NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4865 8.3049 120.3493 55.3873 33.4718 174.1010 3 E 4.5437 8.4520 118.8899 53.4152 33.3014 174.5054 4 Q 4.6627 8.0832 120.8052 54.0866 34.6645 176.0670 5 V 3.4938 8.2241 119.8733 66.5739 31.9948 177.7809 6 C 4.0933 8.1727 113.4037 61.8326 29.2224 175.5808 7 D 4.2546 7.8758 118.8455 56.5555 40.9345 178.0091 8 V 3.3872 7.5621 118.5207 65.5204 31.6422 177.2969 9 F 4.4946 8.0293 114.1379 56.1646 40.4108 175.5779 10 D 3.8448 7.5876 118.0178 55.0573 38.0984 173.4213 11 I 4.5245 7.3325 119.3667 60.5230 38.9505 176.6563 12 Y 5.5587 8.9357 124.6305 56.0919 42.0359 174.4979 13 A 5.5089 9.5895 122.7048 50.3607 22.1446 175.1517 14 I 5.3049 8.8087 121.9234 59.5637 40.9657 174.1761 15 C 5.0083 9.1692 122.9335 57.3063 33.7148 172.2101 16 A 4.9010 8.3099 119.4005 50.8259 21.6936 175.5542 17 C 5.8714 9.0510 120.0681 57.2399 32.2977 174.1429 18 C 5.5236 8.9390 118.5968 56.3361 32.8817 172.4349 19 K 4.8292 8.7518 117.4798 55.1533 33.5330 176.3115 20 V 4.8614 8.1059 122.7796 60.9317 33.1923 175.1351 21 E 4.2318 8.3827 127.0005 56.4723 30.2509 176.4431 22 S 4.7884 8.5276 118.9803 56.9514 64.7876 174.5687 23 K 4.0521 8.5360 123.2717 58.0388 32.3965 176.5033 24 N 4.5301 7.9051 117.2850 52.2033 38.4907 174.5396 25 E 4.1867 8.9402 128.2820 54.8493 28.2766 175.2705 26 G 3.9405 7.3260 113.4921 42.3858 0.0000 170.6956 27 K 4.3680 8.0924 119.2414 55.6593 32.3569 175.6546 28 K 4.1372 7.2974 116.4332 55.1324 34.6777 173.5163 29 N 4.3191 8.7729 118.6671 52.9680 38.4114 174.8613 30 E 3.6283 8.5824 123.9308 56.6218 30.0863 176.1554 31 V 4.1459 7.6542 123.8078 60.9587 33.5863 174.7498 32 F 4.9971 8.0582 123.5365 56.0297 42.2115 173.7773 33 N 4.8315 8.7762 119.0065 52.2075 40.4227 175.0566 34 N 4.3681 8.9558 115.0436 56.8788 38.5193 176.6521 35 Y 4.5932 8.0053 116.4901 59.6126 39.2060 176.9659 36 T 3.7974 8.4118 116.6344 66.2858 68.6442 173.5001 37 F 5.0788 7.9987 120.4280 56.1549 38.3674 175.4631 38 R 4.9185 8.3040 118.6776 55.4743 32.6730 174.7997 39 G 4.0936 9.0519 109.9235 47.1442 0.0000 174.0132 40 L 4.5544 8.6540 126.2261 56.1727 43.4987 176.9301 41 G 4.0250 7.4104 103.2794 45.3145 0.0000 171.2609 42 N 5.3404 9.4810 118.6037 52.6818 42.6993 174.5930 43 K 3.8330 10.7800 126.9355 57.5960 30.4381 176.0335 44 G 3.8484 8.7747 102.9037 45.9165 0.0000 173.7386 45 V 4.3564 7.5644 112.7098 59.0403 36.1467 174.2986 46 L 3.6692 7.8169 120.3128 53.8955 41.6607 176.9415 47 P 4.0648 0.0000 0.0000 64.4570 31.3628 177.0502 48 W 4.2198 6.3032 112.3717 55.4727 28.1052 175.7595 49 K 4.0946 8.4993 122.7118 55.3755 30.5258 175.8675 50 C 4.8008 7.4701 109.9709 57.0582 31.6527 174.0126 51 N 4.8759 8.2736 119.0609 51.4604 40.3369 174.4255 52 S 4.1071 8.8004 124.7234 61.6841 62.8637 176.4283 53 L 3.8844 7.9030 123.1733 57.8550 41.8977 178.3929 54 D 4.5695 8.6946 118.2936 57.5028 41.0496 177.8392 55 M 4.0569 8.3035 118.8475 58.7039 32.2954 178.1874 56 K 3.8699 8.3190 119.8245 59.4576 32.1908 178.1999 57 Y 3.7928 7.9592 120.1238 60.2822 38.6863 177.0527 58 F 3.9742 8.7118 122.0061 61.4943 39.5048 176.4178 59 C 3.6641 8.3805 117.9254 62.3751 31.1484 175.1115 60 A 3.8154 7.3586 120.7063 55.2836 17.8211 179.5622 61 V 3.2309 7.3238 116.7715 66.2056 31.3766 178.4046 62 T 3.0978 6.8799 107.6310 63.4630 68.5757 175.3628 63 T 4.3366 7.3227 110.5655 60.7335 69.8667 173.9091 64 Y 4.2758 7.1153 123.6238 57.3217 39.5474 174.6895 65 V 3.2085 6.8709 124.8924 60.7109 34.8877 174.1864 66 N 4.3896 5.7700 124.6219 51.1667 39.0938 174.3960 67 E 3.9554 8.2373 125.9096 59.0135 29.8342 179.5494 68 S 4.3435 8.1505 111.4715 60.0175 61.7324 174.6286 69 K 4.6379 8.0599 119.7622 56.1474 33.0558 177.2587 70 Y 4.6322 8.2614 122.9366 60.5114 38.5589 177.2024 71 E 3.7997 8.2927 119.2998 59.6746 29.6219 179.1676 72 K 3.9329 8.1410 117.4237 59.7034 32.0406 179.1528 73 L 3.8031 7.1392 117.2692 57.5781 41.5714 179.4412 74 K 3.7107 7.2221 119.1783 59.5788 32.2473 177.7482 75 Y 4.2177 7.6953 119.8801 60.8937 38.3868 177.9390 76 K 3.3861 7.9736 119.9515 60.2335 32.1219 178.2778 77 R 3.7821 8.3932 118.4882 58.6198 29.6785 178.4353 78 C 3.8931 8.4551 118.0562 63.1280 28.7598 176.0395 79 K 3.8953 7.7248 120.4858 