NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2096 7.8827 121.4414 61.1975 38.7223 173.7922 17 V 4.1851 8.5277 125.8795 61.7103 32.7917 174.3557 18 G 3.7188 8.9539 114.3792 46.5185 0.0000 173.3550 19 G 4.2162 7.7904 110.1159 44.0576 0.0000 172.7683 20 Y 4.9631 7.7979 116.5037 55.1654 42.1306 174.9156 21 T 4.2144 8.6274 117.4386 64.1864 68.4381 175.0507 22 C 4.3523 8.6190 125.3841 60.7120 36.8860 174.9676 23 G 4.0639 8.9195 106.8364 44.2327 0.0000 172.5471 24 A 4.1947 8.7163 125.4228 53.8203 18.3648 176.6658 25 N 4.2636 8.8992 119.6918 54.5989 36.2680 175.6271 26 T 4.1285 7.7707 108.7593 63.0637 69.9972 174.9650 27 V 4.0875 7.0941 121.9647 60.0244 31.2578 173.8456 28 P 4.4588 0.0000 0.0000 64.8148 31.9207 178.2238 29 Y 5.2391 6.9175 115.7263 57.1793 38.8431 174.8392 30 Q 4.6740 7.3714 123.3052 56.3268 29.6017 175.5063 31 V 4.8892 9.0274 118.5386 59.6372 36.4866 174.1796 32 S 4.9359 8.6981 116.7893 56.5618 64.9578 172.7455 33 L 4.4029 8.7144 128.1784 53.7958 42.8343 175.1499 34 N 6.0113 9.1234 123.3392 50.1038 41.6606 175.0634 *37 S 4.1758 8.3654 121.2897 58.2627 64.0582 174.5002 38 G 3.9162 9.8744 109.0309 46.1026 0.0000 172.4877 39 Y 4.5394 6.3943 115.1411 56.2780 40.0590 172.5827 40 H 4.7798 8.8904 121.4900 56.0637 30.4167 174.7028 41 F 5.1162 7.9978 119.8948 56.8855 39.6997 173.9222 42 C 4.7157 6.9489 114.9703 56.2332 44.7040 173.2072 43 G 4.3273 8.8683 109.3028 45.4499 0.0000 172.1714 44 G 4.3373 8.1274 105.7353 46.3002 0.0000 172.6086 45 S 5.3787 8.8811 115.5917 56.3768 66.6964 173.7304 46 L 4.7814 9.0293 127.8285 55.0386 42.3399 177.2379 47 I 4.3254 8.6844 120.1548 61.2364 38.8534 174.5412 48 N 4.5042 7.6852 117.3627 52.0984 39.3041 175.0500 49 S 4.1618 8.5176 112.3517 60.8197 62.8671 175.5391 50 Q 4.4893 8.1963 117.1279 55.0011 30.3170 174.4506 51 W 5.4920 8.1207 118.5392 54.7424 33.3156 174.4461 52 V 4.9969 9.3056 123.5461 61.1336 34.4310 174.1604 53 V 4.9178 8.9928 127.0567 61.6850 33.9329 174.6291 54 S 4.8818 8.9068 120.2742 57.6305 66.2112 172.0690 55 A 4.5359 8.5120 121.0517 50.8649 20.0064 178.5209 56 A 3.7906 8.3429 124.5509 55.3008 18.4311 179.2775 57 H 4.5419 8.1984 109.5198 57.5519 28.6841 175.3971 58 C 4.7168 7.8748 117.0616 57.1099 40.5425 173.2658 59 Y 4.3196 7.5874 121.7439 58.2242 38.7119 175.2404 60 K 3.6196 7.3222 124.7817 55.5325 34.9650 173.8461 61 S 4.3968 8.0916 117.3043 57.7876 64.2616 173.5244 62 G 3.5314 8.6319 113.0143 45.9435 0.0000 172.9358 63 I 4.6308 7.2032 118.9180 59.5693 40.5241 176.0905 64 Q 4.8231 8.8446 128.1655 54.2316 31.4802 174.1591 65 V 4.4200 8.9946 127.1216 61.9066 33.5021 174.5399 66 R 5.1530 8.8640 127.2063 54.6582 32.3847 175.3854 67 L 4.7693 9.2165 124.3959 52.4705 45.2649 177.0517 *69 G 4.4113 8.1806 105.9476 45.6987 0.0000 172.7038 70 E 4.6665 8.3012 118.0577 54.7333 30.6891 174.1474 71 D 4.7851 7.8383 117.9218 54.7830 44.3198 173.9291 72 N 5.1060 8.8884 116.9769 52.7017 39.5950 176.2456 73 I 3.9473 8.3932 119.5883 62.1592 38.0033 176.1969 74 N 4.7161 8.6914 118.0432 53.1420 39.3721 174.9162 75 V 4.3020 7.2824 117.1829 60.6164 34.1126 175.0679 76 V 4.0955 8.4388 126.8047 62.7137 30.8963 175.2032 77 E 4.3700 9.3608 127.6623 55.5670 30.2001 176.8994 78 G 4.0172 7.9108 106.5857 45.4399 0.0000 174.4695 79 N 4.9416 8.2732 115.8325 53.0646 40.0129 174.3609 80 E 5.4274 7.8853 117.9591 55.3679 31.3068 176.0896 81 Q 4.3024 8.4651 119.8219 54.3829 32.7172 174.0641 82 F 5.5990 8.7554 123.5462 56.1050 40.6132 175.4500 83 I 4.7146 8.8198 124.8678 59.4499 41.1051 175.5310 84 S 4.8058 8.6482 121.6620 58.1091 64.4789 173.0586 85 A 4.6510 8.4350 125.5033 51.8982 18.3659 177.9052 86 S 4.4931 9.0749 118.3095 60.3629 64.4263 174.8013 87 K 4.6595 7.5659 117.0082 55.7330 35.4733 174.8333 88 S 5.3134 8.7877 117.6964 56.9603 66.1852 173.6796 89 I 4.5855 9.0169 124.3223 59.5958 40.1579 174.8367 90 V 