NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2617 7.8827 121.4580 61.2139 38.7742 173.7900 17 V 4.4286 8.7255 125.7921 61.7386 32.8572 174.3192 18 G 3.7453 9.0033 114.5780 46.5954 0.0000 172.9919 19 G 4.4566 7.8645 108.7434 44.5870 0.0000 171.8510 20 Y 5.0991 7.9042 117.7402 55.5272 42.3170 174.1776 21 T 4.5200 8.5615 115.7952 62.7717 68.9926 176.1237 22 C 4.3189 8.5269 124.8319 60.8786 34.9620 174.5862 23 G 4.0983 8.6517 107.5553 44.1414 0.0000 172.6521 24 A 4.2098 8.7273 125.7483 53.8590 18.3901 176.7343 25 N 4.2556 8.8606 119.4887 54.7121 36.1311 175.4401 26 T 4.2099 7.6704 107.5081 62.6395 69.9999 175.1185 27 V 4.0588 7.0240 122.0401 59.8736 31.4393 173.6852 28 P 4.5480 0.0000 0.0000 64.0949 31.8219 178.2396 29 Y 5.0605 6.7482 115.4701 56.7415 38.8605 174.7309 30 Q 4.6114 7.2992 123.4334 56.3633 29.4658 175.4634 31 V 4.8967 8.8208 118.6022 59.6621 36.5150 174.1035 32 S 4.8535 8.7653 116.3594 56.5821 65.2796 172.5631 33 L 4.5582 8.5092 127.4135 53.3195 43.3888 174.9768 34 N 5.8534 8.9793 122.6285 49.9321 41.8181 174.8735 *37 S 4.3849 8.3391 121.3406 58.1818 63.9920 174.2261 38 G 4.0023 9.5301 108.3131 46.2915 0.0000 172.0534 39 Y 4.6661 6.5113 115.1558 55.9624 40.3116 172.9699 40 H 4.6527 8.7674 121.6326 56.0581 30.4254 174.9576 41 F 4.9533 7.7661 119.2193 56.8263 39.6356 173.8496 42 C 4.7701 6.6385 116.7020 55.8212 44.9081 173.4958 43 G 4.1669 8.7947 109.2806 45.8310 0.0000 172.1296 44 G 4.6473 7.9106 105.4469 46.4729 0.0000 172.7081 45 S 5.4302 8.7195 115.4902 56.3754 66.7095 173.7090 46 L 4.7032 9.3034 128.2207 54.9973 42.2641 177.2242 47 I 4.2268 8.6654 120.1276 61.5826 39.2879 174.7214 48 N 4.7510 7.7893 116.9531 51.6712 39.6428 175.0512 49 S 4.2221 8.7192 112.7422 60.8475 62.9185 175.5919 50 Q 4.5298 9.1712 118.0611 55.0406 30.1027 174.6304 51 W 5.5051 8.4085 117.8667 54.7645 33.5016 174.4557 52 V 5.0480 9.1095 123.0352 61.0775 34.6799 174.3094 53 V 4.9491 8.8516 126.9472 60.4456 33.9234 174.9072 54 S 5.1905 8.9614 117.6247 57.3627 66.3935 172.2275 55 A 4.5764 8.4797 121.4177 51.0629 19.7446 178.6028 56 A 3.8227 8.2674 124.1503 55.2409 18.4703 179.2945 57 H 4.5594 8.0546 109.4433 57.4456 28.6704 175.3202 58 C 4.7460 7.7322 117.2114 57.0707 40.4604 173.2610 59 Y 4.1858 7.6218 122.0771 57.9471 38.8220 175.4796 60 K 4.1252 6.8360 123.6738 55.1788 36.0736 175.3288 61 S 4.2104 8.1670 116.5213 58.5004 64.4451 173.7306 62 G 3.6934 8.3606 108.3033 46.7603 0.0000 173.8119 63 I 4.1421 7.3254 119.0346 60.4196 39.3595 175.7042 64 Q 4.7022 8.6590 126.9577 54.2658 31.5955 174.1744 65 V 4.4526 8.8422 127.1690 61.7417 33.6585 174.5490 66 R 5.1029 8.8333 127.0487 54.6266 32.4611 175.1421 67 L 4.8386 9.2737 124.3937 52.4672 45.3069 177.2128 *69 G 3.7675 8.3228 107.1797 45.5241 0.0000 172.7569 70 E 4.6452 8.2876 118.0242 54.8560 30.6559 174.0435 71 D 4.7590 7.8164 117.4358 55.0327 43.9248 174.2358 72 N 5.7197 8.9479 124.7982 51.9878 38.9205 175.7325 73 I 3.8754 8.1800 120.1288 63.0078 38.1576 176.9430 74 N 4.4824 8.3115 118.0314 54.8761 39.0488 175.4166 75 V 4.1803 7.9078 116.9283 61.0722 32.8796 175.1695 76 V 4.1135 8.2524 126.4432 62.5064 31.8002 175.3457 77 E 4.5071 10.0600 126.0006 55.9157 30.4505 176.9215 78 G 3.9547 8.5161 108.3113 45.2227 0.0000 174.1725 79 N 4.7699 7.7012 114.4089 52.9987 39.1945 174.7249 80 E 4.6461 7.6993 117.9220 56.4295 30.9972 176.4538 81 Q 4.3092 8.9800 120.3344 54.5896 32.9837 174.0117 82 F 5.6341 8.8188 123.4817 55.9940 40.9015 175.3201 83 I 4.7016 8.7198 124.7132 59.3323 40.9568 175.6930 84 S 4.6995 8.6489 121.6554 58.2999 64.3459 173.0367 85 A 4.5381 8.5137 125.4538 51.8752 18.4091 177.8963 86 S 4.4794 9.1548 118.2370 60.4477 64.4195 174.8233 87 K 4.6262 7.4854 116.6938 55.7158 35.5657 174.8405 88 S 5.2657 8.8163 117.8145 57.0690 65.8413 173.3866 