NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 V 4.0521 8.0549 120.3854 62.7133 32.3418 174.5065 8 K 3.6674 8.7166 125.4084 55.4771 32.2395 178.1791 9 E 4.4707 8.5992 122.1983 61.5145 32.4262 177.5720 10 L 4.2846 7.5749 116.8765 57.0144 42.4637 179.0386 11 L 4.0329 7.9719 116.5927 57.7061 41.2042 177.8339 12 E 3.8141 8.4690 119.8468 59.2542 29.7009 178.1634 13 A 3.8198 7.5608 121.8191 52.4185 18.2117 179.4503 14 G 3.7131 8.2963 111.9797 47.9781 0.0000 175.3740 15 V 5.0545 6.3465 127.9664 62.0761 33.1185 170.8599 16 H 5.5337 7.3290 112.4919 55.3532 33.1279 173.6878 17 F 5.1624 8.1230 116.0070 57.2819 38.8982 177.1055 18 G 3.7629 8.2248 104.6267 45.2333 0.0000 172.2789 19 H 4.7030 8.2519 126.8377 54.3124 33.6086 174.1181 20 E 3.4242 7.4203 118.4024 56.1205 28.6779 175.1710 21 R 4.8996 8.1540 121.7952 55.2807 31.5980 175.7656 22 K 4.1415 8.6996 126.9449 57.8305 31.9987 177.1539 23 R 4.5570 7.7027 117.5299 55.3742 30.5643 175.1661 24 W 4.6590 8.5412 124.3887 56.0640 27.0926 179.4403 25 N 4.5019 8.2103 132.7850 52.3917 39.5219 171.7859 26 P 2.9700 0.0000 0.0000 63.3290 31.5850 177.8936 27 K 3.8852 8.2634 121.6501 59.6555 32.5129 178.0163 28 F 4.2033 8.1733 117.6269 58.5121 38.9956 176.4165 29 A 4.4389 7.4574 123.4845 55.1109 18.2275 178.9861 30 R 4.3434 7.6129 110.3190 56.9413 29.7685 176.1910 31 Y 4.9209 7.5420 116.3082 58.1838 38.8263 175.0456 32 I 5.0296 7.8582 118.8327 59.8428 40.2576 174.7187 33 Y 4.5673 9.0374 123.1271 58.2581 40.8584 175.2858 34 A 4.0658 6.8582 120.2255 52.2686 21.6830 174.8401 35 E 4.7466 8.1316 118.7182 53.8039 29.1877 175.3701 36 R 4.1047 7.4883 120.9387 56.4742 31.5887 177.2474 37 N 4.1562 9.7145 116.3637 53.7849 36.4570 175.0064 38 G 3.9977 8.2151 107.1789 45.0762 0.0000 174.0461 39 I 4.2216 7.4952 120.7792 60.5687 38.8768 175.5733 40 H 4.3678 9.4087 123.9306 56.1861 30.1681 174.7103 41 I 4.2332 8.8594 123.4914 59.3904 38.7214 174.9413 42 I 4.3740 8.3153 128.1613 60.6215 39.1686 175.5457 43 D 4.4380 8.8909 128.3174 53.7938 39.6915 176.3881 44 L 3.9235 8.3099 126.2244 60.1889 40.1089 178.5047 45 Q 3.8625 8.1179 120.2923 57.6729 28.9572 178.1967 46 K 4.0671 8.1323 120.7707 59.8322 32.1845 179.0141 47 T 3.7791 7.4905 114.7904 66.4926 68.5315 176.1125 48 M 4.1903 9.1354 121.3803 58.4975 32.0522 178.0632 49 E 3.9625 8.1144 118.3404 59.5759 29.6205 178.9476 50 E 3.9911 8.0118 117.3547 58.3736 29.4191 179.4605 51 L 4.2742 8.0499 120.3856 57.8825 41.7864 179.0733 52 E 4.1393 8.2372 117.1227 59.3607 29.2441 178.7241 53 R 3.9870 7.7136 119.3006 59.8178 29.8456 178.6349 54 T 4.1515 7.9405 115.3379 66.4725 68.0528 177.0842 55 F 3.9920 8.5568 119.8097 60.4251 38.9303 177.4953 56 R 4.0256 9.0766 118.9800 59.6861 29.7927 178.4862 57 F 3.9695 8.0232 119.3201 61.4102 39.4857 177.0144 58 I 3.4129 8.7429 120.4003 64.6032 36.6412 177.6497 59 E 3.8478 9.3845 120.3157 59.2912 29.4945 178.1226 60 D 4.2032 8.6029 118.2815 57.4022 41.2837 178.2685 61 L 3.6827 8.3785 121.6165 57.8327 41.8403 178.3423 62 A 3.9224 7.7225 121.5426 54.9522 18.1711 179.3105 63 M 4.1925 9.0849 116.8185 57.7387 31.2271 177.8670 64 R 4.3435 7.4160 115.5351 55.6286 30.1228 176.1032 65 G 3.5931 8.3911 106.9937 46.8103 0.0000 174.6501 66 G 4.3631 7.9335 108.1941 44.4625 0.0000 174.9408 67 T 4.2168 8.6096 117.8952 61.5625 70.1008 173.2504 68 I 4.8294 8.3411 126.3864 58.3635 39.7229 174.9591 69 L 4.6302 8.6059 129.2952 54.8796 43.9630 175.4349 70 F 5.1024 9.5596 124.8745 55.9408 41.0817 174.9697 71 V 4.1817 8.5964 126.2130 61.4533 31.7315 175.9167 72 G 4.3666 8.3899 117.7960 45.3315 0.0000 172.5148 73 T 4.8579 8.9589 109.8607 62.8864 69.9892 176.2291 74 K 4.2100 8.0208 123.0594 56.3576 33.7271 177.0766 75 K 4.3177 8.3826 125.2534 56.4682 32.0275 177.1704 76 Q 4.5036 7.6668 111.4518 55.1464 31.2268 175.1652 77 A 5.1371 7.2204 127.3541 51.5495 21.7156 179.0052 78 Q 4.2262 6.8182 121.9361 59.5408 28.8367 177.4902 79 D 4.2816 7.9978 119.1798 57.4116 41.3102 178.3962 80 I 3.8617 7.8932 118.3950 63.8011 37.6179 177.4523 81 V 3.6386 7.7390 119.2154 65.5583 31.5306 177.3909 82 R 3.1856 7.5296 117.7437 60.5112 29.7473 177.2614 83 M 4.1451 8.6994 118.7542 57.4071 31.6969 177.7820 84 E 3.8428 8.1047 122.0234 59.4826 30.2054 179.2298 85 A 3.7430 8.6504 121.2398 54.1455 19.1635 178.8240 