NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4808 8.1633 120.2427 55.2776 33.6326 173.8835 2 N 5.5115 8.7355 120.4475 51.2533 41.3021 172.2184 3 I 4.8372 9.6230 122.7789 59.6677 42.7085 173.2258 4 I 4.9363 8.2556 127.9756 59.3608 40.4259 174.3166 5 L 4.9267 8.9839 128.0481 53.2193 44.7170 174.9010 6 K 4.6630 9.2525 129.2274 55.1965 33.8181 175.2057 7 I 4.4536 8.9008 130.0544 59.6956 38.5317 175.6209 8 S 4.4175 9.1233 123.3581 58.5317 63.1661 175.6913 9 G 3.9474 9.0696 111.2337 47.9463 0.0000 176.0915 10 K 4.4580 8.1616 121.7194 58.7600 31.7788 178.8568 11 F 3.3500 8.0042 119.9839 60.5624 39.1538 176.1849 12 F 4.4811 7.9977 114.3585 57.7731 39.3442 176.5438 13 D 4.7212 8.0948 118.9922 56.4251 41.2547 176.4595 14 E 4.4740 8.0028 119.1173 55.8236 31.5064 176.5856 15 D 4.8094 8.0235 122.4262 53.3770 39.7301 174.7945 16 N 3.9818 7.4275 116.6221 54.3801 41.3396 174.1113 *22 V 4.0872 8.2998 118.0929 62.1197 32.9918 175.4431 23 L 4.6459 7.6650 118.3112 55.5285 43.4032 177.1765 24 R 3.9414 8.2365 118.4384 60.2554 29.2332 177.3645 25 Q 4.0978 8.1904 117.2109 59.5028 28.4247 178.6628 26 S 4.1676 7.9658 116.3074 60.5712 63.0526 176.1430 27 I 3.6634 7.5727 123.4478 64.2913 36.8730 178.4111 28 K 4.0097 7.7307 117.6280 59.5038 31.9532 179.1482 29 E 3.9630 7.8134 117.5694 59.3797 29.4589 179.0122 30 L 3.8795 8.6375 119.0942 58.0035 41.7974 179.4653 31 A 4.6544 8.3301 121.9828 54.8951 18.1738 179.2973 32 D 4.4702 8.1460 114.2877 56.6945 41.2247 176.9423 33 N 4.9822 7.8880 115.6172 52.8436 38.7842 175.1431 34 G 3.7896 8.1796 107.7705 46.2364 0.0000 173.4598 35 F 5.1285 8.3102 117.9990 55.4526 41.7379 175.0622 36 R 4.8745 8.8794 122.2213 54.9337 32.2360 175.5198 37 V 5.1178 8.6418 122.0383 61.1582 35.0341 174.2107 38 G 4.7142 9.0753 113.8704 44.6040 0.0000 171.8123 39 I 5.2535 9.3033 123.3903 59.1778 41.3228 174.5695 40 V 4.8743 8.7525 126.0482 61.1565 34.3823 174.0843 41 T 5.0299 8.4172 117.9695 59.8084 71.0828 174.5676 42 G 3.8628 9.0872 112.7382 45.8289 0.0000 174.4022 43 G 3.7966 8.8641 107.5305 45.4924 0.0000 175.2240 44 G 4.1322 8.1064 108.6821 45.7419 0.0000 174.1430 45 S 4.2451 9.3272 113.3765 61.8298 62.9158 176.6771 46 T 3.9967 8.0393 118.8171 66.3896 68.1560 176.2789 47 A 4.0913 7.8923 122.7680 55.3854 18.4562 179.9032 48 R 3.9337 7.9642 116.1843 59.3188 30.1108 179.3582 49 R 3.8551 8.3580 118.7181 59.7814 30.1617 178.3064 50 Y 3.8713 8.2219 116.5477 60.8230 37.8258 178.4240 51 I 3.8260 8.3226 121.3818 64.1032 37.1670 178.2826 52 K 3.8867 8.2296 120.5494 59.3910 31.7387 178.2870 53 L 3.8647 7.8939 120.3017 58.3606 41.9769 178.9284 54 A 3.9035 8.1351 120.4444 55.0762 18.2754 179.5488 55 R 3.8723 8.5396 117.6744 59.7232 29.9693 178.4439 56 E 4.0751 8.2486 117.6239 58.9028 29.4618 178.4351 57 I 4.3470 7.1554 110.1918 60.4349 37.9668 176.2894 58 G 3.9058 8.2042 108.1513 46.0064 0.0000 173.9670 59 I 3.8595 7.7138 120.8097 60.4173 37.7197 177.1699 60 G 3.9826 8.7998 111.6440 44.9090 0.0000 173.7601 61 E 3.9617 8.9630 122.0247 59.3252 29.5760 179.3260 62 A 3.8732 7.9018 120.0427 55.4199 18.4836 179.0401 63 Y 4.1810 7.7318 114.4370 60.7194 38.0672 178.1678 64 L 4.1510 7.9679 120.4589 57.8081 41.6681 179.1173 65 D 4.3871 8.1828 118.9459 57.3758 40.6704 178.7670 66 L 4.0341 7.8638 119.3953 57.8062 41.5766 179.6492 67 L 4.2926 8.2991 119.1802 57.7679 41.5774 179.7197 68 G 3.6741 8.1936 105.7553 47.7741 0.0000 175.8648 69 I 3.5824 8.0659 122.4952 64.0295 37.1275 178.5672 70 W 4.2204 8.3920 119.8332 59.6909 28.7016 178.4191 71 A 4.0034 8.3426 121.1149 55.1917 17.9486 179.8709 72 S 4.2449 7.9201 114.0619 61.0397 62.9114 176.9822 73 R 3.8580 8.0321 121.7977 58.6851 29.8368 178.5793 74 L 4.0957 8.1072 120.4666 58.3607 42.1125 178.8750 75 N 4.0028 7.8553 116.0164 55.7259 38.2508 177.3978 76 A 3.8321 7.5327 122.1288 55.3031 18.4722 179.2924 77 Y 3.4603 7.9351 115.5094 60.6315 37.7148 178.4546 78 L 3.9844 7.7426 121.1825 58.2586 42.0203 179.2768 79 V 3.6931 7.6019 116.5460 66.2336 31.7650 