NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2679 7.8827 121.4512 61.2233 38.6720 173.7636 17 V 4.3496 8.7016 126.3108 61.8563 32.5513 174.5114 18 G 3.9498 8.5183 114.3958 46.7672 0.0000 173.3243 19 G 4.2188 7.7397 110.0327 44.2801 0.0000 172.7460 20 Y 4.9640 7.7658 116.8617 55.2296 42.1778 174.9699 21 T 4.2133 8.6242 117.4198 64.1656 68.4027 175.0398 22 C 4.3093 8.7121 125.4359 60.2741 35.4801 175.2357 23 G 4.0758 8.6996 106.4202 44.4105 0.0000 172.7558 24 A 4.1232 8.6611 125.5928 54.0188 18.5520 176.7966 25 N 4.2542 8.8709 119.0354 54.4935 36.2237 175.3640 26 T 4.2135 7.5848 107.7720 62.7239 69.9029 175.2169 27 V 4.0811 7.0364 122.1500 59.7289 31.3597 173.5589 28 P 4.5084 0.0000 0.0000 64.0810 31.7816 178.2394 29 Y 5.2404 6.8505 115.2385 56.5878 38.8177 174.7243 30 Q 4.5355 7.2572 123.2764 56.2499 29.6155 175.2767 31 V 4.8107 8.9239 125.3488 61.1443 35.6260 173.7360 32 S 4.7934 8.6647 119.9525 56.4220 64.9840 172.5819 33 L 4.4710 8.5566 127.8986 53.4867 42.9612 175.1483 34 N 5.8287 9.0469 122.8540 49.8686 42.1803 174.8025 *37 S 4.1772 8.3482 119.9535 58.3199 64.0480 174.4635 38 G 3.9856 9.7113 108.0698 45.7804 0.0000 172.3745 39 Y 4.4724 6.5834 115.1599 56.3503 39.8520 172.3895 40 H 4.5661 8.8751 121.7556 56.0396 30.3947 174.7474 41 F 5.0233 7.7834 120.1829 57.0192 39.8287 174.0432 42 C 4.7658 6.8681 114.8368 56.1807 44.7557 173.3508 43 G 4.2534 8.6998 109.4633 45.5789 0.0000 172.2396 44 G 4.4797 8.0368 105.6518 46.3711 0.0000 172.6599 45 S 5.5129 8.8038 115.5074 56.4346 66.8355 173.5997 46 L 4.8233 9.1963 127.6159 54.7890 42.3540 177.0890 47 I 4.3833 8.6259 119.9252 61.2469 38.8985 174.4652 48 N 4.7447 7.6261 117.3935 52.0185 39.6214 175.0395 49 S 4.2886 8.6851 111.9834 60.8138 63.1682 174.8924 50 Q 4.6101 9.2590 120.6418 55.1553 30.8000 174.4062 51 W 5.6239 8.4277 116.1673 55.3725 33.5045 174.3315 52 V 5.0874 9.2046 123.6396 61.0507 34.5571 174.3163 53 V 4.9389 8.8806 126.6351 60.5203 33.6245 174.9243 54 S 5.0698 9.1564 117.2873 57.7247 66.1410 171.9034 55 A 4.6850 8.5006 120.6112 50.5947 20.4725 178.3678 56 A 3.8071 8.3198 124.6681 55.3669 18.4155 179.2137 57 H 4.5328 8.3001 109.2414 57.3578 28.6499 175.3377 58 C 4.6626 7.8257 117.1181 57.2244 40.6146 173.3713 59 Y 4.1715 7.7110 121.8888 57.8129 38.8197 175.1011 60 K 3.6013 6.4679 124.4917 55.6801 34.7729 174.2106 61 S 4.2990 8.1814 118.0064 58.0459 64.7155 173.1942 62 G 3.6456 8.2849 105.9755 46.6751 0.0000 173.8289 63 I 4.3545 7.4045 119.2893 59.6986 39.5926 175.5902 64 Q 4.7590 8.9050 128.4728 54.1808 31.5560 174.1700 65 V 4.3289 8.8151 127.4063 62.0045 33.3864 174.6666 66 R 5.0128 8.9400 127.8244 54.7601 32.0045 175.3412 67 L 4.6466 8.9939 125.0631 52.8732 44.3520 177.6956 *69 G 3.9410 8.2155 107.3790 45.4987 0.0000 172.8176 70 E 4.5254 8.2572 118.1778 55.2030 30.3942 174.1449 71 D 4.7683 7.8546 117.3605 55.1032 44.0251 174.2255 72 N 4.9908 8.9469 120.5197 52.7697 39.1237 176.2052 73 I 3.8851 8.5064 119.9479 62.1798 37.8940 176.2680 74 N 4.7555 8.5884 117.9988 53.1608 39.4499 174.9038 75 V 4.3396 7.3383 116.2279 60.6996 34.4110 175.1303 76 V 4.1873 8.3591 126.0515 62.3004 30.8851 175.2538 77 E 4.3991 9.1197 127.1809 55.3993 30.5866 177.0525 78 G 3.9655 8.3596 106.4339 46.1780 0.0000 174.1487 79 N 4.5898 8.9762 116.8586 52.7375 36.6013 174.3742 80 E 4.5361 7.6369 117.1284 56.3256 30.8087 176.3797 81 Q 4.3724 9.0236 120.8679 54.4213 32.8324 173.9928 82 F 5.5150 8.8326 123.3238 56.0549 40.8220 175.4540 83 I 4.6879 8.8273 124.6972 59.4010 40.9320 175.5316 84 S 4.5974 8.7301 122.2966 58.3323 64.3026 173.0323 85 A 4.6608 8.2941 125.2980 51.7371 18.5417 177.9158 86 S 4.5027 8.9278 117.9008 60.0949 64.4320 174.7602 87 K 4.5465 7.4879 116.8423 55.9041 35.3707 174.5011 88 S 5.1883 8.9079 118.4921 57.0309 65.6701 173.5829 89 I 4.4074 9.3357 126.9138 59.5734 38.3639 175.0483 90 V 4.1137 8.2404 127.5003 62.1855 32.6132 