4.2723 8.4358 127.3750 61.9337 32.8080 175.1288 91 H 3.6781 8.7239 126.6601 55.9801 29.9590 174.3802 92 P 4.2954 0.0000 0.0000 65.3426 31.1506 177.0931 93 S 4.6949 7.8469 112.9185 58.0591 63.1726 173.1499 94 Y 4.2764 7.9029 122.7244 57.7405 38.9813 175.0467 95 N 4.4643 8.1219 126.2227 51.2679 39.3956 175.0155 96 S 4.0112 7.8313 121.3253 60.8148 63.3219 175.6986 97 N 4.3816 8.0521 118.6474 55.2585 38.3618 175.8410 98 T 4.0587 7.5801 105.2114 60.3335 70.4939 174.6152 99 L 3.7748 8.1326 120.9424 55.4108 39.6826 173.7535 100 N 4.5315 7.5661 117.3643 54.5521 39.3645 174.7530 101 N 4.6729 8.8359 120.5944 54.6751 35.7281 175.3709 102 D 4.7467 8.1030 117.9319 53.3946 39.2216 174.1939 103 I 4.7413 7.1802 120.8912 59.4770 42.1275 172.5918 104 M 5.5239 9.1905 127.0032 54.2049 36.2634 173.2383 105 L 5.3855 9.2814 124.2590 53.1347 45.1812 175.4507 106 I 5.0165 9.3377 123.3193 59.4690 40.8192 174.2312 107 K 4.0052 8.4785 128.1838 54.3532 34.0061 175.2760 108 L 4.5587 8.0687 127.3240 54.0609 41.9854 177.3944 109 K 4.1886 8.9768 123.1585 59.0030 32.5101 177.6411 110 S 4.5845 7.7169 111.4520 55.8272 66.0823 173.3798 111 A 4.3779 8.4018 123.5732 52.1629 18.7745 177.2282 112 A 4.3057 8.7827 123.3994 51.6607 19.9872 177.6237 113 S 4.5250 8.9695 117.0401 57.2244 63.4840 174.5426 114 L 4.4032 8.5045 126.1170 54.4215 42.5434 176.3012 115 N 4.9557 8.9869 119.8044 51.7334 40.1791 174.7876 116 S 4.1408 8.7924 111.7367 61.5317 62.8349 175.2239 117 R 4.2565 7.8491 116.7079 56.0653 30.5539 176.3225 118 V 4.3792 7.7423 117.4561 61.0774 33.1705 173.4579 119 A 5.2212 8.5466 128.4652 50.1091 22.9608 174.9218 120 S 5.1155 8.7039 113.6889 57.5589 65.0797 173.1079 121 I 4.3947 8.2322 121.3849 59.2021 39.9304 175.5087 122 S 4.4348 8.3826 124.1928 58.3357 64.0992 173.8307 123 L 4.4744 8.2924 122.5988 53.3876 42.5873 175.3104 124 P 4.4773 0.0000 0.0000 62.8499 32.0125 176.7925 125 T 4.0983 8.2635 110.5551 62.8735 69.7771 174.7634 *127 S 4.4272 7.5567 114.5674 57.9686 64.0233 173.9000 128 C 4.3963 8.4067 117.7208 56.7060 40.6312 173.4038 129 A 4.4679 7.9966 124.8057 51.1009 20.2057 176.6364 130 S 4.4878 7.9797 113.1517 56.4512 65.4987 173.1577 *132 A 4.1909 8.1823 122.9311 53.4658 19.2475 176.2193 133 G 4.0788 8.9972 109.6726 45.6565 0.0000 174.7285 134 T 3.9953 7.5176 116.5580 63.7806 69.4660 173.8152 135 Q 4.6697 8.5863 124.9634 55.5554 30.0389 175.7703 136 C 5.2590 9.2017 120.0650 55.0277 46.0859 172.4319 137 L 5.1820 8.9295 122.6796 53.5838 43.9485 175.0341 138 I 5.2391 9.0938 127.5367 58.8782 39.9484 174.9073 139 S 4.8911 8.4407 119.0572 56.5697 66.5087 173.0417 140 G 3.7074 7.4122 107.9915 46.2561 0.0000 173.0294 141 W 4.8161 8.6544 116.9826 56.2674 29.4008 176.9367 142 G 4.0196 8.3783 108.8937 44.3109 0.0000 173.5794 143 N 3.5482 8.1467 118.4905 54.1989 38.9197 174.4897 144 T 5.0037 8.1069 113.1000 60.4501 69.3880 174.1694 145 K 4.6012 7.7566 121.7997 54.6858 34.5153 176.2975 146 S 4.2889 8.8614 118.7085 60.8756 63.6580 174.8878 147 S 4.6753 8.8754 115.7047 53.6026 62.5882 173.2696 148 G 3.9662 6.8110 108.1487 45.6676 0.0000 168.8325 149 T 4.7698 7.7855 115.3544 62.0083 72.2593 174.3434 150 S 4.3877 9.4577 121.4011 58.0565 65.4214 172.5943 151 Y 4.8558 8.7547 126.3550 55.8688 38.6988 174.4380 152 P 4.6109 0.0000 0.0000 62.9316 32.5530 175.6619 153 D 4.9156 8.6809 117.5817 54.7075 42.6034 176.4533 154 V 5.3290 7.7024 110.8019 58.2270 34.5776 175.4857 155 L 3.1252 8.2530 125.4536 55.1609 43.0087 175.9734 156 K 4.8199 8.3343 125.0671 54.8239 35.1784 174.5705 157 C 5.2720 8.6023 119.8317 55.2181 42.2482 172.9306 158 L 4.8619 8.4677 121.9294 54.0306 45.5805 174.1973 159 K 5.1670 8.9496 125.6106 55.1320 33.6534 175.7522 160 A 4.7674 9.1065 125.5468 50.1044 23.1686 173.6225 161 P 4.9994 0.0000 0.0000 61.9102 33.8768 175.2279 162 I 4.2745 8.3120 122.6620 61.4873 37.9900 175.8802 