NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.3165 8.1876 119.6801 56.1028 31.1392 177.0001 6 Q 3.6504 7.8017 115.4610 57.8266 28.8524 176.6356 7 I 3.5310 7.9790 124.0443 64.2539 37.5662 178.7364 8 A 3.9168 7.9517 121.1083 55.6411 18.0336 179.7483 9 T 3.8019 7.4172 113.5347 66.7469 68.5317 176.7460 10 E 4.0278 7.9523 120.0134 59.5334 29.5486 179.2174 11 I 3.6729 7.7601 120.0793 64.6336 37.2149 177.9150 12 E 4.0069 8.4221 120.0218 59.5972 29.3152 178.9751 13 T 3.8785 8.4954 116.0205 66.8915 68.6114 175.6102 14 Y 4.0867 8.7900 121.7287 61.0939 38.7014 178.4886 15 I 3.8716 8.5387 120.7728 64.5801 37.3028 178.1134 16 E 3.9645 8.3892 120.1186 59.1462 29.2265 178.3264 17 E 3.8740 8.7732 119.5114 58.9415 29.7191 177.5791 18 H 4.5644 7.7614 112.9001 54.2106 29.6603 174.7991 19 Q 3.3270 7.7921 119.0099 56.7102 26.8694 174.4258 20 L 4.2334 7.8041 115.7990 54.9532 42.8405 177.1521 21 Q 4.6927 8.7399 119.8692 53.4503 31.4402 175.0852 22 Q 4.3736 8.5459 119.9369 58.4213 29.1611 177.1925 23 G 4.2068 9.8657 114.3999 45.2951 0.0000 173.4309 24 D 4.7384 7.8671 119.7602 52.9929 40.9961 175.5589 25 K 4.5409 8.5826 122.6187 55.7518 32.9968 176.4724 26 L 4.3094 8.3965 127.8185 53.5750 42.4407 175.3763 27 P 4.2968 0.0000 0.0000 62.3742 32.2464 176.9916 28 V 3.6465 8.3896 119.8823 62.1329 32.1534 177.4206 29 L 3.7293 8.2116 123.7584 58.4532 42.5865 179.3258 30 E 4.0967 8.0305 116.5062 59.4273 29.9817 178.6103 31 T 4.0311 7.9378 115.6521 66.5522 68.7254 176.9401 32 L 4.3410 7.4287 121.1411 54.6428 41.2452 178.9517 *34 A 4.2671 8.1043 123.3288 52.2305 20.4383 179.6217 35 Q 3.8317 8.4826 116.2678 58.2999 29.0266 176.7445 36 F 4.6459 7.4999 112.7073 55.8833 41.0175 173.9546 37 E 3.7213 7.8287 119.5179 56.7179 27.7100 173.0283 38 V 4.5071 7.2093 116.2287 59.7112 35.2092 174.6398 39 S 4.2419 8.3770 114.9671 58.0371 62.7015 174.3166 40 K 4.0276 8.1698 122.9789 59.2425 31.7872 178.4138 41 S 4.1364 8.0388 113.1920 61.5094 62.2707 176.8015 42 T 3.8836 7.7733 118.0814 66.7564 68.4043 176.3914 43 I 3.7094 7.5305 120.8289 64.0733 37.9036 178.0183 44 T 3.8886 8.0326 111.0260 64.5106 68.6990 176.5816 45 K 4.0684 7.8048 122.5829 59.3652 31.7317 178.7823 46 S 4.1042 8.0767 113.3567 61.0263 62.2351 176.0396 47 L 4.0506 7.8384 121.8984 57.3200 41.4987 178.8189 48 E 3.9715 8.5426 119.1018 59.3002 29.2898 179.2603 49 L 3.9029 7.7524 119.5976 58.3296 42.3022 179.0164 50 L 3.9608 7.5507 118.1874 57.6123 41.3763 179.3898 51 E 4.1371 8.2296 120.6187 58.9227 29.5003 178.2746 52 Q 3.9286 7.8086 118.1787 59.4279 29.0614 178.3279 53 K 4.2051 8.2138 119.1188 57.1591 32.2736 177.6019 54 G 3.8995 8.0957 106.4456 46.0604 0.0000 174.1258 55 A 4.5041 8.6128 124.6027 53.4200 19.4917 178.2095 56 I 5.2995 7.7347 107.3200 59.3007 41.7926 174.3728 57 F 5.3267 9.2291 117.7170 55.2922 41.3154 173.7230 58 Q 5.3180 8.9806 118.9438 54.1457 32.0300 175.5440 59 V 4.4808 8.7383 121.9847 59.5681 34.4068 175.0877 60 R 3.9330 8.8625 126.3364 57.9448 30.0967 176.4715 61 G 4.0041 9.0914 112.9152 45.8692 0.0000 173.0725 62 S 4.6475 9.7740 114.4879 59.2001 65.1070 175.0389 63 G 3.4576 6.8163 105.8823 44.9661 0.0000 170.1127 64 I 4.6626 6.8316 112.6596 58.9023 40.7978 174.6056 65 F 5.1472 8.3875 123.5709 55.1610 42.8847 174.7582 66 V 4.0951 8.7529 123.4375 61.7866 32.7125 174.8915 67 R 5.0190 8.6703 123.8627 54.6101 32.2421 175.2309 68 K 4.2730 9.2207 127.0390 55.7180 34.8623 174.8699 69 H 4.4919 8.6745 122.3605 55.7241 29.2357 175.1866 70 K 4.4295 8.4931 118.7186 56.3764 32.2845 176.8189 71 R 4.6047 7.8301 117.9741 55.0413 31.5216 175.7000 72 K 4.6322 8.5765 119.1299 55.9237 34.8350 176.6898 73 G 3.9383 8.9660 107.5285 46.0115 0.0000 172.6684 74 Y 4.7111 7.9266 116.1588 55.9926 40.1045 175.0214 75 I 4.6022 8.5284 125.7068 60.0069 38.9119 175.3765 76 S 4.7590 8.9535 122.4595 58.4281 62.9313 173.7243 77 L 4.1889 9.1198 128.2077 57.6982 42.7267 177.1857 78 L 4.5637 7.8778 119.7127 53.2553 42.7737 176.7869 79 S 4.2823 9.1043 120.7854 62.1882 62.8797 176.9929 80 N 5.1789 8.0102 114.9519 54.1259 38.6223 