175.1955 91 H 3.8824 8.6452 127.2690 56.0959 29.9143 174.3464 92 P 4.2719 0.0000 0.0000 65.3187 31.3643 177.1487 93 S 4.6852 7.9424 111.6844 58.0612 63.0738 173.3270 94 Y 4.3266 8.0737 122.8287 57.7087 39.0204 174.8915 95 N 4.5100 8.3066 125.7060 51.3382 40.1849 175.2710 96 S 3.8779 7.9437 120.8623 60.4061 63.5073 175.0674 97 N 4.4137 8.3977 119.0034 54.9556 38.6528 175.9929 98 T 4.0287 7.7100 105.6935 60.6611 70.1034 175.1073 99 L 3.7773 8.0349 120.8454 55.2935 39.8405 173.9031 100 N 4.4782 7.7313 117.6674 54.6278 39.4994 174.5878 101 N 4.8643 8.6755 119.7383 54.2481 35.8298 175.5485 102 D 4.6121 7.9488 117.6006 53.0229 39.7568 174.5570 103 I 4.7667 7.1154 120.9074 59.2788 42.3652 172.8569 104 M 5.3879 9.2702 127.2671 54.1410 36.2989 173.2114 105 L 5.4215 9.2436 124.8356 53.1439 44.8626 175.3449 106 I 4.9143 9.2672 124.1330 59.4113 40.3671 174.3053 107 K 3.7014 8.6827 129.1423 54.6565 33.4213 175.7071 108 L 4.3629 8.2165 128.0966 54.1076 41.9535 177.1153 109 K 4.0370 8.8025 124.5313 59.2917 32.5887 176.9940 110 S 4.6420 7.6938 112.4703 56.1434 67.0327 173.1597 111 A 4.4210 8.3375 123.6347 51.9687 18.7258 177.5219 112 A 4.1848 8.9172 123.8002 51.7632 19.6763 177.6671 113 S 4.4186 9.2144 116.4213 57.1839 62.6238 173.9424 114 L 4.5008 8.4709 128.4213 54.4806 42.2379 176.5502 115 N 4.8150 8.8926 119.6977 52.3288 39.7006 174.3534 116 S 4.0854 8.8895 111.4356 61.7104 62.4559 176.0728 117 R 4.3020 7.9019 116.7358 56.1973 30.7520 175.7198 118 V 4.5175 7.7277 117.3343 61.0657 33.4157 173.5999 119 A 5.1704 8.5940 128.4787 50.4073 22.9818 174.9715 120 S 5.1146 8.7005 113.8355 57.6148 64.9650 173.1763 121 I 4.4184 8.2290 121.4676 59.3061 39.4073 175.4417 122 S 4.4642 8.3320 123.5225 58.1919 64.1533 173.8227 123 L 4.2531 8.3506 123.1944 53.4603 42.4185 175.3471 124 P 4.4888 0.0000 0.0000 63.0360 32.1058 176.3255 125 T 4.1674 8.2432 109.0258 62.4215 69.9618 174.5630 *127 S 4.5798 7.5609 114.8738 58.0813 64.0351 174.0015 128 C 4.4477 8.3908 117.8844 56.5613 40.7719 173.4244 129 A 4.4163 8.0218 124.9110 51.3237 19.6318 177.6304 130 S 4.3013 8.1125 115.2284 57.1150 64.8195 173.1601 *132 A 4.2226 8.1606 123.1923 53.3834 19.2323 176.8260 133 G 4.0160 9.1467 109.9124 45.4537 0.0000 174.5495 134 T 3.9028 7.5117 117.1505 63.9224 69.3612 173.3599 135 Q 4.6966 8.5888 127.6035 55.7760 30.2455 175.2919 136 C 5.2522 9.2730 122.5122 55.1878 46.4521 172.2900 137 L 5.1931 9.0947 122.8686 53.5825 43.8514 175.1069 138 I 5.1806 9.2961 127.0383 58.7913 40.1991 174.7838 139 S 4.8977 8.7177 119.1442 56.3507 66.6590 173.0924 140 G 3.8009 7.2197 108.5192 46.1780 0.0000 172.8065 141 W 4.8999 8.5598 116.9367 56.2888 29.3982 176.9865 142 G 4.1924 8.4618 109.2946 44.2457 0.0000 173.4429 143 N 3.7165 8.6605 118.2367 54.4605 38.8743 174.5553 144 T 5.1010 8.3650 113.5332 60.5294 69.5674 174.3529 145 K 4.6359 7.6458 121.2566 54.7544 35.0037 176.3656 146 S 4.1671 8.8691 119.4632 61.0072 63.0202 174.6289 147 S 4.5143 8.0505 116.8462 59.5597 63.9164 172.9373 148 G 3.8565 9.1825 112.7572 44.0315 0.0000 171.2601 149 T 4.7148 7.9240 113.9184 61.9464 72.3981 174.3391 150 S 4.3159 9.2043 120.7953 58.0792 65.3779 172.3700 151 Y 5.0044 8.6073 125.9707 55.7702 39.1104 174.4615 152 P 4.6868 0.0000 0.0000 62.4300 32.9389 175.9522 153 D 4.5743 8.7720 118.7091 56.5671 41.3379 177.1999 154 V 5.6116 7.3984 109.7827 58.5725 34.4809 175.7067 155 L 3.2196 8.2854 123.4623 54.9911 42.8858 175.9517 156 K 4.9104 8.0956 124.8867 54.9661 34.9859 174.6658 157 C 5.2658 8.6316 119.4802 55.2612 40.3065 172.9262 158 L 4.8745 8.6192 122.1177 53.9652 45.6813 174.1703 159 K 5.1791 8.9496 125.3030 55.0277 33.6853 175.6403 160 A 4.8429 9.2120 125.7212 49.4385 23.1599 173.3126 161 P 5.0987 0.0000 0.0000 61.5632 34.1450 174.9602 162 I 4.2542 8.4255 123.0717 61.3906 37.9713 175.9936 163 L 4.7629 8.7670 127.8072 53.5236 43.0439 177.0574 164 S 4.3619 8.4505 