NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3245 8.2649 123.5838 51.6153 19.8404 176.8464 3 R 3.9475 8.4664 122.3719 55.5787 30.9666 174.8071 4 N 4.8295 8.7129 117.4564 53.4725 41.3986 173.4760 5 K 4.9515 9.1051 121.6407 54.7724 35.5135 174.7278 6 I 4.9904 8.9143 128.1435 59.4481 40.0578 174.1723 7 A 5.0295 9.0382 129.2423 50.1547 21.5742 175.2660 8 L 4.8941 9.1967 123.4703 53.2011 44.0322 176.2611 9 I 4.4746 8.5772 127.4198 63.6543 37.4919 175.4142 10 G 4.4734 9.1933 116.9104 46.0751 0.0000 173.1422 11 S 4.6010 9.3637 123.2317 58.0084 64.7504 176.1668 12 G 4.0330 7.7951 114.5314 45.1259 0.0000 175.8403 13 M 3.6417 8.3211 120.3110 58.3859 32.0989 178.4849 14 I 3.8875 7.6098 119.5827 64.1550 37.4175 178.3513 15 G 3.8898 7.5980 107.6310 47.2113 0.0000 175.6638 16 G 3.6565 8.2565 108.6536 47.6986 0.0000 175.9214 17 T 4.0101 7.6640 117.8819 66.3377 68.4866 176.5776 18 L 3.9993 8.5494 121.0269 57.9490 41.6792 179.5160 19 A 4.1336 8.1220 120.4490 55.5297 18.2668 179.2174 20 H 4.2428 8.4112 116.7371 59.5139 29.9950 177.5812 21 L 3.9279 8.4272 120.9779 57.5928 41.3986 179.3406 22 A 4.1262 8.3802 121.1545 54.8398 18.2064 179.9469 23 G 3.2378 8.3271 104.3249 47.9706 0.0000 175.8294 24 L 3.6599 7.4560 121.3507 56.6099 41.7137 178.9839 25 K 4.2877 7.6569 115.1146 54.9864 32.7770 176.0353 26 E 3.7808 7.9374 117.8311 57.5208 27.2086 175.6683 27 L 4.1315 8.0389 119.1203 56.0769 42.5425 177.8913 28 G 3.7031 7.6878 103.8069 44.2994 0.0000 172.6729 29 D 4.5471 8.2380 120.3091 54.2420 42.5978 175.9204 30 V 4.6976 8.2965 120.1705 61.1521 35.0869 174.1590 31 V 4.7946 9.2781 128.2175 61.1484 34.0158 173.9707 32 L 4.9926 9.3349 128.4500 53.1968 43.6076 175.1763 33 F 5.2454 9.2070 126.7911 56.6469 42.4614 173.3944 34 D 4.6150 7.3102 123.0482 53.2391 44.6553 175.8476 35 I 3.5669 8.0917 114.2551 62.5224 38.8256 176.3714 36 A 4.0179 8.2842 125.8472 51.4866 18.4958 176.6971 37 E 4.2121 8.4597 123.4866 57.7560 30.5728 175.8895 38 G 4.3159 9.0987 114.5352 46.6610 0.0000 175.7014 39 T 3.7950 7.1430 116.0280 66.0245 68.4971 174.9113 40 P 4.2844 0.0000 0.0000 65.7174 31.4824 178.4063 41 Q 4.1122 8.0276 117.8938 58.5431 28.6884 178.6111 42 G 3.5217 8.4555 107.2037 47.8391 0.0000 175.9969 43 K 4.0732 8.2055 121.9697 58.7307 31.9610 179.6509 44 G 3.7294 8.1605 105.9663 47.9115 0.0000 175.4169 45 L 3.9623 8.0194 123.4256 57.5923 41.8281 178.4978 46 D 4.2356 7.9244 116.9806 57.4966 41.5793 178.0381 47 I 3.6567 7.8383 120.1970 64.0509 36.9799 178.1446 48 A 3.8303 7.9243 121.9309 55.3610 18.0674 179.5472 49 E 3.9751 8.3790 115.4921 58.6346 29.7651 178.9905 50 S 4.3136 7.7903 114.2764 60.2104 63.3459 176.4650 51 S 2.7900 7.6917 118.6800 60.4706 62.3436 174.6600 52 P 4.1155 0.0000 0.0000 64.7601 31.0592 178.4729 53 V 3.6847 7.3641 116.8373 66.0958 31.6451 177.3557 54 D 4.6850 7.9930 115.4026 54.6292 41.0976 177.4363 55 G 3.8935 8.0179 107.5985 45.3406 0.0000 173.2585 56 F 4.6140 7.6561 113.7369 55.8510 38.9710 174.7715 57 D 4.8988 8.7250 123.1347 52.9487 41.8142 175.4878 58 A 4.8562 8.3684 124.6052 50.6130 22.4292 175.4479 59 K 4.3731 9.8766 122.3456 56.0523 33.5513 176.0083 60 F 5.0504 8.9961 123.1874 55.9777 41.5916 175.0926 61 T 4.6902 8.8328 119.1867 61.8333 72.6275 172.9931 62 G 4.4943 8.8470 112.6805 44.6696 0.0000 172.6721 63 A 4.8430 8.9828 124.5346 50.4117 22.7618 176.4569 64 N 4.5961 8.8115 116.0703 51.9549 40.1332 174.2079 65 D 5.0791 7.6660 118.8699 52.2362 43.2226 176.4960 66 Y 3.7100 8.7070 123.3595 60.5204 38.5083 177.9958 67 A 2.5800 7.8440 122.5205 54.6283 18.4156 179.3867 68 A 3.9943 7.5064 117.3244 54.6721 18.6307 178.1418 69 I 4.1454 7.6284 108.1057 60.3698 38.2703 175.3495 70 E 4.3526 7.6865 123.0549 58.3851 29.6311 176.9530 71 G 3.8797 8.9274 113.2981 45.5890 0.0000 173.3145 72 A 4.0673 7.7845 122.7343 52.5294 18.8487 178.3069 73 D 4.6933 8.8089 122.8662 56.6746 42.2932 176.8796 74 V 4.8661 7.7394 117.0774 60.9624 35.4430 174.3956 75 V 4.8791 8.6885 126.6952 61.1378 34.5761 173.9722 76 I 4.8804 8.8979 128.7213 59.4434 40.3747 174.4935 77 V 4.8110 8.8561 127.8326 61.4576 33.1724 175.5393 78 T 4.6528 9.1349 117.0450 60.9241 70.4080 173.7287 79 A 4.1471 8.3626 124.6795 51.5167 18.9090 177.6884 80 G 4.0295 7.8419 111.6350 45.8108 0.0000 171.6487 81 V 4.4333 8.3057 113.2326 58.6187 34.0642 174.3742 82 P 4.5111 0.0000 0.0000 62.2548 32.3996 177.2755 83 R 4.0492 8.4066 120.3403 57.0247 28.0098 178.4208 84 K 4.0397 8.4778 129.2089 57.1879 32.0319 176.7245 *90 D 4.6663 8.0694 116.1299 53.6252 42.0676 181.2405 91 D 4.5283 7.9244 118.1077 56.7166 39.8659 182.4079 92 L 3.9502 7.8145 119.1179 58.3443 41.6842 179.1733 93 L 3.9074 7.5485 118.8417 58.0565 42.4544 179.7521 94 G 3.6461 7.8602 104.5646 47.6378 0.0000 175.9293 95 I 3.8058 8.2572 122.4815 64.4347 37.2269 178.3506 96 N 4.4155 8.1057 116.7515 56.0472 38.4297 177.1668 97 L 4.1394 8.2438 124.5655 58.6571 42.1983 179.7795 98 K 3.9392 7.8434 122.9991 59.4522 31.4725 181.4538 99 V 3.7767 7.8538 118.8282 66.5341 31.4385 178.0515 100 M 4.0680 8.3406 118.5547 58.2769 31.7206 178.4723 101 E 2.8109 7.7550 119.2807 59.0082 29.7753 178.8147 102 Q 3.8538 7.8164 118.0178 58.9265 28.7604 179.2439 103 V 3.6458 7.5303 120.9097 65.3686 31.5513 178.0038 104 G 3.7651 8.7506 106.2879 48.0086 0.0000 175.3734 105 A 3.9293 7.8014 123.1290 54.6813 18.3952 179.9497 106 G 2.7370 7.2341 104.1045 47.7481 0.0000 176.0400 107 I 3.7115 7.6142 122.4592 63.6649 36.8563 178.3026 108 K 3.7718 7.8409 119.7720 59.4539 32.0799 178.4750 109 K 3.8107 7.5306 118.1188 59.1933 32.4219 177.5782 110 Y 4.6929 7.9826 115.4353 