NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4748 8.3349 115.3037 58.3615 64.2146 174.8171 3 V 3.6294 7.8317 111.6397 62.2881 31.8122 174.3370 4 I 4.1630 8.5195 122.4784 59.9462 37.6345 174.9566 5 K 4.8175 8.2139 124.4825 53.8395 34.4848 175.7168 6 P 4.8209 0.0000 0.0000 65.1999 31.5338 176.1096 7 D 5.2326 7.6747 114.4959 52.8196 43.7884 175.3664 8 M 5.0324 9.1749 121.9921 53.6534 37.1077 175.0055 9 K 5.0326 8.9760 120.9812 55.6062 35.1018 175.6466 10 I 5.1827 8.5434 120.8970 59.7922 41.5005 174.9035 11 K 4.8596 8.9731 125.4552 53.3976 35.9790 175.0992 12 L 5.0092 8.1475 124.5626 54.0221 45.9804 173.6112 13 R 5.1495 8.8979 125.1135 54.8409 33.6723 173.0739 14 M 5.2525 9.7351 126.4740 53.8998 34.8959 173.9898 15 E 4.8540 8.6868 125.5226 54.8957 32.8198 175.5623 16 G 4.1684 8.0057 108.9608 46.2196 0.0000 171.4143 17 A 5.4707 8.8880 119.8821 50.6871 23.3245 175.7991 18 V 4.7394 8.7208 119.8601 61.6930 34.6756 175.4964 19 N 4.2810 10.4348 125.9694 54.2756 36.7085 175.5204 20 G 3.8721 8.6606 105.2039 45.5079 0.0000 173.6320 21 H 4.8067 8.1161 118.3500 53.5159 29.4613 172.8239 22 P 5.3581 0.0000 0.0000 62.9021 32.7185 175.0821 23 F 5.2347 8.6534 114.5816 56.3616 41.9113 172.5660 24 A 5.2188 9.1106 120.1529 50.5929 22.8644 175.3076 25 I 5.2226 9.1670 121.0074 59.7017 41.7858 174.3993 26 E 5.2628 9.4166 124.8700 54.7133 33.5030 175.2236 27 G 4.4372 8.9541 108.4060 44.7117 0.0000 171.6010 28 V 4.7994 8.5008 121.0025 61.3114 35.5604 174.9303 29 G 4.4424 8.8019 112.2940 46.1755 0.0000 171.3083 30 L 5.2631 8.7062 118.2540 53.6507 46.6491 175.6810 31 G 4.1329 9.2718 108.7130 45.2033 0.0000 171.9899 32 K 5.4019 9.1986 119.9508 52.7566 33.2005 175.5141 33 P 4.3255 0.0000 0.0000 65.3917 31.4807 178.3934 34 F 4.5746 7.7991 115.0576 59.4853 39.1776 176.0287 35 E 4.3815 8.3069 118.3512 55.9988 30.3231 175.9086 36 G 3.9506 8.4838 107.2320 46.6414 0.0000 173.0240 37 K 5.3456 7.8828 116.8508 54.5402 36.7867 175.8376 38 Q 4.7597 8.6642 119.4765 55.3883 32.2926 173.0965 39 S 5.0862 8.8324 115.4904 57.0870 66.2528 172.5276 40 M 5.1632 9.1334 122.9534 53.9690 35.2073 173.1339 41 D 5.3274 8.9453 120.6669 52.7917 43.4902 175.4172 42 L 5.2003 9.0661 123.1083 52.7715 45.5692 175.6387 43 K 5.1205 9.0545 122.1589 54.3521 35.7031 175.7262 44 V 4.1688 8.6141 126.1383 63.2396 31.2916 175.6555 45 K 4.5817 9.4375 127.4591 57.4037 34.0664 176.5489 46 E 4.6065 8.0703 117.5482 55.7152 34.1013 176.3884 47 G 3.8590 9.1426 110.2474 45.9613 0.0000 174.0847 48 G 3.8537 7.8277 107.8728 44.0173 0.0000 172.1171 49 P 4.4535 0.0000 0.0000 61.4623 32.3249 176.3280 50 L 3.6658 8.2797 121.7506 54.7592 41.7138 174.9965 51 P 4.6230 0.0000 0.0000 62.3638 31.4648 175.1773 52 F 4.8862 6.6021 111.8757 54.8064 41.2682 173.9030 53 A 3.7830 8.4689 124.8119 52.2274 18.4505 178.2984 54 Y 3.8023 8.1822 124.3036 60.8076 38.9262 177.7290 55 D 4.6913 8.3094 119.7017 57.3901 40.5973 178.5248 56 I 4.5373 7.6019 113.2299 62.6920 37.8786 177.2892 57 L 4.0274 8.1629 121.0395 55.9611 41.7041 178.6798 58 T 4.3488 7.8756 108.6052 64.8989 68.8217 176.0333 59 T 3.9736 8.0336 109.6691 62.6921 69.4290 175.3772 60 V 4.1784 7.7490 122.1668 65.4807 32.4950 177.0517 61 F 4.8028 7.0492 118.5145 57.5293 36.7428 176.3580 *65 N 4.5648 7.6659 118.7874 53.4734 39.0025 173.9945 66 R 3.8978 8.4467 124.2740 56.7942 29.9366 177.7191 67 V 3.5980 7.4916 116.5048 65.9233 32.2016 176.4524 68 F 4.6627 7.5314 120.7302 55.8451 37.3810 175.1500 69 A 4.8974 7.2861 121.0827 50.0151 22.9349 177.0351 70 K 4.3036 9.1418 124.2689 56.3728 33.1785 175.0943 71 Y 4.9004 8.6993 126.1304 55.5709 39.6298 174.4830 72 P 4.6034 0.0000 0.0000 61.9439 32.4596 176.9030 73 E 4.0069 8.8752 117.7209 59.4320 29.2251 177.6064 74 N 4.7316 8.1218 113.7521 52.6915 37.9080 174.4066 75 I 4.5430 7.4288 119.7505 59.2767 39.9041 175.6049 76 V 3.5556 8.4141 125.1091 62.9023 31.6937 175.1346 77 D 3.8098 