59.9789 31.4423 177.7102 80 Y 4.0001 7.3149 117.8620 60.8095 38.8692 177.7714 81 L 4.1067 8.3145 117.9573 55.0034 41.5923 178.3322 82 N 4.3297 8.2927 115.6428 53.2648 37.3271 173.8760 83 K 4.5582 7.3992 117.2090 55.1710 35.1251 176.4413 84 E 4.2426 8.6723 117.8937 58.6773 29.8949 176.7814 85 T 4.4709 7.4506 109.2030 61.0386 70.0736 173.0729 86 V 4.1320 8.1720 125.2402 60.2299 31.3740 175.4960 *91 D 4.5578 8.4004 124.7469 53.9044 42.6432 176.4335 92 M 4.3145 7.6215 119.3708 53.1314 30.8945 171.7771 93 P 4.3195 0.0000 0.0000 62.3750 31.1863 176.1954 94 N 4.0268 9.3045 123.7468 54.3989 34.0429 175.1758 95 S 3.8674 8.0210 108.8303 58.0043 61.4354 169.7949 96 K 3.9132 8.3862 116.5577 56.4532 30.3100 174.9327 97 K 4.1845 7.1373 110.1857 55.0971 35.4655 174.7901 98 L 4.0886 8.1988 126.1052 55.7897 43.2387 175.5018 99 Q 4.6002 8.2659 120.8099 55.5150 33.8597 172.6249 100 N 5.5911 8.8227 116.4938 52.0424 42.2348 173.9991 101 V 4.8052 8.7771 120.2536 61.4887 34.0276 175.0080 102 V 4.8302 8.5688 121.0060 59.6849 33.8995 174.5120 103 V 4.4113 8.8902 127.6862 62.2462 32.7236 174.8301 104 M 5.3249 9.0693 124.5968 53.5663 35.4829 174.7811 105 G 4.1641 8.7917 107.3753 45.2599 0.0000 174.9336 106 R 4.0439 8.7517 118.8565 59.8894 29.9494 178.2748 107 T 3.9106 7.9814 114.7244 66.9423 68.5839 176.4270 108 S 4.0792 8.0921 116.3080 61.4752 62.6967 176.3996 109 W 4.2434 8.1888 129.7953 60.5125 30.4632 177.5568 110 E 4.1608 8.3170 118.1340 59.3834 29.0235 179.1612 111 S 4.2058 8.0977 113.3601 60.1639 63.1405 175.0321 112 I 3.8425 6.6108 122.4145 59.9761 37.5988 174.2449 113 P 4.3597 0.0000 0.0000 62.3026 31.5893 177.6309 114 K 3.9068 8.5228 120.4039 59.4138 32.3882 179.7209 115 K 3.7263 7.8120 117.4410 59.2151 31.8853 177.6685 116 F 4.8488 7.4144 114.4517 56.9251 38.8354 175.0171 117 K 4.2791 7.4423 122.4140 53.6928 33.4318 173.9793 118 P 4.5671 0.0000 0.0000 61.3156 32.9464 175.2616 119 L 3.8838 8.8535 120.3281 54.9734 41.6333 177.0233 120 S 4.2254 8.7579 118.0095 60.2841 62.9154 174.1286 121 N 4.8875 8.9620 118.3686 53.4891 35.9476 173.7839 122 R 4.7124 7.7054 115.5993 54.4406 34.0478 176.0936 123 I 4.2035 8.9466 124.5370 60.5749 37.0838 174.9197 124 N 4.9418 8.6300 124.7992 53.3667 40.2830 174.4735 125 V 4.5172 8.4592 121.8117 61.8543 35.4856 173.5520 126 I 4.8636 7.9530 127.4201 59.7041 40.3998 174.8330 127 L 4.6331 8.2390 124.0236 52.8490 43.0643 175.0829 128 S 4.5519 8.5111 117.4659 56.3826 65.5240 174.2023 129 R 4.3967 8.9173 125.1704 56.8269 30.1057 176.7680 130 T 4.5303 7.3353 106.2923 61.2768 70.6283 174.5173 131 L 4.3199 7.7045 122.3180 54.0132 42.6973 176.2345 132 K 4.4668 8.3954 121.8261 54.7226 33.2842 177.5533 133 K 4.0640 8.9978 124.2389 59.7226 32.4010 178.8373 134 E 3.8462 8.3202 117.1376 59.6605 29.3398 177.5184 135 D 4.6101 7.6376 114.6524 53.8157 41.0275 175.4376 136 F 4.9285 7.9541 115.8225 54.9360 41.5827 175.1798 137 D 4.6363 8.6715 123.3826 54.3182 41.2978 176.5726 138 E 4.0270 8.6595 118.9372 59.9535 29.6257 178.5311 139 D 3.9999 7.9943 116.6711 56.2224 39.4035 176.6346 140 V 3.6404 7.4134 121.2769 62.4628 31.8311 175.3328 141 Y 4.5904 8.1640 127.0679 57.6522 39.9777 174.4605 142 I 4.7068 7.9993 118.9249 60.4309 41.1852 174.8021 143 I 4.6079 8.3159 124.2360 59.9799 41.2231 176.1534 144 N 4.3305 8.8818 122.6474 55.7346 39.3485 174.7350 145 K 4.5517 7.5499 113.7284 53.9887 36.8784 177.1552 146 V 3.3877 8.3433 117.8078 66.6299 31.0877 177.6031 147 E 3.8824 8.1358 116.1004 59.4525 29.6210 178.5309 148 D 4.4679 7.7514 118.2089 55.9888 40.9690 178.4468 149 L 3.8014 7.9487 121.5419 58.3267 41.9390 178.7469 150 I 3.1707 7.6496 117.6751 64.4117 37.2820 178.1108 151 V 3.6415 7.4550 118.3506 65.8764 30.3717 177.7833 152 L 3.8388 7.5405 119.3976 57.7016 41.3186 178.7294 153 L 4.0583 7.6792 119.1665 57.0267 41.3158 179.4011 154 G 3.7559 7.6946 107.2500 48.1147 0.0000 174.4366 155 K 4.4585 7.4483 117.4701 55.9343 32.0727 175.9737 156 L 4.8522 7.4958 117.9051 52.9795 44.7932 176.1995 157 N 5.1270 8.6991 116.5299 51.0281 38.7373 173.7863 158 Y 4.8333 8.2502 119.9346 55.4282 41.1749 174.3001 159 Y 4.4523 9.7009 122.7475 59.5149 38.6009 175.2038 160 K 4.5153 9.1989 116.9996 54.6486 