86 E 4.2595 8.4809 115.3622 57.9746 29.7975 178.1247 87 R 4.3430 8.0229 117.6395 56.3750 30.4902 175.8448 88 A 4.4951 7.2232 117.6001 51.1659 20.6463 176.5158 89 G 3.8403 8.2952 103.6274 46.7070 0.0000 173.6075 90 M 4.6249 7.6184 117.6903 52.7024 34.2485 174.4042 91 P 5.1945 0.0000 0.0000 63.1832 32.9671 174.7062 92 Y 5.4514 7.9043 118.1633 57.3330 40.5044 173.3661 93 V 4.8960 8.7396 111.4897 60.4134 35.9546 175.9899 94 N 5.0305 9.1247 120.1187 53.7567 41.8305 174.6448 95 Q 4.5288 7.7921 123.0903 55.9112 28.3744 176.6162 96 R 4.2615 8.8134 125.9645 56.3736 30.2043 177.1009 97 W 4.5028 8.8868 134.9733 56.9129 27.9282 174.7032 98 L 3.4981 7.4222 122.4956 53.1258 42.5349 177.2897 99 G 3.6488 8.4378 110.5447 47.7708 0.0000 172.0140 100 G 3.3189 8.8484 120.5703 46.1717 0.0000 175.4362 101 M 3.0460 6.0516 113.9466 57.0548 32.7452 177.6571 102 L 4.4782 8.4554 125.3017 57.6747 42.6031 177.6652 103 T 4.2262 8.8526 116.8882 65.1023 68.8783 176.4084 104 N 4.7985 7.4191 121.9199 52.6254 39.1397 177.1681 105 F 3.7445 10.5467 114.2837 61.4101 38.8095 177.4614 106 K 4.8440 8.3031 117.1211 59.0741 34.6418 176.7488 107 T 3.9314 7.4605 115.2037 66.8334 68.4887 177.0773 108 I 3.7742 8.0164 121.8070 63.8262 36.7182 177.7495 109 S 4.3538 7.2018 114.6323 59.0865 62.4475 174.9394 110 Q 4.5403 7.6775 120.3681 56.0120 28.9837 176.8749 111 R 4.3103 7.7203 120.7301 58.0290 31.1553 178.5464 112 V 3.6804 7.7346 117.5289 66.2092 31.3651 177.4495 113 H 4.4460 7.7673 118.8809 58.8097 30.0357 176.9580 114 R 4.3850 7.5483 118.6070 57.4512 29.7457 177.4830 115 L 4.2202 7.7150 120.0031 58.3853 41.9716 178.1025 116 E 4.1203 8.2411 117.3055 59.2178 28.2859 178.9879 117 E 3.9509 8.3836 120.1295 59.5865 29.6115 179.3594 118 L 4.3107 7.5824 117.4610 57.5695 41.4328 178.7998 119 E 3.9295 8.3930 118.9031 59.8999 29.3952 178.5051 120 A 4.0872 7.7035 120.0240 54.7439 18.5522 178.6776 121 L 4.6255 7.3877 120.3813 57.9395 42.2193 178.3464 122 F 3.9011 8.4802 117.2913 60.9209 39.2032 174.9229 123 A 4.3070 8.4038 133.2062 52.6933 18.5260 177.0037 124 S 5.0650 7.7984 120.1443 58.4634 64.8288 175.9213 125 P 4.4567 0.0000 0.0000 63.5109 30.9900 178.1223 126 E 4.2319 8.2375 121.3398 59.5607 29.4582 179.1293 127 I 3.5580 8.2776 118.4679 64.1796 37.1893 179.2842 128 E 3.5595 8.1391 119.8680 57.5405 31.9907 176.6517 129 E 4.5799 7.6815 114.8242 53.9285 34.6687 172.6199 130 R 3.8289 8.8911 127.1305 54.7332 31.4427 174.5480 131 P 4.2289 0.0000 0.0000 63.0810 31.8983 176.6580 132 K 3.7687 9.0438 122.8343 59.9535 31.9107 178.7965 133 K 3.9897 8.0330 117.7600 58.9908 32.1711 177.9248 134 E 4.8435 8.0581 117.5258 56.5829 30.5795 177.0210 135 Q 4.3214 7.7132 116.6441 57.2192 31.7649 177.7783 136 V 3.8759 8.2686 113.7162 63.8379 31.7243 176.8470 137 R 4.3109 8.0608 117.8719 59.3769 30.5721 177.8709 138 L 4.0029 7.8096 118.2211 57.9162 41.6405 179.5996 139 K 4.0701 8.1471 118.3995 59.6483 32.0982 178.8994 140 H 4.2638 8.1591 118.2142 59.2273 29.6897 176.8148 141 E 4.0425 8.4549 121.4932 59.0580 29.3944 178.5644 142 L 4.0047 8.3287 120.6271 58.4852 42.2465 178.1175 143 E 3.4872 9.0040 113.1117 60.3884 29.3989 179.3947 144 R 3.9608 7.0331 117.2808 59.7299 29.8773 178.5370 145 L 3.9373 7.4744 120.0774 58.3564 42.3675 178.8495 146 Q 4.1036 8.9169 117.8531 58.9828 28.5007 178.6210 147 K 3.8179 7.7822 119.5637 59.9825 32.3273 177.4822 148 Y 4.2948 8.3857 115.1467 59.0717 38.3413 176.7553 149 L 4.8167 7.2940 117.5094 53.7201 43.0099 178.8302 150 S 3.3169 7.9330 107.7945 59.4047 63.4381 175.6937 151 G 2.4314 8.8827 119.9860 47.0904 0.0000 175.3718 152 F 4.1191 8.9354 124.1292 60.4467 39.7402 177.6312 153 R 4.0001 7.8372 116.0967 59.0729 29.3309 177.8111 154 L 3.9958 7.9508 117.6723 57.5386 41.6964 177.3836 155 L 4.1242 7.0677 118.2947 55.1357 42.4024 176.5580 156 K 4.6468 8.1558 122.3204 55.2935 33.9482 176.0553 157 R 3.7046 8.4047 113.5262 56.8411 31.5473 174.9249 158 L 3.3454 7.0253 124.0971 53.0156 39.1373 174.6779 159 P 4.4453 0.0000 0.0000 62.8735 31.5454 175.3828 160 D 4.8613 8.2029 115.3256 53.6752 42.3832 175.3886 161 A 5.5711 7.1909 120.1438 51.6764 22.3990 175.2554 162 I 4.6399 7.6644 112.8018 59.0164 41.0166 174.2046 163 F 4.8413 9.1910 130.3293 57.2987 40.0445 174.3197 164 V 4.3476 8.8076 129.2208 61.3282 32.1192 