NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4931 8.1927 115.4156 57.7764 64.7020 173.9763 3 L 3.2205 8.2566 120.6413 57.2691 41.6279 177.1719 4 R 3.4731 7.7832 118.5864 59.3500 30.5047 178.0844 5 S 3.9797 7.9641 114.0804 61.5021 63.0228 176.1617 6 D 4.3545 8.2762 122.5836 56.6196 40.4638 178.5727 7 L 3.8444 8.1188 121.4796 58.1502 42.1666 178.9062 8 I 3.2648 7.5323 119.7927 64.2405 36.8453 178.2258 9 N 4.2213 7.9619 116.8877 56.2509 38.3496 177.2434 10 A 3.9714 7.8932 122.0630 55.1073 18.3791 179.5943 11 L 3.9104 8.0940 117.6820 58.2383 41.7714 179.2050 12 Y 4.4444 7.7451 116.4659 61.4816 37.7644 178.7796 13 D 4.4165 8.5159 119.8100 57.3676 40.9329 178.4236 14 E 4.1318 8.5533 120.0817 59.4467 29.4230 178.3502 15 N 4.5897 8.4588 116.1106 56.9999 39.0991 176.5743 16 Q 4.1620 8.0862 118.5846 58.5529 28.9057 178.1377 17 K 3.9515 8.2031 118.9108 57.1494 32.6285 176.8293 18 Y 4.9321 7.8454 115.1217 56.0767 41.3626 174.7399 19 D 4.9336 8.7220 122.4957 52.2775 42.6496 176.4509 20 V 3.8906 7.8330 118.8945 61.6351 31.8881 176.3291 21 C 4.6773 8.3543 116.4740 57.0539 30.9261 173.0914 22 G 4.1240 7.4599 106.0661 46.2519 0.0000 172.2477 23 I 4.6617 8.4936 113.9515 59.1889 39.7875 174.6991 24 I 5.1967 8.3729 124.8379 59.3490 40.6586 174.7148 25 S 4.8672 8.7741 122.9701 56.6410 65.1255 175.0818 26 A 4.0556 8.7255 123.0998 54.7725 18.1779 178.3411 27 E 4.2401 8.1757 113.3628 56.5832 29.9478 177.3462 28 G 3.9765 8.4566 108.5911 44.6235 0.0000 173.6629 29 K 4.3587 7.6972 121.2010 56.1554 33.6628 175.4714 30 I 5.1800 8.8099 128.1730 59.8367 40.2022 173.9041 31 Y 4.8597 9.2199 124.9645 55.6620 39.9976 174.1779 32 P 4.8089 0.0000 0.0000 62.5395 32.6706 175.4631 33 L 4.5109 8.3208 120.3179 53.4849 43.2467 176.8910 34 G 3.9302 8.3261 112.5117 45.6121 0.0000 174.1779 35 S 4.7302 8.3489 112.8560 57.7374 62.9931 172.7371 36 D 5.1352 7.6260 120.5767 52.4278 43.0569 176.3494 37 T 4.0530 8.5425 119.6222 67.5560 68.1554 177.3660 38 K 3.8124 8.1279 125.0306 59.7961 31.5660 181.1440 39 V 3.6307 7.5500 118.1396 65.9248 31.5725 178.2048 40 L 3.2653 7.6815 118.9829 57.3322 41.2668 179.6128 41 S 4.2980 8.5516 116.0678 61.2870 62.8236 176.7730 42 T 3.8611 7.3323 119.1404 66.2343 68.1216 176.7586 43 I 3.6313 7.4738 121.5748 64.4405 37.1314 178.4948 44 F 4.1695 8.1834 118.9616 60.4733 38.6786 177.4422 45 E 4.1411 8.3923 118.9929 59.3921 29.2989 178.9188 46 L 4.1699 7.8554 117.9909 57.5711 41.6912 178.9338 47 F 4.3478 8.3732 120.4166 61.4338 39.6577 177.1705 48 S 4.2812 8.3905 114.8408 61.2085 62.5740 176.4516 49 R 3.7934 7.9498 120.9303 59.0622 29.9263 177.2545 50 P 4.2779 0.0000 0.0000 65.8026 31.3295 178.4627 51 I 3.6666 7.4623 119.3734 64.1119 37.1125 178.1212 52 I 3.5442 7.5341 120.7434 64.3245 36.8443 178.0399 53 N 4.2988 8.0512 117.9300 56.3764 38.7478 176.6539 54 K 3.9965 8.1487 121.1744 59.7973 32.3207 178.8622 55 I 3.7392 7.8041 119.5828 64.2432 37.0195 178.4320 56 A 4.0069 7.9834 121.7792 55.1153 18.1979 179.5562 57 E 3.9365 8.1925 117.1670 59.4762 29.3588 179.4827 58 K 3.9796 8.1033 118.3689 58.9244 32.2238 177.4394 59 H 4.9041 7.8381 113.5486 54.8022 29.1441 174.9917 60 G 3.8535 8.0526 108.6406 46.3086 0.0000 172.9229 61 Y 4.5643 8.4209 116.8132 56.0464 39.7116 175.8865 62 I 3.9923 8.0833 124.3779 60.9254 38.7598 174.9493 63 V 5.0147 8.2729 124.8535 61.2291 33.8757 174.4794 64 E 4.8611 9.3665 126.4595 54.7585 33.1859 174.9452 65 E 4.9911 8.5907 122.5497 52.8702 32.2838 174.1433 66 P 4.2255 0.0000 0.0000 63.6175 31.9032 177.7291 67 K 4.1621 8.5030 123.2318 55.8296 32.3879 175.2940 68 Q 4.5862 7.5076 117.7586 54.1940 30.6575 175.0592 69 Q 4.2140 8.3813 122.8582 56.2146 29.5468 174.8935 70 N 4.3029 8.6795 113.2019 54.9701 36.2186 174.3646 71 H 5.0276 8.1099 112.5890 54.0673 32.4341 173.0917 72 Y 4.5427 9.2783 125.9271 56.8367 40.1579 172.6446 73 P 4.6200 0.0000 0.0000 60.7130 33.4977 174.6637 74 D 4.2852 9.0073 119.0804 56.8778 41.7535 177.2654 75 F 5.0725 8.5756 116.6449 55.8441 43.0758 174.1778 76 T 5.0996 9.1841 120.6736 61.9764 70.7914 173.2466 77 L 5.9290 8.9396 127.0180 52.5504 44.9105 175.3191 78 Y 5.0762 7.9719 117.8923 56.0877 41.0099 173.8909 79 K 4.0242 8.2062 122.0945 55.1214 32.8519 176.3524 80 P 4.3756 0.0000 0.0000 64.7805 31.3420 177.1619 81 S 4.3859 8.0451 115.3861 60.1866 64.5190 