89 I 4.4652 9.3243 126.8985 59.7651 38.5456 175.2206 90 V 4.3106 8.3898 127.6154 61.8719 32.8533 175.1714 91 H 3.6411 8.4602 127.2108 55.7565 30.0400 174.2795 92 P 4.1945 0.0000 0.0000 65.4253 31.2983 177.1840 93 S 4.7085 7.7735 111.1610 58.0978 63.0601 173.3031 94 Y 4.3790 8.1775 123.2616 57.6717 39.0642 174.4874 95 N 4.6520 8.2714 125.4874 51.2807 40.1630 175.1355 96 S 3.9881 7.7524 120.4462 59.9450 63.4671 175.2350 97 N 4.4070 8.2311 118.7992 55.2033 38.5917 176.0270 98 T 4.0422 7.6419 105.1445 60.5723 70.0144 174.8087 99 L 3.7937 8.0260 121.1192 55.5153 39.8582 173.8701 100 N 4.4959 7.6305 117.2528 54.6061 39.5192 174.6575 101 N 4.9362 8.7151 120.3241 54.1366 35.9151 175.5738 102 D 4.6507 7.9666 117.6121 53.0767 39.5578 174.6690 103 I 4.7738 7.1718 121.0302 59.3937 42.2732 172.7450 104 M 5.2947 9.3063 126.6303 54.3171 36.3996 173.1170 105 L 5.3770 9.2531 124.1698 53.0764 45.0747 175.3741 106 I 4.9279 9.2131 124.3486 59.4108 40.2490 174.3908 107 K 3.5595 8.6859 129.2390 54.7009 32.8588 175.6494 108 L 4.4099 8.2491 127.5570 54.0161 42.5412 178.0163 109 K 4.1286 8.6840 123.9997 59.0088 32.6809 177.2868 110 S 4.6214 7.4219 110.6643 56.1170 66.8875 173.4554 111 A 4.3777 8.4133 124.9771 51.9388 18.7911 177.3006 112 A 4.2228 8.9897 124.3053 51.6751 19.6515 177.2249 113 S 4.4018 8.8833 116.5923 57.5157 62.8950 173.9748 114 L 4.6058 8.5337 127.8926 54.4683 42.6521 176.5197 115 N 4.7087 8.6800 118.8343 52.7652 39.7609 175.2010 116 S 4.3396 8.8423 111.0345 61.1867 63.4902 175.1057 117 R 4.2724 8.7912 119.8809 56.1835 31.0347 175.8024 118 V 4.6024 7.6616 118.1378 60.8867 33.3316 173.8325 119 A 5.1475 8.4131 127.8983 50.4672 22.9325 175.2657 120 S 5.0737 8.7067 114.3144 57.8291 64.9091 173.0187 121 I 4.4092 8.0628 120.9634 59.0580 39.3995 175.4914 122 S 4.3804 8.3928 124.4360 58.4010 64.0214 173.7853 123 L 4.2632 8.3558 123.5216 53.5068 42.3935 175.3239 124 P 4.5165 0.0000 0.0000 62.9636 32.4088 176.1657 125 T 4.1961 8.2300 108.6986 62.3370 70.1828 174.5711 *127 S 4.8588 7.5718 114.5782 58.0555 64.0406 173.9832 128 C 4.4173 8.3823 118.0018 56.5677 40.7650 173.6180 129 A 4.3716 8.0163 125.2628 51.4818 19.5845 177.4668 130 S 4.3446 8.0886 114.4475 56.9390 64.9427 173.1696 *132 A 4.2332 8.1936 123.2331 53.5611 19.2108 177.0705 133 G 4.0044 8.9770 110.9664 45.3362 0.0000 174.2562 134 T 4.0643 7.5508 117.1749 63.5066 69.4867 173.9564 135 Q 4.4980 8.6377 125.6642 55.9670 29.6483 175.9731 136 C 5.2599 9.2728 120.6148 54.9964 46.3726 172.4148 137 L 5.1603 8.9663 122.5503 53.5542 43.9863 174.9883 138 I 5.2756 9.2719 127.4184 58.8053 39.9271 174.9113 139 S 4.9166 8.6287 119.5012 56.4621 66.5215 173.0248 140 G 3.7739 7.5875 108.3826 46.1806 0.0000 173.0264 141 W 4.5900 8.6826 117.1023 56.2912 29.3815 177.1064 142 G 4.0761 8.3802 109.0535 44.1354 0.0000 173.4948 143 N 4.5320 8.9158 118.2874 54.7514 39.0125 174.4515 144 T 5.2016 8.5807 113.0195 60.4954 69.4746 174.2411 145 K 4.6673 8.2430 121.8833 54.7408 34.8660 176.5354 146 S 4.2919 8.7277 117.3169 60.1418 63.5913 174.4803 147 S 4.5803 8.1563 116.5517 58.3364 65.3096 172.6127 148 G 3.9798 9.8007 112.4863 44.1290 0.0000 171.9128 149 T 4.5515 7.6680 116.4640 62.3376 73.0315 174.0762 150 S 4.0819 7.8300 115.4052 58.0898 65.2080 173.3908 151 Y 5.2575 8.2938 126.0453 55.5881 39.2568 174.5046 152 P 4.6356 0.0000 0.0000 62.5608 32.6496 175.7324 153 D 4.6909 8.6925 118.1241 54.2356 40.5240 176.4222 154 V 5.4456 7.4436 111.3002 58.1319 34.9088 175.5262 155 L 3.1614 8.2613 125.3155 55.1961 42.9449 176.1475 156 K 4.8309 8.2176 125.1921 55.0097 35.0743 174.6437 157 C 5.3024 8.5972 119.2015 55.2026 40.7625 172.9817 158 L 4.9178 8.7050 122.6208 53.7769 45.6317 174.4860 159 K 5.1796 8.9921 125.3521 55.0571 33.5847 175.6968 160 A 4.7870 9.0449 126.5148 49.6773 23.2350 