176.9752 165 V 3.5827 8.7626 122.7584 62.8428 31.9624 176.0905 166 D 4.7898 7.6208 117.7542 52.7221 45.3799 173.3196 167 P 4.2496 0.0000 0.0000 64.4824 29.6721 180.1451 168 T 3.2908 7.8324 102.7701 63.0955 71.8818 174.7993 169 K 3.8567 7.9078 124.1445 58.4067 32.4844 178.1797 170 E 4.5039 8.3911 117.8842 55.6941 28.9416 176.8302 171 A 4.4812 7.4767 117.2467 52.1548 20.2897 178.2787 172 I 3.8429 7.3581 120.1569 64.4443 37.4491 177.8657 173 A 2.0000 7.0054 120.8729 54.8807 18.0509 179.6969 174 V 3.2824 6.7288 116.1214 66.9750 31.5278 177.2506 175 R 4.0287 8.2130 118.5918 57.5400 29.5389 178.5793 176 E 3.8455 7.8454 120.4072 59.4175 30.4362 179.3169 177 A 4.1252 8.2636 121.1964 55.0155 18.4880 179.3696 178 R 3.7448 7.9441 116.3212 59.4940 29.9996 178.4821 179 K 3.9171 8.5615 117.5076 57.8056 31.9352 176.8347 180 L 4.6471 8.1029 119.2357 54.8424 42.4579 176.6428 181 F 3.8441 7.5622 114.1073 58.3625 37.1936 175.3969 182 I 4.2441 7.3293 120.9782 59.9342 37.2901 174.4211 183 P 5.3303 0.0000 0.0000 62.5484 32.7370 175.4703 184 V 4.7405 8.5772 121.7269 61.1685 34.5920 174.0688 185 I 5.2789 8.5097 127.2829 58.8615 40.5207 174.4154 186 A 4.0860 7.9316 124.0918 50.8135 22.2212 175.0571 187 L 4.4081 8.2310 123.4995 55.3361 42.9968 175.4598 188 A 5.3940 9.8423 131.5291 52.2873 22.3097 174.1476 189 D 4.7520 8.0306 110.7754 53.4971 42.5865 177.0269 190 T 3.3278 7.6096 108.5973 64.8752 69.1082 174.7446 191 D 4.3866 8.3714 121.9827 56.4290 41.4176 175.5690 192 S 4.9564 6.9107 111.6236 56.2518 65.3478 172.3799 193 D 5.0417 8.1475 118.1534 51.2243 42.9264 174.2269 194 P 4.8675 0.0000 0.0000 60.8265 30.7941 178.7301 195 D 3.9553 9.0872 109.9449 56.4691 40.3319 174.7759 196 L 4.4220 9.1704 116.3375 55.3909 40.3987 176.1514 197 V 4.2921 7.1551 119.1427 61.5797 33.5466 174.9670 198 D 4.1940 8.8367 127.3740 57.2787 41.7616 175.9534 199 Y 4.7119 8.2814 122.4496 55.9600 39.5501 174.7984 200 I 4.1454 8.2451 124.6777 61.1008 38.5601 176.5317 201 I 4.7668 8.2495 125.0155 58.3520 37.6885 171.2652 202 P 4.7662 0.0000 0.0000 63.1674 31.7955 176.9770 203 G 4.1567 8.4843 112.4317 45.4362 0.0000 171.2689 204 N 4.4113 8.7943 121.0643 54.0217 38.5066 173.7752 205 D 4.8123 8.5660 124.1386 53.3553 39.8574 176.6428 206 D 4.7045 8.0981 120.1151 55.4634 43.1666 176.6696 207 A 4.3154 7.7807 122.4461 51.3353 19.3859 178.0918 208 I 3.8874 8.4138 123.7747 63.3203 36.7352 178.5641 209 R 3.8400 7.8550 119.4831 59.4843 29.9305 178.8746 210 S 4.4092 8.0631 114.1335 62.4955 62.9749 175.9724 211 I 3.5945 8.1306 120.3774 64.8578 36.8198 177.4313 212 Q 3.8267 8.4895 119.4261 59.6528 29.0317 179.2689 213 L 3.9318 7.7083 120.3805 59.3793 42.0301 178.6198 214 I 4.0320 8.7749 120.5870 63.5587 36.7961 178.0181 215 L 4.0248 9.2685 118.3495 58.6445 41.6672 179.7951 216 S 4.9475 8.0739 116.2441 61.9067 63.0869 176.8040 217 R 4.9006 8.2174 121.3858 58.9350 29.5562 178.9207 218 A 4.6748 8.5428 120.3970 55.4512 18.3571 179.6671 219 V 3.5762 8.6888 117.2061 66.1691 31.3452 178.2065 220 D 4.4275 8.0991 118.6530 57.3361 40.6815 178.4346 221 L 4.1521 7.4390 116.4282 56.8834 41.8121 179.2247 222 I 3.9745 7.4190 119.8032 64.1271 37.3436 178.1453 223 I 3.8060 7.5745 113.3663 63.8663 37.4011 177.7585 224 Q 3.9144 8.7375 121.1022 57.8452 29.9701 176.6647 225 A 4.6690 7.2182 123.4015 50.0872 18.2737 175.6598 226 R 4.4865 7.7021 120.0340 55.9858 37.7400 176.6040 227 G 4.1873 7.9998 107.2643 44.0002 0.0000 173.2589 228 G 4.2751 7.7033 123.2173 45.2326 0.0000 170.4003 229 V 3.6602 7.2286 120.8963 63.8440 32.4599 175.2075 230 V 4.5258 7.8747 117.0768 59.2950 35.4122 174.9500 231 E 4.2791 8.3679 119.7271 54.3610 30.9486 173.9062 232 P 4.2401 0.0000 0.0000 62.9265 30.7130 176.5271 233 S 4.2472 8.6365 118.2906 56.9127 63.0296 171.4529 234 P 4.1944 0.0000 0.0000 62.7921 29.5464 174.2501 235 S 4.5503 8.1491 115.0469 60.1967 65.7737 175.5500 236 Y 4.2862 7.8408 120.4328 56.8699 35.4911 176.1243 237 A 4.4886 7.8753 120.3697 51.5421 18.8275 178.3068 238 L 4.9569 8.1439 128.8389 57.1926 39.4280 175.8035 239 V 3.0877 6.9103 116.1618 65.1858 29.1295 173.7729 240 Q 3.8788 8.6121 133.5738 56.0060 25.7211 174.4530 *241 E 4.1515 8.5422 120.6138 56.6314 30.4602 178.1128 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 7 V 8.05 4.05 