NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2666 7.8827 121.4506 61.2414 38.5721 173.8271 17 V 4.2417 8.6126 126.3920 62.0418 32.5628 174.9222 18 G 4.1018 8.5650 114.1212 46.5719 0.0000 173.3820 19 G 4.0733 7.5544 108.9709 44.4748 0.0000 172.3671 20 Y 4.9466 7.5133 116.1251 55.1151 41.1089 174.9733 21 T 4.3349 8.5369 116.8990 63.8949 68.8125 175.9015 22 C 4.2930 8.5157 125.9050 58.6520 37.5713 175.9586 23 G 3.9621 7.8828 102.4164 45.1065 0.0000 172.5942 24 A 4.2221 8.2064 124.3320 52.9684 18.5408 177.3800 25 N 4.3816 9.0406 119.1014 54.0792 36.0992 175.5928 26 T 4.0326 7.5733 109.3364 63.4056 69.6487 175.0982 27 V 3.9728 7.1344 122.4349 60.3351 30.9659 173.7484 28 P 4.4277 0.0000 0.0000 64.4457 32.2020 178.4224 29 Y 4.8037 6.9604 115.9743 57.3866 38.7052 174.5708 30 Q 4.4396 7.5590 123.5833 56.3750 29.3619 175.6013 31 V 4.8585 8.9043 119.6307 59.6933 35.6244 174.4124 32 S 4.8951 8.9202 117.8304 56.6372 64.9365 172.5990 33 L 4.8250 8.3288 126.8552 53.0257 43.5139 174.9093 34 N 5.6249 8.9096 122.3595 50.0959 42.1857 174.9890 *37 S 4.3757 8.6113 120.3995 58.8122 64.3925 174.0959 38 G 4.0678 8.2270 112.2498 47.3477 0.0000 174.3182 39 Y 4.7222 6.8797 115.7863 55.5194 40.5205 173.2801 40 H 4.4124 8.8325 121.6287 56.4901 30.1692 174.6176 41 F 5.0648 7.9780 121.4875 57.7018 40.1997 174.3149 42 C 4.6927 6.7735 114.7151 56.1222 41.2214 173.1726 43 G 4.4375 9.1108 108.7202 46.0391 0.0000 172.2589 44 G 4.7847 7.9491 105.7438 46.5087 0.0000 172.7116 45 S 5.4757 9.0085 115.6767 56.3655 66.7730 173.7386 46 L 4.6977 9.2902 128.1133 55.0381 42.2242 177.1425 47 I 4.5276 8.7186 119.6955 61.1858 39.2070 174.4452 48 N 4.9857 7.7033 116.8620 51.6151 39.8685 174.6620 49 S 4.3195 8.7986 111.4257 60.6458 62.8878 174.8232 50 Q 4.4396 8.1497 117.9134 55.1362 31.2844 174.8238 51 W 5.3884 8.2901 118.8788 54.8313 33.7102 174.2373 52 V 4.9977 9.0915 123.8252 61.1447 34.3619 174.1586 53 V 4.7616 9.1856 127.7349 62.0606 33.3568 174.7708 54 S 4.8460 8.8856 121.6063 57.2181 66.4069 172.0264 55 A 4.8353 8.4536 120.7393 50.8666 20.1971 178.6258 56 A 3.8663 8.1803 124.0996 54.9829 18.5347 179.3102 57 H 4.5240 8.0216 110.0449 57.6271 28.8570 175.4929 58 C 4.6891 7.7065 117.0053 57.2444 40.2670 173.1683 59 Y 4.2706 7.5408 122.0019 57.8537 38.7824 175.2537 60 K 3.7450 6.9404 125.6078 54.9208 35.0316 174.9786 61 S 4.2305 7.9263 118.5197 58.5975 64.4040 173.4229 62 G 3.6702 8.3269 107.0434 46.6812 0.0000 173.8598 63 I 4.4144 7.3485 119.0993 60.1493 39.5505 175.8231 64 Q 4.7953 8.8928 127.9755 54.2018 31.5457 174.4358 65 V 4.2947 8.9292 127.0855 62.3164 33.3966 174.7661 66 R 5.1178 9.1077 126.6116 54.6664 32.7660 174.9984 67 L 4.8747 9.1934 124.4095 53.6044 45.0498 177.7255 68 G 4.1987 8.7424 106.1326 46.4132 0.0000 173.6988 69 E 4.1945 7.8319 119.1022 55.6572 29.9313 175.6299 *71 D 5.1007 7.7646 119.2575 54.4273 43.4253 174.1890 72 N 5.4574 8.5425 118.0427 52.7852 39.3511 176.0447 73 I 4.0449 8.0796 118.4815 61.4660 38.1160 176.0314 74 N 4.7207 8.1962 117.8881 53.1046 38.9023 174.8842 75 V 4.2887 7.4085 118.2831 60.7700 34.2968 174.8513 76 V 3.9162 8.5341 127.2257 62.9743 31.1468 175.1258 77 E 4.4141 10.2309 127.7243 56.0166 30.0584 177.0915 78 G 4.0160 8.9257 107.6790 45.1056 0.0000 173.7950 79 N 4.9844 7.9184 114.9867 52.7158 40.5412 174.2789 80 E 4.4363 8.0714 118.4370 56.4342 30.7891 176.2386 81 Q 4.4119 8.9384 120.4973 54.2597 32.6643 174.1971 82 F 5.5784 8.8170 122.9549 56.0325 40.9677 175.2377 83 I 4.6587 8.6686 124.6592 59.2978 40.8189 175.5573 84 S 4.6702 8.7180 122.6650 58.2653 64.1755 173.3957 85 A 4.5316 8.8014 126.3615 52.2207 18.2193 177.6746 86 S 4.5991 8.6875 116.9388 59.6568 64.6729 174.7044 87 K 4.7503 7.6225 117.3782 55.4032 35.9503 175.1638 88 S 5.1901 8.7632 117.2679 56.9994 