NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 V 4.2125 8.0393 114.0845 60.0379 33.2961 174.6809 25 P 4.1156 0.0000 0.0000 62.9060 31.4392 174.8971 26 N 5.2868 9.1814 120.6423 52.9162 40.0943 175.8002 27 E 4.2404 7.9776 117.4531 54.8266 30.5595 175.3756 28 P 4.4399 0.0000 0.0000 63.4011 32.2059 175.9031 29 I 4.4281 8.6093 123.8257 59.5099 41.5446 173.7303 30 N 5.4228 8.3814 123.3362 50.8823 40.4315 174.4818 31 W 3.9581 9.6070 135.0000 57.6158 31.2004 175.3503 32 G 3.5747 6.0622 114.0616 44.7797 0.0000 171.8084 33 F 4.2181 6.7236 112.2554 55.6111 39.4128 173.5885 34 K 4.0021 8.6586 123.8189 55.9793 32.5284 177.1713 35 R 4.4173 8.4662 125.1218 56.1245 30.7055 176.3254 36 S 4.2688 8.6401 114.4066 58.5540 63.2129 173.7447 37 V 4.3542 7.6711 124.9699 62.2747 34.3634 175.2456 38 N 4.0234 9.4689 120.9374 54.0015 36.0283 173.8572 39 H 4.8614 7.9948 112.0855 57.2812 25.8153 174.4446 40 Q 4.7539 7.7321 117.0940 53.2252 30.7587 174.2668 41 P 4.0138 0.0000 0.0000 61.8194 31.8703 174.9216 42 P 4.6276 0.0000 0.0000 62.3005 32.4071 174.7461 43 D 4.9659 8.3057 116.6854 52.5078 43.6468 175.0942 44 A 3.8603 8.7818 128.6473 52.3735 19.2505 178.0943 45 G 4.0245 9.3662 105.1505 44.7026 0.0000 174.7577 46 K 3.8918 8.9755 122.6874 59.5791 31.8208 178.9326 47 Q 3.9215 7.9475 118.9682 59.3144 29.1695 178.1096 48 L 4.1080 7.7990 119.4940 57.7761 41.7449 178.8356 49 N 4.5334 8.8098 116.8402 56.6147 38.4527 177.5356 50 S 4.1520 8.0881 116.1423 61.6033 62.7742 176.4853 51 L 4.1172 7.5549 121.6049 58.3637 42.1264 178.5272 52 I 3.9986 8.4463 120.0647 64.8889 36.9179 178.0628 53 E 4.0187 8.3554 118.3917 59.4945 29.4585 178.9943 54 K 3.7646 8.0675 118.7061 59.2641 32.3333 175.0415 55 Y 4.8287 7.6543 114.8764 56.1584 41.2044 175.2929 56 D 4.9323 8.5748 119.1505 53.5204 40.3061 174.9837 57 A 5.3900 8.4269 121.6556 51.5126 22.4582 175.0166 58 F 5.1589 7.5992 115.0938 56.0686 41.3862 174.1447 59 Y 4.7042 8.6640 114.5542 56.1551 39.1824 174.9469 60 L 4.8855 7.5291 119.1248 52.5973 45.5385 177.3219 61 G 3.7651 8.9912 109.3736 46.3911 0.0000 175.9071 62 N 4.8438 9.8504 126.7578 52.9846 38.5749 175.9962 63 T 4.3003 8.4136 115.8207 62.6399 69.3786 175.9673 64 K 4.1764 8.0023 121.0758 57.8212 32.4418 176.2661 65 E 4.6434 7.5305 116.0120 53.6571 32.7893 176.8366 66 K 4.1872 8.0970 122.6702 55.8555 30.4361 175.1664 67 T 5.5768 7.5731 118.8817 60.3968 73.0567 173.5405 68 I 4.7703 7.4234 123.7037 59.5275 41.6914 173.8727 69 Y 5.2446 8.8195 122.9455 55.2724 40.8531 174.6845 70 L 4.6881 8.6354 125.2332 54.1214 42.8754 176.1115 71 T 4.8921 8.5095 113.1276 59.8942 72.6679 172.8037 72 F 5.5150 9.2384 120.3023 54.8017 43.5403 173.3774 73 D 5.2407 8.5749 121.2515 52.7032 42.9868 175.5867 74 N 4.4885 9.5571 121.0428 51.6696 40.6601 174.9819 75 G 3.9970 8.5962 113.2214 46.4016 0.0000 171.5696 76 Y 5.0807 7.3445 115.0237 56.1549 40.5607 172.9423 77 E 4.8026 8.8794 121.1195 54.7756 31.4173 174.8324 78 N 4.9851 8.8654 122.7561 53.3226 39.7994 175.0031 79 G 3.7153 8.8090 104.2536 45.0468 0.0000 174.5530 80 Y 4.7811 7.4615 115.4861 58.0667 39.2384 177.3547 81 T 4.0165 8.2084 117.8080 66.2150 68.4786 174.3811 82 P 4.2119 0.0000 0.0000 65.6001 31.3691 178.7951 83 K 4.1645 8.0534 116.8229 59.3651 31.9674 179.4312 84 V 3.6678 7.9249 118.6348 66.0215 31.4534 178.1431 85 L 3.9615 8.2150 119.0188 57.8046 41.3241 179.2176 86 D 4.3699 8.2675 119.0746 57.1872 40.7028 178.9991 87 V 3.5790 8.2487 119.1253 66.0942 31.6459 177.9662 88 L 4.0080 8.1517 118.9162 57.7021 41.4580 179.5685 89 K 3.9137 8.2190 119.4049 59.3070 31.9770 178.4971 90 K 3.8125 7.9620 118.7852 60.0131 32.2073 177.6855 91 H 4.4373 8.1076 112.4113 54.9874 29.3022 174.9433 92 R 3.7920 7.8646 120.1190 57.5805 28.7946 175.5786 93 V 4.4812 8.2152 115.7364 61.3125 33.9810 175.1179 94 T 4.5791 8.6472 124.0513 62.5157 69.3050 174.7614 95 G 4.1197 9.0771 113.9718 45.4820 0.0000 172.1682 96 T 4.9984 8.1939 116.7852 61.7136 71.5798 173.4372 97 F 5.0902 9.3909 127.1909 55.8591 41.0376 175.5931 98 F 4.7142 9.7133 125.4265 56.7991 39.6985 175.5844 99 V 4.9405 8.5801 117.8895 59.8430 34.8567 175.8463 100 T 5.1770 7.6850 113.2299 59.6614 71.3326 176.1403 101 G 2.3902 8.2639 108.1038 47.7236 0.0000 175.4704 102 H 4.0400 7.7602 120.2723 58.7586 29.8982 176.9994 103 F 3.9265 8.0820 122.0403 61.2716 39.0659 177.2934 104 V 3.5718 7.6355 