NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4507 8.3044 118.1964 54.5810 32.9694 174.9888 2 D 4.2965 8.2445 117.7284 53.2780 43.0577 174.9290 3 N 4.5345 9.3956 125.9272 56.2905 39.3802 176.2969 4 Y 4.0920 8.3928 118.6656 61.1861 37.9409 178.4964 5 Q 3.8614 8.0989 119.8860 59.0613 28.9170 177.7751 6 E 3.9376 7.9669 119.2904 59.3119 29.4490 179.3134 7 L 3.5037 7.9914 118.9086 57.5146 41.4199 179.3814 8 A 3.6417 7.2766 119.6032 54.9009 18.4369 179.3918 9 I 3.9863 7.5065 118.2504 64.7425 37.0153 178.4565 10 Q 3.8985 7.5938 118.9325 58.5155 28.8643 177.3347 11 F 4.9594 7.4036 115.6180 56.4188 39.7804 176.0407 12 A 4.3381 7.2935 122.0275 51.7322 18.9013 177.5678 13 A 4.4698 8.4919 124.1679 52.0000 19.2672 178.2068 14 Q 4.1300 8.9093 121.4990 58.3488 28.9784 176.6101 15 A 4.7848 7.5020 117.3745 49.6492 22.5172 175.4512 16 V 3.8491 8.1883 118.8460 63.1464 32.7886 176.6414 17 D 4.6788 8.2492 129.3255 54.5941 41.1115 177.0083 *19 N 4.6822 8.6238 116.2915 52.8059 40.4764 175.7421 20 E 4.0184 8.3630 122.0535 59.5045 29.5308 178.0897 21 I 3.8695 8.0381 118.2134 64.4489 37.5933 177.3025 22 E 4.1173 7.9108 118.0449 58.9005 29.6290 178.7348 23 Q 3.8002 7.9294 117.8781 57.6465 28.0298 177.9083 24 W 4.6943 7.8756 117.9584 56.5963 31.4007 176.2426 25 V 3.6262 7.6662 117.0512 64.1452 31.5976 175.8962 26 R 4.0686 8.8110 120.9671 56.5318 27.6797 177.7940 27 E 3.8520 7.9295 119.3118 59.4172 29.4743 177.8051 28 F 4.7419 8.0642 113.1983 57.2444 39.2341 175.6631 29 A 4.2626 7.9146 125.0207 51.7219 18.7064 177.4025 30 Y 4.1997 8.7587 122.4493 58.4263 39.1399 175.8783 31 Q 4.4736 8.0360 124.7659 54.2696 30.9195 176.1906 32 G 3.9295 8.0370 114.7132 43.3664 0.0000 171.8195 33 F 4.8753 7.5871 117.6728 54.4924 41.3118 174.7967 34 D 4.2916 8.5095 121.5992 53.2903 42.8478 177.3324 35 A 3.8787 7.8668 128.2758 55.2175 18.1366 179.9308 36 R 3.7729 7.9293 116.7134 59.2044 30.0379 179.2525 37 R 3.7754 7.6349 118.1581 59.2083 30.1156 178.2983 38 V 3.5569 7.6553 118.0694 66.3547 31.4739 178.1560 39 I 3.5140 7.6510 119.2560 64.1332 36.7960 178.1456 40 E 3.7542 8.2041 119.6682 59.5337 29.2712 179.5557 41 L 3.5187 8.1414 119.1845 57.4402 41.5086 179.5180 42 L 4.2165 8.0120 119.2491 57.8279 41.5493 179.8176 43 K 3.5741 7.5611 118.3093 59.1453 31.6984 179.1887 44 Q 3.8308 7.7189 118.8654 59.5623 29.0428 177.7372 45 Y 4.5699 7.7249 116.3800 60.4636 37.9510 177.5849 46 G 4.1223 8.3482 107.8442 44.9471 0.0000 174.9239 47 G 4.0098 8.8497 110.2194 46.4002 0.0000 175.8470 48 A 4.2417 8.8516 123.6479 54.5636 18.8484 178.3567 49 D 4.8423 7.9040 114.2897 53.9460 41.0360 178.1281 50 W 4.5175 8.2043 120.3667 60.0984 27.9644 178.1876 51 E 3.2181 7.0846 118.7267 58.4912 28.2888 179.3240 52 K 3.8796 7.7081 118.0902 59.5397 32.2302 178.9744 53 D 4.4260 8.2019 118.9626 57.2814 40.6820 178.5731 54 A 3.9273 8.4771 121.6893 54.9732 18.3318 179.3299 55 K 3.8399 8.0405 118.0192 59.8100 32.1615 179.0254 56 K 4.1719 7.7123 117.3314 59.9782 31.9494 179.3301 57 M 3.9756 8.1682 118.8558 58.2187 31.6837 178.9066 58 I 3.6710 8.1721 120.5548 64.3398 37.3039 178.5671 59 V 3.6160 7.9126 119.0655 65.9687 31.3070 178.0670 60 L 3.8614 8.0595 118.5064 57.7067 40.2503 179.3178 61 A 4.4060 8.0701 122.2208 54.7594 18.0916 179.7286 62 L 4.3731 8.2177 116.9448 57.3496 41.8539 178.7742 63 T 4.7567 8.1864 107.7252 62.1480 70.0145 175.5242 64 R 4.6056 8.8581 119.3237 56.6750 33.3607 174.8051 65 G 2.6462 6.0331 101.7294 44.1149 0.0000 174.5805 66 N 4.9339 7.9804 124.9749 52.9333 39.7880 175.7093 67 K 4.4755 7.8736 118.0266 52.6907 32.2152 174.7151 68 P 4.1389 0.0000 0.0000 65.5501 31.2524 178.1049 69 R 3.8959 7.7786 114.9169 59.1528 30.1678 178.6742 70 R 4.0090 7.8310 118.2125 59.6275 30.0284 178.3402 71 M 4.0553 7.7887 115.3302 58.3419 31.3691 178.1275 72 M 4.1807 7.8733 119.4547 58.9336 31.9091 178.6255 73 M 3.8184 7.1065 117.5583 58.0895 32.3388 177.8928 74 K 4.5265 8.0159 115.5634 56.3377 32.7028 175.9815 75 M 4.9009 8.1566 119.9577 54.0928 33.0913 176.6848 76 S 4.4130 8.3478 115.5502 58.1811 