37.6783 174.1020 161 C 5.0649 8.5924 122.5765 57.8711 33.7194 172.3488 162 F 5.5067 9.7558 126.6678 55.9209 41.1855 174.9270 163 I 4.5145 9.1428 126.5901 60.2276 37.9990 176.2549 164 I 4.8366 8.9166 122.6322 60.8218 38.4217 176.2062 165 G 3.0489 8.2033 108.7468 45.4411 0.0000 173.0996 166 G 4.0150 7.8102 108.0413 43.9810 0.0000 175.0651 167 S 4.3089 8.7903 114.8049 62.0223 62.8645 177.0223 168 V 3.5566 7.6714 121.0346 65.4950 31.4249 177.8017 169 V 3.6533 7.6967 117.4783 66.3751 31.3735 177.1483 170 Y 4.3776 7.9574 116.3328 61.6862 37.6358 178.3202 171 Q 3.8086 8.3164 120.1827 59.6550 29.1575 179.2324 172 E 4.1711 8.2058 119.1128 59.0735 29.8014 178.9664 173 F 4.2514 8.2883 118.7743 60.0169 38.8964 177.8235 174 L 4.1775 8.1547 119.0482 57.8463 41.5492 179.2592 175 E 4.1353 8.0276 117.6676 59.1200 29.2978 178.3929 176 K 4.3424 8.3989 116.8583 55.4762 32.5304 176.7488 177 K 4.0028 7.7819 118.0246 57.6786 30.1477 175.3168 178 L 4.5855 8.0454 115.9927 54.7606 42.6746 177.0534 179 I 4.5780 7.7597 120.4637 60.1343 38.5349 175.0884 180 K 4.5093 9.2415 127.1747 58.2363 33.6251 176.3482 181 K 5.3867 8.4538 116.8635 54.9230 37.3333 175.6478 182 I 5.1424 8.7950 122.3279 60.1842 40.8033 174.6598 183 Y 4.5517 9.9891 127.3978 56.9244 38.2769 173.8718 184 F 4.7527 9.0647 127.5657 56.8586 41.3308 174.3814 185 T 4.6151 8.3891 124.0415 62.6141 70.3945 174.2605 186 R 4.5578 8.5867 126.7369 54.7109 31.6385 175.9615 187 I 3.8501 8.3208 127.1255 59.7765 37.7936 176.3159 188 N 5.2877 8.3316 131.6280 51.2708 36.4036 174.0473 189 S 4.6439 7.6840 114.4612 57.8022 66.7758 175.4382 190 T 5.1331 8.1639 117.9543 62.8152 69.7293 173.5852 191 Y 4.9083 8.6661 121.5173 56.2230 43.3842 173.8501 192 E 4.5055 8.9199 121.5353 56.0806 30.4546 175.4164 193 C 5.0323 8.5498 122.3866 58.1316 32.2696 173.1392 194 D 4.9525 8.7388 119.8012 52.9712 41.2566 176.3189 195 V 4.3270 6.8816 111.4847 59.3661 35.3039 174.8462 196 F 5.4618 8.5158 120.4456 55.7121 43.1869 174.2332 197 F 4.4878 9.0849 123.7456 57.5593 39.9223 173.6557 198 P 4.5307 0.0000 0.0000 61.9731 31.8564 176.0262 199 E 4.1509 8.6302 121.6317 56.0150 29.3923 176.7225 200 I 3.8081 8.4440 128.3964 60.9407 37.5378 175.4923 201 N 4.4409 8.9493 125.1454 53.4006 38.8797 175.3181 202 E 4.2879 8.8350 124.5756 58.9095 30.0107 177.7675 203 N 4.5781 8.4464 116.4290 55.0636 39.2189 176.0005 204 E 4.1667 8.2237 117.3540 57.6407 30.3960 175.5798 205 Y 5.3433 8.0276 114.0984 56.2571 41.7352 174.5562 206 Q 4.8546 8.7840 118.3826 54.9186 32.4777 173.8392 207 I 4.2255 8.3324 122.7073 61.3562 37.3415 175.7012 208 I 4.5023 8.7423 119.1377 60.9179 39.6134 175.8071 209 S 4.7126 7.6164 117.9852 57.3650 67.3395 173.4826 210 V 4.8854 8.2937 116.2897 59.7330 35.0885 175.4477 211 S 4.7719 8.4960 119.4820 56.5539 65.5947 172.9603 212 D 4.3767 8.6424 119.2157 54.3583 41.5632 174.8575 213 V 4.4127 7.5431 121.4900 61.5202 33.3782 174.0266 214 Y 4.9520 8.8200 123.1210 56.6914 43.0445 173.9848 215 T 5.0709 8.5543 116.2422 62.0124 71.1688 174.1187 216 S 4.4332 9.2669 120.5129 58.2405 66.2289 173.2853 217 N 4.1990 9.6898 124.0540 55.2265 35.7330 173.4331 218 N 4.2341 7.8693 106.0722 53.8520 37.0519 174.5289 219 T 4.6493 7.4887 108.9053 61.5169 71.6669 172.3237 220 T 5.0922 8.2426 116.3289 60.8891 71.7729 173.0335 221 L 5.0582 8.7139 121.2110 56.0494 44.2557 173.1696 222 D 4.7283 7.7696 118.1579 52.0471 43.6812 173.5210 223 F 5.2620 8.7972 117.5064 55.5534 41.8299 174.9167 224 I 5.0258 8.9331 116.8222 59.0371 41.4161 174.3258 225 I 4.8044 8.5984 123.6179 59.8139 40.2429 174.1338 226 Y 5.0482 8.9485 125.2329 56.3693 40.1681 174.6398 227 K 4.9906 9.4195 124.7546 54.0327 35.7227 174.9893 228 K 4.0938 9.0720 129.1406 56.7561 32.3641 176.7454 229 T 4.0870 8.5027 118.7703 61.2920 69.6723 175.2016 230 N 4.7096 8.2334 122.0516 52.1732 37.3556 175.2104 231 N 4.5757 7.5672 118.5095 53.3766 39.6389 174.8891 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 M 8.30 4.49 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.62 0.00 3 E 8.45 4.54 0.00 2.10 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 2.14 2.41 0.00 4 Q 8.08 4.66 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 5 V 8.22 