8.1527 126.5954 52.2648 40.5635 175.6506 78 Y 3.7586 7.8464 127.4154 60.3227 38.9016 177.5168 79 F 3.8946 7.1949 117.9295 60.4272 38.9470 177.9589 80 K 4.2255 8.4634 117.9755 59.4420 31.5287 179.4938 81 Q 4.2065 7.4863 117.6419 58.6139 28.7916 178.3732 82 S 3.9748 7.5828 114.8542 59.9129 62.9966 174.5736 83 F 4.7893 6.8657 121.2776 56.1169 39.4465 174.1078 84 P 4.6945 0.0000 0.0000 65.4038 31.7153 177.6326 85 E 3.9255 8.2331 118.5628 58.4410 29.7751 177.1907 86 G 2.9082 9.4599 104.2643 45.3577 0.0000 171.0080 87 Y 5.3289 7.6383 114.7142 55.9517 41.6427 173.6306 88 S 5.1879 9.2891 114.4810 56.3225 66.8778 172.7593 89 W 5.8874 8.6895 116.7562 55.1699 31.8846 173.6655 90 E 5.3085 9.2521 119.6466 54.9364 33.4065 174.8072 91 R 5.0984 9.3769 122.6922 54.9100 34.2587 173.6212 92 S 5.1176 8.7784 119.8481 56.8826 66.1221 173.1568 93 M 4.7511 8.9659 121.6803 53.7871 35.3146 173.9893 94 N 5.0046 8.8924 124.5707 52.0419 40.6400 173.5560 95 Y 4.8289 9.0471 125.4222 56.9289 39.1972 177.1955 96 E 4.1188 8.6821 120.6111 58.9690 29.8386 177.5103 97 D 4.7225 8.5113 117.5470 53.1238 39.6537 177.2428 98 G 3.9361 8.4708 109.3772 45.0486 0.0000 174.5506 99 G 2.8927 7.5269 106.7014 46.4426 0.0000 172.7442 100 I 5.2140 8.0242 123.7555 59.5844 41.9459 173.2111 101 C 5.2305 9.3787 126.8823 57.9610 31.4416 172.5020 102 N 5.3766 8.8291 120.5367 51.4400 41.0303 173.6965 103 A 5.2073 9.0716 124.2594 50.4846 23.3737 174.9142 104 T 4.6157 8.5190 109.1411 59.8676 72.9729 172.4893 105 N 4.7952 7.6494 120.6729 51.9701 42.7046 172.2880 106 D 4.8920 8.6901 126.2197 52.6383 43.0323 174.6391 107 I 5.1435 8.2429 127.6486 59.8607 39.6323 175.1333 108 T 4.8521 9.1811 116.6302 59.7156 72.7551 172.2815 109 L 5.0840 8.6385 122.8312 53.3183 44.7291 175.1243 110 D 4.7302 9.0871 126.3721 52.8656 43.4514 177.7513 111 G 3.8998 8.7434 120.4372 47.0295 0.0000 172.4964 112 D 4.6590 9.0157 123.1605 53.5887 41.5850 174.3377 113 C 5.1140 7.6525 120.2716 57.6593 34.6527 172.7774 114 Y 4.8114 8.7418 124.6145 57.9729 39.1642 174.6674 115 I 5.0053 9.3442 124.5010 59.8739 40.4437 173.9386 116 Y 5.2613 9.0529 125.5739 56.3325 40.5926 174.4593 117 E 4.7391 8.9954 125.1101 54.7242 31.9913 174.3342 118 I 4.9425 8.5893 128.3579 59.3773 40.3764 174.8189 119 R 5.1509 8.4029 126.3238 54.4890 33.1382 174.2242 120 F 5.1197 8.8324 126.9913 56.6533 43.0562 173.0278 121 D 5.1626 8.8907 125.7703 52.7387 44.8134 174.5860 122 G 4.6146 9.1782 110.9005 44.4938 0.0000 172.0243 123 V 4.7920 8.1622 115.5086 59.7312 36.4957 175.3488 124 N 4.0209 8.8373 116.5100 54.3553 35.6599 174.4764 125 F 4.3585 7.9516 117.8915 56.2056 39.4279 174.1945 126 P 4.3825 0.0000 0.0000 62.2214 31.8257 177.3963 127 A 3.9877 8.7423 125.4063 55.0087 18.3872 178.2055 128 N 4.7148 8.0470 110.7464 53.6842 38.3867 176.0384 129 G 3.8666 7.9981 107.5678 43.3127 0.0000 172.7081 130 P 4.1855 0.0000 0.0000 65.0751 31.0861 178.9647 131 V 3.3135 7.3172 118.1290 66.2885 31.4555 177.7841 132 M 4.1502 7.8457 116.0159 57.4646 31.9818 177.5370 133 Q 4.2602 7.8164 116.1177 54.3035 30.2482 175.3148 134 K 3.6736 7.6161 118.3388 58.1655 29.5670 175.2486 135 R 4.6830 8.3895 113.2843 56.1739 31.8432 177.6575 136 T 4.6751 7.7305 108.9373 61.0410 70.2664 173.5877 137 V 4.3699 8.1269 121.3600 63.6538 33.4188 175.5063 138 K 4.5139 7.4025 116.5148 55.6917 35.4519 173.8053 139 W 4.9803 8.7993 121.5835 56.4074 29.8920 176.2825 140 E 4.3062 9.3611 124.7318 55.4169 29.7596 175.1057 141 P 4.4358 0.0000 0.0000 63.5841 32.1207 175.3926 142 S 4.8054 8.9624 116.9066 56.8326 67.3163 172.7725 143 T 4.9919 8.2363 115.5352 61.7690 71.0393 173.5118 144 E 4.5153 9.5092 128.8568 55.4866 31.4940 175.0359 145 K 4.7209 9.1467 126.4516 54.8555 34.3061 175.2213 146 L 5.1353 8.2974 125.5891 53.0301 44.6737 175.1841 147 Y 4.8182 7.8662 119.5807 55.8494 41.6457 173.6475 148 V 4.3528 8.3398 121.0018 62.2699 33.0625 175.4463 149 R 4.5049 