116.5731 66.0275 31.3881 177.8643 105 K 4.1011 7.7912 117.2981 59.1342 31.9757 178.4406 106 D 4.4071 7.8254 117.4092 55.4648 42.7615 176.2289 107 Q 4.4538 7.5985 117.5029 53.1727 29.2158 174.3824 108 P 4.2045 0.0000 0.0000 66.1983 31.6266 178.5044 109 Q 3.9227 7.8860 117.2090 58.6204 28.6127 178.5276 110 L 3.9065 7.6757 119.6277 57.6738 41.7380 179.2645 111 I 3.6859 7.5443 119.4687 64.3231 36.9774 178.3849 112 K 3.9095 8.2281 120.6731 59.4797 32.0148 179.0707 113 R 3.8209 8.1023 118.5681 59.4061 29.9792 178.7403 114 M 3.9164 8.2305 118.8844 58.4664 31.9438 178.8326 115 S 4.0524 7.9605 112.8638 61.7020 62.4811 175.9890 116 D 4.4430 8.6309 120.5395 56.7212 40.4832 177.5963 117 E 4.4985 8.3830 117.7574 55.8361 29.7733 177.0464 118 G 3.8404 7.8162 106.4658 45.6000 0.0000 173.6974 119 H 4.9025 7.7985 116.5977 55.0723 30.6598 174.4357 120 I 4.5278 8.7797 120.5732 59.9653 39.3184 175.1360 121 I 4.7451 9.1083 128.4822 59.9596 38.4045 175.9106 122 G 3.5846 9.0055 115.4976 44.7468 0.0000 171.1824 123 N 5.2903 9.2429 119.0063 52.0429 40.4766 174.3840 124 H 5.4593 9.1930 125.3668 54.7937 31.2602 173.0850 125 S 4.4624 9.0839 112.1554 57.5129 64.3014 171.0169 126 F 3.7918 9.0743 124.1425 61.6771 39.1760 176.5751 127 H 4.7010 9.3084 114.2086 54.9591 29.1683 174.2686 128 H 4.3427 8.2820 117.4764 55.4159 27.8300 171.9827 129 P 4.5528 0.0000 0.0000 61.3417 33.3157 174.8664 130 D 4.5630 8.3271 117.7278 53.1823 40.7030 176.6580 131 L 4.1843 8.5103 128.1847 57.4410 41.8371 179.3436 132 T 4.2931 8.5389 108.4789 63.5009 68.9607 175.1763 133 T 4.4778 7.8486 111.8308 61.1382 69.0277 174.3189 134 K 4.9293 7.7127 120.9857 54.8957 35.1594 176.7131 135 T 4.4012 9.7744 113.5904 61.0311 71.1055 175.6463 136 A 4.0637 8.2024 123.6328 55.6324 18.3922 179.7538 137 D 4.2795 8.1117 115.6671 57.7547 41.3916 178.4668 138 Q 4.0280 7.9632 118.2948 58.9569 28.7064 178.6824 139 I 3.6806 8.3391 121.1820 64.4732 37.0791 178.1266 140 Q 3.9637 8.3488 120.5518 59.4022 28.8620 178.0278 141 D 4.3163 8.0439 118.4802 57.2309 41.2561 177.8816 142 E 4.0761 8.7103 119.6695 59.2945 29.3175 179.2859 143 L 4.0848 7.9034 118.6628 57.4682 41.9971 178.6979 144 D 4.4556 8.4725 118.5975 57.4386 41.2490 178.4239 145 S 4.2852 8.1874 114.7209 61.2776 62.6756 176.8809 146 V 3.8139 7.8241 122.1537 66.1970 31.4047 177.8092 147 N 4.4500 8.2929 115.8159 56.2486 38.4829 176.7914 148 E 4.0232 8.7635 121.2971 59.3253 29.6040 178.5906 149 E 4.0620 8.3428 119.2111 59.1253 29.7733 178.8609 150 V 3.6351 8.1672 118.5508 66.1225 31.6228 177.3646 151 Y 4.0435 8.6768 119.6800 60.5929 38.4294 177.6824 152 K 3.9833 7.9648 119.3170 59.8399 32.2496 178.4136 153 I 3.9149 7.4189 118.8364 63.9143 37.3237 177.5948 154 T 4.3447 8.2920 108.0933 60.5640 69.6060 175.5160 155 G 3.1359 7.7740 109.2682 45.5953 0.0000 172.7745 156 K 4.6620 7.1907 117.3934 54.9333 36.2959 175.6921 157 Q 4.4246 8.1919 118.8567 55.5955 31.1759 173.5753 158 D 4.7038 8.6191 125.5845 53.4606 41.8580 175.7176 159 N 4.2453 8.3922 117.5945 53.4865 39.1368 175.2246 160 L 4.0892 7.8204 120.6742 54.6129 42.5312 175.4487 161 Y 5.5536 8.6232 121.5358 56.0356 41.9399 174.4909 162 L 5.1461 9.6515 125.2882 53.2484 45.6021 174.9824 163 R 4.3508 8.7491 125.9747 53.4749 32.5766 173.0601 164 P 4.3225 0.0000 0.0000 62.1870 32.0726 174.4244 165 P 4.2297 0.0000 0.0000 63.7866 31.6956 177.4436 166 R 3.8991 9.1310 119.5276 56.0857 28.0101 176.9928 167 G 4.3532 8.3338 105.9125 46.1380 0.0000 172.9219 168 V 4.9344 7.6321 120.1225 61.6732 32.7014 175.2548 169 F 5.1362 8.9330 122.4805 57.0719 41.7951 172.5571 170 S 4.5588 8.5117 111.4909 56.9360 65.5049 175.8154 171 E 3.9375 8.8425 119.8823 59.2872 29.2747 177.7753 172 Y 4.0877 8.1444 119.7218 60.7634 38.8361 178.2797 173 V 3.1324 7.6278 118.6040 65.8223 31.6181 177.9369 174 L 3.7863 7.7393 118.6292 57.4854 41.3700 179.4314 175 K 3.7992 7.5927 119.6987 59.4543 32.0588 178.5211 176 E 3.8391 8.2955 120.1843 59.4311 29.4689 178.8604 177 T 3.9463 8.0914 110.2420 64.3918 68.7708 176.6861 178 K 4.2397 8.0462 124.0658 58.9127 32.0623 178.8453 179 R 3.9280 8.0637 117.8805 58.8409 30.0576 177.5155 180 L 4.4328 7.4846 116.4352 54.8285 42.0336 177.4373 181 G 3.8767 8.2817 108.0641 44.9877 0.0000 173.0761 182 Y 4.5203 8.2637 117.9317 56.9413 40.0728 174.3373 183 Q 4.4707 8.7691 124.5812 54.9962 31.0583 174.4541 184 T 4.4002 