NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2510 7.8827 121.4490 61.2430 38.5854 173.8027 17 V 4.2868 8.7536 126.4092 61.8776 32.6553 174.5858 18 G 3.9264 8.4719 113.8987 46.6223 0.0000 173.5485 19 G 4.1979 7.7294 110.0022 44.4472 0.0000 172.6251 20 Y 4.9517 8.0332 117.4778 55.3533 42.2793 174.9245 21 T 4.2368 8.6099 117.1259 64.0241 68.3941 175.0552 22 C 4.2484 8.5037 125.3109 60.9845 35.5844 174.9113 23 G 4.1040 8.7555 106.2046 43.8235 0.0000 172.6691 24 A 4.2417 8.7104 124.9829 53.6948 18.3513 176.8860 25 N 4.2700 8.9084 119.5479 54.7503 36.1865 175.6137 26 T 4.1559 7.7240 107.9402 63.0432 69.8137 175.0126 27 V 4.1110 7.0668 121.9246 59.7444 31.3243 173.6152 28 P 4.5281 0.0000 0.0000 64.1904 31.7536 178.2667 29 Y 5.0726 7.0073 115.2703 56.8104 38.8338 174.5545 30 Q 4.6241 7.3628 123.6244 56.1772 29.5193 175.4298 31 V 4.8838 9.0109 119.0163 59.6490 36.3040 174.1578 32 S 4.8671 8.7168 116.5585 56.5871 65.0974 172.6130 33 L 4.7407 8.5828 127.4083 53.3531 43.1620 174.9152 34 N 5.6975 8.8699 123.0070 50.2245 41.7901 174.8593 *37 S 4.1609 8.3913 120.3263 58.3587 63.3398 174.1468 38 G 4.0170 9.3953 108.6213 44.8770 0.0000 172.8361 39 Y 4.4592 6.7005 115.7828 56.4201 39.7557 172.2460 40 H 4.6375 8.9717 121.4695 56.2001 30.2710 174.6754 41 F 5.0534 7.8690 120.0212 56.7983 39.6574 173.7404 42 C 4.6047 6.7694 115.1595 56.2992 44.8200 172.7330 43 G 4.2863 8.7111 108.7298 45.3954 0.0000 172.2049 44 G 4.6007 8.0299 105.2177 46.3569 0.0000 172.7778 45 S 5.4205 8.9042 116.2616 56.2966 66.3565 173.6235 46 L 4.7820 9.3320 128.5077 55.0680 42.3443 177.1845 47 I 4.4157 8.5169 119.7820 60.9835 39.0743 174.6064 48 N 4.5864 7.7414 117.3311 51.9840 39.3749 175.1790 49 S 4.2414 8.5868 112.9778 61.0530 62.9815 175.3086 50 Q 4.6080 9.0463 117.8565 55.0411 30.8414 175.0494 51 W 5.5353 8.6107 119.0186 54.8003 33.5759 174.4096 52 V 4.9557 9.1712 123.0649 61.1847 34.6286 174.1216 53 V 4.8414 9.0396 127.3894 61.8428 33.6295 174.7688 54 S 4.6694 8.9680 120.8986 57.6431 66.1833 172.3132 55 A 4.5899 8.4742 120.8760 50.8454 20.1962 178.5132 56 A 3.8297 8.3588 124.0995 55.2620 18.3906 179.5607 57 H 4.4939 7.9969 108.7504 57.3333 28.8234 176.4211 58 C 4.7556 7.7088 117.3169 57.1352 40.3632 173.2053 59 Y 4.2507 7.7600 122.3670 57.4748 38.8405 175.3312 60 K 4.0123 7.3909 127.0104 54.4686 35.1391 175.4826 61 S 4.0979 8.3211 121.2256 58.8270 64.3517 174.1152 62 G 3.9293 8.4893 111.0512 46.6328 0.0000 173.5948 63 I 4.0937 7.2859 118.4506 61.0055 39.0894 176.2555 64 Q 4.7195 8.9193 127.8857 54.1822 31.7006 174.1762 65 V 4.3537 8.8684 127.4580 62.1154 33.3915 174.6639 66 R 4.9824 9.0539 127.6898 54.7885 31.9573 175.3030 67 L 4.7608 9.1020 124.9263 52.6749 44.7878 177.6787 *69 G 4.1313 8.2512 107.5643 45.4180 0.0000 172.7065 70 E 4.4650 8.1992 118.3749 55.3393 30.2569 174.2013 71 D 4.7938 7.8694 118.0489 55.3017 43.8617 174.2885 72 N 4.7448 8.9738 122.8198 52.8437 38.9305 176.1995 73 I 3.4683 8.8302 127.6091 62.9844 38.0859 176.1544 74 N 4.7824 8.3617 115.6273 53.1498 39.2760 174.9116 75 V 4.3681 7.3869 117.2663 60.5977 34.5835 174.9861 76 V 4.0084 8.4296 126.2281 62.9581 31.1454 175.3888 77 E 4.4017 9.8271 127.1861 55.9350 30.1663 177.1428 78 G 4.0138 8.4669 107.4257 45.2814 0.0000 174.2379 79 N 4.8650 8.0753 115.4675 52.9485 39.2229 173.9686 80 E 4.6603 7.7744 117.8014 56.2759 30.9849 176.3475 81 Q 4.3660 9.0812 120.6493 54.4802 32.7493 174.2117 82 F 5.5216 8.9038 123.7338 56.0920 40.6290 175.5101 83 I 4.6510 8.7643 125.1785 59.2617 40.6332 175.8009 84 S 4.6804 8.7168 122.4874 58.3302 64.2775 173.1635 85 A 4.6360 8.5154 125.4498 52.0046 18.2964 177.7957 86 S 4.5288 8.9027 117.3365 59.2979 64.6279 174.7027 87 K 4.6535 7.5454 118.5204 55.2841 36.6886 175.5660 88 S 4.9541 8.6761 118.7709 57.1338 65.2868 172.7551 89 I 4.3170 9.2032 126.4414 59.7760 37.8843 175.2973 90 V 4.2154 8.2944 127.6385 62.1851 