NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2723 7.8827 121.4515 61.2566 38.2868 173.8211 17 V 4.2520 8.8616 126.7388 62.0376 32.4547 174.7116 18 G 4.0940 8.5686 114.2973 46.8926 0.0000 173.0309 19 G 4.2305 7.7288 109.6580 43.9184 0.0000 172.6145 20 Y 4.9825 7.8683 116.0934 55.0608 42.0431 174.9714 21 T 4.1795 8.5826 117.3612 64.0414 68.4719 175.1737 22 C 4.2250 8.6003 125.3130 60.6761 39.4968 174.7936 23 G 4.1199 8.6730 106.2998 43.9244 0.0000 172.8233 24 A 4.3936 8.7366 125.2337 53.8545 18.6020 177.2246 25 N 4.1936 8.7215 121.2882 54.6620 36.2741 175.0621 26 T 4.3431 7.4433 105.5627 61.9724 70.4384 175.0325 27 V 4.1187 6.9813 121.6047 60.1132 31.3446 173.7859 28 P 4.5072 0.0000 0.0000 64.2452 31.8239 178.0647 29 Y 5.1433 6.7549 115.3814 56.4724 38.8045 174.6080 30 Q 4.5466 7.4241 123.5925 56.3061 29.4294 175.4525 31 V 4.8849 9.0123 118.8413 59.6700 36.3673 174.1378 32 S 4.8662 8.7356 117.0940 56.6067 64.9263 172.6995 33 L 4.5785 8.6077 127.5994 53.4138 43.0377 174.9349 34 N 5.6061 8.8353 123.1671 50.2915 41.8159 174.9479 *37 S 4.2837 8.4910 120.3383 58.5091 63.4486 174.2112 38 G 4.0468 9.7333 108.6221 45.0920 0.0000 173.5078 39 Y 4.4976 6.7007 115.1762 56.2245 39.9086 172.5921 40 H 4.4858 8.9959 121.7248 56.3645 30.2493 174.7476 41 F 5.0989 7.9087 120.1360 56.8885 39.7244 173.9133 42 C 4.6339 6.8449 114.9453 56.3506 44.7249 173.2132 43 G 4.2056 8.5414 109.0992 45.8842 0.0000 172.4212 44 G 4.7159 7.3342 102.6020 46.6963 0.0000 172.6500 45 S 5.4573 8.7104 116.0515 56.4089 66.6309 173.6737 46 L 4.9425 9.1041 127.0903 54.5877 42.4108 176.8705 47 I 4.5641 8.2468 119.1075 60.6296 38.8465 174.7855 48 N 4.8148 7.6711 118.1452 52.6250 41.6574 175.0113 49 S 4.2870 8.7811 117.3408 60.7014 63.3150 175.4391 50 Q 4.5153 8.9906 118.1797 55.0101 30.2581 174.5476 51 W 5.4526 8.2017 118.3027 54.7728 33.3174 174.5152 52 V 5.1025 9.0872 122.9175 61.1062 34.5979 174.3546 53 V 4.9475 8.9608 127.1873 60.5998 33.9778 175.0173 54 S 4.5260 8.8937 116.7949 57.8235 65.9974 172.3380 55 A 4.5987 8.5053 120.5601 50.8667 20.2580 178.5722 56 A 3.8289 8.2540 123.7383 55.2073 18.4959 179.4369 57 H 4.4837 7.9845 109.6547 57.5187 28.7977 175.4023 58 C 4.7160 7.6776 117.1121 57.2313 40.3428 173.1795 59 Y 4.2050 7.6454 122.4402 57.6760 38.7709 175.1359 60 K 4.0334 7.0258 125.8183 55.0327 35.1673 175.1680 61 S 4.1849 8.0674 119.4789 58.8308 63.7147 173.8786 62 G 3.8343 8.3533 108.3987 46.7158 0.0000 174.0649 63 I 4.0131 7.5166 119.8237 60.7124 38.8808 175.3371 64 Q 4.7905 9.0303 128.5097 54.2207 31.5144 174.2287 65 V 4.4163 8.8941 127.2432 61.9903 33.5356 174.6217 66 R 5.0428 8.9482 127.1203 54.5942 32.4437 175.1645 67 L 4.7799 9.0745 124.4620 52.5643 45.1399 177.3642 *69 G 3.7179 8.2323 106.7676 45.4721 0.0000 172.7587 70 E 4.4777 8.2390 118.3355 55.2872 30.2137 174.2509 71 D 4.7902 7.8856 118.1368 55.1036 43.7626 174.3424 72 N 4.9971 8.8611 124.2834 52.5767 38.6806 176.2091 73 I 3.7409 8.3815 120.1617 62.2704 37.7765 176.5160 74 N 4.7151 8.5115 118.0960 53.5695 39.4601 175.4169 75 V 4.3897 7.2893 109.5870 59.0611 34.9211 175.6456 76 V 4.0043 8.3764 123.5027 62.8694 30.8758 175.4961 77 E 4.3262 9.6050 127.4413 56.2226 29.8590 177.4104 78 G 3.9181 8.6021 110.6974 45.9907 0.0000 174.7995 *79 N 4.7172 7.9128 114.9815 52.3472 37.9564 179.8109 80 E 5.3644 7.6098 117.2738 56.7496 31.2394 176.4064 81 Q 4.3651 8.5236 119.3452 54.8684 32.9846 173.7986 82 F 5.4949 8.8466 123.5988 56.0756 40.8059 175.5096 83 I 4.6760 8.9570 124.8016 59.3710 40.8717 175.6716 84 S 4.7022 8.7453 122.2047 58.4181 64.2929 172.9704 85 A 4.7360 8.1913 124.2426 51.5695 18.9066 177.6825 86 S 4.4958 8.9652 116.6139 59.5718 64.7522 174.8337 87 K 4.7382 7.6365 117.7470 54.6540 36.7909 175.9412 88 S 5.0648 8.7817 118.2176 57.2134 66.1348 173.7396 89 I 4.4258 9.4439 128.4389 59.5802 38.5337 175.4551 90 V 4.2538 8.3218 127.7036 61.9394 32.7261 175.1763 