8.6513 124.6353 62.8276 69.8862 173.9047 185 V 3.6177 8.2521 127.3146 60.9439 32.6903 174.8567 186 F 4.7167 7.8742 131.8658 56.6248 40.9066 174.5696 187 W 5.1678 7.3997 120.0510 56.8739 30.6461 174.1655 188 S 4.0903 9.2812 110.9216 57.5075 64.0573 174.2264 189 V 4.7541 7.9298 120.7369 61.7350 34.4909 173.4302 190 A 4.7800 8.9181 126.9166 51.7342 21.9394 174.7157 191 F 4.7389 7.6545 113.7685 55.6794 40.7002 175.0278 192 V 3.7342 8.4791 120.9774 62.2425 29.5131 174.6994 193 D 5.0733 8.2177 128.9416 52.5049 39.8732 176.6481 194 W 4.9087 7.3291 113.0682 56.6156 29.6048 174.8337 195 K 4.2365 7.1875 120.0359 55.3148 31.1062 177.4107 196 I 3.8513 8.3756 126.4480 63.9516 37.2759 177.2831 197 N 4.5984 8.0345 115.2599 54.0481 38.0784 175.0846 198 N 4.8205 7.4851 117.1779 52.7505 39.2330 174.5446 199 Q 4.2317 7.7167 118.9296 54.5437 28.2083 177.3375 200 K 3.7952 8.1503 123.1883 57.5406 32.4215 177.3238 201 G 3.8521 7.6599 105.1327 44.0640 0.0000 174.2566 202 K 3.8510 8.7924 118.1731 59.5662 31.8821 178.0604 203 K 3.8748 8.1321 119.0778 59.8183 31.9015 177.3562 204 Y 3.9420 8.2617 118.8325 60.9199 38.5897 178.1517 205 A 3.5060 7.7496 120.7161 55.0804 18.5997 178.7375 206 Y 3.9595 8.0557 118.0362 61.1597 38.8437 178.1675 207 D 4.1952 8.4872 119.9617 57.7257 40.8550 178.6542 208 H 3.8880 7.3633 116.4892 58.9870 28.3131 177.8387 209 M 4.1393 7.4734 119.5034 58.1703 32.1358 178.6135 210 I 3.8132 7.4500 120.0429 64.0787 37.1575 178.5690 211 K 4.1431 8.0693 118.6290 59.3104 32.0347 178.7437 212 Q 4.3016 7.9921 114.9277 55.1503 29.5690 176.2295 213 A 4.2653 7.4555 123.3235 52.2270 19.2866 176.4334 214 H 5.3331 8.2270 115.6418 53.6313 31.2192 171.3319 215 P 4.5278 0.0000 0.0000 64.2141 31.7310 177.6769 216 G 4.1849 9.1856 110.3340 45.4403 0.0000 172.9041 217 A 4.4015 7.8308 122.0155 52.0802 19.7611 177.2851 218 I 5.0476 8.8478 123.0381 59.8281 39.2538 174.7225 219 Y 4.6608 9.2860 126.1287 57.5813 39.3415 174.9358 220 L 4.7586 8.5593 125.2911 52.4649 43.9006 175.3802 221 L 4.7596 8.3867 126.2010 53.1619 45.6011 175.4762 222 H 5.3032 9.1171 117.8746 54.0251 31.8939 174.1941 223 T 4.7696 8.3734 106.9644 61.7504 69.0963 175.0989 224 V 4.2941 7.9893 115.4117 62.4342 33.0994 176.1785 225 S 4.7418 7.8173 114.6897 56.5283 63.4012 172.9834 226 R 3.6354 8.3321 125.5604 57.3811 30.2436 175.8255 227 D 5.1607 8.6760 121.3657 54.3975 38.9181 175.3237 228 N 4.3739 7.6072 119.7194 55.9841 37.0096 177.0686 229 A 4.0751 7.8208 122.7121 54.9594 18.5737 179.3082 230 E 3.9190 8.1385 116.4827 59.4310 29.5633 179.1478 231 A 4.1017 8.2652 120.9998 55.1355 18.3799 179.4470 232 L 3.9482 8.1900 118.8065 58.2431 42.2136 178.3489 233 D 4.3913 8.4523 118.3618 57.8463 41.1062 178.2237 234 D 4.4297 8.3986 118.8564 57.3323 40.8453 178.7186 235 A 4.0713 8.5496 121.5406 55.2498 18.3067 179.8239 236 I 3.5059 8.0265 118.6691 64.5292 37.0899 178.7141 237 T 3.8701 7.8011 116.5558 67.0183 68.5052 176.4746 238 D 4.5083 8.6572 121.0043 57.1951 40.8508 178.9014 239 L 4.1699 8.6718 120.1240 57.5418 41.5144 179.6300 240 K 4.4247 8.4720 120.1146 59.0928 31.8480 179.5303 241 K 4.0065 7.9144 117.3315 59.3716 32.0342 178.5807 242 Q 4.3163 7.7775 115.6467 56.3006 28.9215 176.7083 243 G 3.9583 8.2072 108.9857 44.9973 0.0000 173.1529 244 Y 4.4612 8.0862 118.0553 57.4535 39.5835 174.5464 245 T 4.7238 8.8001 120.1550 61.8498 71.4551 173.2696 246 F 4.8585 8.8571 124.4325 56.0726 40.4176 175.1914 247 K 4.8596 8.6566 122.7165 54.5157 36.5013 175.6025 248 S 4.9030 9.2524 116.5166 57.0746 64.9408 175.5048 249 I 3.6397 7.7994 120.9817 64.3619 36.4901 178.6424 250 D 4.7172 7.9655 120.8271 56.8660 40.7647 178.1250 251 D 4.4484 8.2687 119.4152 57.4145 40.9148 178.5102 252 L 3.8824 8.1335 120.6891 58.5735 42.0735 179.0566 253 M 3.9314 8.3064 118.6280 58.4150 31.7432 178.5995 254 F 3.9325 8.7075 119.8153 61.2690 39.9467 176.7432 255 E 4.1950 8.9985 118.9775 59.1719 29.0617 179.4229 256 K 3.9637 7.7656 118.0698 59.7335 32.7369 178.5708 257 E 3.9567 7.7429 118.9554 58.3933 29.5197 178.4385 258 M 3.9460 7.3892 120.6807 58.9009 32.1983 177.0192 *259 R 4.1420 7.8170 119.8224 56.3817 30.3682 176.8214 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 24 V 8.04 4.21 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 0.77 0.00 0.00 0.94 0.00 0.00 25 P 0.00 4.12 0.00 2.32 2.23 