NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7023 8.3829 118.2176 52.3192 38.9673 175.7167 3 N 4.2289 8.5071 118.6402 57.3989 37.4245 175.2451 4 T 4.0948 8.7491 118.3785 66.7701 69.0566 176.4156 5 I 3.8567 8.0877 123.8047 64.8818 36.7554 178.9943 6 E 4.0503 8.0433 119.2337 61.2741 29.2855 181.7977 7 T 4.1275 7.7062 115.5896 66.5384 68.3330 176.6620 8 I 3.8682 7.6952 121.6974 64.5621 37.0295 178.4635 9 L 4.1629 7.8925 117.0952 56.5206 41.5524 178.1897 10 A 4.4092 7.3223 118.9282 51.3017 19.3816 176.7813 11 H 4.3223 7.3146 117.9791 56.2946 30.5833 174.8407 12 R 4.4247 7.6352 120.3987 54.6794 31.9606 174.8195 13 S 4.4040 8.4951 117.3270 58.6219 63.4321 173.5800 14 I 4.3500 8.2394 126.4189 59.9209 38.1348 175.7520 15 R 4.0379 9.1986 123.8687 55.1268 30.8398 175.5188 16 K 4.4529 6.8451 117.7223 54.9647 35.9725 175.2515 17 F 5.5783 8.7733 123.1000 55.7351 42.7052 174.9796 18 T 4.4942 8.6323 111.7848 60.8501 70.1648 174.5420 19 A 4.3139 8.5355 122.6142 52.4442 18.8282 177.6998 20 V 3.7381 7.3096 117.2164 61.8258 31.8286 174.3878 21 P 4.5714 0.0000 0.0000 62.3471 32.2450 175.3520 22 I 4.2389 7.9812 120.2020 60.2589 38.1986 177.0275 23 T 4.1767 8.2754 116.4990 61.5133 70.7299 175.3420 24 D 4.4523 8.7062 123.8775 58.1745 40.5055 179.6021 25 E 4.0527 8.0945 118.5099 61.0894 29.9508 181.8650 26 Q 4.2788 7.9393 118.7740 58.8263 28.7873 178.7023 27 R 3.9749 8.2582 122.3106 60.1160 30.1421 179.2597 28 Q 4.0805 8.1437 120.5339 60.3451 28.0417 180.7331 29 T 4.1401 7.6163 115.3745 66.7790 68.5996 177.0503 30 I 3.7574 7.6680 121.4112 64.3679 37.0659 178.6745 31 I 3.8265 7.9492 123.1565 65.1487 36.6197 179.2098 32 Q 4.0509 8.3043 121.1800 59.9261 27.6006 180.2762 33 A 4.3515 8.0416 120.6701 55.2433 18.6345 179.6591 34 G 3.7600 7.9414 103.8787 48.0479 0.0000 176.0471 35 L 4.1139 8.0054 120.1479 57.0732 41.7064 178.7404 36 A 4.1823 7.5602 118.0280 52.3630 18.7086 177.6015 37 A 4.1706 7.0622 120.4331 51.4658 19.1511 177.9778 38 S 4.3188 8.4219 116.4855 58.7800 63.8286 174.1490 39 S 4.5528 8.2722 116.2916 56.1458 65.1157 173.3039 40 S 4.2042 9.1823 124.1093 60.1065 62.6603 174.4561 41 S 3.8143 9.4810 120.0449 59.0921 60.2969 171.8309 42 M 3.2417 8.0007 116.1294 56.4942 30.9171 178.1044 43 L 4.0899 8.1678 118.9226 55.5614 42.2753 177.3921 44 Q 3.2845 7.6592 115.1333 57.1796 26.2324 173.5530 45 V 4.2935 7.2749 107.7870 60.0795 33.4898 175.7642 46 V 4.8459 7.6678 120.4574 61.2726 33.4254 175.0412 47 S 4.7917 8.8723 122.7443 56.6917 66.6448 172.8620 48 I 4.3850 8.1692 123.5803 59.3220 39.6149 174.9691 49 V 4.1087 8.3157 127.5723 61.0553 33.2076 174.3971 50 R 4.3305 8.4684 129.3941 55.7071 30.8642 175.6745 51 V 4.3203 8.4625 127.8938 61.9630 31.4534 175.1133 52 T 4.3018 8.4517 118.2057 62.2131 70.3383 175.1566 53 D 4.4206 7.9698 122.8262 54.0494 42.0793 176.6584 54 S 4.2408 8.8520 125.5001 62.0215 63.0151 176.8881 55 E 4.0149 8.3604 122.0993 60.8346 29.4233 183.0261 56 K 4.4698 8.0663 120.1865 58.8093 32.2193 179.5018 57 R 3.8701 8.0782 120.8361 59.9767 29.8499 179.5058 58 N 4.2980 7.9287 118.6045 57.4247 37.3211 179.0214 59 E 3.7856 7.8281 120.8165 59.2145 29.5647 179.4746 60 L 4.2684 8.1262 118.9567 57.5891 41.7346 179.4395 61 A 3.8924 8.0241 123.4481 55.7157 18.1584 180.3722 62 Q 4.0730 7.6492 119.3210 60.2737 27.9859 180.7347 63 F 4.8340 7.9427 118.5108 60.1276 39.0135 176.7879 64 A 4.5418 7.9086 117.9750 52.1593 18.5717 177.4146 65 G 3.7309 7.7173 105.3579 46.5647 0.0000 173.4832 66 N 3.9930 7.9186 110.6542 54.0694 36.2390 176.7401 67 Q 3.9589 7.5468 117.4412 54.0168 28.6214 176.8000 68 A 3.9249 8.1402 126.5559 55.1248 18.4573 178.2527 69 Y 4.7132 6.9437 116.3507 59.0890 37.8976 178.3543 70 V 3.4694 7.2717 122.2123 66.1577 31.5500 177.9597 71 E 4.1144 7.7105 117.7750 60.5887 30.0901 181.5932 72 S 4.5876 7.9881 113.0986 58.4513 63.7289 174.0709 73 A 3.6844 7.1819 125.3908 51.7799 18.7961 177.3867 74 A 4.2160 8.2286 123.0905 54.5273 19.1918 178.0634 75 E 4.7143 8.3581 113.7365 54.5284 34.3382 175.1910 76 F 5.2237 8.7420 124.5158 56.7140 42.4920 172.9797 77 L 4.8486 8.2699 126.7773 52.8865 44.1781 175.8168 78 V 4.3868 