NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 V 4.1416 7.9127 120.3806 62.7154 32.8545 173.7365 17 V 4.1273 8.0949 127.1929 61.1939 32.5950 174.6199 18 G 3.8262 8.7248 114.2565 46.1819 0.0000 173.5976 19 G 3.9803 7.4758 109.5371 44.3654 0.0000 172.7348 20 E 4.6925 7.8534 118.3090 54.3802 34.7379 174.7438 21 D 4.9628 8.6158 120.9889 54.4615 41.3084 176.7023 22 A 4.7688 9.0753 125.7849 51.8511 19.6737 177.1651 23 K 4.4447 9.0229 118.9755 54.2710 33.6358 175.2481 24 P 4.2701 0.0000 0.0000 64.1872 31.5993 177.2904 25 G 3.7669 8.9881 109.7115 45.7058 0.0000 174.2124 26 Q 3.5702 7.6964 121.1860 57.8800 29.4993 176.1794 27 F 3.5462 7.1038 115.8218 54.2494 39.1784 173.4093 28 P 4.4015 0.0000 0.0000 63.6295 31.8268 178.5785 29 W 5.2183 6.2477 115.2573 56.3522 29.1147 175.5408 30 Q 4.7086 7.6786 122.2354 56.3368 29.0056 175.4443 31 V 4.9960 9.0804 118.9375 59.5714 36.2277 174.6647 32 V 4.7892 8.3643 121.1755 60.0302 34.4576 174.4228 33 L 5.1122 8.3460 122.1326 53.1132 44.3197 175.2478 34 N 5.5480 9.1169 120.4978 51.0667 42.2573 173.1167 35 G 4.3920 8.9407 112.2457 45.8655 0.0000 176.2018 36 K 3.8993 8.7477 125.4436 58.6202 32.5221 176.4357 *38 V 4.5620 7.4774 117.1246 62.6924 32.3252 173.7706 39 D 4.6664 8.6851 125.4358 54.7542 42.4233 175.4697 40 A 3.7950 8.8799 126.9437 53.2103 16.4293 177.2598 41 F 4.8142 8.1430 115.9708 58.0722 40.2858 176.3293 42 C 4.9366 6.6070 115.5038 57.0618 41.7444 172.5574 43 G 4.4847 8.7038 108.2401 45.4406 0.0000 171.9814 44 G 4.6530 8.1128 105.2734 46.4580 0.0000 172.6805 45 S 5.5056 8.9061 115.1878 56.4420 67.4510 174.1699 46 I 4.1534 8.9394 125.1237 61.8231 37.3214 177.1424 47 V 3.7559 9.0714 128.4190 64.9597 31.9930 174.8988 48 N 4.9029 7.6773 114.1374 52.1014 39.5540 174.1079 49 E 4.0416 8.9919 116.3866 59.0654 29.6709 178.5758 50 K 4.4684 8.7522 115.8779 55.6130 33.5619 175.3237 51 W 5.6129 8.2900 119.1945 54.9269 33.5197 174.1851 52 I 5.2107 9.0682 124.5368 59.4693 40.2569 174.6954 53 V 4.9011 8.8646 125.6330 60.7257 33.9291 174.9409 54 T 4.9604 8.9787 117.7870 61.4251 71.1713 171.4548 55 A 4.8366 8.4400 122.3324 50.5094 20.8761 178.4709 56 A 3.8145 8.1322 124.9282 55.0378 18.5127 179.2646 57 H 4.7308 8.4246 110.6412 57.8413 28.7490 175.8492 58 C 4.7524 7.8172 117.1465 58.6797 40.3780 174.1714 59 V 4.5789 7.4500 112.6811 60.8337 32.3999 175.5097 60 E 4.0361 9.0295 120.0882 57.6872 29.6075 177.2737 61 T 3.6975 7.6626 118.0668 61.4055 66.1382 171.5195 61A G 4.1339 8.3368 116.4825 46.3296 0.0000 172.1908 61B V 4.4086 7.1775 112.1978 59.1161 35.4560 174.8620 62 K 4.5308 8.3985 118.6953 56.4597 34.1723 175.6576 63 I 4.9584 8.0167 119.9565 59.9937 41.2311 174.4084 64 T 4.9198 9.1109 121.7961 61.7669 72.0936 173.1574 65 V 4.7715 8.7697 124.6057 61.0649 34.7335 174.4371 65A V 4.8253 8.6674 126.8639 61.2484 34.0421 174.4791 66 A 5.1354 8.3118 130.0699 49.1362 21.8715 177.2565 66 G 4.7754 8.4018 115.0699 41.7362 0.0000 174.3565 70 E 4.6232 8.2008 119.4972 55.2757 30.9975 174.1298 71 H 4.9746 8.8903 122.2939 57.1257 32.0208 172.1752 72 N 5.4881 8.9080 120.2633 51.4792 40.0596 175.2237 73 I 3.5356 8.8110 128.4887 63.6876 37.2647 176.9914 74 E 4.3088 8.4284 116.3202 56.3114 30.2461 175.4068 75 E 4.6255 7.8092 118.4412 54.8748 32.2358 174.8881 76 T 4.6066 8.1585 116.2814 62.2077 69.2343 174.6227 77 E 4.3074 9.2556 125.0077 55.7412 30.8684 176.7663 78 H 4.0225 8.1676 114.7541 56.8575 26.5148 175.2492 79 T 4.4478 6.9907 105.5027 61.2932 70.1826 174.2495 80 E 4.3620 8.1645 122.3750 56.6341 30.3225 176.3340 81 Q 4.5120 8.9158 122.1616 54.1690 31.5235 174.8052 82 K 4.7560 8.6534 123.8883 55.2638 33.7457 176.5410 83 R 4.7376 9.0861 122.5003 54.5995 34.9419 174.0210 84 N 5.0018 8.6965 118.8982 52.3780 40.7654 174.3389 85 V 4.5157 7.9664 122.8756 61.9796 31.8282 175.6109 86 I 4.2770 8.5186 121.8442 61.6948 39.0778 175.9327 87 R 4.7471 7.5740 122.3262 54.8450 33.7057 173.5082 88 I 5.0917 8.4456 125.1600 59.7683 40.8390 175.2446 89 I 4.7009 9.2995 128.1113 58.7304 38.7710 173.0606 90 P 4.8883 0.0000 0.0000 62.0026 32.7768 175.9543 91 H 3.7355 8.8151 121.7026 56.4693 30.1019 176.1371 92 H 4.2368 8.3387 121.4905 58.1203 28.5896 175.6053 93 N 4.6835 7.7157 115.7481 52.7118 39.1550 174.4523 94 F 4.5329 7.9734 121.7394 