8.4805 126.8019 56.0738 33.2049 174.6168 150 D 4.6171 9.7481 125.6169 55.6151 38.2487 174.6927 151 G 3.9085 8.3685 103.8899 45.8369 0.0000 173.0459 152 V 4.5511 7.3801 111.9501 59.2756 36.4006 173.7434 153 L 4.6133 8.0166 122.6423 53.4158 44.0065 175.3041 154 K 4.8652 8.6423 124.9356 54.5180 35.6789 175.3711 155 G 4.7073 8.6612 108.8887 43.6217 0.0000 171.1748 156 D 5.7843 9.3075 124.8711 52.5304 44.6705 175.5496 157 V 4.6713 8.3997 120.9699 60.4583 35.2485 173.2355 158 N 4.8220 8.7739 122.2843 52.9822 38.9913 174.2949 159 M 4.6867 9.1195 123.8903 53.4578 35.6109 175.1695 160 A 5.0831 8.4585 121.7263 50.4975 23.0931 174.4948 161 L 4.7522 9.0278 125.5446 53.1620 44.0256 175.9175 162 S 4.6294 9.2023 122.0271 58.5084 63.8039 172.7610 163 L 5.2175 8.3496 124.7676 52.3822 45.0878 175.7037 164 E 3.9379 8.7935 121.2237 57.6454 30.0142 177.5851 165 G 3.6009 9.2176 112.5662 46.6800 0.0000 174.5917 166 G 3.6766 8.0410 108.2888 44.9737 0.0000 174.6181 167 G 3.9950 8.3438 106.3974 45.2277 0.0000 171.8131 168 H 5.5202 8.3816 114.1764 53.9629 32.9801 172.8082 169 Y 5.0443 9.2016 122.2046 56.2099 41.1573 174.9358 170 R 4.9780 9.4041 126.4636 55.6209 32.7079 175.1908 171 C 4.9325 8.9703 121.0366 58.1394 35.7309 172.1577 172 D 5.1613 8.8517 125.4453 52.7588 42.9569 175.1449 173 F 5.2633 9.1502 122.8572 55.7938 41.6967 175.0879 174 K 4.7127 8.9419 122.1803 55.1398 35.4146 175.2684 175 T 4.9064 8.9790 122.4657 61.8188 71.8190 173.5875 176 T 4.8203 8.5288 121.5252 61.9518 71.7103 172.6251 177 Y 5.5507 9.2289 124.1644 56.3291 41.0486 175.1327 178 K 4.8757 9.7109 122.6022 54.4985 35.7498 175.8579 179 A 4.2869 9.2560 128.0310 51.3551 19.1970 176.9801 180 K 4.4536 8.1350 118.7676 55.8181 32.7574 176.7257 181 K 4.2146 7.2250 116.1182 55.3641 34.6938 174.4709 182 V 3.6858 8.3410 123.9453 62.9402 31.7357 175.6974 183 V 4.4703 7.8295 119.1870 58.9436 35.4408 174.9398 184 Q 4.1062 8.4925 122.8206 56.0777 29.3954 175.5670 185 L 4.5755 8.2135 124.7442 52.9242 43.1342 174.8080 186 P 4.5769 0.0000 0.0000 61.8502 32.4993 175.6306 187 D 4.5931 8.2970 119.1513 53.8325 41.4789 175.5657 188 Y 4.2970 8.3882 121.6791 59.3518 39.2858 175.1175 189 H 4.4126 8.1908 120.1941 55.0636 32.5741 171.9558 190 F 5.2944 8.6012 115.6522 55.7578 43.2733 174.8128 191 V 4.6735 8.7161 121.1700 61.1787 34.4570 174.3375 192 D 5.1160 9.1932 128.9411 54.5262 42.2866 175.2921 193 H 5.4790 9.1908 119.1722 54.3245 33.1392 172.1668 194 H 5.2324 9.1225 118.6267 53.9902 32.0510 172.5372 195 I 5.2340 8.4277 122.1873 59.3837 41.3269 173.9346 196 E 4.7669 9.2056 129.0376 54.8385 33.4655 173.9537 197 I 4.3994 8.6485 127.9940 61.2887 36.7700 175.9558 198 K 4.3222 9.0081 128.9150 59.1387 32.6130 177.6840 199 S 4.6918 7.7424 112.3517 57.9011 66.1221 173.1447 200 H 4.9237 7.8570 113.9748 54.5405 30.6477 173.0181 201 D 4.3989 8.3998 120.3201 53.9388 41.7409 177.4634 202 K 3.6793 8.7456 121.2081 59.6225 31.9181 177.0940 203 D 4.8037 7.9521 113.9765 52.8957 39.5120 175.6859 204 Y 3.2842 7.4320 114.9087 59.3156 35.9960 170.7956 205 S 4.3558 8.1328 117.9066 60.6164 63.8162 173.7099 206 N 5.5700 8.0294 116.4336 51.2577 42.0630 173.9069 207 V 4.7143 8.5891 122.1976 61.1352 35.6717 173.1272 208 N 5.4005 9.1425 126.5449 51.8079 41.0335 172.8129 209 L 5.3194 9.0715 128.5639 53.6451 45.3557 174.7146 210 H 5.4634 9.3186 122.1294 54.2052 32.9629 172.1817 211 E 5.3785 9.1126 121.5595 55.0400 33.7120 173.5244 212 H 5.7204 9.2390 120.3421 53.9408 32.1881 172.0367 213 A 5.7631 9.3287 122.8034 49.2908 22.9212 174.6653 214 E 4.9810 8.5272 119.1483 54.6028 33.6841 174.8357 215 A 4.8193 8.7160 127.2628 51.9345 19.8249 176.0094 216 H 4.8818 8.9259 114.7230 55.0239 31.8995 174.5443 217 S 4.5816 8.9415 114.6311 59.4847 63.5242 174.2623 218 E 4.9058 8.0759 118.1516 54.2456 32.7464 174.6976 219 L 4.2808 8.2003 120.7944 52.9895 42.0114 175.3529 220 P 4.7495 0.0000 0.0000 61.9160 