163 L 4.8463 8.6639 127.4561 53.2231 43.4088 176.9735 164 S 4.3303 8.4572 115.0142 58.2374 63.8756 175.2636 165 D 4.4906 8.7261 122.2383 57.3567 40.4807 179.3520 166 S 4.2035 8.0131 114.7772 61.5344 63.1064 176.5688 167 S 4.1190 7.8630 118.9989 61.1872 62.6045 175.8271 168 C 4.2976 8.3243 121.1290 59.8875 43.2939 175.9613 169 K 3.9994 8.4245 118.7895 59.4098 31.6334 179.3364 170 S 4.2636 8.0875 114.9233 61.3856 62.7743 176.1601 171 A 4.0229 7.6385 122.6669 53.6579 19.7226 177.3052 172 Y 4.8169 7.5754 114.1781 54.9232 38.2213 172.0326 173 P 4.5230 0.0000 0.0000 63.9123 32.1496 177.0125 174 G 3.9897 9.0639 110.3522 46.1497 0.0000 173.6588 175 Q 4.5193 8.1236 116.9556 55.3262 30.6877 175.6064 176 I 4.4206 7.9005 119.3868 60.0485 38.3399 175.2226 177 T 4.6435 8.2175 115.5716 59.5467 71.1429 174.9304 178 S 4.3526 8.5366 114.6479 60.3927 63.2894 174.3250 179 N 4.9467 8.2044 118.5903 53.4417 38.4328 173.9053 180 M 5.6369 7.8676 117.0698 53.9037 36.3690 174.5491 181 F 5.1013 8.6211 114.5135 56.0201 41.9458 172.5525 182 C 5.3983 9.0411 117.1028 55.8863 42.2328 172.5266 183 A 4.9823 9.2645 122.6264 50.7348 22.3046 175.1606 184 G 3.9256 6.9043 108.3581 44.6664 0.0000 172.8276 184A Y 4.6825 8.2805 119.9588 55.9541 41.2937 176.4492 185 L 4.1995 8.6952 124.9607 57.2214 41.9720 178.5408 186 E 4.1689 8.2477 114.9983 56.7445 30.2523 177.5439 187 G 3.7337 7.8867 108.0195 44.9713 0.0000 171.2357 188 G 4.3181 8.9841 107.4016 44.7311 0.0000 174.3256 188A K 5.3841 7.2137 116.8367 53.4933 35.3620 175.3680 189 D 4.5884 8.2773 122.4029 53.7729 44.7668 174.8561 190 S 4.8779 8.7730 117.0342 58.3280 65.0639 172.7697 191 C 4.7138 9.2356 118.6970 55.4895 45.4314 172.3592 192 Q 4.2880 8.5861 119.4313 57.9088 28.4311 178.0373 193 G 4.3354 9.2886 110.7852 45.8446 0.0000 174.0587 194 D 4.6647 8.5407 118.6064 55.3335 41.6697 176.4975 195 S 4.4005 8.0278 115.1775 60.0786 63.2104 175.7631 196 G 4.2244 8.7189 112.0508 46.3978 0.0000 173.8282 197 G 3.9514 7.9307 107.4025 45.4003 0.0000 171.3895 198 P 5.1000 0.0000 0.0000 62.4600 33.4879 175.7347 199 V 4.6011 8.5526 120.7603 61.3806 34.0178 173.6774 200 V 4.7530 8.6125 128.4493 61.2925 33.6646 173.7601 201 C 5.0948 8.5713 124.6457 55.6581 43.9537 174.5832 202 S 3.3962 9.7248 119.2516 59.7628 59.9686 173.1244 203 G 3.9073 8.5374 105.2750 45.6590 0.0000 174.0989 204 K 4.6894 7.6144 117.7288 52.9813 35.3420 175.4965 *209 L 4.2720 8.2352 121.9604 55.4947 42.2466 175.9248 210 Q 4.5486 8.9121 125.9462 56.5466 31.1518 175.8383 211 G 5.3034 7.9672 104.4559 45.7848 0.0000 171.5318 212 I 5.2204 8.2156 119.6977 58.8535 41.2199 175.0256 213 V 3.6499 8.8739 127.3324 64.2622 31.7887 174.3647 214 S 4.9924 8.5163 121.6301 58.6322 63.9974 174.6851 215 W 5.0403 7.4475 113.8737 55.9589 32.2661 172.2880 216 G 3.6866 7.9346 105.2716 46.7806 0.0000 172.8324 217 S 4.6222 8.2806 114.3351 56.3520 63.0902 172.8380 *219 G 4.2354 7.9747 117.0380 45.4923 0.0000 170.3329 220 C 4.9369 8.0506 115.0712 56.3617 43.3854 173.9894 221 A 4.0069 8.9027 125.3290 53.1676 16.6809 176.8123 221A Q 4.5186 7.3767 117.8745 56.1385 29.6806 175.9134 222 K 4.1687 8.5146 122.7625 58.1298 32.6131 176.1031 223 N 4.2703 9.3086 121.5920 54.0063 37.0345 175.2954 224 K 4.4098 7.7255 116.9118 53.8706 32.2796 173.5999 225 P 4.6003 0.0000 0.0000 62.1112 33.1846 177.4873 226 G 3.6272 8.3953 106.0963 45.9598 0.0000 172.7854 227 V 4.3186 7.5361 121.7707 60.6800 34.0005 174.1663 228 Y 4.8779 8.1638 124.1506 55.9623 42.3361 174.9175 229 T 4.3960 8.5005 119.3445 63.6159 70.1280 174.3814 230 K 4.8975 9.4468 128.2574 55.3533 31.4810 177.1595 231 V 3.9286 8.7047 126.1288 65.9747 31.3913 174.8969 232 C 4.4199 8.4068 112.5133 58.4391 41.3682 174.9439 233 N 4.2340 8.0514 116.8817 54.5700 38.5398 175.6212 234 Y 4.7883 8.1297 117.6815 57.3906 38.6430 177.2401 235 V 3.6532 7.9201 121.2040 66.4829 