NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2804 7.8827 121.4509 61.2256 38.7212 173.7799 17 V 4.3001 8.5903 126.0920 61.8688 32.6291 174.5581 18 G 3.8205 8.4747 114.0267 46.5645 0.0000 173.3877 19 G 4.2131 7.7178 109.8292 44.2680 0.0000 172.6969 20 Y 4.9620 7.8146 116.6305 55.2127 42.1499 174.9250 21 T 4.2161 8.5878 117.4172 64.0701 68.3492 175.2417 22 C 4.2476 8.6853 125.3789 59.0827 35.4949 175.4446 23 G 4.0442 8.3952 105.3555 44.7490 0.0000 172.5775 24 A 4.3489 8.3768 125.4362 53.1610 18.7256 177.0879 25 N 4.2804 8.8743 119.4865 54.5633 36.0070 175.2442 26 T 4.2361 7.6041 107.1346 62.4877 69.6879 175.3139 27 V 4.0718 7.0335 122.3671 60.3262 31.3464 173.5094 28 P 4.5027 0.0000 0.0000 63.9349 32.1687 178.0904 29 Y 4.9887 6.9117 115.9701 56.6047 38.7976 174.6275 30 Q 4.6039 7.4268 123.5939 56.1490 29.6335 175.1870 31 V 4.7439 8.8440 125.7807 61.1890 35.1953 173.7608 32 S 4.7989 8.7344 120.8559 56.5239 64.6651 172.5858 33 L 4.5251 8.4612 127.7925 53.4575 43.2781 175.1165 34 N 5.8185 8.9451 122.2419 49.8629 42.0609 174.8493 *37 S 4.4374 8.3661 121.0590 58.3065 64.0062 174.4461 38 G 3.9703 9.9290 107.2539 45.8180 0.0000 172.1562 39 Y 4.5006 6.6293 114.8982 56.1956 39.9195 172.5812 40 H 4.5243 8.8723 121.9401 56.1054 30.2942 174.7366 41 F 5.0161 7.7736 120.3119 56.8938 39.6743 174.0177 42 C 4.7009 6.8735 114.9915 56.3069 44.7517 173.2299 43 G 4.1623 8.5190 109.2719 45.7299 0.0000 172.0590 44 G 4.4308 7.9351 105.6514 46.4537 0.0000 172.6551 45 S 5.5129 8.7619 115.3749 56.3929 66.9039 173.7538 46 L 4.6046 9.3179 128.0464 55.0077 42.3788 177.1120 47 I 4.5339 8.5380 119.5154 60.9080 38.6527 174.3629 48 N 4.7469 7.5307 117.5085 52.3189 39.5630 174.7449 49 S 4.3453 8.6276 111.4419 60.3067 63.3755 174.4660 50 Q 4.5666 9.3889 121.2815 55.3065 31.0052 174.2636 51 W 5.6176 8.4771 117.1379 55.6411 33.5193 174.3341 52 V 5.1807 9.1563 123.4058 61.0525 34.5386 174.3777 53 V 4.9722 8.7777 126.1518 60.5292 33.8342 174.9011 54 S 5.0155 8.9052 116.5569 57.8262 66.0005 172.2094 55 A 4.6051 8.5096 120.5036 50.7618 20.2838 178.5352 56 A 3.7966 8.2311 123.9559 55.2278 18.4592 179.3804 57 H 4.5260 8.1144 109.6907 57.5645 28.7203 175.4672 58 C 4.6871 7.9332 117.0702 57.3947 40.4944 173.3090 59 Y 4.2109 7.6975 122.0963 57.8526 38.8145 175.1959 60 K 3.8641 6.7497 125.0179 55.1949 34.9513 174.8316 61 S 4.2866 8.0641 118.9251 58.5638 64.3449 173.3088 62 G 3.6457 8.4645 106.6977 46.6170 0.0000 173.5366 63 I 4.2619 7.5730 119.8220 59.9888 39.1822 175.0628 64 Q 4.8036 8.7479 128.3238 54.2374 31.4525 174.1371 65 V 4.3909 8.7662 127.2182 61.7849 33.5268 174.5412 66 R 5.0864 8.9769 127.3984 54.6400 32.3920 175.1239 67 L 4.7319 9.0533 124.6854 52.6946 44.7111 177.5691 *69 G 3.8832 8.2650 108.1258 45.3955 0.0000 172.8223 70 E 4.4244 8.1970 118.3407 55.5058 30.1383 174.2260 71 D 4.7879 7.9795 117.2963 55.3583 44.0436 174.4545 72 N 4.8579 8.4255 121.5371 53.3621 39.2034 176.0087 73 I 3.7032 8.4945 120.2693 62.3912 37.8219 176.3834 74 N 4.7225 8.6750 118.0082 53.1054 39.4435 174.8754 75 V 4.3852 7.2073 117.5333 60.5003 33.9766 174.9787 76 V 4.0457 8.4038 126.8175 62.8396 31.8272 175.2253 77 E 4.5222 9.5963 125.9755 54.9761 32.0930 176.3101 78 G 4.0195 8.9468 106.6008 45.7331 0.0000 174.7382 79 N 4.6744 9.0068 116.7002 52.8520 36.7258 174.4786 80 E 4.5075 7.2981 116.2136 56.4235 30.5497 176.4711 81 Q 4.4709 9.0240 120.6450 54.2509 32.9830 174.0190 82 F 5.5945 8.8392 122.3202 55.9140 41.3840 175.0941 83 I 4.7100 8.7308 123.9445 59.4992 41.2172 175.3947 84 S 4.6130 8.7352 122.1843 58.2429 64.3257 173.1402 85 A 4.5557 8.3426 125.1837 52.0583 18.2253 177.9460 86 S 4.5268 8.9547 118.0571 60.0691 64.4222 174.7138 87 K 4.6803 7.5767 117.3491 55.7106 35.5934 174.8427 88 S 5.1806 8.7995 117.6312 56.9970 66.0598 173.7846 89 I 4.4848 9.1217 125.5010 