NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 S 4.4437 8.3344 115.4145 57.7183 64.5062 173.2782 -1 N 4.1794 8.8446 118.9310 56.3259 38.5580 173.9614 0 A 4.3217 7.3143 119.8737 52.3593 19.8862 176.4825 0 K 4.3217 7.3643 116.4737 56.0593 33.8862 175.2825 3 L 4.5467 8.3257 122.6949 54.7844 42.4662 176.1517 4 T 4.8590 7.4017 108.3932 58.7303 71.3454 172.2560 5 P 4.4587 0.0000 0.0000 62.7253 32.1742 176.6669 6 N 4.6318 8.0802 119.8075 52.1972 37.4633 173.1751 7 F 4.6417 8.1115 121.1558 56.5395 40.2650 174.8434 8 Y 3.8278 9.4186 127.3419 58.7141 38.8873 175.9646 9 R 3.5542 8.6174 126.5096 57.7275 27.8568 175.5489 10 D 4.4620 8.3220 111.2855 55.1214 39.0529 174.5112 11 R 4.5784 8.2288 117.2664 57.3507 34.9500 174.8721 12 V 5.1152 7.9704 117.5936 61.2649 35.3731 173.4359 13 C 5.0967 9.0784 127.1270 57.4120 34.6560 173.4044 14 L 4.5281 8.7175 125.9939 54.8447 43.1763 175.7424 15 N 5.6979 8.8998 119.0052 51.1789 41.9239 173.5917 16 V 5.2003 8.2790 118.1745 59.6922 36.6346 174.5467 17 L 4.8284 8.5882 121.6848 53.9540 42.9342 175.9890 18 A 4.8628 8.4858 124.4874 50.6511 20.3551 177.5462 19 G 3.9413 9.5863 109.7233 45.1582 0.0000 173.9219 20 S 4.7655 7.2589 114.9119 57.1803 66.3373 176.9683 21 K 3.4207 7.9445 121.4561 59.3802 31.6995 179.2169 22 D 4.3409 7.9875 118.7217 57.5085 40.7220 178.3312 23 N 4.3216 8.5748 117.5234 56.4940 38.9096 176.6061 24 A 4.0905 8.4128 122.5676 55.4449 18.5093 179.8349 25 R 3.9360 8.0979 116.3767 59.5370 30.0606 179.2263 26 E 4.0325 8.3393 118.3756 59.3199 29.4323 179.5019 27 I 3.7060 8.2229 120.3577 64.5656 37.2141 177.8346 28 Y 4.1611 8.2852 120.4464 60.7939 38.6247 177.8744 29 D 4.2258 8.4130 119.6283 57.3264 40.7374 178.5866 30 A 3.9899 8.0019 120.0719 54.6720 18.5966 178.5532 31 A 4.2492 8.0600 117.0996 51.1321 18.7431 177.2540 32 E 3.6349 8.8468 116.1575 57.4864 27.6542 176.2372 33 G 3.1469 7.6518 106.3756 45.7578 0.0000 174.5284 34 H 5.2262 7.9644 119.0992 53.7237 27.9625 174.4420 35 V 4.9971 7.0727 117.0778 60.4590 35.3704 175.3270 36 L 4.8518 8.9763 122.0594 53.0508 44.6020 175.5937 37 V 4.5627 8.9932 125.1989 61.4671 33.2459 174.9261 38 G 4.1647 9.2018 116.4459 45.5581 0.0000 172.4933 39 V 4.6617 8.3577 123.7497 60.7909 35.0697 173.9925 40 L 4.9066 8.3049 127.4140 53.1761 43.0922 177.7694 41 S 4.2446 9.2238 119.5144 61.3897 62.9735 176.2119 42 K 4.2535 7.4337 119.8879 57.9818 31.9650 176.6678 43 N 4.5523 7.9317 114.8315 54.0108 38.4821 174.2591 44 Y 4.7916 7.5666 115.6517 55.4659 41.5530 173.9614 45 P 4.4934 0.0000 0.0000 64.7218 32.4471 175.8146 46 D 4.5913 7.5831 117.7068 51.2020 42.9923 176.2549 47 V 3.5115 8.2623 118.6498 66.0819 31.4739 177.5384 48 A 3.9724 8.0045 120.1766 55.3263 18.2228 179.6493 49 S 4.0570 8.6109 112.5587 61.4282 62.9410 176.4281 50 A 2.5800 7.4145 123.0379 54.2857 18.0983 179.4299 51 V 3.5418 7.7009 115.9607 66.0300 31.9058 177.9685 52 V 3.7579 7.5330 117.8662 66.0410 31.2742 178.0064 53 D 4.7722 7.7283 115.8472 54.8988 41.1547 177.5908 *55 R 4.2127 7.9891 120.0677 55.9561 31.9530 177.1961 56 D 4.3256 8.0317 116.4503 57.4142 40.6626 177.7753 57 Y 4.1169 8.3177 117.1647 61.2557 37.9249 178.7793 58 A 3.9764 8.1033 120.8476 55.1671 18.2874 179.3665 59 K 3.9148 7.8516 117.0094 59.5921 32.2649 178.7267 60 L 4.1954 7.6778 118.1888 56.2249 41.7838 177.3147 61 I 3.7291 6.8452 112.1815 60.2379 37.9443 175.0554 62 D 4.3730 8.9751 116.7818 56.5425 38.2624 174.0738 63 N 4.2598 8.5671 114.3469 54.1219 38.7453 174.4727 64 A 4.9003 7.5798 119.6483 51.1572 17.6004 177.2540 65 L 5.0350 7.4480 124.4149 53.4556 45.3504 175.7204 66 S 5.0859 8.8171 120.7045 56.3871 65.1055 172.9426 67 V 4.0398 8.8204 128.8799 62.6793 32.4067 175.0855 68 G 4.3146 8.8476 115.4210 44.7542 0.0000 174.5067 69 L 3.8874 8.5590 122.5123 57.6100 40.8901 178.7746 70 G 4.1145 7.3113 102.1815 45.2024 0.0000 171.8813 71 A 4.5541 9.2592 122.3548 49.0463 16.0771 179.3673 72 G 3.7281 8.8863 109.0246 48.2739 0.0000 172.7583 73 D 4.4168 7.4538 118.4420 53.8070 41.8052 175.1246 74 P 4.4947 0.0000 0.0000 64.6766 32.1335 177.3474 75 N 4.5548 8.3583 114.7952 55.0744 38.5226 175.3449 76 Q 4.3206 7.5641 115.8709 56.1612 29.0621 176.8141 77 S 4.1797 