31.5980 178.0121 236 S 4.1223 8.1122 114.1396 61.2503 62.6309 176.3658 237 W 4.1760 8.2791 130.5523 60.4622 30.5845 177.7508 238 I 2.9766 8.2869 120.1060 64.2379 36.4650 178.4706 239 K 3.7575 8.0839 119.2239 59.5628 31.6567 179.4993 240 Q 3.8963 7.7421 116.9033 59.2229 28.5829 178.6478 241 T 3.7537 7.6153 117.2464 66.4261 68.1540 176.8816 242 I 2.6298 6.9372 113.4886 63.1903 37.5260 177.7581 243 A 4.1475 7.3743 121.7578 53.8727 18.2699 178.6495 244 S 4.7063 7.2451 111.2967 58.2946 63.3495 174.0390 245 N 4.6744 7.8628 125.0675 53.6912 39.5792 174.1798 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 4.21 1.77 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 1.38 1.10 0.89 0.00 0.00 17 V 8.53 4.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.96 0.00 0.00 18 G 8.95 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 0.00 0.00 0.00 19 G 7.79 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 0.00 0.00 0.00 0.00 20 Y 7.80 4.96 0.00 3.02 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 21 T 8.63 4.21 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 8.62 4.35 0.00 2.77 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 8.92 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 0.00 0.00 0.00 24 A 8.72 4.19 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.90 4.26 0.00 2.87 2.90 0.00 0.00 7.19 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 7.77 4.13 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 1.29 0.00 0.00 27 V 7.09 4.09 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 4.46 0.00 2.38 2.30 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.00 0.00 29 Y 6.92 5.24 0.00 3.26 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.37 4.67 0.00 1.79 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.74 0.00 0.00 0.00 0.00 0.00 1.96 2.49 0.00 31 V 9.03 4.89 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.98 0.00 0.00 32 S 8.70 4.94 0.00 3.23 3.40 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 33 L 8.71 4.40 0.00 0.50 0.84 0.77 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.12 6.01 0.00 2.47 2.51 0.00 0.00 6.77 7.97 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 *37 S 8.37 4.18 0.00 3.62 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 38 G 9.87 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 0.00 0.00 0.00 39 Y 6.39 4.54 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 40 H 8.89 4.78 0.00 2.89 3.18 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 8.00 5.12 0.00 3.12 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 6.95 4.72 0.00 2.21 2.77 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 43 G 8.87 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 0.00 0.00 0.00 0.00 44 G 8.13 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 45 S 8.88 5.38 0.00 3.81 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 46 L 9.03 4.78 0.00 1.89 1.67 1.07 0.62 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 47 I 8.68 4.33 1.89 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.89 0.95 0.00 0.00 48 N 7.69 4.50 0.00 2.93 2.99 0.00 0.00 6.00 8.03 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 49 S 8.52 4.16 0.00 4.04 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 0.00 50 Q 8.20 4.49 0.00 2.06 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.90 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 51 W 8.12 5.49 0.00 3.18 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 52 V 9.31 5.00 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 0.92 0.00 0.00 0.98 0.00 0.00 53 V 8.99 4.92 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 1.10 0.00 0.00 1.00 0.00 0.00 54 S 8.91 4.88 0.00 3.91 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.51 4.54 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.34 3.79 0.23 