NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2464 7.8827 121.4437 61.2095 38.6971 173.7655 17 V 4.2957 8.6817 126.1980 61.8750 32.6319 174.5166 18 G 3.9567 8.5196 114.3279 46.8849 0.0000 173.4586 19 G 4.2393 7.7384 110.1550 44.4371 0.0000 172.7732 20 Y 4.9566 7.9076 117.5263 55.3494 42.5317 175.0007 21 T 4.2280 8.5447 117.3655 63.9452 68.9559 175.9515 22 C 4.0539 8.5738 125.5561 59.6718 35.0581 175.5728 23 G 4.0164 7.7471 103.5813 44.7694 0.0000 172.8168 24 A 4.2950 8.4294 125.3806 53.5238 18.6518 177.0060 25 N 4.2730 8.8882 119.1690 54.5056 36.0972 175.3629 26 T 4.1872 7.6448 107.5836 62.7198 69.8091 175.2285 27 V 4.0371 7.0630 122.3753 60.3551 31.2467 173.5482 28 P 4.4966 0.0000 0.0000 63.9759 32.2378 178.2149 29 Y 4.8498 6.8906 116.0260 56.9732 38.8122 174.6274 30 Q 4.5491 7.4310 123.6477 56.2818 29.4962 175.5404 31 V 4.8343 8.9756 119.4652 59.7223 35.5828 174.2769 32 S 4.7977 8.6563 117.5913 56.6836 64.4840 172.7647 33 L 4.5960 8.4431 127.8492 53.6084 43.0719 175.1057 34 N 5.8113 9.0085 122.6147 49.9699 41.9921 174.9663 *37 S 4.1996 8.4265 120.9386 58.3231 64.1314 174.5167 38 G 3.9721 9.1292 108.5062 46.2730 0.0000 172.8501 39 Y 4.5546 6.5547 114.7118 55.9946 40.0268 172.9257 40 H 4.5001 8.9401 122.0846 56.5462 30.3021 174.8107 41 F 5.0926 7.9067 119.8065 56.8064 39.5596 173.9086 42 C 4.8092 6.8437 114.8441 56.1031 44.6406 173.5884 43 G 4.2916 8.7761 109.6502 45.9719 0.0000 172.2778 44 G 4.5890 8.2249 105.9876 46.2558 0.0000 172.4922 45 S 5.3716 8.8930 115.3344 56.4246 66.7363 173.7048 46 L 4.7557 9.2309 128.1544 54.9741 42.3436 177.0923 47 I 4.3999 8.8490 119.1821 60.1560 38.9467 174.3876 48 N 4.7323 7.5766 117.5172 52.1996 39.5415 174.9743 49 S 4.3036 8.6696 111.8247 60.7089 63.1736 174.7664 50 Q 4.5496 8.9437 120.6801 55.2932 30.6924 174.5279 51 W 5.5931 8.3640 116.1960 55.5877 33.6965 174.1937 52 V 4.9585 9.1629 123.4384 61.1786 34.3913 174.1440 53 V 4.8233 8.8059 127.3100 61.8644 33.2953 174.7737 54 S 5.2640 8.9236 120.7702 57.3903 66.4119 172.0167 55 A 4.5329 8.5169 121.1597 50.9772 19.8181 178.5071 56 A 3.8157 8.3404 124.7324 55.3310 18.3999 179.2902 57 H 4.5355 8.3267 109.7074 57.5895 28.7525 175.5176 58 C 4.6447 7.8516 117.0089 57.6235 40.4551 173.3214 59 Y 4.2015 7.7153 122.3073 57.8424 38.7021 175.1793 60 K 3.4703 7.0828 123.8841 55.4789 35.0881 174.9766 61 S 4.2145 7.9039 114.2205 58.8954 63.8601 173.3581 62 G 3.6715 8.4255 106.7374 46.7461 0.0000 173.5972 63 I 4.3186 7.5795 119.9501 60.1906 39.0523 174.9459 64 Q 4.7440 8.9335 128.6390 54.2315 31.3209 174.2881 65 V 4.1394 8.6298 127.2388 62.2237 33.3319 174.6627 65A R 5.0434 8.9538 127.4299 54.7241 32.2907 175.1291 66 L 4.7563 9.1271 124.8987 52.7344 44.6726 177.6956 *69 G 4.2449 8.2603 107.8532 45.3774 0.0000 172.7141 70 E 4.3763 8.2516 118.5917 55.5245 29.8303 174.0923 71 D 4.8931 7.9763 118.4472 55.2701 44.6996 174.5103 72 N 4.9966 8.9384 117.9411 53.0970 39.4253 176.1379 73 I 3.8562 8.3992 119.3987 62.1079 37.8513 176.1501 74 N 4.8645 7.9706 117.1219 52.9898 39.3492 174.3788 75 V 4.3448 7.4874 118.1856 60.8284 34.5084 174.8242 76 V 4.0933 8.4874 126.9395 62.7057 31.3567 175.1604 77 E 4.4731 9.3479 126.9075 55.3069 30.7797 176.7910 78 G 4.0239 8.1734 105.6226 45.3313 0.0000 174.1082 79 N 4.9673 8.1069 115.7332 52.8400 40.3681 174.2736 80 E 4.5268 8.0810 118.6426 56.4714 30.6990 176.2628 81 Q 4.4520 9.0609 121.1393 54.1929 32.5807 174.1721 82 F 5.5785 8.8609 122.8208 55.9505 41.0770 175.2252 83 I 4.6564 8.7888 124.6436 59.4410 40.9611 175.4907 84 S 4.5750 8.7411 122.7402 58.1632 64.2308 173.4260 85 A 4.5376 8.4963 125.5080 52.2187 18.1895 177.9198 86 S 4.5386 8.8103 117.1721 59.9793 64.4345 174.5761 87 K 4.6658 7.5091 117.2677 55.8512 35.4351 174.8267 88 S 5.2376 8.7423 117.1211 57.0176 66.6619 173.9006 89 I 4.5920 9.1595 124.0617 59.4542 40.0748 174.9598 90 V 4.0929 8.4335 127.2644 62.3738 32.5359 175.2032 91 H 3.5833 