66.0793 173.7780 89 I 4.5088 9.6277 126.5917 59.2787 38.8973 175.0119 90 V 4.0992 8.3195 127.0340 62.4306 32.5591 175.1037 91 H 3.5797 8.6635 127.0960 55.7760 30.0539 174.4523 92 P 4.2703 0.0000 0.0000 65.3801 31.1943 177.1632 93 S 4.6425 7.8602 112.3197 57.9486 63.1396 173.1087 94 Y 4.3094 7.7987 122.6898 58.1251 38.7458 175.1468 95 N 4.3875 8.8309 126.6235 51.5371 39.4029 175.2346 96 S 3.5849 7.9585 121.5287 60.9563 62.8230 174.7769 97 N 4.3854 7.9961 118.3035 55.4345 38.7886 175.4212 98 T 4.1327 7.5664 105.0065 60.2863 70.4661 174.6738 99 L 3.8099 8.0270 120.7377 55.1428 39.9580 174.0568 100 N 4.4427 7.6403 118.3647 54.8288 39.5303 174.4432 101 N 4.7672 8.7246 119.1877 53.7073 36.3695 175.6380 102 D 4.7374 7.9434 116.5498 53.3354 39.2721 174.7756 103 I 4.7499 7.0521 120.5638 59.2901 42.3123 173.2979 104 M 5.4450 9.1901 127.8179 53.9701 36.0838 173.3928 105 L 5.3986 9.3230 125.1140 53.2487 44.7070 175.4650 106 I 5.2266 8.7611 123.4615 59.4449 40.6871 174.3889 107 K 3.6739 8.5501 129.1523 54.9478 33.4945 175.5786 108 L 4.5326 8.8746 128.6386 54.0025 41.7580 177.7251 109 K 4.0554 8.6122 123.2683 58.7059 33.0178 177.4488 110 S 4.6073 7.5863 112.3747 55.5678 65.8199 173.3707 111 A 4.2987 8.5422 124.4542 52.2352 18.5764 177.3276 112 A 4.2736 9.3254 125.2150 51.9658 19.6006 176.8631 113 S 4.5412 9.1149 115.6203 56.9913 63.4072 173.6489 114 L 4.7762 8.5387 128.0237 53.5313 42.7442 175.4238 115 N 4.9744 8.7995 122.7936 51.7608 39.5800 174.8674 116 S 4.1090 8.8533 110.8720 61.0361 63.3453 174.8186 117 R 4.3615 7.9014 117.5990 55.8313 31.4539 175.8913 118 V 4.4065 7.5471 116.7305 60.8187 32.9843 173.5595 119 A 5.1280 8.4718 128.7195 49.8998 22.6185 175.4603 120 S 4.8390 8.8598 115.5943 58.3281 64.4324 173.0849 121 I 4.4468 8.3538 121.8577 58.8961 39.8902 175.2316 122 S 4.2891 8.4948 123.8627 58.3027 63.4634 173.3271 123 L 4.3922 8.4030 126.6464 53.3741 42.4239 175.1791 124 P 4.4646 0.0000 0.0000 63.0967 32.0861 176.2448 125 T 4.1757 8.2641 109.2101 62.5424 70.1232 174.7160 *127 S 4.6359 7.5792 114.4011 57.8950 64.0346 174.2032 128 C 4.3663 8.4435 118.6600 56.8775 40.6635 173.4992 129 A 4.3874 7.3784 122.3059 51.6796 19.5103 177.4997 130 S 4.4602 7.7536 115.7276 56.8897 64.8598 173.7271 *132 A 4.2898 8.2200 124.4877 53.5901 19.2795 176.8844 133 G 4.0326 8.9380 110.8212 45.4342 0.0000 174.4238 134 T 4.0066 7.5964 117.2065 63.7119 69.4020 173.9128 135 Q 4.5118 8.6545 125.4867 55.9489 29.8061 175.9980 136 C 5.2682 9.2081 120.2212 55.0419 46.2860 172.4906 137 L 5.1664 9.0264 123.2020 53.7685 43.5900 175.0474 138 I 5.2592 9.1555 127.7409 58.8163 39.7582 174.9697 139 S 4.9192 8.7762 119.7119 56.2871 66.5431 173.1593 140 G 3.8497 7.3897 109.2230 46.2980 0.0000 172.9851 141 W 4.8413 8.6309 117.6465 56.1865 29.2080 177.1106 142 G 4.1004 8.7053 109.6044 44.9059 0.0000 173.1162 143 N 3.7872 9.2118 118.0545 54.2034 39.0292 175.2439 144 T 5.1649 8.1744 113.4154 60.6694 69.5232 174.5743 145 K 4.6057 7.4785 121.4214 54.8486 34.9861 176.2107 146 S 4.3882 8.6085 116.2575 59.3010 63.7389 174.4229 147 S 4.2526 7.8077 117.3323 60.0220 65.3581 173.4859 148 G 3.8067 9.6414 113.3183 44.1010 0.0000 171.1068 149 T 5.0053 7.9293 108.2500 59.2039 71.2399 173.4888 150 S 4.5822 8.2165 120.6560 56.5438 65.9262 171.6860 151 Y 4.9275 8.6978 124.8291 55.6141 39.3889 174.1168 152 P 4.6878 0.0000 0.0000 62.6877 33.0152 175.2616 153 D 4.8854 8.6112 117.7857 55.7144 43.0361 177.3720 154 V 4.8554 7.7648 109.8738 59.7048 33.2092 176.0651 155 L 3.3426 8.5154 125.1844 54.8575 43.2458 175.7630 156 K 4.8301 8.0310 124.5255 54.9510 35.1019 174.6409 157 C 5.1878 8.4734 119.6367 55.0290 41.6345 172.9770 158 L 5.0874 9.0010 123.2153 53.5057 45.3216 175.0442 159 K 5.0901 9.1117 125.8649 55.6168 33.0257 176.0590 160 