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 57 H 8.20 4.54 0.00 3.40 3.61 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 7.87 4.72 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 59 Y 7.59 4.32 0.00 2.96 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 7.32 3.62 0.00 1.25 1.23 0.00 0.76 0.00 0.00 1.11 0.00 0.00 2.52 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 1.00 7.81 61 S 8.09 4.40 0.00 3.73 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.63 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 0.00 0.00 0.00 63 I 7.20 4.63 1.89 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.83 0.96 0.00 0.00 64 Q 8.84 4.82 0.00 2.01 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 65 V 8.99 4.42 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 1.00 0.00 0.00 0.91 0.00 0.00 66 R 8.86 5.15 0.00 1.61 1.81 0.00 2.68 0.00 0.00 2.61 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.24 0.00 67 L 9.22 4.77 0.00 1.59 1.63 0.96 0.71 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 *69 G 8.18 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.30 4.67 0.00 2.15 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 2.51 2.15 0.00 71 D 7.84 4.79 0.00 2.78 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 72 N 8.89 5.11 0.00 2.85 2.83 0.00 0.00 7.18 7.79 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 73 I 8.39 3.95 1.42 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 1.10 0.49 -0.43 0.00 0.00 74 N 8.69 4.72 0.00 2.81 2.89 0.00 0.00 6.64 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.28 4.30 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 0.95 0.00 0.00 76 V 8.44 4.10 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 0.81 0.00 0.00 1.01 0.00 0.00 77 E 9.36 4.37 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 78 G 7.91 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 8.27 4.94 0.00 2.64 2.79 0.00 0.00 7.16 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 7.89 5.43 0.00 1.41 1.82 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 2.46 2.48 0.00 81 Q 8.47 4.30 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 82 F 8.76 5.60 0.00 2.83 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 83 I 8.82 4.71 1.88 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 0.84 0.94 0.00 0.00 84 S 8.65 4.81 0.00 3.76 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 8.44 4.65 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 86 S 9.07 4.49 0.00 3.76 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 7.57 4.66 0.00 1.85 1.89 0.00 1.45 0.00 0.00 1.91 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.26 1.49 7.81 88 S 8.79 5.31 0.00 3.95 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 89 I 9.02 4.59 2.05 0.00 0.00 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 1.25 1.05 1.12 0.00 0.00 90 V 8.44 4.27 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.75 0.00 0.00 91 H 8.72 3.68 0.00 2.88 3.07 0.00 5.65 0.00 0.00 0.00 0.00 6.65 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 4.30 0.00 2.17 2.18 0.00 2.72 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 1.56 1.87 0.00 93 S 7.85 4.69 0.00 4.04 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 7.90 4.28 0.00 2.94 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.12 4.46 0.00 2.58 2.45 0.00 0.00 6.59 7.79 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 96 S 7.83 4.01 0.00 3.97 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 97 N 8.05 4.38 0.00 2.81 2.79 0.00 0.00 6.82 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 98 T 7.58 4.06 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 1.08 0.00 0.00 99 L 8.13 3.77 0.00 1.37 1.89 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.57 4.53 0.00 2.75 2.64 0.00 0.00 7.28 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 