8.3539 114.3139 61.4898 62.6534 177.6919 78 A 3.9563 7.8823 120.7553 52.5506 17.7419 179.2346 *80 V 4.0110 7.9702 120.6492 64.6885 33.6457 177.7340 81 S 4.2125 8.0191 117.0243 61.1832 62.1801 176.6796 82 E 3.9980 8.2829 121.1670 59.2604 29.1070 179.3790 83 I 3.5636 7.6654 119.3870 64.6622 37.1897 178.5500 84 S 4.0706 8.2344 115.8922 61.2838 62.3283 176.4752 85 R 3.9620 7.5995 120.5922 59.7384 29.8113 177.9786 86 Q 4.2177 7.3375 115.5517 58.2179 29.1468 178.1116 87 V 3.6221 7.9851 118.9211 63.6494 32.8008 175.9510 88 Q 3.3106 8.0699 116.3759 56.2769 26.3111 170.5984 89 P 4.8018 0.0000 0.0000 61.9963 33.5341 176.9489 90 Q 4.5904 8.1811 115.2317 58.3500 29.6995 176.1880 91 H 5.3325 8.1454 117.9311 54.6912 34.1097 172.4705 92 V 4.6526 8.6183 124.3177 61.1896 34.7805 173.7611 93 N 5.3771 8.8905 125.6352 52.7046 39.6093 174.6461 94 Q 4.6942 9.2736 121.3921 54.1352 33.8314 175.5038 95 V 4.2461 8.2203 114.5495 60.3718 32.4913 177.3849 96 F 4.1060 8.9455 123.6481 61.8038 39.3556 176.7110 97 T 4.2171 8.2173 108.0863 62.2574 69.2360 175.3860 98 G 4.1491 8.0445 110.0062 43.7064 0.0000 175.4317 99 V 3.5461 7.1877 120.6468 66.2020 31.4987 177.7381 100 A 3.9369 7.8177 119.7786 55.3449 18.2329 179.5178 101 T 3.7935 7.8048 113.7360 66.9195 68.3684 176.8471 102 S 4.0998 8.1471 116.9893 61.5178 62.9759 176.6777 103 R 3.9341 8.2554 121.3750 59.4342 29.6025 178.4011 104 A 3.9986 8.0724 119.5998 55.2785 18.4723 179.3750 105 L 4.1114 7.9209 116.3549 57.5616 41.7373 179.3179 106 L 4.1480 8.0383 119.1246 56.1499 41.6580 178.6600 107 G 3.9796 8.9948 104.4915 45.4070 0.0000 172.5228 108 Q 4.5724 7.4885 115.3570 55.2183 31.3962 174.0304 109 N 4.8310 8.5699 114.0822 53.3555 39.3084 176.1510 110 E 4.2639 8.6444 119.3143 59.3285 30.0141 177.5513 111 T 4.2758 8.1843 113.5094 64.3674 69.2391 173.8398 112 V 4.0606 8.8634 126.3409 62.4990 33.0685 174.7233 113 V 4.7961 8.6979 128.5160 61.1278 33.5141 174.7600 114 N 5.2947 8.3064 126.0642 51.4707 39.3696 174.8072 115 G 4.2227 8.6917 105.7080 44.3098 0.0000 171.6080 116 L 4.9620 8.8046 128.8337 55.1419 42.8706 176.4644 117 V 4.9195 9.0722 118.6557 59.9131 36.3629 174.6514 118 S 5.0551 8.7621 117.1517 54.6608 67.2363 172.1346 119 P 5.0949 0.0000 0.0000 62.7551 31.4544 176.4977 120 T 4.4558 9.5079 109.6948 60.6264 69.9931 175.2493 121 G 3.9273 9.0905 110.7026 45.4515 0.0000 173.5297 122 T 4.4485 7.5784 115.3227 60.6255 70.0506 171.9188 123 P 4.1973 0.0000 0.0000 64.4803 31.9697 177.0558 124 G 3.9373 8.7592 110.8916 45.6737 0.0000 173.0391 *126 V 4.3905 7.6337 111.0301 60.6506 33.8115 174.5340 127 K 4.7781 8.9290 125.6961 55.9510 32.8620 176.9285 128 I 4.0199 8.6246 121.0903 60.2778 38.8130 176.8123 129 S 4.4228 7.5088 120.7387 57.5041 61.5388 174.3324 130 T 4.4699 7.7016 109.2460 61.9305 69.7803 175.3773 131 G 4.3161 7.9536 112.2309 43.4106 0.0000 172.8066 132 P 4.2459 0.0000 0.0000 65.7628 31.5703 178.1174 133 L 4.3026 7.8875 117.2075 57.0529 42.4376 179.5270 134 S 4.2378 8.0749 113.2105 60.9436 63.1959 176.3957 135 S 4.7072 7.7873 114.9868 60.0085 62.7105 175.1330 136 G 3.7880 7.8519 107.9103 45.4351 0.0000 173.5502 137 A 4.3441 7.5332 122.9650 50.2937 19.8733 176.8957 138 A 4.0645 8.3670 121.9084 52.5047 18.7420 177.6306 139 D 4.3237 8.6734 121.1970 54.5723 41.5811 176.2294 140 G 4.0271 8.9292 111.6550 44.8255 0.0000 172.4402 141 I 5.1561 8.2967 126.6385 59.4551 39.8041 175.5398 142 V 4.6089 8.5299 119.0992 58.5781 35.8921 173.9339 143 P 4.5693 0.0000 0.0000 62.4714 32.1407 177.6444 144 L 3.9393 8.6333 121.9823 58.2148 41.5468 179.5698 145 E 3.6575 8.1953 118.4009 59.7625 29.3801 179.0217 146 T 3.8199 7.7666 114.7674 66.4228 68.5499 176.4003 147 A 4.0877 8.1995 122.9297 55.2878 18.3240 179.7464 148 I 3.1407 7.8868 118.0786 64.3105 37.0625 178.5570 149 A 3.8041 7.8838 121.5154 54.9334 17.9479 179.5822 150 L 3.9064 8.0085 116.8221 58.0634 42.0046 179.4774 151 L 4.0241 8.0546 118.9314 57.6592 41.3218 179.7311 152 K 3.9811 7.7794 117.6749 59.3153 32.1326 180.7374 153 D 4.6109 8.0012 118.9940 53.8675 40.8455 177.5265 *155 G 3.8300 7.9964 105.9569 44.9269 0.0000 174.0624 156 G 3.9903 8.2946 108.9167 45.3372 0.0000 173.9869 157 S 4.4514 8.8910 