NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 A 4.2211 8.3645 123.5703 51.4582 20.5804 177.3502 6 E 4.6184 7.5743 107.8941 54.4259 34.0624 176.6234 7 H 5.1041 9.0077 113.2302 56.0146 30.9051 173.0040 8 L 4.4702 7.9809 121.8567 54.0731 42.6732 177.3494 9 L 4.3574 8.2160 121.4489 54.1027 42.4026 177.3713 10 K 4.0901 8.5404 120.4655 56.0182 32.6208 175.4127 11 P 4.3922 0.0000 0.0000 62.3472 31.8723 176.4923 12 L 4.0995 8.3339 122.0946 54.1128 42.1444 175.7013 13 P 4.5179 0.0000 0.0000 61.9067 32.3740 177.1261 14 A 4.0207 8.5293 122.5667 55.3318 18.3472 178.7243 15 D 4.4414 8.0272 112.9175 53.8565 39.8555 176.5564 16 K 3.8242 7.7969 118.2834 57.7502 29.8854 176.0644 17 Q 4.4849 7.9864 119.8546 54.1752 28.5641 174.6495 18 I 3.8973 7.8998 124.7116 60.9664 38.7482 175.0123 19 E 4.6003 8.8466 127.0173 56.6270 30.2928 177.8057 20 T 3.9167 9.3188 122.9070 66.7163 68.6295 176.7727 21 G 3.4917 7.7820 106.8421 47.7160 0.0000 173.7348 22 P 4.3402 0.0000 0.0000 64.5056 31.3755 178.5900 23 F 4.2498 8.0999 119.2953 61.4925 39.4683 177.1940 24 L 3.7471 8.3365 118.9684 57.5432 41.1238 179.2299 25 E 3.8143 8.0371 118.2603 59.1177 29.9154 178.4884 26 A 4.0946 7.9162 120.6667 55.4474 18.6381 180.1006 27 V 3.7790 7.6620 110.3436 63.6598 31.3618 178.5865 28 S 4.2708 7.6114 113.1396 60.7014 62.8779 175.1482 29 H 4.6461 7.8756 118.4866 56.7419 29.0770 176.6517 30 L 4.5898 7.9979 122.2418 57.2276 41.9702 177.0361 31 P 4.5161 0.0000 0.0000 65.3849 31.2569 176.7474 32 P 4.5800 0.0000 0.0000 64.8766 31.2284 178.5045 33 F 4.2108 8.2292 116.3583 60.1314 38.6153 177.3859 34 F 4.3031 8.6510 116.8448 59.6277 38.1815 176.5913 35 D 4.6682 8.1738 118.4375 55.7542 41.0741 178.2058 36 C 4.4325 7.4142 112.9249 59.7629 29.4615 174.0481 37 L 4.2962 7.3889 120.3923 54.2725 44.3675 175.0113 38 G 4.3652 8.6655 110.2599 45.6893 0.0000 172.9042 39 S 4.4460 8.5427 120.5594 56.8152 63.8527 173.1554 40 P 4.3736 0.0000 0.0000 63.9325 31.1293 179.0091 41 V 3.4094 6.9772 118.9832 65.6217 31.5822 177.4135 42 F 4.6055 7.0630 116.1426 58.6850 38.7892 177.3977 43 T 3.7972 7.4225 115.7807 66.2272 68.0988 174.1053 44 P 3.9723 0.0000 0.0000 65.6681 31.3055 178.6911 45 I 3.7067 7.1649 117.7355 64.1198 37.1640 177.9312 46 K 2.6913 7.2259 119.7983 59.3574 31.8462 178.5437 47 A 4.1127 8.1732 120.9687 54.7097 18.0428 179.6866 48 V 3.5855 7.2952 116.5761 65.9570 31.7322 178.0911 49 I 4.0175 7.2941 118.1483 64.1368 37.4014 178.2327 50 S 4.1229 8.4050 114.3285 61.4385 62.2126 176.3432 51 G 3.6159 8.0178 108.4265 47.9787 0.0000 175.4036 52 N 4.4576 8.0983 118.3615 55.8700 38.5711 177.3870 53 I 3.7554 8.0189 121.5454 64.7674 37.2579 178.4539 54 T 3.8864 7.7988 116.0322 66.6520 68.1400 176.8342 55 K 4.0094 7.8976 120.1310 59.4672 31.9822 179.6045 56 I 3.7529 7.7854 120.0768 64.2275 36.9943 178.2155 57 K 3.9634 8.4781 120.6906 59.5805 31.7111 178.5296 58 A 3.9981 7.7546 119.8673 55.1303 18.1794 179.5690 59 V 3.5589 7.5031 116.7798 66.2768 31.7141 177.5463 60 Y 4.2080 8.1856 119.5388 61.0188 38.4048 177.9182 61 D 4.2616 8.3667 119.1619 57.3224 40.9400 178.5154 62 T 4.1182 7.4587 109.2232 64.1544 70.2011 174.5490 63 N 4.8506 8.0507 116.8169 51.8147 40.7993 172.3012 64 P 3.6526 0.0000 0.0000 65.1284 32.1836 178.9300 65 A 4.0444 7.9495 119.4518 55.0224 18.5267 178.5580 66 K 3.9109 7.8812 115.9423 58.6671 32.2739 177.3786 67 F 5.1509 7.5743 117.1414 56.9554 39.7150 177.1753 68 R 4.3763 8.6494 122.7311 58.2657 30.4617 175.8222 69 T 5.1260 7.5949 106.6154 59.4932 72.8524 174.8691 70 L 4.0750 8.4358 121.3033 57.7663 41.5319 179.6001 71 Q 3.9604 8.0699 119.2314 59.2007 28.9687 177.8336 72 N 4.6640 