3.49 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 1.08 0.00 0.00 1.02 0.00 0.00 6 C 8.17 4.09 0.00 3.27 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 7 D 7.88 4.25 0.00 2.62 2.75 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 8 V 7.56 3.39 1.14 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 -0.20 0.00 0.00 0.29 0.00 0.00 9 F 8.03 4.49 0.00 3.03 3.20 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 10 D 7.59 3.84 0.00 2.59 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 0.00 0.00 0.00 0.00 11 I 7.33 4.52 2.08 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 1.23 0.81 0.82 0.00 0.00 12 Y 8.94 5.56 0.00 2.93 3.18 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 13 A 9.59 5.51 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 I 8.81 5.30 2.02 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.48 1.16 0.00 0.00 15 C 9.17 5.01 0.00 2.82 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 16 A 8.31 4.90 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 17 C 9.05 5.87 0.00 2.95 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 18 C 8.94 5.52 0.00 3.64 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.75 4.83 0.00 1.88 1.69 0.00 1.47 0.00 0.00 1.25 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.81 1.07 7.81 20 V 8.11 4.86 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 0.99 0.00 0.00 1.18 0.00 0.00 21 E 8.38 4.23 0.00 2.00 1.95 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 2.56 2.35 0.00 22 S 8.53 4.79 0.00 3.85 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 23 K 8.54 4.05 0.00 1.75 1.87 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.38 7.81 24 N 7.91 4.53 0.00 2.65 2.73 0.00 0.00 6.94 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 25 E 8.94 4.19 0.00 1.96 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 2.27 2.29 0.00 26 G 7.33 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 27 K 8.09 4.37 0.00 1.71 1.78 0.00 1.81 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.40 7.81 28 K 7.30 4.14 0.00 1.67 1.60 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.18 1.32 7.81 29 N 8.77 4.32 0.00 2.74 2.78 0.00 0.00 6.75 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 30 E 8.58 3.63 0.00 1.76 1.68 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 1.47 1.90 0.00 31 V 7.65 4.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.85 0.00 0.00 32 F 8.06 5.00 0.00 3.08 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 33 N 8.78 4.83 0.00 3.02 2.98 0.00 0.00 7.19 6.32 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 34 N 8.96 4.37 0.00 2.91 3.04 0.00 0.00 6.46 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.01 4.59 0.00 2.94 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 36 T 8.41 3.80 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 0.98 0.00 0.00 37 F 8.00 5.08 0.00 3.33 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 8.30 4.92 0.00 2.03 2.11 0.00 2.61 0.00 0.00 2.25 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.65 0.00 39 G 9.05 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 40 L 8.65 4.55 0.00 1.74 1.78 1.33 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 41 G 7.41 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 42 N 9.48 5.34 0.00 2.79 2.50 0.00 0.00 7.75 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 43 K 10.78 3.83 0.00 1.67 1.81 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.34 7.81 44 G 8.77 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 0.00 0.00 0.00 45 V 7.56 4.36 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 0.72 0.00 0.00 0.93 0.00 0.00 46 L 7.82 3.67 0.00 1.16 0.13 0.82 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.06 0.00 1.96 2.26 0.00 2.20 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.73 0.00 48 W 6.30 4.22 0.00 2.94 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 0.00 0.00 0.00 0.00 49 K 8.50 4.09 0.00 2.02 2.05 0.00 1.79 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.34 7.81 50 C 7.47 4.80 0.00 3.07 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 51 N 8.27 4.88 0.00 2.50 2.64 0.00 0.00 6.60 