58.0427 40.0546 175.7086 111 A 4.9403 8.3237 122.8639 50.3379 19.1421 175.4642 112 P 4.2701 0.0000 0.0000 65.2349 32.0362 177.6718 113 E 4.3512 8.0505 115.8296 56.1734 29.8132 176.0366 114 A 4.4599 7.7444 121.5097 51.7719 19.5206 177.2636 115 F 4.4983 8.8473 123.6112 57.6900 40.6605 174.4176 116 V 4.5406 8.6686 126.7340 61.0421 33.8652 174.1909 117 I 4.5571 8.4380 128.7547 59.6451 39.8407 173.9054 118 C 4.7287 8.8871 128.7384 58.2768 32.5295 173.9309 119 I 4.3086 8.7144 126.0847 62.1119 39.4142 176.7047 120 T 3.9052 8.0079 118.1644 64.2122 68.8425 172.5927 121 N 5.2405 8.3336 121.6497 50.7013 41.1481 173.4696 122 P 4.4107 0.0000 0.0000 62.3893 32.6411 176.6904 123 L 4.3823 8.5759 126.0039 57.9862 41.8899 178.8138 124 D 4.5874 8.1189 117.7688 56.8910 40.7238 178.3205 125 A 4.3454 7.8560 120.8312 54.9027 18.9792 179.2888 126 M 4.1685 8.3242 117.7843 58.2764 32.0485 179.3217 127 V 3.4384 8.4123 119.8298 64.0637 31.4538 178.3935 128 W 3.7658 7.5387 129.3150 60.0780 30.5233 177.9333 129 A 3.2270 8.1096 120.7642 54.8202 17.8776 179.2234 130 L 3.9684 7.9598 119.1065 58.3662 42.0903 178.9489 131 Q 3.8432 7.7787 119.3133 59.0914 28.7443 178.5843 132 K 3.7129 6.9841 118.2591 59.4097 32.1000 179.0852 133 F 4.4718 7.6117 117.4529 60.5648 38.8474 177.5534 134 S 4.4478 8.1140 113.2605 59.2363 63.1665 175.7612 135 G 3.9099 8.0593 108.7575 45.0544 0.0000 173.7327 136 L 4.1530 7.2466 119.1582 53.6474 42.3545 175.3488 137 P 4.3292 0.0000 0.0000 62.6676 32.1228 177.7938 138 A 4.1047 8.6964 124.9718 55.3346 18.7011 178.8335 139 H 4.6250 8.3656 109.9161 57.1424 29.0803 176.1516 140 K 4.8186 8.3188 119.7261 56.2503 33.5991 175.5445 141 V 4.6685 7.9549 120.0066 61.3363 33.9229 174.8987 142 V 5.0072 8.7514 120.3089 59.7608 36.7247 174.4262 143 G 4.3460 9.0674 108.8474 44.6591 0.0000 172.5023 144 M 4.6720 8.9100 124.7631 55.0738 32.3458 174.6789 145 A 4.7182 8.7391 127.6827 52.8870 23.4745 178.0454 146 G 3.7386 8.2453 102.0397 48.0469 0.0000 175.7474 147 V 3.7928 7.7837 119.9035 65.4850 31.5792 177.8575 148 L 3.9363 7.8752 119.7789 58.3309 42.0698 178.6286 149 D 4.4385 8.1668 118.3835 57.5080 40.8236 178.6295 150 S 4.2388 8.7854 113.7981 61.2667 62.3770 176.1320 151 A 4.0142 8.3304 123.7410 55.1131 18.0968 179.8368 152 R 3.4786 8.0012 116.5548 59.2503 30.1455 179.0034 153 F 4.5627 8.2457 120.3429 61.6558 39.2754 177.4221 154 R 3.9129 8.1917 117.6804 59.0640 29.8430 178.2684 155 Y 4.0480 8.0430 119.3858 60.8208 38.8430 178.0283 156 F 4.3003 8.0115 118.9692 60.9800 39.0825 177.8378 157 L 3.9903 8.3401 118.5253 57.3979 41.2931 179.5425 158 S 4.2455 8.4216 114.9314 61.5152 62.5683 176.5870 159 E 3.8364 7.6441 121.2788 58.9948 29.2712 178.4608 160 E 3.8847 7.6067 118.1387 58.8930 29.7658 178.1226 161 F 4.7406 7.8172 114.4650 56.3485 40.5538 174.9209 162 N 4.1484 7.6361 117.0024 55.0522 37.5109 172.7151 163 V 4.5694 7.2408 108.9525 58.8523 36.1282 176.0605 164 S 4.2103 8.4963 115.2821 58.6445 62.6897 175.3939 165 V 3.6901 8.7269 120.1367 64.8644 31.4215 178.0042 166 E 4.1744 8.4091 117.5197 58.2290 29.5322 176.9060 167 D 4.8334 8.2216 118.0428 54.0019 42.4141 175.8168 168 V 4.6282 7.5429 120.0783 61.9502 32.7454 175.1557 169 T 4.7474 8.9025 124.5823 61.8899 71.3731 173.6719 170 V 4.7616 8.3540 117.4974 59.4297 36.1763 174.6800 171 F 4.8501 8.9937 123.1915 56.5965 42.1429 173.8744 172 V 5.1401 8.2567 124.7790 60.1949 34.5939 174.2776 173 L 4.7074 8.8487 122.1639 53.6795 46.1629 176.6039 174 G 3.9480 9.4384 106.3599 45.8110 0.0000 170.7351 175 G 4.5305 7.7432 109.5973 44.2064 0.0000 171.9235 176 H 5.0687 8.4605 118.2523 55.2131 31.5991 175.9595 177 G 4.1364 8.3475 108.2008 46.6723 0.0000 176.4837 178 D 4.5019 8.7839 122.6115 56.2446 41.0288 176.9698 179 S 4.3861 7.9958 113.3719 58.8904 63.6808 173.6093 180 M 4.6355 7.6097 121.5772 55.2043 33.0722 176.2304 181 V 4.6290 8.7914 125.3389 60.4209 32.9435 171.9172 182 P 5.2035 0.0000 0.0000 61.9207 33.1520 175.9992 183 L 4.6416 9.0487 122.6056 53.0594 43.0378 177.1778 184 A 4.2270 8.6576 128.6061 54.4949 18.7967 179.4323 185 R 4.0735 7.8408 111.0568 58.4218 29.8328 176.6985 186 Y 5.0499 7.6135 115.3145 57.8018 39.0199 175.3612 187 S 5.1721 8.0440 116.1593 57.1058 65.8003 173.4228 188 T 5.0885 9.0792 113.3352 60.3352 73.1331 172.6574 189 V 4.5350 8.4152 121.8959 61.2380 33.5661 175.2739 190 A 3.4736 10.0248 131.7447 53.1232 16.5508 177.9939 191 G 3.9392 8.5440 108.8746 46.7381 0.0000 174.5390 192 I 3.9918 7.4584 122.0399 59.6132 37.8663 173.8869 193 P 4.8823 0.0000 0.0000 62.2070 33.4267 176.9532 194 L 3.9534 8.4754 120.2628 58.1859 41.6538 178.5473 195 P 4.2757 0.0000 0.0000 65.3698 31.3398 178.3774 196 D 4.3625 7.9572 117.5084 56.9345 40.8024 178.5449 197 L 3.5166 7.6542 119.8785 57.3361 41.6029 179.4377 198 V 3.9201 8.1997 120.9768 66.8403 31.2652 178.9733 199 K 4.0757 7.8040 121.8822 59.9078 31.6117 180.2446 200 M 4.5067 7.8198 117.2376 56.4317 31.9660 177.4687 201 G 4.1259 7.8544 107.1738 45.2231 0.0000 174.6261 202 W 4.4794 8.3476 120.6516 59.2642 29.3087 175.5584 203 T 4.6083 7.8452 110.4250 60.4066 69.7429 172.1953 204 S 4.9258 8.2303 116.3555 56.2365 66.9231 174.4161 205 Q 4.0211 8.5562 122.7723 59.6216 28.7270 178.3480 206 D 4.4274 8.0484 119.4429 57.2918 40.9211 178.7106 207 K 4.0426 8.1046 118.9404 58.9981 31.9209 179.3009 208 L 4.0112 7.9673 120.9144 58.2254 42.0392 178.5515 209 D 4.4356 8.6978 121.7902 58.0930 40.6979 179.7388 210 K 3.9654 8.0448 124.0245 59.7302 31.6577 181.2261 211 I 3.7712 7.7445 121.0369 64.1946 37.0727 178.4474 212 I 3.1890 7.9311 120.9947 64.3978 36.9513 178.2263 