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 0.98 0.00 0.00 0.92 0.00 0.00 8 K 8.72 3.67 0.00 1.86 1.53 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.41 7.81 9 E 8.60 4.47 0.00 1.98 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 0.00 2.26 2.25 0.00 10 L 7.57 4.28 0.00 1.68 1.67 0.91 0.59 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 11 L 7.97 4.03 0.00 1.85 1.72 0.94 0.93 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 12 E 8.47 3.81 0.00 1.93 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 2.28 2.36 0.00 13 A 7.56 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.30 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 V 6.35 5.05 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 0.64 0.00 0.00 0.76 0.00 0.00 16 H 7.33 5.53 0.00 3.19 3.29 0.00 6.05 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 F 8.12 5.16 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 18 G 8.22 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 19 H 8.25 4.70 0.00 3.14 3.17 0.00 5.73 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 20 E 7.42 3.42 0.00 2.20 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.32 0.00 21 R 8.15 4.90 0.00 2.01 1.93 0.00 3.15 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.61 0.00 22 K 8.70 4.14 0.00 2.00 2.05 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.50 7.81 23 R 7.70 4.56 0.00 1.83 2.07 0.00 3.43 0.00 0.00 3.30 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 24 W 8.54 4.66 0.00 3.53 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.21 4.50 0.00 2.63 2.78 0.00 0.00 6.62 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 2.97 0.00 1.85 1.31 0.00 3.11 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 27 K 8.26 3.89 0.00 1.67 1.89 0.00 1.54 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.28 7.81 28 F 8.17 4.20 0.00 2.99 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 29 A 7.46 4.44 1.66 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 30 R 7.61 4.34 0.00 1.94 1.98 0.00 2.91 0.00 0.00 3.10 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.15 0.00 31 Y 7.54 4.92 0.00 1.88 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 32 I 7.86 5.03 2.05 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.71 0.95 0.00 0.00 33 Y 9.04 4.57 0.00 2.91 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 34 A 6.86 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.13 4.75 0.00 1.57 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 36 R 7.49 4.10 0.00 1.88 1.77 0.00 3.29 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 37 N 9.71 4.16 0.00 2.83 2.89 0.00 0.00 7.17 7.65 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 38 G 8.22 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 39 I 7.50 4.22 1.92 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 1.22 1.12 0.95 0.00 0.00 40 H 9.41 4.37 0.00 3.53 3.31 0.00 5.77 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 41 I 8.86 4.23 2.08 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 1.06 0.69 1.11 0.00 0.00 42 I 8.32 4.37 2.13 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.08 1.11 0.00 0.00 43 D 8.89 4.44 0.00 2.89 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 44 L 8.31 3.92 0.00 1.79 1.86 0.61 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.12 3.86 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 46 K 8.13 4.07 0.00 2.02 1.78 0.00 1.76 0.00 0.00 1.85 0.00 0.00 3.11 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.27 1.35 7.81 47 T 7.49 3.78 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 1.27 0.00 0.00 48 M 9.14 4.19 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 49 E 8.11 3.96 0.00 2.21 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 2.40 2.39 0.00 50 E 8.01 3.99 0.00 2.04 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 2.21 2.21 0.00 51 L 8.05 4.27 0.00 1.96 1.86 0.97 1.18 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 52 E 8.24 4.14 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.43 0.00 53 R 7.71 3.99 0.00 2.16 2.27 0.00 3.29 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.89 0.00 54 T 7.94 4.15 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 55 F 8.56 3.99 0.00 3.39 