175.0625 82 E 4.6213 7.4652 117.8822 52.7303 29.1514 176.6227 83 P 4.1741 0.0000 0.0000 64.8837 31.8129 177.9314 84 N 4.4733 7.8476 114.7288 53.5051 39.1162 175.2419 85 K 4.5810 7.3977 117.1566 54.6826 31.2762 175.9916 86 K 4.4356 8.3725 122.0793 55.8017 34.3701 177.0354 87 I 4.6539 8.9171 124.1334 59.4445 39.8236 174.3344 88 A 4.9421 8.5731 129.2494 50.5476 20.8103 175.6582 89 I 5.0348 8.8019 124.0230 59.5535 40.5435 174.3161 90 D 5.2835 9.1232 126.1044 52.5630 44.4731 174.1867 91 I 4.9592 9.4586 127.3903 60.6321 38.3559 175.4835 92 K 4.9975 9.2982 125.4770 55.0857 36.4806 175.4192 93 T 5.6764 8.6911 117.8708 62.6353 73.0728 172.7324 94 T 4.8061 9.0539 118.6176 61.0049 71.5999 171.6656 95 Y 4.6547 8.4522 122.3884 55.1327 41.0804 174.8781 96 T 4.2122 8.3190 109.2260 59.8219 72.2164 173.9360 97 N 4.9796 8.6580 123.8675 53.1928 38.4157 176.2077 98 K 4.1887 7.3493 128.4505 55.1407 34.7025 178.0742 *102 K 4.5471 7.8398 117.4691 56.0531 33.4469 174.7745 103 I 4.7512 9.1226 120.1867 59.8921 41.5336 174.9585 104 K 5.3001 8.1155 124.2572 54.1225 35.5868 175.7067 105 F 5.1413 9.8753 122.5552 55.2860 42.9174 174.2643 106 T 4.8114 8.6895 111.1153 60.3346 70.3134 174.6799 107 L 4.7410 9.1599 125.6210 54.4272 42.5686 177.6580 108 G 3.9603 8.6246 104.2338 44.9114 0.0000 174.1070 109 G 3.7860 7.9224 107.6463 45.3680 0.0000 173.3038 110 Y 4.4921 8.0676 117.1662 56.6121 38.4444 176.8564 111 T 4.6349 7.3082 108.7205 61.5560 71.1335 173.8436 112 S 4.6527 6.9489 119.1066 57.6009 61.1118 177.1993 113 F 4.9103 8.8842 116.2442 58.9426 37.1238 176.6612 114 I 2.9650 6.6563 112.2824 61.7445 37.7874 176.3160 115 R 4.3489 7.8418 121.5309 56.8260 31.9959 176.5034 116 N 4.9396 7.5448 115.4520 50.0598 40.9803 179.3633 117 N 4.4938 9.1072 122.9040 55.5759 39.0709 175.8858 118 T 4.6125 7.8931 111.2858 62.8497 69.3832 173.2828 119 K 4.2209 8.1819 123.6876 56.2284 32.3682 175.8078 120 N 3.9571 8.8813 124.4291 54.2045 36.0276 173.6025 121 I 5.1499 7.6594 115.6634 58.9599 41.2899 175.1499 122 V 3.7213 8.7514 127.0198 65.5257 31.6177 175.8695 123 Y 4.9471 7.7524 114.3580 55.0169 41.9485 172.9343 124 P 4.6452 0.0000 0.0000 63.1721 32.3415 177.3033 125 F 4.4237 9.8172 125.1587 61.5176 39.4123 176.5002 126 D 4.6737 8.5682 117.8752 54.8239 39.5105 176.7136 127 Q 4.1558 8.3778 119.1878 56.5111 29.2381 174.4954 128 Y 4.7951 7.6756 116.9972 56.4863 39.0311 175.4508 129 I 4.3981 8.2310 117.4953 61.2453 39.0652 175.5433 130 A 4.7753 7.5302 123.8561 51.0316 22.9570 175.0300 131 H 5.1640 9.0234 116.8691 54.0213 32.0659 172.2348 132 W 5.4311 9.5312 124.2297 55.4881 31.3846 175.6489 133 I 4.9707 9.3352 124.7862 59.7823 39.5204 174.7960 134 I 4.3479 8.7078 129.3087 59.9202 38.2214 174.7543 135 G 3.2014 7.2094 115.3819 44.2199 0.0000 170.7303 136 Y 5.0425 9.0666 122.5336 55.9305 41.0473 174.8663 137 V 5.1185 9.0173 124.1762 61.1882 34.7282 173.7839 138 Y 5.3729 8.3294 124.7386 55.5552 41.9897 174.3166 139 T 5.3718 8.5995 118.9646 62.2501 69.9113 174.6000 140 R 4.5562 8.7254 126.1222 57.3866 30.9943 174.7259 141 V 3.6338 8.8302 119.2402 62.5477 29.7803 178.7214 *147 S 4.3056 9.0902 123.8676 59.8208 64.3135 174.1292 148 L 4.7960 8.3704 120.6213 54.6570 41.7350 174.7907 149 K 4.8214 7.7205 121.7653 54.2091 35.7932 178.0242 150 T 4.4874 7.8866 109.0012 61.4712 71.3419 172.8167 151 Y 5.0286 8.5523 119.0808 56.6477 43.2972 173.4255 152 N 5.4111 9.0565 117.2871 50.8304 40.6689 175.5626 153 I 3.6256 8.7466 121.5844 65.4842 37.1260 178.6981 154 N 4.5836 8.3154 114.8875 53.9482 37.7374 177.3222 155 E 4.7040 8.3596 116.3038 56.9206 30.2250 177.5901 156 L 3.9020 7.7881 122.2467 58.2384 41.6600 179.6015 157 N 4.4355 8.1362 113.1805 55.1231 38.6010 175.4489 158 E 4.4186 7.8066 114.8448 55.6998 30.0077 175.7278 159 I 3.2959 7.0410 121.7572 59.7306 37.4538 174.0397 160 P 4.2025 0.0000 0.0000 62.5312 31.6542 176.2229 161 K 3.9015 8.2512 122.9842 55.2749 32.7108 175.0827 162 P 4.8059 0.0000 0.0000 62.4725 31.5745 175.1751 163 Y 5.1727 6.6786 114.9469 56.6710 40.9328 174.5896 164 K 4.3207 8.9150 122.1622 59.0054 33.1662 177.5808 165 G 4.3683 7.9454 104.6517 45.0385 0.0000 172.1811 166 V 5.0448 8.2786 121.5060 60.7074 34.7898 174.6891 167 K 4.6482 9.2146 126.4211 54.3556 35.4411 175.4754 168 V 4.7575 8.3975 122.9853 59.9051 34.2454 174.6227 