8.0932 118.7903 55.8025 38.6085 177.1753 73 I 4.1374 7.6934 120.5718 64.6858 37.2989 178.4893 74 L 4.4257 8.0843 120.8362 57.4028 41.3838 179.5027 75 E 3.7536 8.2914 117.6353 59.1742 29.5976 179.3629 76 V 3.5488 8.2611 119.6508 65.9323 31.3139 177.9780 77 E 4.3549 8.6061 118.3186 58.9783 29.4595 179.1198 78 K 3.0660 7.5837 119.9906 59.0691 31.8008 178.4359 79 E 3.8322 7.5440 117.8576 59.4635 29.6291 178.4366 80 M 4.0337 7.8423 117.5192 58.1209 32.2584 177.5618 81 Y 4.5704 8.4138 114.9888 55.9625 39.5546 177.2018 82 G 3.8994 8.6591 108.6325 46.6677 0.0000 177.8943 83 A 4.2362 8.8807 128.1364 54.0615 18.4884 178.8081 84 E 4.1090 8.1694 117.4202 58.4446 30.0084 176.8902 85 W 4.2826 8.0818 128.3410 56.8116 31.1781 173.5302 86 P 3.0391 0.0000 0.0000 62.0156 31.3319 176.4515 87 K 4.2280 7.3001 121.4144 54.5372 31.0353 176.3595 88 V 4.1428 7.2670 118.5447 61.5093 34.9104 174.9252 89 G 3.7420 8.5205 108.4660 45.5304 0.0000 175.1456 90 A 4.0879 8.7568 119.7202 54.9455 18.4705 179.8706 91 T 3.9406 8.4658 115.2650 66.7719 68.5312 176.5709 92 L 4.0790 8.0748 122.0660 57.9613 42.0461 178.7481 93 A 4.3391 7.7992 122.2862 54.7153 18.2947 179.4013 94 L 3.9924 8.3077 118.7951 58.1141 42.4762 178.6612 95 M 2.9406 7.9707 118.4652 57.9941 32.1570 178.1310 96 W 3.7824 7.9244 118.4626 59.0499 29.3048 178.4468 97 L 4.1140 8.2172 120.9676 57.9698 41.4828 179.1562 98 K 4.0547 8.2148 118.9482 59.9829 32.2780 179.4537 99 R 4.5266 6.8050 119.7179 58.4482 30.0132 179.0826 100 G 3.8078 8.2048 105.2487 47.9209 0.0000 175.8115 101 L 4.6487 8.5055 123.1944 57.0896 41.5934 179.5647 102 R 3.8977 8.5427 118.9876 59.2140 29.9505 178.1062 103 F 4.1960 8.6600 120.6203 61.6127 39.3207 177.0934 104 I 3.9435 8.2816 119.1472 64.5419 36.9558 178.0340 105 Q 4.2814 8.6287 120.3535 59.5700 28.8296 178.8012 106 V 3.5927 8.0547 119.2342 65.7029 31.6482 177.6758 107 F 4.0161 8.2391 120.6291 61.3357 39.1631 177.2103 108 L 3.6821 8.2663 118.8720 57.6545 41.3850 179.1692 109 Q 3.9082 8.4426 119.9845 59.1687 28.9424 178.2525 110 S 4.1910 8.0865 115.6290 60.9214 62.3929 176.3133 111 I 3.5601 7.2964 122.0359 64.6022 36.5800 178.3324 112 C 4.2110 7.9843 116.5158 62.4144 28.0081 174.9321 113 D 4.6783 8.1066 118.2011 53.7946 40.5848 176.7705 114 G 3.8496 7.7510 107.5332 46.2381 0.0000 173.7561 115 E 4.1074 8.0192 120.4274 55.8368 29.8546 176.5620 116 R 4.4809 7.9253 118.2582 55.1926 32.1887 173.6193 117 D 4.5669 8.4274 118.3371 53.3930 41.4093 176.7241 118 E 4.0386 8.8770 126.9870 59.5490 29.6634 178.3131 119 N 4.4613 8.4197 115.2544 55.7201 39.4106 175.2221 120 H 5.0335 8.0040 115.2146 53.5395 29.4424 172.3608 121 P 4.2996 0.0000 0.0000 64.9903 32.0512 177.6266 122 N 4.7923 8.2113 116.1666 53.1612 38.9555 173.8427 123 L 4.9524 7.5894 116.8401 53.6230 43.6027 176.0625 124 I 4.6024 7.8428 111.2379 60.5487 38.2648 177.9147 125 R 3.9860 8.1039 123.0254 60.0876 29.8446 179.0383 126 V 3.7019 7.7683 111.8361 64.2806 31.5804 178.2808 127 N 4.3589 8.1383 115.8061 56.2692 38.5400 177.2112 128 A 4.0841 8.3116 122.2502 55.2932 18.3679 179.9387 129 T 4.0538 8.3398 114.6408 66.5388 68.5707 176.7361 130 K 3.8725 8.2741 121.4319 59.7434 32.3258 178.6326 131 A 3.9768 8.0525 120.8325 55.1520 17.9870 179.0104 132 Y 4.4668 8.4511 118.1018 61.1054 38.7527 178.0208 133 E 3.8416 8.3997 118.4269 59.5911 29.7276 178.7616 134 M 4.2395 7.9886 115.7725 56.2958 32.3490 177.3130 135 A 4.7041 7.7651 119.5498 53.0069 20.9282 177.3419 136 L 4.6767 8.0075 114.4563 55.5851 45.0469 178.7283 137 K 3.1143 7.3235 119.1446 58.9547 32.0873 178.2847 138 K 3.5724 7.5927 118.3242 58.8862 32.1347 176.4766 139 Y 4.6283 7.7845 