NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 4.0431 8.0244 120.8130 60.5754 39.1553 175.0847 6 S 4.2938 8.3688 120.7915 56.2221 62.6518 172.6160 7 D 4.8976 9.4773 124.3910 55.1202 40.5935 174.9618 8 N 5.4457 8.1435 117.2965 52.0121 42.1172 174.1689 9 V 4.7262 8.8271 116.2104 59.7226 36.5956 174.9722 10 R 4.9474 8.9207 121.0744 54.9182 33.1378 175.5062 11 I 4.8766 8.3969 120.5387 59.5153 41.3005 174.8536 12 K 4.7914 8.8024 125.2552 54.4485 35.7168 174.9702 13 L 5.2552 8.9625 126.9882 53.4944 45.4646 174.6769 14 Y 5.1076 8.8495 121.4900 56.1244 43.0611 173.8168 *16 E 4.3377 8.5835 120.6327 56.4258 31.2472 174.7041 17 G 3.9732 7.6842 111.9293 45.7386 0.0000 171.8863 18 T 5.1810 8.5392 115.8744 61.7745 72.5994 173.6317 19 V 4.6966 8.8333 126.1900 61.4485 34.6333 175.3119 20 N 4.2868 9.7124 126.1711 54.6170 36.5920 174.5629 21 N 4.2840 8.5362 111.9150 54.1307 38.0517 172.3096 22 H 4.8128 8.4030 117.8461 54.8501 30.7076 173.2546 23 H 5.1126 8.6180 127.2267 55.9637 31.1145 174.3944 24 F 5.3390 7.6384 118.8835 57.0879 40.8882 172.5918 *26 C 4.9973 8.5768 114.9582 60.6614 29.4665 173.2343 27 E 5.0022 9.0127 118.6660 55.1897 34.0739 174.3555 28 A 5.3270 8.5434 122.5425 50.8107 23.4641 174.9782 29 E 4.9558 8.6467 118.1433 55.0265 33.8916 175.6225 30 G 4.6007 8.8435 109.6083 46.2022 0.0000 171.1824 31 E 5.2131 8.4286 116.1988 55.6591 33.4258 173.9541 32 G 3.9131 8.4005 106.0656 45.9907 0.0000 172.8045 33 K 5.1366 8.7554 120.0365 52.6804 33.4402 175.3587 34 P 4.1727 0.0000 0.0000 65.7492 31.4449 178.3411 35 Y 4.3590 7.9916 112.7460 59.3615 38.3069 176.0757 36 E 4.2614 8.3426 117.8719 56.2907 30.4637 177.2561 37 G 3.9339 8.4869 107.1227 45.6455 0.0000 172.5238 38 T 5.1339 7.2579 109.4289 60.3116 71.9774 173.8596 39 Q 4.6497 8.1725 118.8038 56.9257 32.6388 172.2390 *41 E 4.5036 8.4896 116.7572 56.9581 31.5549 175.1868 42 N 5.1649 8.9280 120.9327 51.9809 40.2729 173.4355 43 I 4.6642 9.0464 126.1988 59.7343 39.2246 174.8575 44 K 4.9573 9.0767 129.1836 54.5296 34.8106 175.3548 45 V 4.5051 8.9532 128.7120 62.4012 30.5494 175.7932 46 T 4.1639 8.6567 119.0785 63.4662 69.7297 175.1795 47 K 4.4447 7.9708 123.0058 56.3312 35.1029 176.1062 48 G 4.0517 9.3552 113.9434 45.4434 0.0000 172.9895 49 G 4.1257 7.5158 107.2318 42.6405 0.0000 172.2863 50 P 4.3320 0.0000 0.0000 61.8493 32.0394 176.8723 51 L 3.8522 8.1487 122.6103 54.2403 41.9892 175.6391 52 P 4.6422 0.0000 0.0000 62.6663 31.2004 175.3839 53 F 4.9383 6.6126 112.7536 55.4268 40.8524 173.8687 54 S 4.2041 8.7891 116.5684 58.1319 62.6140 175.0478 55 F 4.0200 8.8330 129.2721 60.5995 39.1561 176.3315 56 D 4.5260 8.0837 120.8320 57.7941 40.3246 178.6846 57 I 4.3096 7.4045 111.4205 63.1236 37.9408 177.3897 58 L 4.2203 7.7873 121.0845 56.5149 41.7747 178.5025 59 T 4.1351 7.3512 116.8381 65.6286 68.3434 174.0761 60 P 4.3253 0.0000 0.0000 64.5202 31.4667 176.8566 61 N 5.0406 8.0636 115.4096 54.4004 38.9511 175.0239 62 C 4.5176 7.6688 117.7458 60.3913 28.7013 174.3543 *66 S 4.0765 7.7165 113.5005 58.4741 62.4546 174.9405 67 V 3.4385 7.2419 112.1141 62.6973 31.8832 177.8836 68 A 4.1619 8.0136 122.3160 54.0383 18.6497 177.4061 69 I 4.3382 7.1182 116.8950 60.6985 36.9512 175.2933 70 T 4.5304 8.1467 120.4797 62.2068 73.3530 173.7670 71 K 4.3887 8.7907 127.8542 56.0354 32.8745 175.3521 72 Y 4.2829 8.6860 126.7849 57.4709 38.6872 175.3627 73 T 4.4339 8.1890 115.0751 59.7888 72.3944 174.6880 74 S 3.5195 9.4946 113.6845 59.5979 60.2642 173.6348 75 G 3.9518 8.5171 105.5061 45.8439 0.0000 174.4642 76 I 3.8288 7.6229 121.6337 59.9980 37.2414 174.3574 77 P 4.0313 0.0000 0.0000 63.2907 31.4264 175.8424 78 D 3.3700 8.1113 121.7849 52.3401 40.0828 175.5450 79 Y 3.7101 7.6941 127.4575 60.2639 38.9839 177.5958 80 F 3.6645 7.1859 117.9173 60.2307 39.1300 177.9731 81 K 4.1605 8.1383 117.9769 59.4531 31.5557 179.5114 82 Q 3.9484 7.6446 117.7033 