31.4879 175.2594 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.33 4.47 0.00 3.87 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 3 V 7.83 3.63 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.06 0.00 0.00 4 I 8.52 4.16 2.08 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 1.51 0.86 0.55 0.00 0.00 5 K 8.21 4.82 0.00 1.96 1.76 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.37 7.81 6 P 0.00 4.82 0.00 2.29 2.26 0.00 3.64 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 7 D 7.67 5.23 0.00 2.51 2.59 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 8 M 9.17 5.03 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.45 0.00 9 K 8.98 5.03 0.00 1.67 1.73 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.42 7.81 10 I 8.54 5.18 1.79 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.94 0.42 0.00 0.00 11 K 8.97 4.86 0.00 1.58 1.62 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.78 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.15 7.81 12 L 8.15 5.01 0.00 1.49 1.55 1.21 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.90 5.15 0.00 1.91 1.74 0.00 3.32 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 14 M 9.74 5.25 0.00 2.40 2.11 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 15 E 8.69 4.85 0.00 1.89 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 16 G 8.01 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 0.00 0.00 0.00 0.00 17 A 8.89 5.47 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 18 V 8.72 4.74 1.63 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 0.67 0.00 0.00 0.19 0.00 0.00 19 N 10.43 4.28 0.00 2.96 2.95 0.00 0.00 7.23 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 20 G 8.66 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 0.00 0.00 0.00 21 H 8.12 4.81 0.00 3.54 3.38 0.00 5.81 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 5.36 0.00 2.11 2.07 0.00 3.92 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 23 F 8.65 5.23 0.00 3.42 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 9.11 5.22 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 9.17 5.22 2.30 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.35 0.98 0.00 0.00 26 E 9.42 5.26 0.00 1.89 1.81 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 2.25 2.27 0.00 27 G 8.95 4.44 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 0.00 28 V 8.50 4.80 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 1.00 0.00 0.00 0.90 0.00 0.00 29 G 8.80 4.44 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 0.00 30 L 8.71 5.26 0.00 1.52 1.49 0.91 0.94 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 31 G 9.27 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 32 K 9.20 5.40 0.00 1.73 1.86 0.00 1.75 0.00 0.00 1.97 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.69 1.29 7.81 33 P 0.00 4.33 0.00 1.22 1.73 0.00 3.85 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 34 F 7.80 4.57 0.00 3.14 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 35 E 8.31 4.38 0.00 2.05 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 2.35 2.43 0.00 36 G 8.48 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 37 K 7.88 5.35 0.00 1.71 1.68 0.00 1.73 0.00 0.00 1.88 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.61 7.81 38 Q 8.66 4.76 0.00 1.51 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 39 S 8.83 5.09 0.00 3.49 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 40 M 9.13 5.16 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 41 D 8.95 5.33 0.00 2.56 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 42 L 9.07 5.20 0.00 1.43 1.36 0.69 -0.38 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 43 K 9.05 5.12 0.00 1.63 1.68 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.33 7.81 44 V 8.61 4.