NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3801 8.3001 120.3227 55.4359 34.2045 176.6024 2 A 3.6559 7.9218 120.5947 52.8682 18.6604 176.6488 3 S 4.3359 8.0414 109.6987 58.6705 64.4642 172.1209 4 K 4.3217 8.2894 120.7360 54.7550 35.1186 173.1578 5 P 4.3338 0.0000 0.0000 62.9675 32.0621 177.3563 6 I 3.7656 8.5328 123.1372 64.6016 37.1899 177.8410 7 E 4.1889 8.1129 117.4982 58.2660 29.5672 177.0248 8 D 4.5993 8.1059 118.5463 54.3758 41.3945 175.6601 9 Y 4.2446 7.8384 121.8672 59.3483 39.0980 176.5007 10 G 3.5971 8.4940 114.9477 45.2419 0.0000 174.3398 11 K 4.2904 7.9211 118.1143 55.7618 32.8959 176.9283 12 G 3.8620 7.9605 106.7812 45.9339 0.0000 173.0956 13 K 4.0047 8.0839 120.5238 57.0169 32.6605 176.5805 14 G 3.8518 8.8344 113.6296 46.0561 0.0000 173.5726 15 R 4.0801 7.4035 115.6631 55.1686 30.3909 175.8211 16 I 4.1790 7.8576 119.6138 59.8457 37.9998 176.1781 17 E 4.0576 8.6327 125.3765 55.7875 29.8860 174.9554 18 P 4.6418 0.0000 0.0000 62.3280 32.9235 175.3936 19 M 4.1662 8.4137 120.5718 55.8905 33.2948 174.1655 20 Y 4.6434 8.6691 127.3031 56.5318 40.0462 174.5187 21 I 4.2611 7.7884 128.8249 58.9092 38.0150 174.4769 22 P 4.3087 0.0000 0.0000 61.8962 31.9445 176.2517 23 D 4.3281 8.5946 120.1908 55.8076 41.3668 176.1278 24 N 4.3076 8.3985 116.0167 55.0172 36.7989 175.4692 25 T 4.3232 7.1234 113.8895 61.9286 69.7440 174.0126 26 F 4.9032 8.1099 123.6490 56.1494 43.4361 173.8832 27 Y 4.7169 9.3059 118.7722 56.7771 40.6468 174.7051 28 N 4.8952 8.9297 118.7426 52.8562 39.5783 176.2713 29 A 4.2169 9.2607 127.4303 55.5855 18.6769 179.3589 30 D 4.5471 8.1886 114.0189 57.0674 40.9429 176.8477 31 D 4.5379 8.2415 117.3011 54.5054 41.0332 175.6420 32 F 4.7029 7.9970 117.5942 55.0682 42.0934 174.4726 33 L 4.3482 8.5817 123.9159 54.2741 41.8908 175.8718 34 V 4.6673 8.2922 126.5662 60.0619 33.2658 173.4723 35 P 4.5329 0.0000 0.0000 62.0326 31.9582 175.2252 36 P 4.2468 0.0000 0.0000 66.3809 31.0255 178.5400 37 H 4.5406 8.4132 111.4752 57.9761 28.8152 176.1521 38 C 4.8349 8.0474 119.0716 60.4922 28.9853 175.4741 39 K 3.7330 7.4937 120.3164 59.2843 31.4321 176.8580 40 P 3.8405 0.0000 0.0000 64.9475 31.2506 176.6356 41 Y 4.6202 7.4067 113.3541 57.8066 38.6638 175.3170 42 I 4.3599 7.0763 121.1025 59.5508 39.2116 174.4944 43 D 4.8566 8.6773 123.5359 54.7914 44.2882 176.1072 44 K 4.9837 7.7898 116.7223 54.4900 35.8648 175.2861 45 I 4.5901 8.7505 125.7932 60.1862 38.3406 176.2220 46 L 3.9782 9.0802 130.5624 57.4006 42.8040 176.9224 47 L 4.5787 7.5140 120.5960 51.9041 45.0134 174.3903 48 P 4.2016 0.0000 0.0000 62.4726 32.2301 177.8974 49 G 3.9147 8.5018 109.8759 47.4177 0.0000 176.2984 50 G 3.6694 8.0713 107.5188 47.3431 0.0000 175.3987 51 L 4.0396 7.8946 122.2114 57.8766 42.1109 178.7587 52 V 3.9093 7.8111 118.2789 66.4342 31.4376 178.2194 53 K 4.1643 8.0671 117.8476 59.5917 31.7345 179.1167 54 D 4.3754 8.3118 119.2655 57.3892 40.6905 178.8745 55 R 3.8087 8.2158 119.2576 59.3140 29.9918 178.7329 56 V 3.7105 8.2575 118.5153 65.7619 31.5107 177.6189 57 E 2.7497 7.9392 119.2277 58.6392 29.3842 178.7690 58 K 3.8940 7.6322 119.5388 59.4154 32.2788 178.5828 59 L 4.0365 8.0740 119.1526 57.9576 41.6088 179.3305 60 A 3.9405 8.2817 120.8640 55.4007 18.2938 179.0384 61 Y 4.0001 8.0804 117.8998 60.9089 38.8658 178.0265 62 D 4.4137 8.2804 119.8365 57.5037 40.9745 178.8889 63 I 3.3527 8.0202 120.7319 64.3280 36.4684 177.9109 64 H 4.1685 8.6060 119.5508 59.3676 29.4352 177.6117 65 R 3.8051 7.5938 118.6648 59.3753 29.9498 178.7804 66 T 3.9198 7.6828 114.3477 66.4417 68.7299 175.4858 67 Y 4.6447 7.6965 116.2027 56.3652 38.1599 175.0690 68 F 4.0442 7.2393 122.0634 59.9908 39.6009 175.2877 69 G 3.3856 7.7602 114.6917 45.9067 0.0000 172.6278 70 E 4.7318 7.7255 117.3900 53.6402 32.8143 175.4683 71 E 4.1549 8.7668 122.6644 55.9995 30.5029 175.6352 72 L 4.6366 8.4896 127.3583 53.6188 45.2721 174.3606 73 H 5.3712 9.1187 124.3364 54.5289 30.6469 173.6585 74 I 4.9018 8.7654 124.6254 59.1845 40.5340 174.0718 75 I 4.7809 8.7540 130.4774 59.6715 39.5746 174.1023 76 C 4.1674 8.3627 128.8107 58.3236 