58.7515 28.7495 178.5444 83 S 4.0182 7.4011 115.5043 59.8796 62.7928 174.5043 84 F 5.0501 6.7380 120.3530 56.3394 39.3750 174.1364 85 P 4.6546 0.0000 0.0000 64.8731 31.7767 177.2742 86 E 3.9419 8.3581 118.7097 57.9604 29.7323 177.5853 87 G 3.9086 10.1508 105.3954 45.0303 0.0000 171.1343 88 F 5.2735 7.4928 111.8136 56.5463 41.7547 172.7537 89 T 5.3785 9.1658 109.0114 60.0861 72.6110 172.5554 90 W 5.8650 8.7890 117.7254 55.3884 31.9349 173.3803 91 E 5.2462 9.2596 118.7662 55.1391 32.8677 174.3264 92 R 5.0976 8.8888 119.9527 55.9100 34.4917 173.5158 93 T 5.1654 8.6544 120.1349 62.0990 72.6507 172.8787 94 T 4.9528 9.1655 122.8853 61.8401 71.3342 173.1708 95 I 4.3805 8.5845 128.0166 59.6891 39.3892 174.7418 96 Y 4.6667 8.6711 126.0260 56.6633 39.0436 177.0347 97 E 4.0459 9.0495 120.8714 58.5967 29.8273 177.3379 98 D 4.7380 8.1887 118.3326 53.1046 39.7085 177.3154 99 G 3.8809 8.0962 107.8688 45.5654 0.0000 174.1607 100 A 4.2515 7.3250 121.5127 51.4016 20.1638 176.0587 101 Y 5.1075 8.5591 117.5094 56.0828 42.3355 174.6472 102 L 5.2558 9.1091 124.5148 54.0041 45.5720 174.9158 103 T 5.2426 9.2278 123.7195 62.2778 71.3063 173.8589 104 T 5.1352 9.3059 121.5482 61.7872 72.9578 172.5887 105 Q 4.7562 8.8281 126.1862 54.2589 32.1145 173.8920 106 Q 4.6670 8.5732 126.6569 54.0591 33.0715 172.9946 107 E 4.8579 8.8748 125.5119 54.5850 33.1170 174.4490 108 T 5.2561 8.8307 123.2352 61.6565 71.6770 172.9550 109 K 4.8622 9.1877 127.1305 54.3825 36.1734 174.5825 110 L 4.8116 8.6268 127.3579 53.5266 43.8016 175.4600 111 D 4.6972 8.9363 128.2042 53.0180 42.4020 176.9718 112 G 3.9056 8.1862 119.8555 46.9075 0.0000 172.5165 113 N 4.9628 8.7148 120.2021 52.3555 38.4517 171.8974 114 C 5.1502 7.9984 120.4072 58.4694 34.3880 172.4313 115 L 4.6460 8.8520 127.6138 54.0176 42.8841 175.8511 116 V 4.6487 8.9756 124.6706 61.3151 33.9225 173.7077 117 Y 5.5526 8.8762 125.8124 56.4197 40.9418 174.4683 118 N 5.5438 9.1404 120.8460 51.7064 41.7264 173.3757 119 I 4.8655 8.9639 125.2618 59.2577 40.1624 175.4581 120 K 4.8539 8.9617 125.3201 54.6886 35.5653 175.3205 121 I 5.1538 8.6166 124.2522 59.5746 41.8165 174.5598 122 L 4.9791 9.1354 125.0203 53.2346 45.4445 175.6787 123 G 4.8500 9.5282 111.9337 44.7770 0.0000 171.0964 124 C 5.0279 9.5192 116.4180 56.9888 33.7846 173.4095 125 N 4.1407 8.9031 113.0621 54.1475 35.7737 174.4640 126 F 4.0316 7.7151 115.0576 56.1372 39.4747 173.9170 127 P 4.4092 0.0000 0.0000 61.9302 31.6214 175.5965 128 P 4.2239 0.0000 0.0000 65.3632 31.2610 176.6776 129 N 4.7782 8.1183 113.7101 52.7310 38.7947 174.8922 130 G 4.0039 8.0728 109.7517 43.5901 0.0000 173.4555 131 P 4.1647 0.0000 0.0000 65.9280 31.2725 178.6271 132 V 3.7266 7.2849 112.5402 63.7484 30.6378 176.9560 *134 Q 4.2488 7.9484 115.3229 54.0403 30.4215 174.8775 135 K 3.8242 7.7559 115.8870 57.6499 29.7425 175.5617 136 K 4.5211 8.2736 117.0995 56.8179 33.5775 178.0315 137 T 4.5323 7.7049 110.5226 60.8077 70.1881 174.4138 138 Q 4.5140 9.2109 121.2618 55.2596 29.0355 175.7952 139 G 4.1212 8.2263 105.1209 45.3022 0.0000 172.0403 140 W 5.2344 8.1927 117.8819 55.0641 30.8498 176.4787 141 E 4.6033 8.7664 121.3142 55.2101 29.9582 174.8885 142 P 4.7938 0.0000 0.0000 63.2866 32.5986 174.4777 143 C 4.9245 9.1818 114.8691 56.8122 33.9709 172.2942 144 C 4.9443 8.4931 118.4685 57.8743 32.6688 172.5226 145 E 5.0105 8.9591 133.5685 55.0836 32.5358 174.5384 *147 R 4.3700 8.4546 115.2222 56.4237 31.9685 174.3227 148 Y 5.0580 7.7113 119.9583 55.9970 41.6213 174.0611 149 T 4.6152 8.4712 111.2910 61.4834 70.8805 174.1927 150 R 4.4309 9.1278 121.5311 57.0116 33.6026 174.7355 151 D 4.5403 10.0109 125.3984 55.4161 38.5155 174.7675 152 G 3.9647 8.6224 105.5839 45.2979 0.0000 173.3947 153 V 4.5591 7.6926 112.0615 59.3033 36.4207 173.7925 154 L 4.4079 7.6959 123.4173 53.7295 43.6458 175.0410 155 C 4.9606 8.7369 123.7074 58.0393 31.4976 