NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 P 4.3721 0.0000 0.0000 62.5094 33.1355 176.4476 5 G 3.7406 8.5626 106.9259 45.0998 0.0000 170.3957 6 P 4.6474 0.0000 0.0000 62.9362 33.1198 174.0527 7 A 5.3282 8.7258 123.6947 50.5070 23.5689 174.2443 8 L 4.7368 8.5430 120.2725 53.3931 45.7397 174.9205 9 C 5.2019 8.9880 123.6985 58.2744 30.2191 172.5374 10 L 5.2913 9.0652 124.3418 52.9518 44.3184 175.5438 11 F 5.3183 9.0901 121.5523 55.3235 42.3334 174.5601 12 D 4.9232 8.6914 122.7907 54.4405 41.5990 175.8792 13 V 3.8487 8.6508 116.4193 63.4983 32.3174 175.3646 14 D 4.6316 7.2068 117.2929 54.6637 41.8237 178.0857 15 G 4.0831 8.6597 114.8414 46.3280 0.0000 175.7235 16 T 4.1488 7.6452 115.5828 65.5570 69.0625 176.6541 17 L 4.3146 7.7263 118.6626 54.8516 42.7180 176.6364 18 T 4.6345 7.3854 107.1861 58.8884 71.9764 173.1203 19 A 4.0769 8.2157 125.1222 51.3012 19.1040 175.5824 20 P 4.6848 0.0000 0.0000 64.4110 31.8263 176.5216 21 R 3.8568 8.5628 120.3410 57.2526 28.3972 176.1875 22 Q 4.6002 7.8400 113.5202 53.5678 32.6665 175.5141 23 K 4.3246 8.3645 121.5795 56.0569 33.0964 176.3730 24 I 3.8296 8.3808 125.8290 61.8829 38.5044 175.6095 25 T 4.2826 8.2760 123.8696 62.6544 69.3585 174.8714 26 K 3.9241 8.8094 125.7975 59.8309 32.5141 178.7004 27 E 3.8347 8.2095 115.4699 57.7696 29.7875 177.3180 *29 D 4.4877 8.1740 117.4904 54.3811 43.1166 176.9882 30 D 4.3274 8.4793 119.1968 57.3720 40.7157 178.5457 31 F 3.9116 8.3132 120.9053 61.5549 39.3624 177.2291 32 L 3.8798 7.9901 117.8027 57.9095 41.1943 179.4655 33 Q 3.9641 7.7828 117.2543 58.4237 28.7348 178.2484 34 K 3.9433 7.8222 120.9699 59.2298 32.1854 178.6715 35 L 3.6810 7.5874 120.7100 58.0165 41.7810 178.8383 36 R 4.6452 7.9435 118.9944 58.4814 29.9008 177.9577 37 Q 4.0871 7.4734 117.7880 58.4305 28.7930 177.4874 38 K 4.3552 7.8321 116.8364 57.2692 34.3502 176.0784 39 I 4.7087 7.0240 118.0099 58.7283 41.8729 174.5175 40 K 4.8391 8.4733 126.4062 56.4298 33.3183 176.0763 41 I 5.2342 9.0104 116.6817 59.4173 41.0275 174.5156 42 G 4.8275 9.7975 110.7300 45.1617 0.0000 171.3347 43 V 5.3250 8.5587 112.3760 59.3503 35.4848 175.6534 44 V 5.2238 8.7531 123.1393 60.4496 34.9791 174.5979 45 G 4.1791 8.7704 107.9500 45.6474 0.0000 174.5693 46 G 3.8536 8.7609 108.9283 47.8338 0.0000 174.4604 47 S 4.4558 7.8121 116.5679 57.7814 64.1792 172.9884 48 D 4.9673 8.2001 121.9737 52.3845 41.9612 176.9121 49 F 4.2465 8.8583 121.0093 61.7653 39.2113 176.8554 50 E 3.8145 8.2957 117.5664 59.0666 29.3259 179.0009 51 K 3.8661 8.2480 119.7235 59.5706 32.2768 179.0531 52 V 3.5325 7.5488 118.0271 65.8586 31.3614 177.9650 53 Q 3.9249 7.6436 117.7904 58.9561 28.3164 178.4864 54 E 3.8822 7.7619 118.0315 59.7480 29.7650 179.2936 55 Q 4.1400 7.9601 117.6903 57.9256 28.7476 177.5286 56 L 4.6068 8.4714 116.9813 53.0351 43.6202 177.2754 57 G 4.0530 7.9958 106.7568 44.8697 0.0000 174.7605 58 N 4.2921 8.4424 117.5600 55.7086 38.9467 175.7121 59 D 4.7940 7.9982 117.1762 53.3293 40.0763 178.2328 60 V 3.6975 7.7327 122.9603 66.2095 30.7356 178.5177 61 V 3.7165 7.7731 110.7086 63.3602 31.4441 177.4173 62 E 4.2373 8.1854 116.9371 57.5359 29.6927 177.8392 63 K 4.0623 7.7969 117.3696 56.3947 32.9096 176.1850 64 Y 4.7688 7.0355 114.6751 55.9360 41.7576 175.0939 65 D 4.4922 9.1849 122.8355 56.8023 42.2522 176.0731 66 Y 5.0896 7.9918 114.3713 56.0534 42.5902 174.9613 67 V 4.4416 8.2817 121.5003 61.4887 35.1938 174.2821 68 F 5.7866 9.0527 127.0148 53.9412 39.3419 172.8871 69 P 4.7440 0.0000 0.0000 61.9200 33.5214 175.5012 70 E 3.9380 10.0188 117.7471 56.7059 27.5781 176.1813 71 N 4.1299 9.3278 111.9531 54.0011 36.8945 176.4658 72 G 4.1609 8.4105 106.0473 45.2756 0.0000 175.1645 73 L 3.6477 7.8024 120.8593 56.4093 41.9015 176.7896 74 V 4.7628 7.6993 118.4663 61.0092 33.8306 174.5535 75 A 5.2785 8.4779 127.9110 50.5689 22.8918 174.2083 76 Y 5.0198 9.1188 119.2454 55.9585 41.6789 174.8040 77 K 4.7035 8.7427 124.0253 55.2227 35.6374 175.8350 78 D 4.4172 9.7766 126.8390 55.2833 38.9384 174.9459 79 G 3.9664 8.7038 106.1829 44.9663 0.0000 173.8752 80 K 4.5892 7.9041 121.1427 53.7310 34.5323 174.8331 81 L 3.5934 8.5484 127.6583 55.3502 42.2691 175.8034 82 L 4.4192 8.7184 129.5937 57.0372 42.5969 176.1734 83 C 4.8576 7.5370 112.1090 56.7224 33.5422 172.7460 84 R 4.8305 8.4709 118.5022 54.8826 32.7681 174.1581 85 