32.8314 172.4825 77 I 4.4415 8.1462 127.7805 60.2073 37.0721 175.6114 78 L 4.4076 9.2559 128.5954 54.5026 42.7046 178.7202 79 K 3.8422 8.7194 120.2899 58.6225 32.9010 179.5290 80 G 4.0892 8.1986 106.4027 48.1073 0.0000 174.5756 81 S 4.3666 8.2881 114.7971 59.7506 63.2973 176.1603 82 R 4.0388 7.9444 121.0591 59.6734 29.7416 178.1490 83 G 3.5891 8.0231 104.4882 47.7938 0.0000 175.1341 84 F 4.4413 8.2024 123.2589 60.8759 39.5274 176.6854 85 F 3.6852 8.6796 120.6389 61.3706 39.2969 176.8489 86 N 4.2370 8.5182 116.1693 56.1363 38.3274 177.4423 87 L 3.8532 7.9944 120.3853 57.5787 41.7500 179.2169 88 L 3.9420 8.0372 120.8456 58.2393 41.9998 179.1798 89 I 3.2938 7.1658 112.8457 63.5515 37.2974 177.9238 90 D 4.2280 7.6646 120.3115 57.4704 40.6589 178.3236 91 Y 4.1874 7.8057 117.1376 60.9765 37.8525 178.4494 92 L 4.0240 8.4373 120.1799 57.8324 41.6674 179.5101 93 A 3.9909 8.1192 120.6042 55.5208 18.3342 179.8954 94 T 3.4834 7.8875 114.2846 66.5120 68.4429 177.1434 95 I 3.7141 8.2605 122.1749 64.3578 36.9281 178.1930 96 Q 4.0043 7.8171 119.0958 59.1478 28.9716 177.8799 97 K 4.0464 7.9617 119.5753 59.4211 32.3243 177.5138 98 Y 4.7514 7.7512 114.1814 57.3561 38.4679 176.1770 99 S 4.3032 7.6650 116.6441 58.4155 63.5077 175.4995 100 G 3.4538 8.6709 111.2279 46.6380 0.0000 173.2827 101 R 4.4094 7.3299 120.1045 54.2499 30.7406 174.7866 102 E 4.5794 8.5528 123.2223 55.6230 31.1607 175.7903 103 S 4.6184 8.1309 113.0528 56.9685 65.4151 173.8176 104 S 4.4600 8.5870 119.3395 58.3554 63.4433 173.7441 105 V 4.1595 7.3112 121.9318 60.5749 32.2823 173.9136 106 P 4.1816 0.0000 0.0000 61.7797 31.6938 175.6057 107 P 4.2431 0.0000 0.0000 65.4905 31.3406 175.6526 108 F 4.6468 5.7445 112.0346 56.2984 41.3476 173.4074 109 F 4.8774 8.7858 117.6690 55.5775 41.8628 174.6006 110 E 5.0199 9.1874 122.2567 56.2914 31.1602 175.5368 111 H 5.0394 8.6598 117.5663 54.6402 33.8807 171.9040 112 Y 5.0293 8.5807 117.6150 56.4362 41.2747 175.2486 113 V 4.7300 8.8496 115.6486 59.6122 36.9876 174.2781 114 R 4.7200 8.7803 122.9804 54.6203 32.4640 174.1697 115 L 5.2175 8.0214 126.1129 52.8221 44.4080 176.3124 116 K 4.4653 8.6117 122.4410 54.8976 34.8610 175.1810 117 S 5.0370 8.5142 121.3843 57.4702 64.9152 174.3327 118 Y 4.5462 9.0697 121.0414 56.2902 40.1581 173.2661 119 Q 4.3956 8.4192 122.2681 53.6801 31.4440 175.0587 *125 G 3.8963 9.0116 112.3916 44.5806 0.0000 173.2520 126 Q 4.9237 5.8330 115.8827 54.0850 33.2938 175.8647 127 L 5.4966 8.6666 121.9521 53.9057 44.6966 175.7818 128 T 4.6311 9.0865 123.1312 62.7331 70.6572 173.9709 129 V 4.5695 8.2878 123.4061 61.0973 34.6967 174.3209 130 L 4.7759 8.5138 130.3317 54.0192 43.7610 174.9504 131 S 4.8994 8.1952 118.9441 57.6273 65.6896 174.4532 132 D 4.6463 8.6765 121.1127 53.4011 41.3405 175.6927 133 D 4.4210 8.4437 119.2811 54.9094 41.5474 176.8237 134 L 4.1553 8.5784 125.3794 56.3454 42.3586 178.9728 135 S 4.0858 8.3611 114.7874 61.1000 62.4147 175.9834 136 I 3.3597 6.7493 121.4401 63.9562 37.7673 176.8816 137 F 4.5022 7.7889 116.7275 56.8901 38.8769 175.3237 138 R 4.2616 7.4154 119.4850 57.2339 30.0967 175.4110 139 D 4.4252 8.9237 123.0396 54.8264 40.5696 172.9418 140 K 4.6900 7.7179 116.4686 54.6971 35.4742 175.1733 141 H 4.9392 8.6711 119.4403 54.8728 30.0424 174.3808 142 V 4.8915 9.0347 124.3892 60.8414 34.3307 173.9918 143 L 5.2428 8.9115 129.7612 53.4381 44.6751 174.9559 144 I 4.5119 9.0480 128.9649 60.4891 39.0707 175.1029 145 V 4.8823 8.9139 127.9888 61.2826 33.4002 174.0030 146 E 5.2672 9.6776 129.1003 53.4608 32.6961 176.1929 147 D 4.5078 8.9924 125.5358 56.2034 40.3748 175.6418 148 I 5.0638 7.6331 117.4439 58.0189 41.6957 173.4691 149 V 3.9349 8.5507 127.5823 62.1699 32.9749 173.4311 150 D 4.8192 9.1206 126.6404 55.1959 43.5977 176.3775 151 T 4.0887 8.1548 111.5376 62.6871 70.3865 177.2276 152 G 3.9651 8.4390 110.5349 45.3573 0.0000 174.7992 153 F 4.1548 8.1578 122.8325 61.0824 39.2988 176.8361 154 T 3.7673 8.2115 114.5140 67.0042 68.2458 176.3663 155 L 4.3187 7.9543 120.0673 57.4410 41.3664 179.5560 156 T 3.9843 7.9250 110.4630 64.9203 68.8795 