59.4544 39.8658 174.3757 95 N 3.9106 7.8581 122.1437 53.8677 35.9046 175.2564 96 A 4.0137 7.8653 123.3867 53.9813 18.6289 178.6659 97 A 4.6552 7.3942 117.2721 49.8840 21.2662 175.6656 98 I 3.6463 8.0456 122.2976 62.1220 38.6893 175.4115 98A N 4.4380 8.3244 122.8110 54.2754 36.1209 175.1472 98B T 3.4769 6.6917 107.9206 61.1233 69.7498 174.9347 99 Y 3.7811 7.3039 117.1121 58.5125 35.5149 169.2279 100 N 4.5063 7.7100 117.8854 54.8262 39.5748 174.0719 101 H 4.2416 8.5065 117.8317 56.3326 26.1271 176.0523 102 D 4.5156 8.0254 119.3896 52.9296 39.8674 174.4006 103 I 4.6082 7.2782 120.7524 59.6881 41.7539 172.2322 104 A 5.4356 9.0498 128.2248 51.0950 23.3156 174.9493 105 L 5.4283 9.0613 119.0252 52.9644 45.4392 175.7306 106 L 5.2261 9.4861 122.6529 52.9709 44.9000 174.9409 107 E 3.6206 8.7862 125.4689 54.4093 30.9766 175.2304 108 L 4.7339 8.1179 127.5280 53.9964 42.6343 177.0997 109 D 4.3552 8.9657 122.2563 56.0123 39.6433 176.5978 110 E 4.7116 7.6329 118.3191 52.5124 32.2788 174.0015 111 P 4.6122 0.0000 0.0000 62.8281 31.9121 176.2172 112 L 4.1866 8.9121 122.8261 55.0362 42.6232 176.8628 113 V 4.2174 8.6560 122.4687 61.1541 32.1847 175.8523 114 L 4.4228 8.5367 128.9472 55.0298 42.5749 176.4396 115 N 4.8152 8.6476 118.2568 52.5501 39.7505 174.9604 116 S 4.1058 8.6710 113.1641 61.1079 62.8265 174.5060 117 Y 4.4392 8.6333 116.4854 57.6215 38.9669 176.0698 118 V 4.5037 7.8366 119.0944 61.1502 32.7536 173.3619 119 T 5.0511 8.7933 122.5502 60.8922 72.8608 172.2204 120 P 5.0606 0.0000 0.0000 62.6473 32.5009 175.2972 121 I 3.8989 8.1711 121.6306 59.7739 39.3681 175.2196 122 C 4.2839 7.6961 124.8357 59.5043 29.5264 173.2607 123 I 4.7119 8.1110 121.2476 59.6344 39.3276 175.5011 124 A 4.4731 8.8350 129.0380 50.8896 19.7992 176.1686 125 D 4.7159 8.2127 119.6573 52.4547 41.9869 176.9680 126 K 3.7723 8.5066 119.1817 59.7616 31.9791 177.8255 126A E 3.7104 8.0685 118.7348 59.6920 29.5291 178.3056 126B Y 3.2525 8.5257 116.7730 60.6114 37.7607 178.2721 127 T 3.7439 7.8932 117.2492 66.4984 68.4411 176.2184 128 N 4.1654 7.8822 118.8245 56.4183 38.6892 177.0541 129 I 3.4520 6.9481 120.5398 64.2842 37.4275 178.0958 130 F 3.2323 7.6142 118.9033 60.0039 38.5630 177.4475 131 L 3.8171 7.8655 120.0317 58.0422 41.6922 178.8833 132 K 4.0742 7.8733 116.0727 57.9916 32.0027 178.6228 133 F 4.6433 7.8325 118.4595 58.8727 39.0258 176.4426 134 G 3.9365 9.1922 106.5664 45.1844 0.0000 172.5883 135 S 4.8834 7.7705 113.6317 56.6577 65.4149 173.0175 136 G 4.2390 8.7003 112.3984 45.2469 0.0000 170.3752 137 Y 5.2032 9.2980 117.5751 56.1096 40.6462 175.8106 138 V 5.2824 9.0779 116.7155 59.0375 35.3107 174.8021 139 S 4.8386 8.0496 116.1736 56.7415 66.1159 173.2964 140 G 3.7362 7.4107 108.3718 46.1938 0.0000 172.5948 141 W 4.5353 8.4950 116.9587 56.5422 30.0378 177.5177 142 G 4.0188 8.4252 109.6212 45.4981 0.0000 173.5889 143 R 4.4737 8.6351 119.1663 56.3154 29.8543 178.0466 144 V 4.5885 8.8048 114.8432 60.8981 32.1389 175.8724 145 F 4.7157 7.3935 118.2512 55.8877 42.8729 172.8854 143 H 4.8637 8.8251 116.8663 55.3154 27.9543 175.8466 144 K 4.7885 9.0648 116.0432 54.8981 32.3389 176.1724 145 G 4.0557 7.4235 106.7512 43.2877 0.0000 171.9854 150 R 4.2616 8.4878 115.5657 56.3605 30.3342 176.7263 151 S 4.7708 8.5665 116.1924 58.0494 64.2418 173.5428 152 A 4.4157 8.1810 123.4023 51.8968 19.0596 177.6213 153 L 4.4433 8.7024 119.7439 55.9903 43.7550 176.7392 154 V 4.8317 7.6732 117.8044 60.6219 33.2714 175.5712 155 L 2.8266 8.4870 129.3578 55.9247 42.8774 175.9150 156 Q 5.2560 8.2332 124.5522 54.5177 31.9449 174.0750 157 Y 5.2561 8.4143 118.4711 55.8471 42.1973 173.6358 158 L 4.6816 8.8992 121.0152 54.0184 46.1930 173.8785 159 R 4.2407 8.5819 126.5039 55.3879 31.3860 175.6570 160 V 4.3896 8.5492 119.5872 58.7258 35.3823 173.3014 161 P 4.7236 0.0000 0.0000 61.9812 32.9088 175.3286 162 L 4.2702 8.4491 124.9988 55.2472 42.7447 176.1084 163 V 4.2913 7.9963 125.1088 60.5858 33.7755 174.9863 164 D 4.3879 8.4790 126.6464 53.9632 42.1149 176.6928 165 R 3.8982 8.8618 125.4025 59.8457 29.8962 178.6328 166 A 4.0721 7.9731 120.2488 55.4404 18.1346 179.8170 167 T 3.8682 7.7454 112.9875 66.6602 68.8783 176.9127 168 C 4.3335 8.4902 120.8724 59.9136 42.9197 175.5027 169 L 3.9891 8.3905 120.7049 58.1269 41.0881 