8.0370 123.0192 61.0689 34.0169 174.1428 79 F 4.6633 8.9092 127.5691 56.4368 40.5005 174.8105 80 C 5.3326 8.7867 120.7799 57.7396 32.5345 173.5132 81 I 4.3489 8.7700 123.4515 61.3947 38.1644 174.9968 82 D 4.6907 9.2355 126.0979 53.2527 44.0337 174.6422 83 Y 4.6941 9.2352 123.3280 57.7461 38.9396 177.9943 84 Q 4.0728 8.5595 123.6790 59.1302 29.0054 178.1561 85 R 3.8981 8.1901 118.7770 59.6943 30.1375 178.5991 86 H 4.2549 8.2743 115.2371 58.7449 28.6165 177.5553 87 A 4.3219 7.8375 121.3892 55.1715 18.2560 179.5415 88 T 4.0336 7.9871 114.1971 66.6966 68.5794 176.8614 89 I 4.1186 7.4358 120.6602 62.7645 37.3352 176.0822 90 N 4.8129 8.1484 119.4897 51.3452 40.7459 173.0697 91 P 4.3844 0.0000 0.0000 65.7523 31.5943 178.0003 92 D 4.5562 8.2096 115.7399 53.8602 39.9823 182.1036 93 V 3.5946 7.3116 118.8913 64.3034 31.7333 175.3953 94 Q 4.3435 8.6746 126.2401 54.7850 28.4563 174.9079 95 A 4.2268 8.2921 125.0506 51.7622 19.6558 176.9758 96 D 4.6345 7.4801 115.2171 53.2963 40.5079 176.4914 97 F 4.5932 7.8086 120.4747 57.5259 39.8074 176.1853 98 T 3.9032 9.0534 122.7449 66.8588 68.2075 176.2120 99 E 3.9674 8.3649 120.6624 59.5800 29.6257 178.8847 100 L 4.1376 8.1054 118.6027 57.8087 41.5033 179.5138 101 T 4.1468 7.7566 115.5150 66.2700 68.5082 176.8348 102 L 4.0525 8.1234 121.1344 57.7605 41.5378 179.5756 103 I 3.8688 8.0805 119.9956 64.2698 37.1955 178.6815 104 G 3.6747 8.2627 106.2663 47.7829 0.0000 175.6617 105 A 4.1217 8.3120 123.5204 54.7747 18.4566 179.9097 106 V 3.5476 8.0129 116.8113 66.4712 31.7361 178.0264 107 D 4.4544 8.4416 118.8029 57.4992 40.4931 179.1303 108 S 4.4035 8.2454 115.6156 61.4254 62.9135 176.8888 109 G 3.6110 8.1834 108.1522 47.7571 0.0000 175.9020 110 I 3.7113 7.7726 122.3043 64.2375 37.2983 178.1855 111 M 4.0734 8.1804 118.6795 58.7796 32.1659 178.0000 112 A 3.5664 8.1664 121.1921 55.1635 18.3176 179.4135 113 Q 4.0893 8.0200 119.1720 58.7855 29.0976 178.1711 114 N 4.3608 7.9768 117.4028 56.3025 38.5377 177.2116 115 C 4.3100 8.0345 117.8704 62.7522 28.2857 175.9350 116 L 3.8972 7.9756 121.8694 58.2093 41.8328 178.9919 117 L 4.0979 8.2638 118.9899 57.6089 41.2603 179.4361 118 A 3.9881 7.8839 119.8621 55.0322 18.7298 179.2693 119 A 4.0866 7.9823 119.2984 55.4913 18.3367 179.8149 120 E 4.4721 8.9813 118.9623 58.8256 29.2480 179.5078 121 S 4.2489 7.8566 112.9202 60.6880 63.4017 174.9142 122 M 4.1741 7.7829 120.3268 55.7032 32.1304 176.9386 123 G 3.9771 7.8502 107.4273 44.8836 0.0000 173.4854 124 L 4.5010 7.6539 120.0835 53.6852 44.2206 175.2050 125 G 4.5104 9.1284 106.8943 45.1006 0.0000 171.4768 126 G 4.6650 8.4605 105.6878 46.1734 0.0000 172.4651 127 V 5.0829 8.2001 117.5880 60.6078 34.5264 173.4769 128 Y 4.6483 8.9627 120.9442 58.2234 39.7468 174.6870 129 I 4.7205 9.4891 123.9459 59.5002 38.8070 176.3382 130 G 4.2272 8.9294 113.8430 46.0989 0.0000 172.8638 131 G 3.9178 8.3657 107.7000 47.5649 0.0000 175.3376 132 L 4.2098 8.1755 120.6418 57.7365 41.4360 178.9880 133 R 4.0871 8.0377 116.5566 57.9963 30.0361 178.0237 134 N 4.5772 7.9897 116.6121 55.4118 39.6727 175.6213 135 S 4.5461 7.7156 113.6499 56.4745 64.0088 175.2662 136 A 3.5571 7.9754 124.7101 55.4269 18.3266 179.2857 137 A 4.0335 7.6215 120.8341 55.9184 18.6286 180.3456 138 Q 3.8241 7.5569 118.7542 59.9079 28.3178 180.9499 139 V 3.7124 7.4268 119.5584 65.7804 31.5799 177.6363 140 D 4.4103 8.2210 120.3183 58.1988 41.0309 178.8269 141 E 4.0530 8.0778 118.6052 60.9892 29.4403 180.6433 142 L 4.2385 7.6794 119.7323 57.7586 42.3270 178.2582 143 L 4.4280 7.8540 115.8706 53.8448 42.0550 176.7548 144 G 3.9299 7.7221 107.0801 46.2978 0.0000 174.2122 145 L 4.0655 7.6874 119.8125 53.6232 42.0440 176.2477 146 P 4.5793 0.0000 0.0000 62.1505 31.8061 176.1571 147 E 4.0596 8.4264 113.2888 57.3242 30.2578 172.6190 148 N 4.3986 9.3916 115.5355 54.4045 36.7090 174.0498 149 S 5.0699 7.5156 108.9214 56.7544 65.8428 172.8912 150 A 4.9504 8.5824 126.6899 50.5394 22.8045 175.8057 151 V 4.1232 8.8899 121.2217 61.9423 32.1381 175.0326 152 L 4.8648 8.3558 122.3942 55.6824 43.6389 176.3705 153 F 4.9758 7.3284 110.9443 56.3937 41.3196 172.2651 154 G 4.3274 9.3875 