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 56 R 9.08 4.03 0.00 2.07 2.13 0.00 3.36 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 57 F 8.02 3.97 0.00 2.98 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 58 I 8.74 3.41 1.86 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.33 0.61 0.00 0.00 59 E 9.38 3.85 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 60 D 8.60 4.20 0.00 2.79 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 61 L 8.38 3.68 0.00 0.41 0.87 0.74 0.50 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 62 A 7.72 3.92 1.31 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 63 M 9.08 4.19 0.00 1.98 2.20 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 2.55 2.66 0.00 64 R 7.42 4.34 0.00 1.91 2.01 0.00 3.02 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.59 0.00 65 G 8.39 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 66 G 7.93 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 0.00 0.00 0.00 67 T 8.61 4.22 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 1.20 0.00 0.00 68 I 8.34 4.83 2.04 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 1.31 1.59 0.42 0.00 0.00 69 L 8.61 4.63 0.00 1.81 1.62 1.24 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 70 F 9.56 5.10 0.00 3.37 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 71 V 8.60 4.18 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 0.84 0.00 0.00 0.84 0.00 0.00 72 G 8.39 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.96 4.86 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 1.45 0.00 0.00 74 K 8.02 4.21 0.00 1.96 1.98 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.42 7.81 75 K 8.38 4.32 0.00 1.74 1.82 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.66 1.39 7.81 76 Q 7.67 4.50 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.44 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 77 A 7.22 5.14 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 6.82 4.23 0.00 2.28 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.98 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 79 D 8.00 4.28 0.00 2.69 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 80 I 7.89 3.86 1.85 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 1.54 1.33 0.91 0.00 0.00 81 V 7.74 3.64 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 0.89 0.00 0.00 1.03 0.00 0.00 82 R 7.53 3.19 0.00 1.55 1.96 0.00 3.21 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.87 0.00 83 M 8.70 4.15 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.71 0.00 84 E 8.10 3.84 0.00 2.10 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 2.41 2.60 0.00 85 A 8.65 3.74 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 86 E 8.48 4.26 0.00 2.11 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 2.50 2.88 0.00 87 R 8.02 4.34 0.00 1.85 2.08 0.00 3.44 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 0.00 88 A 7.22 4.50 1.16 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 89 G 8.30 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 0.00 0.00 0.00 90 M 7.62 4.62 0.00 2.56 1.87 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.53 0.00 91 P 0.00 5.19 0.00 2.19 1.94 0.00 4.27 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 2.16 1.92 0.00 92 Y 7.90 5.45 0.00 3.12 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 93 V 8.74 4.90 2.33 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 1.07 0.00 0.00 1.26 0.00 0.00 94 N 9.12 5.03 0.00 2.69 2.76 0.00 0.00 7.12 7.30 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 95 Q 7.79 4.53 0.00 2.16 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.03 0.00 0.00 0.00 0.00 0.00 2.21 1.69 0.00 96 R 8.81 4.26 0.00 1.87 1.95 0.00 3.50 0.00 0.00 3.57 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 97 W 8.89 4.50 0.00 3.32 3.30 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 98 L 7.42 3.50 0.00 1.28 1.24 0.58 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.44 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.85 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 0.00 0.00 0.00 101 M 6.05 3.05 0.00 2.15 1.58 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.94 0.00 102 L 8.46 4.48 0.00 2.16 1.95 1.72 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 