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.80 4.11 0.00 4.12 4.15 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 53 L 7.90 3.88 0.00 1.78 1.78 0.78 0.69 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 54 D 8.69 4.57 0.00 2.79 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 55 M 8.30 4.06 0.00 2.28 2.12 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 56 K 8.32 3.87 0.00 1.83 1.98 0.00 1.65 0.00 0.00 1.52 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.39 7.81 57 Y 7.96 3.79 0.00 2.75 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 8.71 3.97 0.00 3.14 3.25 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 59 C 8.38 3.66 0.00 2.97 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 60 A 7.36 3.82 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.32 3.23 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 -0.25 0.00 0.00 62 T 6.88 3.10 3.81 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 0.05 0.00 0.00 63 T 7.32 4.34 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 64 Y 7.12 4.28 0.00 2.93 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 65 V 6.87 3.21 1.68 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 0.21 0.00 0.00 0.85 0.00 0.00 66 N 5.77 4.39 0.00 2.57 2.58 0.00 0.00 7.19 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 67 E 8.24 3.96 0.00 1.99 1.95 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 2.22 2.11 0.00 68 S 8.15 4.34 0.00 3.99 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 69 K 8.06 4.64 0.00 2.01 1.91 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.40 1.58 7.81 70 Y 8.26 4.63 0.00 3.13 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 E 8.29 3.80 0.00 1.99 1.95 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 2.43 2.36 0.00 72 K 8.14 3.93 0.00 1.76 1.91 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.52 7.81 73 L 7.14 3.80 0.00 1.66 1.53 0.78 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 74 K 7.22 3.71 0.00 1.37 1.55 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.44 7.81 75 Y 7.70 4.22 0.00 2.99 3.18 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 76 K 7.97 3.39 0.00 1.79 1.87 0.00 1.53 0.00 0.00 1.49 0.00 0.00 2.99 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.23 1.28 7.81 77 R 8.39 3.78 0.00 1.89 1.87 0.00 3.15 0.00 0.00 3.27 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.58 0.00 78 C 8.46 3.89 0.00 2.91 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 7.72 3.90 0.00 1.65 1.80 0.00 1.48 0.00 0.00 1.52 0.00 0.00 2.54 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.28 1.42 7.81 80 Y 7.31 4.00 0.00 2.95 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 81 L 8.31 4.11 0.00 1.90 1.76 1.09 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.29 4.33 0.00 2.78 2.92 0.00 0.00 6.82 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 83 K 7.40 4.56 0.00 1.81 1.82 0.00 1.63 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.42 7.81 84 E 8.67 4.24 0.00 2.00 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 2.29 2.25 0.00 85 T 7.45 4.47 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 86 V 8.17 4.13 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 0.97 0.00 0.00 1.02 0.00 0.00 *91 D 8.40 4.56 0.00 2.71 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 M 7.62 4.31 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.65 0.00 93 P 0.00 4.32 0.00 2.12 2.08 0.00 3.89 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 2.06 2.13 0.00 94 N 9.30 4.03 0.00 2.89 2.90 0.00 0.00 7.18 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 95 S 8.02 3.87 0.00 4.05 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 96 K 8.39 3.91 0.00 1.92 1.86 0.00 1.87 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.35 7.81 97 K 7.14 4.18 0.00 1.78 1.69 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.24 1.26 7.81 98 L 8.20 4.09 0.00 1.36 1.51 0.48 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.27 4.60 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.52 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 100 N 8.82 5.59 0.00 2.98 3.16 0.00 0.00 6.32 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 