Q 4.8955 8.9189 125.7430 54.1744 32.1141 174.1917 86 N 5.3595 8.5402 120.4771 50.1204 41.0127 175.1049 87 I 3.7154 9.0562 119.2146 64.1338 37.9904 177.9089 88 Q 4.1463 8.2441 118.0403 58.9473 28.5366 178.3600 89 S 4.2331 8.2256 116.7299 61.5073 63.0117 175.6823 90 H 4.4480 8.1639 119.7107 59.3500 29.8318 176.9061 91 L 4.0888 8.0249 118.7481 54.1115 42.3995 178.0373 92 G 4.1843 7.5534 104.2595 45.9835 0.0000 174.3730 93 E 3.9534 8.7967 120.1446 59.2024 29.5029 179.4754 94 A 4.0128 8.0488 120.2751 55.1894 18.3452 179.3372 95 L 3.9303 7.9209 118.1015 58.3201 42.3472 178.6885 96 I 3.6705 7.5425 119.7917 64.8770 37.0788 177.9003 97 Q 4.1074 8.3721 119.8645 58.9183 28.9562 177.5020 98 D 4.5533 8.6186 120.5174 57.3703 40.8095 178.7101 99 L 3.6657 8.2926 119.7483 57.7466 41.5158 179.6240 100 I 3.7760 7.8785 119.4719 64.5370 37.1132 177.9963 101 N 4.3653 8.6140 117.6299 56.6617 38.3997 176.6113 102 Y 4.1348 8.2936 120.5053 61.2780 38.9236 178.1257 103 C 4.6671 8.7953 117.6962 62.7814 28.2182 176.0832 104 L 4.0184 8.4085 120.9536 58.1724 41.0842 179.8474 105 S 4.0853 7.8225 113.4666 61.4921 63.1149 175.9573 106 Y 3.7138 7.9987 122.2955 60.6684 38.5558 177.8960 107 I 3.7291 8.0108 120.5836 64.6289 37.0464 178.0826 108 A 3.8866 7.6838 120.0561 54.9017 18.1830 179.0496 109 K 4.1009 7.5991 114.4774 56.2543 32.7174 177.1115 110 I 3.9268 7.0061 121.3211 60.3497 37.7505 175.5707 111 K 4.2922 8.4983 125.2353 55.7875 32.4903 176.2658 112 L 5.0136 8.1515 122.8516 51.9866 45.8157 174.8744 113 P 4.4783 0.0000 0.0000 65.3900 31.5398 176.9102 114 K 4.7986 7.7681 115.3097 54.5126 36.1274 175.2629 115 K 4.9176 8.5413 119.6766 56.3305 35.8481 173.6600 116 R 4.3623 9.4167 120.7140 55.9858 32.4324 177.5021 117 G 3.4018 5.3800 115.9769 46.1279 0.0000 173.7365 118 T 3.5814 7.8797 112.9150 64.8344 65.6700 173.7094 119 F 4.4028 7.5367 120.6975 59.1171 40.9270 177.0262 120 I 4.9203 7.8435 118.4853 59.4377 39.9690 174.6646 121 E 4.5617 9.4169 129.6631 54.4139 31.4386 174.2384 122 F 4.7960 8.8965 129.9141 57.0182 39.9594 174.9953 123 R 4.8187 7.9420 124.2180 53.9383 33.5619 176.2047 124 N 4.5494 8.9621 117.5466 56.2789 38.5814 176.8577 125 G 3.9497 7.3459 103.9969 45.6503 0.0000 173.0449 *127 L 3.9755 7.5654 119.9702 54.4192 43.4617 175.0088 128 N 5.0941 9.1518 123.5672 52.0852 40.7670 173.6149 129 V 4.5869 8.0786 126.1870 60.9238 34.3736 174.0923 130 S 4.7720 8.9258 121.8592 54.7288 64.5587 172.7240 131 P 4.6234 0.0000 0.0000 65.7086 31.6828 177.6205 132 I 3.9028 7.3232 117.9120 61.8589 38.6779 176.2207 133 G 3.5942 7.7312 107.8871 45.6351 0.0000 174.6954 134 R 3.9419 8.1515 123.2134 58.3365 30.1777 177.9161 135 S 4.2833 7.5527 111.4713 58.9709 63.4903 174.4076 136 C 4.2061 7.4102 116.4744 58.4025 29.7396 174.2160 137 S 4.4397 9.2435 117.1940 57.6067 64.9550 175.0528 138 Q 3.9540 8.5615 121.8008 59.6824 28.6093 178.2498 139 E 4.0525 8.1456 118.8646 59.3427 29.5314 179.0726 140 E 4.0143 7.9950 118.5743 59.3560 29.5254 179.2295 141 R 4.0036 8.3384 119.0595 59.5725 30.1403 178.5583 142 I 3.8672 7.9706 119.5149 64.3449 37.1472 177.8484 143 E 3.9636 8.2564 120.1189 59.3937 29.4380 178.5931 144 F 4.1177 8.4715 120.5497 61.6481 39.4867 176.4554 145 Y 4.3955 8.8262 119.7921 60.6017 38.4271 177.8029 146 E 3.7288 8.4046 118.8427 58.9011 29.8097 178.6804 147 L 3.7660 7.7802 121.3148 58.0145 42.0481 178.3427 148 D 4.1094 8.0541 118.0566 57.3872 40.8020 178.4382 149 K 3.5968 7.5402 117.7235 59.1568 32.0245 178.9073 150 K 4.0368 7.5155 118.8520 59.0721 32.3503 178.0907 151 E 4.2316 8.4218 116.9814 55.4755 31.1310 175.6924 152 N 4.2580 9.0061 116.9547 54.5293 36.8598 176.0230 153 I 3.8133 7.7926 121.2333 64.6652 37.7417 178.3590 154 R 4.1359 8.6713 118.7820 59.3956 29.9246 178.5676 155 Q 3.8972 8.2586 118.8758 59.4260 28.8178 178.6607 156 K 3.9532 8.0487 120.1094 59.3296 32.2159 178.5110 157 F 4.3250 8.2603 122.3146 60.7816 39.2513 177.2579 158 V 2.8231 7.5604 117.6268 65.5610 31.2172 177.6868 159 A 3.8013 8.0055 120.6721 55.2599 18.1473 179.1634 160 D 4.3658 8.2643 117.4577 57.7747 40.9990 179.2732 161 L 3.8406 8.2140 119.6709 57.6496 41.3060 179.5634 162 R 3.6754 7.4058 118.0066 59.0388 30.1242 178.2724 163 K 3.9575 7.9408 119.4653 59.4656 32.0742 178.0639 164 E 3.6041 7.8162 118.7409 58.4246 29.5614 177.8228 165 F 4.6938 7.8906 116.2172 56.6944 