 4.03 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.28 0.00 0.00 254 K 8.28 4.26 0.00 1.84 1.81 0.00 1.88 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.33 7.81 255 E 7.76 4.30 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.20 0.00 256 F 8.37 4.56 0.00 3.10 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 L 8.14 3.73 0.00 1.78 1.75 0.84 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 258 S 8.11 4.34 0.00 4.08 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 T 7.28 4.33 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 260 L 7.28 4.18 0.00 1.49 1.40 0.49 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.