NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4679 8.1627 120.3278 55.1252 33.4549 176.1418 2 D 4.2674 8.6241 122.8895 56.2253 41.2985 176.6047 3 K 3.8877 8.9279 120.3797 59.9374 32.5795 178.5476 4 I 3.9015 7.7350 119.1397 63.9989 37.0441 178.5076 5 K 4.0527 7.8245 118.5275 59.6208 31.9507 179.0320 6 Q 3.9896 8.4780 120.1414 59.0168 28.8844 178.0854 7 L 3.8913 7.9358 121.2831 58.2955 42.0661 179.0888 8 F 4.0141 8.3267 117.3552 60.3076 38.7475 177.5081 9 A 4.1091 8.5223 120.7872 55.3475 18.1758 179.3145 10 N 4.3236 8.7672 115.2900 56.5972 38.6324 177.1577 11 N 4.3923 8.3705 118.3292 56.8168 39.0147 176.2418 12 Y 4.1364 8.4433 121.1280 60.9591 38.9460 178.0951 13 S 4.0452 8.6263 114.2555 60.8059 62.4479 175.9344 14 W 4.0534 8.6073 131.1641 60.3637 30.3360 177.5378 15 A 3.2694 8.3229 119.7021 55.2829 17.8489 179.1144 16 Q 3.7723 7.6020 116.4221 59.1273 29.1199 178.0296 17 R 3.9160 7.5642 118.8773 60.2116 30.6493 178.5137 18 M 4.3107 7.5498 123.2666 54.2047 34.0369 178.8875 *30 A 4.1262 8.2656 121.6261 52.9833 19.3177 173.6210 31 D 4.6958 7.3365 119.6444 52.0557 45.2371 174.1383 32 H 4.2762 7.9681 115.3812 56.1995 29.0838 175.2556 33 Q 4.4974 8.2725 122.4165 54.9615 31.8898 174.2009 34 T 4.1124 8.4739 122.8030 62.4710 69.1701 172.6544 35 P 4.8888 0.0000 0.0000 62.7231 32.0324 175.8292 36 H 4.8805 9.4188 117.3498 55.7571 30.8191 173.4895 37 Y 5.1859 7.9299 115.7249 56.2364 42.7593 173.5268 38 L 5.2474 9.2001 125.8961 53.5728 44.1863 174.6917 39 W 5.0126 9.8638 135.0000 55.7703 33.2234 174.2702 40 I 4.8120 8.8347 129.4655 59.9781 38.6127 174.9495 41 G 4.5934 9.0098 114.7680 44.0362 0.0000 169.7873 42 C 5.1901 8.3037 119.9060 58.2026 32.4200 174.7655 43 S 4.0754 8.7711 122.4344 61.9415 62.2667 175.7850 44 D 4.2546 9.0301 119.8375 57.1759 41.3520 178.1802 45 S 3.7611 7.0645 113.4771 59.9372 58.6712 173.1145 46 R 4.0706 7.9641 122.4240 58.4485 30.4833 177.9647 47 V 3.6204 7.6214 117.4519 61.7449 31.9211 174.4018 48 P 4.1999 0.0000 0.0000 62.2200 33.1315 176.9922 49 A 3.2900 8.1834 123.1751 55.3211 17.9939 180.0399 50 E 3.6849 7.7082 116.2850 59.1458 29.3207 179.5103 51 K 3.8232 7.5356 119.3707 59.4233 32.3086 178.8628 52 L 3.9700 7.4094 118.9272 58.7645 40.3984 178.7191 53 T 3.9800 7.7309 109.1588 61.5442 70.0409 173.8090 54 N 4.0290 7.4354 119.7536 55.0348 37.5916 171.8925 55 L 4.8102 6.9425 113.8994 52.1806 45.6934 176.6456 56 E 4.0298 8.5180 120.4793 55.4649 29.9979 174.1897 57 P 4.3981 0.0000 0.0000 64.7527 31.6129 176.5808 58 G 4.0901 9.0288 111.1244 45.2469 0.0000 175.0438 59 E 4.0976 8.4687 119.6123 58.5730 29.7694 176.5375 60 L 5.3021 7.8372 117.9195 53.0757 43.6890 175.8589 61 F 4.9860 9.6644 126.5766 56.6117 41.3477 174.3016 62 V 4.8539 7.9448 125.9876 61.4107 33.6309 173.7338 63 H 4.9701 9.2154 128.2291 54.4237 32.3425 173.0605 64 R 5.6607 8.4872 123.3060 53.4190 33.5341 174.0366 65 N 4.9646 8.4722 119.4843 50.9459 41.8373 173.2749 66 V 3.8575 8.2368 119.0585 63.2709 31.9239 175.2906 67 A 3.7396 9.1242 130.1175 52.7967 16.2661 176.9114 68 N 4.3793 8.0915 112.7868 55.5805 35.9499 173.2545 69 Q 4.6220 9.0542 116.0413 55.0357 31.2438 176.9786 70 V 4.1708 8.7481 121.8303 61.0978 31.4095 174.3670 71 I 3.8826 7.5601 126.1852 59.8793 38.2187 176.9210 72 H 4.1685 8.5942 122.0848 58.6304 28.6334 176.2923 73 T 4.4741 7.5914 106.5908 60.8907 69.1879 173.5910 74 D 4.6673 8.1598 122.7533 54.1695 41.7021 176.3009 75 F 3.8547 8.9275 130.1492 61.1144 39.5762 176.1823 76 N 4.3564 8.6473 117.0058 57.0243 38.7987 176.4856 77 C 3.9382 8.4514 119.4537 62.3305 31.6320 175.5403 78 L 3.9085 8.0831 121.0064 57.7407 41.1776 179.6354 79 S 4.0740 8.0399 114.2441 