103 T 8.85 4.23 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 1.27 0.00 0.00 104 N 7.42 4.80 0.00 2.83 2.74 0.00 0.00 7.02 7.59 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 0.00 105 F 10.55 3.74 0.00 3.36 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 0.00 106 K 8.30 4.84 0.00 2.03 1.88 0.00 1.82 0.00 0.00 1.86 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.64 7.81 107 T 7.46 3.93 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 108 I 8.02 3.77 1.72 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.01 0.64 0.00 0.00 109 S 7.20 4.35 0.00 3.84 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 0.00 110 Q 7.68 4.54 0.00 2.35 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.61 0.00 0.00 0.00 0.00 0.00 2.28 2.56 0.00 111 R 7.72 4.31 0.00 1.93 1.90 0.00 3.23 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 112 V 7.73 3.68 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.21 0.00 0.00 113 H 7.77 4.45 0.00 3.42 3.30 0.00 5.88 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.55 4.39 0.00 2.13 2.00 0.00 3.30 0.00 0.00 3.32 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 115 L 7.71 4.22 0.00 1.99 1.80 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.24 4.12 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.32 0.00 117 E 8.38 3.95 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.53 0.00 118 L 7.58 4.31 0.00 1.93 1.77 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.39 3.93 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 120 A 7.70 4.09 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 0.00 121 L 7.39 4.63 0.00 1.91 1.95 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 122 F 8.48 3.90 0.00 3.10 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 0.00 123 A 8.40 4.31 1.46 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 0.00 0.00 124 S 7.80 5.06 0.00 4.04 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 0.00 125 P 0.00 4.46 0.00 2.25 2.24 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 126 E 8.24 4.23 0.00 2.23 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 2.33 2.29 0.00 127 I 8.28 3.56 1.82 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 1.57 0.61 0.84 0.00 0.00 128 E 8.14 3.56 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 129 E 7.68 4.58 0.00 1.93 1.65 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 2.20 2.32 0.00 130 R 8.89 3.83 0.00 1.95 2.19 0.00 3.39 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 131 P 0.00 4.23 0.00 2.21 2.20 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 132 K 9.04 3.77 0.00 1.83 1.87 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.55 7.81 133 K 8.03 3.99 0.00 1.83 1.84 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.52 1.53 7.81 134 E 8.06 4.84 0.00 2.00 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 2.30 2.48 0.00 135 Q 7.71 4.32 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 136 V 8.27 3.88 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 0.77 0.00 0.00 0.95 0.00 0.00 137 R 8.06 4.31 0.00 2.08 1.87 0.00 3.42 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 2.10 0.00 138 L 7.81 4.00 0.00 1.86 1.73 0.95 1.04 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 0.00 139 K 8.15 4.07 0.00 1.83 1.93 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.80 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.46 1.59 7.81 140 H 8.16 4.26 0.00 3.43 3.49 0.00 5.87 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 0.00 141 E 8.45 4.04 0.00 2.09 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 2.31 2.31 0.00 142 L 8.33 4.00 0.00 1.87 1.93 0.94 1.01 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 0.00 143 E 9.00 3.49 0.00 2.18 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 2.68 2.64 0.00 144 R 7.03 3.96 0.00 2.40 2.27 0.00 2.82 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 145 L 7.47 3.94 0.00 1.92 1.86 0.97 1.03 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 0.00 146 Q 8.92 4.10 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.39 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 147 K 7.78 3.82 0.00 1.66 1.89 0.00 1.65 0.00 0.00 1.46 0.00 0.00 2.53 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.68 