173.3631 161 P 5.0328 0.0000 0.0000 61.8955 33.8567 175.1981 162 I 4.2709 8.1465 122.6613 61.4327 38.0468 175.7506 163 L 4.8480 8.7746 127.4626 53.2887 43.3205 177.0174 164 S 4.3475 8.4888 115.4116 57.9479 64.1365 174.8502 165 D 4.4187 8.9392 122.7604 56.9088 38.8595 179.0479 166 S 4.1197 8.0589 115.2190 61.3036 63.0958 176.3586 167 S 4.1290 7.8436 119.0684 61.2149 62.5803 175.9993 168 C 4.3574 8.2232 120.9528 59.8291 43.2474 175.8757 169 K 4.0218 7.9662 118.6996 59.5647 31.6820 179.3537 170 S 4.2825 8.1449 114.5224 61.1686 62.7641 176.1952 171 A 4.0790 7.7473 122.7093 53.6942 19.7293 177.3132 172 Y 4.7197 7.7861 114.4474 54.6666 38.2054 171.7973 173 P 4.4711 0.0000 0.0000 64.1242 32.0160 177.0630 174 G 3.9861 9.0440 110.6572 46.0428 0.0000 173.4004 175 Q 4.5194 8.2851 117.0405 55.4982 30.2612 175.5322 176 I 4.3859 7.8625 119.6726 60.1222 38.1418 175.4306 177 T 4.5820 8.2354 115.6277 59.6275 70.9521 175.2239 178 S 4.3087 8.5522 114.9261 60.3737 63.3033 174.3768 179 N 5.0345 8.2426 118.9440 53.3002 38.5772 173.8526 180 M 5.6511 7.8116 116.7411 53.9395 36.3637 174.5249 181 F 5.1337 8.7762 114.9115 55.8138 42.1370 172.5042 182 C 5.4432 9.0324 116.9681 55.7967 40.9708 172.5935 183 A 5.0379 9.4267 122.9939 50.0262 22.1666 175.2099 184A G 3.8820 6.8051 108.9655 44.9586 0.0000 172.4272 184 Y 4.7077 8.2262 119.8812 56.1288 41.5512 176.2921 185 L 4.1702 8.6171 123.9972 56.9478 42.0844 178.4131 186 E 3.9312 8.2717 118.3274 56.6415 29.9611 177.1659 187 G 3.8235 7.9864 107.1050 44.8857 0.0000 171.6912 188A G 4.1302 9.4175 105.5029 44.8601 0.0000 174.3178 188 K 5.3617 7.1881 116.7169 53.7557 35.9380 175.3517 189 D 4.6084 8.3398 122.3765 53.9161 44.7303 174.8791 190 S 4.8918 8.8072 116.9824 58.1709 65.2289 172.8277 191 C 4.7585 9.4600 119.0123 55.4277 45.0025 172.3615 192 Q 4.3385 8.6941 119.3550 57.9268 28.3767 178.2168 193 G 4.1857 9.2229 110.5513 45.5493 0.0000 173.7048 194 D 4.7233 8.3494 118.6428 54.7353 41.8398 176.7438 195 S 4.4342 8.0577 115.7132 60.5013 63.4608 175.6323 196 G 4.1046 8.7950 112.2500 46.3935 0.0000 173.7377 197 G 4.3372 7.7882 107.5674 45.0560 0.0000 171.4235 198 P 5.0442 0.0000 0.0000 62.4870 33.4645 175.7599 199 V 4.5956 8.3874 121.3135 61.4327 34.1469 173.8376 200 V 4.8690 8.6919 128.7557 61.3150 33.8407 173.8037 201 C 5.0965 8.6828 124.5454 55.5637 43.9757 174.5879 202 S 3.3388 9.6255 120.2732 59.7981 59.9293 172.9886 203 G 3.9457 8.4836 104.0289 45.9233 0.0000 173.9929 204 K 4.6805 7.6207 117.5899 52.8864 35.4127 175.6098 *209 L 4.2566 8.2980 123.0897 55.4175 42.0744 175.7361 210 Q 4.4753 8.7804 125.9680 56.7417 30.6859 175.7622 211 G 5.2772 7.9694 104.5699 45.7987 0.0000 171.4806 212 I 5.0576 8.1800 119.1632 59.0028 41.3294 175.3374 213 V 3.6554 8.9603 127.7436 63.9401 31.7965 174.0997 214 S 4.8475 8.4498 120.7331 58.5568 64.4172 174.2030 215 W 5.0294 7.5000 114.0744 55.8756 32.1191 172.2684 216 G 3.8782 8.3398 106.1995 46.6694 0.0000 173.3352 217 S 4.6709 8.4303 114.8764 56.5007 62.1216 172.8724 *219 G 4.2257 7.9059 116.9490 45.4950 0.0000 170.2775 220 C 4.8185 8.1048 115.0302 56.3857 44.7938 173.9004 221A A 4.4181 9.3487 125.7777 53.1240 16.8779 176.9542 221 Q 4.4463 7.4081 116.9678 56.2973 29.5893 175.9316 222 K 4.1606 8.5429 121.9263 58.3072 32.5387 175.9637 223 N 4.2742 9.0431 121.8793 54.1561 37.0568 175.3683 224 K 4.3548 7.6915 115.3224 54.0381 32.5060 173.9699 225 P 4.6334 0.0000 0.0000 62.0134 33.2677 177.7519 226 G 3.5866 8.4356 107.2582 46.2038 0.0000 172.6204 227 V 4.4165 7.5926 121.6900 60.6950 33.9938 174.1495 228 Y 4.8501 8.1757 124.4719 55.9951 42.2054 174.8951 229 T 4.5023 8.4385 119.2740 63.4383 70.1325 174.4901 230 K 4.7611 9.2152 128.0642 55.6439 31.5112 177.2156 231 V 3.9573 8.8164 126.9097 65.9102 31.3517 175.0050 232 C 4.3572 8.3064 112.6789 