A 4.8384 8.9355 126.6755 49.7557 23.0821 173.3589 161 P 5.0279 0.0000 0.0000 61.6446 33.9485 175.3507 162 I 4.2344 8.4119 122.7184 61.7802 37.9558 175.2551 163 L 4.9550 8.7577 127.4905 52.8373 43.4185 176.9761 164 S 4.1993 8.6706 116.4872 58.6755 63.6343 174.6936 165 D 4.3787 8.9907 121.7995 57.8067 40.8657 178.4849 166 S 4.0950 8.1998 112.9314 61.8476 62.2503 176.1114 167 S 4.1049 8.1586 115.4003 61.3653 62.0714 175.3312 168 C 4.3185 8.3730 121.2254 59.7615 42.8115 175.7654 169 K 4.0336 8.4410 120.6611 59.4475 31.3835 179.5231 170 S 4.2469 7.9933 113.5213 61.0355 63.0485 176.1614 171 A 4.0836 7.6773 123.6000 53.6787 19.4645 177.2321 172 Y 4.7687 7.8142 115.2318 54.7690 38.2969 171.7119 173 P 4.4198 0.0000 0.0000 63.2398 32.0697 177.1288 174 G 3.9964 9.0727 110.6232 45.9703 0.0000 173.5444 175 Q 4.4364 7.9800 117.1603 55.4862 30.5173 175.5567 176 I 4.3871 7.8251 119.0943 59.8870 37.3927 175.6228 177 T 4.4522 8.2694 116.5219 60.1142 70.2915 175.5322 178 S 4.3280 8.5483 115.0218 60.2693 63.2689 174.3802 179 N 5.0108 8.2276 118.5837 53.3584 38.5444 173.7891 180 M 5.6678 7.6932 116.7472 53.8849 36.1060 174.7560 181 F 5.0818 8.7624 114.1848 56.0932 41.8814 172.5427 182 C 5.7852 9.2424 117.1005 55.4036 40.7487 172.4976 183 A 5.0737 8.9591 122.2100 50.5771 22.4319 174.1957 184A G 4.0042 7.5844 105.4636 44.3141 0.0000 175.5455 184 Y 4.6685 8.4878 122.7450 56.2232 41.4414 175.9576 185 L 4.1460 8.7142 125.3603 57.4464 42.1438 179.3361 186 E 4.0304 8.2159 117.5863 57.5001 29.5738 177.1410 187 G 3.8273 7.5767 103.5654 45.0734 0.0000 173.1306 188A G 3.9625 9.9762 106.3253 44.9116 0.0000 173.4116 188 K 4.9053 7.5115 117.7897 55.6045 35.4952 174.8445 189 D 4.7525 9.0124 124.0568 53.4291 45.5160 174.4968 190 S 4.9211 8.0970 114.0717 58.2948 64.9315 171.7638 191 C 4.8859 9.8966 119.6706 55.3576 44.1079 172.6389 192 Q 4.4091 8.7899 118.5934 57.8941 28.5101 178.1453 193 G 4.4254 9.2947 110.5378 45.5564 0.0000 173.8345 194 D 4.7131 8.2932 118.7949 55.3099 41.8149 176.8350 195 S 4.5216 8.0951 115.1995 60.3190 63.5166 175.4003 196 G 3.8742 8.8256 111.8332 46.6042 0.0000 174.0165 197 G 4.2907 7.7920 107.2754 44.9016 0.0000 171.2273 198 P 4.9792 0.0000 0.0000 62.4804 33.2910 175.6076 199 V 4.5360 8.6758 122.6251 61.4103 33.7387 174.1316 200 V 4.8935 8.6451 128.8390 61.2545 34.2595 173.6573 201 C 5.0393 8.7008 124.6965 55.5305 43.9130 174.6155 202 S 3.8139 9.5944 120.4254 59.7957 59.8956 172.8321 203 G 3.9406 8.4700 104.0071 46.0153 0.0000 174.0159 204 K 4.8986 7.4979 117.2642 53.1307 35.0033 175.4954 *209 L 4.3332 8.1808 122.9658 55.4426 41.8294 175.8236 210 Q 4.3613 8.2924 124.2936 56.8684 30.4334 175.3749 211 G 5.2689 8.5573 105.2270 45.6863 0.0000 171.6649 212 I 5.1629 8.2348 119.8922 58.8463 40.9725 175.2452 213 V 3.7677 8.8675 127.5413 64.6428 31.7707 174.0075 214 S 5.0298 8.7949 121.2388 58.0850 64.5098 174.3439 215 W 5.2341 7.4121 113.9115 55.3324 32.9135 173.7295 216 G 4.2506 8.4661 105.7164 46.2679 0.0000 172.8313 217 S 4.7468 8.9263 116.5326 57.0423 63.9645 174.6297 *219 G 3.9733 8.2229 115.0156 45.5506 0.0000 171.6359 220 C 4.8796 8.1475 115.4777 56.3711 45.2337 173.7918 221A A 3.9669 8.9769 125.4995 53.1666 16.7547 176.8366 221 Q 4.6171 7.3065 117.5197 55.8637 30.0229 175.9094 222 K 4.2337 8.4900 122.0735 58.2334 32.5042 176.3264 223 N 4.2394 9.1908 121.8948 53.8845 36.9986 175.1959 224 K 4.1852 7.6761 118.1685 53.8231 31.8912 173.8215 225 P 4.6047 0.0000 0.0000 61.5295 33.1313 177.0323 226 G 3.4916 8.1143 105.5597 46.0365 0.0000 172.7788 227 V 4.2780 7.4341 123.6743 60.8077 33.6610 174.1751 228 Y 4.9739 8.1815 124.2596 56.1084 42.4035 174.8235 229 T 4.5365 8.5675 119.0704 63.5799 70.1746 174.5362 230 K 5.1722 9.1280 127.7619 55.3031 31.2147 177.3130 231 V 4.0065 8.8697 