0.00 101 V 8.78 4.81 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 0.90 0.00 0.00 0.68 0.00 0.00 102 V 8.57 4.83 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 0.77 0.00 0.00 1.11 0.00 0.00 103 V 8.89 4.41 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 1.11 0.00 0.00 0.89 0.00 0.00 104 M 9.07 5.32 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.79 0.00 105 G 8.79 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 0.00 106 R 8.75 4.04 0.00 1.90 1.96 0.00 3.25 0.00 0.00 3.36 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.80 0.00 107 T 7.98 3.91 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 108 S 8.09 4.08 0.00 4.19 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 0.00 109 W 8.19 4.24 0.00 3.40 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 0.00 110 E 8.32 4.16 0.00 2.26 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.65 0.00 111 S 8.10 4.21 0.00 3.92 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 I 6.61 3.84 1.61 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.62 0.85 0.00 0.00 113 P 0.00 4.36 0.00 2.19 1.90 0.00 3.83 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 2.31 2.14 0.00 114 K 8.52 3.91 0.00 1.72 1.81 0.00 1.62 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.40 7.81 115 K 7.81 3.73 0.00 0.79 1.26 0.00 1.42 0.00 0.00 1.49 0.00 0.00 2.13 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.18 1.12 7.81 116 F 7.41 4.85 0.00 2.98 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 K 7.44 4.28 0.00 1.61 1.45 0.00 0.61 0.00 0.00 1.16 0.00 0.00 2.80 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.30 0.21 7.81 118 P 0.00 4.57 0.00 2.46 2.53 0.00 3.96 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 119 L 8.85 3.88 0.00 1.82 1.78 1.14 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 120 S 8.76 4.23 0.00 3.99 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 0.00 121 N 8.96 4.89 0.00 2.89 2.96 0.00 0.00 7.05 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 0.00 122 R 7.71 4.71 0.00 1.94 1.85 0.00 3.13 0.00 0.00 3.08 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.57 0.00 123 I 8.95 4.20 2.05 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 1.33 0.66 1.14 0.00 0.00 124 N 8.63 4.94 0.00 2.81 2.95 0.00 0.00 6.42 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 0.00 125 V 8.46 4.52 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 0.87 0.00 0.00 0.96 0.00 0.00 126 I 7.95 4.86 1.44 0.00 0.00 -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 0.84 0.37 0.69 0.00 0.00 127 L 8.24 4.63 0.00 1.62 1.59 0.96 1.00 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 0.00 128 S 8.51 4.55 0.00 3.79 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 R 8.92 4.40 0.00 1.83 1.93 0.00 3.18 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 130 T 7.34 4.53 4.25 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 1.21 0.00 0.00 131 L 7.70 4.32 0.00 1.73 1.85 1.10 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 132 K 8.40 4.47 0.00 1.83 1.86 0.00 1.59 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.62 7.81 133 K 9.00 4.06 0.00 1.86 1.94 0.00 1.74 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.52 7.81 134 E 8.32 3.85 0.00 1.90 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 135 D 7.64 4.61 0.00 2.40 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 0.00 0.00 0.00 0.00 136 F 7.95 4.93 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 0.00 137 D 8.67 4.64 0.00 2.94 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.66 4.03 0.00 1.86 1.95 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 2.30 2.34 0.00 139 D 7.99 4.00 0.00 2.69 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 0.00 140 V 7.41 3.64 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 0.09 0.00 0.00 1.11 0.00 0.00 141 Y 8.16 4.59 0.00 2.81 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 0.00 142 I 8.00 4.71 1.85 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.70 0.85 0.00 0.00 143 I 8.32 4.61 1.95 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 1.04 0.79 0.92 0.00 0.00 144 N 8.88 4.33 0.00 2.65 3.02 0.00 0.00 6.80 6.68 