NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.8977 8.2076 120.4843 54.8317 43.1809 173.6480 2 S 4.6308 8.7892 114.2370 55.9437 67.0619 168.4334 3 V 5.1046 8.3147 119.6214 59.0083 32.2311 174.6826 4 T 4.5691 8.1534 123.7679 62.7142 68.8522 172.6402 5 Q 5.5583 8.5203 124.3212 54.9288 31.9182 173.7812 6 T 3.8008 7.6733 116.1046 62.3034 69.1235 173.2740 7 E 4.4900 8.8838 123.7569 56.4613 31.2919 177.4776 8 G 3.9321 7.8321 107.0624 45.3135 0.0000 172.2294 9 L 4.3870 8.5024 116.4576 53.8003 43.8664 176.0878 10 V 3.4648 7.7344 117.4911 64.1425 29.3561 171.8924 11 T 4.5617 7.4839 116.2748 63.8032 69.4993 175.8690 12 V 4.5644 8.8849 124.4508 61.6610 36.0090 173.6760 13 T 5.0146 8.3278 121.5909 61.4813 70.5827 173.8410 14 E 4.7654 8.1850 124.1672 57.9035 29.2672 175.9142 15 G 4.1253 9.2947 110.7718 45.8144 0.0000 173.7748 16 L 4.3389 7.7655 118.9901 53.4522 43.1263 175.2899 17 P 5.6379 0.0000 0.0000 62.1111 32.8643 175.1181 18 V 4.4843 8.2215 119.0048 61.4023 35.6749 174.5986 19 K 4.3481 8.2559 122.0365 56.1677 34.0215 173.9763 20 L 4.5897 8.6398 129.5143 53.2465 43.5716 175.8779 21 N 4.6184 8.9642 122.4324 52.9113 40.2131 173.5848 22 C 5.5011 8.8441 122.9669 55.2715 42.0689 172.5219 23 T 5.4061 9.4597 116.4103 60.0454 72.2728 172.2704 24 Y 5.2794 7.3213 119.2338 55.6019 42.2697 174.4020 25 Q 4.5358 9.5953 121.1528 55.5769 31.5429 173.1031 26 T 5.6119 8.8988 116.0758 59.1816 71.7476 173.9426 27 T 4.1761 8.3296 110.3198 61.8794 69.8804 173.7975 28 Y 4.9005 7.8390 119.1836 55.3802 41.5565 175.1832 29 L 4.1564 8.6268 122.9146 55.3698 42.4780 176.7172 30 T 3.8229 8.4951 117.5734 62.2987 68.6047 174.2526 30A I 4.0082 8.9146 126.3023 63.1154 38.4478 175.9997 31 A 4.4073 6.5092 117.3521 51.0957 23.0168 175.5647 32 F 4.3152 8.3100 119.1206 55.5671 42.4664 174.7363 33 F 5.6807 9.0622 118.9640 56.0678 44.1425 173.4081 34 W 5.2210 9.8654 120.6174 55.2913 32.2209 174.2121 35 Y 5.3648 9.7509 122.8772 56.1258 40.8714 175.0304 36 V 4.2381 9.2772 122.9972 59.7699 34.3777 174.1946 37 Q 4.7648 8.7937 127.6774 54.1765 30.7480 174.1237 38 Y 4.5421 8.3789 124.6418 56.9708 39.6700 175.1009 39 L 3.9120 8.6707 123.5302 57.1195 42.1943 176.4275 40 N 4.4547 9.1828 122.6754 54.0850 37.1894 172.9593 41 E 4.7769 8.3915 114.1824 53.6942 33.3584 175.5513 42 A 4.2173 8.3363 123.3765 51.2798 19.1804 175.7525 43 P 4.5177 0.0000 0.0000 62.5515 31.9451 176.2219 44 Q 5.0164 8.7024 122.3421 53.6021 32.1349 175.4989 45 V 3.4609 8.5089 121.6002 63.4485 31.6422 175.1754 46 L 4.7499 9.0008 129.4226 55.4712 43.9616 176.4531 47 L 4.8704 7.3026 118.0404 55.3859 42.4504 173.2599 48 K 5.4848 8.8084 118.8457 55.8968 35.9835 175.1552 49 S 4.7553 9.4428 115.1521 57.2890 65.6801 174.6182 50 S 4.4095 8.3620 117.4776 58.2400 65.1184 174.8353 51 T 4.3217 7.6621 109.2788 60.8592 69.9845 173.0960 52 D 4.5740 8.3875 118.9042 52.7424 41.5566 175.4262 53 N 5.2911 7.3431 128.9595 53.4776 39.9863 172.8971 54 K 4.2168 7.8450 125.2870 54.9994 33.5901 175.6006 55 R 4.4905 8.3703 130.8110 55.2797 28.6319 176.3520 56 T 3.8876 7.6856 116.0322 64.0816 68.9020 172.9259 57 E 4.9113 8.4568 126.7241 54.7763 31.9664 174.2721 58 H 4.7832 9.2210 122.7296 55.9848 33.4375 173.3816 59 Q 3.5385 7.0635 125.6257 56.7495 26.9678 176.4788 *61 G 3.8170 8.0085 110.1313 45.0204 0.0000 171.3013 62 F 4.4988 7.6168 119.5385 57.0664 40.6257 174.3145 63 H 5.4872 8.9584 114.9430 53.7461 32.2036 172.6254 64 A 4.6876 8.5121 122.4119 51.6944 21.7066 175.3551 65 T 4.6414 8.6418 119.7208 62.2659 70.7162 174.5486 66 L 4.7000 8.4837 127.6027 54.9565 43.1968 176.4633 67 H 5.4839 8.9909 120.7267 53.2389 30.5785 174.3553 68 K 4.3832 9.5898 123.9503 59.3524 