8.84 4.67 0.00 3.09 2.78 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 8.10 4.75 0.00 3.12 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 7.18 4.74 1.47 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 1.39 1.21 0.17 0.00 0.00 104 M 9.19 5.52 0.00 2.12 1.83 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.64 0.00 105 L 9.28 5.39 0.00 1.72 1.79 -0.02 0.72 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 9.34 5.02 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 1.21 0.82 0.90 0.00 0.00 107 K 8.48 4.01 0.00 0.79 1.02 0.00 1.15 0.00 0.00 1.31 0.00 0.00 2.63 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.67 0.21 7.81 108 L 8.07 4.56 0.00 1.47 1.58 0.93 0.98 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 8.98 4.19 0.00 1.63 1.84 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.48 7.81 110 S 7.72 4.58 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 8.40 4.38 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.78 4.31 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 0.00 113 S 8.97 4.53 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 0.00 114 L 8.50 4.40 0.00 1.66 1.63 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.99 4.96 0.00 2.80 2.91 0.00 0.00 6.43 7.40 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 0.00 116 S 8.79 4.14 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 7.85 4.26 0.00 1.83 2.02 0.00 3.31 0.00 0.00 3.16 7.27 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.43 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.41 4.40 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 8.00 4.47 1.08 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 0.00 130 S 7.98 4.49 0.00 3.96 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 *132 A 8.18 4.19 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.00 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 0.00 134 T 7.52 4.00 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 1.16 0.00 0.00 135 Q 8.59 4.67 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 136 C 9.20 5.26 0.00 2.75 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 0.00 137 L 8.93 5.18 0.00 1.76 1.56 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.09 5.24 1.84 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.33 0.93 0.00 0.00 139 S 8.44 4.89 0.00 3.54 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.41 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 0.00 0.00 0.00 141 W 8.65 4.82 0.00 3.28 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 0.00 142 G 8.38 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 0.00 143 N 8.15 3.55 0.00 1.86 2.49 0.00 0.00 7.11 7.27 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 0.00 144 T 8.11 5.00 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 1.18 0.00 0.00 145 K 7.76 4.60 0.00 1.79 1.73 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.30 1.31 7.81 146 S 8.86 4.29 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 0.00 147 S 8.88 4.68 0.00 3.84 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 0.00 148 G 6.81 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 0.00 149 T 7.79 4.77 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 1.47 0.00 0.00 150 S 9.46 4.39 0.00 3.86 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 0.00 151 Y 8.75 4.86 0.00 2.93 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 0.00 152 P 0.00 4.61 0.00 2.42 2.08 0.00 3.87 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.00 0.00 153 D 8.68 4.92 0.00 2.68 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 0.00 154 V 7.70 5.33 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 1.07 0.00 0.00 0.98 0.00 0.00 155 L 8.25 3.13 0.00 1.22 1.27 -0.65 0.04 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 8.33 4.82 0.00 