59.2901 39.1446 174.8815 90 V 4.0543 8.2409 127.0163 62.3251 32.6288 175.1270 91 H 3.8062 8.6448 127.1155 56.0229 29.9390 174.3391 92 P 4.3042 0.0000 0.0000 65.3718 31.3492 177.1499 93 S 4.7191 7.9061 111.6778 58.0928 63.1021 173.3250 94 Y 4.3477 7.9294 122.4144 57.7783 39.0071 174.9572 95 N 4.5476 8.2222 125.0989 51.3869 40.5723 175.1879 96 S 3.7573 7.9764 120.3747 60.1523 63.6131 174.9580 97 N 4.4166 8.4966 119.2331 55.0987 38.6677 176.0543 98 T 4.0188 7.7508 105.9512 60.8014 70.0642 175.3047 99 L 3.8152 7.9610 120.2174 55.1120 40.0319 173.9796 100 N 4.4479 7.8182 118.1815 54.8144 39.3440 174.5885 101 N 4.9423 8.7270 119.8564 54.2050 35.8128 175.3435 102 D 4.6169 8.0708 118.3941 53.3462 39.8788 174.3345 103 I 4.7456 7.2609 121.6644 59.3486 42.1292 172.4635 104 M 5.3695 9.1666 126.6122 54.1544 36.3012 173.3150 105 L 5.3295 9.2232 124.7846 53.2641 44.7269 175.3934 106 I 4.9934 9.1568 123.7287 59.4202 40.4455 174.3757 107 K 3.6804 8.6114 129.0042 54.8713 33.4101 175.7049 108 L 4.5187 8.2315 127.9468 54.0685 42.0104 177.0677 109 K 4.0400 8.8379 124.6754 59.0994 32.5894 176.9842 110 S 4.6988 7.7454 112.5281 55.9961 66.8637 173.1198 111 A 4.4524 8.3466 123.6005 51.8284 18.7024 177.6293 112 A 4.2552 9.0020 124.0514 51.9309 19.6268 177.2292 113 S 4.4821 9.0541 115.6378 57.3017 62.8163 173.7832 114 L 4.8063 8.3173 127.6517 53.7527 43.5135 176.6047 115 N 4.5064 8.2123 117.5911 53.2781 40.8234 174.2822 116 S 4.2267 9.0200 111.0162 61.8439 62.6591 176.4251 117 R 4.2544 7.8599 116.2663 56.8125 30.6129 176.3401 118 V 4.5187 7.5622 117.6792 60.8714 34.3060 173.5935 119 A 5.0507 8.5569 127.4751 50.8584 22.9285 175.3992 120 S 5.0422 8.6786 114.3137 57.8727 64.8088 173.0943 121 I 4.4205 8.1094 121.0933 59.2446 39.4581 175.3970 122 S 4.4820 8.3591 123.9918 58.0136 64.1957 173.9114 123 L 4.1946 8.3683 123.3352 53.7410 42.2301 175.4599 124 P 4.4991 0.0000 0.0000 63.0268 32.3793 176.2509 125 T 4.1895 8.2315 108.7798 62.3751 70.0642 174.6131 *127 S 4.8749 7.5724 114.7638 57.9319 64.0402 174.1723 128 C 4.3701 8.4508 118.3168 56.9275 40.6221 173.5335 129 A 4.4146 8.0226 125.3313 51.3286 19.6623 177.4994 130 S 4.3029 8.0834 114.5680 57.0786 64.8105 173.1517 *132 A 4.3313 8.2001 123.2029 53.5223 19.2384 176.6924 133 G 4.0137 9.1879 110.8866 45.4206 0.0000 174.4493 134 T 3.9095 7.7150 117.1154 63.9300 69.3669 173.3035 135 Q 4.7617 8.5733 127.3246 55.5078 30.5344 175.0490 136 C 5.2421 9.1794 122.1364 55.2758 45.9976 172.2294 137 L 5.2523 9.0791 122.1683 53.5184 44.1125 174.9919 138 I 5.2431 9.0268 127.0952 58.8443 40.1000 174.8093 139 S 4.8604 8.3769 119.2022 56.6615 66.3728 173.1195 140 G 3.7436 7.4344 107.9845 46.2947 0.0000 173.0877 141 W 5.0217 8.7698 117.1062 56.2945 29.4174 176.9802 142 G 4.1641 8.2027 109.0157 44.3571 0.0000 173.5114 143 N 3.8832 8.8388 118.5564 54.2634 38.9366 174.6639 144 T 5.0739 8.3956 113.7899 60.6181 69.6371 174.4752 145 K 4.6340 7.6876 121.3769 54.7130 34.9878 176.3458 146 S 4.2024 8.8577 119.4678 61.1345 62.9350 174.7418 147 S 4.4447 8.0248 117.5373 58.5160 63.1537 172.1630 148 G 3.8230 7.8129 110.8141 43.7816 0.0000 170.5966 149 T 4.7152 8.0267 115.0173 61.8258 72.2203 174.3754 150 S 4.3419 9.3012 121.1657 57.8552 65.6116 172.2673 151 Y 4.9487 8.6390 125.8568 55.9399 39.1296 174.2739 152 P 4.7399 0.0000 0.0000 62.1563 33.2064 175.9742 153 D 4.5528 8.7641 118.6302 56.9995 41.2334 177.3758 154 V 5.1652 7.4190 109.7448 58.9033 33.9755 175.7016 155 L 3.2462 8.3459 123.9474 54.8535 43.0490 175.8388 156 K 4.9172 8.0134 124.5558 54.8458 35.1183 174.5792 157 C 5.2663 8.5055 119.9873 55.0874 44.1662 172.9513 158 L 5.0030 8.7042 123.1257 53.6859 45.4663 174.7714 159 K 5.0704 9.0190 125.4063 55.5410 33.5172 175.8918 160 A 4.8739 9.1542 125.1344 50.2847 23.1989 173.5799 161 P 4.9740 0.0000 0.0000 61.8060 33.9530 