179.6596 170 R 4.1011 7.9217 117.0432 58.5903 30.1232 177.8414 171 S 4.4931 7.9218 112.4254 59.3294 63.7273 173.6452 172 T 4.7540 6.9557 115.0243 60.5183 70.4040 173.4817 173 K 4.1053 8.3563 124.8784 58.9971 33.2798 177.7400 174 F 4.6061 7.7562 117.8185 57.2236 39.4795 175.1105 175 T 4.1609 8.5011 120.3809 63.5107 68.8943 174.4656 176 I 4.5262 8.4120 127.4516 59.9044 38.0245 175.7021 177 T 4.4337 8.2892 116.7231 60.2214 70.2029 175.0526 178 N 4.6189 8.5974 117.5110 54.6535 37.6637 175.1474 179 N 4.9346 8.1809 116.5652 53.4451 38.7682 173.8520 180 M 5.6150 7.9204 116.8776 53.8968 36.4360 174.2906 181 F 5.1108 8.6908 114.1896 55.9565 42.2549 172.4280 182 C 5.5297 8.9659 116.2590 55.5797 39.1655 172.7870 183 A 5.0813 9.2254 122.9263 50.2007 22.7900 176.9670 184 G 4.3052 7.2615 107.5933 45.0086 0.0000 171.4685 184A F 4.8149 8.1870 117.8056 55.6167 40.8797 176.6745 185 H 4.3820 8.9906 122.1810 59.1632 28.6603 176.7381 186 E 4.0966 8.3901 115.6719 56.0620 30.1407 178.0229 187 G 3.7431 8.3417 108.2485 45.5796 0.0000 173.4351 188 G 4.0464 9.0038 107.2836 45.2327 0.0000 173.9179 188A R 4.8585 7.2528 117.1114 54.6371 33.7254 174.0215 189 D 4.6008 8.6478 121.7539 53.7760 45.7471 175.1661 190 S 4.8095 8.7715 117.3080 58.3448 65.1278 172.7910 191 C 4.7089 9.1594 118.4924 55.5833 46.4402 172.3674 192 Q 4.3412 8.5335 119.0381 58.0013 28.5757 177.4194 193 G 4.1677 9.1378 110.0257 45.1870 0.0000 174.6717 194 D 4.5496 8.0997 118.4226 55.3487 41.6750 176.7351 195 S 4.4266 7.9545 115.6768 60.5674 63.5284 174.6774 196 G 4.2968 8.7669 112.2072 46.5332 0.0000 173.8907 197 G 4.3066 7.8338 106.8071 45.4934 0.0000 171.1487 198 P 5.2922 0.0000 0.0000 62.1752 33.8225 174.2349 199 H 5.2501 9.2217 121.7038 54.7996 31.8718 173.5081 200 V 5.0730 9.0264 118.9893 59.8645 35.9319 174.6958 201 T 4.9488 8.7990 119.8581 61.8097 71.3560 172.6906 202 E 4.6563 9.0535 127.7966 55.1248 31.0965 175.6890 203 V 4.1590 8.8158 127.3589 61.5535 32.5087 174.9470 204 E 3.6968 9.7740 130.1301 57.3902 26.6428 176.1661 205 G 3.9218 8.2394 103.8431 45.5139 0.0000 172.4706 206 T 4.4784 7.6689 117.1099 61.6684 71.4530 173.4932 207 S 4.8704 8.2709 122.7614 57.7809 64.6527 173.2843 208 F 4.9606 8.9028 122.1843 55.2215 42.6889 174.1971 209 L 4.5737 8.8156 125.2278 55.3686 41.5317 176.5036 210 T 4.6734 9.2513 115.9460 61.8430 71.4415 173.5823 211 G 4.8421 7.9709 107.8809 46.7315 0.0000 171.8201 212 I 5.1362 8.1510 119.9720 58.9474 40.5983 175.4982 213 I 3.7674 8.8780 128.2436 62.3212 37.4204 174.7329 214 S 4.6275 8.2980 119.6952 58.6408 64.2747 173.5035 215 W 4.7358 7.4264 114.2067 55.9012 31.9316 172.1734 216 G 4.1545 7.9460 105.6691 46.4201 0.0000 172.6416 217 E 4.6440 8.8122 119.4687 54.6187 30.8285 175.2379 217 E 4.6440 8.8122 119.4687 54.6187 30.8285 175.2379 220 C 4.9119 7.9076 114.9949 57.4208 43.1198 173.8484 221 A 4.2642 9.3287 124.6090 53.3074 16.7848 177.0503 221A M 4.5175 7.2582 117.9426 55.4667 32.8613 176.1844 222 K 4.0622 8.3488 124.0193 57.9440 32.7321 177.1742 223 G 3.8749 8.2754 114.5810 45.0465 0.0000 173.0007 224 K 4.4969 7.1218 117.6012 54.5941 35.0841 174.5885 225 Y 4.8664 7.8919 116.9279 56.0893 42.5121 175.2057 226 G 3.7222 8.8733 108.3875 46.1826 0.0000 172.7224 227 I 4.7088 7.6266 124.0650 59.3034 39.7205 174.4145 228 Y 4.9053 8.1242 122.9677 56.0798 42.2237 174.8452 229 T 4.5296 8.8136 120.3224 63.1853 70.2073 174.3154 230 K 4.5823 9.4115 128.3456 56.0682 32.0721 177.4687 231 V 3.9861 8.5599 127.1883 65.6916 31.2277 177.6175 232 S 4.2441 8.2736 113.9011 61.5805 62.4430 176.2398 233 R 3.7290 7.8070 119.1340 57.5844 30.1695 176.5610 234 Y 4.7685 8.0986 115.4597 57.1786 39.8340 177.6009 235 V 3.7792 7.6562 120.3603 66.1592 31.5087 177.5282 236 N 4.3716 8.2484 115.7936 56.0635 38.4728 177.0075 237 W 4.2265 8.3576 129.2922 60.4437 30.9950 177.9403 238 I 3.2730 8.3883 120.0490 64.3456 36.3742 178.6114 239 K 3.8978 7.9674 118.0039 59.3182 31.8807 178.7711 240 E 3.9598 7.9694 118.9218 58.9250 29.6585 178.4718 241 K 3.8684 7.3420 117.1259 57.5204 32.2474 177.6384 242 T 2.6783 6.5338 107.5701 60.3340 68.8355 174.9814 243 K 3.9658 7.5018 121.3227 57.0377 32.5632 176.1755 244 L 4.6595 8.2942 122.7029 53.7017 43.2584 176.6245 245 T 4.1731 8.4136 115.6622 62.2138 67.4357 