126.0886 65.5440 31.4458 174.8216 232 C 4.3417 8.2731 112.8198 58.1148 41.5602 174.6878 233 N 4.2436 7.9486 117.0246 54.3135 38.5507 175.3736 234 Y 4.8240 7.9989 117.5764 57.2876 39.3933 177.2059 235 V 3.7047 8.0024 120.5771 66.0491 31.4682 177.4975 236 S 4.3379 8.0682 113.0374 60.4142 63.4203 176.1127 237 W 4.2031 8.2871 131.7072 60.1356 30.5084 177.9683 238 I 3.0480 8.2220 120.0144 64.0848 36.4789 178.3494 239 K 3.7233 7.8745 119.1807 59.6999 31.7051 179.2529 240 Q 3.8733 7.6735 118.2149 59.1042 28.8615 177.9848 241 T 3.7288 7.4982 117.1583 66.4257 68.0540 176.8149 242 I 2.5545 7.0496 114.6621 63.4024 37.0673 178.0535 243 A 4.0519 7.3684 122.2806 53.9785 18.2362 178.6680 244 S 4.6697 7.4033 109.0695 58.2158 63.6472 174.0843 245 N 4.7092 7.8553 124.2764 53.8134 39.0519 174.0473 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 4.27 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 1.23 0.67 0.90 0.00 0.00 17 V 8.61 4.24 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 0.95 0.00 0.00 0.89 0.00 0.00 18 G 8.56 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 19 G 7.55 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 20 Y 7.51 4.95 0.00 3.08 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 21 T 8.54 4.33 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 8.52 4.29 0.00 2.75 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 23 G 7.88 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 24 A 8.21 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 25 N 9.04 4.38 0.00 2.91 2.98 0.00 0.00 7.18 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 7.57 4.03 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 7.13 3.97 1.74 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 0.25 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.43 0.00 2.36 2.38 0.00 3.57 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 2.14 1.97 0.00 29 Y 6.96 4.80 0.00 3.25 3.43 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 30 Q 7.56 4.44 0.00 1.82 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.71 0.00 0.00 0.00 0.00 0.00 1.90 2.48 0.00 31 V 8.90 4.86 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.00 0.00 0.00 32 S 8.92 4.90 0.00 3.11 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 8.33 4.83 0.00 0.53 0.83 0.84 0.53 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 8.91 5.62 0.00 2.43 2.45 0.00 0.00 6.78 7.15 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 *37 S 8.61 4.38 0.00 3.75 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 38 G 8.23 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 39 Y 6.88 4.72 0.00 3.07 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 40 H 8.83 4.41 0.00 2.90 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.98 5.06 0.00 3.08 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 42 C 6.77 4.69 0.00 2.30 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 9.11 4.44 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 0.00 44 G 7.95 4.78 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 45 S 9.01 5.48 0.00 3.76 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 9.29 4.70 0.00 1.86 1.68 1.13 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.72 4.53 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 1.45 1.02 0.95 0.00 0.00 48 N 7.70 4.99 0.00 2.95 3.01 0.00 0.00 6.04 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 8.80 4.32 0.00 4.24 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 50 Q 8.15 4.44 0.00 2.06 1.78 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 2.27 2.36 0.00 51 W 8.29 5.39 0.00 3.21 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 52 V 9.09 5.00 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 1.01 0.00 0.00 0.99 0.00 