91 H 3.8541 8.8687 127.4304 56.0098 29.9169 174.2307 92 P 4.2444 0.0000 0.0000 65.5835 31.0514 177.0423 93 S 4.6591 7.9138 112.3571 58.0201 63.1287 173.2485 94 Y 4.2877 8.0845 123.5608 57.7509 39.0579 174.5077 95 N 4.5278 8.0901 125.6376 51.3821 40.1847 175.1682 96 S 3.9511 8.0328 122.5835 60.3353 63.7725 176.0140 97 N 4.3996 8.3935 119.0272 55.0459 37.5429 181.9557 98 T 3.9503 7.7784 106.6202 61.3478 69.5563 175.4437 99 L 3.6956 7.9443 120.9663 55.0640 39.8846 173.8953 100 N 4.4778 7.6705 117.9057 54.5781 39.4432 174.5947 101 N 4.7906 8.7031 119.8385 54.3670 35.9002 175.3944 102 D 4.7873 8.0358 117.2106 53.2793 39.3173 174.6001 103 I 4.7997 7.1650 120.8286 59.3403 42.3968 173.1086 104 M 5.4649 9.0742 126.6488 54.2664 36.2712 173.1393 105 L 5.3678 9.4947 124.8279 53.1160 44.9982 175.3520 106 I 4.9704 9.2105 124.1715 59.4110 40.3410 174.3866 107 K 3.4501 8.7266 129.3250 54.7324 33.3535 175.8351 108 L 4.3142 8.2440 127.9731 54.2282 41.8401 177.3215 109 K 4.1627 8.9836 124.8432 58.9754 32.6350 177.0660 110 S 4.6260 7.6981 111.4771 55.8834 66.1325 173.2204 111 A 4.4084 8.3388 122.9990 51.9933 18.8265 177.3166 112 A 4.3686 9.0416 125.5768 52.3102 19.9867 178.6595 113 S 4.5485 8.9486 119.1019 57.3955 62.4682 175.3605 114 L 4.2182 8.4566 128.7760 54.1916 42.4097 178.0307 *115 N 4.5415 8.6006 118.2818 52.8503 39.4788 174.0764 *116 S 4.5159 8.3292 117.4521 58.5777 63.9080 174.1467 *117 R 4.2397 8.1882 119.6336 57.5473 29.8469 176.0893 118 V 4.8852 7.6245 114.8828 61.3767 34.1352 174.0563 119 A 4.8729 8.5895 127.5218 50.9020 22.9464 175.3430 120 S 5.1373 8.6679 114.4247 57.6930 65.1620 172.9991 121 I 4.4303 8.3018 121.1046 59.1200 39.7648 175.4748 122 S 4.4320 8.3770 123.9439 58.3342 64.0789 173.9503 123 L 4.3778 8.3339 122.7877 53.4473 42.4909 175.1483 124 P 4.4849 0.0000 0.0000 63.4830 32.1475 177.3593 125 T 3.9877 8.2848 112.4853 62.9629 68.9729 174.8091 *127 S 4.3670 7.5487 112.4239 58.1483 64.0592 174.0702 128 C 4.5162 8.4176 117.6999 56.8263 40.5836 173.4165 129 A 4.4891 8.1245 125.4316 51.0577 19.8927 177.5074 130 S 4.2957 8.1109 115.3658 57.1637 64.7597 173.1456 *132 A 4.3042 8.1985 123.3615 53.5631 19.2274 177.0872 133 G 3.9999 9.3295 111.4577 45.3193 0.0000 174.3700 134 T 3.9993 7.8261 119.8351 64.3883 69.5211 174.1511 135 Q 4.8282 8.5684 126.3885 55.1025 29.4163 173.6097 136 C 5.2505 9.4069 120.9843 54.1378 46.3859 172.5314 137 L 5.2131 8.7995 122.9311 53.6906 43.7493 175.0200 138 I 5.2377 9.3556 127.5907 58.8479 39.7480 174.9450 139 S 4.9791 8.8171 119.5777 56.3216 66.5850 173.0497 140 G 3.7729 7.1981 108.2608 46.2313 0.0000 172.9817 141 W 4.5152 8.5613 116.8984 56.2332 29.4513 176.9852 142 G 4.1259 8.3634 109.3406 44.3556 0.0000 173.4334 143 N 3.8520 8.7758 118.4905 54.3129 38.9310 174.7292 144 T 5.1279 8.4250 113.7589 60.6029 69.6334 174.3952 145 K 4.6174 7.7691 121.8166 54.7188 34.6751 176.2726 146 S 4.3007 8.8731 120.2860 61.0494 63.8367 175.3754 *147 S 4.7083 8.7589 116.1729 53.1279 62.4596 175.7070 148 G 3.8741 7.0144 112.6869 46.5794 0.0000 169.6315 149 T 4.5109 7.8660 114.2623 60.1061 72.0612 170.0779 150 S 4.2817 9.4449 123.8084 56.7818 65.2566 172.2429 151 Y 4.9483 8.4912 125.8931 55.8427 38.9536 174.4589 152 P 4.6562 0.0000 0.0000 62.5462 32.9130 176.0221 153 D 4.5642 8.7837 118.6823 56.7392 41.3776 177.3581 154 V 5.3678 7.4073 109.7207 58.8056 34.0736 175.7344 155 L 3.2252 8.3044 124.1742 54.9780 43.0147 175.8826 156 K 4.8519 8.1949 125.1743 54.9141 34.9598 174.6462 157 C 5.2324 8.5927 119.9455 55.2721 42.7644 172.8631 158 L 4.8878 8.4273 121.2955 54.1714 45.6621 173.9766 159 K 5.1442 9.0133 125.6134 55.1506 33.6728 175.7362 160 A 4.8142 8.9168 125.8857 49.7597 23.1402 173.3352 161 P 5.0601 0.0000 0.0000 61.5797 34.0495 175.0511 162 I 4.2510 8.6382 122.7324 61.4584 38.1134 175.4980 163 L 5.0014 8.6654 126.7759 52.7639 43.9727 176.8123 164 S 4.3079 8.5777 117.5309 