65.1075 175.3459 77 K 3.9532 8.5300 121.9716 60.0365 32.2622 178.8969 78 E 4.0131 8.1944 120.1454 58.9499 29.6324 178.6880 79 G 3.8218 8.2340 105.7883 47.9045 0.0000 175.5354 80 K 3.9346 8.3406 121.4356 59.1290 32.1256 179.1324 81 A 4.0304 8.0682 120.7625 55.4979 18.2756 179.7928 82 T 3.8440 7.9406 113.9592 66.9477 68.5561 177.0874 83 V 3.5096 8.1471 120.3917 65.7827 31.5894 177.4075 84 E 3.8694 8.6149 119.3487 59.5291 29.4926 178.8904 85 A 4.0737 8.0925 120.4092 54.8140 18.2765 179.7218 86 L 4.1624 7.8789 117.9211 57.9965 41.7418 179.4778 87 I 3.6912 7.9716 119.9716 64.6889 36.8555 178.3214 88 N 4.3230 7.8335 115.6836 55.8213 38.4139 177.2924 89 K 3.8346 7.7476 120.3220 59.1759 32.3795 177.8061 90 Y 4.2334 8.0859 114.7771 56.6498 38.6695 175.4027 91 K 3.7069 7.7673 118.7407 57.0897 30.2751 175.6511 92 L 4.3640 7.8260 116.8721 55.0768 42.5345 177.9868 93 K 4.6551 8.7287 121.7760 54.8152 35.7220 174.7125 94 E 4.3505 8.5406 120.6785 54.8645 31.9791 178.1732 95 G 3.6584 8.6099 107.9878 47.1444 0.0000 175.6879 96 N 4.7794 8.4624 113.9735 50.9509 38.5567 172.3613 97 P 4.6076 0.0000 0.0000 60.8502 33.5906 176.5252 98 S 4.4523 8.3152 112.9788 57.8173 63.5151 175.1592 99 R 4.1454 8.5592 116.8527 58.8310 29.0303 176.9676 100 D 4.9608 7.9760 116.9977 54.0639 41.3654 175.4084 101 E 4.8993 7.7625 117.5986 54.5692 32.8077 175.6551 102 L 4.7052 8.4959 122.4807 53.9366 44.0751 175.6381 103 T 4.9917 7.9726 111.2364 59.1595 72.5735 174.8312 104 L 3.8999 8.5364 121.8575 57.8223 41.5819 179.8450 105 S 4.0919 8.6482 114.6075 61.7088 62.7709 176.8837 106 R 3.3416 7.8663 121.9248 58.3215 29.6385 179.1597 107 V 3.5340 7.6319 117.8201 65.9718 31.3294 177.7798 108 A 4.0656 7.9672 120.0333 54.6181 18.2784 179.2171 109 A 4.1776 7.8842 117.6971 55.3065 18.6143 179.5339 110 A 4.2082 8.4928 118.6392 53.9485 19.0879 178.5593 111 L 4.8499 8.1042 118.1951 53.7837 42.1909 178.3438 112 A 4.0845 8.3305 122.9804 55.6649 18.3156 179.6289 113 G 2.9909 7.8047 103.3388 47.7245 0.0000 176.0710 114 R 4.1563 7.8990 119.8370 59.2578 30.0353 178.8812 115 T 3.7714 8.1276 115.8111 67.0517 67.9613 176.5201 116 C 4.1043 8.3148 118.6778 62.5149 28.1688 175.9638 117 Q 3.6969 7.6719 119.8350 58.8774 28.5529 177.9783 118 A 3.2796 7.8194 121.7896 54.6850 17.9015 179.4512 119 L 3.7404 7.2716 116.8670 57.7014 41.2960 179.7851 120 V 3.4192 7.1035 117.5257 65.8873 31.4804 177.7225 121 V 3.9245 7.4718 115.8562 64.8809 31.8999 176.7708 122 L 4.6785 7.9407 117.1607 54.4122 41.7301 178.0386 123 S 4.0269 7.6210 116.5689 61.5864 62.2556 175.7706 124 E 4.3948 8.1667 115.5117 56.5389 29.5698 176.6272 125 W 4.6139 8.3748 118.5431 56.9180 29.9033 176.6406 126 L 4.4897 7.7080 118.1304 53.0960 42.1676 174.9955 127 P 4.0496 0.0000 0.0000 64.6027 31.3614 177.0077 128 V 4.2967 7.7434 117.3214 60.8498 33.5163 175.5558 129 T 5.1305 7.6935 119.1930 60.0080 71.5548 175.8261 130 G 3.6784 8.4817 108.7599 48.3343 0.0000 176.2986 131 T 3.8996 7.6982 117.1679 66.6573 68.6216 176.6317 132 T 3.9924 7.7638 117.1792 66.9727 68.4393 176.5663 133 M 3.8961 8.0652 120.5003 58.5492 30.6103 178.5829 134 D 4.8094 8.0385 120.6855 56.6823 40.6880 179.0668 135 G 3.7917 7.6812 105.4101 47.2889 0.0000 175.1405 136 L 4.4012 7.8029 120.2810 55.6108 42.3818 177.4799 137 S 4.5749 7.2169 110.6100 56.1296 65.7296 171.7241 138 P 4.3729 0.0000 0.0000 63.8223 31.9680 175.6674 139 A 3.7093 8.6691 121.4605 53.2734 16.0811 177.3484 140 Y 3.9433 8.1728 122.2818 57.4108 39.8958 173.2000 141 P 4.1338 0.0000 0.0000 62.2014 31.8515 177.3813 142 R 3.8731 8.5818 123.4203 59.5680 30.1467 178.6354 143 H 4.1767 7.7169 112.5858 57.5391 28.6453 175.7200 144 M 3.3343 7.2495 117.4882 55.4362 32.3170 175.9611 145 M 2.9713 7.1375 119.5532 53.9740 32.4310 175.6069 146 H 4.6751 6.7026 114.7528 54.0221 33.1795 172.2585 147 P 4.5205 0.0000 0.0000 65.5449 31.2248 178.9063 148 S 4.3423 8.1739 112.3575 60.6368 62.9033 175.7576 149 F 4.0191 8.4448 124.8912 61.3594 38.9741 176.5403 150 A 3.9659 7.9777 120.1741 55.1203 17.9077 179.2806 151 G 3.7491 7.8046 