31.5667 179.7563 69 S 3.8813 7.2199 108.6446 61.9110 63.6758 174.4985 70 S 4.3514 7.8965 115.7839 56.5944 61.9254 174.5887 71 S 3.2952 8.8292 117.1939 58.8590 59.9669 170.3994 72 S 5.0662 8.2439 114.4915 56.6124 66.7298 175.1105 73 F 5.5990 9.0124 124.3615 57.6599 38.8840 174.4774 74 H 4.6192 8.9183 113.7432 56.5359 29.7531 175.1400 75 L 4.4930 8.7645 123.2598 53.1947 44.9128 175.1406 76 Q 5.2009 8.4444 121.9445 55.2154 32.7614 173.7054 77 K 4.2059 8.3211 121.8607 55.2901 34.8388 175.8597 78 S 3.9963 9.2307 122.8945 61.5497 63.1448 173.5403 79 S 5.1810 7.8463 117.6014 55.5929 64.5234 172.8194 80 A 4.7269 8.1460 125.5809 50.3095 21.2540 175.7318 81 Q 4.6901 9.2130 122.3507 54.6730 30.7589 177.5312 82 L 4.1217 8.6370 121.2467 57.6395 41.9681 179.9408 83 S 4.2670 8.0606 112.3947 61.0894 63.0799 175.1162 84 D 4.8616 8.0952 119.8435 56.2794 40.5803 175.9608 85 S 4.8123 7.9663 115.1089 58.7732 62.4694 173.1912 86 A 4.4427 8.1939 125.4831 51.2090 22.8293 173.6411 87 L 4.8520 7.9127 119.2488 54.1892 44.0253 175.4053 88 Y 5.2226 8.8498 123.2442 56.3788 41.5224 174.0691 89 Y 5.0700 9.5022 121.3304 56.3775 41.3904 173.6387 90 C 4.5456 8.6660 123.9118 54.9010 44.9640 172.1735 91 A 4.8110 8.5070 126.5035 51.4799 23.4363 173.9343 92 L 4.2119 7.6108 118.3282 55.1646 44.2485 173.9688 93 S 5.0878 8.0797 113.1492 56.4579 66.0273 173.0742 94 E 4.5219 8.8462 121.6379 54.5400 32.8070 175.8203 *99 G 3.5618 8.3007 108.6228 46.0194 0.0000 171.4317 100 G 2.9297 7.9193 107.6651 46.2220 0.0000 174.4810 101 N 3.9645 6.8640 118.9679 53.9320 39.5240 176.7630 102 Y 3.9700 6.9852 113.0898 57.4042 36.7500 169.2568 103 K 3.8635 7.3457 120.7010 57.4939 33.2768 174.9428 104 Y 5.6251 8.3103 126.9237 54.2020 38.3145 174.5241 105 V 3.8671 7.7336 122.7916 62.7757 33.2451 174.2994 106 F 5.1514 8.7239 124.1148 55.5486 42.3531 175.0215 107 G 4.2485 9.4633 109.3656 45.0133 0.0000 173.6549 108 A 4.2531 9.0069 125.7347 56.4257 18.3950 177.6403 109 G 4.0177 7.5783 98.9837 44.0520 0.0000 173.4478 110 T 4.6093 8.4242 116.8398 61.9139 72.7028 173.7181 111 R 4.5248 8.7260 127.1566 55.9231 31.6305 175.1394 112 L 4.9962 8.8851 125.5829 52.0965 45.5955 175.0274 113 K 4.6931 8.5432 127.6251 54.5887 34.6771 174.6156 114 V 4.5601 8.2475 127.6022 60.8470 32.6022 176.1025 115 I 4.4639 10.2875 118.3300 59.3371 40.4593 174.7691 116 A 5.0147 8.3505 125.0613 51.2164 20.4713 176.5498 117 H 4.6789 9.5538 114.2724 53.8454 29.9662 173.3823 118 I 3.9589 8.1377 125.8972 60.0176 37.7606 175.7122 119 Q 4.0211 8.5373 127.5236 58.6034 29.2323 176.6557 120 N 4.8718 7.5377 119.6210 49.5859 38.6550 171.2202 121 P 4.3328 0.0000 0.0000 63.4760 32.2776 177.4053 122 E 4.8324 8.7296 122.1199 54.4394 28.6148 174.6920 123 P 4.5617 0.0000 0.0000 63.0693 33.1523 176.9822 124 A 4.6609 8.6960 122.1338 51.1536 22.4449 175.2992 125 V 5.1542 7.8037 114.0596 58.8729 34.6977 174.7253 126 Y 4.8854 8.5002 122.9663 56.1777 41.4300 174.8027 127 Q 5.4140 8.6526 119.0914 54.0878 30.0076 175.0998 128 L 4.6965 8.6655 123.8937 53.4100 44.0029 176.0753 129 K 4.3853 8.3231 119.3254 54.5639 35.1508 175.0632 *132 D 4.9735 8.5224 117.8166 53.5080 41.3525 174.2003 133 P 4.4373 0.0000 0.0000 65.6682 33.0729 178.6204 134 R 4.2402 7.8000 116.2814 56.4536 29.2362 180.0330 135 S 4.2891 9.2892 122.0730 59.0864 63.8311 174.9540 136 Q 3.8435 8.6417 124.9577 58.8493 29.1475 176.3592 137 D 4.6220 7.3141 115.4883 53.6787 42.0761 176.1553 138 S 5.0361 7.8666 115.9695 58.7405 63.7186 177.0100 139 T 4.4444 7.3112 124.4337 62.9547 67.9312 172.9723 140 L 5.4816 8.1286 126.5260 53.4251 45.6567 175.2464 141 C 5.5948 9.5588 121.1344 55.2846 45.7057 172.8017 142 L 5.1000 9.7137 124.7607 