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.07 0.00 26 N 9.18 5.29 0.00 2.50 2.68 0.00 0.00 7.10 7.65 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 27 E 7.98 4.24 0.00 1.98 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 2.28 2.24 0.00 28 P 0.00 4.44 0.00 1.87 1.96 0.00 3.57 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 29 I 8.61 4.43 0.62 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.60 0.42 0.00 0.00 30 N 8.38 5.42 0.00 2.51 2.74 0.00 0.00 6.97 7.68 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 31 W 9.61 3.96 0.00 2.99 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.06 3.57 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 0.00 0.00 0.00 33 F 6.72 4.22 0.00 2.94 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 0.00 0.00 0.00 0.00 34 K 8.66 4.00 0.00 1.72 1.79 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 35 R 8.47 4.42 0.00 1.90 1.98 0.00 3.29 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 36 S 8.64 4.27 0.00 3.78 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.67 4.35 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 0.98 0.00 0.00 1.00 0.00 0.00 38 N 9.47 4.02 0.00 2.93 2.93 0.00 0.00 7.05 8.16 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 39 H 7.99 4.86 0.00 3.41 3.58 0.00 5.72 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 7.73 4.75 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.74 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 41 P 0.00 4.01 0.00 2.04 2.00 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.33 0.00 42 P 0.00 4.63 0.00 2.30 2.23 0.00 3.50 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.94 0.00 43 D 8.31 4.97 0.00 2.66 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 44 A 8.78 3.86 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.37 4.02 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 0.00 0.00 0.00 46 K 8.98 3.89 0.00 1.89 1.85 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.60 7.81 47 Q 7.95 3.92 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 48 L 7.80 4.11 0.00 1.73 1.75 1.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 49 N 8.81 4.53 0.00 2.99 3.19 0.00 0.00 7.04 7.45 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 50 S 8.09 4.15 0.00 4.11 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 51 L 7.55 4.12 0.00 1.76 1.96 1.19 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.45 4.00 2.36 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.55 1.20 0.00 0.00 53 E 8.36 4.02 0.00 2.11 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 0.00 2.40 2.47 0.00 54 K 8.07 3.76 0.00 1.79 1.77 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.51 1.22 7.81 55 Y 7.65 4.83 0.00 3.07 2.94 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 56 D 8.57 4.93 0.00 2.72 2.92 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 0.00 57 A 8.43 5.39 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 58 F 7.60 5.16 0.00 2.95 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 59 Y 8.66 4.70 0.00 2.94 2.28 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 60 L 7.53 4.89 0.00 1.10 1.40 0.58 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.99 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 62 N 9.85 4.84 0.00 2.88 2.84 0.00 0.00 7.37 7.01 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 63 T 8.41 4.30 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 1.26 0.00 0.00 64 K 8.00 4.18 0.00 1.97 1.89 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.50 7.81 65 E 7.53 4.64 0.00 1.81 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.18 0.00 66 K 8.10 4.19 0.00 1.58 1.47 0.00 1.29 0.00 0.00 1.28 0.00 0.00 2.13 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.94 7.81 67 T 7.57 5.58 4.01 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 0.60 0.00 0.00 68 I 7.42 4.77 0.71 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.24 0.27 0.00 0.00 69 Y 8.82 5.24 0.00 2.86 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 70 L 8.64 4.69 0.00 1.58 1.26 0.79 0.40 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 71 T 8.51 4.89 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 1.32 0.00 0.00 72 F 9.24 5.51 0.00 2.65 2.83 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 0.00 0.00 0.00 73 D 8.57 5.24 0.00 2.28 2.45 