175.1917 162 I 4.3935 8.4463 123.2318 61.4952 37.9893 175.9541 163 L 4.7783 8.6858 127.6265 53.3941 43.2140 176.9547 164 S 4.3691 8.4238 114.7616 58.0423 64.0481 174.9751 165 D 4.4140 8.8209 122.1896 57.7451 40.4281 179.4488 166 S 4.1639 7.9865 114.2113 61.6388 63.1901 176.6271 167 S 4.0963 8.0449 118.6870 61.1645 62.6436 175.8958 168 C 4.3138 8.4669 121.4067 59.8069 43.2781 175.9085 169 K 3.9816 8.3146 118.9664 59.3454 31.6411 179.3155 170 S 4.2624 8.2107 115.1202 61.3892 62.7659 176.1508 171 A 3.9942 7.8816 122.8733 53.8919 19.6711 177.3994 172 Y 4.8819 7.7403 113.3335 55.0840 38.3925 172.9171 173 P 4.4930 0.0000 0.0000 64.3422 32.2115 177.5852 174 G 4.0038 9.0688 110.5072 45.9646 0.0000 173.5498 175 Q 4.5351 8.2027 116.7896 55.4749 30.0236 175.3084 176 I 4.4115 7.8252 119.9377 59.9374 38.5121 175.5565 177 T 4.5142 8.2355 115.9451 59.8311 70.6919 175.2916 178 S 4.4270 8.5304 114.3814 59.9473 63.1485 174.2157 179 N 4.9701 8.2096 118.4770 53.4106 38.5414 173.8400 180 M 5.6064 7.9351 116.7779 53.7216 36.0562 174.6768 181 F 5.1262 8.7814 115.3772 55.7112 42.1338 172.6730 182 C 5.4279 8.9939 116.6524 56.0096 41.3437 172.5732 183 A 4.9888 9.3895 122.6708 51.0598 22.4173 175.4194 184A G 4.1413 7.0621 107.1248 44.6420 0.0000 172.8431 184 Y 4.5883 8.4361 119.3038 56.1159 41.4269 176.3150 185 L 4.1987 8.6621 125.2350 57.2613 42.0264 178.6044 186 E 4.0993 8.2128 115.0184 56.8834 29.9077 177.6684 187 G 3.9235 7.6272 105.1675 45.8879 0.0000 173.5656 188A G 3.9923 9.8890 107.1121 44.7131 0.0000 173.5143 188 K 4.9529 7.3000 117.8173 55.2652 35.6749 175.0168 189 D 4.6769 8.8097 123.3635 53.6403 45.6049 174.8704 190 S 4.9114 8.8068 117.0523 58.3025 65.0329 172.9054 191 C 4.7502 9.4053 119.2439 55.1638 43.6418 172.2853 192 Q 4.2800 8.6911 118.1635 58.1962 27.9342 177.5193 193 G 4.5332 9.2995 110.3861 45.7779 0.0000 174.0444 194 D 4.6676 8.6261 118.7508 55.7559 41.5855 176.4778 195 S 4.3847 7.9909 114.7771 59.8256 63.3055 175.5545 196 G 4.0097 8.8466 113.0876 46.4088 0.0000 173.7174 197 G 4.2451 7.9414 107.4314 45.1151 0.0000 171.2337 198 P 5.0797 0.0000 0.0000 62.3370 33.4417 175.5414 199 V 4.6004 8.7138 121.8582 61.4287 34.1234 174.0544 200 V 4.8300 8.7913 128.9828 61.2901 34.1132 173.7489 201 C 5.0687 8.8832 124.7940 55.4283 43.8647 174.6243 202 S 3.7165 9.6623 121.4974 59.7569 59.9228 173.3504 203 G 3.9229 8.3675 104.2907 45.6816 0.0000 173.6084 204 K 4.6831 7.6376 118.0164 53.0430 35.1759 175.4902 *209 L 4.3591 8.2660 122.7896 55.4400 42.1796 175.8173 210 Q 4.4792 8.8747 126.1885 56.8957 30.7563 175.9699 211 G 5.3068 8.0377 104.3259 45.6909 0.0000 171.4538 212 I 5.2926 8.1923 119.8380 58.8204 41.1102 175.1577 213 V 3.7184 8.9716 127.1958 64.0884 31.8035 174.3526 214 S 4.8351 8.4812 120.9303 58.6866 64.1656 173.9373 215 W 5.0946 7.6122 113.9737 55.6929 32.1500 172.2542 216 G 4.0135 8.4259 106.0466 46.4156 0.0000 173.0854 217 S 4.6958 8.4759 114.7293 56.5708 62.6396 172.5730 *219 G 4.1994 8.0184 118.4285 45.6455 0.0000 170.9265 220 C 4.7530 8.1356 116.4194 56.3581 43.7358 173.9257 221A A 3.9740 9.1808 127.0704 53.2555 16.6393 176.9443 221 Q 4.4859 7.3601 117.7906 56.2896 29.6902 176.0089 222 K 4.2785 8.4868 122.7238 58.1058 32.5746 176.3128 223 N 4.3260 9.2387 122.1159 53.8863 36.7558 175.2410 224 K 4.2317 7.6265 117.8251 53.4931 32.4070 173.8950 225 P 4.6322 0.0000 0.0000 61.9626 33.0280 176.8394 226 G 3.7138 8.5243 106.5771 46.0847 0.0000 172.7667 227 V 4.5263 7.6093 121.2671 60.7251 34.1780 174.1099 228 Y 4.8576 8.1156 124.0273 56.0442 42.3101 174.8405 229 T 4.3785 8.5019 119.7853 63.4794 70.0788 174.3834 230 K 5.0047 9.3950 128.5374 55.5891 31.5053 177.3236 231 V 4.0114 8.8174 126.7336 65.6365 31.3905 174.9535 232 C 4.3519 8.3081 112.8781 58.1873 41.5541 174.7773 233 N 4.2417 7.9722 117.0375 54.4608 38.5439 175.4791 234 