53.4618 44.8852 174.7903 143 F 5.5004 9.3007 129.7960 57.3954 41.1940 174.6580 144 T 5.5982 8.8781 121.8505 60.6129 73.5903 173.4738 145 D 4.1595 8.3900 117.2559 54.9809 38.7704 173.9293 146 F 4.6625 6.4955 112.8493 55.5622 38.7216 174.9788 147 D 4.3878 8.6935 121.3096 55.0393 41.3269 177.0874 148 S 5.2045 8.4921 116.5757 58.7675 62.3858 174.2546 149 Q 4.6317 7.6877 115.7066 56.2012 30.3993 176.1371 150 I 3.8642 7.7305 111.6106 60.6931 38.2404 175.9119 151 N 4.6049 8.4500 121.1711 51.5681 37.5523 174.8157 152 V 3.5349 8.1800 123.1657 62.0590 31.9428 174.2350 153 P 4.3623 0.0000 0.0000 62.8578 31.5338 174.8548 154 K 4.4087 7.7298 116.0871 54.1161 35.9046 176.6204 155 T 3.7352 7.7747 117.0008 64.4255 68.7142 174.9552 156 M 4.5781 8.4133 123.0955 55.1009 33.8247 175.2775 157 E 4.7201 7.6467 115.1583 54.1441 32.9703 174.7157 158 S 4.2663 8.4532 114.5013 59.0137 63.9189 175.8002 159 G 4.5897 8.6994 106.3284 46.2796 0.0000 173.2014 160 T 5.0559 7.1178 115.1300 62.0028 72.0171 173.5896 161 F 4.4537 7.7812 121.3185 58.1549 43.6157 172.6670 162 I 3.9789 6.8849 127.0654 59.3496 38.7892 175.7690 163 T 4.3520 7.8866 118.9947 61.7777 69.7465 173.1125 164 D 4.9815 8.5973 120.4710 52.2855 42.8564 176.4550 165 K 5.1270 8.8325 121.5923 57.6123 33.2369 176.0559 166 T 4.7685 8.4168 110.8748 60.4552 72.2258 172.6126 167 V 4.6757 8.4458 124.5544 61.8463 33.3056 174.9245 168 L 4.6779 8.5930 126.1527 54.2948 43.8049 174.6799 169 D 4.9866 8.7043 123.2476 51.7232 41.4402 175.0816 170 M 4.1088 8.8894 121.5920 54.8879 31.9244 177.3504 171 K 4.4811 8.1658 117.4467 56.6190 31.3250 175.1008 172 A 3.9187 7.7594 129.1734 52.1716 16.9370 175.3316 173 M 4.7796 8.3260 118.4080 57.3797 36.2077 174.1898 174 D 4.2705 7.5464 119.6020 53.2480 44.2185 174.9891 175 S 4.1516 8.6285 120.0931 59.7570 62.9136 174.1399 176 K 4.5738 8.0443 123.4623 55.4041 34.5114 175.6600 177 S 4.4561 8.7887 114.7955 57.1424 66.0588 172.8990 178 N 4.7699 8.4039 124.4305 52.7242 39.8535 174.3221 179 G 5.0456 8.8528 109.4571 43.5992 0.0000 171.5063 180 A 5.1554 8.3952 116.5009 51.5851 21.6198 175.4435 181 I 5.3792 7.9999 115.6300 60.4104 40.5530 174.8564 182 A 5.3410 9.4462 124.5172 49.1937 22.9002 174.9648 183 W 6.3000 8.0339 115.3739 55.5301 32.0925 173.4807 184 S 5.6786 8.9658 114.4399 59.1110 65.1440 173.4816 185 N 4.8082 8.7729 115.4702 53.6466 39.0879 175.4271 186 Q 4.2955 7.6181 120.2385 55.7093 26.2782 177.3186 187 T 4.0633 7.7634 110.1242 64.8285 69.1800 175.4279 188 S 4.4385 8.6951 119.1877 59.7453 63.9688 174.6938 189 F 5.0039 7.8118 118.4905 57.5797 39.6439 174.4238 190 T 4.8019 7.9923 116.7249 61.0576 73.4209 174.5108 191 C 4.1699 8.8024 120.4467 60.6043 39.9976 176.3515 192 Q 3.5157 7.6265 118.9365 59.1407 28.5244 177.9164 193 D 4.1278 7.5502 117.8281 57.3759 41.0572 177.9471 194 I 3.4770 7.6239 119.1986 63.5778 38.5206 177.2206 195 F 4.0238 8.2336 119.8518 55.1004 37.2300 175.4021 196 K 3.7330 7.4416 123.2248 57.3031 32.9328 175.1106 197 E 3.6515 8.5440 125.1069 56.4988 26.1274 172.4756 198 T 4.3242 7.5837 111.0997 59.5547 71.2884 173.9522 *203 N 5.4339 8.7079 122.6787 52.5889 38.9933 171.9971 204 A 4.5344 7.3579 121.7460 51.4232 23.1327 174.9486 205 T 4.2142 7.8172 114.5142 61.9214 71.1990 174.5005 206 Y 4.9544 7.2756 125.9128 53.7563 36.6118 172.1288 207 P 4.3654 0.0000 0.0000 63.9799 32.2031 176.6520 208 S 4.5875 8.2989 116.6079 58.4934 64.8862 175.0474 209 S 4.5857 8.0655 119.0682 58.0820 66.4628 175.3641 210 D 4.5474 8.5481 120.5591 53.4880 39.7664 176.2447 211 V 3.8323 8.1435 115.0157 60.2494 32.0687 174.7487 212 P 4.4007 0.0000 0.0000 62.6291 32.1017 176.2230 213 C 4.3994 8.5482 115.7101 60.6741 28.2439 