39.8367 175.1148 166 A 4.1712 7.4313 123.3899 53.6121 18.5517 179.3584 167 G 4.0004 8.8769 109.3596 45.6185 0.0000 174.3823 168 K 4.2118 7.7798 117.0924 55.8679 32.7124 176.4820 169 G 3.7782 7.9636 107.0502 46.6322 0.0000 173.0716 170 L 4.8520 7.6914 117.0163 52.7281 44.5365 176.9440 171 T 4.3710 7.7649 118.3062 61.6118 71.9379 173.1349 172 F 4.7958 8.1388 120.6392 56.0134 42.8187 175.2889 173 S 4.5286 9.0478 116.1687 57.7302 65.6823 172.9364 174 I 4.7710 8.5871 129.0605 60.3907 38.1333 175.5526 175 G 4.0507 8.5731 115.1394 45.2003 0.0000 173.3691 176 G 3.7727 8.4282 106.5776 45.9382 0.0000 173.1739 177 Q 4.0713 8.6026 116.0572 55.7819 30.7089 175.8968 178 I 4.6941 7.6273 108.2628 60.0630 39.5342 174.6998 179 S 4.8424 7.9175 116.9589 57.1125 66.9848 172.3606 180 F 5.4574 8.4322 114.2776 55.4471 41.7989 173.1139 181 D 5.4390 9.8633 120.3287 52.6983 43.6387 175.5706 182 V 4.5959 8.4710 122.1775 60.9403 33.7449 174.6634 183 F 4.7954 7.6951 121.3218 54.6683 41.6420 172.1072 184 P 4.4502 0.0000 0.0000 62.1719 32.6355 175.7344 185 D 4.4876 7.7461 121.8360 55.5049 41.2076 178.0741 186 G 4.2613 9.2044 110.9490 45.7536 0.0000 173.4967 187 W 4.6167 8.4173 118.8279 57.0881 29.5965 176.3034 188 D 4.7221 7.5887 121.0992 52.1242 41.5840 176.3880 189 K 3.8186 8.6370 116.6525 60.2066 31.8163 178.7677 190 R 3.7844 8.1400 118.4096 59.3358 29.7330 177.8415 191 Y 3.7312 8.0948 119.6753 60.9734 38.6679 178.3314 192 C 3.5054 7.7235 113.9594 60.6365 29.4134 175.7538 193 L 3.8435 7.6382 122.0931 57.2562 40.8845 179.2035 194 R 4.1248 6.8900 116.8153 58.4930 29.2100 177.8135 195 H 4.6518 7.4369 114.8131 56.7447 29.4093 176.5037 196 V 4.4068 7.6160 113.3085 61.1537 33.3812 176.6637 197 E 4.3519 8.0436 114.9994 57.3708 29.8928 177.1864 198 N 4.9874 8.0200 116.1571 53.5199 39.3146 174.1859 199 D 4.6408 8.0139 115.7683 54.0765 41.0051 177.5954 200 G 3.7842 8.0598 106.1336 45.4786 0.0000 173.7651 201 Y 4.5382 6.9880 117.3677 57.9290 38.3809 176.1055 202 K 4.3534 9.2498 124.3617 58.7838 33.1626 177.4947 203 T 4.6009 7.8444 115.5812 61.8251 73.4449 173.0280 204 I 4.5439 8.0490 125.2214 59.7879 40.3276 174.1266 205 Y 4.5696 9.1295 126.1255 57.0237 39.8509 174.6215 206 F 5.1678 8.3520 124.4051 56.3390 42.7729 173.3482 207 F 4.8904 7.9080 125.3192 56.3875 41.1382 174.4648 208 G 4.1491 8.0302 111.3847 46.1073 0.0000 171.1962 209 D 5.0649 9.1036 121.6423 53.9897 41.7466 177.1298 210 K 3.5508 8.5216 120.6375 57.5016 33.2745 175.9390 211 T 5.0145 7.0722 114.7763 62.4078 73.7077 174.6498 *216 N 4.8309 7.9623 119.2693 52.7328 39.3326 176.9403 217 D 4.6372 8.4484 125.1006 54.6164 43.9462 173.7724 218 H 4.5871 8.7081 124.1754 54.9960 29.7502 176.3888 219 E 4.0052 8.7671 124.6416 59.2519 29.1591 179.0803 220 I 3.4801 7.5555 117.7146 63.7496 38.0238 177.1967 221 F 4.0834 7.6972 121.3375 60.7000 39.3856 176.2711 222 T 4.4190 7.5929 105.8880 60.7316 70.0422 174.3597 223 D 4.3879 7.4887 123.2908 53.6250 41.7366 175.3132 224 P 4.3179 0.0000 0.0000 65.4551 31.4102 177.6796 225 R 4.1422 8.3833 117.7967 57.8846 31.1504 177.5898 226 T 5.1992 6.5565 107.3315 60.5763 68.3005 175.2657 *228 G 2.8231 8.4981 106.6827 45.6269 0.0000 170.8380 229 Y 4.7982 8.5764 121.6243 55.8646 41.2924 174.7858 230 S 5.4510 9.3465 119.6003 57.8586 64.4487 173.9413 231 V 4.8220 8.8108 116.4762 59.9694 34.6131 175.8205 232 T 4.3656 8.9694 110.9998 60.7038 69.9512 174.3086 233 A 4.8095 7.3205 128.2294 50.3053 21.0920 175.5465 234 P 4.4501 0.0000 0.0000 65.1366 31.3046 178.9922 235 E 3.8196 8.1364 116.8865 59.3214 29.2069 179.0983 236 D 4.2613 7.7756 118.3356 57.5854 41.1106 178.3462 237 T 3.8487 7.8128 116.2233 67.0591 68.3855 176.6745 238 R 3.1188 7.8366 119.5655 58.7516 29.9399 178.9988 239 R 3.8063 7.6836 118.3950 59.6194 30.0364 178.7137 240 I 3.6620 7.9866 119.7973 64.5718 37.0963 178.1754 241 C 4.1248 8.2645 117.9042 62.8078 27.7003 175.9013 242 E 4.0282 8.3509 120.5123 59.1661 29.3267 178.3323 243 L 4.0304 7.6122 119.3928 58.0667 42.2310 178.5353 244 L 3.7971 7.5677 117.9199 55.8410 41.7779 176.3730 245 F 4.9573 7.7949 115.7915 55.5112 42.0704 175.5542 246 S 4.5174 8.8070 114.9249 58.8498 62.7382 168.7300 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 4 P 0.00 4.37 0.00 2.11 2.13 0.00 3.87 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.13 0.00 5 G 8.56 