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.09 0.00 0.00 45 K 9.44 4.58 0.00 1.79 1.87 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.61 1.58 7.81 46 E 8.07 4.61 0.00 2.03 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 47 G 9.14 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 0.00 0.00 0.00 48 G 7.83 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.45 0.00 2.14 2.24 0.00 3.51 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.09 0.00 50 L 8.28 3.67 0.00 1.10 0.27 0.55 0.73 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 51 P 0.00 4.62 0.00 2.18 2.09 0.00 3.55 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 2.13 1.98 0.00 52 F 6.60 4.89 0.00 2.77 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 53 A 8.47 3.78 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 8.18 3.80 0.00 2.47 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 55 D 8.31 4.69 0.00 2.62 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.60 4.54 2.17 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.81 0.75 0.00 0.00 57 L 8.16 4.03 0.00 1.44 1.06 0.31 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.88 4.35 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 1.74 0.00 0.00 59 T 8.03 3.97 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 60 V 7.75 4.18 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 0.98 0.00 0.00 1.24 0.00 0.00 61 F 7.05 4.80 0.00 3.29 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *65 N 7.67 4.56 0.00 2.73 3.14 0.00 0.00 6.69 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 66 R 8.45 3.90 0.00 0.86 0.66 0.00 3.24 0.00 0.00 3.03 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.18 0.00 67 V 7.49 3.60 1.22 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 0.65 0.00 0.00 1.15 0.00 0.00 68 F 7.53 4.66 0.00 3.23 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 69 A 7.29 4.90 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 70 K 9.14 4.30 0.00 2.00 1.77 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.63 7.81 71 Y 8.70 4.90 0.00 3.02 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 72 P 0.00 4.60 0.00 2.47 2.22 0.00 3.70 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 2.18 1.98 0.00 73 E 8.88 4.01 0.00 2.12 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 0.00 2.32 2.29 0.00 74 N 8.12 4.73 0.00 2.88 2.99 0.00 0.00 5.81 7.81 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 75 I 7.43 4.54 2.06 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 0.73 0.85 0.00 0.00 76 V 8.41 3.56 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 0.72 0.00 0.00 0.92 0.00 0.00 77 D 8.15 3.81 0.00 2.37 2.33 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 78 Y 7.85 3.76 0.00 2.35 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 F 7.19 3.89 0.00 3.04 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.46 4.23 0.00 1.86 1.91 0.00 1.86 0.00 0.00 1.61 0.00 0.00 2.49 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.38 1.49 7.81 81 Q 7.49 4.21 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.01 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 82 S 7.58 3.97 0.00 3.87 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 6.87 4.79 0.00 3.28 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 84 P 0.00 4.69 0.00 2.25 2.26 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 85 E 8.23 3.93 0.00 2.04 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 2.40 2.36 0.00 86 G 9.46 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 0.00 0.00 0.00 87 Y 7.64 5.33 0.00 3.11 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 9.29 5.19 0.00 3.84 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 89 W 8.69 5.89 0.00 3.20 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.25 5.31 0.00 1.90 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 2.16 2.22 0.00 91 R 9.38 5.10 0.00 1.72 1.77 0.00 2.45 0.00 0.00 2.