61.0165 63.0001 176.7220 80 V 3.8114 7.7698 121.8984 65.8680 31.2056 178.0373 81 V 3.6010 7.9679 118.0734 66.1493 31.3374 177.7516 82 Q 3.8896 8.2950 119.3860 59.2980 28.8672 177.5677 83 Y 4.1536 8.2416 120.2991 60.6145 38.8512 177.8256 84 A 3.5989 8.4074 122.0356 55.0265 18.2525 179.8493 85 V 3.4030 7.9566 116.8880 66.3933 31.5167 177.9343 86 D 4.4534 8.2777 117.2542 55.7188 40.8704 177.3580 87 V 4.0299 7.3162 116.5915 64.4524 32.7348 176.6201 88 L 3.8858 7.3950 116.4595 54.6820 41.6392 177.1284 89 K 4.0196 7.7583 115.7921 56.0125 29.6093 175.4093 90 I 3.7510 7.6216 119.3282 61.8786 37.5132 176.1095 91 E 4.6689 8.6560 122.6453 56.6699 31.1943 175.0271 92 H 5.4707 7.8950 117.3447 54.2202 33.1609 172.0559 93 I 4.9703 8.9499 124.3502 59.4916 40.1613 174.5730 94 I 4.3778 8.7974 127.8534 59.3190 40.1458 174.5133 95 I 4.3144 8.5690 128.6121 60.0019 38.8123 174.2374 96 C 4.9820 8.6127 128.8514 57.5738 33.5005 173.8544 97 G 4.3412 9.0188 115.4708 44.1337 0.0000 170.9302 98 H 5.9126 8.6143 113.1737 55.4287 30.9320 173.7994 99 T 4.0213 8.6181 110.1074 60.9065 69.8550 173.3539 100 N 3.9940 8.3512 118.5465 54.4546 37.4107 175.0243 101 C 4.3162 7.6707 118.4782 58.8258 33.0134 172.4482 102 G 3.9251 8.6135 115.7043 48.1576 0.0000 175.3225 103 G 3.6906 8.2629 107.4748 47.5637 0.0000 175.6679 104 I 3.7245 7.7664 122.0742 64.3562 37.1083 178.0263 105 H 3.9748 8.4193 116.7545 58.8935 28.3483 177.7057 106 A 4.0458 8.3531 121.3457 55.1910 18.2713 179.2357 107 A 4.1714 8.3451 118.8118 55.4195 18.5562 179.2278 108 M 4.2303 7.7981 115.2231 56.0519 32.4012 176.7938 109 A 4.3625 7.1591 121.5828 51.9283 19.3307 176.6583 110 D 4.8197 8.3947 117.1223 53.9508 41.9303 176.8462 111 K 4.1620 7.8151 117.7826 57.1082 32.7059 175.9790 112 D 4.7088 8.5700 122.9299 53.5780 41.2671 176.3671 113 L 4.4993 8.8593 123.4102 54.3099 43.2738 177.5264 114 G 4.0000 7.9364 105.0645 44.2210 0.0000 175.4612 115 L 3.9603 8.7501 119.8445 58.4394 42.0258 179.1384 116 I 3.7961 7.8976 117.8911 64.2342 37.9321 177.2252 117 N 4.4328 8.3069 117.4517 56.5248 38.1007 177.0054 118 N 4.4227 8.0548 116.9699 55.9114 39.0505 176.8419 119 W 4.3567 8.3378 129.4079 60.5307 31.0040 177.5230 120 L 4.3691 8.1626 117.7455 56.5307 41.2114 178.9883 121 L 4.0713 7.7424 119.2371 57.9979 41.5550 179.0358 122 H 4.1335 7.6820 115.1153 58.8058 28.5537 177.8712 123 I 3.8564 7.6965 121.2586 64.4084 36.9749 178.5120 124 R 4.4515 8.1319 118.8002 59.3494 29.7606 178.8483 125 D 4.4272 8.4066 118.9328 57.4099 40.9329 178.8686 126 I 3.8499 7.7664 119.9304 64.0192 36.9002 178.0178 127 W 4.5033 8.6144 128.6229 60.7300 30.8165 177.4124 128 F 4.0360 8.6531 120.5642 61.2317 38.6398 176.6632 129 K 3.9105 8.3198 118.2331 58.9261 32.2927 176.6171 130 H 4.9572 8.2332 116.0324 54.8682 29.8293 176.7308 131 G 3.5613 8.0790 108.3793 48.2586 0.0000 175.0640 132 H 4.0725 7.9825 119.0565 58.6986 29.9720 176.4681 133 L 4.1010 7.9427 121.6017 58.4309 41.8606 178.7969 134 L 4.2493 8.1386 118.2939 56.9890 41.4305 179.2023 135 G 3.7728 8.1530 104.7530 46.5877 0.0000 175.0763 136 K 4.2539 7.6061 118.7730 56.5149 32.5182 176.4512 137 L 4.7789 6.7588 119.1090 52.4058 44.5936 176.8132 138 S 4.4719 8.1609 115.4998 57.4222 65.1939 173.3459 139 P 4.2848 0.0000 0.0000 65.7338 30.4090 178.4495 140 E 3.8983 8.0571 117.6084 59.4248 29.8327 178.9915 141 K 4.0339 7.7950 117.1342 59.0696 31.9974 179.4380 142 R 3.7809 8.4490 119.5805 59.2610 29.9658 178.3987 143 A 3.7308 7.5822 120.4807 55.1832 18.4998 179.2876 144 D 4.2698 7.6477 116.4351 57.7559 40.8485 178.8247 145 M 4.0985 7.8574 118.1804 58.4329 32.1981 178.0436 146 L 3.9031 8.0683 120.6988 58.2211 41.7709 