177.2210 80 M 4.1753 8.4246 118.2229 58.8665 31.8453 178.2620 81 F 4.6908 8.3777 117.2166 60.3095 39.1645 177.0078 82 S 4.5907 7.9050 111.4453 59.3129 63.5036 175.1441 83 L 4.6783 7.7755 122.5194 53.5574 42.0425 175.4720 84 Q 4.1427 7.6793 117.1714 58.0338 29.1532 175.8699 85 D 5.1715 9.1280 121.4640 54.4355 39.5267 175.8584 86 L 4.2368 7.9849 117.5391 55.6218 42.2423 176.2997 87 A 5.2800 7.6203 120.0767 49.9356 21.3977 175.2178 88 Y 4.3467 8.5792 122.7656 57.9054 39.6151 177.0365 89 M 4.3418 7.8026 128.4969 53.0153 30.6563 174.5077 90 H 4.4395 7.3833 116.0003 55.0622 33.3021 172.9318 91 V 4.2884 8.2450 126.2650 59.4276 31.7929 173.5629 92 P 4.6712 0.0000 0.0000 63.1876 31.6412 176.2379 93 Q 4.5450 10.0046 120.0964 56.0090 29.5269 175.1191 94 S 3.6778 7.0655 112.5884 55.3546 67.1829 174.4755 95 L 3.5465 7.2094 123.3798 58.1386 41.6273 178.8911 96 E 3.9301 7.8357 118.0632 59.5324 29.3842 179.0662 97 E 4.0253 8.1445 118.6003 59.1264 29.4627 179.1712 98 F 4.1344 8.2874 121.0295 61.2804 39.2523 177.1197 99 I 3.7099 7.8642 118.5571 64.4341 37.3170 177.9339 100 Q 4.0368 7.8605 120.1035 59.2412 28.9718 177.8165 101 D 4.1794 8.2581 120.1907 57.2557 40.8366 178.7132 102 W 4.0599 8.3088 128.7350 60.2322 30.2790 177.6602 103 S 4.0628 7.5300 111.7162 60.8118 61.8367 174.8252 104 H 4.2609 7.6774 117.0021 55.8795 28.6192 176.1651 105 G 3.5650 7.2931 108.9130 45.2723 0.0000 173.1759 106 K 4.4442 7.0927 117.9611 53.7084 35.0705 175.6169 107 V 4.3550 8.2078 119.6880 62.8054 32.7546 174.8711 108 V 4.8305 8.8264 126.2510 61.1439 34.7887 173.8965 109 V 4.9336 8.5090 127.0094 61.5354 34.0984 174.0607 110 T 4.6778 9.3871 121.4294 60.4166 71.2237 172.5665 111 G 4.1590 8.2699 113.8413 44.9204 0.0000 173.2562 112 G 3.6107 8.4320 113.6761 45.4411 0.0000 172.4249 113 F 5.1421 8.3765 114.8889 57.5302 41.1015 175.9436 114 Q 4.5360 7.6723 117.6292 53.2575 32.0853 172.7475 115 P 4.2200 0.0000 0.0000 64.1260 31.8501 176.7720 116 G 3.9171 10.0758 109.5956 45.4288 0.0000 172.6635 117 Q 4.4646 7.4469 115.9426 54.6547 31.9727 173.2245 118 S 4.7015 8.0219 112.3309 56.2653 65.6437 174.8843 119 T 3.8293 8.0935 109.6402 63.8071 68.3428 176.2524 120 A 3.9114 7.7117 124.0077 55.0186 18.3051 179.3996 121 A 3.8166 7.7019 119.2505 55.1738 18.3904 179.9435 122 V 3.1795 7.4363 116.0243 66.0408 31.5177 177.8714 123 A 3.7165 8.2122 120.5568 54.9450 18.1291 179.5435 124 A 3.8116 7.7518 119.2318 55.2400 18.4033 179.8415 125 L 3.8735 7.9068 117.6169 58.0339 41.8291 180.0524 126 V 3.0525 7.8031 118.0576 65.4868 31.2807 178.0122 127 A 3.7996 7.7232 120.7814 54.8177 18.3013 179.2453 128 E 3.7582 8.1958 117.6185 59.4876 29.5971 179.0310 129 A 4.1185 8.0906 119.5910 54.1224 18.4633 178.6124 130 S 4.3406 7.4768 110.2151 57.3642 63.4793 174.2358 131 S 3.7918 7.6257 116.6734 59.9340 60.5550 171.5726 132 S 4.6426 8.3335 116.2954 57.7153 63.2252 174.7183 133 K 4.4305 8.6317 123.2857 57.3157 33.3962 176.2967 134 T 5.0485 7.6663 117.2431 61.6707 72.9921 172.2375 135 L 4.8160 9.2565 128.7836 53.2474 44.7962 174.8913 136 V 4.6208 8.7041 127.1250 61.3625 33.5823 174.4542 137 V 4.6330 9.1561 129.1863 61.3401 33.1120 174.2708 138 A 4.9078 9.0030 132.0175 51.3641 20.2444 175.7555 139 T 5.0748 8.8363 117.9701 60.4961 71.5729 173.8352 140 N 4.1402 8.6331 118.5372 52.5641 37.1319 174.6981 141 V 4.5663 7.0275 111.3608 59.7404 35.3839 176.1963 142 D 4.5132 8.8474 120.4747 55.1688 41.5940 177.4189 143 G 4.0734 7.0703 105.0170 46.2233 0.0000 171.4110 144 V 4.3154 7.9697 121.5297 61.4327 33.2961 175.3591 145 Y 4.9881 9.4668 123.6631 55.7219 40.8143 175.5225 146 E 4.0003 8.7889 124.8523 59.0256 29.6992 177.4635 147 K 4.5965 7.5687 114.3464 53.5938 35.6593 175.8362 148 D 4.5166 8.6437 119.4130 53.9972 41.9523 175.1639 149 P 4.2589 0.0000 0.0000 65.6209 31.4563 178.6420 150 R 4.0019 8.3588 116.6541 58.8174 30.0038 178.4988 151 I 3.8763 7.7005 117.7166 62.2636 38.1449 175.6693 152 Y 4.5363 7.7093 115.5650 56.2751 39.6552 174.9266 153 A 4.5984 8.3956 