173.0516 156 G 4.5415 8.4433 107.0741 44.2274 0.0000 171.6757 157 Q 5.2551 8.5518 120.4180 54.6106 32.9673 174.4322 158 T 4.7512 8.8901 118.2108 62.3456 73.5193 172.8727 159 L 5.2848 8.5827 122.9176 52.0269 45.3941 175.6391 *161 A 4.4899 8.2205 120.6754 52.1401 20.1739 175.7121 162 L 4.3668 8.9879 123.5674 53.7117 43.4172 176.4862 163 K 4.2911 8.8168 123.7109 56.3037 33.4401 175.9287 164 C 4.9600 8.5475 121.5148 57.6518 30.7404 174.9167 165 A 4.6451 8.2973 124.0159 55.0194 18.0017 178.7148 166 D 4.4018 7.9067 112.3800 55.2101 41.4667 176.6737 167 G 3.9550 8.0946 106.9187 45.8188 0.0000 173.4926 168 N 4.8084 7.7934 116.9221 53.2401 40.4487 173.3344 169 H 5.3631 8.5724 115.5714 54.1028 32.9504 173.0652 170 L 4.9119 8.8548 124.0889 53.7045 44.0835 175.5948 171 T 5.0538 9.7565 117.5071 60.7904 71.6067 173.1510 172 C 5.0005 8.2633 115.8478 57.3570 33.8161 171.7825 173 H 5.0697 8.9566 119.1153 54.4241 32.3972 171.8979 174 L 5.0158 9.2717 126.2068 53.2221 44.1625 175.7784 175 R 4.8120 8.8141 122.1088 54.8925 33.1310 174.6134 176 T 4.9690 9.0400 121.0560 61.7885 72.5201 173.5521 177 T 4.6992 8.5032 120.4765 62.0386 71.9970 172.4146 178 Y 5.1433 9.0611 124.8013 56.5429 40.5765 175.1051 179 R 4.9303 9.4632 123.2337 54.2200 32.8338 175.1322 180 S 4.5566 9.1572 119.7269 58.2860 62.8791 174.2121 181 K 4.4099 8.6348 123.8263 56.8072 32.3546 177.2152 182 K 4.3370 7.9224 120.0347 54.7655 33.5438 176.5540 183 A 4.1641 8.2202 124.1214 51.6708 19.2695 178.6194 184 A 4.0644 8.7279 123.9063 55.2962 18.6194 180.3716 185 K 3.8379 8.1317 113.7867 59.1243 32.1905 177.4613 186 A 4.5253 8.1020 119.9308 51.6529 18.9515 176.4330 187 L 4.7279 7.9084 118.9918 54.0913 44.9818 177.2023 188 Q 4.5260 8.4700 119.9408 52.7561 30.6005 174.1606 *190 P 4.2348 0.0000 0.0000 63.6103 32.1294 174.4225 191 P 4.6602 0.0000 0.0000 61.6420 32.5854 175.3559 192 F 4.4421 8.6523 120.9758 59.4640 39.6917 173.6080 193 H 4.6647 7.5730 119.7888 55.2203 31.7570 171.9474 194 F 5.0745 9.0578 116.4966 55.9222 43.3840 174.8270 195 S 4.8213 8.7415 114.2725 57.1747 65.6175 172.5820 196 D 5.0974 9.0941 127.9938 54.0126 42.4979 175.3451 197 H 5.3005 9.0476 118.5677 54.3111 33.4804 172.7533 198 R 4.7194 8.8296 122.3432 53.8494 30.9838 170.5471 199 P 5.0713 0.0000 0.0000 62.1640 32.8186 175.9654 200 E 4.8082 9.7372 123.1307 54.8413 34.1548 174.2890 201 I 4.7932 8.6580 125.4629 60.8442 37.5957 176.0541 202 V 4.2115 8.6816 120.6342 61.8386 32.6150 176.2888 203 K 4.5339 7.6504 120.3471 55.2406 35.5794 174.1128 204 V 4.5789 8.2659 125.9233 61.2253 34.4470 174.3944 205 S 4.3355 8.3115 121.2875 57.1202 66.7281 172.7494 206 E 3.5502 8.9385 114.8176 58.6026 26.6038 174.2979 207 N 3.8117 8.7900 109.4392 54.7421 37.7424 173.3536 208 G 3.6972 7.9934 98.7924 47.0191 0.0000 174.2848 209 T 4.5885 7.3210 108.3110 60.4646 71.1807 172.8043 210 L 5.0424 7.4521 125.3649 53.2180 45.0824 174.8512 211 F 5.0310 9.3749 125.1337 55.5455 42.4314 173.8360 212 E 4.8613 9.1766 125.7471 55.2632 30.2935 174.3566 213 Q 5.2693 9.6389 129.4815 54.7174 31.8650 173.9942 214 H 5.2077 9.4746 123.0970 54.4738 32.7517 172.6349 215 E 5.6810 8.7376 119.4489 56.1848 33.6634 174.0154 216 S 5.3278 8.6919 120.7255 56.9769 67.2092 173.0948 217 S 5.1694 9.1040 118.8988 56.9014 67.4814 173.3215 218 V 4.7425 8.4836 122.7495 61.2290 34.9823 173.6939 219 A 4.7743 8.4966 130.5644 50.9879 20.5789 176.2810 220 R 4.6405 8.7563 117.5984 56.1810 33.4396 172.8216 221 Y 5.2822 8.3395 116.7221 56.2417 41.1251 175.2463 222 C 4.2477 9.1425 120.9208 59.5073 31.4433 172.7051 223 Q 4.4633 8.5583 125.5902 57.3064 29.5215 177.0705 224 T 3.9702 7.9158 108.1843 63.3477 69.2670 173.9445 225 C 4.6637 7.7603 119.2771 56.9559 29.3302 171.8195 226 P 4.4179 0.0000 0.0000 62.2082 31.6934 176.4090 227 S 4.4392 8.3549 116.1526 57.9162 63.1121 174.0993 228 K 4.3775 8.4589 124.1984 56.6727 31.2745 