32.6980 175.2161 91 H 4.0598 8.8360 127.3001 55.9590 29.9756 174.3973 92 P 4.3270 0.0000 0.0000 65.3278 31.1373 177.0156 93 S 4.6742 7.9864 113.0038 58.0751 63.1701 173.2392 94 Y 4.3228 8.0461 122.8115 57.8078 38.9398 174.9406 95 N 4.4811 8.1774 125.8906 51.4479 39.9097 175.0571 96 S 3.9169 8.0416 120.1446 59.6720 63.6315 174.4924 97 N 4.5397 8.4346 118.9505 55.4110 39.2417 176.5065 98 T 3.8558 7.8385 105.3245 61.9494 69.4745 175.4208 99 L 3.7708 7.8404 120.5759 54.9512 39.9017 173.9968 100 N 4.4363 7.6424 118.3186 54.7215 39.5595 174.4259 101 N 4.9086 8.6764 119.2889 54.2223 35.9427 175.5925 102 D 4.6909 7.9362 117.2978 53.1299 39.4542 174.9841 103 I 4.8270 7.1110 120.7498 59.3084 42.4700 173.2924 104 M 5.4805 9.2421 127.0227 54.0665 36.3139 173.2771 105 L 5.3584 9.3346 125.2582 53.1448 44.7600 175.2907 106 I 4.9840 9.1413 124.7346 59.4122 40.0480 174.5014 107 K 3.5289 8.4238 128.8746 54.7350 33.6177 175.3747 108 L 4.4191 8.0867 127.6236 53.8009 41.9276 177.0149 109 K 4.1015 8.9188 125.8798 58.9081 32.6226 177.1022 110 S 4.6409 7.7286 111.4561 55.6607 66.0714 173.2232 111 A 4.3381 8.4609 123.9247 52.0244 18.6818 177.3064 112 A 4.2333 9.0570 125.0058 51.8118 19.4990 177.3425 113 S 4.3652 9.2754 117.3383 57.7452 62.6971 173.5909 114 L 4.9258 8.5052 127.7503 53.3556 44.8047 174.3493 115 D 4.6312 8.5487 122.7447 53.9342 37.6266 178.0772 116 S 4.6735 9.1982 112.1437 58.6093 65.0807 175.8209 117 R 4.0657 7.9209 119.2775 57.5500 30.3019 175.8643 118 V 4.6340 7.9320 116.8091 60.9838 33.7002 173.7254 119 A 4.8622 8.5661 128.2868 50.5087 22.9897 175.0694 120 S 5.0707 8.6860 113.9014 57.7249 64.9305 173.1191 121 I 4.3955 8.1854 121.5380 59.0894 39.5709 175.5737 122 S 4.3828 8.4237 124.5500 58.4797 63.9954 173.9177 123 L 4.2641 8.3367 123.0160 53.3111 42.5372 175.2145 124 P 4.4924 0.0000 0.0000 63.0042 32.1298 176.4124 125 T 4.1217 8.2474 109.3698 62.7384 69.8777 174.6963 *127 S 4.3783 7.5627 114.6013 57.8797 64.0422 174.0790 128 C 4.3685 8.3986 118.0981 56.7439 40.6356 173.5438 129 A 4.3491 8.0153 125.6412 51.4597 19.4748 177.7363 130 S 4.2256 8.1735 115.5632 57.4405 64.5189 173.1638 *132 A 4.2639 8.2191 123.5355 53.5813 19.2349 177.1690 133 G 3.9797 9.1786 111.1938 45.2526 0.0000 174.2270 134 T 3.9819 7.5631 117.4045 63.7414 69.3447 173.8300 135 Q 4.5042 8.6440 125.7801 56.0253 29.8151 175.9554 136 C 5.2319 9.3177 120.0904 55.1421 46.2636 172.4179 137 L 5.2132 9.1440 122.5040 53.6166 43.8464 174.9511 138 I 5.2822 9.1916 127.6718 58.8471 39.7922 174.9774 139 S 4.9358 8.9267 119.6753 56.1587 66.6746 173.0378 140 G 3.8218 7.2180 108.5745 46.0803 0.0000 172.7729 141 W 4.5762 8.4582 117.0000 56.2834 29.3608 177.0884 142 G 4.1369 8.4462 109.3514 44.2725 0.0000 173.5045 143 N 3.6547 8.7328 118.4690 54.3001 38.9100 174.5839 144 T 5.0260 8.1620 113.3874 60.5607 69.5485 174.3919 145 K 4.6200 7.7230 121.7400 54.6393 34.6939 176.3984 146 S 4.1813 8.7010 117.9058 60.3060 63.4557 173.9701 147 S 4.3385 8.0660 114.4064 59.6611 63.7333 170.8927 148 G 3.7809 8.4483 114.1206 44.2291 0.0000 171.2866 149 T 4.6538 8.0993 114.6532 61.9765 72.3201 174.3330 150 S 4.2992 8.9825 121.0319 58.0635 65.2849 172.4037 151 Y 4.8882 8.5697 126.0463 55.6623 38.9427 174.5149 152 P 4.6044 0.0000 0.0000 62.8422 32.8441 176.0134 153 D 4.6563 8.8212 119.0771 57.0200 41.9651 177.2141 154 V 5.2920 7.6475 109.1280 58.8229 34.0809 175.8389 155 L 3.1260 8.3051 124.2656 55.1950 42.9720 175.9945 156 K 4.8116 8.1296 125.0708 54.9549 34.9612 174.6770 157 C 5.2304 8.7062 119.8338 55.2063 41.4852 173.0236 158 L 4.9161 8.5111 122.4349 54.0348 45.5820 174.2662 159 K 5.1705 9.0105 125.8651 55.3160 33.3439 175.8429 160 A 4.8528 8.9200 126.0326 49.8413 23.1968 173.3067 161 P 5.0582 0.0000 0.0000 61.7531 33.8333 175.3008 162 I 4.2283 8.4212 122.8156 61.5762 38.0597 175.3467 163 L 5.0833 8.7075 126.7907 52.6316 44.1511 176.8333 164 