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 74 N 9.56 4.49 0.00 1.65 1.42 0.00 0.00 6.37 7.61 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 75 G 8.60 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 76 Y 7.34 5.08 0.00 3.21 3.03 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 77 E 8.88 4.80 0.00 1.99 1.90 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 2.18 2.40 0.00 78 N 8.87 4.99 0.00 2.90 2.95 0.00 0.00 7.31 7.98 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 79 G 8.81 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.46 4.78 0.00 3.27 2.96 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 81 T 8.21 4.02 4.44 0.00 0.00 0.00 0.00 0.00 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 82 P 0.00 4.21 0.00 2.16 2.08 0.00 3.54 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 83 K 8.05 4.16 0.00 2.08 1.93 0.00 1.92 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.59 1.56 7.81 84 V 7.92 3.67 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 0.99 0.00 0.00 1.07 0.00 0.00 85 L 8.21 3.96 0.00 1.85 1.81 0.75 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 86 D 8.27 4.37 0.00 2.88 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.25 3.58 2.29 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 1.13 0.00 0.00 1.10 0.00 0.00 88 L 8.15 4.01 0.00 1.94 2.03 0.96 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 89 K 8.22 3.91 0.00 1.93 1.97 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.45 7.81 90 K 7.96 3.81 0.00 1.78 2.05 0.00 1.79 0.00 0.00 1.60 0.00 0.00 2.74 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.21 1.41 7.81 91 H 8.11 4.44 0.00 3.11 3.22 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 R 7.86 3.79 0.00 1.94 1.99 0.00 3.22 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 93 V 8.22 4.48 2.03 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 0.84 0.00 0.00 0.83 0.00 0.00 94 T 8.65 4.58 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 1.40 0.00 0.00 95 G 9.08 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.19 5.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 97 F 9.39 5.09 0.00 2.89 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 98 F 9.71 4.71 0.00 3.08 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 99 V 8.58 4.94 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 0.79 0.00 0.00 1.09 0.00 0.00 100 T 7.68 5.18 4.23 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 1.33 0.00 0.00 101 G 8.26 2.39 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 0.00 102 H 7.76 4.04 0.00 3.15 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 8.08 3.93 0.00 3.33 3.21 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 0.00 104 V 7.64 3.57 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.08 0.00 0.00 105 K 7.79 4.10 0.00 1.80 1.84 0.00 1.92 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.55 1.61 7.81 106 D 7.83 4.41 0.00 2.44 2.39 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 0.00 107 Q 7.60 4.45 0.00 1.21 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.56 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 108 P 0.00 4.20 0.00 2.21 2.26 0.00 3.68 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 2.00 2.01 0.00 109 Q 7.89 3.92 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 110 L 7.68 3.91 0.00 1.57 1.69 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.54 3.69 2.05 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.84 0.92 0.00 0.00 112 K 8.23 3.91 0.00 1.93 1.92 0.00 1.48 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.62 7.81 113 R 8.10 3.82 0.00 1.98 1.88 0.00 3.15 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 114 M 8.23 3.92 0.00 1.86 2.14 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 1.50 0.00 115 S 7.96 4.05 0.00 3.89 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 0.00 116 D 8.63 4.44 0.00 2.65 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 0.00 117 E 8.38 4.50 0.00 2.03 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 2.28 0.00 118 G 7.82 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 0.00 0.00 0.00 119 H 7.80 4.90 0.00 3.31 3.77 0.00 5.63 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 8.78 4.53 1.89 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.71 1.03 0.00 0.00 121 I 9.11 4.75 2.04 