176.9769 229 L 4.4893 7.8064 118.6143 53.9839 42.4313 177.7742 230 G 3.7158 8.2139 105.4733 46.2339 0.0000 173.8728 231 H 4.6524 7.1375 116.3335 54.6656 29.7459 175.3520 232 N 4.2837 8.3425 117.1224 53.6646 38.2938 175.4492 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 I 8.02 4.04 1.88 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 1.30 1.17 0.99 0.00 0.00 6 S 8.37 4.29 0.00 3.98 3.77 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 7 D 9.48 4.90 0.00 2.99 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 8 N 8.14 5.45 0.00 2.61 2.74 0.00 0.00 6.72 7.21 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 9 V 8.83 4.73 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 0.73 0.00 0.00 0.93 0.00 0.00 10 R 8.92 4.95 0.00 1.65 1.77 0.00 3.04 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 11 I 8.40 4.88 1.85 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 1.10 0.78 0.59 0.00 0.00 12 K 8.80 4.79 0.00 1.59 1.54 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.26 7.81 13 L 8.96 5.26 0.00 1.67 1.44 1.22 0.83 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 14 Y 8.85 5.11 0.00 3.11 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 *16 E 8.58 4.34 0.00 2.08 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 2.22 2.33 0.00 17 G 7.68 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.54 5.18 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 1.29 0.00 0.00 19 V 8.83 4.70 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.93 0.00 0.00 20 N 9.71 4.29 0.00 2.94 2.94 0.00 0.00 7.06 7.37 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 21 N 8.54 4.28 0.00 2.92 3.01 0.00 0.00 7.06 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 22 H 8.40 4.81 0.00 3.33 3.57 0.00 5.63 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.62 5.11 0.00 3.08 3.17 0.00 6.00 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.64 5.34 0.00 3.32 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 *26 C 8.58 5.00 0.00 3.11 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 27 E 9.01 5.00 0.00 1.86 1.65 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 2.11 2.31 0.00 28 A 8.54 5.33 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 29 E 8.65 4.96 0.00 1.84 1.75 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 2.20 2.20 0.00 30 G 8.84 4.60 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 0.00 0.00 0.00 31 E 8.43 5.21 0.00 2.00 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 2.25 2.32 0.00 32 G 8.40 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 33 K 8.76 5.14 0.00 1.71 1.81 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.25 7.81 34 P 0.00 4.17 0.00 1.88 1.98 0.00 3.79 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 2.30 2.16 0.00 35 Y 7.99 4.36 0.00 3.01 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.34 4.26 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 37 G 8.49 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 38 T 7.26 5.13 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 39 Q 8.17 4.65 0.00 2.26 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.17 0.00 *41 E 8.49 4.50 0.00 2.06 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 2.34 2.41 0.00 42 N 8.93 5.16 0.00 2.79 2.76 0.00 0.00 6.94 6.92 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 43 I 9.05 4.66 2.01 0.00 0.00 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 1.27 0.79 1.21 0.00 0.00 44 K 9.08 4.96 0.00 1.75 1.65 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.48 7.81 45 V 8.95 4.51 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.10 0.00 0.00 46 T 8.66 4.16 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 1.31 0.00 0.00 47 K 7.97 4.44 0.00 1.80 1.68 0.00 1.77 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.45 1.48 7.81 48 G 9.36 