173.5083 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 D 8.21 4.90 0.00 2.64 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 2 S 8.79 4.63 0.00 3.89 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 3 V 8.31 5.10 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 1.18 0.00 0.00 0.99 0.00 0.00 4 T 8.15 4.57 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 1.24 0.00 0.00 5 Q 8.52 5.56 0.00 2.30 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.37 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 6 T 7.67 3.80 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 1.23 0.00 0.00 7 E 8.88 4.49 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 8 G 7.83 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 9 L 8.50 4.39 0.00 1.69 1.72 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.73 3.46 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 0.95 0.00 0.00 0.94 0.00 0.00 11 T 7.48 4.56 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 1.31 0.00 0.00 12 V 8.88 4.56 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.98 0.00 0.00 13 T 8.33 5.01 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 1.22 0.00 0.00 14 E 8.19 4.77 0.00 1.95 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 2.19 0.00 15 G 9.29 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 16 L 7.77 4.34 0.00 1.62 1.58 0.91 0.99 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 17 P 0.00 5.64 0.00 2.02 2.03 0.00 3.03 0.00 0.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.89 0.00 18 V 8.22 4.48 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.95 0.00 0.00 19 K 8.26 4.35 0.00 1.70 1.61 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.24 1.48 7.81 20 L 8.64 4.59 0.00 1.35 1.70 0.65 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.96 4.62 0.00 2.62 2.66 0.00 0.00 5.94 7.20 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 22 C 8.84 5.50 0.00 3.01 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 23 T 9.46 5.41 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 1.28 0.00 0.00 24 Y 7.32 5.28 0.00 3.12 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 25 Q 9.60 4.54 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 26 T 8.90 5.61 4.52 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 1.21 0.00 0.00 27 T 8.33 4.18 3.49 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 1.02 0.00 0.00 28 Y 7.84 4.90 0.00 2.95 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 29 L 8.63 4.16 0.00 1.69 1.64 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.50 3.82 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 30A I 8.91 4.01 1.91 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 1.21 0.55 0.93 0.00 0.00 31 A 6.51 4.41 1.08 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 0.00 0.00 32 F 8.31 4.32 0.00 1.74 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 9.06 5.68 0.00 2.98 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 34 W 9.87 5.22 0.00 3.29 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 35 Y 9.75 5.36 0.00 3.22 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 36 V 9.28 4.24 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 -0.31 0.00 0.00 37 Q 8.79 4.76 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 7.02 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 38 Y 8.38 4.54 0.00 2.97 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 39 L 8.67 3.91 0.00 1.67 1.72 0.97 1.03 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 40 N 9.18 4.45 0.00 2.92 2.96 0.00 0.00 7.00 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 41 E 8.39 4.78 0.00 2.24 