176.5001 157 E 3.9925 7.9179 120.7007 58.0909 29.7514 178.6098 158 F 4.4698 8.2546 122.3959 60.9268 39.3189 177.2453 159 G 3.2808 8.3319 105.7922 47.8211 0.0000 175.4869 160 E 3.8764 8.1346 121.1603 59.1545 29.2338 179.7659 161 R 3.8663 7.4910 116.6793 58.7456 30.3364 178.5476 162 L 3.8769 7.3036 120.4263 57.7863 42.0722 178.8732 163 K 3.7881 7.9982 118.3996 59.4315 31.6777 179.0117 164 A 4.0028 7.4792 120.2617 54.6710 18.1416 179.0749 165 V 3.9708 7.9023 109.1789 60.3099 33.0790 175.4070 166 G 3.8885 8.0913 107.7843 45.6314 0.0000 171.7522 167 P 4.9226 0.0000 0.0000 62.4563 32.7300 177.2544 168 K 4.2718 8.6674 121.7703 59.3858 32.7015 177.1032 169 S 4.8596 7.8369 112.2447 57.3156 66.6994 172.9043 170 M 4.9901 8.6152 119.8256 54.0063 35.2612 174.7905 171 R 5.1126 9.6123 121.8063 54.6179 35.6098 173.9838 172 I 5.2333 9.5774 120.7205 59.5955 40.6132 174.6141 173 A 5.5191 9.6298 128.3141 50.5539 21.7751 175.0202 174 T 5.8244 9.0560 116.7060 59.2448 70.8862 174.5298 175 L 3.4936 8.4215 129.8687 57.3672 43.4119 176.6487 176 V 5.1694 7.9504 117.4862 60.8815 35.5669 174.0619 177 E 5.1728 9.3456 124.0520 54.5002 32.3916 175.0523 178 K 4.7265 8.6725 122.6285 55.6824 33.7786 177.1042 179 R 4.4097 8.6680 123.7303 55.5958 30.2316 175.8095 180 T 4.7596 8.2298 120.5031 61.0217 70.9490 174.7558 181 D 4.6671 8.9426 124.8478 54.7121 40.1899 176.9859 182 R 4.3646 7.7696 116.1074 57.4531 30.5430 176.8202 183 S 4.4856 7.6155 113.9260 58.1050 62.8054 173.4674 184 N 4.6060 8.8765 123.9971 53.1482 37.4086 176.0228 185 S 4.3084 8.4541 113.7950 57.9469 62.3287 168.8998 186 L 4.2135 8.4873 124.2784 55.1197 42.2804 175.8597 187 K 4.6959 8.6751 124.7689 54.9845 35.8387 175.9485 188 G 3.9171 7.8491 109.2055 45.8519 0.0000 173.5775 189 D 4.4283 8.7075 119.9127 55.7243 41.9959 176.9054 190 F 4.7893 8.1426 117.1836 55.6553 41.7161 174.0248 191 V 5.2437 7.7465 123.3044 60.1973 33.3680 175.3225 192 G 3.4895 8.8279 115.9238 48.6405 0.0000 172.7874 193 F 5.4236 8.6888 119.6526 55.0133 44.1932 173.0397 194 S 5.2755 9.0708 117.1771 56.6825 64.2211 173.0213 195 I 4.8531 8.3060 119.9175 58.4746 41.4690 174.4627 196 E 4.3145 8.3524 121.0747 55.9447 30.8713 177.2818 197 D 4.7003 8.4327 120.2956 53.0948 39.2529 175.2785 198 V 4.5755 7.6600 114.5398 58.4064 35.9331 174.6692 199 W 4.6098 8.5931 131.6220 56.5422 31.7552 175.1874 200 I 4.7370 7.4906 120.2448 59.5411 39.7573 174.7772 201 V 4.7835 8.7846 115.7956 60.5173 36.6599 176.0744 202 G 4.9246 9.0981 106.5289 48.4419 0.0000 173.0058 203 C 4.1822 9.6745 115.0661 60.9291 26.0938 174.4039 204 C 3.9272 8.2853 116.6163 59.9907 27.6397 174.3300 205 Y 4.2649 7.4984 118.2701 57.6848 37.8887 174.5824 206 D 5.6925 8.7164 122.4220 51.4717 42.7455 175.2322 207 F 4.9811 8.7016 120.2040 57.1426 40.5559 174.0887 208 N 4.0612 9.2453 128.1326 54.4019 35.6652 175.5453 209 E 3.8344 9.1188 114.8757 56.7889 28.5803 174.6646 210 M 4.0614 7.6979 119.0378 54.9154 33.9651 176.5991 211 F 4.0731 7.9693 118.9506 57.6949 37.1954 177.2385 212 R 4.1621 8.0006 121.0256 59.3518 29.9277 177.8103 213 D 4.6440 8.0582 114.3062 53.9475 40.2812 176.2007 214 F 4.6366 8.3478 124.5783 58.4832 39.8496 175.4850 215 D 4.4181 8.4459 126.6882 56.0706 41.2064 175.1581 216 H 4.8561 5.7014 115.4742 53.3974 33.2032 172.5852 217 V 4.5883 8.5376 120.5953 62.2303 32.6349 174.8673 218 A 5.2606 9.5236 128.8699 50.3659 23.3179 174.5224 219 V 4.0402 8.3581 112.3200 61.5876 32.6799 176.1384 220 L 2.7672 8.1113 115.8342 54.7085 41.8610 177.6961 221 S 4.6985 9.0613 114.6662 57.6876 63.5456 172.5426 222 D 4.3119 8.8539 123.7875 57.7949 40.7418 178.1580 223 A 4.0162 8.2032 120.1520 55.6430 18.2633 179.0937 224 A 4.1868 8.5216 117.5397 55.3569 18.6310 180.0059 225 R 3.7005 8.1451 118.8602 59.9980 29.8588 179.8535 226 K 3.9898 7.6759 122.0967 59.7656 31.8816 180.6914 227 K 4.0029 8.0155 119.8338 58.3592 32.1054 177.6948 228 F 4.9340 7.9809 117.1049 57.5345 39.8573 175.9535 229 E 4.2615 8.4368 120.6550 56.2064 29.5215 181.6143 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 8.30 4.38 0.00 1.94 2.27 