101.4507 46.5612 0.0000 174.6201 152 M 4.2431 7.5012 119.8467 54.1809 32.6604 176.0096 153 V 3.5703 6.5916 120.3997 61.8791 32.3508 174.8902 154 D 4.5218 8.5357 127.5570 52.6532 40.6027 174.7377 155 P 4.4105 0.0000 0.0000 64.4940 31.4644 177.1295 156 S 4.4096 8.0110 112.9913 58.3407 63.5935 174.5820 157 L 4.0855 7.6533 121.7947 54.4060 42.1096 175.7852 158 P 4.1890 0.0000 0.0000 63.1529 32.5318 177.5482 159 G 3.9684 8.8007 109.1364 48.3755 0.0000 175.5086 160 D 4.3824 7.8706 120.4657 57.3520 40.9929 178.3240 161 Y 4.3682 7.7952 116.7625 61.0162 37.9606 178.1161 162 L 4.0197 8.4476 121.7243 58.3079 42.1386 179.0788 163 R 3.9635 8.3516 118.4963 59.2734 29.9464 178.2739 164 A 4.0664 8.1943 120.7142 55.2567 18.4154 179.7024 165 I 3.7223 7.9151 118.2868 64.6446 37.1373 178.7568 166 L 4.2194 8.1476 119.8393 57.6885 41.2424 179.2254 167 D 4.1101 8.3591 118.3836 57.1011 40.9571 178.2311 168 A 4.2439 8.2095 121.3702 55.7065 18.4227 179.2615 169 H 4.3251 8.2649 117.9114 59.0043 29.9336 177.6432 170 S 3.7955 8.3352 117.2376 60.8332 61.9722 176.3681 171 L 4.1416 7.4904 123.3806 58.2219 41.9310 178.3160 172 Y 3.8452 7.8934 118.8344 60.7698 38.8769 177.8219 173 L 3.5287 7.5111 119.7852 57.3068 41.2997 179.2543 174 L 4.1184 7.5503 120.2267 58.3365 42.0040 179.1328 175 Q 3.9441 7.5402 117.1449 58.9040 28.7097 178.5050 176 F 4.0069 8.0339 121.9165 61.5381 39.2955 177.2314 177 S 4.3181 8.6896 114.9835 61.8003 62.2770 176.8329 178 R 3.9770 7.7021 120.3369 58.3529 29.6028 179.1429 179 V 3.5624 7.1191 117.8275 65.7124 31.6594 177.7804 180 I 4.0451 7.3841 111.7602 62.1011 38.5155 175.2522 181 N 4.8425 8.2136 119.9670 49.9100 38.9315 172.2218 182 P 4.5828 0.0000 0.0000 64.5434 31.5132 177.5214 183 N 4.4224 8.2341 114.6610 55.9528 38.4747 176.6929 184 L 4.3074 8.2924 119.7656 56.1658 41.5171 179.0842 185 R 3.8823 7.7880 118.6135 59.0504 30.0902 177.7346 186 G 3.9272 7.6050 102.2735 45.4365 0.0000 173.4968 187 R 4.5580 7.2531 118.5178 54.3272 32.2272 176.9696 188 T 4.0951 8.2438 110.6495 61.2802 70.7238 175.4428 189 K 3.8519 8.5203 122.8713 60.0791 32.3225 178.9234 190 E 4.0257 8.0868 118.0808 59.2703 29.1438 179.0601 191 E 3.9197 7.7801 117.6532 59.2844 29.8330 179.2360 192 V 3.6465 7.8155 118.0731 65.9454 31.6571 177.8286 193 A 2.5800 8.2210 120.6613 54.5957 17.8520 179.4263 194 A 3.8476 7.4285 117.9390 54.8458 18.4517 179.2352 195 T 4.1136 7.4096 107.2633 63.0332 69.5050 175.9086 196 F 4.6244 6.9862 115.2843 56.9947 39.3555 177.3062 197 T 4.0718 7.6532 117.0098 66.6985 68.1034 176.5766 198 Q 4.0651 8.0407 119.8282 58.4351 28.8755 176.8357 199 P 4.3674 0.0000 0.0000 65.8802 31.4423 177.8965 200 M 4.1120 8.1423 117.6852 58.9012 32.1968 178.0231 201 N 4.3783 8.7084 116.5237 56.1354 38.4605 177.1142 202 A 4.0081 8.1900 121.4230 55.3499 18.6391 179.3064 203 A 4.0931 8.0942 119.1364 55.2005 18.2403 179.7983 204 V 3.6850 7.7903 115.8999 65.8255 31.6076 177.1022 205 N 4.8787 7.7505 112.6971 52.0219 38.9903 175.1997 206 S 4.4575 7.1802 116.3496 57.9788 63.9513 173.6012 207 N 4.6611 8.5781 116.7252 52.7428 37.3033 174.2815 208 F 4.5736 7.8684 121.8846 57.8298 40.0137 171.2256 209 I 3.0266 7.9278 135.0000 60.6137 36.5224 174.3390 210 S 4.2368 8.2533 120.1794 58.4776 64.7152 174.6166 211 H 4.1121 8.7480 120.4653 59.4290 28.4564 177.5399 212 E 3.8848 8.0625 120.1245 59.3309 29.6163 178.8889 213 K 3.8781 8.3699 118.9406 59.2121 31.9397 179.7273 214 R 3.9962 8.2576 118.6926 59.4083 30.0521 179.0681 215 R 3.8466 8.1737 118.5650 59.2806 29.9870 178.3871 216 E 3.8077 8.0867 118.4962 59.2842 29.3747 179.0403 217 F 3.6874 7.6874 117.6841 60.6734 38.9487 177.8562 218 L 4.0241 8.0421 118.4716 57.4531 41.2690 179.6918 219 K 4.2495 8.3326 120.8451 59.0120 32.0224 178.7495 220 A 3.9953 8.1225 119.9365 55.1027 18.3225 178.8004 221 F 4.6375 8.2785 114.0561 57.5885 39.1676 176.6009 222 G 3.9570 7.9839 106.8640 46.0540 0.0000 174.7231 223 L 4.2943 8.1165 121.5524 55.9688 42.3501 177.1990 224 V 4.8088 7.3084 110.2457 59.4005 35.8286 175.0130 225 D 4.8575 8.3215 122.0794 