124.6331 51.0166 21.9748 176.4139 154 D 4.3577 8.2812 116.9337 55.6522 38.2006 174.2532 155 V 4.4787 7.2741 110.6822 59.2513 34.7421 176.1731 156 K 4.6444 8.3068 122.6101 55.6986 34.8098 175.5267 157 L 3.9584 8.4310 124.0948 54.9602 43.3249 176.3877 158 I 4.2225 8.5024 127.4896 59.5264 37.4212 174.8233 159 P 4.3292 0.0000 0.0000 64.9690 32.4571 176.0608 160 H 5.4406 7.5979 114.0690 54.2738 33.0554 172.8581 161 L 4.7728 8.8339 121.7914 55.1332 44.4765 173.9296 162 T 5.2368 8.9659 108.4424 59.4299 72.1750 175.3676 163 T 3.9044 8.5181 112.1872 64.8635 68.6116 176.3808 164 Q 4.0128 7.8229 121.4499 58.8920 29.0886 177.8379 165 D 4.3678 7.9998 120.3648 57.1547 40.8496 178.6205 166 L 4.0129 7.7443 119.2847 57.7672 41.8235 179.4187 167 R 4.1233 8.0216 115.1228 58.3209 29.4821 178.8652 168 K 4.3015 7.7753 121.2757 58.9854 32.0532 179.2201 169 I 4.0916 7.5038 121.0924 63.8192 36.7686 178.4999 170 L 4.0859 7.6516 119.1013 57.4824 41.8259 178.5138 171 E 4.3090 8.2499 116.7484 56.2627 29.3028 178.1208 172 G 3.9840 7.6941 107.2570 45.9821 0.0000 174.6536 173 S 4.3244 8.3866 115.5329 59.1267 62.4366 173.5202 174 Q 4.6798 7.7293 119.5000 54.1190 32.2008 173.3810 175 S 4.7206 8.2737 116.7031 56.7060 64.3138 174.8906 176 V 3.9572 8.1704 124.0007 63.3098 32.4265 174.7403 177 Q 4.5905 8.1168 117.3660 53.6884 33.1845 175.0438 178 A 4.1414 8.8119 123.7631 55.4969 18.5834 180.0554 179 G 3.7326 8.1084 103.4864 48.4557 0.0000 175.9000 180 T 3.9146 7.9576 118.4076 66.2943 68.1319 175.7232 181 Y 4.1549 8.7807 121.9108 60.9700 38.4870 178.0042 182 E 4.1731 7.9447 117.8807 58.1421 29.4814 177.5596 183 L 4.6776 7.7162 117.0248 54.3318 43.7284 177.3329 184 L 4.3094 7.2731 121.1927 53.0671 40.2947 175.3282 185 D 4.3699 8.0862 118.4655 50.2990 42.6827 174.0659 186 P 4.1597 0.0000 0.0000 66.1395 31.0047 178.0247 187 L 3.8372 7.9020 119.6830 57.5170 41.9992 178.4466 188 A 3.9483 7.8748 120.1710 55.3034 18.2910 179.7054 189 I 3.5911 7.5389 117.6255 64.3413 37.2100 178.4867 190 K 3.8900 8.5794 120.7487 59.5592 31.9703 178.8784 191 I 3.6558 8.1456 120.2607 64.6520 37.1002 178.9932 192 V 3.6697 7.9416 113.1764 64.2015 30.7376 178.6755 193 E 3.9665 8.2670 118.9171 59.3169 29.1711 179.4211 194 R 4.0945 7.9532 114.7230 58.2280 29.7069 177.9121 195 S 4.5528 7.7740 113.2454 56.6339 64.6081 173.8650 196 K 3.7811 7.2510 119.4647 57.4109 29.7772 175.0669 197 I 4.5268 7.7392 117.8704 59.8953 39.0121 178.1713 198 R 4.1994 8.9740 126.7648 55.9971 31.7762 175.9233 199 V 4.7808 8.3304 121.6550 61.3494 34.2231 174.3526 200 I 4.6066 8.8260 130.7102 60.1698 38.7914 175.1407 201 V 4.6427 9.1315 129.1456 61.7251 33.0402 174.7000 202 M 5.2058 8.9068 124.8891 53.8929 35.6779 173.2010 203 N 5.0530 8.7598 116.4861 52.0579 40.0319 175.1996 204 Y 4.3406 8.1485 123.7617 59.1513 38.3772 178.0793 205 R 4.2019 8.4211 119.5938 58.4483 30.4137 177.3360 206 K 4.6927 8.0500 117.1319 56.0671 32.5576 178.3559 207 L 4.0208 7.8528 123.0659 57.7679 41.5585 178.9714 208 N 4.5797 8.1803 113.9662 54.5034 37.7312 175.5616 209 R 4.5728 8.1331 118.6316 56.1677 30.7388 177.6998 210 I 3.6502 7.5953 122.3900 64.7140 36.8859 178.1506 211 I 3.5325 7.6052 119.7986 64.6988 36.9825 178.1478 212 D 4.4206 8.0059 118.8885 56.9747 40.6590 178.7496 213 I 3.6907 7.7307 120.6413 64.4353 36.9305 178.2737 214 L 3.9803 7.7871 118.4009 57.8986 41.5517 179.6344 215 K 4.2313 7.8369 116.9745 57.5019 31.9604 178.0493 216 G 3.8877 7.9866 106.8687 46.0680 0.0000 173.5278 217 E 4.5882 8.6398 116.7499 55.4138 29.7226 175.4301 218 E 4.6673 7.6273 118.0849 53.8905 32.9029 174.9719 219 V 3.5467 8.3780 123.1589 63.2708 31.8805 175.2521 220 S 4.9016 7.3770 119.6888 58.5656 65.6230 175.3582 221 S 4.8867 8.2500 115.7237 56.7146 65.9641 173.4614 222 I 4.7922 8.5205 125.4249 59.5645 40.0516 174.5773 223 I 4.7630 8.7253 128.6378 59.9898 38.8482 174.7478 224 E 4.6872 9.3614 128.4683 54.8272 31.0253 174.1823 225 P 4.6940 0.0000 0.0000 62.5321 32.3004 176.7704 226 V 4.0134 8.2620 117.5208 