8.6247 126.8414 55.7048 30.1138 174.3050 92 P 4.2344 0.0000 0.0000 65.4917 31.0220 177.1687 93 S 4.6723 7.8879 111.7866 57.8924 63.0074 173.1666 94 Y 4.3050 7.9621 123.2693 58.0484 38.8826 174.6924 95 N 4.6723 8.3487 125.7539 51.3758 40.0413 175.0735 96 S 3.8003 7.6613 120.3060 59.8245 63.6916 175.4791 97 N 4.3384 8.2449 119.2190 56.0160 38.3543 176.2624 98 T 3.8993 7.7455 105.3240 61.0788 69.7296 175.1471 99 L 3.7251 7.8618 120.5910 55.2973 39.9095 173.9129 100 N 4.4071 7.7448 117.9209 54.7483 39.5370 174.6136 101 N 4.7269 8.6767 120.4776 54.1415 35.7554 175.7337 102 D 4.6675 7.8642 117.7548 52.8710 39.8990 174.6998 103 I 4.7656 7.1129 120.9375 59.4462 42.1071 172.6020 104 M 5.4697 9.2464 126.9755 54.2751 36.3666 173.2459 105 L 5.4014 9.2257 123.5720 53.2547 44.9086 175.5335 106 I 5.0287 9.0239 122.9738 59.4944 40.7392 174.2852 107 K 3.7869 8.5565 128.7020 54.6323 33.6478 175.5465 108 L 4.4279 8.1064 127.5229 54.1003 41.9965 177.4894 109 K 4.2132 8.7659 122.6079 58.8741 32.4940 177.6240 110 S 4.6056 7.7291 111.6147 55.7672 66.1152 173.3112 111 A 4.3743 8.4137 123.5387 51.8335 18.7227 177.4586 112 A 4.2000 8.8061 124.2476 52.0127 19.5239 177.6013 113 S 4.4052 9.0213 116.3184 57.3150 62.5822 173.9880 114 L 4.5408 8.4789 128.1612 54.5182 42.3983 176.3843 115 N 4.8582 8.8589 118.9900 52.2595 39.7729 174.9389 116 S 4.2902 8.7378 111.7132 60.9238 63.1445 174.8523 117 R 4.3598 8.4160 118.4235 55.8591 31.2767 176.0971 118 V 4.4345 7.8128 115.8848 60.9347 33.0389 173.5904 119 A 5.1765 8.5365 128.6260 50.1209 22.8151 175.3300 120 S 4.8530 8.7920 114.9044 58.2172 64.8316 173.0724 121 I 4.4180 8.4891 121.9222 59.2022 39.6966 175.1352 122 S 4.5083 8.4312 124.6325 58.3492 64.0043 174.0026 123 L 4.1848 8.3686 123.1235 53.5557 42.3080 175.3712 124 P 4.4600 0.0000 0.0000 63.2139 32.3125 176.6187 125 T 4.0146 8.3789 117.0633 65.7952 69.1230 175.2805 *127 S 4.7793 7.5181 112.5852 57.9125 64.0660 174.0788 128 C 4.3651 8.4522 118.6261 56.8537 40.6405 173.6714 129 A 4.3505 8.1016 125.7635 51.7545 19.4235 177.0989 130 S 4.4878 8.0704 115.3830 56.7132 65.2794 173.5339 *132 A 4.2870 8.2065 124.2647 53.5623 19.2511 177.0724 133 G 4.0094 9.0236 110.6287 45.3936 0.0000 174.3938 134 T 4.0298 7.5889 117.3131 63.5221 69.4659 173.7348 135 Q 4.6430 8.5764 127.2793 56.0697 30.1765 175.3442 136 C 5.2986 9.2693 122.3092 55.1258 46.6852 172.3796 137 L 5.1654 9.0142 122.8803 53.6043 43.8656 175.0042 138 I 5.2533 9.0842 127.6316 58.8462 39.8272 174.9374 139 S 4.8703 8.5955 119.5477 56.4478 66.5280 173.1204 140 G 3.7715 7.4991 108.1879 46.3429 0.0000 172.9633 141 W 4.6147 8.6197 116.8137 56.2994 29.2159 177.0051 142 G 4.0670 8.4512 109.5307 44.1916 0.0000 173.3882 143 N 3.6099 8.1912 118.2972 54.2357 38.9388 174.5052 144 T 5.0426 8.1456 112.9895 60.4361 69.3561 174.2458 145 K 4.6081 7.7222 120.9858 54.7935 34.8234 176.2285 146 S 4.2114 8.7344 117.4662 60.2474 62.6982 174.1835 147 S 4.5305 8.1588 115.8155 58.3108 64.9023 174.0824 148 G 3.8695 9.8280 113.8251 44.4461 0.0000 171.2653 149 T 4.8514 7.9918 114.2627 62.1678 72.6204 174.0421 150 S 4.5015 9.4600 121.5340 57.6605 65.9024 172.0798 151 Y 4.8002 8.7802 125.6981 55.7004 39.1990 174.2098 152 P 4.6840 0.0000 0.0000 62.4251 32.9720 175.7235 153 D 4.6468 8.6883 118.6584 56.0165 41.6021 177.1094 154 V 5.1805 7.4518 110.3974 58.7185 34.0988 175.7851 155 L 3.2344 8.4361 125.1646 54.8793 43.0285 176.0247 156 K 4.8683 8.2273 124.8672 54.9401 35.2645 174.5486 157 C 5.2676 8.4114 118.8792 55.2330 43.2373 173.0556 158 L 4.9976 8.6005 122.6516 53.7876 45.4950 174.6851 159 K 5.0991 9.0573 125.7014 55.5695 33.2896 175.9731 160 A 4.8959 9.2026 125.8093 49.6777 23.1837 173.4715 161 P 4.9802 0.0000 0.0000 61.8755 33.7583 175.4266 162 I 4.3714 8.3637 122.9482 61.6558 37.9817 175.5412 163 L 4.8487 8.7653 127.3308 53.1606 43.2148 177.0703 164 S 4.2417 8.5729 115.7983 58.4278 63.7113 174.8426 165 D 4.3795 