58.1992 41.5477 174.7865 233 N 4.2629 7.9467 116.6469 54.4131 38.5358 175.5100 234 Y 4.7981 8.0241 117.6642 57.1739 38.9880 177.1244 235 V 3.6649 7.9796 121.3878 66.4022 31.5423 178.0118 236 S 4.1484 8.1096 113.2407 61.0762 62.9034 175.9754 237 W 4.1684 8.3041 131.5034 60.2371 30.4929 177.7856 238 I 3.0921 8.1503 119.8098 64.3067 36.4442 178.5254 239 K 3.7201 7.9861 119.1805 59.3352 31.5753 179.2903 240 Q 3.8280 7.7449 118.8537 59.3667 29.3619 177.9204 241 T 3.6666 7.2454 116.6058 66.6253 68.1792 176.4645 242 I 2.0000 6.7665 119.7531 63.7677 37.0175 177.1908 243 A 4.1897 7.2043 119.9356 53.1457 18.5383 177.7560 244 S 4.7310 7.7171 110.4700 57.9747 63.9251 174.0940 245 N 4.6923 7.9511 123.4678 53.5563 39.4075 174.0923 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 4.26 1.82 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.59 0.92 0.00 0.00 17 V 8.73 4.43 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 1.04 0.00 0.00 0.93 0.00 0.00 18 G 9.00 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 0.00 0.00 0.00 19 G 7.86 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.90 5.10 0.00 3.05 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 21 T 8.56 4.52 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 1.28 0.00 0.00 22 C 8.53 4.32 0.00 2.89 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.65 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 8.73 4.21 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.86 4.26 0.00 2.89 2.91 0.00 0.00 7.17 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 7.67 4.21 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 7.02 4.06 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.55 0.00 2.38 2.32 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.96 0.00 29 Y 6.75 5.06 0.00 3.26 3.44 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 30 Q 7.30 4.61 0.00 1.82 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.74 0.00 0.00 0.00 0.00 0.00 1.87 2.43 0.00 31 V 8.82 4.90 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 0.81 0.00 0.00 1.01 0.00 0.00 32 S 8.77 4.85 0.00 3.31 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 33 L 8.51 4.56 0.00 0.69 0.98 0.77 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.98 5.85 0.00 2.50 2.48 0.00 0.00 6.78 8.46 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 *37 S 8.34 4.38 0.00 3.67 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 38 G 9.53 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 39 Y 6.51 4.67 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 40 H 8.77 4.65 0.00 2.86 3.16 0.00 5.86 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.77 4.95 0.00 3.25 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 42 C 6.64 4.77 0.00 2.17 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 8.79 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.91 4.65 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 0.00 0.00 0.00 45 S 8.72 5.43 0.00 3.81 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 46 L 9.30 4.70 0.00 1.85 1.67 1.07 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.67 4.23 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.89 0.95 0.00 0.00 48 N 7.79 4.75 0.00 2.99 2.98 0.00 0.00 6.01 7.14 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 49 S 8.72 4.22 0.00 4.21 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 9.17 4.53 0.00 2.07 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 51 W 8.41 5.51 0.00 3.34 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.11 5.05 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 1.05 0.00 0.00 0.97 0.00 0.00 53 V 8.85 4.95 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 0.68 0.00 0.00 1.01 0.00 0.00 54 S 8.96 5.19 0.00 3.87 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 55 A 8.48 4.58 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 8.27 3.82 0.21 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 57 H 8.05 4.56 0.00 3.40 3.58 0.00 5.55 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 7.73 4.75 0.00 3.19 3.29 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 59 Y 7.62 4.19 0.00 3.03 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 6.84 4.13 0.00 1.45 1.30 0.00 0.61 0.00 0.00 1.17 0.00 0.00 2.