52.0244 41.4744 177.0411 226 S 4.1000 8.6231 112.5740 61.2378 62.7648 174.6261 227 N 4.7293 8.6643 116.5679 52.7816 38.4402 175.8482 228 G 3.9994 8.2162 107.6845 44.9164 0.0000 174.0961 229 K 2.4800 7.6081 121.9027 54.6994 32.7289 174.6060 230 P 4.7922 0.0000 0.0000 61.9855 32.1878 176.1842 231 S 4.3018 8.5204 115.5229 57.6936 63.9072 175.2351 232 A 3.9603 8.5864 122.1641 55.4213 17.9647 179.8280 233 A 3.9220 7.8767 118.7194 54.9548 18.4585 179.9265 234 V 3.4310 7.5651 116.5999 66.4066 31.6761 178.1756 235 M 4.0530 8.1581 118.2079 58.3224 31.7388 178.5491 236 A 4.0056 8.2636 120.7779 55.2179 18.4857 179.5337 237 A 4.1010 8.2090 119.0130 55.2149 18.4333 179.6687 238 A 4.0512 8.2920 119.4143 55.4593 18.3516 179.6902 239 Q 3.9481 8.1976 117.7453 59.2762 29.1494 178.1530 240 A 4.0463 8.5179 122.3068 55.4238 18.1686 179.0001 241 Y 4.1179 8.2861 117.4162 60.8016 38.9770 177.9373 242 K 3.9934 8.1286 118.9067 58.9453 32.2545 178.2993 243 T 4.2999 7.3034 106.8864 60.6543 69.8384 174.9945 244 A 4.0214 6.9933 124.9367 52.0171 19.1069 177.3952 245 A 4.1334 8.4189 123.0889 52.4836 18.4920 177.6147 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 1 M 8.30 4.45 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 2 D 8.24 4.30 0.00 2.94 2.64 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 0.00 0.00 0.00 0.00 3 N 9.40 4.53 0.00 2.69 2.61 0.00 0.00 7.68 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 4 Y 8.39 4.09 0.00 3.16 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 5 Q 8.10 3.86 0.00 2.24 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.57 2.67 0.00 6 E 7.97 3.94 0.00 2.11 1.90 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 2.31 2.53 0.00 7 L 7.99 3.50 0.00 1.75 1.54 0.84 0.61 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 8 A 7.28 3.64 -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 9 I 7.51 3.99 2.03 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 1.74 1.50 0.97 0.00 0.00 10 Q 7.59 3.90 0.00 1.75 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 11 F 7.40 4.96 0.00 3.02 2.88 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 12 A 7.29 4.34 1.59 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 13 A 8.49 4.47 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Q 8.91 4.13 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 15 A 7.50 4.78 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.19 3.85 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 0.85 0.00 0.00 0.96 0.00 0.00 17 D 8.25 4.68 0.00 2.72 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 *19 N 8.62 4.68 0.00 2.83 3.02 0.00 0.00 6.49 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 20 E 8.36 4.02 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.74 0.00 21 I 8.04 3.87 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 1.70 1.24 0.95 0.00 0.00 22 E 7.91 4.12 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 23 Q 7.93 3.80 0.00 1.51 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.57 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 24 W 7.88 4.69 0.00 3.44 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 25 V 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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 0.00 34 D 8.51 4.29 0.00 2.64 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 35 A 7.87 3.88 0.04 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 36 R 7.93 3.77 0.00 1.87 1.95 0.00 3.16 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 37 R 7.63 3.78 0.00 1.87 2.07 0.00 3.31 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 38 V 7.66 3.56 2.25 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 1.05 0.00 0.00 1.04 0.00 0.00 39 I 7.65 3.51 1.91 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.72 0.63 0.00 0.00 40 E 8.20 3.75 0.00 2.09 1.86 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 2.23 2.40 0.00 41 L 8.14 3.52 0.00 1.72 1.55 0.96 0.31 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 67 K 7.87 4.48 0.00 1.80 1.75 