8.8753 121.6146 57.6152 40.8950 178.9231 166 S 4.1250 8.0210 114.2004 61.6819 63.0973 176.5122 167 S 4.1258 8.1868 119.1057 61.2139 62.5609 175.9043 168 C 4.3526 8.4509 121.2333 59.7961 42.7769 175.8722 169 K 4.0209 8.3938 120.2369 59.5532 31.3767 179.6349 170 S 4.2273 8.1362 114.6366 61.3325 62.7700 176.2137 171 A 4.0554 7.9863 123.0031 53.7984 19.7450 177.3351 172 Y 4.8268 7.8450 114.0907 55.1308 38.3311 172.7257 173 P 4.5560 0.0000 0.0000 63.3484 32.3150 177.3864 174 G 4.0233 9.0716 109.9123 45.9541 0.0000 173.6769 175 Q 4.5181 8.0787 116.3188 55.2611 30.9924 175.5062 176 I 4.3592 7.8965 119.1001 60.0171 37.8962 175.6164 177 T 4.4879 8.2550 116.3817 59.9113 70.5378 175.4950 178 S 4.3397 8.5443 115.0792 60.4110 63.1405 174.4031 179 N 5.0059 8.2799 118.8999 53.3129 38.5128 173.8326 180 M 5.5655 7.9334 116.8814 53.6945 36.0700 174.6633 181 F 5.1440 8.7635 115.4865 55.5973 42.1537 172.7891 182 C 5.8726 9.1913 116.4232 55.3899 40.8421 172.5536 183 A 5.0480 9.0030 121.9946 50.7896 22.3513 174.1224 184 G 4.0219 7.4904 105.4531 44.3692 0.0000 175.0198 184A Y 4.6265 8.5501 121.7923 56.1202 41.5191 176.0713 185 L 4.1935 8.7362 125.5269 57.3790 41.9999 178.9005 186 E 4.1610 8.2215 115.3013 57.0667 29.9869 177.7155 187 G 3.7387 7.9502 108.2534 44.9356 0.0000 172.1116 188 G 4.0946 9.3133 106.2603 44.8733 0.0000 173.4595 188A K 5.0696 7.3672 117.2968 55.1425 35.3715 175.2490 189 D 4.6851 8.7929 123.4292 53.4682 45.5299 174.9226 190 S 4.9243 8.2110 114.4925 58.5516 64.6412 171.9272 191 C 4.7745 9.2858 119.2402 55.2710 46.3496 172.5983 192 Q 4.3661 8.6115 119.5477 57.9968 28.4816 178.3030 193 G 4.2343 9.3033 110.7698 45.6094 0.0000 173.9212 194 D 4.7043 8.3004 118.6743 55.7081 41.6572 177.0497 195 S 4.5625 7.9033 115.8075 59.8263 63.6453 175.0204 196 G 3.9352 8.8869 112.3981 46.4685 0.0000 173.9180 197 G 4.5418 7.8021 107.3184 44.7827 0.0000 171.0807 198 P 5.1691 0.0000 0.0000 62.1688 33.6568 175.6007 199 V 4.6057 8.6509 121.2013 61.4136 34.1979 174.1450 200 V 4.8879 8.6917 128.7165 61.2648 34.1764 173.6823 201 C 5.1021 8.8056 124.6393 55.6848 44.0071 174.5609 202 S 3.4697 9.9013 120.2540 59.6992 60.1416 173.3496 203 G 3.9287 8.5359 104.7571 45.5373 0.0000 174.0027 204 K 4.6910 7.6704 117.8400 53.0324 35.2112 175.5356 *209 L 4.3505 8.2446 122.8619 55.4402 41.9199 175.7660 210 Q 4.4610 8.7535 125.8892 56.7748 30.6217 175.9240 211 G 5.2759 8.0781 104.4862 45.5722 0.0000 171.3788 212 I 5.2612 8.2024 120.4027 58.8124 40.7426 175.2632 213 V 3.9347 8.9630 127.6061 63.9493 31.8126 174.1381 214 S 4.8157 8.3967 120.6979 58.2969 64.2820 173.6249 215 W 4.8511 7.3648 113.9855 55.5097 31.9306 172.3401 216 G 3.9038 8.3111 107.0788 46.2804 0.0000 172.7730 217 S 4.6263 8.5750 115.4977 56.9854 62.7739 172.6955 *219 G 4.4737 8.0908 117.9753 45.7275 0.0000 171.3790 220 C 4.8120 8.2416 116.7781 56.4497 43.0548 173.3173 221 A 3.8311 9.2739 125.0293 53.1807 16.7838 177.0333 221A Q 4.5568 7.7197 116.9396 55.9781 29.8791 175.6395 222 K 4.1488 8.4875 122.1585 58.2522 32.5555 176.1063 223 N 4.2887 9.2486 121.7943 54.1039 36.8817 175.4921 224 K 4.2429 7.6376 116.1560 54.0357 32.6256 173.6705 225 P 4.6416 0.0000 0.0000 61.8461 33.2903 177.5286 226 G 3.5629 8.4379 106.8087 46.1907 0.0000 172.7630 227 V 4.3843 7.6349 122.2808 60.6238 34.2308 174.0274 228 Y 4.9298 8.1221 124.4382 55.9706 42.0169 175.0255 229 T 4.3700 8.5962 120.4600 63.6734 70.0300 174.2502 230 K 5.1437 9.2891 128.1783 55.3132 31.2723 177.2114 231 V 3.9743 8.9080 126.2527 65.8020 31.4238 174.8776 232 C 4.3432 8.3352 112.7824 58.4676 41.4598 175.0834 233 N 4.1415 8.0622 117.3691 54.7897 38.3806 175.5524 234 Y 4.7764 7.9827 117.2953 57.4815 38.9987 177.4752 235 V 3.6802 7.8089 120.6807 66.0231 31.6311 177.6431 236 S 4.0683 8.0774 112.4298 61.0868 62.2907 175.6831 237 W 4.1815 8.3263 130.5841 60.5103 30.4267 177.7430 238 I 2.9919 8.2641 119.9798 64.2049 36.5859 178.6105 239 