61.4333 32.5041 175.2947 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 1 M 8.16 4.48 0.00 1.98 1.31 0.00 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 2 N 8.74 5.51 0.00 2.86 2.97 0.00 0.00 6.52 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 3 I 9.62 4.84 2.06 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.64 1.10 0.00 0.00 4 I 8.26 4.94 1.77 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.80 0.82 0.00 0.00 5 L 8.98 4.93 0.00 1.63 1.46 0.85 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 6 K 9.25 4.66 0.00 1.78 1.73 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.96 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.31 1.42 7.81 7 I 8.90 4.45 1.85 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.45 -0.03 0.00 0.00 8 S 9.12 4.42 0.00 4.16 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 9 G 9.07 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 10 K 8.16 4.46 0.00 2.06 2.08 0.00 1.80 0.00 0.00 1.93 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.46 7.81 11 F 8.00 3.35 0.00 2.25 2.65 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 12 F 8.00 4.48 0.00 3.13 3.12 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 13 D 8.09 4.72 0.00 2.86 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 14 E 8.00 4.47 0.00 1.76 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 2.31 2.40 0.00 15 D 8.02 4.81 0.00 2.72 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 16 N 7.43 3.98 0.00 2.58 2.60 0.00 0.00 7.08 7.71 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 *22 V 8.30 4.09 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 0.86 0.00 0.00 0.95 0.00 0.00 23 L 7.67 4.65 0.00 1.68 1.57 0.89 0.75 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 24 R 8.24 3.94 0.00 2.01 1.98 0.00 3.33 0.00 0.00 3.43 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 25 Q 8.19 4.10 0.00 2.30 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 26 S 7.97 4.17 0.00 4.04 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 27 I 7.57 3.66 1.91 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 1.55 0.87 0.96 0.00 0.00 28 K 7.73 4.01 0.00 2.06 1.88 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.65 7.81 29 E 7.81 3.96 0.00 2.25 1.99 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 2.34 2.36 0.00 30 L 8.64 3.88 0.00 1.81 1.77 0.87 0.61 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 31 A 8.33 4.65 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 0.00 0.00 0.00 0.00 0.00 32 D 8.15 4.47 0.00 2.79 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 33 N 7.89 4.98 0.00 3.22 3.25 0.00 0.00 7.03 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.18 3.79 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 0.00 0.00 0.00 35 F 8.31 5.13 0.00 3.17 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 36 R 8.88 4.87 0.00 2.24 1.90 0.00 2.81 0.00 0.00 2.92 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 37 V 8.64 5.12 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 1.09 0.00 0.00 1.04 0.00 0.00 38 G 9.08 4.71 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 39 I 9.30 5.25 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 1.14 0.79 0.92 0.00 0.00 40 V 8.75 4.87 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 0.77 0.00 0.00 0.70 0.00 0.00 41 T 8.42 5.03 4.07 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 1.29 0.00 0.00 42 G 9.09 3.86 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 0.00 0.00 0.00 43 G 8.86 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.11 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 45 S 9.33 4.25 0.00 4.07 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 46 T 8.04 4.