0.00 53 V 9.19 4.76 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 0.90 0.00 0.00 1.01 0.00 0.00 54 S 8.89 4.85 0.00 3.93 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 8.45 4.84 1.22 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 0.00 0.00 56 A 8.18 3.87 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.02 4.52 0.00 3.40 3.57 0.00 5.56 0.00 0.00 0.00 0.00 7.02 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 4.69 0.00 3.23 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 59 Y 7.54 4.27 0.00 2.97 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 60 K 6.94 3.75 0.00 1.10 1.10 0.00 0.83 0.00 0.00 1.19 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 0.94 7.81 61 S 7.93 4.23 0.00 3.96 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 62 G 8.33 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 7.35 4.41 1.88 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.66 0.94 0.00 0.00 64 Q 8.89 4.80 0.00 1.99 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.95 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 65 V 8.93 4.29 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 0.90 0.00 0.00 0.91 0.00 0.00 66 R 9.11 5.12 0.00 1.58 1.72 0.00 2.59 0.00 0.00 2.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.96 0.00 0.00 77 E 10.23 4.41 0.00 2.04 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 2.27 2.39 0.00 78 G 8.93 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 7.92 4.98 0.00 2.62 2.79 0.00 0.00 7.11 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 8.07 4.44 0.00 1.40 1.65 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 2.40 2.46 0.00 81 Q 8.94 4.41 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 82 F 8.82 5.58 0.00 2.82 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 83 I 8.67 4.66 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.74 0.93 0.00 0.00 84 S 8.72 4.67 0.00 3.75 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 85 A 8.80 4.53 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 8.69 4.60 0.00 3.82 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 7.62 4.75 0.00 1.83 1.88 0.00 1.42 0.00 0.00 1.85 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.23 1.48 7.81 88 S 8.76 5.19 0.00 3.98 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 89 I 9.63 4.51 2.06 0.00 0.00 1.00 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 1.26 1.14 0.00 0.00 90 V 8.32 4.10 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 0.73 0.00 0.00 0.83 0.00 0.00 91 H 8.66 3.58 0.00 2.88 2.96 0.00 5.65 0.00 0.00 0.00 0.00 6.61 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 4.27 0.00 2.17 2.18 0.00 2.31 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.93 0.00 93 S 7.86 4.64 0.00 3.93 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 7.80 4.31 0.00 2.91 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.83 4.39 0.00 2.55 2.58 0.00 0.00 6.41 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 96 S 7.96 3.58 0.00 3.66 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 97 N 8.00 4.39 0.00 2.65 2.86 0.00 0.00 7.05 7.37 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 98 T 7.57 4.13 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 1.10 0.00 0.00 99 L 8.03 3.81 0.00 1.53 1.91 0.39 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.64 4.44 0.00 2.70 2.65 0.00 0.00 7.26 6.56 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 0.00 101 N 8.72 4.77 0.00 3.04 2.58 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 4.74 0.00 3.11 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 7.05 4.75 1.23 0.00 0.00 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 1.14 1.25 -0.05 0.00 0.00 104 M 9.19 5.45 0.00 2.25 1.83 