179.0508 147 T 3.8438 7.9372 115.9093 66.5119 68.3137 176.7524 148 K 4.0348 7.6619 119.0885 59.5802 32.0991 179.5522 149 I 3.6945 7.8920 120.1720 64.2022 36.8976 177.8958 150 N 4.2941 8.4075 118.1750 56.7408 38.7579 177.0119 151 V 3.5685 7.5663 118.8298 65.9661 31.6248 177.6867 152 A 4.1135 7.8640 120.1071 55.5208 18.2021 179.5488 153 E 4.1534 8.6032 117.0956 59.6533 29.5117 179.6222 154 Q 4.0802 8.4392 118.3649 58.6930 28.7613 178.6845 155 V 3.5998 8.0643 119.5703 65.9435 31.3963 177.5068 156 Y 4.1128 8.0121 119.2911 60.9191 38.4532 177.5742 157 N 4.1716 8.2932 116.3849 56.3865 38.9478 176.8336 158 L 4.1085 7.9594 121.7444 57.8475 42.0444 178.6730 159 G 3.7796 7.8721 103.1211 45.9859 0.0000 174.7930 160 R 4.2421 7.1223 119.1313 55.5999 31.0962 176.8198 161 T 3.9608 6.8180 110.1161 61.0924 69.5511 175.4869 162 S 4.0235 8.5825 118.5412 61.7728 62.8905 176.9434 163 I 3.5488 7.4397 122.7377 64.1561 36.9406 178.4354 164 V 3.1233 7.3565 118.7517 65.5145 31.2978 178.0889 165 K 3.9483 7.8016 118.2928 59.7706 31.9175 179.5197 166 S 4.1310 8.2703 115.2737 61.2580 62.7080 176.4343 167 A 3.9455 7.6855 123.1772 55.0858 18.1134 179.7666 168 W 4.3914 7.9397 117.3368 60.0051 28.9173 178.3790 169 E 4.0671 8.2808 118.4283 58.9842 29.1875 178.1863 170 R 4.3490 7.9188 113.2718 56.3186 29.9002 176.9663 171 G 3.8984 7.9859 107.7541 45.9492 0.0000 173.3900 172 Q 4.1235 7.9002 120.1903 54.9383 29.6436 175.4419 173 K 4.2929 8.5104 126.1453 55.7911 32.3673 175.8568 174 L 4.9011 8.5287 128.2563 54.0155 45.6022 173.9528 175 S 5.2607 9.5566 121.4184 56.5994 66.4243 172.7692 176 L 5.1842 8.9524 122.3811 53.4801 44.2773 175.2177 177 H 5.0513 9.1749 119.7089 53.8332 33.4300 172.8794 178 G 4.1784 8.3880 107.9843 44.4447 0.0000 171.6212 179 W 5.7959 9.2163 125.8239 54.6041 33.8920 174.6960 180 V 4.9153 8.9533 121.6392 61.1606 33.8352 174.2071 181 F 4.9919 9.5480 131.4800 57.9481 40.7498 173.4620 182 D 4.6673 8.2008 126.6330 52.3060 42.0327 176.9911 183 V 3.2524 7.9916 126.3463 64.8548 31.9810 176.8972 184 N 4.4239 8.0520 117.1036 55.5669 38.3775 175.3597 185 D 4.3719 7.6199 113.8047 52.0174 40.6646 176.7682 186 G 3.8380 7.9823 108.3082 45.4636 0.0000 173.3305 187 F 5.1188 7.8003 118.7064 56.3615 41.0533 174.9134 188 L 4.9676 8.6160 122.2831 54.1475 42.6829 176.1939 189 V 4.2348 8.9675 125.1196 60.8430 33.3706 174.3020 190 D 5.0297 8.6205 128.6335 54.7339 41.4850 175.8331 191 Q 4.3023 9.1874 124.0225 56.2444 28.8682 176.5242 192 G 3.9582 9.3152 108.6425 44.9564 0.0000 173.9169 193 V 4.0241 7.7205 120.1274 62.5621 32.5242 174.6776 194 M 5.6743 8.8719 127.4941 52.9283 34.9972 173.9896 195 A 4.9054 8.8164 127.3830 50.2237 22.3690 176.0565 196 T 4.7256 8.3527 109.7713 59.3804 69.7494 174.0576 197 S 2.7900 5.8100 115.8710 56.2743 66.0504 177.1327 198 R 3.9381 7.3885 121.6244 59.3069 29.7880 178.3390 199 E 3.9145 7.8498 118.3224 59.6597 29.6524 179.2961 200 T 3.8905 7.4952 109.3363 64.3299 68.7007 176.2937 201 L 4.0381 7.7602 123.4021 58.1253 42.1764 178.6790 202 E 4.1826 8.1486 118.3053 59.6312 29.4958 179.5260 203 I 3.7084 7.7701 119.8180 64.5635 37.1747 178.8248 204 S 4.3931 8.2646 114.9871 61.1799 62.9031 175.8163 205 Y 3.9999 8.1613 123.3014 60.7645 38.7283 178.2093 206 R 3.6334 7.9520 118.8810 59.2044 30.1306 178.8188 207 N 4.2653 8.6444 116.3571 56.2797 38.5649 177.3915 208 A 3.9384 8.1786 122.3933 54.9976 18.4978 179.6723 209 I 3.4103 7.4134 118.0547 64.4005 36.9490 178.2432 210 A 3.9290 7.3434 119.5901 55.2393 18.4433 179.2945 211 R 3.9415 7.9952 116.8635 59.7885 30.0215 178.7979 212 L 4.0660 8.2063 117.2121 57.3170 41.6177 178.7252 213 S 4.6703 7.6338 112.8438 57.4475 63.0724 