175.7844 81 Q 4.5841 8.2704 120.1718 55.8801 31.3578 175.0232 82 G 4.1831 7.3148 106.4606 44.4486 0.0000 172.5914 *89 D 4.1902 8.4326 115.6515 54.2498 40.9697 174.1308 90 F 4.6478 8.0046 121.2623 56.3757 39.1060 175.8345 91 N 4.7079 8.7366 126.2846 52.7466 38.3030 171.9438 92 V 5.6401 8.4284 123.0510 60.3463 33.5733 174.3222 93 T 4.8462 8.6455 116.8898 60.0126 72.4973 172.7595 94 S 5.2592 8.4105 116.6963 56.7035 66.9166 173.5191 95 K 4.4232 9.3782 125.6643 54.7080 33.7405 175.3097 96 V 3.9691 8.3288 128.4918 63.1029 31.5179 175.4836 97 I 4.1937 8.6728 129.7747 63.6364 37.8755 176.2760 98 E 4.8452 7.7669 119.3888 54.9590 34.2966 174.3480 99 L 5.3973 8.6068 123.6069 55.0492 45.2140 173.7459 100 D 4.7250 8.7822 124.4673 53.0144 43.0089 173.5228 101 V 4.6495 8.2024 118.4240 61.3971 33.0160 174.7222 102 R 4.7347 8.5904 126.3780 54.7787 33.9511 174.1711 103 K 4.5826 8.5677 123.4621 55.6411 32.8658 175.2421 104 P 4.7493 0.0000 0.0000 62.4756 32.5007 176.2937 105 T 4.1153 8.3835 111.0142 60.7670 69.8234 173.3670 106 P 4.1258 0.0000 0.0000 66.0724 31.1795 178.5617 107 E 3.7827 8.0293 117.2125 59.0955 29.6080 178.5947 108 A 3.5922 7.6706 120.1898 54.8283 18.2795 179.5070 109 A 3.8745 8.1269 119.6277 55.1611 17.9391 179.5217 110 E 3.7703 8.0504 117.8712 59.5352 29.5073 178.8777 111 N 4.1963 7.5562 115.3451 55.4348 38.5299 176.4926 112 L 4.2617 7.7453 117.9068 53.4991 42.8382 175.6064 113 N 4.1236 7.6455 115.6330 54.8585 37.4767 172.5984 114 I 4.8109 7.9101 109.5033 58.7828 42.3837 177.3350 115 G 4.5118 8.8576 117.5500 44.6240 0.0000 176.9960 *117 D 4.5628 8.7005 125.4536 52.2859 40.9471 174.2465 118 E 4.4320 7.9670 120.5996 55.3608 30.4416 176.2879 119 D 4.8312 8.8324 124.7977 54.4383 42.3738 175.3305 120 I 5.1094 8.6836 115.1342 59.2577 41.4044 173.9411 121 Y 4.9925 9.0296 121.5138 57.8244 39.5225 173.8017 122 Y 5.0977 9.2334 125.5245 55.6897 41.5432 174.5316 123 V 4.5715 8.3529 126.1827 59.4731 34.6880 174.2010 124 K 4.6240 8.3621 125.8951 54.3630 34.4938 174.8979 125 R 4.9552 8.7112 122.9911 54.8680 33.7380 173.7151 126 V 4.7128 8.7696 120.7058 61.4433 33.5577 174.8863 127 R 5.1130 8.8076 127.1444 55.1054 32.8419 174.8746 128 Y 5.0288 9.2913 119.0071 56.1851 42.0462 174.2416 129 I 4.7354 9.3273 124.7410 59.7934 40.5838 175.1461 130 N 4.2668 10.2499 127.5987 54.2168 36.7276 175.5979 131 G 4.0161 8.6679 105.4768 45.4387 0.0000 174.1774 132 Q 4.7138 8.2731 119.2982 53.8336 30.7865 175.1568 133 T 3.7003 8.2903 110.7082 62.0629 69.5470 173.4259 134 L 4.4931 9.1348 129.5055 56.7420 43.4109 175.6302 135 C 4.9793 7.5004 111.0426 57.4415 32.9851 171.2529 136 Y 5.0905 8.8304 121.6775 55.8299 40.8637 173.9659 137 E 4.7321 8.4554 126.7102 54.2303 33.5698 173.7591 138 E 4.7743 8.7491 126.0835 54.3905 32.6133 175.2258 139 S 4.8912 8.8399 118.4390 56.5859 67.4129 172.4388 140 Y 5.2138 8.7659 118.0967 56.5317 41.2541 174.1366 141 Y 5.8335 9.2459 122.1597 55.2633 41.5018 175.3141 142 T 4.2674 8.8626 120.9947 63.8205 69.0756 175.3862 143 K 4.4355 9.3943 128.4222 58.4070 32.5053 178.4695 144 S 4.4666 8.2100 111.4434 59.7344 63.2658 173.8294 145 I 4.2406 7.6192 119.2798 62.9879 38.7233 177.0221 146 V 4.1057 8.0999 127.1701 61.9407 29.9233 176.3540 147 T 4.5825 8.2715 115.9413 63.0336 69.4894 175.0511 148 Y 5.1669 7.7257 120.5994 55.7134 41.9013 173.5164 149 L 4.0870 6.6324 124.6823 52.1499 45.9387 175.2004 150 N 4.6622 7.4641 117.2815 50.2383 41.6761 174.7833 151 N 4.0679 8.5592 117.5632 56.9971 38.5959 175.9346 152 E 3.8506 7.9909 118.3619 59.3402 30.1612 178.1272 153 I 3.6167 7.6863 119.7240 64.3242 36.9547 177.9798 154 V 3.7405 7.1387 115.5307 64.0207 31.6086 177.4124 155 S 4.2235 7.6258 113.4453 62.5667 63.1420 172.9487 156 H 4.9424 7.7239 118.2806 53.7690 31.4476 173.1169 157 S 4.1591 8.6104 116.0374 59.3227 62.6796 175.6268 158 I 3.6715 8.1165 131.5817 64.3491 36.9112 178.2699 159 F 4.5674 7.7518 118.2428 60.9674 38.6823 177.0047 160 H 4.2340 8.3943 117.6425 59.3333 29.5924 176.6984 161 Y 4.0628 7.9603 121.2983 60.7933 38.6810 178.0569 162 I 3.4526 8.1058 