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 0.00 2.28 2.44 0.00 42 A 8.34 4.22 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 43 P 0.00 4.52 0.00 1.93 2.03 0.00 3.58 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.99 0.00 44 Q 8.70 5.02 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.98 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 45 V 8.51 3.46 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 0.68 0.00 0.00 0.70 0.00 0.00 46 L 9.00 4.75 0.00 1.71 1.86 1.13 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.30 4.87 0.00 1.92 1.83 0.96 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.81 5.48 0.00 2.41 2.09 0.00 1.55 0.00 0.00 2.15 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.65 7.81 49 S 9.44 4.76 0.00 3.92 3.52 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 50 S 8.36 4.41 0.00 3.82 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 51 T 7.66 4.32 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 1.20 0.00 0.00 52 D 8.39 4.57 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 7.34 5.29 0.00 2.79 2.77 0.00 0.00 6.93 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 54 K 7.85 4.22 0.00 1.71 1.70 0.00 1.86 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.44 7.81 55 R 8.37 4.49 0.00 1.82 1.90 0.00 3.11 0.00 0.00 4.01 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 56 T 7.69 3.89 4.61 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 1.36 0.00 0.00 57 E 8.46 4.91 0.00 2.06 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 2.22 2.30 0.00 58 H 9.22 4.78 0.00 3.31 3.29 0.00 5.86 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 59 Q 7.06 3.54 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.41 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 *61 G 8.01 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 7.62 4.50 0.00 2.91 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 63 H 8.96 5.49 0.00 3.23 3.34 0.00 5.76 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.51 4.69 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 8.64 4.64 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 1.17 0.00 0.00 66 L 8.48 4.70 0.00 0.78 1.15 -0.86 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 67 H 8.99 5.48 0.00 3.09 3.13 0.00 5.70 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 68 K 9.59 4.38 0.00 1.88 1.95 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.50 7.81 69 S 7.22 3.88 0.00 3.97 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 70 S 7.90 4.35 0.00 3.95 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 71 S 8.83 3.30 0.00 3.39 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 72 S 8.24 5.07 0.00 3.71 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 73 F 9.01 5.60 0.00 2.93 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 H 8.92 4.62 0.00 3.11 3.29 0.00 5.89 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 75 L 8.76 4.49 0.00 0.27 0.13 0.59 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.44 5.20 0.00 1.99 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.49 0.00 0.00 0.00 0.00 0.00 2.17 2.00 0.00 77 K 8.32 4.21 0.00 1.35 1.33 0.00 0.61 0.00 0.00 1.39 0.00 0.00 2.75 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.22 1.05 7.81 78 S 9.23 4.00 0.00 4.