K 3.7686 8.0841 119.3416 59.5389 31.6353 179.5515 240 Q 3.9187 7.8717 117.3279 59.0780 28.7708 178.6488 241 T 3.7406 7.5783 116.9278 66.5190 68.2435 176.8546 242 I 2.7223 7.2031 121.6016 63.9613 36.7781 178.3165 243 A 4.0980 7.6857 120.1288 53.9650 18.1576 178.2014 244 S 4.7119 7.4485 111.1245 58.1581 63.8932 174.0309 245 N 4.6870 8.0836 124.2184 53.6268 39.4185 174.1559 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 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.62 0.90 0.00 0.00 17 V 8.68 4.30 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 0.93 0.00 0.00 0.95 0.00 0.00 18 G 8.52 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.74 4.24 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 0.00 20 Y 7.91 4.96 0.00 2.97 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 8.54 4.23 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 1.21 0.00 0.00 22 C 8.57 4.05 0.00 2.73 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 23 G 7.75 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 24 A 8.43 4.29 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 25 N 8.89 4.27 0.00 2.89 2.92 0.00 0.00 7.14 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 7.64 4.19 4.24 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 1.23 0.00 0.00 27 V 7.06 4.04 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.50 0.00 2.37 2.27 0.00 3.63 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.99 0.00 29 Y 6.89 4.85 0.00 3.28 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 30 Q 7.43 4.55 0.00 1.78 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 1.89 2.48 0.00 31 V 8.98 4.83 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 0.85 0.00 0.00 1.01 0.00 0.00 32 S 8.66 4.80 0.00 3.01 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 33 L 8.44 4.60 0.00 0.40 1.00 0.83 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.01 5.81 0.00 2.51 2.46 0.00 0.00 6.78 8.36 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 *37 S 8.43 4.20 0.00 3.69 3.65 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 38 G 9.13 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 39 Y 6.55 4.55 0.00 3.05 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 40 H 8.94 4.50 0.00 2.89 3.22 0.00 5.86 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.91 5.09 0.00 3.10 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 42 C 6.84 4.81 0.00 2.23 2.82 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 43 G 8.78 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 8.22 4.59 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 45 S 8.89 5.37 0.00 3.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.23 4.76 0.00 1.87 1.69 1.09 1.11 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 47 I 8.85 4.40 1.90 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 1.17 1.32 0.95 0.00 0.00 48 N 7.58 4.73 0.00 2.99 3.00 0.00 0.00 6.01 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 49 S 8.67 4.30 0.00 4.21 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 50 Q 8.94 4.55 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 1.94 2.15 0.00 51 W 8.36 5.59 0.00 3.41 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 52 V 9.16 4.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.99 0.00 0.00 53 V 8.81 4.82 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 1.03 0.00 0.00 1.01 0.00 0.00 54 S 8.92 5.26 0.00 3.91 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 55 A 8.52 4.53 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 56 A 8.34 3.82 0.28 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 57 H 8.33 4.54 0.00 3.39 3.60 0.00 5.56 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.85 4.64 0.00 3.24 3.34 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 59 Y 7.72 4.20 0.00 2.95 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 60 K 7.08 3.47 0.00 1.45 1.30 