NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *3 N 4.6716 8.5245 117.7920 52.1137 38.9553 174.2707 *4 K 4.4840 8.3082 125.1600 51.3274 34.1015 170.7731 5 T 4.3254 8.3791 116.1237 64.1694 69.9664 174.4763 6 V 3.7472 9.1676 127.9896 62.7941 32.9573 175.0033 7 V 4.2842 9.3536 129.0175 62.0141 32.5832 174.5920 8 V 4.5498 8.6305 129.4057 62.0198 33.2910 174.3120 9 T 4.9042 8.7815 123.2959 61.0025 69.4618 173.2914 10 T 4.9619 8.7508 122.2882 60.8180 71.8362 171.5219 11 I 4.6423 7.8466 121.4796 58.7785 41.1204 175.5141 12 L 4.2278 8.5212 128.2906 54.7627 40.3660 175.7779 13 E 4.5432 8.6037 124.4353 54.3599 32.1385 174.8920 14 S 4.3597 8.6676 123.1672 57.8990 63.8613 172.1298 15 P 4.3441 0.0000 0.0000 62.7448 31.7092 177.4151 16 Y 3.8266 7.7062 118.2469 61.1164 37.9762 175.8632 17 V 4.7784 8.1782 120.0363 61.5781 34.8520 173.6530 18 M 4.8964 9.1583 126.9730 53.6031 36.7016 174.1555 19 M 4.5253 8.7055 121.9694 54.7697 33.3919 176.0742 20 K 4.0625 8.9553 126.9427 56.0419 33.4323 176.6556 21 K 3.9375 8.7917 124.9357 58.4160 32.3149 175.7370 22 N 4.4392 8.7759 121.5271 54.4563 36.0584 174.3277 23 H 4.7340 7.9408 112.4532 55.4083 29.7179 176.2330 24 E 3.9050 8.1934 120.7625 59.5550 29.3349 178.2436 25 M 4.3373 7.8013 114.6806 55.3050 32.5186 176.0929 26 L 4.3722 7.5478 122.1562 54.3588 43.6020 175.9028 *27 E 4.6505 7.9513 113.7262 55.5934 33.7441 172.2688 28 G 3.9452 8.4872 106.3450 45.6190 0.0000 173.9091 29 N 4.5997 8.5209 114.5893 55.8933 38.6788 177.1245 30 E 4.1632 8.1000 114.9384 58.3851 30.1364 178.2499 31 R 3.8896 7.7358 119.5086 58.6891 30.2130 176.3595 32 Y 5.2527 7.1832 114.3350 56.7015 39.8399 174.4609 33 E 4.6812 9.0736 118.5113 55.0551 32.8685 174.3917 34 G 3.0625 8.3479 105.9112 42.4963 0.0000 173.6750 35 Y 3.8221 7.0371 120.9980 61.1547 38.4574 178.3770 36 C 4.2426 8.2634 116.9506 62.3211 28.3205 176.3074 37 V 3.5969 7.4448 119.9338 65.9390 31.3528 177.6831 38 D 4.3826 8.2722 118.8697 57.1960 40.6202 178.4332 39 L 3.7353 8.0374 121.0010 57.9760 42.0046 178.8599 40 A 3.7138 8.1492 120.7403 54.9866 18.2823 179.4670 41 A 4.0323 7.6832 120.1764 54.7129 18.4087 179.7733 42 E 3.8740 7.9536 116.6377 59.5537 29.4923 179.5006 43 I 3.5553 7.8313 119.8430 64.4593 37.2107 178.3328 44 A 2.5800 7.7045 123.8109 54.9230 17.6994 180.5147 *45 K 3.9410 7.7719 122.0694 60.4503 31.6667 181.4745 46 H 4.3433 8.0651 116.5148 58.3824 28.7011 177.0984 47 C 4.4104 8.1446 116.8371 59.1793 28.8229 173.3863 48 G 3.8200 7.5490 108.1824 46.5656 0.0000 173.3245 49 F 5.1975 7.6910 112.0082 54.7694 41.5650 175.0447 50 K 4.9411 8.8748 