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 0.00 0.00 0.00 49 G 7.52 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.33 0.00 2.00 1.96 0.00 3.66 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 1.99 2.16 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 60 P 0.00 4.33 0.00 1.94 1.68 0.00 3.75 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 1.90 1.61 0.00 61 N 8.06 5.04 0.00 2.96 3.06 0.00 0.00 6.96 7.04 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 62 C 7.67 4.52 0.00 3.24 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 *66 S 7.72 4.08 0.00 4.08 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 67 V 7.24 3.44 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.02 0.00 0.00 68 A 8.01 4.16 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 0.00 0.00 0.00 0.00 0.00 69 I 7.12 4.34 2.24 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 1.28 0.76 1.03 0.00 0.00 70 T 8.15 4.53 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 1.08 0.00 0.00 71 K 8.79 4.39 0.00 1.94 1.71 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.48 7.81 72 Y 8.69 4.28 0.00 2.92 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.19 4.43 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 1.23 0.00 0.00 74 S 9.49 3.52 0.00 4.01 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 0.00 75 G 8.52 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 7.62 3.83 1.97 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.38 0.75 0.00 0.00 77 P 0.00 4.03 0.00 2.23 2.04 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 78 D 8.11 3.37 0.00 2.30 2.34 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 79 Y 7.69 3.71 0.00 2.43 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 0.00 0.00 0.00 80 F 7.19 3.66 0.00 3.08 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 81 K 8.14 4.16 0.00 1.76 1.92 0.00 1.65 0.00 0.00 1.23 0.00 0.00 2.13 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.51 1.54 7.81 82 Q 7.64 3.95 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 83 S 7.40 4.02 0.00 3.78 4.01 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 0.00 0.00 0.00 84 F 6.74 5.05 0.00 3.11 2.93 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 85 P 0.00 4.65 0.00 2.24 2.24 0.00 3.85 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 86 E 8.36 3.94 0.00 2.17 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 2.33 2.41 0.00 87 G 10.15 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 88 F 7.49 5.27 0.00 3.40 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 9.17 5.38 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 1.24 0.00 0.00 90 W 8.79 5.87 0.00 3.38 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 E 9.26 5.25 0.00 2.03 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 0.00 2.40 2.23 0.00 92 R 8.89 5.10 0.00 1.99 2.09 0.00 3.11 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 93 T 8.65 5.17 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 1.36 0.00 0.00 94 T 9.17 4.95 4.35 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 0.87 0.00 0.00 95 I 8.58 4.38 1.70 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 1.25 0.58 0.44 0.00 0.00 96 Y 8.67 4.67 0.00 2.80 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 E 9.05 4.05 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.28 0.00 98 D 8.19 4.74 0.00 2.79 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 99 G 8.10 3.88 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 0.00 0.00 0.00 100 A 7.33 4.25 -0.33 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 0.00 101 Y 8.56 5.11 0.00 2.93 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 0.00 102 L 9.11 5.26 0.00 2.09 1.76 1.05 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 103 T 9.23 5.24 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 1.27 0.00 0.00 104 T 9.31 