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 6 P 0.00 4.65 0.00 2.18 2.07 0.00 3.61 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 7 A 8.73 5.33 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 8.54 4.74 0.00 0.27 0.81 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 9 C 8.99 5.20 0.00 2.88 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 10 L 9.07 5.29 0.00 1.81 1.78 1.00 1.08 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 11 F 9.09 5.32 0.00 2.91 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 12 D 8.69 4.92 0.00 2.73 2.63 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 13 V 8.65 3.85 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.95 0.00 0.00 14 D 7.21 4.63 0.00 3.00 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 15 G 8.66 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 T 7.65 4.15 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 1.42 0.00 0.00 17 L 7.73 4.31 0.00 1.58 1.62 0.75 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.39 4.63 4.39 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 0.00 0.00 0.00 1.22 0.00 0.00 19 A 8.22 4.08 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.68 0.00 2.05 2.01 0.00 3.82 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 21 R 8.56 3.86 0.00 1.93 1.96 0.00 3.10 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 22 Q 7.84 4.60 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.92 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 23 K 8.36 4.32 0.00 1.74 1.68 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.71 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.64 7.81 24 I 8.38 3.83 1.86 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 1.21 0.90 0.96 0.00 0.00 25 T 8.28 4.28 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 1.25 0.00 0.00 26 K 8.81 3.92 0.00 1.73 1.79 0.00 1.91 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.37 7.81 27 E 8.21 3.83 0.00 2.02 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 2.35 2.30 0.00 *29 D 8.17 4.49 0.00 2.95 2.65 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 30 D 8.48 4.33 0.00 2.85 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 31 F 8.31 3.91 0.00 3.19 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 32 L 7.99 3.88 0.00 1.74 1.56 0.88 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 7.78 3.96 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.37 0.00 34 K 7.82 3.94 0.00 1.78 1.74 0.00 1.55 0.00 0.00 1.41 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.23 1.32 7.81 35 L 7.59 3.68 0.00 1.27 1.51 0.59 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 36 R 7.94 4.65 0.00 1.83 1.98 0.00 3.01 0.00 0.00 2.96 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 37 Q 7.47 4.09 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 38 K 7.83 4.36 0.00 1.82 1.88 0.00 1.49 0.00 0.00 1.51 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.44 7.81 39 I 7.02 4.71 1.61 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 1.28 1.47 0.42 0.00 0.00 40 K 8.47 4.84 0.00 1.85 1.84 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.63 1.90 7.81 41 I 9.01 5.23 2.36 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.46 1.07 0.00 0.00 42 G 9.80 4.83 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 43 V 8.56 5.32 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 0.20 0.00 0.00 0.64 0.00 0.00 44 V 8.75 5.22 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.11 0.00 0.00 45 G 8.77 4.18 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 0.00 0.00 0.00 46 G 8.76 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 47 S 7.81 4.46 0.00 3.91 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 48 D 8.20 4.97 0.00 3.03 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 49 F 8.86 4.25 0.00 3.27 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 0.00 50 E 8.30 3.81 0.00 2.10 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 2.44 2.46 0.00 51 K 8.25 3.87 0.00 1.99 1.95 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.47 7.81 52 V 7.55 3.53 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.02 0.00 0.00 53 Q 7.64 3.92 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.53 0.00 0.00 0.00 0.00 0.00 2.07 1.42 0.00 54 E 7.76 3.88 0.00 2.06 