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.63 0.00 105 L 9.32 5.40 0.00 1.67 1.85 -0.07 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.76 5.23 1.94 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 0.96 0.89 0.00 0.00 107 K 8.55 3.67 0.00 0.79 1.07 0.00 1.28 0.00 0.00 1.29 0.00 0.00 2.61 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.62 0.21 7.81 108 L 8.87 4.53 0.00 1.24 1.63 0.98 0.84 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 0.00 109 K 8.61 4.06 0.00 1.83 2.02 0.00 1.51 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.34 7.81 110 S 7.59 4.61 0.00 3.92 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 0.00 111 A 8.54 4.30 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 9.33 4.27 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 9.11 4.54 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 0.00 114 L 8.54 4.78 0.00 1.69 1.62 0.96 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.80 4.97 0.00 2.80 2.91 0.00 0.00 6.30 7.89 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 0.00 116 S 8.85 4.11 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 7.90 4.36 0.00 1.81 2.16 0.00 3.27 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 7.58 4.64 0.00 3.99 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 0.00 128 C 8.44 4.37 0.00 2.93 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 0.00 129 A 7.38 4.39 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 7.75 4.46 0.00 3.92 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 *132 A 8.22 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 0.00 133 G 8.94 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 0.00 134 T 7.60 4.01 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 135 Q 8.65 4.51 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 136 C 9.21 5.27 0.00 2.78 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 0.00 137 L 9.03 5.17 0.00 1.77 1.60 0.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.16 5.26 1.85 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.51 0.92 0.00 0.00 139 S 8.78 4.92 0.00 3.49 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 0.00 140 G 7.39 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 0.00 141 W 8.63 4.84 0.00 3.23 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 0.00 142 G 8.71 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 0.00 143 N 9.21 3.79 0.00 2.51 2.60 0.00 0.00 7.32 7.19 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 0.00 144 T 8.17 5.16 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 1.21 0.00 0.00 145 K 7.48 4.61 0.00 1.77 1.82 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.29 1.31 7.81 146 S 8.61 4.39 0.00 4.28 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 0.00 147 S 7.81 4.25 0.00 3.82 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 0.00 148 G 9.64 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 0.00 149 T 7.93 5.01 4.42 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 1.30 0.00 0.00 150 S 8.22 4.58 0.00 3.81 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.70 4.93 0.00 2.99 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 4.69 0.00 2.46 2.08 0.00 4.14 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 2.14 2.02 0.00 153 D 8.61 4.89 0.00 2.68 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 0.00 154 V 7.76 4.86 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 1.04 0.00 0.00 0.97 0.00 0.00 155 L 8.52 3.34 0.00 1.24 1.25 -0.82 -0.06 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 0.00 156 K 8.03 4.83 0.00 1.65 1.49 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.47 7.81 157 C 8.47 5.19 0.00 1.46 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 0.00 0.00 0.00 0.00 158 L 9.00 5.09 0.00 1.63 