107.2665 44.8935 0.0000 171.8616 155 M 5.3290 8.1101 119.0233 54.6034 35.9811 173.4325 156 C 5.2818 9.4340 124.8618 59.1541 30.2488 172.8478 157 L 5.1375 9.2430 122.3289 52.3508 46.0823 176.2597 158 G 4.0248 7.9441 108.7418 46.4584 0.0000 170.9189 159 H 4.9549 8.2034 117.0905 54.8065 29.7598 173.9191 160 P 4.7159 0.0000 0.0000 62.3449 32.0295 175.6315 161 D 5.1088 8.5201 123.4379 53.4214 42.0137 175.0692 162 Q 4.5893 7.7694 111.9888 55.0319 31.2212 173.6575 163 N 4.8923 8.0866 116.2651 51.2555 38.8801 172.0519 164 P 4.4220 0.0000 0.0000 62.3484 32.6568 177.0031 165 E 4.3282 8.3680 116.6160 54.9739 30.6199 177.8683 166 V 3.6939 8.2188 121.1398 62.8722 32.0913 175.7026 167 K 3.4694 8.2896 127.1096 54.4708 32.7108 175.1186 168 P 4.3270 0.0000 0.0000 62.6541 32.0087 175.6330 169 R 4.4054 7.8751 118.5545 53.7044 32.8823 175.7284 170 L 3.0125 7.2593 118.6666 53.6705 42.1481 175.9588 171 P 4.2420 0.0000 0.0000 62.3488 32.0598 177.0119 172 A 3.9254 8.6175 121.8167 55.7821 17.9314 179.6602 173 H 4.1830 8.0016 111.4566 57.7352 28.7700 177.3486 174 V 3.6733 7.1303 120.8273 65.5597 31.7274 177.6809 175 V 3.6998 7.4582 116.1696 63.9598 31.7099 175.9498 176 V 4.1558 7.4548 118.7599 61.4412 32.4254 174.4160 177 H 4.7644 8.6287 123.8454 53.9168 31.0131 173.4379 178 E 4.3761 8.6372 123.0385 55.8196 30.1445 176.4503 179 N 4.5824 9.3993 127.4559 55.0312 37.9892 175.2553 180 Q 4.6604 7.4660 112.5299 52.9768 32.2024 176.2868 181 Y 3.9731 8.7714 123.0499 58.6352 39.3683 175.9631 182 Q 4.6680 8.2325 127.6418 53.4921 30.4322 173.1320 183 E 4.3637 8.4923 117.5061 54.9997 30.5509 175.4923 184 L 4.1219 8.3704 123.0469 54.7530 43.0328 175.8132 185 N 4.7714 8.5343 124.3632 52.0303 39.5051 175.4056 186 L 4.2024 8.5026 126.7307 57.4566 41.6474 179.0435 187 D 4.4424 8.2217 119.1409 57.3860 40.6859 178.3171 188 D 4.4329 8.2246 119.5608 57.2696 40.6981 178.8622 189 I 3.9758 7.7805 120.1500 64.3080 37.2455 178.0401 190 Q 4.0371 8.1952 120.4396 59.3101 28.9701 178.3890 191 S 4.1892 8.3654 116.3579 61.6748 62.8464 176.0919 192 Y 4.1669 8.1527 122.3853 60.7259 38.5600 177.4078 193 D 4.4241 8.6139 122.5263 58.1582 40.8402 179.5320 194 Q 4.0904 8.1341 121.1841 60.4220 27.7021 180.8970 195 T 4.1171 7.6548 116.7679 66.7982 68.3324 176.7538 196 M 4.1171 8.0296 122.9064 58.5212 31.7452 179.4333 197 Q 4.1897 8.0288 120.4020 60.0432 28.3819 182.1511 198 A 4.3503 7.7334 121.1980 54.9838 18.4287 178.9119 199 Y 3.9683 7.4035 117.2278 58.9183 39.2250 176.5377 200 Y 4.2488 7.9823 117.2877 57.5621 37.3850 178.5848 *210 S 4.1563 8.6603 119.0749 58.9336 63.6788 172.9435 211 T 4.3980 8.0365 117.1635 60.3937 71.2120 175.6074 212 W 4.1746 8.7494 130.8826 60.8777 30.7617 178.0271 213 S 3.5268 8.8756 116.4544 62.1244 62.3565 177.1109 214 Q 4.0509 7.9123 125.6798 60.2068 27.7251 181.0265 215 E 4.0897 8.2447 119.8945 61.2540 29.9648 182.3873 216 V 3.6856 7.4164 114.1798 64.2263 31.6438 178.8948 217 T 3.9995 7.6279 109.2221 64.3080 68.4123 177.0694 218 G 3.6120 7.8309 110.7169 48.1761 0.0000 176.2664 219 K 4.1732 7.7899 126.1637 59.4378 31.5788 181.1421 220 L 4.3593 7.6287 117.3775 56.3307 41.7604 178.5770 221 A 4.2724 7.6725 119.7924 54.9138 18.9058 177.3083 222 G 4.0157 7.6468 106.3036 44.4112 0.0000 172.2329 223 E 4.3395 8.5384 118.7202 55.2097 30.6127 176.1772 224 S 4.4053 8.4313 119.9804 57.5971 63.4989 174.6939 225 R 3.6129 8.4009 125.2325 56.4135 26.8426 175.7468 226 P 4.3926 0.0000 0.0000 65.0919 32.1740 177.8281 227 H 4.5737 8.0303 113.8953 56.8244 29.5741 177.3078 228 I 3.7750 7.7285 122.5361 64.5253 36.8177 177.8364 229 L 3.9775 7.8691 120.6032 57.8304 42.0690 177.0898 230 P 4.2473 0.0000 0.0000 65.4103 30.6995 178.0520 231 Y 4.1154 8.0038 118.2634 60.7628 38.7439 177.8326 232 L 3.5948 7.8929 119.8092 57.9070 41.7496 179.3914 233 N 4.4713 8.6773 118.1775 55.6882 38.2345 177.5347 234 S 4.2076 7.8877 114.4936 60.3295 63.4270 175.5774 235 K 4.3453 7.4257 119.9302 55.6942 31.9515 177.5651 236 G 3.8534 8.0516 108.3750 45.3354 0.0000 173.0559 237 L 4.6057 7.8703 118.9682 53.3125 44.2133 175.9693 238 A 3.5085 8.2682 120.8856 53.3299 16.0093 178.5554 239 K 