213 Q 3.8877 8.1040 120.2079 59.2197 28.6583 178.2528 214 R 3.8408 8.0222 119.0178 59.6232 30.3703 178.3670 215 T 4.3078 8.1203 115.7720 66.6897 68.5328 176.8927 216 R 3.9838 7.9116 119.9888 58.8800 30.1066 177.8633 217 D 4.9077 8.0950 116.4508 54.1405 41.0730 178.3765 218 G 4.0016 7.9893 108.6894 47.9634 0.0000 176.1674 219 G 3.6145 8.0973 107.1438 47.6953 0.0000 175.5570 220 A 4.0685 7.9537 123.0832 54.3477 18.3037 178.9777 221 E 3.8694 8.6442 118.5135 59.6485 29.6208 179.1634 222 I 3.6914 7.5553 119.1046 64.5195 37.1635 178.3839 223 V 4.0011 7.3099 120.4652 65.5174 31.0191 178.2814 224 G 3.6094 8.0954 104.3620 47.4921 0.0000 175.3901 225 L 4.2435 7.3983 120.2605 57.6057 42.0158 179.0664 226 L 4.0911 8.0601 117.9240 55.8599 41.6413 178.0505 227 K 4.4475 8.3714 121.1942 56.6481 31.4477 177.0610 228 T 4.4471 7.3957 104.5854 60.6223 69.2429 174.2064 229 G 3.9605 6.9800 109.7062 46.0731 0.0000 171.8155 230 S 4.7214 8.5218 113.2890 55.5072 66.1569 173.0645 231 A 4.1385 8.5679 122.8369 52.9398 18.5051 177.4083 232 F 4.8853 7.9851 112.7901 56.5597 40.3663 176.9728 233 Y 3.9785 7.3803 118.7323 61.0678 37.7997 177.8344 234 A 4.0047 7.9173 121.1906 54.5435 18.5659 177.7142 235 P 4.2050 0.0000 0.0000 65.5506 31.5061 178.5999 236 A 3.9681 8.0904 119.3167 55.2697 18.5016 179.4929 237 A 4.0102 8.3366 119.5404 55.4263 17.8739 180.0579 238 S 4.0879 8.2759 113.3884 61.8104 62.9658 176.8518 239 A 4.0889 8.0691 123.4392 55.1460 17.9947 179.7938 240 I 3.7451 7.9714 118.5540 64.3833 37.1499 178.3199 241 Q 3.9861 8.0585 120.1645 59.5313 29.0118 178.3412 242 M 4.1792 7.8812 118.6045 58.4753 31.9742 178.6437 243 A 4.3171 8.2320 120.9102 55.2116 18.4419 179.6420 244 E 3.9744 8.5036 117.4293 59.5783 29.5751 179.1859 245 S 4.0732 8.2419 113.2342 61.6583 62.3289 175.6616 246 Y 3.9729 7.9489 121.4837 60.8322 38.4031 178.0604 247 L 4.0432 8.4438 119.0910 56.7798 41.8311 178.6606 248 K 4.3058 8.0793 115.7896 54.6690 33.6085 175.2381 249 D 4.3490 7.5543 117.5192 55.2157 39.9397 174.4789 250 K 4.0364 8.2488 119.1055 57.5157 32.7193 178.0816 251 K 3.9579 7.6932 116.0394 57.3950 29.9230 176.2045 252 R 4.1210 7.6771 116.8495 56.2046 31.6281 177.2107 253 V 4.4778 8.3128 123.0151 62.4900 32.0283 175.0967 254 L 4.9786 8.9552 128.5822 52.0876 45.6970 174.1995 255 P 4.9871 0.0000 0.0000 62.7254 32.0843 175.7822 256 V 4.6610 8.7969 116.6371 59.3947 37.1186 174.1528 257 A 4.7497 8.9914 124.4920 51.6611 19.3527 176.5984 258 A 4.8855 9.0219 124.1574 49.8506 23.0736 174.9247 259 Q 3.6365 7.5453 121.5446 56.4839 29.6289 176.1021 260 L 4.7138 8.8817 127.3093 53.5163 43.7436 177.1182 261 S 4.8649 9.2001 114.8612 55.9722 63.4558 172.4974 262 G 3.6033 9.0020 117.1292 46.6017 0.0000 173.2859 263 Q 4.3040 8.0689 119.6114 57.2892 29.4867 176.1514 264 Y 3.3124 9.5734 117.6367 58.4940 36.3414 171.1113 265 G 4.1050 8.2483 106.5778 46.4243 0.0000 173.9253 266 V 4.5717 7.9614 118.1718 60.4887 34.3153 174.5804 267 K 4.9766 8.0818 123.9793 55.5457 35.7135 175.0052 268 D 4.5185 8.4024 117.8547 54.8325 40.2872 173.1472 269 M 5.0517 7.5764 114.3664 54.4034 36.0762 172.8050 270 Y 4.5720 8.9856 123.2604 57.7743 39.0209 175.0923 271 V 4.4364 8.6366 123.2499 60.8841 36.0368 174.2458 272 G 4.2795 8.5173 113.9028 45.9162 0.0000 172.8512 273 V 5.0551 8.9330 118.5399 58.7737 37.1320 172.6721 274 P 4.8579 0.0000 0.0000 63.3629 32.2618 175.4113 275 T 5.1617 9.1489 113.1956 60.0438 73.2376 172.4818 276 V 4.7034 8.6525 122.4714 61.4687 33.5887 174.2836 277 I 4.8720 8.5817 129.1933 59.9550 39.3278 175.4467 278 G 4.1260 8.4519 115.3119 44.5643 0.0000 172.4111 279 A 3.3638 8.5930 121.7574 54.0626 18.3396 178.4145 280 N 4.9023 8.8614 112.8471 52.7948 39.9502 175.8388 281 G 3.7078 7.9565 108.1236 45.0064 0.0000 176.4997 282 V 3.7667 9.1040 129.1677 63.0822 30.4330 174.8869 283 E 4.3921 8.9916 128.5985 58.0363 30.5052 177.0291 284 R 4.5843 7.6923 117.4646 55.2663 33.6902 173.3648 285 I 4.8423 8.3531 126.1958 59.7254 38.9229 175.3393 286 I 4.2895 8.7609 128.9137 60.5802 38.3471 175.3225 287 E 4.8291 8.9230 124.7597 53.1186 32.0740 174.7679 288 I 4.7594 8.3416 118.2958 58.8251 40.8411 174.5861 289 D 4.6143 8.5474 121.1558 53.9245 41.5443 175.9226 290 L 4.8441 8.1365 122.7612 52.5995 43.9892 176.8718 291 D 4.6689 8.7453 126.1788 53.2426 41.3772 178.1667 292 K 3.8652 8.5952 123.7755 60.2900 31.3434 177.2256 293 D 4.5019 8.1004 119.5192 57.2136 40.8843 178.2188 294 E 3.9777 8.6074 119.3047 59.7635 29.5734 179.7267 295 K 4.0100 8.8498 119.2972 59.0982 32.1849 178.6892 296 A 4.0156 8.3336 121.5942 55.2561 18.3803 179.5779 297 Q 3.9270 8.4307 116.8205 59.0199 28.7346 178.7057 298 F 3.9562 8.5161 121.8301 61.5342 39.4339 176.7858 299 D 4.4793 9.0086 121.1029 57.9200 40.5518 179.5408 300 K 3.8893 8.0035 124.0670 59.8703 31.6244 180.6048 301 S 4.1455 7.8105 114.4763 61.2173 62.3174 176.0870 302 V 3.3583 7.6625 120.7703 66.1530 31.0239 177.8919 303 A 3.8915 8.3712 120.4230 55.2277 18.2879 179.3543 304 S 3.9604 8.2373 112.0399 61.7096 62.3441 176.6700 305 V 3.5084 8.1519 120.9084 65.3603 31.1621 177.5237 306 A 3.8545 8.3079 121.4072 55.3134 18.1540 179.8287 307 G 3.4974 8.2508 104.0396 47.9860 0.0000 175.7236 308 L 3.9717 7.8170 121.6926 57.7070 41.6309 179.5616 309 C 3.7201 8.1972 116.9228 62.4709 27.8898 175.7961 310 E 3.9098 8.2785 120.3260 59.3993 29.0817 179.1997 311 A 3.9880 7.9546 120.4519 55.6119 18.4933 179.2908 312 C 4.1218 8.1371 115.0333 63.3041 28.0852 176.5425 313 I 4.1341 8.1591 121.3624 64.1911 36.4259 178.4913 314 G 3.7490 7.8689 105.7579 48.1940 0.0000 175.4930 315 I 4.1747 7.7046 121.0958 