169 F 5.1618 8.2929 116.2844 55.4329 41.8865 172.9079 170 L 5.1524 8.5546 121.5192 53.5444 44.0748 175.0276 171 Q 4.5290 9.2531 126.8349 54.0907 33.6730 173.8074 172 D 5.0222 8.5305 122.1873 53.6595 41.9336 177.5012 173 K 3.9476 9.1886 125.4693 59.6116 32.0587 179.0093 174 W 3.1489 8.0282 116.2054 59.6013 27.5439 178.0291 175 V 2.5211 6.1651 117.5950 64.3822 30.7751 176.9668 176 I 4.0407 7.2737 110.0459 59.5777 38.2101 175.4116 177 A 4.4523 7.2208 124.9318 52.5613 18.9714 177.6640 178 G 4.2576 8.9984 112.2467 44.2246 0.0000 172.6797 179 D 4.6414 8.5887 116.6413 52.8400 40.4111 175.6296 180 L 5.1262 7.7572 120.1934 52.8017 44.3316 175.9425 181 A 4.3540 9.1465 123.9945 52.7159 18.7466 177.5985 182 G 4.1083 9.2713 106.6412 47.2928 0.0000 174.0287 183 S 4.3979 8.0142 113.0915 57.6051 65.7176 173.2688 184 G 3.8724 9.0036 108.9982 47.3604 0.0000 175.4982 185 N 4.3563 8.1138 121.9677 54.3097 37.9619 176.1784 186 T 4.2034 7.7470 107.4027 60.9448 69.8592 175.0465 187 T 3.3388 7.4447 111.2549 62.7881 67.8979 170.8329 188 N 5.1847 7.9528 122.1110 52.3987 42.0580 176.3095 189 I 3.0585 8.7978 122.8111 60.8574 38.6063 175.3315 190 G 4.5954 8.4399 112.3390 43.9229 0.0000 173.7066 191 S 5.1083 8.7247 118.3834 57.0754 65.2110 173.3819 192 I 4.0186 8.2957 114.2405 61.3666 38.5690 175.6548 193 H 5.1658 8.7284 122.5337 54.7364 30.1527 172.4584 194 A 4.6372 8.8089 126.2651 50.2683 23.4932 174.6653 195 H 4.8503 8.5658 115.0935 55.5914 29.8439 176.1938 196 Y 4.4987 9.2300 125.2373 62.1194 38.3838 179.7644 197 K 3.8024 8.2374 123.6736 59.8438 31.6966 180.7024 198 D 4.5486 8.3075 119.4962 57.1318 40.1534 178.9285 199 F 3.5125 7.8195 118.0622 59.9768 38.6849 177.7296 200 V 3.2936 6.8639 117.1085 65.9888 31.2562 176.9100 201 E 3.9836 8.2640 116.4129 56.3541 29.6251 176.6170 202 G 3.5460 7.0147 106.2314 46.5868 0.0000 175.7239 203 K 4.1322 7.7476 119.2397 54.8451 30.9090 177.8167 204 G 4.0978 7.5490 109.8181 43.7081 0.0000 170.3285 205 I 4.2474 7.9608 110.1639 61.3875 39.6919 176.2427 206 F 4.6826 7.8583 119.3110 57.1887 39.3695 175.0267 207 D 4.6281 9.8118 125.7352 57.0684 41.4780 176.2794 208 S 4.0432 7.6399 112.1540 56.0522 66.7354 174.8907 209 E 3.3727 6.9235 121.6630 58.6503 29.1355 178.1508 210 D 4.2426 7.6513 118.0428 57.2639 41.4111 177.6041 211 E 4.0387 8.3576 120.0452 59.0748 29.6302 178.4099 212 F 2.4780 8.1149 120.6974 60.7903 39.4152 176.9070 213 L 3.3997 7.9616 118.5455 57.7944 41.2711 179.1526 214 D 4.3188 7.8350 116.2750 57.3771 41.3090 177.2087 215 Y 3.2411 7.6055 119.9394 60.3775 38.5178 178.2611 216 W 3.9199 7.4781 117.5514 58.8628 29.2757 178.2509 217 R 4.2482 7.9435 116.8434 57.4390 29.7088 176.6726 218 N 4.8021 7.3769 114.0627 52.5675 39.7801 173.5748 219 Y 3.2233 7.4889 120.5709 56.7427 39.1842 175.1841 220 E 4.1326 7.2970 126.5660 55.8536 30.4367 177.2371 221 R 4.6840 8.7917 119.8984 58.0626 30.6634 177.7742 222 T 4.7360 7.3903 106.8034 59.3346 72.9922 174.8129 223 S 4.0558 8.7641 120.6075 62.5576 62.5602 177.7801 224 Q 4.0245 8.0454 124.4835 60.7684 28.2229 181.8308 225 L 4.2597 7.3469 123.7167 59.4019 41.0418 181.2800 226 R 3.6821 7.8569 119.5468 58.9009 29.7115 178.6611 227 N 4.5823 8.5198 117.5158 55.8393 38.5540 176.5555 228 D 4.7594 7.7997 121.1496 56.1283 40.6788 181.1771 229 K 4.6570 7.8303 114.5446 56.3537 35.4738 175.1827 230 Y 4.8308 6.3318 116.7029 56.8270 40.3074 174.0845 231 N 4.8073 9.0614 118.2283 53.1108 40.6000 174.1125 232 N 5.2550 7.8365 116.5311 51.0542 41.4956 174.7133 233 I 3.7597 8.9189 120.0510 64.5681 37.9030 177.8881 234 S 4.2115 8.1567 115.3869 61.7837 62.6523 176.4485 235 E 4.1348 8.9772 121.5138 59.4439 29.1054 178.7944 236 Y 3.6119 8.2057 119.8569 60.5091 38.7791 178.0663 237 R 3.6881 8.2664 119.1317 59.1715 30.0670 178.5800 238 N 4.4311 8.3129 116.9608 56.2414 38.8573 176.7998 239 W 4.1414 8.4952 130.2807 60.3262 30.8182 177.9378 240 I 3.1279 7.8570 120.1316 64.4577 36.3349 177.6777 241 Y 4.0273 7.6092 118.6842 60.7165 38.7328 177.9021 242 R 3.7337 7.9055 116.2546 56.7381 30.0388 177.1192 243 G 3.4768 7.1728 107.0422 45.5773 0.0000 173.8232 244 R 2.0000 6.9682 114.5421 54.9508 27.6969 176.7689 245 K 4.2078 7.0392 120.3996 57.6349 31.9334 175.3011 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.19 4.49 0.00 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 