173.9687 214 I 4.0207 7.1487 123.9890 60.7770 37.1131 176.0480 215 L 4.3271 8.4165 124.6619 54.8058 41.9407 176.4364 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 M 8.16 4.47 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.49 0.00 2 D 8.62 4.27 0.00 2.80 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 3 K 8.93 3.89 0.00 1.85 1.87 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.55 7.81 4 I 7.74 3.90 1.95 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 1.67 1.23 1.12 0.00 0.00 5 K 7.82 4.05 0.00 2.01 1.89 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.46 7.81 6 Q 8.48 3.99 0.00 2.43 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 7 L 7.94 3.89 0.00 1.93 1.79 0.83 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 8 F 8.33 4.01 0.00 3.28 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.52 4.11 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.77 4.32 0.00 2.91 2.90 0.00 0.00 6.72 6.79 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 11 N 8.37 4.39 0.00 2.68 2.97 0.00 0.00 6.90 7.16 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 12 Y 8.44 4.14 0.00 3.22 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 13 S 8.63 4.05 0.00 4.06 4.08 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 14 W 8.61 4.05 0.00 3.46 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.32 3.27 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.60 3.77 0.00 1.69 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.91 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 17 R 7.56 3.92 0.00 1.92 1.94 0.00 3.32 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 18 M 7.55 4.31 0.00 1.72 1.22 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 2.05 0.00 *30 A 8.27 4.13 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 D 7.34 4.70 0.00 2.58 2.53 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 32 H 7.97 4.28 0.00 3.27 3.25 0.00 5.70 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.27 4.50 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 34 T 8.47 4.11 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 35 P 0.00 4.89 0.00 2.11 2.22 0.00 3.19 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.71 0.00 36 H 9.42 4.88 0.00 2.64 2.86 0.00 5.60 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 7.93 5.19 0.00 2.96 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 38 L 9.20 5.25 0.00 1.97 1.66 1.21 1.19 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 39 W 9.86 5.01 0.00 3.49 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 40 I 8.83 4.81 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.52 0.97 0.00 0.00 41 G 9.01 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 42 C 8.30 5.19 0.00 3.32 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 43 S 8.77 4.08 0.00 3.77 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 9.03 4.25 0.00 2.85 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 45 S 7.06 3.76 0.00 4.13 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 46 R 7.96 4.07 0.00 1.85 2.00 0.00 3.28 0.00 0.00 2.72 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 47 V 7.62 3.62 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 0.60 0.00 0.00 1.04 0.00 0.00 48 P 0.00 4.20 0.00 2.02 1.80 0.00 3.54 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.03 0.00 49 A 8.18 3.29 -0.14 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 50 E 7.71 3.68 0.00 1.91 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 2.30 2.26 0.00 51 K 7.54 3.82 0.00 1.71 1.79 0.00 1.65 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.44 7.81 52 L 7.41 3.97 