Y 4.7719 7.9594 117.4914 57.3319 39.0987 177.3146 235 V 3.7002 7.8768 120.6952 66.3177 31.5470 177.9273 236 S 4.1393 8.0828 114.3567 61.2527 62.6848 176.2974 237 W 4.1192 8.2881 130.6651 60.4004 30.4782 177.9338 238 I 3.2311 8.3706 120.1653 64.2268 36.4999 178.5799 239 K 3.7706 8.0624 119.2424 59.5499 31.7417 179.5275 240 Q 3.8655 8.0911 118.3858 59.1274 28.3621 178.9974 241 T 3.5576 7.3220 115.9995 66.5629 68.5468 176.6741 242 I 2.8038 7.3461 121.7263 63.7838 36.7085 178.3414 243 A 4.0664 7.9256 121.1607 53.9587 18.1907 178.7025 244 S 4.6513 7.3382 110.8238 58.2620 63.5159 174.0663 245 N 4.6666 7.9495 125.4292 53.9183 39.4111 174.0341 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 4.28 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 1.34 0.52 0.86 0.00 0.00 17 V 8.59 4.30 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 0.92 0.00 0.00 0.89 0.00 0.00 18 G 8.47 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.72 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 20 Y 7.81 4.96 0.00 2.93 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 21 T 8.59 4.22 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 1.24 0.00 0.00 22 C 8.69 4.25 0.00 2.73 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 23 G 8.40 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.38 4.35 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 8.87 4.28 0.00 2.90 2.93 0.00 0.00 7.14 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 7.60 4.24 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 1.23 0.00 0.00 27 V 7.03 4.07 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 0.27 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.50 0.00 2.38 2.28 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.00 0.00 29 Y 6.91 4.99 0.00 3.27 3.40 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 30 Q 7.43 4.60 0.00 1.78 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.68 0.00 0.00 0.00 0.00 0.00 1.96 2.48 0.00 31 V 8.84 4.74 2.20 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 0.90 0.00 0.00 1.00 0.00 0.00 32 S 8.73 4.80 0.00 3.04 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 33 L 8.46 4.53 0.00 0.50 0.76 0.77 0.12 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 8.95 5.82 0.00 2.40 2.46 0.00 0.00 6.78 7.46 0.00 0.00 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 8.37 4.44 0.00 3.78 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 38 G 9.93 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 39 Y 6.63 4.50 0.00 3.01 2.92 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 40 H 8.87 4.52 0.00 2.83 3.14 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.77 5.02 0.00 3.02 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.87 4.70 0.00 2.23 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 43 G 8.52 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 0.00 0.00 0.00 44 G 7.94 4.43 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 0.00 0.00 0.00 45 S 8.76 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 9.32 4.60 0.00 1.86 1.69 1.07 0.79 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 47 I 8.54 4.53 1.89 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 1.57 0.89 0.95 0.00 0.00 48 N 7.53 4.75 0.00 2.99 3.01 0.00 0.00 6.01 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 8.63 4.35 0.00 4.18 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 50 Q 9.39 4.57 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.03 2.19 0.00 51 W 8.48 5.62 0.00 3.32 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 52 V 9.16 5.18 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 1.01 0.00 0.00 0.99 0.00 0.00 53 V 8.78 4.97 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 0.77 0.00 0.00 1.07 0.00 0.00 54 S 8.91 5.02 0.00 3.89 