62.3232 38.3485 176.2632 316 A 4.6574 8.6154 123.5138 49.1513 19.3435 174.3306 317 P 4.7522 0.0000 0.0000 64.7972 31.7940 178.8553 318 S 4.2861 8.1582 111.5021 60.1348 62.7681 174.8203 319 L 4.0018 7.7521 122.3221 55.8412 42.0235 177.4796 320 K 4.1481 7.9575 125.1672 55.1055 31.5304 181.7758 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 2 A 8.26 4.32 1.28 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 0.00 0.00 3 R 8.47 3.95 0.00 1.89 1.88 0.00 3.50 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 4 N 8.71 4.83 0.00 2.91 2.78 0.00 0.00 6.28 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 5 K 9.11 4.95 0.00 1.80 1.62 0.00 1.57 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.35 7.81 6 I 8.91 4.99 1.84 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 1.30 1.11 0.92 0.00 0.00 7 A 9.04 5.03 1.21 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 0.00 0.00 8 L 9.20 4.89 0.00 1.64 1.64 1.01 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.58 4.47 1.93 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.94 1.05 0.00 0.00 10 G 9.19 4.47 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 0.00 11 S 9.36 4.60 0.00 3.71 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 12 G 7.80 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.32 3.64 0.00 0.70 1.71 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 14 I 7.61 3.89 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.61 0.94 0.00 0.00 15 G 7.60 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.26 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.66 4.01 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 18 L 8.55 4.00 0.00 1.85 1.77 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.12 4.13 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 H 8.41 4.24 0.00 3.40 3.50 0.00 5.61 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 21 L 8.43 3.93 0.00 1.91 1.71 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.38 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.33 3.24 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 0.00 0.00 0.00 0.00 24 L 7.46 3.66 0.00 1.48 1.69 0.63 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.66 4.29 0.00 1.80 1.81 0.00 1.96 0.00 0.00 1.90 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.47 7.81 26 E 7.94 3.78 0.00 2.12 2.06 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 2.33 2.28 0.00 27 L 8.04 4.13 0.00 1.63 1.74 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.69 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.24 4.55 0.00 2.56 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.30 4.70 1.29 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 0.96 0.00 0.00 0.72 0.00 0.00 31 V 9.28 4.79 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.95 0.00 0.00 32 L 9.33 4.99 0.00 1.78 1.59 1.05 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 33 F 9.21 5.25 0.00 2.99 2.86 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 0.00 0.00 0.00 34 D 7.31 4.61 0.00 2.65 2.19 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 35 I 8.09 3.57 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.64 0.89 0.00 0.00 36 A 8.28 4.02 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 E 8.46 4.21 0.00 1.91 1.84 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 2.36 2.23 0.00 38 G 9.10 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 7.14 3.79 4.16 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 1.15 0.00 0.00 40 P 0.00 4.28 0.00 2.35 2.23 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.84 0.00 41 Q 8.03 4.11 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.96 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 42 G 8.46 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.21 4.07 0.00 1.81 1.86 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.54 7.81 44 G 8.16 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.02 3.96 0.00 1.88 1.80 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 46 D 7.92 4.24 0.00 2.80 2.80 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 47 I 7.84 3.66 1.32 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.86 0.32 0.00 0.00 48 A 7.92 3.83 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 3.98 0.00 2.02 1.98 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 2.31 2.39 0.00 50 S 7.79 4.31 0.00 4.08 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 0.00 51 S 7.69 2.79 0.00 3.07 3.45 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 0.00 0.00 0.00 52 P 0.00 4.12 0.00 1.96 2.08 0.00 3.62 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.04 0.00 53 V 7.36 3.68 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.90 0.00 0.00 54 D 7.99 4.69 0.00 2.95 2.88 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 55 G 8.02 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 56 F 7.66 4.61 0.00 3.13 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 57 D 8.73 4.90 0.00 2.74 2.70 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 0.00 0.00 0.00 0.00 58 A 8.37 4.86 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.88 4.37 0.00 1.71 1.75 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.53 7.81 60 F 9.00 5.05 0.00 2.99 3.13 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 61 T 8.83 4.69 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 1.22 0.00 0.00 62 G 8.85 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 0.00 0.00 0.00 0.00 63 A 8.98 4.84 1.29 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 0.00 0.00 64 N 8.81 4.60 0.00 