S 4.3005 8.4488 115.3494 58.1357 63.8957 174.8865 165 D 4.3852 8.7476 121.2827 57.6020 40.9088 178.6641 166 S 4.1065 8.0384 113.5363 61.3876 62.5344 176.1727 167 S 4.1681 8.1709 117.0923 61.3948 62.8088 175.6533 168 C 4.3463 8.3988 122.1316 59.5911 42.7921 175.8089 169 K 4.0202 8.4096 120.2213 59.4820 31.3521 179.6427 170 S 4.2181 7.9694 114.8181 61.4086 62.7920 176.2042 171 A 4.0633 7.9536 122.7774 53.7623 19.5717 177.3063 172 Y 4.7482 7.9012 114.8591 54.7862 38.4055 171.7515 173 P 4.5472 0.0000 0.0000 63.1714 32.1424 176.7196 174 G 4.0318 9.0675 110.2177 46.3830 0.0000 173.8666 175 Q 4.5300 8.0837 117.5648 55.2704 31.0767 175.8039 176 I 4.2763 7.9589 119.1585 60.4175 37.9764 175.6699 177 T 4.5118 8.2880 116.1881 59.8296 70.6469 175.4724 178 S 4.3371 8.5488 115.1035 60.3864 63.2132 174.4843 179 N 4.9967 8.1687 118.2902 53.2353 38.5785 173.7252 180 M 5.6459 7.9195 116.9541 53.7900 36.0602 174.8422 181 F 5.1032 8.8407 114.9218 55.9452 41.9040 172.7850 182 C 5.3410 9.0247 117.4574 56.2836 41.0096 172.3946 183 A 5.0029 8.8178 121.9259 51.0552 22.4167 176.1256 184A G 3.7665 6.8508 108.4503 44.8084 0.0000 172.2126 184 Y 4.6663 8.3145 119.1816 55.9352 41.1495 176.5123 185 L 4.1288 8.7013 125.0504 57.3755 41.9702 178.6926 186 E 4.0413 8.2135 114.9987 56.9383 30.0052 177.5950 187 G 3.9260 7.6605 105.4723 45.6136 0.0000 173.1900 188A G 4.0214 9.4903 106.7207 44.5678 0.0000 173.4566 188 K 4.8969 7.3587 117.5425 55.1446 35.4246 175.0849 189 D 4.6337 8.8137 123.5281 53.8281 45.5431 174.6560 190 S 4.9299 8.7768 115.9690 57.9027 65.0729 173.5749 191 C 4.8053 9.5922 119.9071 55.0795 45.1745 172.6238 192 Q 4.2627 8.7389 118.9079 58.0291 28.3248 178.0279 193 G 4.3495 9.2461 110.6398 45.7291 0.0000 173.8412 194 D 4.7121 8.5773 119.0146 55.1784 41.8750 176.7900 195 S 4.5058 8.0651 115.1626 60.4365 63.5768 175.4475 196 G 4.0469 8.8511 112.4018 46.5127 0.0000 173.7798 197 G 4.4119 7.8478 107.3479 45.2315 0.0000 171.1461 198 P 5.1851 0.0000 0.0000 62.3447 33.6222 175.8317 199 V 4.5153 8.4116 120.8966 61.4487 34.1730 173.6883 200 V 4.8418 8.7863 128.6428 61.2288 33.8827 173.7012 201 C 5.0825 8.7787 124.7756 55.4870 43.6523 174.5932 202 S 3.3397 9.7215 120.8829 59.7586 60.0163 173.2493 203 G 3.9086 8.4446 104.1768 45.7298 0.0000 173.8351 204 K 4.7034 7.5260 118.0851 53.0626 34.9348 175.4714 *209 L 4.2356 8.2733 123.4424 55.3573 42.0134 175.7046 210 Q 4.3920 8.7311 126.0695 57.0703 30.3928 175.8789 211 G 5.3582 8.0164 104.4527 45.8261 0.0000 171.4765 212 I 5.0402 8.2677 119.8004 58.8533 40.8240 175.4315 213 V 3.7397 8.8465 127.5473 64.0303 31.7954 174.0913 214 S 4.8783 8.3816 120.7841 58.3506 64.4869 174.4482 215 W 4.8887 7.2271 113.9963 55.9954 31.9727 172.4249 216 G 3.7835 8.3674 107.1927 46.4862 0.0000 173.2148 217 S 4.6092 8.4979 115.3533 57.0243 61.8437 172.7316 *219 G 4.4795 7.9478 118.6207 45.4891 0.0000 170.7460 220 C 4.9344 8.1366 116.5646 56.4736 44.3481 173.7841 221A A 4.1536 9.2539 125.5042 53.1482 16.8630 176.9660 221 Q 4.4900 7.3605 117.2005 56.2790 29.6786 175.9478 222 K 4.2355 8.4148 122.2711 57.9723 32.6810 176.4559 223 N 4.3006 9.3659 121.7169 53.9038 37.0034 175.2638 224 K 4.3342 7.6007 117.0102 53.6660 32.3282 174.0537 225 P 4.5728 0.0000 0.0000 62.1003 33.0085 177.6413 226 G 3.5435 8.3965 107.2740 46.3734 0.0000 172.5297 227 V 4.3349 7.7376 122.6116 60.8631 33.6467 174.2660 228 Y 4.8779 8.2753 123.9866 56.0501 42.5051 174.7822 229 T 4.4092 8.5830 119.3437 63.5352 70.0399 174.4938 230 K 4.9895 9.4679 128.3011 55.5312 31.4150 177.2678 231 V 3.9336 8.8178 126.5562 65.8177 31.3838 174.9063 232 C 4.4009 8.2810 112.5522 57.9688 41.5879 174.6845 233 N 4.2764 8.0787 117.4269 54.2387 38.6294 175.0327 234 Y 4.7969 7.8526 117.2823 57.4763 39.3742 177.3764 235 V 3.6846 8.2022 121.3845 66.5519 31.4479 178.0943 236 S 4.1595 8.1138 114.0870 61.3009 62.6454 176.3693 237 W 4.1430 8.2960 