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 2.30 2.53 0.00 55 Q 7.96 4.14 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.63 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 56 L 8.47 4.61 0.00 1.58 1.76 0.63 1.04 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 57 G 8.00 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 0.00 0.00 0.00 58 N 8.44 4.29 0.00 2.69 2.87 0.00 0.00 6.96 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 59 D 8.00 4.79 0.00 2.80 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 60 V 7.73 3.70 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 0.72 0.00 0.00 0.98 0.00 0.00 61 V 7.77 3.72 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 0.22 0.00 0.00 0.85 0.00 0.00 62 E 8.19 4.24 0.00 1.89 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 63 K 7.80 4.06 0.00 1.86 1.25 0.00 1.54 0.00 0.00 1.50 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.54 7.81 64 Y 7.04 4.77 0.00 2.96 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 65 D 9.18 4.49 0.00 2.72 2.45 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 66 Y 7.99 5.09 0.00 2.60 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 0.00 0.00 0.00 67 V 8.28 4.44 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 1.22 0.00 0.00 0.99 0.00 0.00 68 F 9.05 5.79 0.00 3.20 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 69 P 0.00 4.74 0.00 2.26 2.25 0.00 4.10 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 70 E 10.02 3.94 0.00 2.09 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 0.00 2.25 2.38 0.00 71 N 9.33 4.13 0.00 2.74 3.02 0.00 0.00 7.23 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 72 G 8.41 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 73 L 7.80 3.65 0.00 1.56 1.58 0.62 -1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 74 V 7.70 4.76 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 0.94 0.00 0.00 0.93 0.00 0.00 75 A 8.48 5.28 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 9.12 5.02 0.00 2.83 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 77 K 8.74 4.70 0.00 1.90 1.62 0.00 1.97 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.14 1.07 7.81 78 D 9.78 4.42 0.00 2.80 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 79 G 8.70 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 80 K 7.90 4.59 0.00 1.78 1.64 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.35 7.81 81 L 8.55 3.59 0.00 1.52 1.45 0.79 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.72 4.42 0.00 1.60 1.75 0.96 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 83 C 7.54 4.86 0.00 2.99 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 84 R 8.47 4.83 0.00 1.61 1.83 0.00 3.11 0.00 0.00 3.13 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.49 0.00 85 Q 8.92 4.90 0.00 1.98 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.72 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 86 N 8.54 5.36 0.00 3.06 2.92 0.00 0.00 5.79 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 87 I 9.06 3.72 1.96 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 1.37 1.14 0.70 0.00 0.00 88 Q 8.24 4.15 0.00 2.41 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.70 0.00 0.00 0.00 0.00 0.00 2.62 2.47 0.00 89 S 8.23 4.23 0.00 4.21 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 90 H 8.16 4.45 0.00 3.56 3.39 0.00 5.94 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 91 L 8.02 4.09 0.00 1.66 1.61 0.70 0.73 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 92 G 7.55 4.18 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 0.00 0.00 0.00 93 E 8.80 3.95 0.00 2.01 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 2.43 2.34 0.00 94 A 8.05 4.01 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 95 L 7.92 3.93 0.00 1.79 1.80 1.02 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 96 I 7.54 3.67 2.05 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 1.70 1.16 1.10 0.00 0.00 97 Q 8.37 4.11 0.00 2.41 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 98 D 8.62 4.55 0.00 3.12 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.29 3.67 0.00 1.70 1.55 0.64 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 100 I 7.88 3.78 2.08 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.93 1.00 0.00 0.00 101 N 8.61 4.37 0.00 