2.58 2.64 0.00 0.00 7.05 8.06 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 65 D 7.67 5.08 0.00 2.66 2.49 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 0.00 66 Y 8.71 3.71 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.84 2.58 1.07 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 0.00 0.00 68 A 7.51 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 I 7.63 4.15 1.87 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 1.46 0.77 0.83 0.00 0.00 70 E 7.69 4.35 0.00 2.09 1.93 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 2.39 2.55 0.00 71 G 8.93 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 0.00 0.00 0.00 72 A 7.78 4.07 1.38 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 0.00 0.00 0.00 73 D 8.81 4.69 0.00 2.75 2.91 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 0.00 0.00 0.00 74 V 7.74 4.87 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 1.06 0.00 0.00 1.06 0.00 0.00 75 V 8.69 4.88 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.91 0.00 0.00 76 I 8.90 4.88 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.55 0.92 0.00 0.00 77 V 8.86 4.81 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.91 0.00 0.00 78 T 9.13 4.65 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 1.22 0.00 0.00 79 A 8.36 4.15 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.84 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.31 4.43 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 0.99 0.00 0.00 82 P 0.00 4.51 0.00 2.17 2.03 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 83 R 8.41 4.05 0.00 1.85 1.83 0.00 3.27 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 84 K 8.48 4.04 0.00 1.77 1.76 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.00 7.81 *90 D 8.07 4.67 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 7.92 4.53 0.00 2.60 2.70 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 0.00 0.00 0.00 0.00 92 L 7.81 3.95 0.00 1.75 1.62 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 93 L 7.55 3.91 0.00 1.82 1.85 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 94 G 7.86 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.26 3.81 1.97 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 1.53 0.78 0.92 0.00 0.00 96 N 8.11 4.42 0.00 2.76 2.90 0.00 0.00 6.70 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.24 4.14 0.00 1.97 1.79 1.18 0.56 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 98 K 7.84 3.94 0.00 1.83 1.81 0.00 1.87 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.32 7.81 99 V 7.85 3.78 2.31 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 1.08 0.00 0.00 1.02 0.00 0.00 100 M 8.34 4.07 0.00 2.25 2.45 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.94 0.00 101 E 7.75 2.81 0.00 1.42 1.71 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 1.79 1.47 0.00 102 Q 7.82 3.85 0.00 2.39 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 103 V 7.53 3.65 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 1.27 0.00 0.00 1.13 0.00 0.00 104 G 8.75 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.80 3.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.23 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 7.61 3.71 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.64 0.91 0.00 0.00 108 K 7.84 3.77 0.00 1.85 1.91 0.00 1.87 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.38 7.81 109 K 7.53 3.81 0.00 1.45 1.20 0.00 1.48 0.00 0.00 1.01 0.00 0.00 2.60 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.30 0.93 7.81 110 Y 7.98 4.69 0.00 3.17 2.89 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 0.00 0.00 0.00 111 A 8.32 4.94 1.23 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 0.00 0.00 112 P 0.00 4.27 0.00 2.18 2.30 0.00 3.86 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 113 E 8.05 4.35 0.00 2.02 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 2.29 2.27 0.00 114 A 7.74 4.46 1.27 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 0.00 0.00 115 F 8.85 4.50 0.00 1.51 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.67 4.54 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 0.78 0.00 0.00 0.83 0.00 0.00 117 I 8.44 4.56 1.72 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 0.78 -0.00 0.84 0.00 0.00 118 C 8.89 4.73 0.00 2.89 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 0.00 119 I 8.71 4.31 1.97 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 1.24 0.76 0.93 0.00 0.00 120 T 8.01 3.91 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 1.31 0.00 0.00 121 N 8.33 5.24 0.00 2.71 2.73 0.00 0.00 7.01 8.02 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 0.00 122 P 0.00 4.41 0.00 2.25 2.19 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 123 L 8.58 4.38 0.00 1.88 1.69 0.93 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.12 4.59 0.00 2.69 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 0.00 125 A 7.86 4.35 1.29 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 0.00 0.00 126 M 8.32 4.17 0.00 2.05 2.27 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.89 0.00 127 V 8.41 3.44 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 0.43 0.00 0.00 0.54 0.00 0.00 128 W 7.54 3.77 0.00 3.60 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.11 3.23 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 7.96 3.97 0.00 1.86 1.71 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 7.78 3.84 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.69 0.00 132 K 6.98 3.71 0.00 1.01 1.34 0.00 0.61 0.00 0.00 0.93 0.00 0.00 2.42 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.07 0.95 7.81 133 F 7.61 4.47 0.00 2.90 2.91 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 0.00 0.00 0.00 134 S 8.11 4.45 0.00 3.98 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 8.06 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 136 L 7.25 4.15 0.00 1.56 1.60 0.