114.9014 57.5823 38.0200 174.1492 140 H 5.0427 7.9899 117.7654 53.5549 31.3462 175.1478 141 G 4.0181 8.4350 111.2202 43.6387 0.0000 174.0632 142 W 4.3458 8.7900 116.7821 59.6230 27.8992 178.4187 143 I 3.0960 6.6260 120.0813 63.9866 36.5923 178.4945 144 V 3.6684 7.5259 118.5056 65.8358 31.4172 177.8747 145 Q 4.3465 8.1472 119.4605 58.3769 28.5873 178.8678 146 K 4.0469 8.0163 119.1111 59.4431 31.6345 179.3388 147 I 3.6605 7.5367 120.1353 64.5825 37.0107 178.5838 148 F 3.7828 8.5141 118.4802 60.4136 38.7133 177.5326 149 Q 3.8678 8.6498 119.4216 59.1010 28.6178 178.3565 150 A 3.9815 8.1522 121.6302 55.0035 18.1762 179.4922 151 A 3.8661 7.3674 117.6796 55.3491 18.5970 179.6155 152 L 4.1515 8.1838 117.7132 58.0395 41.4578 179.0240 153 Y 4.0166 8.0906 118.3566 59.6919 38.8042 176.3747 154 A 4.3823 7.4659 119.6186 50.9351 19.3165 177.0869 155 A 4.0059 7.1270 121.8463 52.0826 18.9211 176.4481 156 P 4.4301 0.0000 0.0000 61.9066 32.6325 176.3536 157 Y 4.4005 7.9899 116.2970 58.1175 39.4980 177.3420 158 K 3.9534 8.9643 125.6230 60.1115 32.2868 179.3215 159 S 4.3174 8.3890 114.0489 61.7319 62.9158 176.2584 160 D 4.4426 8.2422 122.0779 56.7722 40.4978 178.3880 161 F 4.1823 8.5256 121.4148 61.3478 39.5960 177.3195 162 L 3.7242 8.1762 118.7032 57.4203 40.8903 179.1505 163 K 3.8197 8.1625 119.4384 59.6781 31.8419 178.6786 164 A 4.0133 7.6693 119.7847 55.0585 18.3540 179.3651 165 L 4.1011 7.3636 116.6275 57.1828 41.7135 178.7830 166 S 4.5413 8.1575 112.2597 59.0450 63.2379 176.4034 167 K 4.5681 7.2848 121.9000 57.9049 31.4253 175.5522 *172 T 4.1315 7.6430 108.9986 62.6040 71.0734 173.1353 173 E 4.0176 8.3937 118.9444 59.2171 29.4328 179.0492 174 E 3.9375 8.0712 119.2486 59.0811 29.7052 178.4527 175 E 4.2756 8.0334 119.8008 58.5471 29.6192 178.6916 176 C 4.0117 7.9111 118.4032 62.5556 31.6968 175.6185 177 L 3.9653 8.0470 120.5976 57.7669 40.7283 179.1949 178 E 3.9683 8.0826 118.3823 59.6948 29.4662 179.7935 179 K 4.1074 7.8854 117.8271 59.3674 31.9712 179.6069 180 I 3.7686 7.6941 120.0627 64.3386 36.7676 178.6097 181 R 3.9374 7.8915 118.0884 59.0515 30.0573 178.5568 182 L 4.1075 7.8560 119.6720 58.2149 41.8519 178.7446 183 F 4.1598 8.2906 120.5868 61.3831 39.2001 176.9890 184 L 4.0972 8.2834 118.2852 57.4621 41.1867 178.8118 185 V 3.6027 7.5923 118.9737 66.2750 31.4214 177.6132 186 N 4.4042 7.8813 115.7964 55.8585 38.5512 177.0215 187 Y 4.0101 7.3950 121.1030 60.9828 38.8732 178.1380 188 T 3.6457 8.0610 116.7197 66.4725 68.5338 176.4975 189 A 3.9736 7.6896 122.7310 55.4828 18.3944 179.8595 190 T 3.8048 7.8040 114.1229 66.7922 68.4529 177.0694 191 I 3.7389 7.4626 121.3114 64.5503 37.1515 178.1954 192 D 4.3017 8.0664 119.7076 57.4444 40.6069 179.1633 193 V 3.6714 7.8756 118.7807 65.8842 31.5092 178.2690 194 I 3.7977 7.8261 119.7846 64.4604 37.0021 177.9069 195 Y 3.8440 8.4948 117.9248 61.0964 37.6334 178.4267 196 E 4.0249 8.4476 120.2114 59.3264 29.7219 178.4563 197 M 4.0023 8.2568 118.3127 58.9996 32.3544 177.8295 198 Y 3.6924 8.1711 116.7918 61.1864 37.9408 178.9015 199 T 3.9155 8.0392 116.7129 66.7633 68.4246 176.6765 200 Q 4.0346 8.2196 120.3233 58.8459 29.1414 177.2272 201 M 4.3917 8.0432 116.7706 54.0527 32.5939 175.4994 202 N 4.2062 7.9124 115.3151 54.2478 36.9284 175.0585 203 A 3.6414 7.9393 120.7322 52.9552 19.3535 178.5552 204 E 4.1190 7.9481 116.9122 55.7200 30.3854 175.6179 205 L 4.9021 7.9339 124.0597 53.2497 45.2798 176.0572 206 N 5.0836 8.5847 115.9449 52.8957 39.7985 174.8499 207 Y 4.3958 8.0883 116.6262 57.1410 38.5783 175.6783 208 K 4.8092 8.5696 120.1540 55.1403 34.4993 177.1068 209 V 4.0663 8.3611 113.7987 61.6469 31.6667 