0.00 3 L 8.26 3.22 0.00 1.54 1.61 0.69 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 4 R 7.78 3.47 0.00 1.61 1.71 0.00 2.56 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.50 0.00 5 S 7.96 3.98 0.00 4.04 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 6 D 8.28 4.35 0.00 2.94 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.12 3.84 0.00 1.80 1.64 0.83 0.97 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 8 I 7.53 3.26 1.55 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.38 0.18 0.00 0.00 9 N 7.96 4.22 0.00 2.84 2.85 0.00 0.00 6.92 7.48 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 10 A 7.89 3.97 1.35 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 11 L 8.09 3.91 0.00 1.59 1.64 0.76 0.70 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 12 Y 7.75 4.44 0.00 3.14 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.52 4.42 0.00 2.76 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 14 E 8.55 4.13 0.00 2.20 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 0.00 1.67 2.21 0.00 15 N 8.46 4.59 0.00 3.07 3.12 0.00 0.00 7.32 6.67 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 16 Q 8.09 4.16 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.70 2.54 0.00 17 K 8.20 3.95 0.00 1.81 0.82 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.46 1.34 7.81 18 Y 7.85 4.93 0.00 3.37 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.72 4.93 0.00 2.73 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 20 V 7.83 3.89 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 0.65 0.00 0.00 0.90 0.00 0.00 21 C 8.35 4.68 0.00 2.91 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 22 G 7.46 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 23 I 8.49 4.66 1.88 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.42 0.91 0.00 0.00 24 I 8.37 5.20 1.93 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 1.45 1.03 0.95 0.00 0.00 25 S 8.77 4.87 0.00 4.22 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.73 4.06 1.32 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 27 E 8.18 4.24 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 28 G 8.46 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 29 K 7.70 4.36 0.00 1.92 1.79 0.00 1.56 0.00 0.00 1.68 0.00 0.00 2.53 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.96 1.25 7.81 30 I 8.81 5.18 1.96 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 1.29 0.83 1.04 0.00 0.00 31 Y 9.22 4.86 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 32 P 0.00 4.81 0.00 2.14 2.06 0.00 3.77 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 2.35 2.49 0.00 33 L 8.32 4.51 0.00 1.55 1.50 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.33 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.35 4.73 0.00 3.62 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 36 D 7.63 5.14 0.00 2.78 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 37 T 8.54 4.05 4.32 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 1.37 0.00 0.00 38 K 8.13 3.81 0.00 1.76 1.84 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.08 7.81 39 V 7.55 3.63 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 0.90 0.00 0.00 0.92 0.00 0.00 40 L 7.68 3.27 0.00 1.12 0.55 0.41 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.55 4.30 0.00 4.10 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 42 T 7.33 3.86 4.35 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 1.19 0.00 0.00 43 I 7.47 3.63 1.45 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.62 0.80 0.00 0.00 44 F 8.18 4.17 0.00 2.73 1.79 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 45 E 8.39 4.14 0.00 2.20 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 2.44 2.61 0.00 46 L 7.86 4.17 0.00 1.75 1.78 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 47 F 8.37 4.35 0.00 3.10 3.34 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 48 S 8.39 4.28 0.00 4.21 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 49 R 7.95 3.79 0.00 1.96 2.16 0.00 3.28 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.22 0.00 50 P 0.00 4.28 0.00 2.16 2.25 0.00 3.85 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 1.90 1.95 0.00 51 I 7.46 3.67 1.73 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.97 