114.8763 58.1034 64.0440 175.0423 165 D 4.4085 8.8200 122.3235 57.6347 40.5314 179.3090 166 S 4.1458 8.0139 114.2032 61.7651 63.1874 176.6869 167 S 4.1497 7.9244 119.0068 61.0034 62.5957 175.8670 168 C 4.3221 8.5165 121.5103 59.8590 42.2157 175.9622 169 K 3.9614 8.5129 120.2080 59.3740 31.3177 179.6071 170 S 4.1962 7.9751 114.9615 61.2928 62.7966 176.1034 171 A 4.0191 7.7535 122.5647 53.8200 19.6938 177.3757 172 Y 4.8385 7.7583 113.6011 55.1003 38.3428 172.8337 173 P 4.5405 0.0000 0.0000 63.3783 32.2291 177.3967 174 G 3.9859 9.0438 110.2119 46.1017 0.0000 173.6223 175 Q 4.5205 8.2006 116.8278 55.4147 30.2976 175.4494 176 I 4.3686 7.8569 119.7680 60.0655 38.1003 175.5199 177 T 4.5388 8.2273 115.9277 59.6986 70.7801 175.4046 178 S 4.3299 8.5283 115.0991 60.3928 63.1795 174.3734 179 N 4.9891 8.0518 119.1857 53.3652 38.4935 173.8795 180 M 5.6195 7.8182 116.9394 54.0239 36.4776 174.4821 181 F 5.0972 8.6143 114.2974 56.0967 41.9169 172.4801 182 C 5.4991 9.0812 117.0898 55.8934 42.1962 172.5526 183 A 5.0241 9.3111 122.7188 50.8134 22.3841 175.7587 184A G 3.8741 6.8904 108.0395 44.7524 0.0000 172.5089 184 Y 4.6589 8.2989 119.6785 55.9877 41.0790 176.4774 185 L 4.1271 8.6659 125.2850 57.2655 41.9943 178.6088 186 E 4.1172 8.2658 114.9519 56.5556 30.0258 177.4964 187 G 3.8382 8.1126 108.3850 45.2542 0.0000 173.0629 188A G 4.0301 9.6736 106.3803 44.7435 0.0000 173.5008 188 K 4.8156 7.3293 117.5517 55.1790 35.6626 175.1317 189 D 4.6558 8.8815 123.4187 53.7997 45.6551 174.7804 190 S 4.9042 8.7552 116.8695 58.0471 65.2414 172.8791 191 C 4.7691 9.3840 119.2271 55.1805 44.9122 172.3364 192 Q 4.3313 8.6322 118.3011 58.1400 28.1395 176.8862 193 G 4.3622 9.2768 109.1550 46.0273 0.0000 174.2309 194 D 4.6463 8.5382 118.6376 55.6920 41.5890 176.6236 195 S 4.4290 8.1090 115.1881 60.5103 63.2470 175.5585 196 G 4.1431 8.8484 113.0315 46.3311 0.0000 173.6258 197 G 4.3012 7.9508 107.4954 45.1255 0.0000 171.2887 198 P 5.0655 0.0000 0.0000 62.4885 33.3641 175.7724 199 V 4.6002 8.5734 121.1999 61.4064 34.1258 173.8086 200 V 4.7537 8.7278 128.8540 61.2704 33.7422 173.7153 201 C 5.1008 8.8142 124.9884 55.5872 43.7140 174.6339 202 S 3.7193 9.7276 120.4247 59.7372 60.0878 173.1536 203 G 3.9204 8.3999 103.6723 45.8337 0.0000 173.8234 204 K 4.6653 7.6520 117.8837 52.9623 35.1255 175.5143 *209 L 4.3244 8.2942 123.2364 55.4164 42.0951 175.7144 210 Q 4.4797 8.8914 126.1901 56.8266 30.8565 175.9244 211 G 5.2738 8.0344 104.3967 45.6490 0.0000 171.4245 212 I 5.2431 8.1751 119.7391 58.8325 40.9100 175.3550 213 V 3.6830 8.9788 127.6910 64.1053 31.7733 174.0863 214 S 4.8755 8.4579 120.8736 58.4593 64.4963 174.5587 215 W 4.9727 7.4255 114.1428 56.1540 32.0730 172.3027 216 G 3.7353 8.2946 106.2622 46.7026 0.0000 172.9652 217 S 4.6901 8.2507 115.1133 56.5339 62.4825 172.6853 *219 G 4.1650 7.9756 117.8955 45.6279 0.0000 170.6392 220 C 4.8238 8.1173 115.2299 56.4294 44.4731 173.8680 221A A 3.9807 9.0820 126.1598 53.2108 16.5555 176.9419 221 Q 4.5689 7.3016 117.6994 55.9454 30.0129 175.9346 222 K 4.0868 8.4621 122.1104 58.0093 32.6054 176.2291 223 N 4.2783 9.3119 122.0658 54.0915 36.9629 175.3121 224 K 4.3052 7.5538 116.7176 53.8618 32.3278 173.6506 225 P 4.6226 0.0000 0.0000 62.0198 33.2547 177.4893 226 G 3.6091 8.4601 106.1086 46.1063 0.0000 172.7613 227 V 4.4365 7.6755 122.6369 60.7522 33.8869 174.1660 228 Y 4.8520 8.3033 124.3793 55.9764 42.3051 174.8777 229 T 4.4370 8.4576 119.4633 63.4792 69.9797 174.4513 230 K 4.9226 9.3261 128.5065 55.6376 31.3334 177.1281 231 V 3.9312 8.8315 126.6742 65.8994 31.3748 174.9559 232 C 4.3512 8.3328 112.6440 58.2656 41.5124 174.8362 233 N 4.2554 8.0482 117.0617 54.4743 38.5904 175.5352 234 Y 4.8019 8.0088 117.6946 57.3072 38.8248 177.2045 235 V 3.6779 7.9199 121.2066 66.4005 31.5028 178.0016 236 S 4.1186 8.0972 114.1447 61.3171 62.6847 176.2991 237 W 4.1672 8.3092 130.5275 60.4867 30.4693 