173.7532 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 V 7.91 4.14 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 0.91 0.00 0.00 0.92 0.00 0.00 17 V 8.09 4.13 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 1.11 0.00 0.00 0.93 0.00 0.00 18 G 8.72 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.48 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 20 E 7.85 4.69 0.00 1.41 1.70 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 2.11 2.06 0.00 21 D 8.62 4.96 0.00 2.63 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 9.08 4.77 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 23 K 9.02 4.44 0.00 1.71 1.67 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.41 7.81 24 P 0.00 4.27 0.00 2.09 1.94 0.00 3.69 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.60 0.00 25 G 8.99 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 26 Q 7.70 3.57 0.00 1.76 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 7.13 0.00 0.00 0.00 0.00 0.00 1.16 1.61 0.00 27 F 7.10 3.55 0.00 2.84 2.42 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 28 P 0.00 4.40 0.00 2.18 2.19 0.00 2.20 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 29 W 6.25 5.22 0.00 3.62 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 30 Q 7.68 4.71 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.74 0.00 0.00 0.00 0.00 0.00 2.17 2.64 0.00 31 V 9.08 5.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.02 0.00 0.00 32 V 8.36 4.79 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 0.39 0.00 0.00 0.74 0.00 0.00 33 L 8.35 5.11 0.00 0.68 1.26 0.77 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.12 5.55 0.00 2.59 2.70 0.00 0.00 6.44 7.15 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 35 G 8.94 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 0.00 0.00 0.00 0.00 36 K 8.75 3.90 0.00 1.70 1.66 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.72 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.44 1.38 7.81 *38 V 7.48 4.56 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 1.27 0.00 0.00 0.88 0.00 0.00 39 D 8.69 4.67 0.00 2.69 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 40 A 8.88 3.79 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.14 4.81 0.00 3.16 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.61 4.94 0.00 2.03 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 43 G 8.70 4.48 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 44 G 8.11 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.91 5.51 0.00 3.85 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 46 I 8.94 4.15 2.05 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 1.21 0.89 1.07 0.00 0.00 47 V 9.07 3.76 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.01 0.00 0.00 48 N 7.68 4.90 0.00 3.02 2.97 0.00 0.00 6.19 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 49 E 8.99 4.04 0.00 2.13 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 0.00 2.43 2.45 0.00 50 K 8.75 4.47 0.00 1.80 1.45 0.00 1.58 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.33 1.51 7.81 51 W 8.29 5.61 0.00 3.29 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 9.07 5.21 1.95 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 1.31 1.07 1.07 0.00 0.00 53 V 8.86 4.90 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 0.91 0.00 0.00 1.14 0.00 0.00 54 T 8.98 4.96 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 1.25 0.00 0.00 55 A 8.44 4.84 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 56 A 8.13 3.81 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.42 4.73 0.00 3.39 3.63 0.00 5.56 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.82 4.75 0.00 3.18 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 59 V 7.45 4.58 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.01 0.00 0.00 60 E 9.03 4.04 0.00 2.05 2.02 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 2.64 2.63 0.00 61 T 7.66 3.70 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 61A G 8.34 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61B V 7.18 4.41 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 0.74 0.00 0.00 0.81 0.00 0.00 62 K 8.40 4.53 0.00 1.85 1.79 0.00 1.51 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.45 