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.38 0.00 92 S 8.78 5.12 0.00 3.83 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 93 M 8.97 4.75 0.00 1.60 1.86 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.81 0.00 94 N 8.89 5.00 0.00 2.71 2.65 0.00 0.00 6.92 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 95 Y 9.05 4.83 0.00 3.21 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 96 E 8.68 4.12 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 97 D 8.51 4.72 0.00 2.91 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.47 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 7.53 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 0.00 0.00 0.00 100 I 8.02 5.21 1.81 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 1.37 1.56 0.86 0.00 0.00 101 C 9.38 5.23 0.00 2.88 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 N 8.83 5.38 0.00 2.43 2.56 0.00 0.00 6.36 7.42 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 0.00 103 A 9.07 5.21 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 0.00 104 T 8.52 4.62 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 1.08 0.00 0.00 105 N 7.65 4.80 0.00 1.44 1.42 0.00 0.00 6.92 8.09 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 0.00 106 D 8.69 4.89 0.00 2.67 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 0.00 107 I 8.24 5.14 1.65 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 0.89 0.64 1.31 0.00 0.00 108 T 9.18 4.85 4.33 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 1.25 0.00 0.00 109 L 8.64 5.08 0.00 1.89 1.89 0.46 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 110 D 9.09 4.73 0.00 2.73 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 0.00 111 G 8.74 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 0.00 112 D 9.02 4.66 0.00 2.65 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 0.00 113 C 7.65 5.11 0.00 2.89 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 0.00 114 Y 8.74 4.81 0.00 3.20 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 0.00 115 I 9.34 5.01 1.97 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 1.25 0.81 0.97 0.00 0.00 116 Y 9.05 5.26 0.00 2.89 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 0.00 117 E 9.00 4.74 0.00 2.05 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.24 0.00 118 I 8.59 4.94 2.07 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.03 0.94 0.00 0.00 119 R 8.40 5.15 0.00 1.85 1.63 0.00 3.17 0.00 0.00 3.03 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.66 0.00 120 F 8.83 5.12 0.00 3.16 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 0.00 121 D 8.89 5.16 0.00 2.43 2.44 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 0.00 122 G 9.18 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 0.00 0.00 0.00 0.00 123 V 8.16 4.79 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 0.71 0.00 0.00 0.86 0.00 0.00 124 N 8.84 4.02 0.00 2.74 2.84 0.00 0.00 6.99 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 0.00 125 F 7.95 4.36 0.00 3.14 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 0.00 126 P 0.00 4.38 0.00 2.21 2.00 0.00 3.83 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.12 0.00 127 A 8.74 3.99 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 N 8.05 4.71 0.00 2.81 2.94 0.00 0.00 6.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.00 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 0.00 0.00 0.00 130 P 0.00 4.19 0.00 1.87 2.01 0.00 3.35 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.03 0.00 131 V 7.32 3.31 1.72 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 0.17 0.00 0.00 0.67 0.00 0.00 132 M 7.85 4.15 0.00 2.03 2.37 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.70 0.00 133 Q 7.82 4.26 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 134 K 7.62 3.67 0.00 1.79 1.71 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.16 1.32 7.81 135 R 8.39 4.68 0.00 1.57 1.81 