177.8215 238 I 3.2332 8.4703 120.0917 64.2414 36.6088 178.5338 239 K 3.7512 8.1083 119.3041 59.6366 31.6731 179.5054 240 Q 3.9115 8.0026 117.3078 59.1260 28.7318 178.7293 241 T 3.7108 7.5587 116.9782 66.4784 68.2410 177.0036 242 I 2.5843 7.2776 121.6519 63.8232 36.7301 178.3469 243 A 4.0226 7.7013 120.7359 53.8771 18.1863 178.7079 244 S 4.6640 7.2538 110.5108 58.1981 63.5285 174.0368 245 N 4.6845 7.8997 125.7118 53.8880 39.2794 174.0358 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 16 I 7.88 4.27 1.80 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 1.39 0.70 0.86 0.00 0.00 17 V 8.70 4.35 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.89 0.00 0.00 18 G 8.52 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.74 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 0.00 0.00 0.00 0.00 20 Y 7.77 4.96 0.00 2.95 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 21 T 8.62 4.21 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 1.25 0.00 0.00 22 C 8.71 4.31 0.00 2.75 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.70 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 0.00 0.00 0.00 24 A 8.66 4.12 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 25 N 8.87 4.25 0.00 2.88 2.90 0.00 0.00 7.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.58 4.21 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 1.24 0.00 0.00 27 V 7.04 4.08 1.74 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 0.25 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.51 0.00 2.38 2.30 0.00 3.78 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 2.20 1.97 0.00 29 Y 6.85 5.24 0.00 3.27 3.42 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 30 Q 7.26 4.54 0.00 1.80 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.70 0.00 0.00 0.00 0.00 0.00 1.91 2.46 0.00 31 V 8.92 4.81 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.01 0.00 0.00 32 S 8.66 4.79 0.00 3.07 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.56 4.47 0.00 0.41 0.73 0.78 0.20 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 34 N 9.05 5.83 0.00 2.37 2.42 0.00 0.00 6.77 7.19 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 *37 S 8.35 4.18 0.00 3.81 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.71 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 0.00 0.00 0.00 39 Y 6.58 4.47 0.00 3.03 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 40 H 8.88 4.57 0.00 2.82 3.14 0.00 5.86 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 41 F 7.78 5.02 0.00 3.02 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 42 C 6.87 4.77 0.00 2.31 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 43 G 8.70 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 44 G 8.04 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 0.00 0.00 0.00 0.00 45 S 8.80 5.51 0.00 3.82 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 46 L 9.20 4.82 0.00 1.87 1.68 1.09 1.15 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 47 I 8.63 4.38 1.90 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 1.61 0.89 0.96 0.00 0.00 48 N 7.63 4.74 0.00 3.00 3.00 0.00 0.00 6.02 7.64 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 49 S 8.69 4.29 0.00 4.05 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 0.00 50 Q 9.26 4.61 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 51 W 8.43 5.62 0.00 3.39 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 52 V 9.20 5.