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 S 7.85 5.18 0.00 3.70 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 80 A 8.15 4.73 1.20 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 0.00 0.00 81 Q 9.21 4.69 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 82 L 8.64 4.12 0.00 1.73 1.76 0.93 0.67 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 83 S 8.06 4.27 0.00 3.97 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 84 D 8.10 4.86 0.00 3.00 3.22 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 85 S 7.97 4.81 0.00 4.11 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.19 4.44 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 7.91 4.85 0.00 1.67 1.34 0.67 0.74 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 88 Y 8.85 5.22 0.00 3.08 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 89 Y 9.50 5.07 0.00 3.09 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 C 8.67 4.55 0.00 1.93 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.51 4.81 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.61 4.21 0.00 0.68 0.82 0.56 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.08 5.09 0.00 3.96 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 94 E 8.85 4.52 0.00 2.19 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 2.20 2.63 0.00 *99 G 8.30 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.92 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 0.00 0.00 0.00 101 N 6.86 3.96 0.00 2.85 2.89 0.00 0.00 6.92 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 0.00 102 Y 6.99 3.97 0.00 3.17 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 0.00 103 K 7.35 3.86 0.00 1.98 1.75 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.18 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.54 7.81 104 Y 8.31 5.63 0.00 2.97 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 0.00 105 V 7.73 3.87 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 0.94 0.00 0.00 0.90 0.00 0.00 106 F 8.72 5.15 0.00 2.96 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 0.00 107 G 9.46 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 0.00 0.00 0.00 0.00 108 A 9.01 4.25 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 7.58 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 0.00 110 T 8.42 4.61 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 111 R 8.73 4.52 0.00 1.82 1.85 0.00 3.24 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 112 L 8.89 5.00 0.00 1.97 1.84 0.97 0.08 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 0.00 113 K 8.54 4.69 0.00 2.00 1.68 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.40 7.81 114 V 8.25 4.56 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 0.92 0.00 0.00 1.02 0.00 0.00 115 I 10.29 4.46 1.90 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 1.18 1.26 0.95 0.00 0.00 116 A 8.35 5.01 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 9.55 4.68 0.00 3.17 3.27 0.00 5.55 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 8.14 3.96 1.80 0.00 0.00 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 1.17 0.43 0.87 0.00 0.00 119 Q 8.54 4.02 0.00 1.93 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.15 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 120 N 7.54 4.87 0.00 2.67 2.71 0.00 0.00 6.89 8.02 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 0.00 121 P 0.00 4.33 0.00 2.19 2.08 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 122 E 8.73 4.83 0.00 1.79 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 2.25 2.26 0.00 123 P 0.00 4.56 0.00 2.22 2.42 0.00 3.73 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 2.23 2.29 0.00 124 A 8.70 4.66 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.80 5.15 1.20 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 0.22 0.00 0.00 0.64 0.00 0.00 126 Y 8.50 4.89 0.00 3.00 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 0.00 127 Q 8.65 5.41 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.90 