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.05 1.02 7.81 61 S 8.17 4.21 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 62 G 8.36 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 0.00 0.00 0.00 63 I 7.33 4.14 1.81 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 1.31 0.66 0.87 0.00 0.00 64 Q 8.66 4.70 0.00 2.02 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.09 2.21 0.00 65 V 8.84 4.45 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 0.96 0.00 0.00 0.88 0.00 0.00 66 R 8.83 5.10 0.00 1.52 1.67 0.00 2.59 0.00 0.00 2.36 7.16 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 0.81 0.00 0.00 0.96 0.00 0.00 77 E 10.06 4.51 0.00 1.93 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 2.25 2.41 0.00 78 G 8.52 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 0.00 0.00 0.00 79 N 7.70 4.77 0.00 2.72 2.85 0.00 0.00 6.98 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 7.70 4.65 0.00 1.49 1.77 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 2.75 2.47 0.00 81 Q 8.98 4.31 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 82 F 8.82 5.63 0.00 2.80 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.72 4.70 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.71 0.93 0.00 0.00 84 S 8.65 4.70 0.00 3.74 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 85 A 8.51 4.54 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 86 S 9.15 4.48 0.00 3.75 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 7.49 4.63 0.00 1.86 1.90 0.00 1.59 0.00 0.00 1.92 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.41 7.81 88 S 8.82 5.27 0.00 4.14 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 9.32 4.47 2.07 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 1.38 1.18 1.15 0.00 0.00 90 V 8.39 4.31 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.82 0.00 0.00 91 H 8.46 3.64 0.00 2.78 3.06 0.00 5.67 0.00 0.00 0.00 0.00 6.72 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 4.19 0.00 1.90 2.09 0.00 2.65 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 1.99 2.17 0.00 93 S 7.77 4.71 0.00 4.05 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 94 Y 8.18 4.38 0.00 3.06 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.27 4.65 0.00 2.57 2.44 0.00 0.00 6.68 7.10 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 96 S 7.75 3.99 0.00 3.95 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 97 N 8.23 4.41 0.00 2.72 2.79 0.00 0.00 6.87 7.16 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 98 T 7.64 4.04 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 1.11 0.00 0.00 99 L 8.03 3.79 0.00 1.49 1.87 0.64 0.94 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 7.63 4.50 0.00 2.82 2.66 0.00 0.00 7.24 6.59 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 0.00 101 N 8.72 4.94 0.00 3.07 2.74 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 7.97 4.65 0.00 3.11 2.68 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 0.00 0.00 0.00 0.00 103 I 7.17 4.77 1.48 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.17 0.14 0.00 0.00 104 M 9.31 5.29 0.00 2.09 1.83 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.65 0.00 105 L 9.25 5.38 0.00 1.77 1.86 1.01 0.33 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 0.00 106 I 9.21 4.93 