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 8.51 4.61 1.11 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 0.00 0.00 56 A 8.23 3.80 0.32 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 0.00 0.00 57 H 8.11 4.53 0.00 3.34 3.55 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 7.93 4.69 0.00 3.20 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 59 Y 7.70 4.21 0.00 3.01 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 60 K 6.75 3.86 0.00 1.24 1.18 0.00 0.77 0.00 0.00 1.22 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 1.02 7.81 61 S 8.06 4.29 0.00 3.96 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 62 G 8.46 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 7.57 4.26 1.87 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.71 0.93 0.00 0.00 64 Q 8.75 4.80 0.00 2.03 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.86 0.00 0.00 0.00 0.00 0.00 2.06 2.21 0.00 65 V 8.77 4.39 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 0.89 0.00 0.00 0.89 0.00 0.00 66 R 8.98 5.09 0.00 1.50 1.83 0.00 2.65 0.00 0.00 2.57 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.16 0.00 67 L 9.05 4.73 0.00 1.60 1.70 0.98 0.88 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 *69 G 8.26 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 0.00 0.00 0.00 70 E 8.20 4.42 0.00 2.16 1.96 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 2.36 2.05 0.00 71 D 7.98 4.79 0.00 2.77 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.43 4.86 0.00 2.84 2.86 0.00 0.00 7.19 7.12 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 73 I 8.49 3.70 1.46 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.55 -0.35 0.00 0.00 74 N 8.67 4.72 0.00 2.82 2.89 0.00 0.00 6.65 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.21 4.39 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 8.40 4.05 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 0.84 0.00 0.00 0.95 0.00 0.00 77 E 9.60 4.52 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 78 G 8.95 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 79 N 9.01 4.67 0.00 2.95 3.08 0.00 0.00 6.95 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 7.30 4.51 0.00 1.58 1.71 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 2.50 2.41 0.00 81 Q 9.02 4.47 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.84 5.59 0.00 2.79 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 83 I 8.73 4.71 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.79 0.89 0.00 0.00 84 S 8.74 4.61 0.00 3.75 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 85 A 8.34 4.56 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 86 S 8.95 4.53 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 7.58 4.68 0.00 1.83 1.88 0.00 1.42 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.24 1.45 7.81 88 S 8.80 5.18 0.00 4.09 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 I 9.12 4.48 2.05 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.01 1.06 0.00 0.00 90 V 8.24 4.05 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 0.66 0.00 0.00 0.76 0.00 0.00 91 H 8.64 3.81 0.00 2.87 2.97 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 4.30 0.00 2.05 2.15 0.00 3.31 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 93 S 7.91 4.72 0.00 3.98 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 94 Y 7.93 4.35 0.00 2.89 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 95 N 8.22 4.55 0.00 2.61 2.45 0.00 0.00 6.69 7.13 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 96 S 7.98 3.76 0.00 3.91 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 8.50 4.42 0.00 2.71 2.79 0.00 0.00 6.88 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 7.75 4.02 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 1.12 0.00 0.00 99 L 7.96 3.82 0.00 1.62 1.93 