0.00 1.71 1.41 0.98 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.73 3.98 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 54 N 7.44 4.03 0.00 2.76 2.85 0.00 0.00 6.98 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 6.94 4.81 0.00 1.69 1.61 0.70 0.88 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 56 E 8.52 4.03 0.00 2.09 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 2.42 2.43 0.00 57 P 0.00 4.40 0.00 2.10 2.04 0.00 3.72 0.00 0.00 3.79 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 58 G 9.03 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 59 E 8.47 4.10 0.00 2.20 2.37 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 2.46 2.73 0.00 60 L 7.84 5.30 0.00 1.51 1.62 0.45 0.73 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 61 F 9.66 4.99 0.00 3.10 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 62 V 7.94 4.85 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 0.85 0.00 0.00 0.88 0.00 0.00 63 H 9.22 4.97 0.00 3.23 3.14 0.00 5.77 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 64 R 8.49 5.66 0.00 1.61 1.74 0.00 3.30 0.00 0.00 4.01 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.43 0.00 65 N 8.47 4.96 0.00 2.75 2.88 0.00 0.00 5.91 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 66 V 8.24 3.86 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 0.90 0.00 0.00 0.80 0.00 0.00 67 A 9.12 3.74 1.49 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 0.00 0.00 68 N 8.09 4.38 0.00 3.00 3.17 0.00 0.00 6.04 7.23 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 69 Q 9.05 4.62 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.57 0.00 70 V 8.75 4.17 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 0.73 0.00 0.00 0.90 0.00 0.00 71 I 7.56 3.88 1.56 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.14 0.57 0.00 0.00 72 H 8.59 4.17 0.00 3.09 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.59 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 1.22 0.00 0.00 74 D 8.16 4.67 0.00 2.93 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 75 F 8.93 3.85 0.00 3.28 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 76 N 8.65 4.36 0.00 2.92 3.22 0.00 0.00 6.77 7.70 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 77 C 8.45 3.94 0.00 3.15 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 78 L 8.08 3.91 0.00 1.77 1.46 0.76 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.04 4.07 0.00 4.12 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 80 V 7.77 3.81 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 1.29 0.00 0.00 1.02 0.00 0.00 81 V 7.97 3.60 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.98 0.00 0.00 82 Q 8.29 3.89 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 83 Y 8.24 4.15 0.00 3.16 3.27 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 84 A 8.41 3.60 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.96 3.40 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 0.91 0.00 0.00 0.90 0.00 0.00 86 D 8.28 4.45 0.00 2.75 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 87 V 7.32 4.03 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 0.74 0.00 0.00 1.00 0.00 0.00 88 L 7.39 3.89 0.00 1.43 1.35 -0.21 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 89 K 7.76 4.02 0.00 1.80 1.82 0.00 1.77 0.00 0.00 2.46 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.28 7.81 90 I 7.62 3.75 1.94 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.31 1.03 0.00 0.00 91 E 8.66 4.67 0.00 1.71 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 0.00 2.39 2.39 0.00 92 H 7.90 5.47 0.00 3.13 3.32 0.00 5.56 