7.81 63 I 8.02 4.96 1.94 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 1.56 1.60 1.03 0.00 0.00 64 T 9.11 4.92 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 1.25 0.00 0.00 65 V 8.77 4.77 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 0.95 0.00 0.00 0.93 0.00 0.00 65A V 8.67 4.83 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 0.87 0.00 0.00 0.85 0.00 0.00 66 A 8.31 5.14 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 66 G 8.40 4.78 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 70 E 8.20 4.62 0.00 1.80 1.81 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 1.49 1.90 0.00 71 H 8.89 4.97 0.00 3.22 3.47 0.00 5.67 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.91 5.49 0.00 2.77 2.86 0.00 0.00 7.34 7.47 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 73 I 8.81 3.54 1.86 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.13 0.83 0.00 0.00 74 E 8.43 4.31 0.00 2.06 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 0.00 2.49 2.26 0.00 75 E 7.81 4.63 0.00 2.01 1.88 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 2.24 2.24 0.00 76 T 8.16 4.61 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 0.96 0.00 0.00 77 E 9.26 4.31 0.00 1.93 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 0.00 2.21 2.26 0.00 78 H 8.17 4.02 0.00 3.27 3.36 0.00 5.61 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 79 T 6.99 4.45 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 0.00 0.00 80 E 8.16 4.36 0.00 1.80 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.51 0.00 81 Q 8.92 4.51 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 82 K 8.65 4.76 0.00 1.61 1.70 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.42 7.81 83 R 9.09 4.74 0.00 1.59 1.70 0.00 3.48 0.00 0.00 3.14 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 84 N 8.70 5.00 0.00 2.70 2.69 0.00 0.00 6.73 8.74 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 85 V 7.97 4.52 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 0.82 0.00 0.00 0.95 0.00 0.00 86 I 8.52 4.28 1.82 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.65 0.85 0.00 0.00 87 R 7.57 4.75 0.00 1.83 1.71 0.00 3.23 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 88 I 8.45 5.09 1.94 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 1.40 0.82 1.00 0.00 0.00 89 I 9.30 4.70 2.01 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 1.45 1.02 1.13 0.00 0.00 90 P 0.00 4.89 0.00 2.19 2.10 0.00 3.93 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 91 H 8.82 3.74 0.00 2.46 3.05 0.00 5.60 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.34 4.24 0.00 3.30 3.47 0.00 5.56 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 N 7.72 4.68 0.00 2.35 2.61 0.00 0.00 6.80 8.13 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 94 F 7.97 4.53 0.00 3.08 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 95 N 7.86 3.91 0.00 2.74 2.74 0.00 0.00 6.97 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 96 A 7.87 4.01 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 97 A 7.39 4.66 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.05 3.65 1.77 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 1.29 1.21 0.81 0.00 0.00 98A N 8.32 4.44 0.00 2.59 2.50 0.00 0.00 6.95 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98B T 6.69 3.48 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 99 Y 7.30 3.78 0.00 2.81 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 0.00 100 N 7.71 4.51 0.00 2.65 2.67 0.00 0.00 7.09 7.21 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 0.00 101 H 8.51 4.24 0.00 3.48 3.22 0.00 5.80 0.00 0.00 0.00 0.00 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.03 4.52 0.00 3.14 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.28 4.61 1.51 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 1.46 1.11 -0.00 0.00 0.00 104 A 9.05 5.44 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 9.06 5.43 0.00 1.62 1.75 -0.32 0.49 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 0.00 106 L 9.49 5.23 0.00 1.53 1.53 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.79 3.62 0.00 1.16 1.20 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 1.57 1.47 0.00 108 L 8.12 4.73 0.00 