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 1.20 0.60 0.98 0.00 0.00 122 G 9.01 3.58 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 0.00 123 N 9.24 5.29 0.00 3.08 2.86 0.00 0.00 7.05 8.40 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 0.00 124 H 9.19 5.46 0.00 3.23 3.34 0.00 5.93 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 S 9.08 4.46 0.00 4.24 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.07 3.79 0.00 3.28 3.20 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 0.00 127 H 9.31 4.70 0.00 3.22 3.41 0.00 6.06 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 H 8.28 4.34 0.00 3.23 3.33 0.00 5.54 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.55 0.00 2.25 2.11 0.00 3.84 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 130 D 8.33 4.56 0.00 2.71 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 L 8.51 4.18 0.00 1.78 1.72 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 132 T 8.54 4.29 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 1.32 0.00 0.00 133 T 7.85 4.48 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 1.22 0.00 0.00 134 K 7.71 4.93 0.00 1.96 1.78 0.00 1.75 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.51 7.81 135 T 9.77 4.40 4.29 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 1.28 0.00 0.00 136 A 8.20 4.06 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 0.00 0.00 0.00 0.00 0.00 137 D 8.11 4.28 0.00 2.75 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 0.00 138 Q 7.96 4.03 0.00 2.44 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.56 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 139 I 8.34 3.68 2.02 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.79 0.82 0.00 0.00 140 Q 8.35 3.96 0.00 2.19 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 141 D 8.04 4.32 0.00 2.85 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 0.00 142 E 8.71 4.08 0.00 2.24 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 2.53 2.57 0.00 143 L 7.90 4.08 0.00 1.67 1.45 0.09 0.83 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 0.00 144 D 8.47 4.46 0.00 2.78 2.76 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 0.00 0.00 0.00 145 S 8.19 4.29 0.00 3.75 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 0.00 146 V 7.82 3.81 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 1.22 0.00 0.00 1.13 0.00 0.00 147 N 8.29 4.45 0.00 3.00 2.94 0.00 0.00 6.70 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 0.00 148 E 8.76 4.02 0.00 2.06 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 0.00 2.32 2.42 0.00 149 E 8.34 4.06 0.00 2.48 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 0.00 2.44 2.43 0.00 150 V 8.17 3.64 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 0.99 0.00 0.00 1.11 0.00 0.00 151 Y 8.68 4.04 0.00 3.14 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 0.00 152 K 7.96 3.98 0.00 2.03 2.09 0.00 1.88 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.56 7.81 153 I 7.42 3.91 2.01 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 1.56 0.77 0.92 0.00 0.00 154 T 8.29 4.34 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 155 G 7.77 3.14 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 0.00 156 K 7.19 4.66 0.00 1.64 1.69 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.44 7.81 157 Q 8.19 4.42 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.04 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 158 D 8.62 4.70 0.00 2.77 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 0.00 159 N 8.39 4.25 0.00 2.49 2.37 0.00 0.00 6.94 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.82 4.09 0.00 1.23 0.60 0.72 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 161 Y 8.62 5.55 0.00 2.99 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 L 9.65 5.15 0.00 1.55 1.44 0.83 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 163 R 8.75 4.35 0.00 0.67 1.17 0.00 2.70 0.00 0.00 2.80 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.43 0.00 164 P 0.00 4.32 0.00 2.42 2.20 0.00 3.54 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 165 P 0.00 4.23 0.00 2.22 1.30 0.00 3.66 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 2.14 0.00 166 R 9.13 3.90 0.00 1.99 2.10 0.00 3.32 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 167 G 8.33 