2.90 2.99 0.00 0.00 6.74 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 0.00 102 Y 8.29 4.13 0.00 3.53 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 0.00 103 C 8.80 4.67 0.00 3.20 3.28 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 0.00 104 L 8.41 4.02 0.00 1.89 1.74 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 105 S 7.82 4.09 0.00 3.75 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 0.00 106 Y 8.00 3.71 0.00 2.64 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.01 3.73 2.06 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.19 0.76 0.00 0.00 108 A 7.68 3.89 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 0.00 109 K 7.60 4.10 0.00 1.48 1.64 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.75 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.29 1.57 7.81 110 I 7.01 3.93 1.93 0.00 0.00 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 1.24 0.50 1.03 0.00 0.00 111 K 8.50 4.29 0.00 1.73 1.76 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.38 7.81 112 L 8.15 5.01 0.00 1.68 1.74 1.18 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.48 0.00 2.37 2.22 0.00 3.86 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.03 0.00 114 K 7.77 4.80 0.00 1.79 1.75 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.51 7.81 115 K 8.54 4.92 0.00 1.73 2.03 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.57 1.57 7.81 116 R 9.42 4.36 0.00 1.46 1.40 0.00 3.36 0.00 0.00 3.25 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.80 0.00 117 G 5.38 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 0.00 0.00 0.00 118 T 7.88 3.58 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 119 F 7.54 4.40 0.00 3.01 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 0.00 120 I 7.84 4.92 1.97 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 1.00 0.00 0.00 121 E 9.42 4.56 0.00 1.96 1.76 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 2.22 2.24 0.00 122 F 8.90 4.80 0.00 3.10 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 0.00 123 R 7.94 4.82 0.00 1.77 1.73 0.00 3.15 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 124 N 8.96 4.55 0.00 3.00 2.91 0.00 0.00 6.66 7.60 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 0.00 125 G 7.35 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *127 L 7.57 3.98 0.00 1.51 1.55 0.86 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 128 N 9.15 5.09 0.00 2.73 2.59 0.00 0.00 6.18 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 0.00 129 V 8.08 4.59 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 0.50 0.00 0.00 0.66 0.00 0.00 130 S 8.93 4.77 0.00 3.68 3.51 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 0.00 131 P 0.00 4.62 0.00 2.35 2.45 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.73 0.00 132 I 7.32 3.90 1.70 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.49 0.53 0.00 0.00 133 G 7.73 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 0.00 0.00 0.00 134 R 8.15 3.94 0.00 1.70 1.92 0.00 3.40 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 135 S 7.55 4.28 0.00 3.95 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 0.00 136 C 7.41 4.21 0.00 3.25 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 0.00 137 S 9.24 4.44 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 Q 8.56 3.95 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 139 E 8.15 4.05 0.00 2.12 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 2.42 2.48 0.00 140 E 7.99 4.01 0.00 2.18 2.04 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 2.37 2.34 0.00 141 R 8.34 4.00 0.00 1.88 2.23 0.00 3.21 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 142 I 7.97 3.87 2.08 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.98 0.99 0.00 0.00 143 E 8.26 3.96 0.00 2.11 2.22 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 2.38 2.37 0.00 144 F 8.47 4.12 0.00 3.29 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 Y 8.83 4.40 0.00 3.24 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 0.00 146 E 8.40 3.73 0.00 2.16 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 0.00 2.49 2.52 0.00 147 L 7.78 3.77 0.00 1.69 1.56 0.87 0.87 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 0.00 148 D 8.05 4.11 0.00 2.03 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 0.00 