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 2 A 7.92 3.66 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 3 S 8.04 4.34 0.00 4.03 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 4 K 8.29 4.32 0.00 1.69 1.72 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.42 7.81 5 P 0.00 4.33 0.00 2.23 2.12 0.00 3.75 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.13 0.00 6 I 8.53 3.77 1.87 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 1.42 0.95 0.87 0.00 0.00 7 E 8.11 4.19 0.00 1.96 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 0.00 2.32 2.41 0.00 8 D 8.11 4.60 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 9 Y 7.84 4.24 0.00 2.91 2.97 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 10 G 8.49 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 11 K 7.92 4.29 0.00 1.91 1.84 0.00 1.85 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.36 7.81 12 G 7.96 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 13 K 8.08 4.00 0.00 1.70 1.70 0.00 1.86 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.41 7.81 14 G 8.83 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 15 R 7.40 4.08 0.00 1.95 1.88 0.00 3.12 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 16 I 7.86 4.18 1.89 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 1.42 0.57 0.92 0.00 0.00 17 E 8.63 4.06 0.00 1.95 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 2.30 2.23 0.00 18 P 0.00 4.64 0.00 2.05 2.17 0.00 3.79 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 2.03 2.11 0.00 19 M 8.41 4.17 0.00 2.05 1.82 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 2.65 2.61 0.00 20 Y 8.67 4.64 0.00 2.98 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 21 I 7.79 4.26 1.64 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.89 0.67 0.00 0.00 22 P 0.00 4.31 0.00 2.02 2.08 0.00 3.63 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 2.06 2.29 0.00 23 D 8.59 4.33 0.00 2.66 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 24 N 8.40 4.31 0.00 2.85 2.95 0.00 0.00 6.80 7.24 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 25 T 7.12 4.32 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 1.02 0.00 0.00 26 F 8.11 4.90 0.00 2.82 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 27 Y 9.31 4.72 0.00 3.02 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 28 N 8.93 4.90 0.00 2.95 2.83 0.00 0.00 6.71 7.18 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 29 A 9.26 4.22 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 30 D 8.19 4.55 0.00 2.73 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 31 D 8.24 4.54 0.00 2.68 2.40 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 32 F 8.00 4.70 0.00 3.03 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 33 L 8.58 4.35 0.00 1.67 1.72 0.99 0.91 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 34 V 8.29 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 0.81 0.00 0.00 1.21 0.00 0.00 35 P 0.00 4.53 0.00 2.36 2.29 0.00 3.96 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 36 P 0.00 4.25 0.00 2.24 2.20 0.00 3.69 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 2.17 2.21 0.00 37 H 8.41 4.54 0.00 3.39 3.50 0.00 5.50 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 C 8.05 4.83 0.00 2.77 2.58 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 39 K 7.49 3.73 0.00 1.83 1.77 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.51 7.81 40 P 0.00 3.84 0.00 0.49 1.58 0.00 3.47 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 1.69 1.88 0.00 41 Y 7.41 4.62 0.00 3.21 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 42 I 7.08 4.36 1.68 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.05 0.88 0.00 0.00 43 D 8.68 4.86 0.00 2.45 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 K 7.79 4.98 0.00 1.19 1.34 0.00 0.92 0.00 0.00 1.46 0.00 0.00 2.20 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 1.09 7.81 45 I 8.75 4.59 1.87 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 1.10 0.25 0.44 0.00 0.00 46 L 9.08 3.98 0.00 1.73 1.75 0.43 