116.0708 59.1557 65.3113 174.3178 158 S 3.9745 7.4258 111.7311 56.9272 66.3997 173.4562 159 I 4.6698 8.5378 122.2142 60.5229 38.8202 174.9444 160 K 4.8195 9.0632 129.2694 55.5557 33.5207 174.7228 161 Y 5.3499 8.8726 130.7722 56.5693 39.5850 174.0062 162 F 5.0677 8.7802 128.3199 56.5458 43.5480 172.3707 163 P 3.4786 0.0000 0.0000 60.5579 34.0954 175.6633 *165 G 3.7415 8.3782 105.9165 45.7937 0.0000 175.7169 166 G 3.8590 8.1185 116.7537 46.4912 0.0000 175.3531 167 L 4.5628 8.7542 127.0619 54.6063 42.0141 178.5603 168 K 4.2634 8.0491 122.6912 57.2211 31.9002 181.5809 169 H 5.0360 7.4979 115.0534 55.0562 29.5583 176.7327 170 R 4.0153 8.4142 120.6833 59.8693 30.0545 176.7302 171 A 4.2020 8.0491 119.7462 55.2084 18.4162 179.1688 172 E 3.9681 8.2915 116.6040 59.7038 29.5656 179.2919 173 F 4.1687 8.7086 120.8085 61.2391 39.3942 176.8891 174 E 3.6803 8.6989 118.5350 59.3902 29.2467 179.3026 175 A 3.8939 7.9966 120.7236 54.8363 18.3180 179.7614 176 V 3.3213 7.6637 116.6170 66.0613 31.5437 178.1214 177 A 3.7568 7.6425 120.6517 54.9508 18.1184 179.4088 178 K 3.7749 8.0853 118.0379 59.6164 32.2307 178.9000 179 A 3.9943 8.0871 121.0051 55.3281 18.2421 179.4021 180 C 4.2310 8.4094 115.3416 62.9246 27.8343 176.2593 181 A 4.0004 8.1969 122.1739 55.1637 17.7674 179.6189 182 A 4.0463 8.0877 118.3091 54.4651 18.3681 178.0531 183 H 4.7201 7.8605 112.6487 55.2052 29.5120 173.8407 184 D 4.4231 7.7339 114.9312 55.6607 39.6145 172.5406 185 F 5.0312 8.5600 118.9477 56.3432 43.4658 174.2840 186 W 5.1797 7.0929 121.5368 55.5504 31.6605 175.0831 187 L 5.2351 8.6931 121.9005 53.8594 45.4612 175.0297 188 E 5.8081 9.3820 125.3132 52.4915 30.6771 172.0977 189 P 4.8862 0.0000 0.0000 62.8907 32.9892 175.2269 190 T 4.6473 9.1796 120.0882 62.6581 73.4863 173.0547 191 G 3.9340 9.9418 115.1233 46.4855 0.0000 174.3924 192 G 4.0749 8.9690 113.2650 45.5153 0.0000 172.7249 193 I 4.1665 7.4769 120.3602 60.8594 38.0297 174.8361 194 D 4.9819 9.4107 122.7099 50.3560 42.4866 175.9428 195 L 4.1139 8.4111 117.9500 57.6153 41.4740 178.9499 196 E 4.2368 8.3677 117.9494 57.9920 29.9819 177.3870 197 N 4.8531 8.2944 114.8698 52.7312 38.0998 176.0004 198 Y 4.0712 7.8707 122.7321 61.2508 38.8387 178.1286 199 S 3.9859 8.1457 115.4380 61.5049 63.0312 176.1972 200 E 3.9067 8.0672 121.4857 59.2253 29.0869 178.7476 201 I 3.7308 7.7929 119.8546 64.3180 37.1040 178.1221 202 L 3.9050 7.8309 121.5148 58.0954 41.8663 178.9869 203 K 3.9162 8.2759 119.6634 59.2315 32.1337 178.6941 204 I 3.6604 7.8065 120.1550 64.4758 37.1996 178.1981 205 A 3.9016 7.7495 120.1001 54.9444 18.2270 179.6959 206 L 3.9320 8.2101 117.8261 58.1661 41.5191 179.5076 207 D 4.3592 8.4001 117.6514 57.3041 40.8050 178.5310 208 A 4.1355 7.6899 120.2160 53.2910 18.2807 178.3711 209 G 3.8256 7.7304 104.9653 45.5369 0.0000 173.7029 210 V 3.7516 7.3025 119.2993 62.5139 31.8900 176.5331 211 S 4.3083 8.7810 121.8060 60.3761 63.9146 174.5486 212 K 4.3485 7.5732 119.3157 54.2521 36.0660 175.5097 213 I 5.0753 8.8071 124.6605 59.7961 41.2986 174.5931 214 I 5.7719 9.2002 127.6524 57.5471 38.8278 172.2971 215 P 4.9621 0.0000 0.0000 62.8937 32.9672 174.8884 216 H 5.3369 8.9435 120.3159 54.2386 30.5339 174.3095 217 I 4.0882 8.5145 123.6886 61.7032 39.6568 174.0924 218 Y 4.5750 8.7934 126.4951 58.1291 38.5809 178.2734 219 S 4.2444 9.5232 123.1107 62.0327 63.9926 177.6839 220 S 4.2577 8.2296 114.9860 59.9525 63.1496 175.1007 221 I 4.6997 7.9188 112.9811 59.5349 37.7122 174.3687 222 I 4.6428 7.3860 122.2618 59.6465 38.3678 174.8867 223 D 4.4489 8.9607 126.2415 53.8282 41.1661 176.8961 224 K 3.9751 8.8134 126.9950 59.5176 32.4606 178.4252 225 A 4.1393 8.1363 120.7857 54.8181 18.4551 178.3454 226 S 4.3284 8.5737 109.1018 58.3167 63.8811 175.6753 227 G 3.9113 8.5700 108.1782 45.3907 0.0000 172.8221 228 N 4.9124 7.8781 117.7216 51.8764 39.8442 174.8881 229 T 4.2448 8.4476 119.0547 63.3944 69.4785 174.5332 230 R 4.0953 8.9595 126.1882 55.4042 30.3470 175.9597 231 P 4.2725 0.0000 0.0000 65.4885 31.2958 178.5142 232 A 3.9637 7.9624 119.2666 55.1799 18.0196 179.2680 233 D 4.2716 7.9873 117.0932 57.3881 40.8931 178.8650 234 V 3.5187 7.6514 118.3725 66.0020 31.5129 178.2937 