120.8870 64.3454 37.1872 178.6909 163 R 4.0447 8.3336 120.4640 58.6620 29.7851 178.6236 164 E 3.9877 8.4323 118.1689 58.7705 29.9250 178.5043 165 G 3.3726 7.4328 103.8319 47.6436 0.0000 175.2504 166 L 4.1148 7.4628 120.2193 53.7536 41.9361 177.3800 167 G 4.3370 7.7208 106.1012 46.1098 0.0000 173.5745 168 L 4.3101 7.5807 118.6994 53.6788 43.8298 176.4161 169 K 4.6453 8.3191 121.1129 54.9053 33.9828 175.4142 170 I 4.3569 8.3855 127.0462 59.5422 37.9512 175.2066 171 G 4.3616 9.3653 114.8165 46.3233 0.0000 176.2916 172 F 5.0730 8.5623 123.2244 56.0091 39.8790 173.2354 173 S 5.0486 8.4760 112.3889 57.1012 66.1508 172.8402 174 D 4.7838 8.6578 120.2610 52.3788 43.9944 174.9189 175 L 4.9026 7.9987 122.1317 52.7436 44.7819 175.6736 176 F 4.7824 9.0805 122.5571 55.6124 41.5754 174.3071 177 L 5.1428 8.5123 123.4411 53.2441 44.1089 175.6658 178 H 5.1232 9.4654 119.7093 54.0588 33.5581 172.3069 179 V 4.8525 8.4419 120.1446 61.6999 33.8272 175.2734 180 G 4.0934 8.7434 113.2878 46.1883 0.0000 170.9118 181 Q 5.1650 8.5241 119.4683 53.9284 30.7567 176.0793 182 L 4.3832 9.1889 124.2040 55.3320 43.1529 176.8146 183 N 5.1580 9.1313 120.7860 51.7324 40.1903 175.5456 184 E 3.8964 8.8089 117.3459 59.8140 29.4741 179.3410 185 E 3.7453 8.0912 117.0789 59.1303 29.7553 178.8492 186 E 3.6322 8.4926 119.3136 59.1088 29.5100 179.0679 187 A 3.9737 8.1542 121.0263 55.0590 18.1842 179.0688 188 E 3.7416 8.3280 118.0666 59.8598 29.5054 178.5112 189 Y 4.2856 7.7099 115.8159 60.8846 38.0117 178.1790 190 L 4.4387 8.0948 117.3525 54.0703 42.3385 176.9384 191 G 3.8264 7.9645 106.6923 46.4502 0.0000 172.9490 192 L 4.8811 7.9573 118.0775 52.3364 45.8078 175.5440 193 E 4.3743 8.4248 119.5471 54.5102 30.6702 175.1114 194 A 4.0280 8.4127 128.2186 54.2107 18.7884 177.5230 195 G 3.9990 8.7326 110.4208 45.1748 0.0000 174.1068 196 L 4.2611 7.3681 119.3950 53.7047 42.8967 175.0822 197 P 5.0001 0.0000 0.0000 62.9668 32.3452 175.6962 198 K 4.8373 9.1344 119.7960 55.3756 36.6674 174.6739 199 L 4.9108 8.7935 124.3173 54.7960 43.7896 174.4147 200 Y 5.3736 9.3617 127.6937 55.9923 41.5361 174.0029 201 I 4.8632 8.5122 127.7902 59.4688 40.6814 174.2581 202 E 4.8958 9.1265 126.8784 54.8544 31.5704 175.1552 203 S 5.1779 9.2018 120.9494 56.6550 66.8012 173.1764 204 I 4.9906 8.4617 124.1498 59.6586 40.1085 174.4120 205 F 5.0119 9.1041 126.3607 56.0163 41.4087 174.6939 206 H 5.4675 8.8334 118.9563 53.7576 32.4409 173.6199 207 L 4.8198 9.0951 121.8655 54.5323 42.4838 178.5313 208 T 4.1471 8.3836 111.0491 64.4044 68.6872 175.1957 209 N 4.5154 8.0989 117.8313 53.5644 37.6223 175.7358 210 G 4.0921 8.4885 108.8533 45.4007 0.0000 173.8664 211 Q 4.1186 8.3726 122.2188 55.1979 29.4607 173.9057 212 P 4.6863 0.0000 0.0000 62.8261 32.1469 175.9362 213 F 5.1270 8.8882 113.8709 56.3026 40.4743 173.7836 214 D 4.7097 7.3987 119.4651 52.7892 44.4641 172.8318 215 Y 5.3969 8.8740 127.5300 55.9164 41.5289 174.1585 216 S 4.7876 8.7624 120.6607 56.2807 66.2463 172.4494 217 K 4.7683 9.0382 126.2422 54.6131 34.8800 175.2070 218 I 4.7859 8.4416 125.8054 59.4937 41.3923 174.4588 219 S 5.3499 9.0187 123.2366 57.1508 65.0749 173.0323 220 Y 4.9672 8.7876 122.9554 56.5112 39.9340 175.2806 221 N 4.7628 9.4568 122.4527 53.5247 39.2215 175.5531 222 Y 4.3812 9.2174 125.5345 59.4273 38.3717 176.8687 223 E 3.8381 8.0919 119.3766 57.4740 29.8288 176.9221 224 Q 4.5318 8.0449 115.4211 54.9988 30.3324 175.1274 225 S 4.3495 7.4533 111.6537 56.5995 66.3392 173.0268 226 Q 4.4181 6.8756 116.8520 55.3871 31.0840 172.7339 227 F 5.5932 9.0219 119.4247 55.7101 42.9876 174.5566 228 V 4.6440 8.8673 120.6669 59.9166 34.2263 174.9006 229 V 4.9573 8.3079 121.6246 60.1659 34.4746 174.5755 230 Q 4.6345 8.9831 121.1881 54.0373 31.4173 175.0070 231 A 4.7527 8.3259 123.2582 50.4675 21.8626 175.4277 232 N 4.8422 8.2474 117.3923 51.1646 40.9627 175.7636 233 S 4.2825 8.6249 114.0456 59.4608 62.8933 174.8766 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 5 Q 8.19 4.32 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.89 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 