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 1.17 0.89 0.86 0.00 0.00 107 K 8.69 3.56 0.00 0.79 1.08 0.00 1.35 0.00 0.00 1.39 0.00 0.00 2.65 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.74 0.21 7.81 108 L 8.25 4.41 0.00 1.50 1.54 0.94 0.57 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 0.00 109 K 8.68 4.13 0.00 1.87 1.79 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.38 7.81 110 S 7.42 4.62 0.00 3.82 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.41 4.38 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 0.00 112 A 8.99 4.22 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 8.88 4.40 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 0.00 114 L 8.53 4.61 0.00 1.70 1.60 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.68 4.71 0.00 2.89 2.90 0.00 0.00 6.64 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 0.00 116 S 8.84 4.34 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 0.00 117 R 8.79 4.27 0.00 2.04 2.02 0.00 3.12 0.00 0.00 3.10 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.86 0.00 4.00 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 8.38 4.42 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 8.02 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.09 4.34 0.00 3.97 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 *132 A 8.19 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 0.00 133 G 8.98 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 0.00 0.00 0.00 134 T 7.55 4.06 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 1.16 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 7.74 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 136 C 9.27 5.26 0.00 2.83 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 8.97 5.16 0.00 1.75 1.56 1.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.27 5.28 1.87 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.60 0.98 0.00 0.00 139 S 8.63 4.92 0.00 3.56 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 7.59 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 8.68 4.59 0.00 3.16 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 0.00 142 G 8.38 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 0.00 0.00 0.00 143 N 8.92 4.53 0.00 2.97 2.89 0.00 0.00 7.09 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 8.58 5.20 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 1.31 0.00 0.00 145 K 8.24 4.67 0.00 1.65 1.85 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.32 1.28 7.81 146 S 8.73 4.29 0.00 4.05 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.16 4.58 0.00 3.83 3.80 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 0.00 148 G 9.80 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 0.00 149 T 7.67 4.55 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 0.70 0.00 0.00 150 S 7.83 4.08 0.00 3.73 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.29 5.26 0.00 2.99 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 0.00 152 P 0.00 4.64 0.00 2.50 2.12 0.00 4.14 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.05 0.00 153 D 8.69 4.69 0.00 3.09 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 0.00 154 V 7.44 5.45 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 1.13 0.00 0.00 0.98 0.00 0.00 155 L 8.26 3.16 0.00 1.06 1.26 -0.78 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 0.00 0.00 0.00 0.00 156 K 8.22 4.83 0.00 1.68 1.52 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.50 7.81 157 C 8.60 5.30 0.00 1.60 2.21 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 0.00 158 L 8.70 4.92 0.00 1.66 1.43 1.04 0.86 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 0.00 159 K 8.99 5.18 0.00 1.83 1.83 0.00 1.83 0.00 0.00 1.77 0.00 0.00 2.75 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.71 