130.6120 60.3856 30.5545 177.8847 238 I 3.1942 8.4866 120.1420 64.2027 36.6236 178.4543 239 K 3.7270 7.9329 119.0730 59.5791 32.0480 179.2613 240 Q 3.8241 7.9743 119.6346 59.2959 28.7115 178.3248 241 T 3.5685 7.2131 117.4247 65.9542 68.5087 176.3855 242 I 2.1274 7.0170 121.3753 63.7713 36.7420 178.3946 243 A 4.0398 7.4936 120.3134 53.9299 18.0822 178.6853 244 S 4.6865 7.4277 111.7666 58.1682 63.3186 174.2173 245 N 4.6387 7.8911 125.6626 54.2382 39.6530 174.1816 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 16 I 7.88 4.25 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.59 0.86 0.00 0.00 17 V 8.75 4.29 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 1.04 0.00 0.00 0.90 0.00 0.00 18 G 8.47 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 0.00 0.00 0.00 19 G 7.73 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.03 4.95 0.00 2.99 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.61 4.24 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 22 C 8.50 4.25 0.00 2.77 3.05 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 23 G 8.76 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.71 4.24 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 25 N 8.91 4.27 0.00 2.87 2.92 0.00 0.00 7.21 7.54 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 26 T 7.72 4.16 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 1.24 0.00 0.00 27 V 7.07 4.11 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 0.18 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.53 0.00 2.40 2.49 0.00 3.86 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.99 0.00 29 Y 7.01 5.07 0.00 3.27 3.42 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 30 Q 7.36 4.62 0.00 1.77 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.73 0.00 0.00 0.00 0.00 0.00 1.84 2.45 0.00 31 V 9.01 4.88 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.01 0.00 0.00 32 S 8.72 4.87 0.00 3.20 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 33 L 8.58 4.74 0.00 0.54 1.07 0.77 0.28 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 34 N 8.87 5.70 0.00 2.42 2.48 0.00 0.00 6.66 7.31 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 *37 S 8.39 4.16 0.00 3.43 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.40 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 39 Y 6.70 4.46 0.00 3.06 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 40 H 8.97 4.64 0.00 2.91 3.21 0.00 5.86 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 41 F 7.87 5.05 0.00 3.02 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 42 C 6.77 4.60 0.00 1.85 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 43 G 8.71 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 0.00 0.00 0.00 0.00 44 G 8.03 4.60 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 45 S 8.90 5.42 0.00 3.80 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.33 4.78 0.00 1.85 1.68 1.09 0.74 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 47 I 8.52 4.42 1.90 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 1.59 0.90 1.00 0.00 0.00 48 N 7.74 4.59 0.00 2.98 2.98 0.00 0.00 5.99 7.21 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 49 S 8.59 4.24 0.00 4.20 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 0.00 50 Q 9.05 4.61 0.00 2.02 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.79 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 51 W 8.61 5.54 0.00 3.33 3.05 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 52 V 9.17 4.96 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.98 0.00 0.00 53 V 9.04 4.84 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 0.99 0.00 0.00 1.02 0.00 0.00 54 S 8.97 4.67 0.00 3.89 3.69 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 55 A 8.47 4.59 1.16 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 56 A 8.36 3.83 0.38 