6 Q 7.80 3.65 0.00 2.36 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 7 I 7.98 3.53 1.73 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 1.54 0.45 0.43 0.00 0.00 8 A 7.95 3.92 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 9 T 7.42 3.80 4.40 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 1.23 0.00 0.00 10 E 7.95 4.03 0.00 2.18 2.35 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 2.45 2.54 0.00 11 I 7.76 3.67 1.83 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 -0.22 0.81 0.00 0.00 12 E 8.42 4.01 0.00 2.25 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 2.34 2.39 0.00 13 T 8.50 3.88 4.49 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 1.29 0.00 0.00 14 Y 8.79 4.09 0.00 3.31 3.26 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 15 I 8.54 3.87 2.13 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 1.54 0.76 0.98 0.00 0.00 16 E 8.39 3.96 0.00 2.11 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 0.00 2.30 2.34 0.00 17 E 8.77 3.87 0.00 2.07 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.26 0.00 18 H 7.76 4.56 0.00 3.08 3.20 0.00 6.05 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Q 7.79 3.33 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 20 L 7.80 4.23 0.00 1.72 1.89 1.09 0.95 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 21 Q 8.74 4.69 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 22 Q 8.55 4.37 0.00 2.33 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.68 0.00 0.00 0.00 0.00 0.00 2.46 2.78 0.00 23 G 9.87 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 0.00 0.00 0.00 0.00 24 D 7.87 4.74 0.00 2.92 2.87 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 25 K 8.58 4.54 0.00 1.91 1.76 0.00 1.41 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.23 1.17 7.81 26 L 8.40 4.31 0.00 1.52 1.44 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.30 0.00 1.95 1.95 0.00 3.53 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.08 0.00 28 V 8.39 3.65 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.88 0.00 0.00 29 L 8.21 3.73 0.00 1.70 1.64 0.89 0.90 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 30 E 8.03 4.10 0.00 1.96 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 2.30 2.38 0.00 31 T 7.94 4.03 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 32 L 7.43 4.34 0.00 2.03 1.79 0.85 0.82 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 *34 A 8.10 4.27 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Q 8.48 3.83 0.00 2.03 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.66 0.00 0.00 0.00 0.00 0.00 1.51 2.02 0.00 36 F 7.50 4.65 0.00 3.00 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 37 E 7.83 3.72 0.00 2.21 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 2.23 2.23 0.00 38 V 7.21 4.51 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 0.78 0.00 0.00 0.94 0.00 0.00 39 S 8.38 4.24 0.00 3.87 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 40 K 8.17 4.03 0.00 1.85 1.72 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.48 7.81 41 S 8.04 4.14 0.00 3.92 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 42 T 7.77 3.88 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 1.20 0.00 0.00 43 I 7.53 3.71 1.96 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.15 0.97 0.00 0.00 44 T 8.03 3.89 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 1.27 0.00 0.00 45 K 7.80 4.07 0.00 1.77 2.11 0.00 1.63 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.42 1.58 7.81 46 S 8.08 4.10 0.00 4.05 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.84 4.05 0.00 1.94 1.65 0.82 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.54 3.97 0.00 2.18 2.00 0.00 0.00 0.00 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 2.46 0.00 49 L 7.75 3.90 0.00 1.76 1.80 0.98 0.68 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 50 L 7.55 3.96 0.00 1.87 1.71 0.84 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.23 4.14 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 