0.00 3.05 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 136 T 7.73 4.68 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 1.10 0.00 0.00 137 V 8.13 4.37 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 0.83 0.00 0.00 0.93 0.00 0.00 138 K 7.40 4.51 0.00 1.90 1.88 0.00 1.61 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.49 7.81 139 W 8.80 4.98 0.00 3.23 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 E 9.36 4.31 0.00 1.86 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 2.58 2.38 0.00 141 P 0.00 4.44 0.00 1.82 1.55 0.00 3.63 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 2.01 2.01 0.00 142 S 8.96 4.81 0.00 3.73 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 0.00 143 T 8.24 4.99 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 1.30 0.00 0.00 144 E 9.51 4.52 0.00 2.06 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 2.29 2.31 0.00 145 K 9.15 4.72 0.00 1.81 1.52 0.00 1.72 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.72 1.87 7.81 146 L 8.30 5.14 0.00 1.01 1.25 0.78 0.56 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 0.00 147 Y 7.87 4.82 0.00 2.96 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 0.00 148 V 8.34 4.35 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 0.75 0.00 0.00 0.88 0.00 0.00 149 R 8.48 4.50 0.00 1.97 1.69 0.00 3.35 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 150 D 9.75 4.62 0.00 2.84 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 G 8.37 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 0.00 152 V 7.38 4.55 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 0.75 0.00 0.00 0.96 0.00 0.00 153 L 8.02 4.61 0.00 0.58 0.91 0.61 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 154 K 8.64 4.87 0.00 0.79 1.14 0.00 1.56 0.00 0.00 1.49 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.05 1.20 7.81 155 G 8.66 4.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 D 9.31 5.78 0.00 2.67 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 0.00 157 V 8.40 4.67 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 0.57 0.00 0.00 0.77 0.00 0.00 158 N 8.77 4.82 0.00 2.57 2.78 0.00 0.00 6.91 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 M 9.12 4.69 0.00 1.36 1.46 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.64 0.00 160 A 8.46 5.08 1.22 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 0.00 0.00 161 L 9.03 4.75 0.00 1.57 1.61 -0.37 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 162 S 9.20 4.63 0.00 4.11 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 0.00 163 L 8.35 5.22 0.00 1.78 1.46 0.88 0.66 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 0.00 164 E 8.79 3.94 0.00 1.77 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 2.33 2.33 0.00 165 G 9.22 3.60 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 0.00 166 G 8.04 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.34 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 0.00 168 H 8.38 5.52 0.00 3.06 3.23 0.00 5.64 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 0.00 169 Y 9.20 5.04 0.00 2.92 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 R 9.40 4.98 0.00 1.86 1.79 0.00 3.17 0.00 0.00 3.11 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 171 C 8.97 4.93 0.00 2.50 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 0.00 172 D 8.85 5.16 0.00 2.66 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 0.00 173 F 9.15 5.26 0.00 2.86 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 0.00 174 K 8.94 4.71 0.00 1.61 1.65 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.39 7.81 175 T 8.98 4.91 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 176 T 8.53 4.82 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 0.00 177 Y 9.23 5.55 0.00 2.83 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 0.00 178 K 9.71 4.88 0.00 1.75 1.78 