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 57 H 8.00 4.49 0.00 3.36 3.53 0.00 5.52 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.71 4.76 0.00 3.19 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 59 Y 7.76 4.25 0.00 2.96 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 60 K 7.39 4.01 0.00 1.28 1.06 0.00 0.61 0.00 0.00 0.62 0.00 0.00 2.50 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.82 0.94 7.81 61 S 8.32 4.10 0.00 3.92 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.49 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 0.00 0.00 0.00 63 I 7.29 4.09 1.84 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 1.39 0.59 0.91 0.00 0.00 64 Q 8.92 4.72 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 65 V 8.87 4.35 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 0.98 0.00 0.00 0.89 0.00 0.00 66 R 9.05 4.98 0.00 1.48 1.69 0.00 2.64 0.00 0.00 2.48 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.11 0.00 67 L 9.10 4.76 0.00 1.66 1.64 1.04 0.63 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 *69 G 8.25 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 70 E 8.20 4.46 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 2.36 2.08 0.00 71 D 7.87 4.79 0.00 2.78 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.97 4.74 0.00 2.83 2.83 0.00 0.00 7.05 7.33 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 73 I 8.83 3.47 0.98 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.37 0.74 0.00 0.00 74 N 8.36 4.78 0.00 2.86 2.83 0.00 0.00 6.65 7.21 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 75 V 7.39 4.37 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 0.77 0.00 0.00 0.95 0.00 0.00 76 V 8.43 4.01 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 0.78 0.00 0.00 0.93 0.00 0.00 77 E 9.83 4.40 0.00 1.96 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 2.28 2.44 0.00 78 G 8.47 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.08 4.87 0.00 2.75 2.81 0.00 0.00 7.17 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 80 E 7.77 4.66 0.00 1.53 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 2.56 2.46 0.00 81 Q 9.08 4.37 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 82 F 8.90 5.52 0.00 2.79 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 83 I 8.76 4.65 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 1.25 0.72 0.95 0.00 0.00 84 S 8.72 4.68 0.00 3.75 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 85 A 8.52 4.64 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 86 S 8.90 4.53 0.00 3.77 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 87 K 7.55 4.65 0.00 1.54 1.73 0.00 1.63 0.00 0.00 1.92 0.00 0.00 2.84 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.41 7.81 88 S 8.68 4.95 0.00 3.98 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 89 I 9.20 4.32 2.04 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 1.24 0.94 1.08 0.00 0.00 90 V 8.29 4.22 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 0.69 0.00 0.00 0.83 0.00 0.00 91 H 8.84 4.06 0.00 2.95 3.12 0.00 5.65 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.33 0.00 2.23 2.24 0.00 3.17 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.06 0.00 93 S 7.99 4.67 0.00 3.94 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 94 Y 8.05 4.32 0.00 2.99 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 95 N 8.18 4.48 0.00 2.58 2.43 0.00 0.00 6.62 7.11 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 96 S 8.04 3.92 0.00 3.97 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 97 N 8.43 4.54 0.00 2.74 2.78 0.00 0.00 6.95 7.17 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 98 T 7.84 3.86 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 99 L 7.84 3.77 0.00 1.58 1.83 0.08 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.64 4.44 0.00 2.69 2.65 0.00 0.00 7.22 