52 Q 7.81 3.93 0.00 2.11 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 53 K 8.21 4.21 0.00 2.00 2.01 0.00 1.91 0.00 0.00 1.73 0.00 0.00 3.15 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.48 7.81 54 G 8.10 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 0.00 0.00 0.00 55 A 8.61 4.50 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 56 I 7.73 5.30 1.91 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 0.96 0.89 0.00 0.00 57 F 9.23 5.33 0.00 3.07 3.13 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 58 Q 8.98 5.32 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.69 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 59 V 8.74 4.48 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.04 0.00 0.00 60 R 8.86 3.93 0.00 1.82 1.94 0.00 3.28 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 61 G 9.09 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 0.00 0.00 0.00 62 S 9.77 4.65 0.00 4.20 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 6.82 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 6.83 4.66 1.70 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.90 0.73 0.00 0.00 65 F 8.39 5.15 0.00 1.54 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 66 V 8.75 4.10 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 0.89 0.00 0.00 1.05 0.00 0.00 67 R 8.67 5.02 0.00 2.18 2.10 0.00 3.33 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.63 0.00 68 K 9.22 4.27 0.00 1.74 1.67 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.36 7.81 69 H 8.67 4.49 0.00 3.27 3.27 0.00 5.56 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 70 K 8.49 4.43 0.00 1.77 1.88 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.52 7.81 71 R 7.83 4.60 0.00 1.86 2.15 0.00 2.77 0.00 0.00 3.35 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 72 K 8.58 4.63 0.00 1.75 1.73 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.36 7.81 73 G 8.97 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 7.93 4.71 0.00 3.02 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 75 I 8.53 4.60 1.41 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.99 0.00 0.00 76 S 8.95 4.76 0.00 3.99 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 77 L 9.12 4.19 0.00 1.81 1.78 0.48 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.88 4.56 0.00 1.79 1.61 0.97 0.87 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 79 S 9.10 4.28 0.00 3.95 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 80 N 8.01 5.18 0.00 2.73 2.86 0.00 0.00 6.66 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 81 Q 8.27 4.58 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.59 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 82 G 7.31 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *89 D 8.43 4.19 0.00 2.63 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 90 F 8.00 4.65 0.00 3.14 2.91 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 91 N 8.74 4.71 0.00 2.90 2.96 0.00 0.00 6.63 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 92 V 8.43 5.64 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.03 0.00 0.00 93 T 8.65 4.85 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 1.22 0.00 0.00 94 S 8.41 5.26 0.00 3.80 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 95 K 9.38 4.42 0.00 1.83 1.88 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.38 7.81 96 V 8.33 3.97 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 0.74 0.00 0.00 0.83 0.00 0.00 97 I 8.67 4.19 1.88 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.65 1.04 0.00 0.00 98 E 7.77 4.85 0.00 1.94 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 2.39 2.41 0.00 99 L 8.61 5.40 0.00 1.49 1.45 0.85 1.04 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 0.00 100 D 8.78 4.72 0.00 2.85 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 0.00 101 V 8.20 4.65 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 0.65 0.00 0.00 0.44 0.00 0.00 102 R 8.59 4.73 0.00 2.07 1.74 0.00 3.10 0.00 0.00 2.93 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 