58.7291 63.9609 175.7039 165 D 4.4677 8.7735 124.3106 58.5866 39.3622 180.1118 166 S 4.3481 8.0055 114.9653 61.5852 63.1243 176.7003 167 S 4.0971 7.8923 118.4486 60.9305 62.7332 175.5050 168 C 4.3015 8.4085 122.1673 59.6162 43.2219 175.8775 169 K 4.0032 8.3652 119.2424 59.1682 31.6557 179.1847 170 S 4.3052 8.1563 114.1215 61.0327 63.1727 176.0966 171 A 4.0737 8.2206 124.2275 53.6223 19.6342 177.1433 172 Y 4.7253 7.8838 114.8386 54.6799 38.4766 171.3916 173 P 4.5042 0.0000 0.0000 63.9236 32.0429 176.5205 174 G 4.0467 9.0392 110.8938 46.6894 0.0000 173.8072 175 Q 4.5683 8.2128 116.8619 54.8794 30.8692 175.6537 176 I 4.4253 7.9225 119.3517 60.0140 38.6246 175.3112 177 T 4.6028 8.2030 115.2300 59.5088 71.0284 175.2259 178 S 4.3099 8.5473 115.1343 60.5244 63.2512 174.4890 179 N 4.9357 8.2413 118.5238 53.3046 38.5042 173.8580 180 M 5.5914 7.9799 117.3507 53.6441 35.9715 174.8358 181 F 5.1376 8.8202 115.1952 55.7206 42.0297 172.7637 182 C 5.4554 9.0056 117.0174 55.9838 41.1632 172.4727 183 A 4.9881 9.1078 122.2307 51.0636 22.3855 175.2229 184A G 3.6961 6.9373 107.4365 44.6658 0.0000 172.8659 184 Y 4.7248 8.3727 119.6698 55.9097 41.3167 176.5172 185 L 4.0744 8.8521 127.0019 58.3254 42.0867 179.9623 186 E 3.7126 8.2201 113.9109 56.9584 29.9627 180.9413 187 G 3.8495 7.6485 103.7167 45.0964 0.0000 172.9214 188A G 4.0104 9.3925 106.2410 44.9283 0.0000 173.2456 188 K 5.1039 7.4190 117.5775 55.1632 35.3150 174.9982 189 D 4.6417 9.0374 123.9282 53.8902 45.5752 174.5677 190 S 4.9628 8.7243 115.9326 57.8575 65.3449 173.4543 191 C 4.7489 9.2479 119.2872 55.3726 45.5499 172.4735 192 Q 4.3791 8.7299 119.0477 57.9868 28.3093 177.8972 193 G 4.3065 9.2396 110.3786 45.6391 0.0000 173.5960 194 D 4.7814 8.4166 118.7601 54.6929 42.2867 176.7451 195 S 4.4720 8.0580 115.1536 60.4465 63.4368 175.5784 196 G 4.3141 8.8102 112.4214 46.4431 0.0000 173.7832 197 G 4.2541 7.8937 107.3774 45.1394 0.0000 171.4195 198 P 5.0565 0.0000 0.0000 62.5808 33.4041 175.8155 199 V 4.6317 8.4819 120.8130 61.3835 33.9268 173.6500 200 V 4.7929 8.6699 128.4334 61.2967 33.6710 173.7607 201 C 5.0804 8.9032 127.3471 56.2195 43.9789 175.2259 *202 S 3.6041 9.6938 119.9105 59.2577 59.2444 170.0867 203 G 3.9802 8.4919 106.7269 46.3504 0.0000 174.1710 204 K 4.6822 7.5233 117.9579 53.0800 35.0989 175.4765 *209 L 4.2197 8.2404 122.4122 55.4433 42.1691 175.9337 210 Q 4.4741 8.8468 126.0762 56.9158 30.7126 175.8232 211 G 5.2532 7.9944 104.4563 45.9699 0.0000 171.5312 212 I 5.1535 8.2358 119.5788 58.8669 40.8338 175.4884 213 V 3.4661 8.8288 127.4129 64.1987 31.7623 174.1023 214 S 4.8907 8.3975 120.7780 58.4500 64.3943 174.5424 215 W 5.0785 7.5878 113.8722 55.6802 32.2484 172.6482 216 G 3.8087 8.3481 106.5750 46.5737 0.0000 172.9603 217 S 4.6572 8.3552 114.7795 56.7024 62.2644 172.7832 *219 G 4.3672 7.9871 117.9858 45.5811 0.0000 170.7259 220 C 4.8393 8.1003 115.1727 56.3254 39.9148 173.8755 221A A 4.3523 9.2250 125.3091 53.1348 16.2280 177.1960 221 Q 4.4254 7.5174 119.4012 57.2618 29.5276 176.8304 222 K 4.3437 8.3732 122.1684 55.9214 32.3030 177.6346 223 N 4.3673 9.4465 119.3389 53.3173 36.8807 175.5221 224 K 4.3044 7.4193 116.7079 53.7646 32.4073 173.9706 225 P 4.6365 0.0000 0.0000 61.8979 33.1721 177.1814 226 G 3.6277 8.4126 106.4582 46.1943 0.0000 172.6957 227 V 4.4534 7.6607 122.5586 60.8536 33.7314 174.2455 228 Y 4.8478 8.3025 124.0958 56.0064 42.4116 174.8049 229 T 4.4094 8.6057 119.3981 63.4258 70.0504 174.5019 230 K 5.1017 9.6049 128.5157 55.6651 31.4718 177.1546 231 V 3.9227 8.9337 126.7752 65.9378 31.4082 174.9108 232 C 4.4851 8.3816 112.5464 58.3663 41.3642 174.7558 233 N 4.3207 7.9416 116.5579 54.0912 38.6526 174.8767 234 Y 4.8142 8.1542 117.6311 57.1496 39.6850 177.3911 235 V 3.6994 8.1050 121.1727 66.3001 31.4579 178.0456 236 S 4.1091 8.0745 114.1684 61.4099 62.7944 176.1793 237 W 4.2411 8.3696 130.5390 60.5401 30.3906 177.8226 238 I 3.2323 