1.39 1.48 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.97 4.36 0.00 2.72 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 0.00 110 E 7.63 4.71 0.00 1.91 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 2.17 2.17 0.00 111 P 0.00 4.61 0.00 2.07 2.05 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 112 L 8.91 4.19 0.00 1.53 1.67 0.96 0.97 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 0.00 113 V 8.66 4.22 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 0.77 0.00 0.00 0.94 0.00 0.00 114 L 8.54 4.42 0.00 1.70 1.71 0.95 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.65 4.82 0.00 2.96 2.96 0.00 0.00 6.86 6.70 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 0.00 116 S 8.67 4.11 0.00 3.49 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 0.00 117 Y 8.63 4.44 0.00 3.00 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 0.00 118 V 7.84 4.50 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 1.06 0.00 0.00 1.06 0.00 0.00 119 T 8.79 5.05 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 1.36 0.00 0.00 120 P 0.00 5.06 0.00 1.96 2.13 0.00 3.72 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 2.07 2.15 0.00 121 I 8.17 3.90 1.49 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 0.90 0.27 0.92 0.00 0.00 122 C 7.70 4.28 0.00 1.68 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 0.00 0.00 0.00 0.00 123 I 8.11 4.71 1.93 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 1.40 0.76 1.01 0.00 0.00 124 A 8.84 4.47 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.21 4.72 0.00 2.97 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 0.00 126 K 8.51 3.77 0.00 1.82 1.82 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.58 7.81 126A E 8.07 3.71 0.00 1.93 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 1.74 2.08 0.00 126B Y 8.53 3.25 0.00 2.93 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 0.00 0.00 0.00 127 T 7.89 3.74 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 1.28 0.00 0.00 128 N 7.88 4.17 0.00 2.74 2.75 0.00 0.00 7.22 7.58 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 0.00 129 I 6.95 3.45 1.30 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.37 0.73 0.00 0.00 130 F 7.61 3.23 0.00 2.84 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 0.00 131 L 7.87 3.82 0.00 1.71 1.56 0.33 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 132 K 7.87 4.07 0.00 1.82 1.83 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.51 7.81 133 F 7.83 4.64 0.00 3.12 3.09 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 0.00 134 G 9.19 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 0.00 0.00 0.00 135 S 7.77 4.88 0.00 3.81 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 0.00 136 G 8.70 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 9.30 5.20 0.00 3.10 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 0.00 138 V 9.08 5.28 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.07 0.00 0.00 139 S 8.05 4.84 0.00 3.37 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.41 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.49 4.54 0.00 3.30 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 0.00 142 G 8.43 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 0.00 143 R 8.64 4.47 0.00 1.68 2.14 0.00 3.15 0.00 0.00 3.35 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.64 0.00 144 V 8.80 4.59 1.59 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 0.84 0.00 0.00 0.69 0.00 0.00 145 F 7.39 4.72 0.00 3.05 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 0.00 143 H 8.83 4.86 0.00 3.11 3.54 0.00 8.53 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 9.06 4.79 0.00 1.74 1.64 0.00 0.95 0.00 0.00 1.74 0.00 0.00 2.13 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.22 7.81 145 G 7.42 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 0.00 0.00 0.00 150 R 8.49 4.26 0.00 1.90 2.02 0.00 3.11 0.00 0.00 3.31 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 151 S 8.57 4.77 0.00 3.84 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 0.00 152 A 8.18 4.42 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 0.00 153 L 8.70 4.44 0.00 1.67 1.77 1.00 0.81 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 0.00 