1.25 7.81 148 Y 8.39 4.29 0.00 2.93 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 0.00 149 L 7.29 4.82 0.00 1.79 1.89 0.94 0.23 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 0.00 150 S 7.93 3.32 0.00 4.24 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 0.00 151 G 8.88 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 F 8.94 4.12 0.00 3.17 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 0.00 153 R 7.84 4.00 0.00 2.00 2.11 0.00 3.12 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.57 0.00 154 L 7.95 4.00 0.00 1.55 1.71 0.79 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 155 L 7.07 4.12 0.00 1.56 1.34 1.02 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.16 4.65 0.00 1.73 1.77 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.55 7.81 157 R 8.40 3.70 0.00 1.65 1.73 0.00 3.20 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.43 0.00 158 L 7.03 3.35 0.00 1.55 1.68 0.18 1.02 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 P 0.00 4.45 0.00 2.09 2.30 0.00 3.68 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.20 0.00 160 D 8.20 4.86 0.00 2.61 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 A 7.19 5.57 1.39 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 0.00 162 I 7.66 4.64 1.86 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 1.21 0.78 0.97 0.00 0.00 163 F 9.19 4.84 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 V 8.81 4.35 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.73 0.00 0.00 165 V 8.76 3.58 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 0.75 0.00 0.00 0.97 0.00 0.00 166 D 7.62 4.79 0.00 2.55 2.81 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 0.00 167 P 0.00 4.25 0.00 2.16 1.80 0.00 3.68 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.87 0.00 168 T 7.83 3.29 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 1.18 0.00 0.00 169 K 7.91 3.86 0.00 1.84 1.86 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.42 7.81 170 E 8.39 4.50 0.00 2.20 1.72 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 2.23 2.26 0.00 171 A 7.48 4.48 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 0.00 172 I 7.36 3.84 2.29 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.94 1.22 0.00 0.00 173 A 7.01 2.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 V 6.73 3.28 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 0.89 0.00 0.00 0.80 0.00 0.00 175 R 8.21 4.03 0.00 2.08 1.93 0.00 3.21 0.00 0.00 3.17 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 176 E 7.85 3.85 0.00 2.47 2.27 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 2.52 2.85 0.00 177 A 8.26 4.13 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 0.00 178 R 7.94 3.74 0.00 1.90 2.00 0.00 3.08 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 179 K 8.56 3.92 0.00 1.76 1.94 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.39 7.81 180 L 8.10 4.65 0.00 1.89 1.65 1.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 181 F 7.56 3.84 0.00 3.20 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 I 7.33 4.24 1.99 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 1.30 0.73 0.98 0.00 0.00 183 P 0.00 5.33 0.00 2.18 2.17 0.00 4.14 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.04 0.00 184 V 8.58 4.74 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 1.03 0.00 0.00 0.96 0.00 0.00 185 I 8.51 5.28 2.31 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 1.28 1.89 1.31 0.00 0.00 186 A 7.93 4.09 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 8.23 4.41 0.00 1.53 1.58 0.91 1.27 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 0.00 188 A 9.84 5.39 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 0.00 189 D 8.03 4.75 0.00 2.78 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 0.00 190 T 7.61 3.33 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 1.50 0.00 0.00 191 D 8.37 4.39 0.00 2.59 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 0.00 192 S 6.91 4.96 0.00 3.91 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 0.00 193 D 8.15 5.04 0.00 2.65 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 0.00 194 P 0.00 4.87 0.00 2.13 1.44 0.00 3.79 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.80 0.00 195 D 9.09 3.96 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 L 9.17 4.42 0.00 1.68 1.69 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 197 V 7.16 4.29 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 0.82 0.00 0.00 0.97 0.00 0.00 198 D 8.84 4.19 0.00 2.95 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 0.00 199 Y 8.28 4.71 0.00 2.87 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 0.00 200 I 8.25 4.15 2.20 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.51 1.17 0.00 0.00 201 I 8.25 4.77 2.