4.2243 8.0211 120.4092 58.9233 33.2371 177.9715 240 R 4.1143 7.4649 120.0309 56.4218 29.1004 174.6078 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 N 8.38 4.70 0.00 2.96 3.04 0.00 0.00 6.25 6.07 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 3 N 8.51 4.23 0.00 2.83 2.87 0.00 0.00 6.57 6.34 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 4 T 8.75 4.09 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 5 I 8.09 3.86 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 1.38 1.02 0.91 0.00 0.00 6 E 8.04 4.05 0.00 1.93 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 2.24 2.22 0.00 7 T 7.71 4.13 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 1.23 0.00 0.00 8 I 7.70 3.87 2.00 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 1.52 1.22 0.90 0.00 0.00 9 L 7.89 4.16 0.00 1.63 1.72 0.91 0.58 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 10 A 7.32 4.41 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 11 H 7.31 4.32 0.00 3.15 3.37 0.00 5.97 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 7.64 4.42 0.00 1.85 1.76 0.00 3.41 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.55 0.00 13 S 8.50 4.40 0.00 3.89 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 8.24 4.35 1.92 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 1.27 0.81 0.45 0.00 0.00 15 R 9.20 4.04 0.00 1.27 0.72 0.00 2.91 0.00 0.00 2.79 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.22 0.00 16 K 6.85 4.45 0.00 1.40 1.51 0.00 1.61 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.33 7.81 17 F 8.77 5.58 0.00 2.97 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.63 4.49 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 19 A 8.54 4.31 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 20 V 7.31 3.74 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.90 0.00 0.00 21 P 0.00 4.57 0.00 2.23 2.06 0.00 3.82 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 2.00 1.99 0.00 22 I 7.98 4.24 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.57 0.96 0.00 0.00 23 T 8.28 4.18 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 24 D 8.71 4.45 0.00 2.71 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 25 E 8.09 4.05 0.00 1.97 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 2.31 1.97 0.00 26 Q 7.94 4.28 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 27 R 8.26 3.97 0.00 1.99 1.91 0.00 3.07 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 28 Q 8.14 4.08 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 29 T 7.62 4.14 4.41 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 1.22 0.00 0.00 30 I 7.67 3.76 2.03 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 1.53 1.07 0.94 0.00 0.00 31 I 7.95 3.83 1.86 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 1.60 0.86 0.89 0.00 0.00 32 Q 8.30 4.05 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 33 A 8.04 4.35 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 7.94 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 0.00 0.00 0.00 35 L 8.01 4.11 0.00 1.64 1.76 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.56 4.18 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 37 A 7.06 4.17 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 38 S 8.42 4.32 0.00 3.89 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 39 S 8.27 4.55 0.00 3.80 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 40 S 9.18 4.20 0.00 3.97 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 41 S 9.48 3.81 0.00 4.02 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 42 M 8.00 3.24 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 43 L 8.17 4.09 0.00 1.77 1.75 1.05 0.88 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 44 Q 7.66 3.28 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.24 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 45 V 7.27 4.29 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 0.36 0.00 0.00 0.84 0.00 0.00 46 V 7.67 4.85 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.99 0.00 0.00 47 S 8.87 4.79 0.00 3.71 3.60 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 