154 V 7.67 4.83 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 0.69 0.00 0.00 0.97 0.00 0.00 155 L 8.49 2.83 0.00 1.28 1.37 -0.62 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 8.23 5.26 0.00 1.85 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.46 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 157 Y 8.41 5.26 0.00 2.86 2.55 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 0.00 158 L 8.90 4.68 0.00 1.67 1.48 0.90 0.87 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 0.00 159 R 8.58 4.24 0.00 1.22 1.72 0.00 3.24 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.26 0.00 160 V 8.55 4.39 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 0.91 0.00 0.00 0.86 0.00 0.00 161 P 0.00 4.72 0.00 1.86 1.91 0.00 2.58 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.16 0.00 162 L 8.45 4.27 0.00 1.50 1.50 0.64 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 163 V 8.00 4.29 1.83 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 0.21 0.00 0.00 0.41 0.00 0.00 164 D 8.48 4.39 0.00 2.67 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 0.00 165 R 8.86 3.90 0.00 1.91 1.93 0.00 3.26 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 166 A 7.97 4.07 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 0.00 167 T 7.75 3.87 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 1.26 0.00 0.00 168 C 8.49 4.33 0.00 3.05 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 0.00 169 L 8.39 3.99 0.00 1.99 1.77 1.01 0.85 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 0.00 170 R 7.92 4.10 0.00 2.10 2.11 0.00 3.27 0.00 0.00 3.30 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 171 S 7.92 4.49 0.00 4.40 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 0.00 172 T 6.96 4.75 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 1.50 0.00 0.00 173 K 8.36 4.11 0.00 1.69 1.71 0.00 1.26 0.00 0.00 0.86 0.00 0.00 2.48 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.33 0.58 7.81 174 F 7.76 4.61 0.00 3.43 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 0.00 175 T 8.50 4.16 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 1.27 0.00 0.00 176 I 8.41 4.53 1.99 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.96 1.02 0.00 0.00 177 T 8.29 4.43 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 N 8.60 4.62 0.00 2.84 3.00 0.00 0.00 5.92 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 0.00 179 N 8.18 4.93 0.00 3.05 3.10 0.00 0.00 6.63 6.96 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 0.00 180 M 7.92 5.61 0.00 1.95 2.15 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.69 0.00 181 F 8.69 5.11 0.00 3.03 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 0.00 182 C 8.97 5.53 0.00 2.82 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 0.00 183 A 9.23 5.08 1.20 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 0.00 184 G 7.26 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A F 8.19 4.81 0.00 3.17 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 0.00 185 H 8.99 4.38 0.00 3.31 3.46 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.39 4.10 0.00 2.00 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 2.38 2.29 0.00 187 G 8.34 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 0.00 188 G 9.00 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 188A R 7.25 4.86 0.00 1.53 1.80 0.00 2.94 0.00 0.00 2.87 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.36 0.00 189 D 8.65 4.60 0.00 2.80 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 0.00 190 S 8.77 4.81 0.00 3.90 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 0.00 191 C 9.16 4.71 0.00 2.92 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 0.00 192 Q 8.53 4.34 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.38 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 193 G 9.14 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.10 4.55 0.00 2.86 2.72 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 0.00 195 S 7.95 4.43 0.00 3.90 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.77 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.83 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.29 0.00 2.28 2.34 0.00 3.86 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 