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 137 P 0.00 4.33 0.00 2.09 2.04 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 138 A 8.70 4.10 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 8.37 4.63 0.00 3.63 3.60 0.00 5.62 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.32 4.82 0.00 1.80 2.05 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.03 1.43 7.81 141 V 7.95 4.67 2.16 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 0.65 0.00 0.00 0.95 0.00 0.00 142 V 8.75 5.01 2.27 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 0.90 0.00 0.00 0.86 0.00 0.00 143 G 9.07 4.35 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 0.00 144 M 8.91 4.67 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.67 0.00 145 A 8.74 4.72 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 0.00 146 G 8.25 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 V 7.78 3.79 2.12 0.00 0.00 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 0.00 148 L 7.88 3.94 0.00 1.87 1.92 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 149 D 8.17 4.44 0.00 2.95 2.80 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 0.00 150 S 8.79 4.24 0.00 3.88 4.13 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 0.00 151 A 8.33 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 R 8.00 3.48 0.00 1.96 1.62 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.78 0.00 153 F 8.25 4.56 0.00 3.21 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 8.19 3.91 0.00 1.94 1.97 0.00 3.19 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 155 Y 8.04 4.05 0.00 3.02 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 F 8.01 4.30 0.00 3.31 2.98 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 0.00 157 L 8.34 3.99 0.00 1.77 1.90 0.67 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.42 4.25 0.00 4.27 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 0.00 159 E 7.64 3.84 0.00 1.99 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 2.13 1.72 0.00 160 E 7.61 3.88 0.00 1.78 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.52 0.00 161 F 7.82 4.74 0.00 3.19 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 0.00 162 N 7.64 4.15 0.00 2.69 2.75 0.00 0.00 6.92 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 V 7.24 4.57 2.16 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 0.87 0.00 0.00 1.10 0.00 0.00 164 S 8.50 4.21 0.00 3.88 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 0.00 165 V 8.73 3.69 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.98 0.00 0.00 166 E 8.41 4.17 0.00 1.97 2.02 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 2.37 2.30 0.00 167 D 8.22 4.83 0.00 2.64 2.70 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 0.00 0.00 0.00 0.00 168 V 7.54 4.63 2.11 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 0.80 0.00 0.00 1.04 0.00 0.00 169 T 8.90 4.75 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 170 V 8.35 4.76 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 1.01 0.00 0.00 171 F 8.99 4.85 0.00 3.53 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 0.00 172 V 8.26 5.14 2.24 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 0.85 0.00 0.00 1.09 0.00 0.00 173 L 8.85 4.71 0.00 1.78 1.82 1.22 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 174 G 9.44 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 G 7.74 4.53 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 0.00 0.00 0.00 176 H 8.46 5.07 0.00 3.22 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 G 8.35 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.78 4.50 0.00 2.67 2.73 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 0.00 0.00 0.00 0.00 179 S 8.00 4.39 0.00 3.95 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 0.00 180 M 7.61 4.64 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.37 0.00 181 V 8.79 4.63 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 1.04 0.00 0.00 1.04 0.00 0.00 182 P 0.00 5.20 0.00 2.32 2.14 0.00 3.81 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 183 L 9.05 4.64 0.00 1.75 1.38 1.06 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 184 A 8.66 4.23 1.38 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 0.00 0.00 0.00 185 R 7.84 4.07 0.00 1.78 1.94 0.00 2.69 0.00 0.00 3.01 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.64 0.00 186 Y 7.61 5.05 0.00 2.58 2.70 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 0.00 0.00 0.00 0.00 187 S 8.04 5.17 0.00 3.92 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 T 9.08 5.09 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 189 V 8.42 4.53 1.82 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 1.02 0.00 0.00 0.88 0.00 0.00 190 A 10.02 3.47 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.54 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 I 7.46 3.99 1.54 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.42 0.63 0.00 0.00 193 P 0.00 4.88 0.00 2.25 2.18 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 194 L 8.48 3.95 0.00 1.90 1.91 1.04 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 195 P 0.00 4.28 0.00 2.14 2.09 0.00 3.54 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 2.18 0.00 