103 K 8.57 4.58 0.00 1.68 1.73 0.00 1.82 0.00 0.00 1.83 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.38 7.81 104 P 0.00 4.75 0.00 2.13 2.10 0.00 3.78 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 1.98 1.98 0.00 105 T 8.38 4.12 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 1.23 0.00 0.00 106 P 0.00 4.13 0.00 2.13 2.13 0.00 3.57 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 107 E 8.03 3.78 0.00 1.97 1.85 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 2.20 2.31 0.00 108 A 7.67 3.59 0.92 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 0.00 109 A 8.13 3.87 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 0.00 110 E 8.05 3.77 0.00 2.07 1.78 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 2.23 2.41 0.00 111 N 7.56 4.20 0.00 1.63 2.08 0.00 0.00 7.05 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.75 4.26 0.00 1.60 1.73 1.10 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 113 N 7.65 4.12 0.00 2.87 2.88 0.00 0.00 6.90 7.82 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 0.00 114 I 7.91 4.81 2.02 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 1.23 0.86 1.02 0.00 0.00 115 G 8.86 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *117 D 8.70 4.56 0.00 2.87 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 0.00 118 E 7.97 4.43 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 119 D 8.83 4.83 0.00 2.57 2.51 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 0.00 0.00 0.00 0.00 120 I 8.68 5.11 2.16 0.00 0.00 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 1.39 1.09 1.04 0.00 0.00 121 Y 9.03 4.99 0.00 3.15 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 0.00 122 Y 9.23 5.10 0.00 3.03 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 0.00 123 V 8.35 4.57 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 0.69 0.00 0.00 0.71 0.00 0.00 124 K 8.36 4.62 0.00 1.53 1.54 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.14 1.13 7.81 125 R 8.71 4.96 0.00 1.90 1.81 0.00 2.68 0.00 0.00 3.00 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.42 0.00 126 V 8.77 4.71 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 0.55 0.00 0.00 0.88 0.00 0.00 127 R 8.81 5.11 0.00 1.71 1.81 0.00 3.23 0.00 0.00 3.13 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.49 0.00 128 Y 9.29 5.03 0.00 2.91 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 0.00 129 I 9.33 4.74 1.83 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 1.25 1.57 0.92 0.00 0.00 130 N 10.25 4.27 0.00 2.88 2.88 0.00 0.00 7.21 7.91 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 0.00 131 G 8.67 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 0.00 132 Q 8.27 4.71 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.93 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 133 T 8.29 3.70 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 1.05 0.00 0.00 134 L 9.13 4.49 0.00 1.71 1.68 0.95 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 135 C 7.50 4.98 0.00 2.52 2.51 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 0.00 0.00 0.00 0.00 136 Y 8.83 5.09 0.00 2.93 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 0.00 137 E 8.46 4.73 0.00 1.77 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.01 0.00 138 E 8.75 4.77 0.00 1.76 1.60 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 1.97 1.73 0.00 139 S 8.84 4.89 0.00 3.36 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 0.00 140 Y 8.77 5.21 0.00 2.96 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 0.00 141 Y 9.25 5.83 0.00 3.06 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 T 8.86 4.27 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 143 K 9.39 4.44 0.00 1.74 1.89 0.00 1.05 0.00 0.00 1.59 0.00 0.00 2.50 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.43 1.33 7.81 144 S 8.21 4.47 0.00 4.07 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 0.00 145 I 7.62 4.24 2.16 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.75 0.94 0.00 0.00 146 V 8.10 