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 47 A 7.89 4.09 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 48 R 7.96 3.93 0.00 1.96 2.04 0.00 3.18 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.87 0.00 49 R 8.36 3.86 0.00 1.98 2.12 0.00 3.04 0.00 0.00 2.71 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.59 0.00 50 Y 8.22 3.87 0.00 3.31 3.10 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 51 I 8.32 3.83 1.99 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 1.65 0.79 0.97 0.00 0.00 52 K 8.23 3.89 0.00 1.91 2.01 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.45 7.81 53 L 7.89 3.86 0.00 1.94 1.72 0.83 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.14 3.90 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.54 3.87 0.00 1.98 2.13 0.00 3.14 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 1.65 1.70 0.00 56 E 8.25 4.08 0.00 2.11 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 2.35 2.61 0.00 57 I 7.16 4.35 1.87 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 1.70 0.66 0.91 0.00 0.00 58 G 8.20 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 59 I 7.71 3.86 2.05 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.88 1.03 0.00 0.00 60 G 8.80 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.96 3.96 0.00 2.11 1.99 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 2.39 2.47 0.00 62 A 7.90 3.87 0.95 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 63 Y 7.73 4.18 0.00 3.25 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 64 L 7.97 4.15 0.00 1.92 1.78 1.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.18 4.39 0.00 2.87 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 66 L 7.86 4.03 0.00 2.11 1.94 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.30 4.29 0.00 2.03 1.87 1.08 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.19 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.07 3.58 1.83 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 0.90 0.52 0.00 0.00 70 W 8.39 4.22 0.00 3.37 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 71 A 8.34 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.92 4.24 0.00 4.18 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 73 R 8.03 3.86 0.00 2.22 2.23 0.00 2.21 0.00 0.00 2.67 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 74 L 8.11 4.10 0.00 1.92 1.87 0.95 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 75 N 7.86 4.00 0.00 2.37 1.42 0.00 0.00 6.92 8.41 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 76 A 7.53 3.83 1.11 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 77 Y 7.94 3.46 0.00 2.96 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 78 L 7.74 3.98 0.00 1.86 1.90 1.07 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.60 3.69 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 0.90 0.00 0.00 1.31 0.00 0.00 80 M 8.42 4.18 0.00 1.89 1.94 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.66 0.00 81 F 8.38 4.69 0.00 3.22 3.04 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 82 S 7.90 4.59 0.00 4.09 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 83 L 7.78 4.68 0.00 1.90 1.74 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 84 Q 7.68 4.14 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.40 5.68 0.00 0.00 0.00 0.00 0.00 2.49 2.71 0.00 85 D 9.13 5.17 0.00 2.81 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 86 L 7.98 4.24 0.00 1.94 1.74 0.96 0.68 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 87 A 7.62 5.28 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 88 Y 8.58 4.35 0.00 2.81 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 89 M 7.80 4.34 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.46 0.00 90 H 7.38 4.44 0.00 2.78 2.92 0.00 5.71 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.24 4.29 1.54 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 0.68 0.00 0.00 -0.00 0.00 0.00 92 P 0.00 4.67 0.00 2.48 2.44 0.00 4.11 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 93 Q 10.00 4.55 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.64 0.00 0.00 0.00 0.00 0.00 2.19 2.40 0.00 94 S 7.07 3.68 0.00 3.68 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 95 L 7.21 3.55 0.00 