196 D 7.96 4.36 0.00 2.78 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 L 7.65 3.52 0.00 1.76 1.42 0.28 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 198 V 8.20 3.92 2.27 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 1.06 0.00 0.00 1.08 0.00 0.00 199 K 7.80 4.08 0.00 1.92 1.72 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.35 7.81 200 M 7.82 4.51 0.00 1.87 1.76 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.43 0.00 201 G 7.85 4.13 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 0.00 202 W 8.35 4.48 0.00 3.41 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 T 7.85 4.61 4.41 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 1.48 0.00 0.00 204 S 8.23 4.93 0.00 4.08 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 0.00 205 Q 8.56 4.02 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 206 D 8.05 4.43 0.00 2.73 2.70 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 0.00 0.00 0.00 0.00 207 K 8.10 4.04 0.00 1.84 1.82 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.44 7.81 208 L 7.97 4.01 0.00 1.87 1.93 1.15 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 209 D 8.70 4.44 0.00 2.84 2.70 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 0.00 0.00 0.00 0.00 210 K 8.04 3.97 0.00 1.78 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 211 I 7.74 3.77 2.09 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.49 1.27 0.00 0.00 212 I 7.93 3.19 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.78 0.79 0.00 0.00 213 Q 8.10 3.89 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 214 R 8.02 3.84 0.00 1.67 1.63 0.00 2.77 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.42 0.00 215 T 8.12 4.31 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 1.28 0.00 0.00 216 R 7.91 3.98 0.00 2.02 2.03 0.00 3.08 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.80 0.00 217 D 8.10 4.91 0.00 2.69 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 G 7.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 G 8.10 3.61 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 0.00 0.00 0.00 220 A 7.95 4.07 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 E 8.64 3.87 0.00 2.03 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 222 I 7.56 3.69 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.84 0.94 0.00 0.00 223 V 7.31 4.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.95 0.00 0.00 224 G 8.10 3.61 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 0.00 0.00 0.00 225 L 7.40 4.24 0.00 1.75 1.75 0.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 226 L 8.06 4.09 0.00 1.65 1.79 1.07 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 227 K 8.37 4.45 0.00 1.94 2.03 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.50 7.81 228 T 7.40 4.45 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 1.22 0.00 0.00 229 G 6.98 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 S 8.52 4.72 0.00 3.97 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 0.00 231 A 8.57 4.14 1.27 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 0.00 0.00 232 F 7.99 4.89 0.00 3.01 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 0.00 233 Y 7.38 3.98 0.00 2.85 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 A 7.92 4.00 1.28 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 0.00 0.00 235 P 0.00 4.21 0.00 2.21 2.14 0.00 3.69 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 236 A 8.09 3.97 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 0.00 0.00 0.00 0.00 0.00 237 A 8.34 4.01 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 238 S 8.28 4.09 0.00 4.10 3.96 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 0.00 0.00 0.00 0.00 239 A 8.07 4.09 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.97 3.75 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.91 0.94 0.00 0.00 241 Q 8.06 3.99 0.00 2.19 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 242 M 7.88 4.18 0.00 2.33 2.36 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.65 0.00 243 A 8.23 4.32 1.49 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 0.00 0.00 0.00 244 E 8.50 3.97 0.00 2.21 2.04 0.00 0.00 0.00 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 2.44 0.00 245 S 8.24 4.07 0.00 3.94 3.93 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 0.00 246 Y 7.95 3.97 0.00 2.64 3.15 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 0.00 247 L 8.44 4.04 0.00 1.69 1.76 1.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 248 K 8.08 4.31 0.00 1.78 1.80 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.41 7.81 249 D 7.55 4.35 0.00 2.60 2.59 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 0.00 0.00 0.00 250 K 8.25 4.04 0.00 1.78 1.85 0.00 1.89 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.40 7.81 251 K 7.69 3.96 0.00 1.88 1.90 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.51 7.81 252 R 7.68 4.12 0.00 1.80 1.86 0.00 3.28 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 253 V 8.31 4.48 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 0.94 0.00 0.00 254 L 8.96 4.98 0.00 1.62 1.52 0.98 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 255 P 0.00 4.99 0.00 2.06 2.09 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 256 V 8.80 4.66 2.30 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 0.82 0.00 0.00 1.04 0.00 0.00 257 A 8.99 4.75 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 A 9.02 4.89 1.21 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 0.00 0.00 259 Q 7.55 3.64 0.00 1.53 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 260 L 8.88 4.71 0.00 1.76 1.71 1.28 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 261 S 9.20 4.86 0.00 3.91 3.84 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 0.00 262 G 9.