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 8.95 4.97 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.86 0.88 0.00 0.00 94 I 8.80 4.38 1.33 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.67 -0.60 0.00 0.00 95 I 8.57 4.31 1.71 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.45 0.83 0.00 0.00 96 C 8.61 4.98 0.00 1.77 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 97 G 9.02 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 H 8.61 5.91 0.00 3.40 3.47 0.00 5.15 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 8.62 4.02 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 1.17 0.00 0.00 100 N 8.35 3.99 0.00 2.77 2.81 0.00 0.00 6.96 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 0.00 101 C 7.67 4.32 0.00 3.11 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 0.00 102 G 8.61 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 0.00 103 G 8.26 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 0.00 0.00 0.00 0.00 104 I 7.77 3.72 1.97 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.82 0.83 0.00 0.00 105 H 8.42 3.97 0.00 3.39 3.35 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.35 4.05 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 0.00 107 A 8.35 4.17 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 M 7.80 4.23 0.00 1.68 1.99 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 1.38 0.00 109 A 7.16 4.36 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 0.00 110 D 8.39 4.82 0.00 2.71 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 0.00 111 K 7.82 4.16 0.00 1.82 1.75 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.49 7.81 112 D 8.57 4.71 0.00 2.68 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 0.00 113 L 8.86 4.50 0.00 1.66 1.72 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 114 G 7.94 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 0.00 115 L 8.75 3.96 0.00 1.79 1.71 0.96 0.82 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 0.00 116 I 7.90 3.80 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.17 0.96 0.00 0.00 117 N 8.31 4.43 0.00 3.14 2.92 0.00 0.00 6.93 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 N 8.05 4.42 0.00 2.95 2.95 0.00 0.00 6.98 7.61 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 0.00 119 W 8.34 4.36 0.00 3.46 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.16 4.37 0.00 1.98 1.79 1.03 0.94 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 0.00 121 L 7.74 4.07 0.00 1.78 1.65 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 122 H 7.68 4.13 0.00 3.03 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 I 7.70 3.86 2.08 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.85 0.97 0.00 0.00 124 R 8.13 4.45 0.00 2.13 2.09 0.00 3.40 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 125 D 8.41 4.43 0.00 2.94 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 0.00 126 I 7.77 3.85 2.15 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.37 1.06 0.00 0.00 127 W 8.61 4.50 0.00 3.33 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 0.00 128 F 8.65 4.04 0.00 3.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.32 3.91 0.00 2.00 2.13 0.00 1.90 0.00 0.00 1.82 0.00 0.00 3.14 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.52 7.81 130 H 8.23 4.96 0.00 3.32 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 8.08 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 0.00 132 H 7.98 4.07 0.00 3.10 3.31 0.00 5.75 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 L 7.94 4.10 0.00 1.82 1.84 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.14 4.25 0.00 2.06 1.80 1.09 