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.98 0.00 0.00 53 V 8.88 4.94 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.08 0.00 0.00 54 S 9.16 5.07 0.00 3.85 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 55 A 8.50 4.69 1.19 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 0.00 0.00 56 A 8.32 3.81 0.35 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 57 H 8.30 4.53 0.00 3.37 3.54 0.00 5.55 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 58 C 7.83 4.66 0.00 3.22 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.71 4.17 0.00 2.99 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 6.47 3.60 0.00 1.30 1.13 0.00 0.77 0.00 0.00 1.17 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.84 0.96 7.81 61 S 8.18 4.30 0.00 3.96 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 62 G 8.28 3.65 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 0.00 0.00 0.00 63 I 7.40 4.35 1.86 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 1.43 0.60 0.91 0.00 0.00 64 Q 8.91 4.76 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 65 V 8.82 4.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.89 0.00 0.00 66 R 8.94 5.01 0.00 1.50 1.85 0.00 2.66 0.00 0.00 2.57 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.16 0.00 67 L 8.99 4.65 0.00 1.61 1.70 0.97 0.94 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 *69 G 8.22 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 70 E 8.26 4.53 0.00 2.16 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 2.34 2.05 0.00 71 D 7.85 4.77 0.00 2.77 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 72 N 8.95 4.99 0.00 2.85 2.83 0.00 0.00 7.17 7.53 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 73 I 8.51 3.89 1.43 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.53 -0.47 0.00 0.00 74 N 8.59 4.76 0.00 2.84 2.89 0.00 0.00 6.63 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.34 4.34 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.36 4.19 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 0.86 0.00 0.00 0.96 0.00 0.00 77 E 9.12 4.40 0.00 1.99 1.97 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 2.28 2.42 0.00 78 G 8.36 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.98 4.59 0.00 2.94 3.11 0.00 0.00 6.98 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 80 E 7.64 4.54 0.00 1.57 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.46 0.00 81 Q 9.02 4.37 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.83 5.52 0.00 2.81 2.85 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 83 I 8.83 4.69 1.87 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 1.25 0.74 0.89 0.00 0.00 84 S 8.73 4.60 0.00 3.75 3.74 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 85 A 8.29 4.66 1.19 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 0.00 0.00 86 S 8.93 4.50 0.00 3.78 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 87 K 7.49 4.55 0.00 1.83 1.88 0.00 1.42 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.21 1.41 7.81 88 S 8.91 5.19 0.00 4.11 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 89 I 9.34 4.41 2.06 0.00 0.00 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 1.24 0.95 1.07 0.00 0.00 90 V 8.24 4.11 1.97 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 0.68 0.00 0.00 0.72 0.00 0.00 91 H 8.65 3.88 0.00 2.91 2.98 0.00 5.66 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.27 0.00 2.07 2.15 0.00 3.31 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 2.16 2.24 0.00 93 S 7.94 4.69 0.00 3.92 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 94 Y 8.07 4.33 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 95 N 8.31 4.51 0.00 2.58 2.44 0.00 0.00 6.65 6.91 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 96 S 7.94 3.88 0.00 3.93 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 97 N 8.40 4.41 0.00 2.72 2.79 0.00 0.00 6.87 7.24 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 98 T 7.71 4.03 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 99 L 8.03 3.78 0.00 1.47 1.86 0.82 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.73 4.48 0.00 2.79 2.65 0.00 0.00 7.24 7.30 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 0.00 101 N 8.68 4.86 0.00 2.95 2.62 0.00 0.00 7.23 8.06 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 