8.5707 119.9745 64.2725 36.7657 178.3953 239 K 3.7116 8.1197 119.3987 59.6200 31.9909 179.2448 240 Q 3.8450 8.0282 119.5749 59.3574 28.7572 178.2450 241 T 3.5165 7.2499 115.8329 66.4203 68.3723 176.3760 242 I 2.2346 6.9131 120.4937 63.8349 37.0720 178.1703 243 A 4.1398 7.4745 120.0627 53.7277 18.1981 178.5966 244 S 4.8006 7.5292 111.8511 57.9401 64.4796 174.0522 245 N 4.6108 8.0106 125.1239 54.7665 39.5339 174.4161 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 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.67 0.88 0.00 0.00 17 V 8.86 4.25 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 1.13 0.00 0.00 0.89 0.00 0.00 18 G 8.57 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 19 G 7.73 4.23 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 0.00 0.00 0.00 20 Y 7.87 4.98 0.00 2.97 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 21 T 8.58 4.18 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 22 C 8.60 4.23 0.00 2.73 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.67 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.74 4.39 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 25 N 8.72 4.19 0.00 2.86 2.89 0.00 0.00 7.09 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 7.44 4.34 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 1.28 0.00 0.00 27 V 6.98 4.12 1.73 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 0.24 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.51 0.00 2.39 2.43 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.98 0.00 29 Y 6.75 5.14 0.00 3.29 3.43 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 30 Q 7.42 4.55 0.00 1.76 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.73 0.00 0.00 0.00 0.00 0.00 1.84 2.46 0.00 31 V 9.01 4.88 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.99 0.00 0.00 32 S 8.74 4.87 0.00 3.24 3.35 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 33 L 8.61 4.58 0.00 0.62 0.94 0.75 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.84 5.61 0.00 2.42 2.50 0.00 0.00 6.65 7.22 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 *37 S 8.49 4.28 0.00 3.45 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 38 G 9.73 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.70 4.50 0.00 3.12 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 40 H 9.00 4.49 0.00 2.92 3.22 0.00 5.86 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 41 F 7.91 5.10 0.00 3.10 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 42 C 6.84 4.63 0.00 2.01 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.54 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 0.00 0.00 0.00 44 G 7.33 4.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.71 5.46 0.00 3.81 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 46 L 9.10 4.94 0.00 1.88 1.70 1.08 0.97 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 47 I 8.25 4.56 1.90 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 1.40 0.90 0.96 0.00 0.00 48 N 7.67 4.81 0.00 2.79 2.95 0.00 0.00 6.91 7.33 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 49 S 8.78 4.29 0.00 4.07 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.99 4.52 0.00 2.29 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.78 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 51 W 8.20 5.45 0.00 3.26 3.07 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 52 V 9.09 5.