0.00 1.65 0.00 0.00 1.58 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.23 1.30 7.81 68 P 0.00 4.14 0.00 2.08 2.02 0.00 3.52 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 2.04 2.09 0.00 69 R 7.78 3.90 0.00 1.74 1.96 0.00 3.35 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 70 R 7.83 4.01 0.00 1.87 2.00 0.00 3.21 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 71 M 7.79 4.06 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.66 0.00 72 M 7.87 4.18 0.00 2.10 2.29 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.56 0.00 73 M 7.11 3.82 0.00 1.99 2.28 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.57 0.00 74 K 8.02 4.53 0.00 1.79 1.81 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.39 7.81 75 M 8.16 4.90 0.00 2.04 2.15 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 2.97 2.70 0.00 76 S 8.35 4.41 0.00 4.07 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 77 K 8.53 3.95 0.00 2.02 2.13 0.00 1.51 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.51 7.81 78 E 8.19 4.01 0.00 2.06 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 2.38 2.37 0.00 79 G 8.23 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 80 K 8.34 3.93 0.00 1.98 1.90 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.18 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.63 1.71 7.81 81 A 8.07 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.94 3.84 4.68 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 1.44 0.00 0.00 83 V 8.15 3.51 2.04 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 0.97 0.00 0.00 0.73 0.00 0.00 84 E 8.61 3.87 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 85 A 8.09 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.88 4.16 0.00 1.92 1.81 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 87 I 7.97 3.69 1.96 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 1.49 0.75 0.88 0.00 0.00 88 N 7.83 4.32 0.00 2.68 2.81 0.00 0.00 7.06 7.39 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 89 K 7.75 3.83 0.00 1.63 1.63 0.00 1.65 0.00 0.00 1.44 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.30 1.08 7.81 90 Y 8.09 4.23 0.00 3.22 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 91 K 7.77 3.71 0.00 1.61 1.73 0.00 1.04 0.00 0.00 1.33 0.00 0.00 2.87 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.21 1.26 7.81 92 L 7.83 4.36 0.00 1.51 1.57 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.73 4.66 0.00 1.56 1.67 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.56 7.81 94 E 8.54 4.35 0.00 1.79 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 2.16 2.24 0.00 95 G 8.61 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 0.00 0.00 0.00 96 N 8.46 4.78 0.00 2.66 2.76 0.00 0.00 6.85 7.69 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 97 P 0.00 4.61 0.00 2.21 2.06 0.00 3.76 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 98 S 8.32 4.45 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 99 R 8.56 4.15 0.00 1.98 2.16 0.00 3.03 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 100 D 7.98 4.96 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 E 7.76 4.90 0.00 1.88 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 2.25 2.40 0.00 102 L 8.50 4.71 0.00 1.69 1.59 1.29 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 103 T 7.97 4.99 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 1.14 0.00 0.00 104 L 8.54 3.90 0.00 1.77 1.66 0.77 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.65 4.09 0.00 3.96 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 0.00 106 R 7.87 3.34 0.00 1.53 1.43 0.00 2.82 0.00 0.00 2.59 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.03 0.00 107 V 7.63 3.53 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 1.00 0.00 0.00 0.93 0.00 0.00 108 A 7.97 4.07 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 0.00 109 A 7.88 4.18 1.53 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 0.00 110 A 8.49 4.21 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 0.00 111 