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 128 L 8.67 4.70 0.00 1.62 1.67 1.02 0.94 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 0.00 129 K 8.32 4.39 0.00 1.81 1.74 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.42 7.81 *132 D 8.52 4.97 0.00 2.79 2.62 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 0.00 133 P 0.00 4.44 0.00 2.22 2.18 0.00 3.83 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 1.99 2.00 0.00 134 R 7.80 4.24 0.00 2.20 1.43 0.00 3.33 0.00 0.00 3.22 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 135 S 9.29 4.29 0.00 3.88 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 0.00 136 Q 8.64 3.84 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 137 D 7.31 4.62 0.00 2.74 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 7.87 5.04 0.00 4.01 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 0.00 139 T 7.31 4.44 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 140 L 8.13 5.48 0.00 1.79 1.76 1.18 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 141 C 9.56 5.59 0.00 3.31 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 L 9.71 5.10 0.00 1.82 1.73 1.09 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 143 F 9.30 5.50 0.00 2.81 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 0.00 144 T 8.88 5.60 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 1.23 0.00 0.00 145 D 8.39 4.16 0.00 3.01 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 0.00 146 F 6.50 4.66 0.00 2.92 2.42 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 0.00 147 D 8.69 4.39 0.00 2.83 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 0.00 148 S 8.49 5.20 0.00 3.83 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 0.00 149 Q 7.69 4.63 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.63 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 150 I 7.73 3.86 1.93 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.64 0.99 0.00 0.00 151 N 8.45 4.60 0.00 2.74 2.83 0.00 0.00 6.91 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 0.00 152 V 8.18 3.53 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 0.88 0.00 0.00 0.88 0.00 0.00 153 P 0.00 4.36 0.00 1.98 2.04 0.00 3.73 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.08 0.00 154 K 7.73 4.41 0.00 1.55 1.48 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.19 1.31 7.81 155 T 7.77 3.74 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 156 M 8.41 4.58 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 157 E 7.65 4.72 0.00 2.02 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 2.25 2.37 0.00 158 S 8.45 4.27 0.00 4.04 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 G 8.70 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 T 7.12 5.06 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 1.11 0.00 0.00 161 F 7.78 4.45 0.00 2.71 1.51 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 0.00 162 I 6.88 3.98 1.34 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 -0.05 0.65 0.00 0.00 163 T 7.89 4.35 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 164 D 8.60 4.98 0.00 2.74 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 0.00 165 K 8.83 5.13 0.00 2.01 2.09 0.00 1.27 0.00 0.00 2.61 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.41 7.81 166 T 8.42 4.77 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 1.39 0.00 0.00 167 V 8.45 4.68 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 0.79 0.00 0.00 0.93 0.00 0.00 168 L 8.59 4.68 0.00 1.76 1.68 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 169 D 8.70 4.99 0.00 2.63 2.58 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 0.00 0.00 0.00 170 M 8.89 4.11 