175.9993 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 5 A 8.36 4.22 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 6 E 7.57 4.62 0.00 2.01 1.69 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 2.11 1.96 0.00 7 H 9.01 5.10 0.00 3.23 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 7.98 4.47 0.00 1.72 1.67 0.97 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 9 L 8.22 4.36 0.00 1.66 1.70 1.10 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.54 4.09 0.00 1.81 1.81 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.55 7.81 11 P 0.00 4.39 0.00 2.06 2.00 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 12 L 8.33 4.10 0.00 1.64 1.63 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.52 0.00 2.37 2.18 0.00 3.71 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.97 0.00 14 A 8.53 4.02 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 15 D 8.03 4.44 0.00 2.78 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 16 K 7.80 3.82 0.00 1.95 1.95 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.57 7.81 17 Q 7.99 4.48 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.18 6.82 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 18 I 7.90 3.90 1.73 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 1.31 0.89 0.82 0.00 0.00 19 E 8.85 4.60 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 20 T 9.32 3.92 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 1.02 0.00 0.00 21 G 7.78 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 22 P 0.00 4.34 0.00 2.24 2.17 0.00 3.74 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 23 F 8.10 4.25 0.00 3.18 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 24 L 8.34 3.75 0.00 1.73 1.63 0.79 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.04 3.81 0.00 1.94 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 2.34 2.33 0.00 26 A 7.92 4.09 1.44 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 0.00 0.00 0.00 27 V 7.66 3.78 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 0.69 0.00 0.00 0.51 0.00 0.00 28 S 7.61 4.27 0.00 4.01 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 29 H 7.88 4.65 0.00 3.35 3.44 0.00 5.65 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.00 4.59 0.00 2.01 1.98 1.12 0.71 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 31 P 0.00 4.52 0.00 2.19 2.10 0.00 3.87 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 32 P 0.00 4.58 0.00 1.81 1.96 0.00 4.00 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 33 F 8.23 4.21 0.00 3.24 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 34 F 8.65 4.30 0.00 3.33 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 35 D 8.17 4.67 0.00 2.87 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 36 C 7.41 4.43 0.00 3.14 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.39 4.30 0.00 1.67 1.68 0.99 0.87 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 38 G 8.67 4.37 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 0.00 39 S 8.54 4.45 0.00 3.91 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 40 P 0.00 4.37 0.00 2.10 2.05 0.00 3.48 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.02 0.00 41 V 6.98 3.41 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 0.59 0.00 0.00 0.61 0.00 0.00 42 F 7.06 4.61 0.00 3.30 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 43 T 7.42 3.80 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 1.11 0.00 0.00 44 P 0.00 3.97 0.00 1.04 1.25 0.00 3.40 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 45 I 7.16 3.71 1.85 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.79 0.68 