L 8.10 4.85 0.00 1.86 1.75 1.13 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.33 4.08 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.80 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 0.00 0.00 0.00 114 R 7.90 4.16 0.00 2.06 2.09 0.00 3.15 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.81 0.00 115 T 8.13 3.77 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 1.01 0.00 0.00 116 C 8.31 4.10 0.00 2.98 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 7.67 3.70 0.00 2.33 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 118 A 7.82 3.28 0.43 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 0.00 119 L 7.27 3.74 0.00 1.57 1.59 0.78 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.10 3.42 2.04 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 0.73 0.00 0.00 0.59 0.00 0.00 121 V 7.47 3.92 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.98 0.00 0.00 122 L 7.94 4.68 0.00 1.68 1.67 0.74 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 123 S 7.62 4.03 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 0.00 124 E 8.17 4.39 0.00 1.87 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.21 0.00 125 W 8.37 4.61 0.00 3.38 3.32 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 0.00 126 L 7.71 4.49 0.00 1.85 1.63 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.05 0.00 1.87 1.43 0.00 3.59 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.49 0.00 128 V 7.74 4.30 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 0.85 0.00 0.00 0.94 0.00 0.00 129 T 7.69 5.13 4.36 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 1.23 0.00 0.00 130 G 8.48 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 0.00 0.00 0.00 131 T 7.70 3.90 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 132 T 7.76 3.99 4.36 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 1.17 0.00 0.00 133 M 8.07 3.90 0.00 1.55 2.19 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.80 0.00 134 D 8.04 4.81 0.00 2.86 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 0.00 135 G 7.68 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 0.00 0.00 0.00 136 L 7.80 4.40 0.00 1.67 1.71 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 137 S 7.22 4.57 0.00 3.88 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 0.00 138 P 0.00 4.37 0.00 2.24 2.06 0.00 4.01 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 2.01 1.98 0.00 139 A 8.67 3.71 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 0.00 140 Y 8.17 3.94 0.00 3.29 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 0.00 141 P 0.00 4.13 0.00 1.70 1.71 0.00 2.20 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 142 R 8.58 3.87 0.00 1.61 1.82 0.00 3.27 0.00 0.00 3.52 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.53 0.00 143 H 7.72 4.18 0.00 2.81 2.89 0.00 5.93 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 0.00 144 M 7.25 3.33 0.00 1.63 1.79 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.81 0.00 145 M 7.14 2.97 0.00 1.71 1.92 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.51 0.00 146 H 6.70 4.68 0.00 2.92 2.98 0.00 5.72 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 P 0.00 4.52 0.00 2.11 2.19 0.00 2.88 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.10 0.00 148 S 8.17 4.34 0.00 4.13 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 0.00 149 F 8.44 4.02 0.00 3.20 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 0.00 150 A 7.98 3.97 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 G 7.80 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 0.00 152 M 7.50 4.24 0.00 1.76 1.57 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.48 0.00 153 V 6.59 3.57 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.66 0.00 0.00 154 D 8.54 4.52 0.00 2.77 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 0.00 155 P 0.00 4.41 0.00 2.19 2.22 0.00 3.69 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.06 0.00 156 S 8.01 4.41 0.00 3.96 3.76 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 