7.81 160 A 9.04 4.79 1.15 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 0.00 0.00 0.00 161 P 0.00 5.03 0.00 2.02 2.08 0.00 3.11 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.72 0.00 162 I 8.15 4.27 1.91 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.65 0.78 0.00 0.00 163 L 8.77 4.85 0.00 1.65 1.60 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.49 4.35 0.00 4.01 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 0.00 165 D 8.94 4.42 0.00 2.95 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 0.00 166 S 8.06 4.12 0.00 4.08 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.84 4.13 0.00 4.03 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 0.00 168 C 8.22 4.36 0.00 3.21 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 0.00 169 K 7.97 4.02 0.00 1.83 1.92 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.70 7.81 170 S 8.14 4.28 0.00 3.86 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 7.75 4.08 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 0.00 172 Y 7.79 4.72 0.00 3.14 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 0.00 173 P 0.00 4.47 0.00 2.08 2.08 0.00 3.83 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 2.05 2.25 0.00 174 G 9.04 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 0.00 0.00 0.00 175 Q 8.29 4.52 0.00 2.46 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.63 0.00 0.00 0.00 0.00 0.00 2.30 2.57 0.00 176 I 7.86 4.39 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.06 1.00 0.00 0.00 177 T 8.24 4.58 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 1.26 0.00 0.00 178 S 8.55 4.31 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 8.24 5.03 0.00 3.07 3.10 0.00 0.00 6.59 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 0.00 180 M 7.81 5.65 0.00 1.83 1.99 0.00 0.00 0.00 0.00 0.00 2.44 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 8.78 5.13 0.00 3.02 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 9.03 5.44 0.00 2.99 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 0.00 183 A 9.43 5.04 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 184A G 6.81 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 0.00 0.00 0.00 184 Y 8.23 4.71 0.00 3.05 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 0.00 185 L 8.62 4.17 0.00 1.74 1.73 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.27 3.93 0.00 1.98 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 2.29 2.32 0.00 187 G 7.99 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 188A G 9.42 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 0.00 188 K 7.19 5.36 0.00 1.66 1.74 0.00 0.75 0.00 0.00 2.05 0.00 0.00 2.53 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.41 1.05 7.81 189 D 8.34 4.61 0.00 2.78 2.54 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 0.00 190 S 8.81 4.89 0.00 3.99 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 9.46 4.76 0.00 2.97 3.15 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 0.00 192 Q 8.69 4.34 0.00 2.33 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.37 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 193 G 9.22 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.35 4.72 0.00 2.96 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 8.06 4.43 0.00 3.99 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 0.00 196 G 8.80 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 0.00 197 G 7.79 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.04 0.00 2.32 2.35 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 199 V 8.39 4.60 2.22 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 0.85 0.00 0.00 0.59 0.00 0.00 200 V 8.69 4.87 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 0.86 0.00 0.00 0.73 0.00 0.00 