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 0.00 101 N 8.68 4.91 0.00 2.94 2.62 0.00 0.00 7.24 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.94 4.69 0.00 3.10 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 0.00 103 I 7.11 4.83 1.46 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.25 0.18 0.00 0.00 104 M 9.24 5.48 0.00 2.23 1.83 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.64 0.00 105 L 9.33 5.36 0.00 1.75 1.80 0.14 0.66 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 0.00 106 I 9.14 4.98 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.95 0.91 0.00 0.00 107 K 8.42 3.53 0.00 0.79 1.02 0.00 1.43 0.00 0.00 1.39 0.00 0.00 2.68 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.75 0.21 7.81 108 L 8.09 4.42 0.00 1.41 1.59 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.92 4.10 0.00 1.83 1.80 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.73 4.64 0.00 3.93 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 0.00 111 A 8.46 4.34 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 0.00 112 A 9.06 4.23 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.28 4.37 0.00 3.87 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 0.00 114 L 8.51 4.93 0.00 1.69 1.60 0.96 1.15 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 0.00 115 D 8.55 4.63 0.00 2.77 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 9.20 4.67 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.92 4.07 0.00 1.92 2.03 0.00 3.15 0.00 0.00 3.45 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.38 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.40 4.37 0.00 2.92 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 0.00 129 A 8.02 4.35 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.17 4.23 0.00 3.98 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 *132 A 8.22 4.26 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.18 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 0.00 134 T 7.56 3.98 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 1.16 0.00 0.00 135 Q 8.64 4.50 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 136 C 9.32 5.23 0.00 2.84 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 9.14 5.21 0.00 1.75 1.58 1.02 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.19 5.28 1.87 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.52 1.01 0.00 0.00 139 S 8.93 4.94 0.00 3.53 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 0.00 140 G 7.22 3.82 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 0.00 141 W 8.46 4.58 0.00 3.17 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 0.00 142 G 8.45 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.73 3.65 0.00 2.31 2.62 0.00 0.00 7.14 7.26 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 0.00 144 T 8.16 5.03 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 145 K 7.72 4.62 0.00 1.91 1.69 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 0.95 7.81 146 S 8.70 4.18 0.00 4.24 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.07 4.34 0.00 3.79 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.45 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 0.00 0.00 0.00 149 T 8.10 4.65 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 1.40 0.00 0.00 150 S 8.98 4.30 0.00 3.83 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 0.00 151 Y 8.57 4.89 0.00 2.97 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 0.00 152 P 0.00 4.60 0.00 2.48 2.09 0.00 4.11 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 153 D 8.82 4.66 0.00 2.70 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 0.00 154 V 7.65 5.29 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 1.06 0.00 0.00 0.97 0.00 0.00 155 L 8.31 3.13 0.00 1.43 1.26 -0.75 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.13 4.81 0.00 1.68 1.51 0.00 1.61 0.00 0.00 1.54 