0.00 0.00 46 K 7.23 2.69 0.00 1.18 1.70 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.22 1.14 7.81 47 A 8.17 4.11 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.30 3.59 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 1.05 0.00 0.00 1.19 0.00 0.00 49 I 7.29 4.02 1.96 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.53 0.99 0.00 0.00 50 S 8.40 4.12 0.00 3.86 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.02 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 N 8.10 4.46 0.00 2.95 3.08 0.00 0.00 7.13 7.32 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 53 I 8.02 3.76 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.85 0.89 0.00 0.00 54 T 7.80 3.89 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 1.21 0.00 0.00 55 K 7.90 4.01 0.00 1.93 1.87 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.61 7.81 56 I 7.79 3.75 1.94 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 1.48 0.86 0.99 0.00 0.00 57 K 8.48 3.96 0.00 1.96 2.02 0.00 1.59 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.51 1.76 7.81 58 A 7.75 4.00 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 59 V 7.50 3.56 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 0.19 0.00 0.00 0.93 0.00 0.00 60 Y 8.19 4.21 0.00 3.10 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 61 D 8.37 4.26 0.00 2.77 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 62 T 7.46 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 1.30 0.00 0.00 63 N 8.05 4.85 0.00 2.80 2.70 0.00 0.00 7.06 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 64 P 0.00 3.65 0.00 2.08 1.66 0.00 3.54 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 1.95 1.64 0.00 65 A 7.95 4.04 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.88 3.91 0.00 1.50 1.47 0.00 1.51 0.00 0.00 1.47 0.00 0.00 2.78 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.34 1.00 7.81 67 F 7.57 5.15 0.00 3.33 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 68 R 8.65 4.38 0.00 2.14 2.00 0.00 3.21 0.00 0.00 3.39 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.70 0.00 69 T 7.59 5.13 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 1.25 0.00 0.00 70 L 8.44 4.07 0.00 1.65 1.71 0.28 0.53 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 71 Q 8.07 3.96 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.88 0.00 0.00 0.00 0.00 0.00 2.58 2.59 0.00 72 N 8.09 4.66 0.00 3.15 3.11 0.00 0.00 6.60 7.00 0.00 0.00 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 I 7.69 4.14 2.17 0.00 0.00 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 1.66 1.11 1.01 0.00 0.00 74 L 8.08 4.43 0.00 1.88 1.87 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.29 3.75 0.00 2.09 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 2.57 2.26 0.00 76 V 8.26 3.55 2.38 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 1.07 0.00 0.00 0.86 0.00 0.00 77 E 8.61 4.35 0.00 2.55 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.76 0.00 78 K 7.58 3.07 0.00 0.79 1.30 0.00 0.69 0.00 0.00 1.13 0.00 0.00 2.69 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.98 0.56 7.81 79 E 7.54 3.83 0.00 2.05 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 2.24 2.42 0.00 80 M 7.84 4.03 0.00 1.39 2.08 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.46 0.00 81 Y 8.41 4.57 0.00 3.26 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 82 G 8.66 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 83 A 8.88 4.24 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.17 4.11 0.00 2.08 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 0.00 2.31 2.26 0.00 85 W 8.08 4.28 0.00 