1.45 1.04 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.11 5.09 0.00 1.82 1.84 0.00 1.86 0.00 0.00 1.80 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.65 1.50 7.81 160 A 8.94 4.84 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 5.03 0.00 2.04 2.30 0.00 3.12 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.82 0.00 162 I 8.41 4.23 1.94 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.83 0.83 0.00 0.00 163 L 8.76 4.96 0.00 1.65 1.60 0.91 0.94 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 8.67 4.20 0.00 4.01 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 0.00 165 D 8.99 4.38 0.00 2.84 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 0.00 166 S 8.20 4.10 0.00 3.94 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.16 4.10 0.00 3.95 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 8.37 4.32 0.00 3.23 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 0.00 169 K 8.44 4.03 0.00 1.87 1.90 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.60 7.81 170 S 7.99 4.25 0.00 4.05 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.68 4.08 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 7.81 4.77 0.00 3.19 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.42 0.00 2.09 2.05 0.00 3.88 0.00 0.00 4.48 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 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.98 4.44 0.00 2.41 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.67 0.00 0.00 0.00 0.00 0.00 2.25 2.49 0.00 176 I 7.83 4.39 1.99 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.09 1.01 0.00 0.00 177 T 8.27 4.45 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 1.25 0.00 0.00 178 S 8.55 4.33 0.00 4.01 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 8.23 5.01 0.00 2.95 3.12 0.00 0.00 6.63 6.94 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 0.00 180 M 7.69 5.67 0.00 1.89 2.14 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 181 F 8.76 5.08 0.00 3.12 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 9.24 5.79 0.00 2.97 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 0.00 183 A 8.96 5.07 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 7.58 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 0.00 0.00 0.00 184 Y 8.49 4.67 0.00 3.08 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.71 4.15 0.00 1.73 1.72 0.92 0.93 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 0.00 186 E 8.22 4.03 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 187 G 7.58 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 0.00 0.00 0.00 188A G 9.98 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 0.00 188 K 7.51 4.91 0.00 1.69 1.80 0.00 1.83 0.00 0.00 1.50 0.00 0.00 2.13 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.29 1.26 7.81 189 D 9.01 4.75 0.00 2.79 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 8.10 4.92 0.00 4.09 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 9.90 4.89 0.00 2.96 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.79 4.41 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.25 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 193 G 9.29 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 0.00 0.00 0.00 0.00 194 D 8.29 4.71 0.00 3.01 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 0.00 195 S 8.10 4.52 0.00 4.02 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 0.00 196 G 8.83 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 0.00 197 G 7.79 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 0.00 198 P 0.00 4.98 0.00 2.31 2.36 0.00 3.69 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 2.22 2.28 0.00 199 V 8.68 4.54 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 0.84 0.00 0.00 0.29 0.00 