0.00 0.00 0.00 0.00 157 L 7.65 4.09 0.00 1.77 1.79 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 158 P 0.00 4.19 0.00 1.49 1.68 0.00 3.77 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 1.96 2.08 0.00 159 G 8.80 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 0.00 160 D 7.87 4.38 0.00 2.55 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 0.00 161 Y 7.80 4.37 0.00 3.11 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 0.00 162 L 8.45 4.02 0.00 1.77 1.88 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 163 R 8.35 3.96 0.00 2.05 1.97 0.00 3.21 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.72 0.00 164 A 8.19 4.07 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 I 7.92 3.72 2.11 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.25 1.17 0.00 0.00 166 L 8.15 4.22 0.00 1.78 1.80 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 167 D 8.36 4.11 0.00 2.79 2.88 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 0.00 168 A 8.21 4.24 1.43 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 0.00 169 H 8.26 4.33 0.00 3.28 3.52 0.00 5.83 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 S 8.34 3.80 0.00 2.97 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 0.00 171 L 7.49 4.14 0.00 1.90 1.95 1.06 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.89 3.85 0.00 2.89 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 0.00 173 L 7.51 3.53 0.00 0.27 0.24 0.65 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 174 L 7.55 4.12 0.00 2.16 1.94 1.08 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 7.54 3.94 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 176 F 8.03 4.01 0.00 2.11 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 0.00 177 S 8.69 4.32 0.00 3.94 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 0.00 178 R 7.70 3.98 0.00 2.02 1.94 0.00 3.29 0.00 0.00 3.09 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 179 V 7.12 3.56 1.91 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 0.63 0.00 0.00 0.87 0.00 0.00 180 I 7.38 4.05 1.84 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.75 0.36 0.00 0.00 181 N 8.21 4.84 0.00 2.72 2.72 0.00 0.00 7.13 8.42 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 0.00 182 P 0.00 4.58 0.00 2.19 2.09 0.00 3.93 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 183 N 8.23 4.42 0.00 2.95 2.87 0.00 0.00 6.89 7.53 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 0.00 184 L 8.29 4.31 0.00 1.76 1.71 0.94 0.74 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 0.00 185 R 7.79 3.88 0.00 1.94 1.99 0.00 3.13 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 186 G 7.60 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 0.00 187 R 7.25 4.56 0.00 1.81 2.06 0.00 3.33 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 188 T 8.24 4.10 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 189 K 8.52 3.85 0.00 1.95 1.78 0.00 0.90 0.00 0.00 1.68 0.00 0.00 2.74 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.44 1.55 7.81 190 E 8.09 4.03 0.00 1.98 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 2.35 2.31 0.00 191 E 7.78 3.92 0.00 2.09 1.98 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 2.31 2.28 0.00 192 V 7.82 3.65 2.25 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 1.14 0.00 0.00 0.97 0.00 0.00 193 A 8.22 2.58 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 0.00 194 A 7.43 3.85 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 0.00 195 T 7.41 4.11 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 0.00 196 F 6.99 4.62 0.00 2.65 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 0.00 197 T 7.65 4.07 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 1.24 0.00 0.00 198 Q 8.04 4.07 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 199 P 0.00 4.37 0.00 2.54 2.52 0.00 3.85 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 2.53 2.30 0.00 200 M 8.14 4.11 0.00 2.45 2.43 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 2.81 2.74 0.00 