48 I 8.17 4.39 1.61 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.31 0.36 0.00 0.00 49 V 8.32 4.11 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 0.90 0.00 0.00 0.86 0.00 0.00 50 R 8.47 4.33 0.00 1.78 1.77 0.00 3.23 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 51 V 8.46 4.32 2.32 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 0.92 0.00 0.00 1.06 0.00 0.00 52 T 8.45 4.30 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 53 D 7.97 4.42 0.00 2.74 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 54 S 8.85 4.24 0.00 4.07 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 55 E 8.36 4.01 0.00 2.03 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 0.00 2.24 2.22 0.00 56 K 8.07 4.47 0.00 1.96 1.93 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.40 7.81 57 R 8.08 3.87 0.00 1.98 1.87 0.00 3.39 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 58 N 7.93 4.30 0.00 2.73 2.83 0.00 0.00 7.09 8.32 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 59 E 7.83 3.79 0.00 2.04 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 2.12 2.38 0.00 60 L 8.13 4.27 0.00 1.72 1.69 1.13 1.09 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 61 A 8.02 3.89 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 7.65 4.07 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 63 F 7.94 4.83 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 64 A 7.91 4.54 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 7.72 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 0.00 0.00 0.00 66 N 7.92 3.99 0.00 2.84 2.83 0.00 0.00 7.11 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 67 Q 7.55 3.96 0.00 1.81 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.74 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 68 A 8.14 3.92 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 69 Y 6.94 4.71 0.00 3.60 3.56 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 70 V 7.27 3.47 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 -0.20 0.00 0.00 0.76 0.00 0.00 71 E 7.71 4.11 0.00 2.13 1.84 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 2.25 2.18 0.00 72 S 7.99 4.59 0.00 4.17 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.18 3.68 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 74 A 8.23 4.22 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.36 4.71 0.00 1.82 1.77 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 2.19 2.35 0.00 76 F 8.74 5.22 0.00 3.07 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 77 L 8.27 4.85 0.00 1.52 1.08 0.92 0.29 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 78 V 8.04 4.39 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 1.01 0.00 0.00 0.82 0.00 0.00 79 F 8.91 4.66 0.00 1.91 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 80 C 8.79 5.33 0.00 2.77 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 81 I 8.77 4.35 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.88 1.09 0.00 0.00 82 D 9.24 4.69 0.00 2.56 2.39 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 0.00 83 Y 9.24 4.69 0.00 3.15 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 84 Q 8.56 4.07 0.00 2.37 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 85 R 8.19 3.90 0.00 1.79 1.85 0.00 3.11 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 86 H 8.27 4.25 0.00 3.48 3.45 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 A 7.84 4.32 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 7.99 4.03 4.40 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 1.21 0.00 0.00 89 I 7.44 4.12 2.02 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.59 0.92 0.00 0.00 90 N 8.15 4.81 0.00 2.69 2.66 0.00 0.00 7.26 7.26 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 91 P 0.00 4.38 0.00 2.09 2.11 0.00 3.74 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 2.03 2.09 0.00 92 D 8.21 4.56 0.00 2.72 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 93 V 7.31 3.59 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.06 0.00 0.00 94 Q 8.67 4.34 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 95 A 8.29 