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.47 7.81 179 A 9.26 4.29 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.13 4.45 0.00 1.80 1.79 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.34 7.81 181 K 7.22 4.21 0.00 1.59 1.51 0.00 1.74 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.17 1.29 7.81 182 V 8.34 3.69 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 0.83 0.00 0.00 0.91 0.00 0.00 183 V 7.83 4.47 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 0.55 0.00 0.00 0.49 0.00 0.00 184 Q 8.49 4.11 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 185 L 8.21 4.58 0.00 1.66 1.52 0.92 1.17 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 0.00 186 P 0.00 4.58 0.00 2.20 2.23 0.00 3.59 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.87 0.00 187 D 8.30 4.59 0.00 2.74 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 0.00 188 Y 8.39 4.30 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 0.00 189 H 8.19 4.41 0.00 3.30 3.32 0.00 5.26 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 0.00 190 F 8.60 5.29 0.00 2.67 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 V 8.72 4.67 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.80 0.00 0.00 192 D 9.19 5.12 0.00 2.78 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 0.00 193 H 9.19 5.48 0.00 2.96 3.07 0.00 5.55 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 H 9.12 5.23 0.00 2.64 3.10 0.00 5.75 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 I 8.43 5.23 1.93 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.20 1.05 0.00 0.00 196 E 9.21 4.77 0.00 2.14 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 2.26 2.36 0.00 197 I 8.65 4.40 2.01 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.86 1.00 0.00 0.00 198 K 9.01 4.32 0.00 1.77 1.78 0.00 1.56 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.09 7.81 199 S 7.74 4.69 0.00 3.74 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 H 7.86 4.92 0.00 2.49 2.91 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 D 8.40 4.40 0.00 2.60 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 K 8.75 3.68 0.00 1.66 1.82 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.44 7.81 203 D 7.95 4.80 0.00 2.81 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Y 7.43 3.28 0.00 2.98 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 0.00 205 S 8.13 4.36 0.00 4.03 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 0.00 206 N 8.03 5.57 0.00 2.64 2.59 0.00 0.00 6.52 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 0.00 207 V 8.59 4.71 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.26 0.00 0.00 208 N 9.14 5.40 0.00 2.83 2.63 0.00 0.00 6.36 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 0.00 209 L 9.07 5.32 0.00 1.79 1.55 1.29 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 210 H 9.32 5.46 0.00 3.16 3.20 0.00 5.84 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 E 9.11 5.38 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 2.36 2.34 0.00 212 H 9.24 5.72 0.00 3.36 3.38 0.00 5.45 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 0.00 213 A 9.33 5.76 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 0.00 214 E 8.53 4.98 0.00 1.93 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 2.31 2.39 0.00 215 A 8.72 4.82 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 H 8.93 4.88 0.00 3.29 3.38 0.00 5.45 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 0.00 217 S 8.94 4.58 0.00 3.98 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 0.00 218 E 8.08 4.91 0.00 1.99 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 219 L 8.20 4.28 0.00 1.37 1.40 0.73 0.52 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 0.00 220 P 0.00 4.75 0.00 2.03 1.90 0.00 3.08 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.94 0.00 * Residues marked with a * may have inaccurate shift predictions.