235 R 3.8630 8.2133 118.0116 59.3349 29.6681 179.0386 236 Q 3.9688 7.8134 116.7532 58.9876 28.7760 178.5902 237 L 3.7427 7.7130 119.0264 57.3202 41.7389 178.9882 238 L 3.9996 8.0859 120.7377 57.8524 42.0793 180.1686 239 E 4.1852 7.9970 119.0249 56.4490 29.5934 178.6935 *241 T 4.3884 7.9278 115.2832 63.1879 70.9485 176.6541 242 K 3.8727 8.0201 120.8530 59.5091 31.7111 179.3721 243 Q 4.1837 8.2010 117.1984 57.8663 28.6632 177.5431 244 L 4.8327 7.7808 117.7995 53.3002 43.1286 176.1991 245 V 4.2452 7.2355 119.7968 61.1891 32.4487 176.0118 246 K 4.2529 8.6190 127.8186 54.8480 31.5972 173.7483 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 -2 S 8.33 4.44 0.00 4.00 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 -1 N 8.84 4.18 0.00 2.77 2.90 0.00 0.00 6.91 7.08 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 A 7.31 4.32 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 0 K 7.36 4.32 0.00 1.82 1.61 0.00 0.61 0.00 0.00 1.63 0.00 0.00 2.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.37 7.81 3 L 8.33 4.55 0.00 1.78 1.70 1.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.40 4.86 4.38 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 1.39 0.00 0.00 5 P 0.00 4.46 0.00 0.80 1.55 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.99 0.00 6 N 8.08 4.63 0.00 2.72 2.88 0.00 0.00 6.96 7.71 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 7 F 8.11 4.64 0.00 3.01 2.96 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 8 Y 9.42 3.83 0.00 2.75 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 9 R 8.62 3.55 0.00 1.57 1.69 0.00 3.39 0.00 0.00 3.08 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.50 0.00 10 D 8.32 4.46 0.00 2.69 2.59 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 11 R 8.23 4.58 0.00 2.00 1.94 0.00 3.10 0.00 0.00 3.04 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 12 V 7.97 5.12 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 0.92 0.00 0.00 1.01 0.00 0.00 13 C 9.08 5.10 0.00 2.44 2.40 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 14 L 8.72 4.53 0.00 1.64 1.54 0.82 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 15 N 8.90 5.70 0.00 2.52 2.38 0.00 0.00 6.86 7.01 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 16 V 8.28 5.20 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 0.70 0.00 0.00 0.95 0.00 0.00 17 L 8.59 4.83 0.00 1.43 1.44 0.43 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.49 4.86 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 19 G 9.59 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 S 7.26 4.77 0.00 4.00 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 21 K 7.94 3.42 0.00 1.54 1.56 0.00 1.35 0.00 0.00 1.43 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.30 0.62 7.81 22 D 7.99 4.34 0.00 2.66 2.71 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 23 N 8.57 4.32 0.00 2.80 3.11 0.00 0.00 7.13 8.51 0.00 0.00 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 8.41 4.09 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.10 3.94 0.00 2.03 2.02 0.00 3.12 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 26 E 8.34 4.03 0.00 2.16 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 0.00 2.34 2.59 0.00 27 I 8.22 3.71 2.10 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.96 0.96 0.00 0.00 28 Y 8.29 4.16 0.00 3.13 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.41 4.23 0.00 2.89 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 30 A 8.00 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.06 4.25 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 32 E 8.85 3.63 0.00 2.10 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 2.19 2.17 0.00 33 G 7.65 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 0.00 0.00 0.00 34 H 7.96 5.23 0.00 3.29 3.31 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.07 5.