0.83 0.00 0.00 52 I 7.53 3.54 1.27 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.60 0.58 0.00 0.00 53 N 8.05 4.30 0.00 2.93 2.91 0.00 0.00 6.87 5.99 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 54 K 8.15 4.00 0.00 1.99 1.89 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.46 7.81 55 I 7.80 3.74 1.83 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 1.64 1.27 0.91 0.00 0.00 56 A 7.98 4.01 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 57 E 8.19 3.94 0.00 2.25 2.01 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 2.33 2.60 0.00 58 K 8.10 3.98 0.00 1.76 2.08 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.44 7.81 59 H 7.84 4.90 0.00 3.25 3.55 0.00 5.77 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.05 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 61 Y 8.42 4.56 0.00 2.82 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.08 3.99 0.81 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.36 0.75 0.00 0.00 63 V 8.27 5.01 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 1.06 0.00 0.00 0.96 0.00 0.00 64 E 9.37 4.86 0.00 2.13 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 65 E 8.59 4.99 0.00 1.76 1.67 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 1.80 2.12 0.00 66 P 0.00 4.23 0.00 2.03 1.96 0.00 3.50 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 1.96 2.15 0.00 67 K 8.50 4.16 0.00 1.77 1.71 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.33 0.99 7.81 68 Q 7.51 4.59 0.00 2.12 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.02 0.00 0.00 0.00 0.00 0.00 2.25 1.92 0.00 69 Q 8.38 4.21 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 70 N 8.68 4.30 0.00 2.91 2.92 0.00 0.00 6.70 8.16 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 71 H 8.11 5.03 0.00 3.19 3.21 0.00 5.89 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 9.28 4.54 0.00 3.01 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.62 0.00 1.69 0.49 0.00 3.69 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.51 0.00 74 D 9.01 4.29 0.00 2.90 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 F 8.58 5.07 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 76 T 9.18 5.10 4.58 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 1.36 0.00 0.00 77 L 8.94 5.93 0.00 1.53 1.61 0.98 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 78 Y 7.97 5.08 0.00 2.80 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 79 K 8.21 4.02 0.00 1.52 1.44 0.00 1.40 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.33 0.21 7.81 80 P 0.00 4.38 0.00 2.11 2.08 0.00 3.57 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.85 0.00 81 S 8.05 4.39 0.00 3.95 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 82 E 7.47 4.62 0.00 1.85 1.86 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 2.13 2.07 0.00 83 P 0.00 4.17 0.00 1.85 2.04 0.00 3.75 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 1.87 1.92 0.00 84 N 7.85 4.47 0.00 2.62 2.78 0.00 0.00 6.72 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 7.40 4.58 0.00 1.58 1.68 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.31 7.81 86 K 8.37 4.44 0.00 0.79 1.11 0.00 0.61 0.00 0.00 0.70 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 0.92 7.81 87 I 8.92 4.65 1.43 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.60 -0.52 0.00 0.00 88 A 8.57 4.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.80 5.03 2.06 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.68 1.05 0.00 0.00 90 D 9.12 5.28 0.00 2.93 2.68 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 91 I 9.46 4.96 2.08 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.27 1.27 0.00 0.00 92 K 9.30 5.00 0.00 1.56 1.90 0.00 1.91 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.59 7.81 93 T 8.69 5.68 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 1.87 0.00 0.00 94 T 9.05 4.81 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 95 Y 8.45 4.65 0.00 2.32 2.30 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 96 T 8.32 4.21 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 97 N 8.66 4.98 0.00 2.71 2.91 0.00 0.00 6.78 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.35 4.19 0.00 1.76 1.62 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.11 0.82 7.81 *102 K 7.84 4.55 0.00 