1.64 1.48 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.45 7.81 157 C 8.60 5.27 0.00 1.55 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 0.00 158 L 8.47 4.86 0.00 1.69 1.42 1.07 0.73 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 8.95 5.17 0.00 1.82 1.82 0.00 1.87 0.00 0.00 1.77 0.00 0.00 2.74 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.68 7.81 160 A 9.11 4.77 1.09 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 0.00 161 P 0.00 5.00 0.00 2.05 2.33 0.00 3.10 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.85 0.00 162 I 8.31 4.27 1.77 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 1.14 0.65 0.82 0.00 0.00 163 L 8.66 4.85 0.00 1.56 1.60 0.92 1.01 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 0.00 164 S 8.46 4.33 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 8.73 4.49 0.00 2.77 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.01 4.20 0.00 4.06 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 0.00 167 S 7.86 4.12 0.00 4.02 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 0.00 168 C 8.32 4.30 0.00 3.20 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 0.00 169 K 8.42 4.00 0.00 1.82 1.92 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.65 7.81 170 S 8.09 4.26 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 0.00 171 A 7.64 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.58 4.82 0.00 3.25 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 0.00 173 P 0.00 4.52 0.00 2.08 2.05 0.00 3.85 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 2.05 2.24 0.00 174 G 9.06 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 8.12 4.52 0.00 2.45 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.52 6.62 0.00 0.00 0.00 0.00 0.00 2.25 2.56 0.00 176 I 7.90 4.42 2.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.97 1.02 0.00 0.00 177 T 8.22 4.64 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 4.35 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 8.20 4.95 0.00 2.94 3.11 0.00 0.00 6.60 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 7.87 5.64 0.00 1.84 2.01 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 2.67 2.62 0.00 181 F 8.62 5.10 0.00 3.13 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 9.04 5.40 0.00 2.98 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.26 4.98 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 0.00 184 G 6.90 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 184A Y 8.28 4.68 0.00 3.09 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.70 4.20 0.00 1.74 1.73 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.25 4.17 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.23 0.00 187 G 7.89 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 0.00 0.00 0.00 188 G 8.98 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 0.00 0.00 0.00 0.00 188A K 7.21 5.38 0.00 1.79 1.84 0.00 1.40 0.00 0.00 2.29 0.00 0.00 2.75 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.13 7.81 189 D 8.28 4.59 0.00 2.77 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 8.77 4.88 0.00 3.99 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 0.00 191 C 9.24 4.71 0.00 2.92 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 0.00 192 Q 8.59 4.29 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.31 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 193 G 9.29 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 0.00 194 D 8.54 4.66 0.00 2.97 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 8.03 4.40 0.00 4.01 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 0.00 196 G 8.72 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 0.00 0.00 0.00 0.00 197 G 7.93 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 0.00 198 P 0.00 5.10 0.00 2.33 2.36 0.00 3.69 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 