149 K 7.54 3.60 0.00 1.68 1.68 0.00 1.32 0.00 0.00 1.42 0.00 0.00 2.89 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.17 0.71 7.81 150 K 7.52 4.04 0.00 1.75 1.85 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.43 7.81 151 E 8.42 4.23 0.00 1.96 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 2.23 2.43 0.00 152 N 9.01 4.26 0.00 2.91 2.87 0.00 0.00 6.84 7.17 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 0.00 153 I 7.79 3.81 2.21 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 1.61 0.76 1.29 0.00 0.00 154 R 8.67 4.14 0.00 2.07 2.16 0.00 3.62 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 155 Q 8.26 3.90 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 156 K 8.05 3.95 0.00 2.15 2.06 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.51 7.81 157 F 8.26 4.33 0.00 3.28 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 V 7.56 2.82 1.93 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 0.68 0.00 0.00 -0.15 0.00 0.00 159 A 8.01 3.80 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 0.00 160 D 8.26 4.37 0.00 3.13 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 0.00 161 L 8.21 3.84 0.00 1.26 1.37 0.77 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 162 R 7.41 3.68 0.00 1.54 1.89 0.00 3.17 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 163 K 7.94 3.96 0.00 1.82 1.90 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.39 7.81 164 E 7.82 3.60 0.00 1.56 1.55 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 1.47 1.47 0.00 165 F 7.89 4.69 0.00 3.33 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 0.00 166 A 7.43 4.17 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 0.00 167 G 8.88 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 K 7.78 4.21 0.00 1.89 1.88 0.00 1.89 0.00 0.00 1.79 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.67 1.76 7.81 169 G 7.96 3.78 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 0.00 0.00 0.00 170 L 7.69 4.85 0.00 1.21 0.84 0.70 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 171 T 7.76 4.37 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 0.95 0.00 0.00 172 F 8.14 4.80 0.00 2.82 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 S 9.05 4.53 0.00 4.15 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 0.00 174 I 8.59 4.77 1.95 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 1.29 0.71 1.06 0.00 0.00 175 G 8.57 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 0.00 176 G 8.43 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 0.00 177 Q 8.60 4.07 0.00 1.89 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.75 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 178 I 7.63 4.69 1.55 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.09 0.93 0.00 0.00 179 S 7.92 4.84 0.00 3.87 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 0.00 180 F 8.43 5.46 0.00 3.26 3.17 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 0.00 181 D 9.86 5.44 0.00 2.78 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 0.00 182 V 8.47 4.60 1.92 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 0.31 0.00 0.00 1.09 0.00 0.00 183 F 7.70 4.80 0.00 3.16 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 0.00 184 P 0.00 4.45 0.00 0.49 1.30 0.00 3.07 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.30 0.00 185 D 7.75 4.49 0.00 2.71 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 G 9.20 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 0.00 187 W 8.42 4.62 0.00 3.58 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 0.00 188 D 7.59 4.72 0.00 2.73 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 0.00 189 K 8.64 3.82 0.00 1.74 1.86 0.00 1.82 0.00 0.00 1.99 0.00 0.00 3.10 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.69 1.60 7.81 190 R 8.14 3.78 0.00 1.99 1.94 0.00 3.22 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 191 Y 8.09 3.73 0.00 2.92 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 0.00 192 C 7.72 3.51 0.00 1.71 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 0.00 193 L 7.64 3.84 0.00 1.60 1.59 0.77 0.43 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 0.00 194 R 6.89 4.12 0.00 1.64 1.65 0.00 2.21 0.00 0.00 2.50 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.01 0.00 195 H 7.44 4.65 0.00 3.19 3.55 0.00 