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 0.00 168 V 7.63 4.93 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 0.91 0.00 0.00 1.09 0.00 0.00 169 F 8.93 5.14 0.00 3.14 3.25 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 0.00 170 S 8.51 4.56 0.00 3.91 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 0.00 171 E 8.84 3.94 0.00 2.17 2.29 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 2.54 2.56 0.00 172 Y 8.14 4.09 0.00 3.16 2.96 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 0.00 173 V 7.63 3.13 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 1.03 0.00 0.00 0.99 0.00 0.00 174 L 7.74 3.79 0.00 1.26 1.15 1.13 0.63 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 0.00 175 K 7.59 3.80 0.00 1.74 1.84 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.72 7.81 176 E 8.30 3.84 0.00 1.65 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 2.09 2.21 0.00 177 T 8.09 3.95 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 1.11 0.00 0.00 178 K 8.05 4.24 0.00 2.04 2.12 0.00 1.97 0.00 0.00 1.90 0.00 0.00 3.51 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.52 1.59 7.81 179 R 8.06 3.93 0.00 2.05 2.11 0.00 3.34 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 180 L 7.48 4.43 0.00 2.01 1.92 0.95 1.48 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 0.00 181 G 8.28 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 0.00 182 Y 8.26 4.52 0.00 3.11 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 0.00 183 Q 8.77 4.47 0.00 2.26 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.96 0.00 0.00 0.00 0.00 0.00 2.83 2.61 0.00 184 T 8.65 4.40 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.00 0.00 185 V 8.25 3.62 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 0.53 0.00 0.00 0.88 0.00 0.00 186 F 7.87 4.72 0.00 1.84 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 0.00 187 W 7.40 5.17 0.00 3.62 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 S 9.28 4.09 0.00 3.82 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 0.00 189 V 7.93 4.75 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 0.47 0.00 0.00 0.83 0.00 0.00 190 A 8.92 4.78 1.22 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 0.00 0.00 191 F 7.65 4.74 0.00 2.95 2.77 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 0.00 192 V 8.48 3.73 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 0.03 0.00 0.00 0.98 0.00 0.00 193 D 8.22 5.07 0.00 2.90 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 0.00 194 W 7.33 4.91 0.00 3.37 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 0.00 195 K 7.19 4.24 0.00 1.43 1.55 0.00 1.26 0.00 0.00 1.54 0.00 0.00 2.62 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.65 0.21 7.81 196 I 8.38 3.85 1.95 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.94 0.99 0.00 0.00 197 N 8.03 4.60 0.00 2.82 2.94 0.00 0.00 5.72 8.04 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 0.00 198 N 7.49 4.82 0.00 2.49 2.56 0.00 0.00 7.16 6.95 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 0.00 199 Q 7.72 4.23 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.61 0.00 200 K 8.15 3.80 0.00 1.36 1.68 0.00 0.61 0.00 0.00 0.76 0.00 0.00 2.73 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.19 1.29 7.81 201 G 7.66 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 K 8.79 3.85 0.00 2.01 1.83 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.52 7.81 203 K 8.13 3.87 0.00 1.87 1.86 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.69 1.55 7.81 204 Y 8.26 3.94 0.00 3.16 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 A 7.75 3.51 1.61 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 0.00 206 Y 8.06 3.96 0.00 3.11 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 D 8.49 4.20 0.00 2.52 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 0.00 208 H 7.36 3.89 0.00 2.02 2.48 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 M 7.47 4.14 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.90 0.00 210 I 7.45 3.81 1.55 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.45 0.83 0.00 0.00 211 K 8.07 4.14 0.00 1.71 1.81 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.41 7.81 212 Q 7.99 4.30 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 213 A 7.46 4.27 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 0.00 214 H 8.23 5.33 0.00 