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 0.00 145 K 7.55 4.55 0.00 1.79 1.72 0.00 1.69 0.00 0.00 1.53 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.33 7.81 146 V 8.34 3.39 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 0.53 0.00 0.00 0.63 0.00 0.00 147 E 8.14 3.88 0.00 1.90 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 2.42 0.00 148 D 7.75 4.47 0.00 2.75 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 0.00 149 L 7.95 3.80 0.00 1.77 1.79 0.84 1.03 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 0.00 150 I 7.65 3.17 1.68 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.80 0.28 0.00 0.00 151 V 7.46 3.64 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 0.98 0.00 0.00 0.88 0.00 0.00 152 L 7.54 3.84 0.00 1.60 1.56 0.24 -0.13 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 0.00 153 L 7.68 4.06 0.00 1.62 1.68 0.71 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 154 G 7.69 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 0.00 0.00 0.00 155 K 7.45 4.46 0.00 1.89 1.85 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.53 7.81 156 L 7.50 4.85 0.00 1.55 1.59 0.61 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 157 N 8.70 5.13 0.00 2.91 2.70 0.00 0.00 6.71 7.34 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 0.00 158 Y 8.25 4.83 0.00 3.08 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 Y 9.70 4.45 0.00 2.73 3.35 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 0.00 160 K 9.20 4.52 0.00 1.56 1.30 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.70 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.03 0.46 7.81 161 C 8.59 5.06 0.00 3.15 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 F 9.76 5.51 0.00 2.94 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 0.00 163 I 9.14 4.51 1.96 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.55 0.74 0.00 0.00 164 I 8.92 4.84 2.17 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 1.49 0.73 1.28 0.00 0.00 165 G 8.20 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 G 7.81 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 0.00 167 S 8.79 4.31 0.00 4.16 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 V 7.67 3.56 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 1.02 0.00 0.00 0.94 0.00 0.00 169 V 7.70 3.65 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 1.21 0.00 0.00 0.98 0.00 0.00 170 Y 7.96 4.38 0.00 3.00 2.52 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 0.00 0.00 0.00 0.00 171 Q 8.32 3.81 0.00 2.33 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.67 0.00 172 E 8.21 4.17 0.00 2.16 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 0.00 2.61 2.02 0.00 173 F 8.29 4.25 0.00 3.49 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 L 8.15 4.18 0.00 1.98 1.81 0.73 0.85 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 0.00 175 E 8.03 4.14 0.00 2.16 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 0.00 2.55 2.44 0.00 176 K 8.40 4.34 0.00 1.73 1.86 0.00 1.53 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.42 1.64 7.81 177 K 7.78 4.00 0.00 1.89 1.87 0.00 1.73 0.00 0.00 2.01 0.00 0.00 3.04 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.61 1.55 7.81 178 L 8.05 4.59 0.00 2.01 1.92 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 179 I 7.76 4.58 2.17 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 1.71 0.98 1.11 0.00 0.00 180 K 9.24 4.51 0.00 1.79 1.83 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.59 1.49 7.81 181 K 8.45 5.39 0.00 2.11 1.50 0.00 1.50 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.70 7.81 182 I 8.80 5.14 1.93 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.74 0.95 0.00 0.00 183 Y 9.99 4.55 0.00 3.13 3.23 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 0.00 184 F 9.06 4.75 0.00 3.26 2.92 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 0.00 185 T 8.39 4.62 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 0.93 0.00 0.00 186 R 8.59 4.56 0.00 1.40 0.66 0.00 2.21 0.00 0.00 2.74 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.40 0.00 187 I 8.32 3.85 1.62 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 -0.36 0.54 0.00 0.00 188 N 8.33 5.29 0.00 2.80 2.89 0.00 0.00 7.07 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 0.00 189 S 7.68 4.64 0.00 3.69 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 0.00 190 T 8.16 5.13 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 1.25 0.00 0.00 191 Y 8.67 4.91 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 0.00 192 E 8.92 4.51 0.00 1.99 1.92 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 2.50 2.38 0.00 193 C 8.55 5.03 0.00 3.10 2.47 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 0.00 194 D 8.74 4.95 0.00 2.53 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 V 6.88 4.33 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 0.63 0.00 0.00 0.80 0.00 0.00 196 F 8.52 5.46 0.00 2.98 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 0.00 197 F 9.08 4.49 0.00 3.15 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 0.00 198 P 0.00 4.53 0.00 1.97 1.96 0.00 2.20 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.08 0.00 199 E 8.63 4.15 0.00 1.24 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 0.00 2.12 2.15 0.00 200 I 8.44 3.81 1.77 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.75 0.76 0.00 0.00 201 N 8.95 4.44 0.00 2.80 2.83 0.00 0.00 6.93 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 0.00 202 E 8.84 4.29 0.00 2.19 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 0.00 2.31 2.37 0.00 203 N 8.45 4.58 0.00 2.90 2.92 0.00 0.00 6.96 7.28 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 0.00 204 E 8.22 4.17 0.00 2.17 1.68 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 2.36 2.29 0.00 205 Y 8.03 5.34 0.00 2.99 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 0.00 206 Q 8.78 4.85 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.02 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 207 I 8.33 4.23 1.66 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 -0.25 0.72 0.00 0.00 208 I 8.74 4.50 1.86 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 1.35 0.62 0.97 0.00 0.00 209 S 7.62 4.71 0.00 3.72 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 V 8.29 4.89 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 0.62 0.00 0.00 0.88 0.00 0.00 211 S 8.50 4.77 0.00 4.08 4.15 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 0.00 212 D 8.64 4.38 0.00 2.52 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 0.00 0.00 0.00 213 V 7.54 4.41 1.92 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 0.76 0.00 0.00 0.81 0.00 0.00 214 Y 8.82 4.95 0.00 2.86 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 0.00 215 T 8.55 5.07 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 1.22 0.00 0.00 216 S 9.27 4.43 0.00 3.76 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 N 9.69 4.20 0.00 2.84 2.84 0.00 0.00 7.12 8.00 0.00 0.00 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 N 7.87 4.23 0.00 2.89 2.91 0.00 0.00 6.96 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 T 7.49 4.65 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 220 T 8.24 5.09 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 1.18 0.00 0.00 221 L 8.71 5.06 0.00 1.38 1.49 0.60 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 222 D 7.77 4.73 0.00 2.52 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 0.00 223 F 8.80 5.26 0.00 2.80 2.63 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 0.00 224 I 8.93 5.03 1.57 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.63 0.73 0.00 0.00 225 I 8.60 4.80 1.75 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.67 0.52 0.00 0.00 226 Y 8.95 5.05 0.00 2.89 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 0.00 227 K 9.42 4.99 0.00 1.80 1.68 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.45 7.81 228 K 9.07 4.09 0.00 2.17 1.73 0.00 1.70 0.00 0.00 1.48 0.00 0.00 2.38 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.32 1.58 7.81 229 T 8.50 4.09 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 1.28 0.00 0.00 230 N 8.23 4.71 0.00 2.73 2.82 0.00 0.00 6.73 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 N 7.57 4.58 0.00 2.62 2.63 0.00 0.00 7.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.