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.98 0.00 0.00 53 V 8.96 4.95 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 0.95 0.00 0.00 1.03 0.00 0.00 54 S 8.89 4.53 0.00 3.88 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 55 A 8.51 4.60 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.25 3.83 0.42 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 57 H 7.98 4.48 0.00 3.39 3.56 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.68 4.72 0.00 3.21 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 59 Y 7.65 4.20 0.00 3.00 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 7.03 4.03 0.00 1.51 1.20 0.00 0.61 0.00 0.00 0.78 0.00 0.00 2.42 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.92 1.04 7.81 61 S 8.07 4.18 0.00 3.78 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 62 G 8.35 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 0.00 0.00 0.00 63 I 7.52 4.01 1.84 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 1.37 1.15 0.90 0.00 0.00 64 Q 9.03 4.79 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.05 2.21 0.00 65 V 8.89 4.42 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 0.84 0.00 0.00 0.89 0.00 0.00 66 R 8.95 5.04 0.00 1.44 1.66 0.00 2.58 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.11 0.00 67 L 9.07 4.78 0.00 1.67 1.64 1.05 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.23 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.24 4.48 0.00 2.11 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.00 0.00 71 D 7.89 4.79 0.00 2.78 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 72 N 8.86 5.00 0.00 2.85 2.75 0.00 0.00 7.17 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 73 I 8.38 3.74 1.42 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.51 -0.68 0.00 0.00 74 N 8.51 4.72 0.00 2.86 2.90 0.00 0.00 6.72 8.26 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 75 V 7.29 4.39 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.95 0.00 0.00 76 V 8.38 4.00 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 0.78 0.00 0.00 0.97 0.00 0.00 77 E 9.60 4.33 0.00 1.97 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 0.00 2.31 2.43 0.00 78 G 8.60 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 *79 N 7.91 4.72 0.00 2.66 2.80 0.00 0.00 6.94 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 7.61 5.36 0.00 1.62 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 2.65 2.36 0.00 81 Q 8.52 4.37 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.88 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 82 F 8.85 5.49 0.00 2.79 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.96 4.68 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 1.24 0.72 0.94 0.00 0.00 84 S 8.75 4.70 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 8.19 4.74 1.23 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 0.00 0.00 86 S 8.97 4.50 0.00 3.76 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 7.64 4.74 0.00 1.55 1.71 0.00 1.60 0.00 0.00 1.91 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.41 7.81 88 S 8.78 5.06 0.00 4.00 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 89 I 9.44 4.43 2.03 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 1.23 0.91 1.10 0.00 0.00 90 V 8.32 4.25 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 0.65 0.00 0.00 0.78 0.00 0.00 91 H 8.87 3.85 0.00 2.88 3.10 0.00 5.66 0.00 0.00 0.00 0.00 6.70 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 4.24 0.00 2.21 2.23 0.00 3.13 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 1.68 2.04 0.00 93 S 7.91 4.66 0.00 3.93 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 94 Y 8.08 4.29 0.00 3.08 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 95 N 8.09 4.53 0.00 2.55 2.39 0.00 0.00 6.65 7.01 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 96 S 8.03 3.95 0.00 3.99 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 97 N 8.39 4.40 0.00 2.75 2.76 0.00 0.00 6.98 8.22 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 98 T 7.78 3.95 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 7.94 3.70 0.00 1.42 1.75 0.01 0.84 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 0.00 100 N 7.67 4.48 0.00 2.74 2.62 0.00 0.00 7.24 6.75 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 0.00 101 N 8.70 4.79 0.00 3.04 2.64 0.00 0.00 7.24 