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.95 0.00 0.00 36 L 8.98 4.85 0.00 1.43 1.51 0.70 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.99 4.56 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 1.05 0.00 0.00 1.01 0.00 0.00 38 G 9.20 4.16 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 0.00 39 V 8.36 4.66 1.83 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 0.78 0.00 0.00 0.16 0.00 0.00 40 L 8.30 4.91 0.00 1.56 1.51 0.79 0.73 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 41 S 9.22 4.24 0.00 4.01 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 7.43 4.25 0.00 1.79 1.84 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.43 1.41 7.81 43 N 7.93 4.55 0.00 2.56 2.33 0.00 0.00 6.72 7.60 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 44 Y 7.57 4.79 0.00 2.99 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 45 P 0.00 4.49 0.00 2.21 2.19 0.00 3.99 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 46 D 7.58 4.59 0.00 2.93 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.26 3.51 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 1.05 0.00 0.00 0.97 0.00 0.00 48 A 8.00 3.97 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 49 S 8.61 4.06 0.00 4.20 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 50 A 7.41 2.58 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 7.70 3.54 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.91 0.00 0.00 52 V 7.53 3.76 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.97 0.00 0.00 53 D 7.73 4.77 0.00 2.95 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *55 R 7.99 4.21 0.00 1.95 2.13 0.00 3.21 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 56 D 8.03 4.33 0.00 2.90 2.66 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 57 Y 8.32 4.12 0.00 2.92 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 58 A 8.10 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 K 7.85 3.91 0.00 1.84 1.95 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.50 7.81 60 L 7.68 4.20 0.00 1.76 1.63 0.74 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 61 I 6.85 3.73 0.83 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 1.50 0.69 0.70 0.00 0.00 62 D 8.98 4.37 0.00 2.84 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 63 N 8.57 4.26 0.00 2.92 3.03 0.00 0.00 7.16 7.76 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 64 A 7.58 4.90 1.41 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 65 L 7.45 5.04 0.00 1.75 1.49 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 74 P 0.00 4.49 0.00 2.31 2.50 0.00 3.78 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 2.07 2.01 0.00 75 N 8.36 4.55 0.00 2.75 2.93 0.00 0.00 6.93 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 76 Q 7.56 4.32 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.63 0.00 77 S 8.35 4.18 0.00 3.97 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.88 3.96 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 *80 V 7.97 4.01 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 1.03 0.00 0.00 1.01 0.00 0.00 81 S 8.02 4.21 0.00 4.07 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.28 4.00 0.00 2.01 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 2.32 2.40 0.00 83 I 7.67 3.56 1.95 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 1.55 0.62 0.82 0.00 0.00 84 S 8.23 4.07 0.00 3.98 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 85 R 7.60 3.96 0.00 1.83 2.16 0.00 3.24 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 86 Q 7.34 4.22 0.00 1.85 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 87 V 7.99 3.62 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 0.80 0.00 0.00 0.91 0.00 0.00 88 Q 8.07 3.31 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 89 P 0.00 4.80 0.00 2.35 2.06 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 90 Q 8.18 4.59 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 91 H 8.15 5.33 0.00 3.15 3.21 0.00 5.52 0.00 0.00 0.00 0.00 6.78 0.00 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0.00 0.00 100 A 7.82 3.94 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 0.00 101 T 7.80 3.79 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 102 S 8.15 4.10 0.00 3.99 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 0.00 103 R 8.26 3.93 0.00 1.90 2.04 0.00 3.37 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 104 A 8.07 4.