199 H 9.22 5.25 0.00 3.23 3.45 0.00 5.52 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 9.03 5.07 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 0.70 0.00 0.00 1.27 0.00 0.00 201 T 8.80 4.95 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 1.34 0.00 0.00 202 E 9.05 4.66 0.00 2.03 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 0.00 2.26 2.29 0.00 203 V 8.82 4.16 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 0.87 0.00 0.00 0.08 0.00 0.00 204 E 9.77 3.70 0.00 2.14 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 2.23 2.29 0.00 205 G 8.24 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 0.00 206 T 7.67 4.48 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 0.82 0.00 0.00 207 S 8.27 4.87 0.00 2.87 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 0.00 208 F 8.90 4.96 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 0.00 209 L 8.82 4.57 0.00 1.62 1.66 1.08 1.26 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 0.00 210 T 9.25 4.67 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 1.32 0.00 0.00 211 G 7.97 4.84 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 0.00 0.00 0.00 212 I 8.15 5.14 1.91 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 1.43 0.89 0.99 0.00 0.00 213 I 8.88 3.77 2.02 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 1.44 1.07 0.84 0.00 0.00 214 S 8.30 4.63 0.00 3.84 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.43 4.74 0.00 2.97 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 7.95 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 0.00 217 E 8.81 4.64 0.00 2.03 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 2.61 2.69 0.00 217 E 8.81 4.64 0.00 2.03 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 2.61 2.69 0.00 220 C 7.91 4.91 0.00 2.97 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 0.00 221 A 9.33 4.26 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 221A M 7.26 4.52 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 222 K 8.35 4.06 0.00 1.70 1.70 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.62 7.81 223 G 8.28 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 0.00 224 K 7.12 4.50 0.00 1.78 1.60 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.29 1.48 7.81 225 Y 7.89 4.87 0.00 2.78 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 0.00 226 G 8.87 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 I 7.63 4.71 0.56 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.12 -0.36 0.51 0.00 0.00 228 Y 8.12 4.91 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.81 4.53 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 1.20 0.00 0.00 230 K 9.41 4.58 0.00 2.06 1.92 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.54 1.62 7.81 231 V 8.56 3.99 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 1.18 0.00 0.00 1.12 0.00 0.00 232 S 8.27 4.24 0.00 4.18 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 0.00 233 R 7.81 3.73 0.00 1.04 1.50 0.00 3.16 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 234 Y 8.10 4.77 0.00 3.09 3.16 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 0.00 235 V 7.66 3.78 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 1.14 0.00 0.00 236 N 8.25 4.37 0.00 2.94 2.92 0.00 0.00 6.78 7.68 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 0.00 237 W 8.36 4.23 0.00 3.49 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.39 3.27 2.07 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 1.71 1.48 0.86 0.00 0.00 239 K 7.97 3.90 0.00 1.83 1.84 0.00 1.73 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.63 7.81 240 E 7.97 3.96 0.00 1.93 2.02 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 2.20 2.29 0.00 241 K 7.34 3.87 0.00 0.87 1.08 0.00 1.52 0.00 0.00 1.51 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.92 0.42 7.81 242 T 6.53 2.68 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 243 K 7.50 3.97 0.00 1.70 1.76 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.62 7.81 244 L 8.29 4.66 0.00 1.67 1.64 0.99 1.12 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 0.00 245 T 8.41 4.17 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 1.24 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.