1.61 1.53 1.02 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 96 E 7.84 3.93 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 97 E 8.14 4.03 0.00 2.18 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 0.00 2.35 2.29 0.00 98 F 8.29 4.13 0.00 3.31 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 7.86 3.71 2.08 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 1.51 0.95 0.94 0.00 0.00 100 Q 7.86 4.04 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 101 D 8.26 4.18 0.00 2.81 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 0.00 102 W 8.31 4.06 0.00 2.41 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 0.00 103 S 7.53 4.06 0.00 4.05 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 0.00 104 H 7.68 4.26 0.00 2.66 3.07 0.00 5.96 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 0.00 105 G 7.29 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 0.00 106 K 7.09 4.44 0.00 1.75 1.92 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.35 7.81 107 V 8.21 4.35 2.26 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 1.49 0.00 0.00 1.03 0.00 0.00 108 V 8.83 4.83 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.17 0.00 0.00 109 V 8.51 4.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.96 0.00 0.00 110 T 9.39 4.68 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 1.08 0.00 0.00 111 G 8.27 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 0.00 0.00 0.00 0.00 112 G 8.43 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 0.00 113 F 8.38 5.14 0.00 3.08 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 0.00 114 Q 7.67 4.54 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.87 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 115 P 0.00 4.22 0.00 2.01 1.91 0.00 3.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.02 0.00 116 G 10.08 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 7.45 4.46 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.26 0.00 118 S 8.02 4.70 0.00 3.88 3.90 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 0.00 119 T 8.09 3.83 4.07 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 1.14 0.00 0.00 120 A 7.71 3.91 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 0.00 121 A 7.70 3.82 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 0.00 122 V 7.44 3.18 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 -0.04 0.00 0.00 0.47 0.00 0.00 123 A 8.21 3.72 1.24 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 0.00 124 A 7.75 3.81 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 0.00 125 L 7.91 3.87 0.00 1.86 1.75 1.01 0.67 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 0.00 126 V 7.80 3.05 1.79 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 0.36 0.00 0.00 -0.44 0.00 0.00 127 A 7.72 3.80 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.20 3.76 0.00 2.00 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 2.28 2.30 0.00 129 A 8.09 4.12 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 7.48 4.34 0.00 3.05 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 0.00 131 S 7.63 3.79 0.00 4.15 4.04 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 0.00 132 S 8.33 4.64 0.00 3.85 3.79 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 0.00 133 K 8.63 4.43 0.00 1.74 1.84 0.00 1.63 0.00 0.00 1.83 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.48 7.81 134 T 7.67 5.05 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 1.21 0.00 0.00 135 L 9.26 4.82 0.00 1.62 1.45 0.90 0.62 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 0.00 136 V 8.70 4.62 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 0.83 0.00 0.00 0.89 0.00 0.00 137 V 9.16 4.63 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 0.97 0.00 0.00 0.89 0.00 0.00 138 A 9.00 4.91 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 0.00 139 T 8.84 5.07 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 0.00 140 N 8.63 4.14 0.00 2.79 2.92 0.00 0.00 5.70 