0.00 200 V 8.65 4.89 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 0.83 0.00 0.00 0.63 0.00 0.00 201 C 8.70 5.04 0.00 2.80 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 0.00 202 S 9.59 3.81 0.00 3.98 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 0.00 203 G 8.47 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 0.00 204 K 7.50 4.90 0.00 1.74 1.63 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.39 7.81 *209 L 8.18 4.33 0.00 1.48 1.63 0.97 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 0.00 210 Q 8.29 4.36 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.52 0.00 0.00 0.00 0.00 0.00 2.34 2.19 0.00 211 G 8.56 5.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.23 5.16 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.90 1.01 0.00 0.00 213 V 8.87 3.77 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 1.08 0.00 0.00 1.19 0.00 0.00 214 S 8.79 5.03 0.00 4.03 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 0.00 215 W 7.41 5.23 0.00 3.36 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 0.00 216 G 8.47 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.93 4.75 0.00 4.14 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 *219 G 8.22 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 0.00 220 C 8.15 4.88 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 8.98 3.97 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 7.31 4.62 0.00 2.24 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.90 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 222 K 8.49 4.23 0.00 1.71 1.73 0.00 1.91 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.68 7.81 223 N 9.19 4.24 0.00 2.81 2.82 0.00 0.00 6.83 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 7.68 4.19 0.00 1.85 1.88 0.00 1.71 0.00 0.00 1.44 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.48 7.81 225 P 0.00 4.60 0.00 2.20 2.07 0.00 3.44 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 226 G 8.11 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 0.00 227 V 7.43 4.28 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 0.36 0.00 0.00 -0.78 0.00 0.00 228 Y 8.18 4.97 0.00 1.43 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.57 4.54 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 1.28 0.00 0.00 230 K 9.13 5.17 0.00 2.18 1.92 0.00 1.76 0.00 0.00 1.86 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.51 7.81 231 V 8.87 4.01 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 8.27 4.34 0.00 3.15 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 0.00 233 N 7.95 4.24 0.00 2.30 2.30 0.00 0.00 6.78 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 8.00 4.82 0.00 3.27 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.00 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 1.10 0.00 0.00 1.04 0.00 0.00 236 S 8.07 4.34 0.00 4.11 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 0.00 237 W 8.29 4.20 0.00 3.47 3.38 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 0.00 238 I 8.22 3.05 1.99 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 1.60 1.09 0.72 0.00 0.00 239 K 7.87 3.72 0.00 1.80 1.79 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.63 7.81 240 Q 7.67 3.87 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 241 T 7.50 3.73 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 0.75 0.00 0.00 242 I 7.05 2.55 0.56 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.45 -0.64 0.00 0.00 243 A 7.37 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 S 7.40 4.67 0.00 4.01 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 0.00 245 N 7.86 4.71 0.00 3.15 3.06 0.00 0.00 6.75 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 * Residues marked with a * may have inaccurate shift predictions.