0.00 102 D 7.95 4.61 0.00 3.06 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 0.00 103 I 7.12 4.77 1.40 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.13 0.08 0.00 0.00 104 M 9.27 5.39 0.00 2.22 1.82 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 2.76 2.65 0.00 105 L 9.24 5.42 0.00 1.82 1.89 1.05 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.27 4.91 1.92 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 1.20 0.96 0.89 0.00 0.00 107 K 8.68 3.70 0.00 0.79 1.11 0.00 1.26 0.00 0.00 1.33 0.00 0.00 2.57 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.56 0.21 7.81 108 L 8.22 4.36 0.00 1.46 1.56 0.96 0.77 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 0.00 109 K 8.80 4.04 0.00 1.85 1.80 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.39 7.81 110 S 7.69 4.64 0.00 3.81 3.66 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 0.00 111 A 8.34 4.42 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 0.00 112 A 8.92 4.18 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 0.00 113 S 9.21 4.42 0.00 3.85 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 0.00 114 L 8.47 4.50 0.00 1.70 1.62 0.96 1.13 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 0.00 115 N 8.89 4.81 0.00 2.81 2.92 0.00 0.00 6.30 7.85 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 0.00 116 S 8.89 4.09 0.00 3.86 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 0.00 117 R 7.90 4.30 0.00 1.92 2.13 0.00 3.28 0.00 0.00 3.27 7.30 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.58 0.00 4.00 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 0.00 128 C 8.39 4.45 0.00 2.94 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.02 4.42 1.04 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 0.00 0.00 130 S 8.11 4.30 0.00 3.98 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 *132 A 8.16 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 0.00 133 G 9.15 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 0.00 134 T 7.51 3.90 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 1.14 0.00 0.00 135 Q 8.59 4.70 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 136 C 9.27 5.25 0.00 2.78 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 0.00 137 L 9.09 5.19 0.00 1.75 1.57 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.30 5.18 1.88 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.36 0.99 0.00 0.00 139 S 8.72 4.90 0.00 3.50 3.58 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 0.00 140 G 7.22 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 0.00 0.00 0.00 141 W 8.56 4.90 0.00 3.10 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 0.00 142 G 8.46 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.66 3.72 0.00 2.25 2.63 0.00 0.00 7.12 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 8.36 5.10 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 1.30 0.00 0.00 145 K 7.65 4.64 0.00 1.66 1.84 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.30 1.37 7.81 146 S 8.87 4.17 0.00 3.86 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 0.00 147 S 8.05 4.51 0.00 3.82 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 0.00 148 G 9.18 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 0.00 149 T 7.92 4.71 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 150 S 9.20 4.32 0.00 3.80 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.61 5.00 0.00 2.97 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.69 0.00 2.45 2.10 0.00 4.19 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.06 0.00 153 D 8.77 4.57 0.00 2.80 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 0.00 154 V 7.40 5.61 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.97 0.00 0.00 155 L 8.29 3.22 0.00 1.30 1.26 -0.58 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.10 4.91 0.00 1.69 1.51 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.48 7.81 157 C 8.63 5.27 0.00 1.63 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.62 4.87 0.00 1.69 1.45 1.03 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.95 5.18 0.00 1.82 1.82 0.00 1.93 0.00 0.00 1.78 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.58 7.81 160 A 9.21 4.