1.62 1.44 0.00 1.26 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 1.35 7.81 103 I 9.12 4.75 1.53 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 1.43 0.73 0.81 0.00 0.00 104 K 8.12 5.30 0.00 1.51 1.55 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 1.04 7.81 105 F 9.88 5.14 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 0.00 106 T 8.69 4.81 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 107 L 9.16 4.74 0.00 1.46 1.74 1.01 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.62 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 7.92 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 0.00 0.00 0.00 110 Y 8.07 4.49 0.00 3.36 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 0.00 111 T 7.31 4.63 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 0.98 0.00 0.00 112 S 6.95 4.65 0.00 4.06 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 0.00 113 F 8.88 4.91 0.00 3.26 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 0.00 114 I 6.66 2.97 1.55 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.38 0.62 0.00 0.00 115 R 7.84 4.35 0.00 1.70 1.95 0.00 3.11 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 116 N 7.54 4.94 0.00 2.77 2.62 0.00 0.00 6.46 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 9.11 4.49 0.00 2.90 2.97 0.00 0.00 6.97 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 0.00 118 T 7.89 4.61 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 1.29 0.00 0.00 119 K 8.18 4.22 0.00 1.73 1.86 0.00 1.90 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.45 7.81 120 N 8.88 3.96 0.00 3.13 2.95 0.00 0.00 6.46 7.32 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 0.00 121 I 7.66 5.15 2.04 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 1.82 1.06 1.16 0.00 0.00 122 V 8.75 3.72 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 0.48 0.00 0.00 0.93 0.00 0.00 123 Y 7.75 4.95 0.00 3.01 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.65 0.00 2.38 2.14 0.00 3.96 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 125 F 9.82 4.42 0.00 3.20 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 0.00 126 D 8.57 4.67 0.00 2.92 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 0.00 127 Q 8.38 4.16 0.00 1.94 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 128 Y 7.68 4.80 0.00 2.77 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.23 4.40 1.87 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 1.24 0.55 0.87 0.00 0.00 130 A 7.53 4.78 1.06 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 0.00 0.00 131 H 9.02 5.16 0.00 3.26 3.47 0.00 5.61 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 W 9.53 5.43 0.00 3.24 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 0.00 133 I 9.34 4.97 2.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.20 0.84 0.00 0.00 134 I 8.71 4.35 1.87 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 1.05 0.80 0.65 0.00 0.00 135 G 7.21 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 0.00 0.00 0.00 136 Y 9.07 5.04 0.00 2.87 2.41 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 0.00 137 V 9.02 5.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.17 0.00 0.00 138 Y 8.33 5.37 0.00 3.15 3.21 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 0.00 139 T 8.60 5.37 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 140 R 8.73 4.56 0.00 2.11 2.01 0.00 3.32 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.23 0.00 141 V 8.83 3.63 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 0.75 0.00 0.00 0.97 0.00 0.00 *147 S 9.09 4.31 0.00 4.07 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 0.00 148 L 8.37 4.80 0.00 1.64 1.52 0.92 0.61 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 0.00 149 K 7.72 4.82 0.00 1.45 1.56 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.27 1.21 7.81 150 T 7.89 4.49 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 0.70 0.00 0.00 151 Y 8.55 5.03 0.00 2.88 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 0.00 152 N 9.06 5.41 0.00 2.83 2.90 0.00 0.00 7.40 7.71 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 0.00 153 I 8.75 3.63 1.89 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 1.30 1.09 0.93 0.00 0.00 154 N 8.32 4.58 0.00 2.76 2.73 0.00 0.00 6.96 