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.51 4.58 0.00 1.31 1.13 -0.09 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 48 P 0.00 4.20 0.00 2.08 1.99 0.00 3.53 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 1.55 1.67 0.00 49 G 8.50 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 50 G 8.07 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 51 L 7.89 4.04 0.00 1.81 1.87 1.08 1.00 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 52 V 7.81 3.91 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 1.17 0.00 0.00 0.88 0.00 0.00 53 K 8.07 4.16 0.00 2.11 2.03 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.56 1.72 7.81 54 D 8.31 4.38 0.00 2.91 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 55 R 8.22 3.81 0.00 1.97 2.04 0.00 2.94 0.00 0.00 2.68 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.30 0.00 56 V 8.26 3.71 2.32 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 1.30 0.00 0.00 1.25 0.00 0.00 57 E 7.94 2.75 0.00 1.26 1.80 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 1.98 1.64 0.00 58 K 7.63 3.89 0.00 1.78 1.92 0.00 1.65 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.53 7.81 59 L 8.07 4.04 0.00 1.94 1.81 1.09 0.89 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 60 A 8.28 3.94 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 61 Y 8.08 4.00 0.00 3.03 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 62 D 8.28 4.41 0.00 3.06 2.97 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 63 I 8.02 3.35 1.74 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 -0.36 0.83 0.00 0.00 64 H 8.61 4.17 0.00 3.21 3.33 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 R 7.59 3.81 0.00 1.85 1.87 0.00 3.12 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.27 0.00 66 T 7.68 3.92 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 0.51 0.00 0.00 67 Y 7.70 4.64 0.00 3.07 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 68 F 7.24 4.04 0.00 2.99 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 69 G 7.76 3.39 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 70 E 7.73 4.73 0.00 2.20 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 2.38 2.35 0.00 71 E 8.77 4.15 0.00 2.04 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 2.52 2.65 0.00 72 L 8.49 4.64 0.00 1.45 1.33 -0.06 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 73 H 9.12 5.37 0.00 3.48 3.58 0.00 5.63 0.00 0.00 0.00 0.00 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.77 4.90 1.79 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.64 0.88 0.00 0.00 75 I 8.75 4.78 1.84 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.47 0.87 0.00 0.00 76 C 8.36 4.17 0.00 1.23 1.88 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 77 I 8.15 4.44 1.94 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.97 0.83 0.00 0.00 78 L 9.26 4.41 0.00 1.67 1.56 0.88 0.59 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 79 K 8.72 3.84 0.00 1.82 1.84 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.42 7.81 80 G 8.20 4.09 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 0.00 0.00 0.00 81 S 8.29 4.37 0.00 4.09 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 82 R 7.94 4.04 0.00 2.01 1.96 0.00 3.29 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.86 0.00 83 G 8.02 3.59 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 0.00 84 F 8.20 4.44 0.00 3.06 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 85 F 8.68 3.69 0.00 3.01 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 86 N 8.52 4.24 0.00 2.98 2.84 0.00 0.00 7.09 6.60 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 87 L 7.99 3.85 0.00 1.98 1.88 1.07 0.23 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 88 L 8.04 3.94 0.00 1.38 1.28 0.81 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.17 3.29 0.56 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 1.15 0.18 -0.73 0.00 0.00 90 D 7.66 4.23 0.00 2.70 2.50 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 91 Y 7.81 4.19 0.00 3.15 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 