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.10 0.00 2.02 2.09 0.00 3.13 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 1.76 1.78 0.00 162 I 8.43 4.25 1.86 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.72 0.68 0.00 0.00 163 L 8.77 4.76 0.00 1.56 1.61 0.93 0.86 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 0.00 164 S 8.45 4.36 0.00 4.00 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 0.00 165 D 8.82 4.41 0.00 2.81 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 0.00 166 S 8.01 4.15 0.00 4.05 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 0.00 167 S 7.92 4.15 0.00 3.97 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 0.00 168 C 8.52 4.32 0.00 3.17 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 0.00 169 K 8.51 3.96 0.00 1.92 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.54 1.65 7.81 170 S 7.98 4.20 0.00 3.99 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 0.00 171 A 7.75 4.02 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 0.00 172 Y 7.76 4.84 0.00 3.12 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.54 0.00 2.08 2.06 0.00 3.90 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 2.05 2.21 0.00 174 G 9.04 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 0.00 0.00 0.00 175 Q 8.20 4.52 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.64 0.00 0.00 0.00 0.00 0.00 2.30 2.59 0.00 176 I 7.86 4.37 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.96 1.00 0.00 0.00 177 T 8.23 4.54 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 S 8.53 4.33 0.00 4.01 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 0.00 179 N 8.05 4.99 0.00 3.00 3.10 0.00 0.00 6.60 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.82 5.62 0.00 1.79 1.99 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 181 F 8.61 5.10 0.00 3.09 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 0.00 182 C 9.08 5.50 0.00 3.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.31 5.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 6.89 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 0.00 184 Y 8.30 4.66 0.00 3.09 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.67 4.13 0.00 1.74 1.73 0.92 0.87 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 0.00 186 E 8.27 4.12 0.00 2.10 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 2.33 2.26 0.00 187 G 8.11 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 188A G 9.67 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 0.00 0.00 0.00 188 K 7.33 4.82 0.00 1.40 1.70 0.00 1.54 0.00 0.00 1.04 0.00 0.00 2.13 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.30 7.81 189 D 8.88 4.66 0.00 2.84 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.76 4.90 0.00 4.00 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 0.00 191 C 9.38 4.77 0.00 2.93 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.63 4.33 0.00 2.43 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.21 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 193 G 9.28 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 0.00 0.00 0.00 0.00 194 D 8.54 4.65 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 0.00 195 S 8.11 4.43 0.00 3.98 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.85 4.14 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 0.00 197 G 7.95 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 0.00 0.00 0.00 0.00 198 P 0.00 5.07 0.00 2.34 2.38 0.00 3.70 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.20 0.00 199 V 8.57 4.60 