3.43 3.33 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 86 P 0.00 3.04 0.00 1.41 0.49 0.00 3.60 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.47 0.00 87 K 7.30 4.23 0.00 1.59 1.68 0.00 1.50 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.33 0.00 0.00 0.00 0.00 1.31 1.27 7.81 88 V 7.27 4.14 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 0.32 0.00 0.00 -0.10 0.00 0.00 89 G 8.52 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.76 4.09 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.47 3.94 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 0.97 0.00 0.00 92 L 8.07 4.08 0.00 1.92 1.82 1.17 1.08 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 93 A 7.80 4.34 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.31 3.99 0.00 1.93 1.94 1.02 0.87 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 95 M 7.97 2.94 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.75 0.00 96 W 7.92 3.78 0.00 3.40 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 97 L 8.22 4.11 0.00 1.92 1.93 1.07 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.21 4.05 0.00 1.90 1.91 0.00 0.61 0.00 0.00 0.64 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.96 0.74 7.81 99 R 6.81 4.53 0.00 2.12 2.20 0.00 2.21 0.00 0.00 2.58 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.21 0.00 100 G 8.20 3.81 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 0.00 0.00 0.00 101 L 8.51 4.65 0.00 2.03 1.88 1.24 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.54 3.90 0.00 2.16 2.33 0.00 2.99 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 103 F 8.66 4.20 0.00 3.38 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.28 3.94 2.51 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.27 1.12 0.00 0.00 105 Q 8.63 4.28 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 106 V 8.05 3.59 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 1.02 0.00 0.00 0.95 0.00 0.00 107 F 8.24 4.02 0.00 2.47 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 0.00 108 L 8.27 3.68 0.00 1.82 1.70 0.94 1.03 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 0.00 109 Q 8.44 3.91 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 110 S 8.09 4.19 0.00 3.93 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 0.00 111 I 7.30 3.56 1.70 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 -0.09 0.82 0.00 0.00 112 C 7.98 4.21 0.00 3.08 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 0.00 113 D 8.11 4.68 0.00 2.60 2.67 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 0.00 114 G 7.75 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 0.00 115 E 8.02 4.11 0.00 2.16 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.21 0.00 116 R 7.93 4.48 0.00 1.87 1.85 0.00 3.03 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 117 D 8.43 4.57 0.00 2.74 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 E 8.88 4.04 0.00 1.98 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 2.31 2.28 0.00 119 N 8.42 4.46 0.00 2.62 2.63 0.00 0.00 6.77 7.67 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 0.00 120 H 8.00 5.03 0.00 3.16 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.30 0.00 2.18 2.19 0.00 3.78 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 1.96 0.00 122 N 8.21 4.79 0.00 2.82 2.85 0.00 0.00 7.17 6.66 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 0.00 123 L 7.59 4.95 0.00 1.85 1.55 0.77 0.73 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 0.00 124 I 7.84 4.60 1.94 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 1.50 0.86 0.84 0.00 0.00 125 R 8.10 3.99 0.00 1.86 2.04 0.00 