92 L 8.44 4.02 0.00 1.80 1.82 0.73 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.12 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 94 T 7.89 3.48 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 0.78 0.00 0.00 95 I 8.26 3.71 1.92 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.82 0.75 0.00 0.00 96 Q 7.82 4.00 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.95 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 97 K 7.96 4.05 0.00 1.75 1.71 0.00 1.88 0.00 0.00 1.65 0.00 0.00 2.73 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.51 1.50 7.81 98 Y 7.75 4.75 0.00 2.97 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 99 S 7.66 4.30 0.00 4.09 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 0.00 100 G 8.67 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 0.00 0.00 0.00 101 R 7.33 4.41 0.00 1.47 1.64 0.00 2.99 0.00 0.00 2.47 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.46 0.00 102 E 8.55 4.58 0.00 2.17 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 2.31 2.34 0.00 103 S 8.13 4.62 0.00 3.62 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 0.00 104 S 8.59 4.46 0.00 4.00 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 0.00 105 V 7.31 4.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.89 0.00 0.00 106 P 0.00 4.18 0.00 1.30 1.44 0.00 3.59 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.92 0.00 107 P 0.00 4.24 0.00 2.26 2.21 0.00 3.27 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 1.25 1.74 0.00 108 F 5.74 4.65 0.00 2.92 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 0.00 109 F 8.79 4.88 0.00 2.91 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 0.00 110 E 9.19 5.02 0.00 2.10 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.59 0.00 111 H 8.66 5.04 0.00 3.21 3.40 0.00 5.56 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 0.00 112 Y 8.58 5.03 0.00 2.80 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 0.00 113 V 8.85 4.73 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 0.86 0.00 0.00 0.55 0.00 0.00 114 R 8.78 4.72 0.00 1.89 1.86 0.00 3.21 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 115 L 8.02 5.22 0.00 1.32 1.48 0.55 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.61 4.47 0.00 1.75 1.74 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.34 1.40 7.81 117 S 8.51 5.04 0.00 3.82 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 0.00 118 Y 9.07 4.55 0.00 3.08 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 0.00 119 Q 8.42 4.40 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 *125 G 9.01 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 0.00 0.00 0.00 126 Q 5.83 4.92 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 127 L 8.67 5.50 0.00 1.74 1.82 1.17 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 128 T 9.09 4.63 4.39 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 1.28 0.00 0.00 129 V 8.29 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 1.01 0.00 0.00 130 L 8.51 4.78 0.00 1.81 1.52 0.94 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.20 4.90 0.00 3.97 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 0.00 132 D 8.68 4.65 0.00 2.73 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 0.00 133 D 8.44 4.42 0.00 2.74 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.58 4.16 0.00 1.82 1.85 1.00 1.23 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 0.00 135 S 8.36 4.09 0.00 4.02 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 0.00 136 I 6.75 3.36 1.53 0.00 0.00 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 1.01 0.53 -0.22 0.00 0.00 137 F 7.79 4.50 0.00 3.29 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 0.00 138 R 7.42 4.26 0.00 1.84 1.84 0.00 3.20 0.00 0.00 2.98 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 139 D 8.92 4.43 0.00 2.79 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 0.00 140 K 7.72 4.69 0.00 2.00 1.74 0.00 1.80 0.00 0.00 1.22 0.00 0.00 2.63 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.31 1.33 7.81 141 H 8.67 