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.34 1.02 0.00 0.00 202 P 0.00 4.77 0.00 2.12 2.26 0.00 3.86 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.51 0.00 203 G 8.48 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 0.00 204 N 8.79 4.41 0.00 3.09 3.07 0.00 0.00 7.13 8.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 D 8.57 4.81 0.00 2.77 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 0.00 206 D 8.10 4.70 0.00 2.70 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 A 7.78 4.32 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 0.00 208 I 8.41 3.89 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.59 0.87 0.00 0.00 209 R 7.85 3.84 0.00 1.89 1.91 0.00 3.26 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 210 S 8.06 4.41 0.00 4.09 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 0.00 211 I 8.13 3.59 2.00 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 1.54 0.79 0.95 0.00 0.00 212 Q 8.49 3.83 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 213 L 7.71 3.93 0.00 1.82 1.81 0.51 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 214 I 8.77 4.03 2.14 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 1.85 0.83 1.15 0.00 0.00 215 L 9.27 4.02 0.00 1.91 1.79 1.07 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 216 S 8.07 4.95 0.00 3.91 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 0.00 217 R 8.22 4.90 0.00 2.25 2.05 0.00 3.31 0.00 0.00 3.27 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 218 A 8.54 4.67 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 V 8.69 3.58 2.37 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 1.06 0.00 0.00 1.13 0.00 0.00 220 D 8.10 4.43 0.00 2.91 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 0.00 221 L 7.44 4.15 0.00 2.06 1.91 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 222 I 7.42 3.97 2.00 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 1.54 1.54 0.90 0.00 0.00 223 I 7.57 3.81 1.86 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 1.77 0.76 0.90 0.00 0.00 224 Q 8.74 3.91 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.41 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 225 A 7.22 4.67 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 0.00 226 R 7.70 4.49 0.00 1.87 1.90 0.00 3.16 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 227 G 8.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 7.70 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 0.00 0.00 0.00 0.00 229 V 7.23 3.66 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 0.83 0.00 0.00 0.92 0.00 0.00 230 V 7.87 4.53 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 0.88 0.00 0.00 0.93 0.00 0.00 231 E 8.37 4.28 0.00 2.08 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 2.26 2.33 0.00 232 P 0.00 4.24 0.00 2.10 2.16 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 233 S 8.64 4.25 0.00 3.84 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 0.00 234 P 0.00 4.19 0.00 2.24 2.12 0.00 3.77 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.03 0.00 235 S 8.15 4.55 0.00 3.78 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 0.00 236 Y 7.84 4.29 0.00 3.05 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 0.00 237 A 7.88 4.49 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 0.00 238 L 8.14 4.96 0.00 1.83 1.97 0.94 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 239 V 6.91 3.09 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.80 0.00 0.00 240 Q 8.61 3.88 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.42 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 *241 E 8.54 4.15 0.00 1.73 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 2.13 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.