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.47 7.81 157 C 8.71 5.23 0.00 1.54 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.51 4.92 0.00 1.70 1.44 1.03 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.01 5.17 0.00 1.82 1.84 0.00 1.83 0.00 0.00 1.77 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.68 7.81 160 A 8.92 4.85 1.19 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 0.00 0.00 161 P 0.00 5.06 0.00 2.00 2.21 0.00 2.97 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.58 0.00 162 I 8.42 4.23 1.93 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 1.33 0.86 0.77 0.00 0.00 163 L 8.71 5.08 0.00 1.63 1.59 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.45 4.30 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.75 4.39 0.00 2.85 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 0.00 166 S 8.04 4.11 0.00 3.94 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 0.00 167 S 8.17 4.17 0.00 4.11 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 0.00 168 C 8.40 4.35 0.00 3.24 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.41 4.02 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.54 1.70 7.81 170 S 7.97 4.22 0.00 4.01 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 0.00 171 A 7.95 4.06 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 0.00 172 Y 7.90 4.75 0.00 3.19 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 0.00 173 P 0.00 4.55 0.00 2.08 2.05 0.00 3.91 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.29 0.00 174 G 9.07 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.08 4.53 0.00 2.48 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.24 6.72 0.00 0.00 0.00 0.00 0.00 2.28 2.58 0.00 176 I 7.96 4.28 1.98 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.93 1.00 0.00 0.00 177 T 8.29 4.51 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 1.25 0.00 0.00 178 S 8.55 4.34 0.00 4.00 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 0.00 179 N 8.17 5.00 0.00 2.89 3.12 0.00 0.00 6.61 8.66 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 0.00 180 M 7.92 5.65 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 181 F 8.84 5.10 0.00 3.10 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 0.00 182 C 9.02 5.34 0.00 2.99 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 0.00 183 A 8.82 5.00 1.19 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 0.00 0.00 184A G 6.85 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.31 4.67 0.00 3.06 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 0.00 185 L 8.70 4.13 0.00 1.74 1.73 0.92 0.88 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 0.00 186 E 8.21 4.04 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 2.34 2.32 0.00 187 G 7.66 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 0.00 0.00 0.00 188A G 9.49 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 0.00 188 K 7.36 4.90 0.00 1.74 1.84 0.00 1.06 0.00 0.00 1.50 0.00 0.00 2.62 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.30 7.81 189 D 8.81 4.63 0.00 2.78 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.78 4.93 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.59 4.81 0.00 2.88 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 0.00 192 Q 8.74 4.26 0.00 2.36 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.55 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 193 G 9.25 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.58 4.71 0.00 2.95 2.78 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 0.00 195 S 8.07 4.51 0.00 3.98 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 0.00 196 G 8.85 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 0.00 0.00 0.00 197 G 7.85 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 0.00 0.00 0.00 0.00 198 P 0.00 5.19 0.00 2.37 2.41 0.00 3.68 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 