4.11 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.26 0.00 0.00 147 T 8.27 4.58 4.39 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 1.39 0.00 0.00 148 Y 7.73 5.17 0.00 2.99 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 0.00 149 L 6.63 4.09 0.00 0.27 0.68 0.17 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 150 N 7.46 4.66 0.00 2.82 2.58 0.00 0.00 5.63 6.96 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 0.00 151 N 8.56 4.07 0.00 2.71 2.81 0.00 0.00 6.51 7.65 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 0.00 152 E 7.99 3.85 0.00 1.97 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 2.31 2.42 0.00 153 I 7.69 3.62 1.50 0.00 0.00 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 0.74 0.79 -0.06 0.00 0.00 154 V 7.14 3.74 1.78 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 0.66 0.00 0.00 0.57 0.00 0.00 155 S 7.63 4.22 0.00 3.89 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 0.00 156 H 7.72 4.94 0.00 3.08 3.21 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 S 8.61 4.16 0.00 3.94 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 0.00 158 I 8.12 3.67 1.54 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 1.36 0.46 0.59 0.00 0.00 159 F 7.75 4.57 0.00 3.09 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 0.00 160 H 8.39 4.23 0.00 3.30 3.53 0.00 5.59 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 0.00 161 Y 7.96 4.06 0.00 3.03 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 I 8.11 3.45 2.11 0.00 0.00 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 1.54 0.98 0.62 0.00 0.00 163 R 8.33 4.04 0.00 1.99 1.90 0.00 3.13 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.46 0.00 164 E 8.43 3.99 0.00 1.80 1.79 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 2.21 2.33 0.00 165 G 7.43 3.37 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 0.00 166 L 7.46 4.11 0.00 1.54 1.57 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.72 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 0.00 168 L 7.58 4.31 0.00 1.41 1.37 0.74 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.32 4.65 0.00 1.63 1.72 0.00 1.65 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.37 7.81 170 I 8.39 4.36 1.84 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.34 0.94 0.00 0.00 171 G 9.37 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 0.00 0.00 0.00 0.00 172 F 8.56 5.07 0.00 3.12 3.19 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 0.00 173 S 8.48 5.05 0.00 3.01 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 D 8.66 4.78 0.00 2.55 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 0.00 0.00 0.00 175 L 8.00 4.90 0.00 1.21 1.34 0.62 0.72 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 0.00 176 F 9.08 4.78 0.00 2.99 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 0.00 177 L 8.51 5.14 0.00 1.40 1.50 0.78 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 178 H 9.47 5.12 0.00 3.31 3.28 0.00 5.76 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 V 8.44 4.85 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.99 0.00 0.00 180 G 8.74 4.09 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 0.00 181 Q 8.52 5.16 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.89 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 182 L 9.19 4.38 0.00 1.56 1.60 1.05 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 183 N 9.13 5.16 0.00 2.80 2.95 0.00 0.00 6.92 8.28 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 0.00 184 E 8.81 3.90 0.00 1.95 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 2.37 2.28 0.00 185 E 8.09 3.75 0.00 2.01 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 0.00 2.54 2.42 0.00 186 E 8.49 3.63 0.00 2.20 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 0.00 2.58 2.48 0.00 187 A 8.15 3.97 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 0.00 188 E 8.33 3.74 0.00 2.01 1.84 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 2.07 2.08 0.00 189 Y 7.71 4.29 0.00 2.72 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 0.00 190 L 8.09 4.44 0.00 1.67 1.73 1.01 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 191 G 7.96 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 0.00 192 L 7.96 4.88 0.00 1.64 1.66 1.11 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 193 E 8.42 4.37 0.00 2.02 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 2.32 2.30 0.00 194 A 8.41 4.03 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 0.00 195 G 8.73 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 0.00 196 L 7.37 4.26 0.00 1.69 1.40 1.