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 0.00 141 V 7.03 4.57 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 0.96 0.00 0.00 1.04 0.00 0.00 142 D 8.85 4.51 0.00 2.80 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 0.00 143 G 7.07 4.07 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 0.00 144 V 7.97 4.32 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.90 0.00 0.00 145 Y 9.47 4.99 0.00 3.12 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 0.00 146 E 8.79 4.00 0.00 2.04 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 2.29 2.31 0.00 147 K 7.57 4.60 0.00 1.70 1.54 0.00 0.61 0.00 0.00 1.27 0.00 0.00 2.70 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.10 0.86 7.81 148 D 8.64 4.52 0.00 2.83 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 0.00 149 P 0.00 4.26 0.00 1.83 1.57 0.00 3.72 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 150 R 8.36 4.00 0.00 1.84 1.94 0.00 3.11 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 151 I 7.70 3.88 1.64 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.44 0.40 0.00 0.00 152 Y 7.71 4.54 0.00 3.07 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 0.00 153 A 8.40 4.60 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 0.00 154 D 8.28 4.36 0.00 2.76 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 0.00 155 V 7.27 4.48 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 0.82 0.00 0.00 156 K 8.31 4.64 0.00 1.86 1.96 0.00 1.51 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.48 1.56 7.81 157 L 8.43 3.96 0.00 1.28 1.41 0.64 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 158 I 8.50 4.22 1.79 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.97 0.90 0.00 0.00 159 P 0.00 4.33 0.00 1.97 2.21 0.00 3.78 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 2.05 1.81 0.00 160 H 7.60 5.44 0.00 3.07 3.17 0.00 5.65 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 0.00 161 L 8.83 4.77 0.00 1.91 1.74 0.91 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 162 T 8.97 5.24 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 1.20 0.00 0.00 163 T 8.52 3.90 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 1.24 0.00 0.00 164 Q 7.82 4.01 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 165 D 8.00 4.37 0.00 3.03 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 0.00 166 L 7.74 4.01 0.00 1.94 1.70 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 167 R 8.02 4.12 0.00 2.05 2.17 0.00 2.76 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.66 0.00 168 K 7.78 4.30 0.00 2.06 1.90 0.00 1.69 0.00 0.00 1.93 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.80 1.48 7.81 169 I 7.50 4.09 2.10 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 1.44 1.63 0.95 0.00 0.00 170 L 7.65 4.09 0.00 1.82 1.73 0.90 0.95 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 0.00 171 E 8.25 4.31 0.00 2.20 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 2.32 2.54 0.00 172 G 7.69 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 S 8.39 4.32 0.00 3.81 4.07 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 0.00 174 Q 7.73 4.68 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 175 S 8.27 4.72 0.00 3.94 3.83 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 0.00 176 V 8.17 3.96 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 0.97 0.00 0.00 1.00 0.00 0.00 177 Q 8.12 4.59 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.65 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 178 A 8.81 4.14 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 0.00 179 G 8.11 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 0.00 180 T 7.96 3.91 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 181 Y 8.78 4.15 0.00 3.21 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 0.00 182 E 7.94 4.17 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.55 0.00 183 L 7.72 4.68 0.00 1.51 1.54 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 184 L 7.27 4.31 