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 8.04 4.79 0.00 3.10 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 0.00 103 I 7.17 4.80 1.44 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.21 0.13 0.00 0.00 104 M 9.07 5.46 0.00 2.27 1.83 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.64 0.00 105 L 9.49 5.37 0.00 1.69 1.82 0.11 0.71 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 0.00 106 I 9.21 4.97 1.92 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 1.19 0.82 0.87 0.00 0.00 107 K 8.73 3.45 0.00 0.79 1.10 0.00 1.42 0.00 0.00 1.38 0.00 0.00 2.68 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.76 0.21 7.81 108 L 8.24 4.31 0.00 1.41 1.58 0.96 0.84 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 0.00 109 K 8.98 4.16 0.00 1.87 1.79 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.34 7.81 110 S 7.70 4.63 0.00 3.92 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.34 4.41 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 0.00 112 A 9.04 4.37 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 0.00 113 S 8.95 4.55 0.00 3.40 3.71 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 0.00 114 L 8.46 4.22 0.00 1.66 1.66 0.96 1.09 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 *115 N 8.60 4.54 0.00 2.49 2.63 0.00 0.00 6.60 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 *116 S 8.33 4.52 0.00 3.59 3.71 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 *117 R 8.19 4.24 0.00 1.73 1.96 0.00 3.15 0.00 0.00 3.26 7.38 0.00 0.00 0.00 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1.21 0.00 0.00 *127 S 7.55 4.37 0.00 3.97 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 0.00 128 C 8.42 4.52 0.00 2.93 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 0.00 129 A 8.12 4.49 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 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 8.20 4.30 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 0.00 133 G 9.33 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 0.00 134 T 7.83 4.00 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 1.15 0.00 0.00 135 Q 8.57 4.83 0.00 1.83 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.80 0.00 0.00 0.00 0.00 0.00 2.24 1.95 0.00 136 C 9.41 5.25 0.00 2.72 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.80 5.21 0.00 1.80 1.58 1.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.36 5.24 1.89 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.62 1.00 0.00 0.00 139 S 8.82 4.98 0.00 3.49 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 7.20 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 0.00 141 W 8.56 4.52 0.00 3.14 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 0.00 142 G 8.36 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 0.00 143 N 8.78 3.85 0.00 2.41 2.65 0.00 0.00 7.13 7.31 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 0.00 144 T 8.43 5.13 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 1.26 0.00 0.00 145 K 7.77 4.62 0.00 1.91 1.69 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 0.95 7.81 146 S 8.87 4.30 0.00 4.05 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 *147 S 8.76 4.71 0.00 3.60 3.67 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 0.00 148 G 7.01 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 0.00 149 T 7.87 4.51 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 1.21 0.00 0.00 150 S 9.44 4.28 0.00 3.74 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 8.49 4.95 0.00 2.97 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 0.00 152 P 0.00 4.66 0.00 2.48 2.10 0.00 4.13 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 153 D 8.78 4.56 0.00 2.80 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 0.00 154 V 7.41 5.37 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 1.10 0.00 0.00 0.97 0.00 0.00 155 L 8.30 3.23 0.00 1.44 1.26 -0.70 