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 263 Q 8.07 4.30 0.00 2.26 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.18 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 264 Y 9.57 3.31 0.00 3.27 2.66 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 0.00 0.00 0.00 0.00 265 G 8.25 4.11 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 0.00 0.00 0.00 266 V 7.96 4.57 2.27 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 0.99 0.00 0.00 1.16 0.00 0.00 267 K 8.08 4.98 0.00 1.77 1.69 0.00 1.98 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.41 7.81 268 D 8.40 4.52 0.00 2.86 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 269 M 7.58 5.05 0.00 2.11 1.82 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.52 0.00 270 Y 8.99 4.57 0.00 3.15 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 V 8.64 4.44 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 0.73 0.00 0.00 0.87 0.00 0.00 272 G 8.52 4.28 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 0.00 0.00 0.00 273 V 8.93 5.06 2.27 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 0.82 0.00 0.00 1.03 0.00 0.00 274 P 0.00 4.86 0.00 2.13 1.90 0.00 3.79 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.08 0.00 275 T 9.15 5.16 4.40 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 0.00 0.00 0.00 1.35 0.00 0.00 276 V 8.65 4.70 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.94 0.00 0.00 277 I 8.58 4.87 1.91 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.62 0.94 0.00 0.00 278 G 8.45 4.13 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 0.00 279 A 8.59 3.36 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 280 N 8.86 4.90 0.00 2.77 2.87 0.00 0.00 7.12 7.53 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 0.00 281 G 7.96 3.71 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 0.00 0.00 0.00 282 V 9.10 3.77 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 0.83 0.00 0.00 1.15 0.00 0.00 283 E 8.99 4.39 0.00 2.01 1.98 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 2.30 2.47 0.00 284 R 7.69 4.58 0.00 1.85 1.72 0.00 3.14 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 285 I 8.35 4.84 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.80 1.05 0.00 0.00 286 I 8.76 4.29 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.53 1.05 0.00 0.00 287 E 8.92 4.83 0.00 1.62 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.47 0.00 288 I 8.34 4.76 2.07 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.10 1.01 0.00 0.00 289 D 8.55 4.61 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 290 L 8.14 4.84 0.00 1.58 1.54 0.60 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 291 D 8.75 4.67 0.00 2.95 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 292 K 8.60 3.87 0.00 1.78 1.89 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.13 7.81 293 D 8.10 4.50 0.00 2.82 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 294 E 8.61 3.98 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 295 K 8.85 4.01 0.00 1.86 1.92 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.46 1.69 7.81 296 A 8.33 4.02 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 0.00 0.00 0.00 0.00 0.00 297 Q 8.43 3.93 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.66 0.00 298 F 8.52 3.96 0.00 3.21 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 299 D 9.01 4.48 0.00 2.92 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 300 K 8.00 3.89 0.00 1.78 1.83 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.33 7.81 301 S 7.81 4.15 0.00 3.79 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 302 V 7.66 3.36 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.55 0.00 0.00 303 A 8.37 3.89 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 304 S 8.24 3.96 0.00 3.90 3.96 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 0.00 0.00 0.00 0.00 305 V 8.15 3.51 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.93 0.00 0.00 306 A 8.31 3.85 1.28 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 0.00 0.00 307 G 8.25 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 0.00 0.00 0.00 308 L 7.82 3.97 0.00 1.79 1.64 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 309 C 8.20 3.72 0.00 2.56 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 310 E 8.28 3.91 0.00 2.07 1.98 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 2.45 2.44 0.00 311 A 7.95 3.99 1.36 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 0.00 0.00 312 C 8.14 4.12 0.00 3.39 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 0.00 313 I 8.16 4.13 2.10 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.98 0.00 0.00 314 G 7.87 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 315 I 7.70 4.17 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 1.49 0.61 0.96 0.00 0.00 316 A 8.62 4.66 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 317 P 0.00 4.75 0.00 2.22 2.15 0.00 3.93 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 318 S 8.16 4.29 0.00 4.02 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 319 L 7.75 4.00 0.00 1.73 1.54 0.95 -0.51 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 0.00 320 K 7.96 4.15 0.00 1.77 1.63 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.40 1.30 7.81 * Residues marked with a * may have inaccurate shift predictions.