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 135 G 8.15 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 0.00 0.00 0.00 136 K 7.61 4.25 0.00 1.83 1.85 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.52 7.81 137 L 6.76 4.78 0.00 1.68 1.53 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 138 S 8.16 4.47 0.00 4.05 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 0.00 139 P 0.00 4.28 0.00 2.17 2.14 0.00 3.60 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 2.13 2.18 0.00 140 E 8.06 3.90 0.00 2.02 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 2.36 2.40 0.00 141 K 7.79 4.03 0.00 1.82 1.81 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.57 7.81 142 R 8.45 3.78 0.00 1.84 1.97 0.00 2.82 0.00 0.00 2.67 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.46 0.00 143 A 7.58 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 D 7.65 4.27 0.00 2.80 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 0.00 145 M 7.86 4.10 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 146 L 8.07 3.90 0.00 1.64 1.51 0.94 0.70 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 0.00 147 T 7.94 3.84 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 1.28 0.00 0.00 148 K 7.66 4.03 0.00 2.03 1.98 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.59 1.48 7.81 149 I 7.89 3.69 1.81 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.64 0.73 0.00 0.00 150 N 8.41 4.29 0.00 2.96 3.03 0.00 0.00 6.81 8.19 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 0.00 151 V 7.57 3.57 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.10 0.00 0.00 152 A 7.86 4.11 1.45 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 0.00 0.00 153 E 8.60 4.15 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.65 0.00 154 Q 8.44 4.08 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.68 2.73 0.00 155 V 8.06 3.60 2.31 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 1.06 0.00 0.00 1.07 0.00 0.00 156 Y 8.01 4.11 0.00 2.94 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 0.00 157 N 8.29 4.17 0.00 2.79 2.88 0.00 0.00 7.07 7.47 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 0.00 158 L 7.96 4.11 0.00 1.81 1.88 0.82 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 159 G 7.87 3.78 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 0.00 160 R 7.12 4.24 0.00 1.63 1.75 0.00 2.21 0.00 0.00 2.74 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.20 0.00 161 T 6.82 3.96 4.11 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 1.19 0.00 0.00 162 S 8.58 4.02 0.00 4.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 I 7.44 3.55 1.73 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 1.43 0.97 0.80 0.00 0.00 164 V 7.36 3.12 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 -0.51 0.00 0.00 0.69 0.00 0.00 165 K 7.80 3.95 0.00 1.78 1.88 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.55 7.81 166 S 8.27 4.13 0.00 3.82 3.87 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 0.00 167 A 7.69 3.95 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 0.00 168 W 7.94 4.39 0.00 3.63 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 0.00 169 E 8.28 4.07 0.00 2.14 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 2.35 2.39 0.00 170 R 7.92 4.35 0.00 2.03 2.03 0.00 3.12 0.00 0.00 3.22 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.65 0.00 171 G 7.99 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Q 7.90 4.12 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 173 K 8.51 4.29 0.00 1.78 1.72 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.45 7.81 174 L 8.53 4.90 0.00 1.78 1.58 0.92 