0.00 0.69 0.00 0.00 1.24 0.00 0.00 2.38 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.78 0.99 7.81 61 S 7.90 4.21 0.00 3.96 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.43 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 63 I 7.58 4.32 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 1.38 0.64 0.92 0.00 0.00 64 Q 8.93 4.74 0.00 1.98 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 65 V 8.63 4.14 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 0.97 0.00 0.00 0.90 0.00 0.00 65A R 8.95 5.04 0.00 1.67 1.76 0.00 2.66 0.00 0.00 2.49 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.19 0.00 66 L 9.13 4.76 0.00 1.62 1.64 0.96 0.62 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 *69 G 8.26 4.24 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 0.00 70 E 8.25 4.38 0.00 2.18 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 0.00 2.39 2.09 0.00 71 D 7.98 4.89 0.00 2.79 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 72 N 8.94 5.00 0.00 2.87 2.74 0.00 0.00 7.18 7.35 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 73 I 8.40 3.86 1.45 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.53 -0.45 0.00 0.00 74 N 7.97 4.86 0.00 2.71 2.86 0.00 0.00 6.66 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.49 4.34 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 0.78 0.00 0.00 1.01 0.00 0.00 76 V 8.49 4.09 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 0.84 0.00 0.00 0.97 0.00 0.00 77 E 9.35 4.47 0.00 1.96 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 2.26 2.43 0.00 78 G 8.17 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 79 N 8.11 4.97 0.00 2.63 2.80 0.00 0.00 7.14 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 8.08 4.53 0.00 1.42 1.50 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 2.42 2.45 0.00 81 Q 9.06 4.45 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 82 F 8.86 5.58 0.00 2.81 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 83 I 8.79 4.66 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 1.24 0.85 0.91 0.00 0.00 84 S 8.74 4.57 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 8.50 4.54 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 86 S 8.81 4.54 0.00 3.79 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 87 K 7.51 4.67 0.00 1.85 1.88 0.00 1.55 0.00 0.00 1.91 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.22 1.44 7.81 88 S 8.74 5.24 0.00 3.97 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 89 I 9.16 4.59 2.07 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.00 1.16 0.00 0.00 90 V 8.43 4.09 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 0.70 0.00 0.00 0.81 0.00 0.00 91 H 8.62 3.58 0.00 2.86 2.94 0.00 5.66 0.00 0.00 0.00 0.00 6.60 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 4.23 0.00 2.15 2.17 0.00 2.40 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 1.55 1.86 0.00 93 S 7.89 4.67 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 94 Y 7.96 4.30 0.00 3.00 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 95 N 8.35 4.67 0.00 2.57 2.44 0.00 0.00 6.59 7.44 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 96 S 7.66 3.80 0.00 3.96 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 97 N 8.24 4.34 0.00 2.76 2.78 0.00 0.00 6.92 7.06 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 98 T 7.75 3.90 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 1.09 0.00 0.00 99 L 7.86 3.73 0.00 1.37 1.82 0.61 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.74 4.41 0.00 2.81 2.65 0.00 0.00 7.24 5.99 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 0.00 101 N 8.68 4.73 0.00 2.94 2.60 0.00 0.00 7.23 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 7.86 4.67 0.00 3.06 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 0.00 103 I 7.11 4.77 1.45 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.25 0.02 0.00 0.00 104 