5.14 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 1.08 0.00 0.00 105 Q 8.83 4.76 0.00 2.05 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.16 2.18 0.00 106 Q 8.57 4.67 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 107 E 8.87 4.86 0.00 1.98 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 2.16 2.21 0.00 108 T 8.83 5.26 3.16 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 1.26 0.00 0.00 109 K 9.19 4.86 0.00 1.80 1.62 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.37 7.81 110 L 8.63 4.81 0.00 0.74 1.21 0.67 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 111 D 8.94 4.70 0.00 2.69 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.19 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 0.00 113 N 8.71 4.96 0.00 2.72 2.98 0.00 0.00 5.35 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 0.00 114 C 8.00 5.15 0.00 2.96 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 0.00 115 L 8.85 4.65 0.00 1.37 1.35 1.07 0.56 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 0.00 116 V 8.98 4.65 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 1.12 0.00 0.00 0.98 0.00 0.00 117 Y 8.88 5.55 0.00 2.99 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 0.00 118 N 9.14 5.54 0.00 2.62 2.69 0.00 0.00 6.51 6.95 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 0.00 119 I 8.96 4.87 1.92 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.66 0.85 0.00 0.00 120 K 8.96 4.85 0.00 1.56 1.61 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.32 7.81 121 I 8.62 5.15 1.93 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.76 1.05 0.00 0.00 122 L 9.14 4.98 0.00 1.57 1.56 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 123 G 9.53 4.85 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 0.00 124 C 9.52 5.03 0.00 3.01 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 0.00 125 N 8.90 4.14 0.00 3.05 2.97 0.00 0.00 6.95 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 F 7.72 4.03 0.00 3.09 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.41 0.00 2.23 2.20 0.00 3.67 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.04 0.00 128 P 0.00 4.22 0.00 2.23 2.27 0.00 3.78 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 2.01 2.03 0.00 129 N 8.12 4.78 0.00 2.73 2.87 0.00 0.00 6.86 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 0.00 130 G 8.07 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 0.00 131 P 0.00 4.16 0.00 2.19 2.32 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 2.08 1.97 0.00 132 V 7.28 3.73 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 0.63 0.00 0.00 0.82 0.00 0.00 *134 Q 7.95 4.25 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.26 6.64 0.00 0.00 0.00 0.00 0.00 2.50 2.34 0.00 135 K 7.76 3.82 0.00 1.87 1.86 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.43 7.81 136 K 8.27 4.52 0.00 1.66 1.80 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.47 7.81 137 T 7.70 4.53 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 1.09 0.00 0.00 138 Q 9.21 4.51 0.00 1.83 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.42 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 139 G 8.23 4.12 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 0.00 0.00 0.00 140 W 8.19 5.23 0.00 3.31 3.16 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 0.00 141 E 8.77 4.60 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 2.59 2.44 0.00 142 P 0.00 4.79 0.00 2.08 2.09 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 143 C 9.18 4.92 0.00 2.90 3.01 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 0.00 0.00 0.00 144 C 8.49 4.94 0.00 2.91 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.96 5.01 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.11 0.00 *147 R 8.45 4.37 0.00 1.15 1.53 0.00 3.10 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.43 