2.20 2.20 0.00 199 V 8.55 4.60 2.19 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 0.90 0.00 0.00 0.55 0.00 0.00 200 V 8.61 4.75 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 0.93 0.00 0.00 0.66 0.00 0.00 201 C 8.57 5.09 0.00 2.81 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 0.00 202 S 9.72 3.40 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 8.54 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.61 4.69 0.00 1.72 1.64 0.00 1.91 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.24 4.27 0.00 1.52 1.64 0.96 0.74 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 8.91 4.55 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 211 G 7.97 5.30 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 0.00 212 I 8.22 5.22 1.92 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 1.29 1.02 0.95 0.00 0.00 213 V 8.87 3.65 2.30 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 0.92 0.00 0.00 1.16 0.00 0.00 214 S 8.52 4.99 0.00 3.89 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 0.00 215 W 7.45 5.04 0.00 3.35 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 0.00 216 G 7.93 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 0.00 217 S 8.28 4.62 0.00 4.22 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 *219 G 7.97 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 0.00 220 C 8.05 4.94 0.00 2.94 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 8.90 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.38 4.52 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.91 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 222 K 8.51 4.17 0.00 1.72 1.73 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.55 7.81 223 N 9.31 4.27 0.00 2.82 2.82 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 0.00 224 K 7.73 4.41 0.00 1.86 1.89 0.00 1.80 0.00 0.00 1.40 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.51 7.81 225 P 0.00 4.60 0.00 2.11 2.09 0.00 3.63 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 226 G 8.40 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 0.00 0.00 0.00 227 V 7.54 4.32 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 0.28 0.00 0.00 -0.76 0.00 0.00 228 Y 8.16 4.88 0.00 1.46 2.49 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 0.00 229 T 8.50 4.40 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 1.13 0.00 0.00 230 K 9.45 4.90 0.00 2.21 1.95 0.00 1.81 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.61 7.81 231 V 8.70 3.93 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 1.16 0.00 0.00 1.09 0.00 0.00 232 C 8.41 4.42 0.00 3.17 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 0.00 233 N 8.05 4.23 0.00 2.43 2.42 0.00 0.00 6.84 6.87 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 0.00 234 Y 8.13 4.79 0.00 3.21 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 0.00 235 V 7.92 3.65 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 1.17 0.00 0.00 1.04 0.00 0.00 236 S 8.11 4.12 0.00 3.97 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 0.00 237 W 8.28 4.18 0.00 3.47 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.29 2.98 2.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.00 0.72 0.00 0.00 239 K 8.08 3.76 0.00 1.71 1.77 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.69 7.81 240 Q 7.74 3.90 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 241 T 7.62 3.75 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 0.85 0.00 0.00 242 I 6.94 2.63 0.56 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.18 -0.50 0.00 0.00 243 A 7.37 4.15 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 0.00 244 S 7.25 4.71 0.00 3.80 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 0.00 245 N 7.86 4.67 0.00 3.04 2.96 0.00 0.00 6.90 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.