0.70 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.82 4.45 0.00 2.84 2.67 0.00 0.00 7.23 6.61 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 0.00 101 N 8.73 4.94 0.00 2.93 2.61 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 8.07 4.62 0.00 3.08 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.26 4.75 1.45 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.21 0.07 0.00 0.00 104 M 9.17 5.37 0.00 2.11 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 2.75 2.64 0.00 105 L 9.22 5.33 0.00 1.83 1.91 1.00 0.45 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 0.00 106 I 9.16 4.99 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 0.90 0.89 0.00 0.00 107 K 8.61 3.68 0.00 0.79 1.12 0.00 1.36 0.00 0.00 1.34 0.00 0.00 2.60 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.71 0.21 7.81 108 L 8.23 4.52 0.00 1.50 1.55 0.97 0.76 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 0.00 109 K 8.84 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 7.75 4.70 0.00 3.82 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 0.00 111 A 8.35 4.45 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 0.00 112 A 9.00 4.26 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 9.05 4.48 0.00 3.88 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 0.00 114 L 8.32 4.81 0.00 1.70 1.60 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.21 4.51 0.00 2.77 2.75 0.00 0.00 6.89 8.11 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 0.00 116 S 9.02 4.23 0.00 3.87 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 0.00 117 R 7.86 4.25 0.00 1.85 1.97 0.00 3.21 0.00 0.00 3.16 7.33 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.87 0.00 4.00 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 0.00 128 C 8.45 4.37 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 4.41 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 8.08 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 4.33 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 9.19 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 0.00 134 T 7.71 3.91 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 8.57 4.76 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 136 C 9.18 5.24 0.00 2.80 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 0.00 137 L 9.08 5.25 0.00 1.75 1.56 0.97 1.15 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 0.00 138 I 9.03 5.24 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.58 0.99 0.00 0.00 139 S 8.38 4.86 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 7.43 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 0.00 141 W 8.77 5.02 0.00 3.09 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 0.00 142 G 8.20 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 0.00 0.00 0.00 143 N 8.84 3.88 0.00 2.26 2.63 0.00 0.00 7.14 7.73 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 0.00 144 T 8.40 5.07 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 nan 0.00 0.00 145 K 7.69 4.63 0.00 1.77 1.69 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.29 1.36 7.81 146 S 8.86 4.20 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 8.02 4.44 0.00 3.81 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 7.81 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.03 4.72 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 150 S 9.30 4.34 0.00 3.77 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 0.00 151 Y 8.64 4.95 0.00 2.99 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 4.74 0.00 2.43 2.10 0.00 4.20 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.05 0.00 153 D 8.76 4.55 0.00 2.81 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 0.00 154 V 7.42 5.