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 197 P 0.00 5.00 0.00 1.81 1.89 0.00 2.79 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.65 0.00 198 K 9.13 4.84 0.00 1.91 1.99 0.00 1.47 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.53 7.81 199 L 8.79 4.91 0.00 1.95 1.80 0.98 0.29 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 0.00 200 Y 9.36 5.37 0.00 3.12 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 0.00 201 I 8.51 4.86 1.87 0.00 0.00 0.62 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 0.72 0.89 0.00 0.00 202 E 9.13 4.90 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 2.08 1.96 0.00 203 S 9.20 5.18 0.00 3.83 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 I 8.46 4.99 1.93 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.11 0.82 0.00 0.00 205 F 9.10 5.01 0.00 2.27 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 0.00 206 H 8.83 5.47 0.00 2.09 2.67 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 L 9.10 4.82 0.00 1.86 1.59 0.92 0.21 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 0.00 208 T 8.38 4.15 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 1.24 0.00 0.00 209 N 8.10 4.52 0.00 2.90 3.01 0.00 0.00 6.26 7.00 0.00 0.00 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 G 8.49 4.09 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 0.00 211 Q 8.37 4.12 0.00 2.40 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 212 P 0.00 4.69 0.00 2.18 1.80 0.00 3.71 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.04 0.00 213 F 8.89 5.13 0.00 3.23 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 0.00 214 D 7.40 4.71 0.00 2.59 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 0.00 0.00 0.00 215 Y 8.87 5.40 0.00 2.97 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 0.00 216 S 8.76 4.79 0.00 3.98 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 0.00 217 K 9.04 4.77 0.00 1.62 1.77 0.00 1.83 0.00 0.00 1.84 0.00 0.00 3.15 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.83 1.12 7.81 218 I 8.44 4.79 1.64 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 0.98 0.59 0.11 0.00 0.00 219 S 9.02 5.35 0.00 3.95 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 0.00 220 Y 8.79 4.97 0.00 3.08 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 0.00 221 N 9.46 4.76 0.00 2.76 2.89 0.00 0.00 7.07 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 0.00 222 Y 9.22 4.38 0.00 3.18 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 E 8.09 3.84 0.00 1.83 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 224 Q 8.04 4.53 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.67 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 225 S 7.45 4.35 0.00 3.24 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 6.88 4.42 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 1.87 1.79 0.00 227 F 9.02 5.59 0.00 2.95 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 0.00 228 V 8.87 4.64 1.78 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 0.93 0.00 0.00 0.73 0.00 0.00 229 V 8.31 4.96 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 0.75 0.00 0.00 0.92 0.00 0.00 230 Q 8.98 4.63 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 231 A 8.33 4.75 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 N 8.25 4.84 0.00 2.72 2.79 0.00 0.00 6.96 7.57 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 0.00 233 S 8.62 4.28 0.00 3.86 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.