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 E 8.36 4.70 0.00 2.22 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 2.29 2.50 0.00 156 L 7.79 3.90 0.00 1.65 1.73 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 157 N 8.14 4.44 0.00 2.67 2.86 0.00 0.00 6.79 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 0.00 158 E 7.81 4.42 0.00 2.04 2.00 0.00 0.00 0.00 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 2.26 0.00 159 I 7.04 3.30 1.67 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 0.40 0.66 0.00 0.00 160 P 0.00 4.20 0.00 2.11 2.02 0.00 3.52 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 1.95 2.01 0.00 161 K 8.25 3.90 0.00 1.36 0.74 0.00 1.48 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.22 1.19 7.81 162 P 0.00 4.81 0.00 2.18 2.02 0.00 3.24 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.85 0.00 163 Y 6.68 5.17 0.00 3.14 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 0.00 164 K 8.91 4.32 0.00 1.80 1.96 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.47 7.81 165 G 7.95 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 0.00 166 V 8.28 5.04 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.60 0.00 0.00 167 K 9.21 4.65 0.00 1.07 0.74 0.00 0.61 0.00 0.00 1.36 0.00 0.00 2.67 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.97 1.02 7.81 168 V 8.40 4.76 1.58 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 0.89 0.00 0.00 0.12 0.00 0.00 169 F 8.29 5.16 0.00 2.99 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 0.00 170 L 8.55 5.15 0.00 1.41 1.29 0.73 -0.17 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 0.00 171 Q 9.25 4.53 0.00 2.01 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.78 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 172 D 8.53 5.02 0.00 2.42 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 K 9.19 3.95 0.00 1.95 1.89 0.00 1.89 0.00 0.00 1.88 0.00 0.00 3.15 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.33 1.52 7.81 174 W 8.03 3.15 0.00 3.24 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 0.00 175 V 6.17 2.52 1.61 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 0.56 0.00 0.00 -0.71 0.00 0.00 176 I 7.27 4.04 1.89 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 1.66 0.81 0.66 0.00 0.00 177 A 7.22 4.45 1.62 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 0.00 0.00 178 G 9.00 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 0.00 0.00 0.00 0.00 179 D 8.59 4.64 0.00 2.48 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 7.76 5.13 0.00 1.77 1.78 1.01 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 181 A 9.15 4.35 1.61 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 0.00 182 G 9.27 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 S 8.01 4.40 0.00 3.87 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 0.00 184 G 9.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 N 8.11 4.36 0.00 2.82 2.98 0.00 0.00 5.89 7.71 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 0.00 186 T 7.75 4.20 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 187 T 7.44 3.34 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 188 N 7.95 5.18 0.00 2.70 2.74 0.00 0.00 7.10 7.27 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 0.00 189 I 8.80 3.06 1.51 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.15 0.30 0.00 0.00 190 G 8.44 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 S 8.72 5.11 0.00 4.45 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 0.00 192 I 8.30 4.02 1.71 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.15 0.85 0.00 0.00 193 H 8.73 5.17 0.00 3.18 3.27 0.00 5.71 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 A 8.81 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 H 8.57 4.85 0.00 3.24 3.28 0.00 5.66 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 Y 9.23 4.50 0.00 3.11 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 0.00 197 K 8.24 3.80 0.00 1.80 1.81 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.45 1.10 7.81 198 D 8.31 4.55 0.00 2.62 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 F 7.82 3.51 0.00 2.51 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 6.86 3.29 1.91 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 0.67 0.00 0.00 0.25 0.00 0.00 201 E 8.26 3.98 0.00 1.88 