M 9.25 5.47 0.00 2.12 1.85 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.66 0.00 105 L 9.23 5.40 0.00 1.75 1.89 0.02 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.02 5.03 1.93 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 1.20 0.97 0.89 0.00 0.00 107 K 8.56 3.79 0.00 0.79 1.05 0.00 1.30 0.00 0.00 1.34 0.00 0.00 2.80 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.71 0.21 7.81 108 L 8.11 4.43 0.00 1.46 1.57 0.95 0.72 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 0.00 109 K 8.77 4.21 0.00 1.59 1.83 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.54 7.81 110 S 7.73 4.61 0.00 3.88 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 0.00 111 A 8.41 4.37 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 0.00 112 A 8.81 4.20 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 0.00 113 S 9.02 4.41 0.00 3.88 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 0.00 114 L 8.48 4.54 0.00 1.70 1.61 0.96 1.10 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 0.00 115 N 8.86 4.86 0.00 2.88 2.92 0.00 0.00 6.58 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 0.00 116 S 8.74 4.29 0.00 4.01 4.06 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 0.00 117 R 8.42 4.36 0.00 1.90 2.00 0.00 3.21 0.00 0.00 3.16 7.34 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.52 4.78 0.00 3.97 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 0.00 128 C 8.45 4.37 0.00 2.94 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 0.00 129 A 8.10 4.35 1.04 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 0.00 0.00 130 S 8.07 4.49 0.00 3.82 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 *132 A 8.21 4.29 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 0.00 133 G 9.02 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 0.00 134 T 7.59 4.03 4.22 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 1.15 0.00 0.00 135 Q 8.58 4.64 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 136 C 9.27 5.30 0.00 2.79 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 0.00 137 L 9.01 5.17 0.00 1.76 1.58 1.00 1.21 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 0.00 138 I 9.08 5.25 1.87 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.42 1.00 0.00 0.00 139 S 8.60 4.87 0.00 3.57 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 0.00 140 G 7.50 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 0.00 141 W 8.62 4.61 0.00 3.17 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 0.00 142 G 8.45 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.19 3.61 0.00 2.09 2.54 0.00 0.00 7.11 7.90 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 0.00 144 T 8.15 5.04 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 1.25 0.00 0.00 145 K 7.72 4.61 0.00 1.94 1.87 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.28 1.30 7.81 146 S 8.73 4.21 0.00 3.83 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 0.00 147 S 8.16 4.53 0.00 3.85 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.83 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 0.00 0.00 0.00 149 T 7.99 4.85 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 1.51 0.00 0.00 150 S 9.46 4.50 0.00 3.85 3.63 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 0.00 151 Y 8.78 4.80 0.00 2.95 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 4.68 0.00 2.41 2.07 0.00 4.06 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 2.13 2.00 0.00 153 D 8.69 4.65 0.00 2.80 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 0.00 154 V 7.45 5.18 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 1.06 0.00 0.00 0.96 0.00 0.00 155 L 8.44 3.23 0.00 1.15 1.21 -0.73 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.23 4.87 0.00 1.64 1.48 0.00 1.59 0.00 0.00 1.53 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.45 7.81 157 C 8.41 5.27 0.00 1.52 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 