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.92 4.11 0.00 1.72 1.73 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.04 4.15 0.00 1.76 1.74 0.96 0.99 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 0.00 107 G 8.99 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 0.00 108 Q 7.49 4.57 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.92 0.00 0.00 0.00 0.00 0.00 2.24 2.62 0.00 109 N 8.57 4.83 0.00 2.74 2.88 0.00 0.00 6.94 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 0.00 110 E 8.64 4.26 0.00 2.14 2.06 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 2.38 2.31 0.00 111 T 8.18 4.28 4.27 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 1.29 0.00 0.00 112 V 8.86 4.06 2.29 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 1.29 0.00 0.00 1.25 0.00 0.00 113 V 8.70 4.80 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 1.02 0.00 0.00 0.99 0.00 0.00 114 N 8.31 5.29 0.00 2.87 3.12 0.00 0.00 6.63 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.69 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 0.00 116 L 8.80 4.96 0.00 1.94 1.71 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 117 V 9.07 4.92 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 1.07 0.00 0.00 1.20 0.00 0.00 118 S 8.76 5.06 0.00 3.70 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 0.00 119 P 0.00 5.09 0.00 1.69 1.91 0.00 3.30 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.32 0.00 120 T 9.51 4.46 4.26 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 1.23 0.00 0.00 121 G 9.09 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 0.00 122 T 7.58 4.45 4.26 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 1.22 0.00 0.00 123 P 0.00 4.20 0.00 2.05 2.18 0.00 3.66 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 2.06 2.22 0.00 124 G 8.76 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *126 V 7.63 4.39 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 0.81 0.00 0.00 0.97 0.00 0.00 127 K 8.93 4.78 0.00 1.80 1.80 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.34 7.81 128 I 8.62 4.02 0.56 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.34 0.62 0.00 0.00 129 S 7.51 4.42 0.00 4.20 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 0.00 130 T 7.70 4.47 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 131 G 7.95 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 0.00 132 P 0.00 4.25 0.00 2.07 2.38 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.38 0.00 133 L 7.89 4.30 0.00 1.73 1.72 0.93 0.82 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 0.00 134 S 8.07 4.24 0.00 4.01 4.16 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 0.00 135 S 7.79 4.71 0.00 4.02 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 7.85 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 0.00 137 A 7.53 4.34 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 0.00 138 A 8.37 4.06 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 D 8.67 4.32 0.00 2.66 2.60 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 0.00 140 G 8.93 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 I 8.30 5.16 1.85 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 1.33 0.70 0.95 0.00 0.00 142 V 8.53 4.61 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 0.63 0.00 0.00 0.89 0.00 0.00 143 P 0.00 4.57 0.00 2.15 1.95 0.00 3.59 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 2.09 2.09 0.00 144 L 8.63 3.94 0.00 1.69 1.73 0.92 0.57 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 0.00 145 E 8.20 3.66 0.00 1.90 1.87 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 2.19 1.98 0.00 146 T 7.77 3.82 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 147 A 8.20 4.09 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 I 7.89 3.14 1.80 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.74 0.32 0.00 0.00 149 A 7.88 3.80 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 0.00 150 L 8.01 3.91 0.00 1.98 1.92 1.09 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 151 L 8.05 4.02 0.00 1.65 1.87 1.21 1.19 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 0.00 152 K 7.78 3.98 0.00 1.68 1.77 0.00 1.50 0.00 0.00 1.59 0.00 0.00 3.02 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.39 0.96 7.81 153 D 8.00 4.61 0.00 2.77 2.65 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 *155 G 8.