1.86 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 2.25 2.23 0.00 202 G 7.01 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 0.00 0.00 0.00 203 K 7.75 4.13 0.00 1.80 1.64 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.45 1.25 7.81 204 G 7.55 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 0.00 0.00 0.00 205 I 7.96 4.25 1.60 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 -0.13 0.75 0.00 0.00 206 F 7.86 4.68 0.00 3.49 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 D 9.81 4.63 0.00 2.72 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 0.00 208 S 7.64 4.04 0.00 3.78 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 0.00 209 E 6.92 3.37 0.00 1.16 1.35 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 2.34 2.39 0.00 210 D 7.65 4.24 0.00 2.78 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 E 8.36 4.04 0.00 2.21 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 2.59 2.70 0.00 212 F 8.11 2.48 0.00 2.79 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 0.00 213 L 7.96 3.40 0.00 1.79 1.68 1.13 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 214 D 7.83 4.32 0.00 2.81 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 0.00 215 Y 7.61 3.24 0.00 2.36 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 W 7.48 3.92 0.00 2.93 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 0.00 217 R 7.94 4.25 0.00 1.96 1.99 0.00 3.17 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 218 N 7.38 4.80 0.00 2.58 2.46 0.00 0.00 6.92 7.69 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 0.00 219 Y 7.49 3.22 0.00 2.18 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 0.00 220 E 7.30 4.13 0.00 1.60 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.92 0.00 221 R 8.79 4.68 0.00 1.84 2.08 0.00 3.20 0.00 0.00 4.01 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 222 T 7.39 4.74 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 1.22 0.00 0.00 223 S 8.76 4.06 0.00 3.86 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 0.00 224 Q 8.05 4.02 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 7.06 0.00 0.00 0.00 0.00 0.00 2.28 2.00 0.00 225 L 7.35 4.26 0.00 1.77 1.70 0.92 0.92 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 0.00 226 R 7.86 3.68 0.00 1.61 1.84 0.00 2.21 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.40 0.00 227 N 8.52 4.58 0.00 2.67 2.85 0.00 0.00 6.85 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 D 7.80 4.76 0.00 2.78 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 K 7.83 4.66 0.00 1.10 0.89 0.00 1.53 0.00 0.00 1.34 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 1.16 7.81 230 Y 6.33 4.83 0.00 3.01 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 N 9.06 4.81 0.00 2.76 2.88 0.00 0.00 6.76 8.04 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 0.00 232 N 7.84 5.25 0.00 3.17 3.01 0.00 0.00 6.36 7.78 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 0.00 233 I 8.92 3.76 1.65 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 1.40 1.26 0.85 0.00 0.00 234 S 8.16 4.21 0.00 3.96 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 0.00 235 E 8.98 4.13 0.00 2.38 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 0.00 2.41 2.57 0.00 236 Y 8.21 3.61 0.00 1.85 3.21 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 0.00 237 R 8.27 3.69 0.00 2.12 1.97 0.00 3.35 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.97 0.00 238 N 8.31 4.43 0.00 2.94 3.03 0.00 0.00 6.83 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 0.00 239 W 8.50 4.14 0.00 3.63 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 I 7.86 3.13 1.88 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.47 0.75 0.00 0.00 241 Y 7.61 4.03 0.00 2.91 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 0.00 242 R 7.91 3.73 0.00 1.74 1.82 0.00 3.26 0.00 0.00 3.32 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.97 0.00 243 G 7.17 3.48 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 0.00 244 R 6.97 2.00 0.00 1.52 1.22 0.00 2.97 0.00 0.00 3.04 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.86 0.00 245 K 7.04 4.21 0.00 1.80 1.65 0.00 1.51 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.18 1.30 7.81 * Residues marked with a * may have inaccurate shift predictions.