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.19 4.85 0.00 1.66 1.51 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.47 7.81 157 C 8.59 5.23 0.00 1.45 2.23 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 0.00 158 L 8.43 4.89 0.00 1.75 1.47 1.05 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.01 5.14 0.00 1.80 1.81 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.60 1.46 7.81 160 A 8.92 4.81 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.06 0.00 2.02 2.07 0.00 3.06 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.69 0.00 162 I 8.64 4.25 1.88 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.76 0.75 0.00 0.00 163 L 8.67 5.00 0.00 1.54 1.59 0.92 0.79 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 0.00 164 S 8.58 4.31 0.00 4.01 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 8.77 4.47 0.00 2.70 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 0.00 166 S 8.01 4.35 0.00 4.05 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.89 4.10 0.00 4.02 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 0.00 168 C 8.41 4.30 0.00 3.22 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 0.00 169 K 8.37 4.00 0.00 1.95 1.92 0.00 1.79 0.00 0.00 1.80 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.55 1.71 7.81 170 S 8.16 4.31 0.00 4.01 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 0.00 171 A 8.22 4.07 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 0.00 172 Y 7.88 4.73 0.00 3.12 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 0.00 173 P 0.00 4.50 0.00 2.08 2.06 0.00 3.88 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 174 G 9.04 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.21 4.57 0.00 2.52 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.98 6.61 0.00 0.00 0.00 0.00 0.00 2.28 2.53 0.00 176 I 7.92 4.43 1.98 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 1.86 1.06 1.00 0.00 0.00 177 T 8.20 4.60 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 8.55 4.31 0.00 4.00 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 8.24 4.94 0.00 2.93 3.11 0.00 0.00 6.60 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 0.00 180 M 7.98 5.59 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.62 0.00 181 F 8.82 5.14 0.00 3.07 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 0.00 182 C 9.01 5.46 0.00 2.99 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 0.00 183 A 9.11 4.99 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 184A G 6.94 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.37 4.72 0.00 3.08 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 0.00 185 L 8.85 4.07 0.00 1.71 1.74 0.91 1.02 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 0.00 186 E 8.22 3.71 0.00 1.99 1.87 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 2.23 1.88 0.00 187 G 7.65 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 188A G 9.39 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.42 5.10 0.00 1.71 1.86 0.00 0.95 0.00 0.00 1.45 0.00 0.00 2.68 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.27 7.81 189 D 9.04 4.64 0.00 2.80 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 8.72 4.96 0.00 3.98 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 0.00 191 C 9.25 4.75 0.00 2.94 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 0.00 192 Q 8.73 4.38 0.00 2.35 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.57 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 193 G 9.24 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.42 4.78 0.00 2.93 2.78 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 0.00 195 S 8.06 4.47 0.00 3.99 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 8.81 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.89 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 0.00 198 P 0.00 5.06 0.00 2.35 2.39 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 