4.94 0.00 3.39 3.46 0.00 5.84 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 9.03 4.89 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 0.69 0.00 0.00 0.88 0.00 0.00 143 L 8.91 5.24 0.00 1.68 1.40 1.29 0.79 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 0.00 144 I 9.05 4.51 2.07 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.62 1.10 0.00 0.00 145 V 8.91 4.88 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 0.82 0.00 0.00 0.94 0.00 0.00 146 E 9.68 5.27 0.00 2.18 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 2.26 2.27 0.00 147 D 8.99 4.51 0.00 2.71 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 I 7.63 5.06 1.85 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.30 0.88 0.00 0.00 149 V 8.55 3.93 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 0.90 0.00 0.00 0.97 0.00 0.00 150 D 9.12 4.82 0.00 2.63 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 0.00 151 T 8.15 4.09 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 1.34 0.00 0.00 152 G 8.44 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 0.00 0.00 0.00 153 F 8.16 4.15 0.00 3.23 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 T 8.21 3.77 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 1.23 0.00 0.00 155 L 7.95 4.32 0.00 1.74 1.86 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 156 T 7.93 3.98 4.27 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 1.29 0.00 0.00 157 E 7.92 3.99 0.00 2.16 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 1.47 1.94 0.00 158 F 8.25 4.47 0.00 3.09 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 0.00 159 G 8.33 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 E 8.13 3.88 0.00 2.09 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 2.52 2.50 0.00 161 R 7.49 3.87 0.00 1.84 1.95 0.00 3.23 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 162 L 7.30 3.88 0.00 1.19 1.29 0.54 -0.01 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 0.00 163 K 8.00 3.79 0.00 1.83 1.76 0.00 1.95 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.46 7.81 164 A 7.48 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 V 7.90 3.97 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 0.94 0.00 0.00 1.05 0.00 0.00 166 G 8.09 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 0.00 167 P 0.00 4.92 0.00 2.32 2.03 0.00 3.70 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 1.91 1.81 0.00 168 K 8.67 4.27 0.00 1.77 1.82 0.00 1.73 0.00 0.00 1.52 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.35 7.81 169 S 7.84 4.86 0.00 4.02 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 0.00 170 M 8.62 4.99 0.00 1.76 1.91 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 171 R 9.61 5.11 0.00 2.03 2.07 0.00 3.43 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 172 I 9.58 5.23 1.87 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.88 1.00 0.00 0.00 173 A 9.63 5.52 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 0.00 174 T 9.06 5.82 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 0.00 175 L 8.42 3.49 0.00 0.65 1.65 0.83 0.77 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 0.00 176 V 7.95 5.17 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 0.84 0.00 0.00 0.92 0.00 0.00 177 E 9.35 5.17 0.00 1.98 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 2.33 2.24 0.00 178 K 8.67 4.73 0.00 1.64 1.74 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.65 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 1.30 7.81 179 R 8.67 4.41 0.00 1.65 1.92 0.00 3.23 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 180 T 8.23 4.76 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 1.34 0.00 0.00 181 D 8.94 4.67 0.00 2.74 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.77 4.36 0.00 1.86 2.04 0.00 3.17 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 183 S 7.62 4.49 0.00 3.82 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 0.00 184 N 8.88 4.61 0.00 2.92 2.98 0.00 0.00 7.18 8.44 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 0.00 185 S 8.45 4.31 