2.93 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 1.79 1.58 0.00 126 V 7.77 3.70 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 0.91 0.00 0.00 0.94 0.00 0.00 127 N 8.14 4.36 0.00 2.93 2.71 0.00 0.00 7.05 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.31 4.08 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 0.00 129 T 8.34 4.05 4.37 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 1.34 0.00 0.00 130 K 8.27 3.87 0.00 2.01 2.01 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.49 7.81 131 A 8.05 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 Y 8.45 4.47 0.00 3.51 3.33 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 0.00 133 E 8.40 3.84 0.00 2.14 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 2.60 0.00 134 M 7.99 4.24 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.54 0.00 135 A 7.77 4.70 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 0.00 136 L 8.01 4.68 0.00 1.40 1.22 1.04 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 137 K 7.32 3.11 0.00 1.06 1.48 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.41 1.43 7.81 138 K 7.59 3.57 0.00 1.29 0.74 0.00 0.82 0.00 0.00 1.05 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.95 1.14 7.81 139 Y 7.78 4.63 0.00 3.09 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 0.00 140 H 7.99 5.04 0.00 3.22 3.21 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.44 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 0.00 142 W 8.79 4.35 0.00 3.63 3.32 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 0.00 143 I 6.63 3.10 1.31 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.57 0.00 0.00 144 V 7.53 3.67 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 1.17 0.00 0.00 0.87 0.00 0.00 145 Q 8.15 4.35 0.00 2.54 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.58 0.00 0.00 0.00 0.00 0.00 2.65 2.56 0.00 146 K 8.02 4.05 0.00 1.98 1.88 0.00 1.97 0.00 0.00 1.80 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.75 7.81 147 I 7.54 3.66 2.15 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.04 0.74 0.00 0.00 148 F 8.51 3.78 0.00 2.88 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Q 8.65 3.87 0.00 2.06 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 150 A 8.15 3.98 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 0.00 151 A 7.37 3.87 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 L 8.18 4.15 0.00 1.75 1.80 0.73 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 153 Y 8.09 4.02 0.00 3.09 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 0.00 154 A 7.47 4.38 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 0.00 155 A 7.13 4.01 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 0.00 156 P 0.00 4.43 0.00 2.27 2.12 0.00 3.54 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 157 Y 7.99 4.40 0.00 3.23 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 0.00 158 K 8.96 3.95 0.00 1.86 2.09 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.52 1.52 7.81 159 S 8.39 4.32 0.00 4.14 4.19 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 0.00 160 D 8.24 4.44 0.00 3.02 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 0.00 161 F 8.53 4.18 0.00 3.14 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 0.00 162 L 8.18 3.72 0.00 1.74 1.64 0.93 0.42 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 0.00 163 K 8.16 3.82 0.00 2.00 1.99 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.46 7.81 164 A 7.67 4.01 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 0.00 165 L 7.36 4.10 0.00 1.45 1.51 0.26 0.89 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 