201 N 8.71 4.38 0.00 3.01 2.91 0.00 0.00 6.99 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 A 8.19 4.01 1.43 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 0.00 203 A 8.09 4.09 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 7.79 3.68 2.26 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 0.87 0.00 0.00 1.03 0.00 0.00 205 N 7.75 4.88 0.00 2.86 2.84 0.00 0.00 7.11 7.61 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 0.00 206 S 7.18 4.46 0.00 3.95 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 0.00 207 N 8.58 4.66 0.00 2.85 2.97 0.00 0.00 5.91 7.43 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 0.00 208 F 7.87 4.57 0.00 2.91 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 0.00 209 I 7.93 3.03 1.64 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.36 0.89 0.00 0.00 210 S 8.25 4.24 0.00 3.98 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 H 8.75 4.11 0.00 3.16 3.48 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 E 8.06 3.88 0.00 2.01 1.89 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 2.32 2.36 0.00 213 K 8.37 3.88 0.00 1.85 1.78 0.00 1.66 0.00 0.00 1.46 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.55 7.81 214 R 8.26 4.00 0.00 2.00 2.13 0.00 3.11 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.92 0.00 215 R 8.17 3.85 0.00 2.16 1.90 0.00 3.09 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 216 E 8.09 3.81 0.00 1.97 1.69 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 2.20 2.37 0.00 217 F 7.69 3.69 0.00 2.99 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 0.00 218 L 8.04 4.02 0.00 1.82 1.77 0.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 219 K 8.33 4.25 0.00 1.86 1.85 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.44 7.81 220 A 8.12 4.00 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 0.00 221 F 8.28 4.64 0.00 3.05 2.61 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 0.00 222 G 7.98 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 0.00 223 L 8.12 4.29 0.00 1.93 1.76 1.15 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 224 V 7.31 4.81 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.92 0.00 0.00 225 D 8.32 4.86 0.00 2.87 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 0.00 226 S 8.62 4.10 0.00 3.99 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 0.00 227 N 8.66 4.73 0.00 2.85 2.93 0.00 0.00 7.18 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 0.00 228 G 8.22 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 0.00 229 K 7.61 2.48 0.00 1.45 1.78 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.22 1.02 7.81 230 P 0.00 4.79 0.00 2.01 1.92 0.00 3.29 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 231 S 8.52 4.30 0.00 3.96 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 0.00 232 A 8.59 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 A 7.88 3.92 1.31 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 0.00 0.00 234 V 7.57 3.43 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.87 0.00 0.00 235 M 8.16 4.05 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.84 0.00 236 A 8.26 4.01 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 0.00 237 A 8.21 4.10 1.53 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 0.00 238 A 8.29 4.05 1.53 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 0.00 239 Q 8.20 3.95 0.00 2.26 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 240 A 8.52 4.05 1.45 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 0.00 241 Y 8.29 4.12 0.00 3.08 3.32 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 0.00 242 K 8.13 3.99 0.00 2.01 1.88 0.00 1.96 0.00 0.00 1.81 0.00 0.00 3.15 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.56 1.76 7.81 243 T 7.30 4.30 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 244 A 6.99 4.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 A 8.42 4.13 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 * Residues marked with a * may have inaccurate shift predictions.