0.00 4.12 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 0.00 186 L 8.49 4.21 0.00 1.58 1.71 0.81 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 187 K 8.68 4.70 0.00 1.65 1.69 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.41 7.81 188 G 7.85 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 0.00 189 D 8.71 4.43 0.00 2.39 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 0.00 0.00 0.00 0.00 190 F 8.14 4.79 0.00 3.12 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 0.00 191 V 7.75 5.24 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 0.75 0.00 0.00 0.98 0.00 0.00 192 G 8.83 3.49 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 0.00 193 F 8.69 5.42 0.00 2.89 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 0.00 194 S 9.07 5.28 0.00 3.92 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 0.00 195 I 8.31 4.85 1.68 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.00 0.75 0.00 0.00 196 E 8.35 4.31 0.00 1.96 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 2.16 2.29 0.00 197 D 8.43 4.70 0.00 2.99 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 0.00 198 V 7.66 4.58 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 0.99 0.00 0.00 199 W 8.59 4.61 0.00 3.47 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 0.00 200 I 7.49 4.74 1.55 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.11 0.69 0.00 0.00 201 V 8.78 4.78 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.65 0.00 0.00 202 G 9.10 4.92 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 0.00 203 C 9.67 4.18 0.00 3.08 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 C 8.29 3.93 0.00 2.89 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 0.00 205 Y 7.50 4.26 0.00 3.16 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 0.00 206 D 8.72 5.69 0.00 2.96 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 0.00 207 F 8.70 4.98 0.00 3.34 3.26 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 0.00 208 N 9.25 4.06 0.00 2.37 2.69 0.00 0.00 7.25 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 E 9.12 3.83 0.00 2.04 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 0.00 2.18 2.35 0.00 210 M 7.70 4.06 0.00 1.57 1.25 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.81 0.00 211 F 7.97 4.07 0.00 3.44 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 R 8.00 4.16 0.00 1.90 2.02 0.00 3.13 0.00 0.00 3.49 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.67 0.00 213 D 8.06 4.64 0.00 2.87 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 0.00 214 F 8.35 4.64 0.00 3.14 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 0.00 215 D 8.45 4.42 0.00 2.29 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 0.00 216 H 5.70 4.86 0.00 2.39 2.70 0.00 5.80 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 V 8.54 4.59 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 0.88 0.00 0.00 0.99 0.00 0.00 218 A 9.52 5.26 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 0.00 219 V 8.36 4.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.65 0.00 0.00 220 L 8.11 2.77 0.00 1.59 1.27 1.23 0.22 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 0.00 221 S 9.06 4.70 0.00 4.03 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 D 8.85 4.31 0.00 2.62 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 0.00 223 A 8.20 4.02 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 0.00 224 A 8.52 4.19 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 0.00 225 R 8.15 3.70 0.00 1.80 1.93 0.00 3.00 0.00 0.00 2.92 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.43 0.00 226 K 7.68 3.99 0.00 1.83 1.71 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.32 7.81 227 K 8.02 4.00 0.00 1.56 1.60 0.00 1.29 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.40 0.21 7.81 228 F 7.98 4.93 0.00 3.51 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 0.00 229 E 8.44 4.26 0.00 2.00 1.72 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 2.26 2.13 0.00 * Residues marked with a * may have inaccurate shift predictions.