0.00 148 Y 7.71 5.06 0.00 3.16 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 0.00 149 T 8.47 4.62 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 1.19 0.00 0.00 150 R 9.13 4.43 0.00 1.95 1.77 0.00 3.32 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 151 D 10.01 4.54 0.00 2.81 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 0.00 152 G 8.62 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 V 7.69 4.56 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.98 0.00 0.00 154 L 7.70 4.41 0.00 0.27 0.63 0.58 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 155 C 8.74 4.96 0.00 1.54 2.22 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 0.00 156 G 8.44 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 Q 8.55 5.26 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.67 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 158 T 8.89 4.75 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 1.17 0.00 0.00 159 L 8.58 5.28 0.00 1.47 1.53 0.88 0.75 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 *161 A 8.22 4.49 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 0.00 162 L 8.99 4.37 0.00 1.44 1.24 0.61 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 163 K 8.82 4.29 0.00 1.63 1.64 0.00 1.69 0.00 0.00 1.85 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.54 1.46 7.81 164 C 8.55 4.96 0.00 2.94 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 0.00 165 A 8.30 4.65 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 0.00 166 D 7.91 4.40 0.00 2.64 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 0.00 167 G 8.09 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 N 7.79 4.81 0.00 2.65 2.78 0.00 0.00 6.90 8.16 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 0.00 169 H 8.57 5.36 0.00 2.99 3.17 0.00 5.66 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.85 4.91 0.00 1.75 1.52 1.03 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 0.00 171 T 9.76 5.05 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 1.25 0.00 0.00 172 C 8.26 5.00 0.00 2.36 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 0.00 173 H 8.96 5.07 0.00 3.08 3.03 0.00 5.56 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 L 9.27 5.02 0.00 1.53 1.44 0.72 0.50 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 0.00 175 R 8.81 4.81 0.00 1.67 1.77 0.00 2.85 0.00 0.00 3.09 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.32 0.00 176 T 9.04 4.97 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 177 T 8.50 4.70 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 1.19 0.00 0.00 178 Y 9.06 5.14 0.00 2.86 3.01 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 0.00 0.00 0.00 179 R 9.46 4.93 0.00 1.85 1.95 0.00 3.19 0.00 0.00 3.15 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 180 S 9.16 4.56 0.00 2.87 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 K 8.63 4.41 0.00 1.85 1.85 0.00 2.04 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.56 7.81 182 K 7.92 4.34 0.00 1.60 1.64 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.22 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.45 7.81 183 A 8.22 4.16 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 0.00 184 A 8.73 4.06 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 K 8.13 3.84 0.00 1.75 1.89 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.45 7.81 186 A 8.10 4.53 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 0.00 187 L 7.91 4.73 0.00 1.70 1.49 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 188 Q 8.47 4.53 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.48 0.00 0.00 0.00 0.00 0.00 2.23 2.14 0.00 *190 P 0.00 4.23 0.00 2.19 2.25 0.00 3.66 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 1.80 1.83 0.00 191 P 0.00 4.66 0.00 2.39 2.23 0.00 3.84 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.18 