119.3049 55.8791 33.9769 174.9572 51 Y 5.4975 7.9804 119.2459 55.7760 42.3800 173.4392 52 K 4.7396 9.2221 120.9626 54.3414 35.0491 175.2198 53 L 4.6077 9.5414 129.1316 55.2720 42.3049 177.0877 54 T 4.6861 8.6054 119.4031 61.9274 73.0945 172.9037 55 I 4.5692 8.3255 126.8808 59.8368 38.6706 175.9948 56 V 3.6901 8.9167 127.1727 62.4310 31.3426 177.2881 57 G 3.7323 9.0950 115.2715 48.3840 0.0000 173.6979 58 D 4.5675 8.0940 115.9831 52.2258 39.9083 176.6637 59 G 3.8618 8.0018 107.1515 46.3769 0.0000 173.6971 60 K 4.6685 7.8958 118.3310 54.2947 35.0514 177.3341 61 Y 3.6029 8.5245 118.5965 61.9374 38.1163 174.2376 62 G 3.5482 6.7122 105.7652 44.1989 0.0000 172.3560 63 A 4.9418 9.3067 127.7784 50.4037 23.3769 174.3705 64 R 4.0704 7.5508 119.9295 54.2102 31.2983 175.6475 65 D 4.3156 8.5807 126.8447 54.3148 41.6914 177.0192 66 A 3.8438 8.8456 131.5206 56.0501 18.5191 178.9800 *67 D 4.5357 8.1962 114.6318 56.3400 40.2148 180.0517 68 T 3.9812 7.8886 109.7563 62.2409 69.2837 175.5506 69 K 3.8579 7.9847 119.6268 56.8092 30.5231 175.0454 70 I 4.4642 7.2201 120.7694 60.1425 38.7389 175.1617 71 W 4.9848 9.3123 127.1437 56.6405 30.5510 175.7257 72 N 4.9189 9.2795 122.4137 51.9651 40.4630 174.5751 73 G 4.1381 9.2221 106.8285 45.9575 0.0000 174.0075 74 M 4.0539 8.0129 116.9265 58.2092 31.7497 178.8073 75 V 3.4923 7.6706 118.8387 66.0310 31.6492 178.3013 76 G 3.9819 8.1253 106.6757 47.4752 0.0000 175.4268 77 E 4.0635 8.3905 120.7755 58.9713 29.2847 179.5647 78 L 4.0323 7.7364 118.9333 57.6600 41.5447 179.5058 79 V 3.2175 7.4089 117.4160 65.8193 31.4063 176.1514 80 Y 4.4053 7.8847 114.8180 57.6537 37.7353 176.1565 81 G 3.9153 7.8745 107.4850 46.0448 0.0000 175.2484 82 K 4.1523 8.2211 119.6682 57.6921 32.4410 176.8905 83 A 4.7337 7.4650 119.4652 50.6436 22.1639 175.0420 84 D 4.6666 8.6147 119.1899 55.7167 42.2509 177.0228 85 I 4.5438 7.3541 116.0614 59.6944 41.8956 172.8604 86 A 5.4996 8.8744 129.9444 49.5007 21.4647 175.3078 87 I 4.3451 8.2310 123.4216 59.8470 38.7365 174.5549 88 A 4.4095 8.1105 128.1803 50.6004 22.2793 175.3257 89 P 3.3970 0.0000 0.0000 61.4395 29.5146 175.1698 90 L 4.6113 7.1687 123.3936 54.3032 44.3481 175.8898 91 T 4.5941 8.4579 123.6511 63.4064 69.3973 174.3814 92 I 2.6312 7.9856 128.0556 60.7703 37.3955 175.6096 93 T 4.6593 8.0694 116.2039 58.6468 72.5191 174.7760 94 L 3.9450 8.5628 123.0662 58.6613 41.9433 179.5249 95 V 3.9977 7.8459 110.2732 64.4804 31.7022 178.3782 96 R 3.8480 7.9315 117.1339 59.1130 29.8922 178.7734 97 E 4.4029 8.4406 118.7777 58.7702 29.4626 178.9827 98 E 4.1405 8.0914 117.6771 58.3538 29.5764 