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 G 8.29 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 0.00 157 S 8.89 4.45 0.00 3.79 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 0.00 158 S 7.43 3.97 0.00 3.98 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 0.00 159 I 8.54 4.67 2.09 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.17 1.18 0.00 0.00 160 K 9.06 4.82 0.00 1.91 1.79 0.00 1.69 0.00 0.00 1.50 0.00 0.00 2.50 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.41 1.32 7.81 161 Y 8.87 5.35 0.00 3.27 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 0.00 162 F 8.78 5.07 0.00 3.12 2.76 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 0.00 163 P 0.00 3.48 0.00 1.53 0.60 0.00 3.49 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 *165 G 8.38 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 G 8.12 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 0.00 0.00 0.00 167 L 8.75 4.56 0.00 1.70 1.68 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 168 K 8.05 4.26 0.00 1.79 1.74 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.29 7.81 169 H 7.50 5.04 0.00 3.33 3.45 0.00 5.80 0.00 0.00 0.00 0.00 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 R 8.41 4.02 0.00 2.10 1.99 0.00 3.22 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.80 0.00 171 A 8.05 4.20 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 0.00 172 E 8.29 3.97 0.00 2.41 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 0.00 2.58 2.49 0.00 173 F 8.71 4.17 0.00 3.27 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 0.00 174 E 8.70 3.68 0.00 2.13 1.93 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 2.29 2.53 0.00 175 A 8.00 3.89 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 0.00 176 V 7.66 3.32 1.70 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 0.83 0.00 0.00 0.12 0.00 0.00 177 A 7.64 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 K 8.09 3.77 0.00 1.82 1.89 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.42 7.81 179 A 8.09 3.99 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 0.00 180 C 8.41 4.23 0.00 3.14 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 0.00 181 A 8.20 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 A 8.09 4.05 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 0.00 183 H 7.86 4.72 0.00 3.21 3.22 0.00 5.82 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 0.00 184 D 7.73 4.42 0.00 2.84 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 0.00 185 F 8.56 5.03 0.00 2.83 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 W 7.09 5.18 0.00 3.34 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 8.69 5.24 0.00 1.84 1.54 1.09 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 188 E 9.38 5.81 0.00 2.02 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 0.00 2.39 2.38 0.00 189 P 0.00 4.89 0.00 2.04 1.78 0.00 3.84 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.50 0.00 190 T 9.18 4.65 4.38 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 1.01 0.00 0.00 191 G 9.94 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 0.00 192 G 8.97 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 I 7.48 4.17 1.89 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 1.42 0.53 1.13 0.00 0.00 194 D 9.41 4.98 0.00 2.80 2.76 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 0.00 195 L 8.41 4.11 0.00 1.64 1.78 0.95 0.81 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 0.00 196 E 8.37 4.24 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 197 N 8.29 4.85 0.00 2.99 3.04 0.00 0.00 6.52 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 Y 7.87 4.07 0.00 3.24 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 0.00 199 S 8.15 3.99 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 0.00 200 E 8.07 3.91 0.00 2.04 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 2.40 2.42 0.00 201 I 7.79 3.73 1.74 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.01 0.65 0.00 0.00 202 L 7.83 