199 V 8.48 4.63 2.28 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 0.86 0.00 0.00 0.67 0.00 0.00 200 V 8.67 4.79 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 0.94 0.00 0.00 0.77 0.00 0.00 201 C 8.90 5.08 0.00 2.78 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 *202 S 9.69 3.60 0.00 3.77 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 0.00 203 G 8.49 3.98 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 0.00 0.00 0.00 204 K 7.52 4.68 0.00 1.82 1.65 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.24 4.22 0.00 1.51 1.64 1.01 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.85 4.47 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.36 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 211 G 7.99 5.25 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 0.00 212 I 8.24 5.15 1.93 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 1.30 0.79 0.89 0.00 0.00 213 V 8.83 3.47 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 0.96 0.00 0.00 1.24 0.00 0.00 214 S 8.40 4.89 0.00 3.99 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 0.00 215 W 7.59 5.08 0.00 3.40 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 0.00 216 G 8.35 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 0.00 0.00 0.00 217 S 8.36 4.66 0.00 4.36 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 *219 G 7.99 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.10 4.84 0.00 2.95 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 221A A 9.23 4.35 1.40 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 0.00 0.00 221 Q 7.52 4.43 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 222 K 8.37 4.34 0.00 1.77 1.60 0.00 1.94 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.03 7.81 223 N 9.45 4.37 0.00 2.79 2.89 0.00 0.00 6.77 7.79 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 0.00 224 K 7.42 4.30 0.00 1.73 1.74 0.00 1.54 0.00 0.00 1.24 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.46 7.81 225 P 0.00 4.64 0.00 2.25 2.10 0.00 3.69 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00 226 G 8.41 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.66 4.45 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 0.43 0.00 0.00 -0.66 0.00 0.00 228 Y 8.30 4.85 0.00 1.43 2.28 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 0.00 229 T 8.61 4.41 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 0.00 230 K 9.60 5.10 0.00 2.14 1.97 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.60 7.81 231 V 8.93 3.92 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 1.14 0.00 0.00 1.15 0.00 0.00 232 C 8.38 4.49 0.00 3.15 3.36 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 0.00 233 N 7.94 4.32 0.00 2.47 2.31 0.00 0.00 6.78 7.35 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 0.00 234 Y 8.15 4.81 0.00 3.19 3.18 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 0.00 235 V 8.11 3.70 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 1.10 0.00 0.00 236 S 8.07 4.11 0.00 3.98 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 0.00 237 W 8.37 4.24 0.00 3.48 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 8.57 3.23 2.05 0.00 0.00 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 1.72 1.04 0.80 0.00 0.00 239 K 8.12 3.71 0.00 1.79 1.79 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.58 7.81 240 Q 8.03 3.84 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 241 T 7.25 3.52 3.24 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 0.69 0.00 0.00 242 I 6.91 2.23 1.43 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 -0.36 0.49 0.00 0.00 243 A 7.47 4.14 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 0.00 244 S 7.53 4.80 0.00 4.02 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 0.00 245 N 8.01 4.61 0.00 3.03 3.01 0.00 0.00 6.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.