4.23 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 7.48 4.63 0.00 2.63 2.88 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 97 F 7.81 4.59 0.00 3.04 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 98 T 9.05 3.90 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 1.23 0.00 0.00 99 E 8.36 3.97 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 100 L 8.11 4.14 0.00 1.59 0.97 0.69 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 101 T 7.76 4.15 4.40 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 1.26 0.00 0.00 102 L 8.12 4.05 0.00 1.94 1.75 0.94 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.08 3.87 2.17 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.89 1.00 0.00 0.00 104 G 8.26 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 A 8.31 4.12 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 0.00 0.00 106 V 8.01 3.55 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 1.05 0.00 0.00 1.00 0.00 0.00 107 D 8.44 4.45 0.00 2.93 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 0.00 108 S 8.25 4.40 0.00 4.26 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 0.00 109 G 8.18 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 I 7.77 3.71 2.05 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 1.42 0.99 0.93 0.00 0.00 111 M 8.18 4.07 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.88 0.00 112 A 8.17 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 8.02 4.09 0.00 2.37 2.27 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 2.36 2.31 0.00 114 N 7.98 4.36 0.00 3.07 2.92 0.00 0.00 6.97 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 C 8.03 4.31 0.00 3.29 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 0.00 116 L 7.98 3.90 0.00 1.55 1.74 0.89 0.57 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 0.00 117 L 8.26 4.10 0.00 1.82 1.71 0.92 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.88 3.99 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.98 4.09 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.98 4.47 0.00 2.00 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 0.00 2.38 2.34 0.00 121 S 7.86 4.25 0.00 4.07 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 M 7.78 4.17 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.49 0.00 123 G 7.85 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 0.00 124 L 7.65 4.50 0.00 1.69 1.62 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 125 G 9.13 4.51 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 0.00 0.00 0.00 126 G 8.46 4.66 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 0.00 0.00 0.00 127 V 8.20 5.08 2.26 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 0.92 0.00 0.00 1.07 0.00 0.00 128 Y 8.96 4.65 0.00 2.95 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 0.00 129 I 9.49 4.72 2.33 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.49 1.20 0.00 0.00 130 G 8.93 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 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 0.00 132 L 8.18 4.21 0.00 1.84 1.83 1.13 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 133 R 8.04 4.09 0.00 1.94 2.01 0.00 3.26 0.00 0.00 3.47 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.96 0.00 134 N 7.99 4.58 0.00 3.03 2.92 0.00 0.00 6.73 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 S 7.72 4.55 0.00 3.53 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 7.98 3.56 0.40 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 0.00 137 A 7.62 4.03 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 0.00 138 Q 7.56 3.82 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.86 0.00 0.00 0.00 0.00 0.00 2.36 1.98 0.00 139 V 7.43 3.71 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 0.98 0.00 0.00 0.90 0.00 0.00 140 D 8.22 4.41 0.00 3.07 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 0.00 141 E 8.08 4.05 0.00 2.05 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 0.00 2.24 2.19 0.00 142 L 7.68 4.24 0.00 1.90 2.01 1.07 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 143 L 7.85 4.43 0.00 1.72 1.70 0.95 0.91 