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 175 S 9.56 5.26 0.00 3.91 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 L 8.95 5.18 0.00 1.65 1.59 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 177 H 9.17 5.05 0.00 2.17 2.70 0.00 5.56 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 0.00 178 G 8.39 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 W 9.22 5.80 0.00 3.22 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 0.00 180 V 8.95 4.92 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 1.02 0.00 0.00 1.01 0.00 0.00 181 F 9.55 4.99 0.00 3.38 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 D 8.20 4.67 0.00 2.66 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 V 7.99 3.25 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 0.97 0.00 0.00 1.02 0.00 0.00 184 N 8.05 4.42 0.00 2.76 2.77 0.00 0.00 6.74 8.08 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 0.00 185 D 7.62 4.37 0.00 1.86 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 G 7.98 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 0.00 0.00 0.00 187 F 7.80 5.12 0.00 3.07 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 0.00 188 L 8.62 4.97 0.00 1.38 1.38 1.06 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 189 V 8.97 4.23 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 1.00 0.00 0.00 0.98 0.00 0.00 190 D 8.62 5.03 0.00 2.63 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 0.00 191 Q 9.19 4.30 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.18 0.00 0.00 0.00 0.00 0.00 2.48 2.53 0.00 192 G 9.32 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 0.00 193 V 7.72 4.02 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 1.11 0.00 0.00 1.05 0.00 0.00 194 M 8.87 5.67 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.62 0.00 195 A 8.82 4.91 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 T 8.35 4.73 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 197 S 5.81 2.79 0.00 3.65 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 0.00 198 R 7.39 3.94 0.00 2.14 1.98 0.00 3.49 0.00 0.00 3.47 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.83 0.00 199 E 7.85 3.91 0.00 1.99 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 2.35 2.39 0.00 200 T 7.50 3.89 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 201 L 7.76 4.04 0.00 2.03 2.05 1.16 1.15 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 0.00 202 E 8.15 4.18 0.00 2.27 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 0.00 2.46 2.59 0.00 203 I 7.77 3.71 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.79 0.91 0.00 0.00 204 S 8.26 4.39 0.00 4.29 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 0.00 205 Y 8.16 4.00 0.00 3.12 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 0.00 206 R 7.95 3.63 0.00 2.04 1.91 0.00 3.29 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 207 N 8.64 4.27 0.00 2.86 2.84 0.00 0.00 6.93 7.10 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 0.00 208 A 8.18 3.94 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 0.00 209 I 7.41 3.41 1.50 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.63 0.83 0.00 0.00 210 A 7.34 3.93 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 R 8.00 3.94 0.00 1.97 2.09 0.00 3.10 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 212 L 8.21 4.07 0.00 1.76 1.68 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 213 S 7.63 4.67 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 0.00 214 I 7.15 4.02 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 1.28 0.73 0.90 0.00 0.00 215 L 8.42 4.33 0.00 1.59 1.52 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.