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 171 K 8.17 4.48 0.00 1.90 1.86 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.39 1.49 7.81 172 A 7.76 3.92 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 M 8.33 4.78 0.00 1.91 2.19 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 174 D 7.55 4.27 0.00 2.64 2.39 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 0.00 175 S 8.63 4.15 0.00 3.78 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 0.00 176 K 8.04 4.57 0.00 1.59 1.90 0.00 1.63 0.00 0.00 1.59 0.00 0.00 3.32 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.76 7.81 177 S 8.79 4.46 0.00 3.72 3.56 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 0.00 178 N 8.40 4.77 0.00 1.79 1.71 0.00 0.00 6.79 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 0.00 179 G 8.85 5.05 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 0.00 180 A 8.40 5.16 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 I 8.00 5.38 2.31 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 1.57 1.48 1.14 0.00 0.00 182 A 9.45 5.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 W 8.03 6.30 0.00 3.50 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 0.00 184 S 8.97 5.68 0.00 3.98 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 0.00 185 N 8.77 4.81 0.00 2.90 3.15 0.00 0.00 5.94 7.44 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 0.00 186 Q 7.62 4.30 0.00 2.02 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.97 0.00 0.00 0.00 0.00 0.00 1.87 2.17 0.00 187 T 7.76 4.06 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 1.25 0.00 0.00 188 S 8.70 4.44 0.00 3.75 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 0.00 189 F 7.81 5.00 0.00 3.17 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 0.00 190 T 7.99 4.80 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 1.12 0.00 0.00 191 C 8.80 4.17 0.00 2.90 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 7.63 3.52 0.00 0.93 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.06 0.00 0.00 0.00 0.00 0.00 1.96 1.74 0.00 193 D 7.55 4.13 0.00 1.82 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 0.00 0.00 0.00 194 I 7.62 3.48 2.07 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 1.53 0.28 0.69 0.00 0.00 195 F 8.23 4.02 0.00 2.90 2.72 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 0.00 196 K 7.44 3.73 0.00 1.50 1.58 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.39 7.81 197 E 8.54 3.65 0.00 2.08 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 2.14 2.17 0.00 198 T 7.58 4.32 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 1.12 0.00 0.00 *203 N 8.71 5.43 0.00 2.76 2.92 0.00 0.00 7.13 7.96 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 0.00 204 A 7.36 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 205 T 7.82 4.21 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 1.02 0.00 0.00 206 Y 7.28 4.95 0.00 2.91 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 P 0.00 4.37 0.00 2.28 2.16 0.00 3.65 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 208 S 8.30 4.59 0.00 3.88 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 0.00 209 S 8.07 4.59 0.00 3.86 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 0.00 210 D 8.55 4.55 0.00 2.80 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 0.00 211 V 8.14 3.83 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 0.74 0.00 0.00 0.94 0.00 0.00 212 P 0.00 4.40 0.00 2.04 2.02 0.00 3.84 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 213 C 8.55 4.40 0.00 3.10 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 * Residues marked with a * may have inaccurate shift predictions.