0.00 166 S 8.16 4.54 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 0.00 167 K 7.28 4.57 0.00 1.89 1.96 0.00 1.50 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.61 7.81 *172 T 7.64 4.13 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 0.00 173 E 8.39 4.02 0.00 2.02 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 2.38 2.35 0.00 174 E 8.07 3.94 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 175 E 8.03 4.28 0.00 2.18 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 0.00 2.31 2.15 0.00 176 C 7.91 4.01 0.00 2.97 3.08 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 0.00 177 L 8.05 3.97 0.00 1.86 1.68 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 178 E 8.08 3.97 0.00 2.25 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 2.33 2.36 0.00 179 K 7.89 4.11 0.00 1.90 1.83 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 180 I 7.69 3.77 1.99 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 1.35 0.66 0.92 0.00 0.00 181 R 7.89 3.94 0.00 1.97 2.00 0.00 3.16 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 182 L 7.86 4.11 0.00 1.81 1.88 0.94 0.75 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 0.00 183 F 8.29 4.16 0.00 3.15 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 0.00 184 L 8.28 4.10 0.00 1.97 1.76 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 185 V 7.59 3.60 2.17 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 1.02 0.00 0.00 1.01 0.00 0.00 186 N 7.88 4.40 0.00 2.75 2.86 0.00 0.00 6.55 7.48 0.00 0.00 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 Y 7.40 4.01 0.00 2.10 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 T 8.06 3.65 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 1.20 0.00 0.00 189 A 7.69 3.97 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 0.00 190 T 7.80 3.80 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 191 I 7.46 3.74 1.67 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.42 0.94 0.00 0.00 192 D 8.07 4.30 0.00 2.82 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 0.00 193 V 7.88 3.67 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.99 0.00 0.00 194 I 7.83 3.80 2.03 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 1.35 0.69 0.91 0.00 0.00 195 Y 8.49 3.84 0.00 3.12 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 0.00 196 E 8.45 4.02 0.00 2.10 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 0.00 2.33 2.34 0.00 197 M 8.26 4.00 0.00 2.32 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.44 0.00 198 Y 8.17 3.69 0.00 3.19 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 0.00 199 T 8.04 3.92 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 1.25 0.00 0.00 200 Q 8.22 4.03 0.00 2.10 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 201 M 8.04 4.39 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.81 0.00 202 N 7.91 4.21 0.00 3.00 2.96 0.00 0.00 6.86 7.47 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 0.00 203 A 7.94 3.64 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 E 7.95 4.12 0.00 1.92 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 205 L 7.93 4.90 0.00 1.64 1.67 0.93 0.95 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 0.00 206 N 8.58 5.08 0.00 2.73 2.86 0.00 0.00 6.96 7.46 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 0.00 207 Y 8.09 4.40 0.00 3.12 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 K 8.57 4.81 0.00 1.85 1.83 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.49 7.81 209 V 8.36 4.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.65 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.