0.00 1.50 1.58 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 185 D 8.09 4.37 0.00 2.73 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 P 0.00 4.16 0.00 2.25 2.37 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 187 L 7.90 3.84 0.00 1.74 1.81 0.90 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 188 A 7.87 3.95 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.54 3.59 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.99 0.89 0.00 0.00 190 K 8.58 3.89 0.00 1.82 1.95 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.47 7.81 191 I 8.15 3.66 1.94 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.62 0.94 0.00 0.00 192 V 7.94 3.67 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 0.75 0.00 0.00 1.00 0.00 0.00 193 E 8.27 3.97 0.00 2.22 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 194 R 7.95 4.09 0.00 1.97 2.05 0.00 3.01 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.65 0.00 195 S 7.77 4.55 0.00 3.94 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 0.00 196 K 7.25 3.78 0.00 1.88 1.81 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.38 7.81 197 I 7.74 4.53 1.84 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 1.40 0.66 0.92 0.00 0.00 198 R 8.97 4.20 0.00 1.75 1.84 0.00 3.07 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.58 0.00 199 V 8.33 4.78 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 1.03 0.00 0.00 0.95 0.00 0.00 200 I 8.83 4.61 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.77 0.87 0.00 0.00 201 V 9.13 4.64 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 0.95 0.00 0.00 0.90 0.00 0.00 202 M 8.91 5.21 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 203 N 8.76 5.05 0.00 2.79 2.66 0.00 0.00 7.44 7.56 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 0.00 204 Y 8.15 4.34 0.00 3.20 3.18 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 0.00 205 R 8.42 4.20 0.00 1.88 2.09 0.00 3.12 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 206 K 8.05 4.69 0.00 1.94 1.78 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.38 7.81 207 L 7.85 4.02 0.00 1.79 1.73 0.86 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 208 N 8.18 4.58 0.00 2.84 2.96 0.00 0.00 5.89 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 0.00 209 R 8.13 4.57 0.00 1.96 1.92 0.00 3.15 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 210 I 7.60 3.65 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 1.47 0.75 0.76 0.00 0.00 211 I 7.61 3.53 1.84 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.79 0.90 0.00 0.00 212 D 8.01 4.42 0.00 2.67 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 0.00 213 I 7.73 3.69 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.85 0.87 0.00 0.00 214 L 7.79 3.98 0.00 1.71 1.72 0.50 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 215 K 7.84 4.23 0.00 1.89 1.89 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.66 7.81 216 G 7.99 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 0.00 217 E 8.64 4.59 0.00 1.91 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.22 0.00 218 E 7.63 4.67 0.00 1.82 1.73 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 2.17 2.32 0.00 219 V 8.38 3.55 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 0.81 0.00 0.00 0.91 0.00 0.00 220 S 7.38 4.90 0.00 4.00 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 0.00 221 S 8.25 4.89 0.00 3.66 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 0.00 222 I 8.52 4.79 1.88 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 1.19 0.88 0.94 0.00 0.00 223 I 8.73 4.76 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.99 0.88 0.00 0.00 224 E 9.36 4.69 0.00 2.09 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 2.28 2.29 0.00 225 P 0.00 4.69 0.00 2.06 2.18 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.90 0.00 226 V 8.26 4.01 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 0.67 0.00 0.00 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.