177.9206 99 V 4.1470 7.6287 110.4456 61.0098 33.5747 175.0228 100 I 4.5407 6.9459 111.8027 59.3006 41.5496 173.4801 101 D 4.9548 8.6775 122.1581 52.7971 43.1041 175.8963 102 F 5.5101 8.5467 119.5257 55.6777 42.5614 175.1633 103 S 4.6406 8.9753 117.6333 57.3669 64.4049 173.6978 104 K 4.3523 9.1038 120.5078 55.5181 32.5143 175.7882 105 P 4.6049 0.0000 0.0000 63.1940 31.6659 176.1966 106 F 4.9562 8.3807 115.2309 57.5748 39.3169 175.3131 107 M 4.7178 7.2009 118.8077 54.4578 35.5840 173.0809 108 S 5.1278 8.0891 121.1714 57.0729 65.4914 173.1667 109 L 4.1821 8.3592 122.5727 55.9582 44.2047 173.0289 110 G 4.4678 8.0344 104.0812 45.3372 0.0000 172.9044 111 I 4.1913 8.8310 122.6621 61.3330 38.2172 175.6084 112 S 4.8768 9.2301 119.7297 57.1299 67.6023 172.1524 113 I 4.6477 8.2078 119.5873 59.7418 39.5736 174.4870 114 M 5.2445 9.1593 127.7902 53.7992 34.3729 174.6532 115 I 5.0072 8.7723 118.8627 58.6344 42.0204 174.4102 116 K 4.5721 8.5063 124.0799 55.7202 33.5135 176.3897 117 K 4.1257 8.7920 127.2577 58.1505 32.3329 177.3901 118 G 4.0752 9.0128 111.8449 45.3671 0.0000 173.8070 119 T 4.0808 7.3523 110.1486 60.8227 69.9288 174.3012 120 P 4.6789 0.0000 0.0000 61.9722 29.5321 176.3952 121 I 4.6156 7.2325 120.0135 60.6580 41.4911 176.1442 *122 E 4.6966 9.0762 118.2276 54.6425 32.0188 173.5765 123 S 4.6337 7.4510 111.7398 57.3390 66.8293 175.3717 124 A 3.9600 8.4557 123.6731 55.0945 18.0969 179.3283 125 E 3.8924 8.2208 117.4494 59.5472 29.4705 178.6230 126 D 4.3132 7.7295 117.6684 57.3463 41.2873 178.4007 127 L 4.7404 7.8655 120.8947 57.3433 41.3779 179.9111 128 S 4.3067 8.2138 112.5970 60.5675 62.9825 175.5172 129 K 4.4143 7.5158 119.8841 55.4145 32.6607 175.5423 130 Q 4.7758 7.5761 117.3440 54.5445 31.7781 176.0458 131 T 4.3762 8.0568 111.8346 63.5370 70.9804 176.4927 132 E 3.8268 8.3471 118.4429 58.2994 29.8834 176.5405 133 I 4.5533 6.9333 118.1444 59.4307 38.1581 176.0536 134 A 4.6196 9.1272 129.7010 51.6400 20.2288 175.4789 135 Y 4.9382 7.4897 114.7541 57.3025 41.2471 174.2043 136 G 4.6896 8.3268 107.2314 46.0578 0.0000 170.4694 137 T 5.7976 8.6048 109.0163 60.1010 73.0511 173.1665 138 T 4.7523 8.8055 117.8478 63.7448 68.5232 174.9423 139 D 4.4438 9.2320 125.4787 56.4812 42.0097 176.8640 140 S 4.7563 7.7448 111.9642 55.7595 62.9774 171.5487 141 G 4.3932 7.3632 111.2817 44.2107 0.0000 172.0752 142 S 4.1936 8.8090 113.4686 61.8129 62.7339 176.5365 143 T 3.8486 7.8326 118.9133 66.3079 68.3370 176.4105 144 K 4.2590 8.1434 121.0942 59.7138 32.2658 178.5130 145 E 3.8082 8.0691 118.5265 59.0636 29.3428 178.9391 146 F 3.7713 8.3106 