3.91 0.00 0.99 1.28 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 203 K 8.28 3.92 0.00 1.92 1.78 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.60 1.47 7.81 204 I 7.81 3.66 2.30 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.16 0.67 0.00 0.00 205 A 7.75 3.90 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 0.00 206 L 8.21 3.93 0.00 1.68 1.72 0.92 1.27 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 0.00 207 D 8.40 4.36 0.00 2.63 2.71 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 0.00 208 A 7.69 4.14 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 0.00 209 G 7.73 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 V 7.30 3.75 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 0.96 0.00 0.00 0.92 0.00 0.00 211 S 8.78 4.31 0.00 4.02 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 0.00 212 K 7.57 4.35 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.89 0.00 0.00 2.13 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.37 0.21 7.81 213 I 8.81 5.08 1.93 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 1.27 0.79 1.05 0.00 0.00 214 I 9.20 5.77 2.01 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.08 0.88 0.00 0.00 215 P 0.00 4.96 0.00 2.38 2.31 0.00 4.04 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 2.29 2.28 0.00 216 H 8.94 5.34 0.00 2.68 2.43 0.00 5.79 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 I 8.51 4.09 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.52 0.95 0.00 0.00 218 Y 8.79 4.57 0.00 2.98 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 0.00 219 S 9.52 4.24 0.00 4.05 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 0.00 220 S 8.23 4.26 0.00 4.04 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 0.00 221 I 7.92 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 1.47 2.09 0.91 0.00 0.00 222 I 7.39 4.64 1.90 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 1.20 0.79 0.96 0.00 0.00 223 D 8.96 4.45 0.00 2.74 2.66 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 0.00 224 K 8.81 3.98 0.00 1.79 1.86 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.45 7.81 225 A 8.14 4.14 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 0.00 226 S 8.57 4.33 0.00 3.98 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 0.00 227 G 8.57 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 0.00 228 N 7.88 4.91 0.00 2.79 2.74 0.00 0.00 7.00 7.07 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 0.00 229 T 8.45 4.24 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 1.22 0.00 0.00 230 R 8.96 4.10 0.00 1.97 1.87 0.00 3.13 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 231 P 0.00 4.27 0.00 2.15 2.10 0.00 3.60 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.16 0.00 232 A 7.96 3.96 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 0.00 233 D 7.99 4.27 0.00 2.83 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 0.00 234 V 7.65 3.52 2.20 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 1.07 0.00 0.00 0.91 0.00 0.00 235 R 8.21 3.86 0.00 1.99 1.92 0.00 3.16 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.85 0.00 236 Q 7.81 3.97 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 237 L 7.71 3.74 0.00 1.52 1.20 0.72 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 238 L 8.09 4.00 0.00 1.63 1.72 0.77 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 239 E 8.00 4.19 0.00 2.08 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 2.28 2.37 0.00 *241 T 7.93 4.39 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 1.24 0.00 0.00 242 K 8.02 3.87 0.00 1.81 1.81 0.00 1.55 0.00 0.00 1.60 0.00 0.00 2.73 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.49 1.29 7.81 243 Q 8.20 4.18 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.53 2.55 0.00 244 L 7.78 4.83 0.00 1.75 1.70 0.93 0.65 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 0.00 245 V 7.24 4.25 2.48 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 0.84 0.00 0.00 1.07 0.00 0.00 246 K 8.62 4.25 0.00 1.82 1.56 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.36 1.00 7.81 * Residues marked with a * may have inaccurate shift predictions.