2.16 2.16 0.00 199 V 8.41 4.52 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 0.86 0.00 0.00 0.53 0.00 0.00 200 V 8.79 4.84 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 0.87 0.00 0.00 0.72 0.00 0.00 201 C 8.78 5.08 0.00 2.79 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 0.00 202 S 9.72 3.34 0.00 3.96 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 0.00 203 G 8.44 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 0.00 204 K 7.53 4.70 0.00 1.81 1.63 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.39 7.81 *209 L 8.27 4.24 0.00 1.51 1.65 1.01 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.73 4.39 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 211 G 8.02 5.36 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 0.00 212 I 8.27 5.04 1.94 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.08 0.94 0.00 0.00 213 V 8.85 3.74 2.37 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 0.98 0.00 0.00 1.24 0.00 0.00 214 S 8.38 4.88 0.00 3.90 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 0.00 215 W 7.23 4.89 0.00 3.39 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 0.00 216 G 8.37 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 0.00 0.00 0.00 217 S 8.50 4.61 0.00 4.29 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *219 G 7.95 4.48 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 0.00 0.00 0.00 220 C 8.14 4.93 0.00 2.94 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 221A A 9.25 4.15 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 0.00 221 Q 7.36 4.49 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.41 4.24 0.00 1.72 1.71 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.63 7.81 223 N 9.37 4.30 0.00 2.82 2.85 0.00 0.00 6.78 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.60 4.33 0.00 1.85 1.77 0.00 1.44 0.00 0.00 1.28 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.47 7.81 225 P 0.00 4.57 0.00 2.13 2.08 0.00 3.73 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 2.11 2.00 0.00 226 G 8.40 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.74 4.33 0.67 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 0.39 0.00 0.00 -0.79 0.00 0.00 228 Y 8.28 4.88 0.00 1.43 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 0.00 229 T 8.58 4.41 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 1.26 0.00 0.00 230 K 9.47 4.99 0.00 2.12 1.93 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.51 7.81 231 V 8.82 3.93 2.34 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 1.14 0.00 0.00 1.15 0.00 0.00 232 C 8.28 4.40 0.00 3.15 3.36 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 0.00 233 N 8.08 4.28 0.00 2.47 2.40 0.00 0.00 6.80 7.59 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 0.00 234 Y 7.85 4.80 0.00 3.15 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 0.00 235 V 8.20 3.68 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.10 0.00 0.00 236 S 8.11 4.16 0.00 3.98 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 0.00 237 W 8.30 4.14 0.00 3.51 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 0.00 238 I 8.49 3.19 2.04 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.09 0.80 0.00 0.00 239 K 7.93 3.73 0.00 1.74 1.77 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.49 7.81 240 Q 7.97 3.82 0.00 2.17 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 241 T 7.21 3.57 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 242 I 7.02 2.13 1.46 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.17 0.05 0.00 0.00 243 A 7.49 4.04 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 0.00 244 S 7.43 4.69 0.00 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.89 4.64 0.00 2.96 3.04 0.00 0.00 6.71 7.58 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 * Residues marked with a * may have inaccurate shift predictions.