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.96 0.00 0.00 155 L 8.35 3.25 0.00 1.23 1.23 -0.67 0.26 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 8.01 4.92 0.00 1.64 1.50 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.47 7.81 157 C 8.51 5.27 0.00 1.65 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 8.70 5.00 0.00 1.69 1.46 1.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.02 5.07 0.00 1.82 1.82 0.00 1.98 0.00 0.00 1.77 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.60 7.81 160 A 9.15 4.87 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 4.97 0.00 2.01 2.07 0.00 3.12 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.71 0.00 162 I 8.45 4.39 1.87 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 1.01 0.52 0.72 0.00 0.00 163 L 8.69 4.78 0.00 1.56 1.60 0.92 1.16 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 8.42 4.37 0.00 4.00 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 0.00 165 D 8.82 4.41 0.00 2.80 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 7.99 4.16 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 8.04 4.10 0.00 4.07 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 8.47 4.31 0.00 3.16 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 0.00 169 K 8.31 3.98 0.00 1.78 1.91 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.68 7.81 170 S 8.21 4.26 0.00 3.93 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 7.88 3.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.74 4.88 0.00 3.12 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.49 0.00 2.09 2.07 0.00 3.84 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 2.06 2.25 0.00 174 G 9.07 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 0.00 175 Q 8.20 4.54 0.00 2.47 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.60 0.00 0.00 0.00 0.00 0.00 2.30 2.61 0.00 176 I 7.83 4.41 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 1.84 0.96 0.99 0.00 0.00 177 T 8.24 4.51 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 1.26 0.00 0.00 178 S 8.53 4.43 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.21 4.97 0.00 3.07 3.07 0.00 0.00 6.68 7.04 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 0.00 180 M 7.94 5.61 0.00 1.87 2.11 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.57 0.00 181 F 8.78 5.13 0.00 3.05 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.99 5.43 0.00 2.99 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 9.39 4.99 1.12 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 184A G 7.06 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 0.00 184 Y 8.44 4.59 0.00 3.06 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 0.00 185 L 8.66 4.20 0.00 1.73 1.73 0.91 0.86 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 0.00 186 E 8.21 4.10 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.27 0.00 187 G 7.63 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 188A G 9.89 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 0.00 188 K 7.30 4.95 0.00 1.26 1.60 0.00 1.47 0.00 0.00 0.76 0.00 0.00 2.18 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.35 1.27 7.81 189 D 8.81 4.68 0.00 2.76 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.81 4.91 0.00 4.00 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 0.00 191 C 9.41 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 8.69 4.28 0.00 2.43 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.31 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 193 G 9.30 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.63 4.67 0.00 2.97 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 7.99 4.38 0.00 4.00 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 0.00 196 G 8.85 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 0.00 197 G 7.94 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 5.08 0.00 2.36 2.38 0.00 3.86 