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.62 0.00 0.00 200 V 8.73 4.75 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 0.61 0.00 0.00 0.65 0.00 0.00 201 C 8.81 5.10 0.00 2.79 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.73 3.72 0.00 3.94 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.40 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.65 4.67 0.00 1.80 1.64 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.29 4.32 0.00 1.50 1.64 1.01 0.76 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 0.00 210 Q 8.89 4.48 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.41 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 211 G 8.03 5.27 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 0.00 212 I 8.18 5.24 1.91 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 1.29 1.10 0.96 0.00 0.00 213 V 8.98 3.68 2.36 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 0.99 0.00 0.00 1.22 0.00 0.00 214 S 8.46 4.88 0.00 3.98 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 0.00 215 W 7.43 4.97 0.00 3.39 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 0.00 216 G 8.29 3.74 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 0.00 0.00 0.00 217 S 8.25 4.69 0.00 4.22 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 *219 G 7.98 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 0.00 220 C 8.12 4.82 0.00 2.94 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 9.08 3.98 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 0.00 221 Q 7.30 4.57 0.00 2.31 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 222 K 8.46 4.09 0.00 1.70 1.72 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.64 7.81 223 N 9.31 4.28 0.00 2.81 2.82 0.00 0.00 6.81 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 0.00 224 K 7.55 4.31 0.00 1.65 1.78 0.00 1.63 0.00 0.00 1.30 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.50 7.81 225 P 0.00 4.62 0.00 2.14 2.11 0.00 3.61 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 226 G 8.46 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.68 4.44 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 -0.73 0.00 0.00 228 Y 8.30 4.85 0.00 1.43 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 0.00 229 T 8.46 4.44 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 1.17 0.00 0.00 230 K 9.33 4.92 0.00 2.10 1.93 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.69 7.81 231 V 8.83 3.93 2.35 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 1.23 0.00 0.00 1.11 0.00 0.00 232 C 8.33 4.35 0.00 3.17 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.05 4.26 0.00 2.46 2.39 0.00 0.00 6.81 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 0.00 234 Y 8.01 4.80 0.00 3.08 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 0.00 235 V 7.92 3.68 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 1.17 0.00 0.00 1.06 0.00 0.00 236 S 8.10 4.12 0.00 3.98 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 0.00 237 W 8.31 4.17 0.00 3.50 3.59 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 0.00 238 I 8.47 3.23 2.05 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.00 0.77 0.00 0.00 239 K 8.11 3.75 0.00 1.72 1.77 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.55 7.81 240 Q 8.00 3.91 0.00 1.92 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.97 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 241 T 7.56 3.71 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 242 I 7.28 2.58 1.38 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.12 0.34 0.00 0.00 243 A 7.70 4.02 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 0.00 244 S 7.25 4.66 0.00 3.95 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 0.00 245 N 7.90 4.68 0.00 3.04 3.03 0.00 0.00 6.74 7.41 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 * Residues marked with a * may have inaccurate shift predictions.