201 C 8.68 5.10 0.00 2.80 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 0.00 202 S 9.63 3.34 0.00 3.97 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 0.00 203 G 8.48 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 0.00 0.00 0.00 204 K 7.62 4.68 0.00 1.83 1.63 0.00 1.88 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 1.50 1.40 7.81 *209 L 8.30 4.26 0.00 1.50 1.64 1.00 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 0.00 210 Q 8.78 4.48 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.36 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 211 G 7.97 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 8.18 5.06 1.92 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 1.29 0.94 0.94 0.00 0.00 213 V 8.96 3.66 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.22 0.00 0.00 214 S 8.45 4.85 0.00 3.89 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 0.00 215 W 7.50 5.03 0.00 3.37 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 8.34 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 0.00 0.00 0.00 217 S 8.43 4.67 0.00 4.35 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 *219 G 7.91 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 0.00 220 C 8.10 4.82 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 221A A 9.35 4.42 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.41 4.45 0.00 2.04 2.04 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 2.42 2.47 0.00 222 K 8.54 4.16 0.00 1.72 1.73 0.00 1.93 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.49 7.81 223 N 9.04 4.27 0.00 2.81 2.79 0.00 0.00 6.78 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 0.00 224 K 7.69 4.35 0.00 1.87 1.77 0.00 1.67 0.00 0.00 1.14 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.48 7.81 225 P 0.00 4.63 0.00 2.14 2.11 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 226 G 8.44 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.59 4.42 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 0.41 0.00 0.00 -0.62 0.00 0.00 228 Y 8.18 4.85 0.00 1.44 2.46 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 0.00 0.00 0.00 0.00 229 T 8.44 4.50 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 1.23 0.00 0.00 230 K 9.22 4.76 0.00 2.14 1.94 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.63 7.81 231 V 8.82 3.96 2.42 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 1.23 0.00 0.00 1.11 0.00 0.00 232 C 8.31 4.36 0.00 3.16 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 0.00 233 N 7.95 4.26 0.00 2.43 2.40 0.00 0.00 6.80 7.05 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 0.00 234 Y 8.02 4.80 0.00 3.22 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.98 3.66 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 1.10 0.00 0.00 1.11 0.00 0.00 236 S 8.11 4.15 0.00 4.12 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 0.00 237 W 8.30 4.17 0.00 3.56 3.68 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 0.00 0.00 0.00 0.00 238 I 8.15 3.09 2.01 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.93 0.76 0.00 0.00 239 K 7.99 3.72 0.00 1.86 1.77 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.52 7.81 240 Q 7.74 3.83 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 241 T 7.25 3.67 3.46 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 0.00 0.00 0.00 0.81 0.00 0.00 242 I 6.77 2.00 1.35 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 -0.17 0.35 0.00 0.00 243 A 7.20 4.19 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 0.00 244 S 7.72 4.73 0.00 3.78 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 0.00 245 N 7.95 4.69 0.00 3.03 2.92 0.00 0.00 6.87 7.56 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 * Residues marked with a * may have inaccurate shift predictions.