3.43 3.44 0.00 5.47 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 P 0.00 4.53 0.00 2.33 2.20 0.00 3.84 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.09 0.00 216 G 9.19 4.18 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 0.00 217 A 7.83 4.40 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 0.00 218 I 8.85 5.05 2.21 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.93 1.12 0.00 0.00 219 Y 9.29 4.66 0.00 2.85 2.83 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 0.00 0.00 0.00 220 L 8.56 4.76 0.00 1.23 1.12 -0.79 0.38 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 0.00 221 L 8.39 4.76 0.00 1.21 1.49 0.87 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 222 H 9.12 5.30 0.00 3.19 3.23 0.00 5.79 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 T 8.37 4.77 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 1.31 0.00 0.00 224 V 7.99 4.29 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 0.23 0.00 0.00 1.00 0.00 0.00 225 S 7.82 4.74 0.00 4.13 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 0.00 226 R 8.33 3.64 0.00 2.01 1.84 0.00 3.35 0.00 0.00 3.12 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 227 D 8.68 5.16 0.00 2.91 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 0.00 228 N 7.61 4.37 0.00 3.05 3.19 0.00 0.00 6.89 6.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 A 7.82 4.08 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 0.00 230 E 8.14 3.92 0.00 2.23 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 0.00 2.41 2.45 0.00 231 A 8.27 4.10 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 0.00 0.00 0.00 0.00 0.00 232 L 8.19 3.95 0.00 2.02 1.96 0.98 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 233 D 8.45 4.39 0.00 2.94 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 D 8.40 4.43 0.00 2.98 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 0.00 235 A 8.55 4.07 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 0.00 236 I 8.03 3.51 1.50 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.44 0.26 0.00 0.00 237 T 7.80 3.87 4.45 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 1.27 0.00 0.00 238 D 8.66 4.51 0.00 2.80 2.83 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 0.00 0.00 0.00 239 L 8.67 4.17 0.00 1.99 1.68 0.89 0.43 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 0.00 240 K 8.47 4.42 0.00 2.14 1.96 0.00 1.74 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.71 1.71 7.81 241 K 7.91 4.01 0.00 2.06 1.93 0.00 1.73 0.00 0.00 1.89 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.53 7.81 242 Q 7.78 4.32 0.00 2.43 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.69 0.00 0.00 0.00 0.00 0.00 2.44 2.54 0.00 243 G 8.21 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 0.00 244 Y 8.09 4.46 0.00 2.91 2.33 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 0.00 245 T 8.80 4.72 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 1.19 0.00 0.00 246 F 8.86 4.86 0.00 2.86 2.95 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 0.00 247 K 8.66 4.86 0.00 1.57 1.93 0.00 1.64 0.00 0.00 1.87 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.23 7.81 248 S 9.25 4.90 0.00 4.05 4.08 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 0.00 0.00 0.00 249 I 7.80 3.64 1.51 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 1.50 0.86 0.14 0.00 0.00 250 D 7.97 4.72 0.00 2.78 2.83 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 0.00 0.00 0.00 251 D 8.27 4.45 0.00 3.16 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 L 8.13 3.88 0.00 1.43 1.66 -0.07 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 253 M 8.31 3.93 0.00 2.17 2.39 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.08 3.03 0.00 254 F 8.71 3.93 0.00 3.12 3.14 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 0.00 255 E 9.00 4.20 0.00 2.10 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 2.46 2.65 0.00 256 K 7.77 3.96 0.00 1.80 1.83 0.00 1.27 0.00 0.00 1.37 0.00 0.00 2.81 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.52 1.31 7.81 257 E 7.74 3.96 0.00 2.03 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 2.12 2.22 0.00 258 M 7.39 3.95 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.47 0.00 *259 R 7.82 4.14 0.00 1.57 1.74 0.00 3.23 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.