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 2.22 2.20 0.00 199 V 8.71 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 8.79 4.83 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 0.76 0.00 0.00 0.67 0.00 0.00 201 C 8.88 5.07 0.00 2.77 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 9.66 3.72 0.00 3.96 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 8.37 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 7.64 4.68 0.00 1.80 1.64 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.27 4.36 0.00 1.50 1.64 1.02 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 8.87 4.48 0.00 2.00 2.02 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 2.42 2.35 0.00 211 G 8.04 5.31 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 0.00 212 I 8.19 5.29 1.92 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 1.29 1.11 0.93 0.00 0.00 213 V 8.97 3.72 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 1.23 0.00 0.00 214 S 8.48 4.84 0.00 3.90 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 0.00 215 W 7.61 5.09 0.00 3.33 2.92 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 0.00 216 G 8.43 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 0.00 217 S 8.48 4.70 0.00 4.33 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 *219 G 8.02 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 0.00 0.00 0.00 0.00 220 C 8.14 4.75 0.00 2.95 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 221A A 9.18 3.97 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.36 4.49 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 222 K 8.49 4.28 0.00 1.70 1.73 0.00 2.00 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.54 7.81 223 N 9.24 4.33 0.00 2.83 2.85 0.00 0.00 6.81 7.62 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 0.00 224 K 7.63 4.23 0.00 1.76 1.81 0.00 1.70 0.00 0.00 1.34 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.51 7.81 225 P 0.00 4.63 0.00 2.14 2.11 0.00 3.55 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 226 G 8.52 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 0.00 0.00 0.00 227 V 7.61 4.53 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 0.41 0.00 0.00 -0.65 0.00 0.00 228 Y 8.12 4.86 0.00 1.43 2.25 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 0.00 229 T 8.50 4.38 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 0.00 230 K 9.39 5.00 0.00 2.09 1.90 0.00 1.80 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.68 7.81 231 V 8.82 4.01 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.13 0.00 0.00 232 C 8.31 4.35 0.00 3.16 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 0.00 233 N 7.97 4.24 0.00 2.29 2.41 0.00 0.00 6.80 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.96 4.77 0.00 3.19 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.88 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 1.09 0.00 0.00 1.03 0.00 0.00 236 S 8.08 4.14 0.00 3.98 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.29 4.12 0.00 3.48 3.55 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 0.00 238 I 8.37 3.23 2.03 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 1.66 1.06 0.77 0.00 0.00 239 K 8.06 3.77 0.00 1.82 1.77 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.49 7.81 240 Q 8.09 3.87 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 241 T 7.32 3.56 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 242 I 7.35 2.80 1.32 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.52 0.40 0.00 0.00 243 A 7.93 4.07 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 7.34 4.65 0.00 3.95 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 0.00 245 N 7.95 4.67 0.00 3.05 3.00 0.00 0.00 6.74 8.81 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 * Residues marked with a * may have inaccurate shift predictions.