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 0.00 144 G 7.72 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 0.00 145 L 7.69 4.07 0.00 2.01 1.66 0.98 1.10 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 0.00 146 P 0.00 4.58 0.00 2.18 2.10 0.00 3.78 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 1.99 1.96 0.00 147 E 8.43 4.06 0.00 1.92 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.90 0.00 148 N 9.39 4.40 0.00 2.94 3.07 0.00 0.00 6.62 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 0.00 149 S 7.52 5.07 0.00 3.75 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 0.00 150 A 8.58 4.95 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 8.89 4.12 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 0.70 0.00 0.00 0.96 0.00 0.00 152 L 8.36 4.86 0.00 1.46 1.92 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 153 F 7.33 4.98 0.00 3.42 3.25 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 0.00 154 G 9.39 4.33 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 0.00 155 M 8.11 5.33 0.00 2.19 1.95 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.48 0.00 156 C 9.43 5.28 0.00 3.23 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 0.00 157 L 9.24 5.14 0.00 1.47 1.44 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 158 G 7.94 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 0.00 159 H 8.20 4.95 0.00 3.19 3.31 0.00 5.63 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 P 0.00 4.72 0.00 1.94 1.94 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 161 D 8.52 5.11 0.00 2.62 2.53 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 0.00 162 Q 7.77 4.59 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.06 0.00 0.00 0.00 0.00 0.00 2.04 2.20 0.00 163 N 8.09 4.89 0.00 2.59 2.67 0.00 0.00 7.04 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 0.00 164 P 0.00 4.42 0.00 2.08 1.97 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.02 0.00 165 E 8.37 4.33 0.00 1.99 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.86 0.00 166 V 8.22 3.69 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 0.92 0.00 0.00 0.92 0.00 0.00 167 K 8.29 3.47 0.00 1.55 1.46 0.00 1.66 0.00 0.00 1.55 0.00 0.00 3.08 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.30 0.88 7.81 168 P 0.00 4.33 0.00 2.21 2.00 0.00 3.00 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.87 0.00 169 R 7.88 4.41 0.00 1.63 1.65 0.00 3.28 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.52 0.00 170 L 7.26 3.01 0.00 1.17 1.17 0.72 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 171 P 0.00 4.24 0.00 2.03 2.10 0.00 3.36 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.84 0.00 172 A 8.62 3.93 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 0.00 173 H 8.00 4.18 0.00 3.25 3.39 0.00 5.52 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 V 7.13 3.67 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.69 0.00 0.00 175 V 7.46 3.70 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.79 0.00 0.00 176 V 7.45 4.16 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 0.81 0.00 0.00 0.92 0.00 0.00 177 H 8.63 4.76 0.00 3.10 3.30 0.00 5.74 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 0.00 178 E 8.64 4.38 0.00 1.94 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 2.22 2.24 0.00 179 N 9.40 4.58 0.00 2.89 2.98 0.00 0.00 6.81 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 0.00 180 Q 7.47 4.66 0.00 2.01 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.17 1.91 0.00 181 Y 8.77 3.97 0.00 2.88 2.88 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 0.00 182 Q 8.23 4.67 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.77 0.00 0.00 0.00 0.00 0.00 2.19 1.89 0.00 183 E 8.49 4.36 0.00 1.98 1.77 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 2.23 1.86 0.00 184 L 8.37 4.12 0.00 1.64 1.66 0.95 1.01 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 0.00 185 N 8.53 4.77 0.00 2.76 2.88 0.00 0.00 7.22 6.66 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 0.00 186 L 8.50 4.20 0.00 1.76 1.75 0.95 1.15 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 