5.59 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 V 7.62 4.41 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 0.51 0.00 0.00 0.87 0.00 0.00 197 E 8.04 4.35 0.00 2.11 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 2.40 2.28 0.00 198 N 8.02 4.99 0.00 2.69 2.80 0.00 0.00 6.87 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 0.00 199 D 8.01 4.64 0.00 2.69 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 G 8.06 3.78 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 0.00 0.00 0.00 201 Y 6.99 4.54 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 0.00 202 K 9.25 4.35 0.00 1.78 1.91 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.50 1.49 7.81 203 T 7.84 4.60 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 0.47 0.00 0.00 204 I 8.05 4.54 1.96 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 1.27 0.82 0.84 0.00 0.00 205 Y 9.13 4.57 0.00 2.97 2.61 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 0.00 206 F 8.35 5.17 0.00 2.99 2.65 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 0.00 207 F 7.91 4.89 0.00 2.94 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 0.00 208 G 8.03 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 0.00 0.00 0.00 0.00 209 D 9.10 5.06 0.00 2.58 2.61 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 0.00 210 K 8.52 3.55 0.00 0.79 0.74 0.00 1.17 0.00 0.00 1.64 0.00 0.00 2.65 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.13 1.12 7.81 211 T 7.07 5.01 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 1.27 0.00 0.00 *216 N 7.96 4.83 0.00 2.73 2.18 0.00 0.00 6.61 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 0.00 217 D 8.45 4.64 0.00 2.59 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 H 8.71 4.59 0.00 3.52 3.29 0.00 5.86 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 E 8.77 4.01 0.00 2.23 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 2.42 2.43 0.00 220 I 7.56 3.48 1.55 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.42 -0.26 0.00 0.00 221 F 7.70 4.08 0.00 3.17 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 T 7.59 4.42 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 1.44 0.00 0.00 223 D 7.49 4.39 0.00 2.81 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 0.00 224 P 0.00 4.32 0.00 2.17 2.14 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 225 R 8.38 4.14 0.00 1.70 1.96 0.00 3.14 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 226 T 6.56 5.20 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 1.08 0.00 0.00 *228 G 8.50 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 0.00 0.00 0.00 229 Y 8.58 4.80 0.00 2.39 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 0.00 230 S 9.35 5.45 0.00 3.88 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 V 8.81 4.82 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 0.97 0.00 0.00 1.12 0.00 0.00 232 T 8.97 4.37 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 1.24 0.00 0.00 233 A 7.32 4.81 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 P 0.00 4.45 0.00 2.08 2.02 0.00 3.85 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.97 0.00 235 E 8.14 3.82 0.00 2.00 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 2.35 2.40 0.00 236 D 7.78 4.26 0.00 3.00 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 0.00 237 T 7.81 3.85 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 238 R 7.84 3.12 0.00 1.65 1.32 0.00 2.40 0.00 0.00 2.58 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.08 0.00 239 R 7.68 3.81 0.00 1.92 2.03 0.00 3.09 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 240 I 7.99 3.66 1.90 0.00 0.00 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 1.57 0.66 0.81 0.00 0.00 241 C 8.26 4.12 0.00 3.27 3.37 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 0.00 242 E 8.35 4.03 0.00 2.23 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 2.38 2.39 0.00 243 L 7.61 4.03 0.00 1.79 1.72 0.90 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 244 L 7.57 3.80 0.00 0.70 0.13 0.60 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 245 F 7.79 4.96 0.00 3.11 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 0.00 246 S 8.81 4.52 0.00 4.08 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 * Residues marked with a * may have inaccurate shift predictions.