8.60 5.00 0.00 1.71 1.46 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.06 5.10 0.00 1.80 1.95 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.67 7.81 160 A 9.20 4.90 1.17 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 0.00 0.00 161 P 0.00 4.98 0.00 2.02 2.09 0.00 3.06 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.75 0.00 162 I 8.36 4.37 1.90 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.58 0.85 0.00 0.00 163 L 8.77 4.85 0.00 1.55 1.60 0.93 0.77 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 0.00 164 S 8.57 4.24 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 8.88 4.38 0.00 2.80 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 8.02 4.13 0.00 4.10 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.19 4.13 0.00 4.06 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.45 4.35 0.00 3.17 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 0.00 169 K 8.39 4.02 0.00 1.88 1.90 0.00 1.86 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.53 1.67 7.81 170 S 8.14 4.23 0.00 4.04 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 0.00 171 A 7.99 4.06 1.14 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 0.00 172 Y 7.85 4.83 0.00 3.07 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 0.00 173 P 0.00 4.56 0.00 2.08 2.04 0.00 3.86 0.00 0.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 174 G 9.07 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 0.00 175 Q 8.08 4.52 0.00 2.47 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.67 0.00 0.00 0.00 0.00 0.00 2.28 2.54 0.00 176 I 7.90 4.36 1.98 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.05 1.00 0.00 0.00 177 T 8.25 4.49 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 8.54 4.34 0.00 4.01 4.06 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 0.00 179 N 8.28 5.01 0.00 3.09 3.12 0.00 0.00 6.61 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 0.00 180 M 7.93 5.57 0.00 1.84 2.11 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 2.62 0.00 181 F 8.76 5.14 0.00 3.10 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 0.00 182 C 9.19 5.87 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 9.00 5.05 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.49 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 184A Y 8.55 4.63 0.00 3.07 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 0.00 185 L 8.74 4.19 0.00 1.73 1.73 0.92 0.87 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 8.22 4.16 0.00 2.35 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 2.27 1.88 0.00 187 G 7.95 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 0.00 188 G 9.31 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 188A K 7.37 5.07 0.00 1.49 1.74 0.00 1.43 0.00 0.00 1.40 0.00 0.00 2.18 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.22 7.81 189 D 8.79 4.69 0.00 2.75 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 0.00 190 S 8.21 4.92 0.00 4.08 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 0.00 191 C 9.29 4.77 0.00 2.93 3.06 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 0.00 192 Q 8.61 4.37 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.16 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 193 G 9.30 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 0.00 0.00 0.00 194 D 8.30 4.70 0.00 2.95 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 0.00 195 S 7.90 4.56 0.00 4.03 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 0.00 196 G 8.89 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 0.00 0.00 0.00 197 G 7.80 4.54 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 0.00 198 P 0.00 5.17 0.00 2.34 2.39 0.00 3.70 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 2.18 2.21 0.00 199 V 8.65 4.61 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 0.59 0.00 0.00 200 V 8.69 4.89 