0.00 192 F 8.65 4.44 0.00 3.10 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 H 7.57 4.66 0.00 3.08 3.07 0.00 5.55 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 0.00 194 F 9.06 5.07 0.00 2.93 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 0.00 195 S 8.74 4.82 0.00 3.69 3.51 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 0.00 196 D 9.09 5.10 0.00 2.51 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 H 9.05 5.30 0.00 2.94 3.03 0.00 5.56 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 0.00 198 R 8.83 4.72 0.00 1.86 1.77 0.00 3.11 0.00 0.00 3.25 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 199 P 0.00 5.07 0.00 2.20 2.23 0.00 3.83 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 2.10 1.88 0.00 200 E 9.74 4.81 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 201 I 8.66 4.79 2.03 0.00 0.00 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 1.59 0.72 1.17 0.00 0.00 202 V 8.68 4.21 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 0.56 0.00 0.00 1.05 0.00 0.00 203 K 7.65 4.53 0.00 1.79 1.58 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.71 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.34 1.37 7.81 204 V 8.27 4.58 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 0.40 0.00 0.00 0.98 0.00 0.00 205 S 8.31 4.34 0.00 3.76 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 0.00 206 E 8.94 3.55 0.00 2.05 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 2.23 2.16 0.00 207 N 8.79 3.81 0.00 2.72 2.76 0.00 0.00 7.28 7.98 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 0.00 208 G 7.99 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 T 7.32 4.59 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 1.21 0.00 0.00 210 L 7.45 5.04 0.00 1.78 1.42 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 211 F 9.37 5.03 0.00 2.56 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 0.00 212 E 9.18 4.86 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 213 Q 9.64 5.27 0.00 2.30 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.47 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 214 H 9.47 5.21 0.00 3.13 3.22 0.00 5.90 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 E 8.74 5.68 0.00 2.08 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 2.24 2.27 0.00 216 S 8.69 5.33 0.00 3.78 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 9.10 5.17 0.00 3.83 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 0.00 218 V 8.48 4.74 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 0.96 0.00 0.00 0.89 0.00 0.00 219 A 8.50 4.77 -0.05 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 0.00 220 R 8.76 4.64 0.00 1.82 1.97 0.00 2.72 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 221 Y 8.34 5.28 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 0.00 222 C 9.14 4.25 0.00 3.02 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 0.00 223 Q 8.56 4.46 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.90 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 224 T 7.92 3.97 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 1.18 0.00 0.00 225 C 7.76 4.66 0.00 2.95 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 0.00 226 P 0.00 4.42 0.00 2.03 1.97 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 227 S 8.35 4.44 0.00 3.86 3.77 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 0.00 228 K 8.46 4.38 0.00 1.74 1.80 0.00 1.61 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.48 7.81 229 L 7.81 4.49 0.00 1.39 1.36 0.93 1.20 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 0.00 230 G 8.21 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 H 7.14 4.65 0.00 3.26 3.14 0.00 5.66 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 0.00 232 N 8.34 4.28 0.00 2.20 1.42 0.00 0.00 6.78 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.