0.00 187 D 8.22 4.44 0.00 2.83 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 0.00 188 D 8.22 4.43 0.00 2.86 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 0.00 189 I 7.78 3.98 2.14 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 1.62 1.00 1.18 0.00 0.00 190 Q 8.20 4.04 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 191 S 8.37 4.19 0.00 4.13 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 0.00 192 Y 8.15 4.17 0.00 3.05 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 0.00 193 D 8.61 4.42 0.00 2.98 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 0.00 194 Q 8.13 4.09 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 195 T 7.65 4.12 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 1.19 0.00 0.00 196 M 8.03 4.12 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.55 0.00 197 Q 8.03 4.19 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.01 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 198 A 7.73 4.35 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 0.00 199 Y 7.40 3.97 0.00 2.83 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 0.00 200 Y 7.98 4.25 0.00 3.04 2.26 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 *210 S 8.66 4.16 0.00 3.82 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 0.00 211 T 8.04 4.40 4.42 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 1.25 0.00 0.00 212 W 8.75 4.17 0.00 3.38 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 S 8.88 3.53 0.00 4.08 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 Q 7.91 4.05 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 215 E 8.24 4.09 0.00 1.96 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 2.24 2.22 0.00 216 V 7.42 3.69 1.80 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 0.46 0.00 0.00 -0.01 0.00 0.00 217 T 7.63 4.00 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 1.12 0.00 0.00 218 G 7.83 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 K 7.79 4.17 0.00 1.72 1.83 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 220 L 7.63 4.36 0.00 1.60 1.72 0.89 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 221 A 7.67 4.27 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 0.00 222 G 7.65 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 0.00 223 E 8.54 4.34 0.00 1.97 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 2.26 2.32 0.00 224 S 8.43 4.41 0.00 3.85 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 0.00 225 R 8.40 3.61 0.00 1.90 1.80 0.00 3.16 0.00 0.00 3.57 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 226 P 0.00 4.39 0.00 2.19 2.20 0.00 3.81 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 2.04 1.99 0.00 227 H 8.03 4.57 0.00 3.36 3.59 0.00 5.46 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 I 7.73 3.77 1.96 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.09 0.99 0.00 0.00 229 L 7.87 3.98 0.00 1.76 1.67 0.91 0.99 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 0.00 230 P 0.00 4.25 0.00 2.37 2.11 0.00 3.74 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 2.14 2.16 0.00 231 Y 8.00 4.12 0.00 3.15 3.26 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 0.00 232 L 7.89 3.59 0.00 1.82 1.62 0.95 0.51 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 0.00 233 N 8.68 4.47 0.00 2.87 2.82 0.00 0.00 6.34 7.70 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 0.00 234 S 7.89 4.21 0.00 4.02 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 0.00 235 K 7.43 4.35 0.00 1.70 1.81 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.99 1.37 7.81 236 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 0.00 237 L 7.87 4.61 0.00 1.71 1.50 0.93 1.16 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 0.00 238 A 8.27 3.51 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 0.00 239 K 8.02 4.22 0.00 1.60 1.77 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.41 7.81 240 R 7.46 4.11 0.00 1.83 1.81 0.00 2.61 0.00 0.00 3.10 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.93 0.00 * Residues marked with a * may have inaccurate shift predictions.