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.62 0.00 0.00 201 C 8.81 5.10 0.00 2.79 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 0.00 202 S 9.90 3.47 0.00 3.95 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 8.54 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 0.00 204 K 7.67 4.69 0.00 1.72 1.64 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.30 1.40 7.81 *209 L 8.24 4.35 0.00 1.50 1.65 1.00 0.77 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 8.75 4.46 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.44 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 211 G 8.08 5.28 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 0.00 212 I 8.20 5.26 1.93 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 1.14 0.98 0.00 0.00 213 V 8.96 3.93 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 1.05 0.00 0.00 1.16 0.00 0.00 214 S 8.40 4.82 0.00 4.01 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 0.00 215 W 7.36 4.85 0.00 3.34 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 0.00 216 G 8.31 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 0.00 217 S 8.58 4.63 0.00 4.23 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 *219 G 8.09 4.47 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 0.00 220 C 8.24 4.81 0.00 2.92 3.06 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 0.00 221 A 9.27 3.83 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 221A Q 7.72 4.56 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.00 0.00 0.00 0.00 0.00 0.00 2.60 2.31 0.00 222 K 8.49 4.15 0.00 1.71 1.72 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 1.61 7.81 223 N 9.25 4.29 0.00 2.81 2.81 0.00 0.00 6.78 7.63 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 0.00 224 K 7.64 4.24 0.00 1.70 1.75 0.00 1.58 0.00 0.00 1.08 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.47 7.81 225 P 0.00 4.64 0.00 2.13 2.11 0.00 3.62 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 226 G 8.44 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.63 4.38 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 0.43 0.00 0.00 -0.73 0.00 0.00 228 Y 8.12 4.93 0.00 1.43 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 0.00 0.00 0.00 229 T 8.60 4.37 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 1.23 0.00 0.00 230 K 9.29 5.14 0.00 2.13 1.92 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.64 7.81 231 V 8.91 3.97 2.36 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 1.22 0.00 0.00 1.13 0.00 0.00 232 C 8.34 4.34 0.00 3.16 3.23 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 0.00 233 N 8.06 4.14 0.00 2.26 2.35 0.00 0.00 6.83 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 0.00 234 Y 7.98 4.78 0.00 3.27 3.30 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 0.00 235 V 7.81 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 1.12 0.00 0.00 1.03 0.00 0.00 236 S 8.08 4.07 0.00 3.96 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 0.00 237 W 8.33 4.18 0.00 3.52 3.53 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 0.00 238 I 8.26 2.99 1.98 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.95 0.71 0.00 0.00 239 K 8.08 3.77 0.00 1.78 1.77 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.55 7.81 240 Q 7.87 3.92 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.96 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 241 T 7.58 3.74 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 0.77 0.00 0.00 242 I 7.20 2.72 1.43 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.06 0.55 0.00 0.00 243 A 7.69 4.10 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 0.00 244 S 7.45 4.71 0.00 3.75 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 0.00 245 N 8.08 4.69 0.00 2.94 2.98 0.00 0.00 6.73 7.77 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 * Residues marked with a * may have inaccurate shift predictions.