120.8467 61.4926 39.1771 177.3678 147 F 4.0806 7.6293 115.6023 60.3358 38.8165 177.4207 148 R 2.0000 7.1590 119.9994 58.5837 29.8065 178.5298 *149 R 4.4044 7.3526 117.5619 57.3286 30.3726 178.7450 150 S 4.1435 7.1583 115.2751 59.7409 62.7474 174.5523 *151 K 4.4314 8.3134 127.2141 54.5611 32.7452 174.9314 152 I 3.8529 7.6562 120.4073 61.7422 38.0388 176.0187 153 A 3.9370 8.6293 127.5239 55.5768 18.1513 179.8047 154 V 3.5446 7.4754 115.5048 66.2437 31.6708 178.1444 155 F 4.9648 7.7585 117.0836 60.7668 38.8571 176.9848 156 D 4.5440 8.8766 118.1572 57.3926 40.9635 178.1628 157 K 4.0718 8.4908 120.2861 59.9717 32.1002 178.6318 158 M 4.5521 8.6830 120.6361 57.7315 31.8347 178.5767 159 W 4.5450 8.9251 128.8939 60.8877 30.6984 178.0999 160 T 3.7362 8.0244 114.8986 66.6947 67.7042 175.7410 161 Y 4.0894 7.8708 121.3625 60.9598 38.8212 177.5443 162 M 3.1625 8.0840 120.0837 58.0767 31.8456 178.9862 163 R 3.4833 7.1413 114.5728 58.1653 29.4017 177.4003 164 S 4.4477 7.0098 108.6673 57.3194 63.4945 174.0354 165 A 3.9219 7.0327 124.8314 52.2827 18.5297 177.2237 166 E 4.5763 8.2302 120.5754 53.6094 32.9412 174.2954 167 P 4.4585 0.0000 0.0000 61.5910 32.4211 175.7248 168 S 3.9717 8.4226 112.6807 59.5834 62.4607 174.2705 169 V 4.0135 7.8134 118.4803 61.7863 32.4488 175.5647 170 F 5.3335 7.4985 119.4756 56.6728 40.3232 175.6195 171 V 4.6908 8.6250 114.1752 59.6841 34.8825 177.3715 172 R 4.0167 9.0187 122.5771 59.0637 30.3623 177.5006 173 T 4.8976 7.4950 106.2761 59.2172 73.2675 174.7665 174 T 4.6660 8.9434 118.5964 66.4586 68.4317 176.5000 175 A 4.0730 8.1786 122.0645 55.3159 18.3449 179.1494 176 E 3.9263 8.0828 117.7822 59.2196 29.6864 179.3601 177 G 2.6593 7.8806 105.8169 47.3297 0.0000 175.8253 178 V 3.6651 8.0320 121.2030 65.8116 31.6245 177.9822 179 A 3.9782 8.1982 120.5451 55.1177 17.8933 179.6241 180 R 3.7262 7.5795 116.7207 59.3446 30.5086 178.6646 181 V 3.9804 8.0730 118.1756 66.2879 31.4147 178.3259 182 R 4.0659 8.2540 116.7294 58.3219 29.8828 178.2046 183 K 4.5191 7.7516 115.5290 56.3420 32.7050 177.4349 184 S 4.5692 7.9881 114.9142 57.2524 62.9715 174.3428 185 K 3.9228 9.1025 119.6802 57.4327 29.4301 176.1676 186 G 3.9663 8.5961 104.5184 45.7671 0.0000 174.8647 187 K 4.3977 8.2327 118.5291 56.5916 32.4886 175.3840 188 Y 5.4791 7.7587 119.7284 55.8231 41.8889 173.8931 189 A 4.8460 8.3929 127.5962 50.1367 22.7476 174.0151 190 Y 5.0599 8.7187 121.9708 55.8152 41.4684 174.5237 191 L 4.7762 8.8515 127.8617 53.7073 42.5160 175.8239 192 L 4.4395 8.2879 123.4865 53.9694 44.6275 175.1503 193 E 4.4264 8.6251 119.3654 56.0194 30.3283 178.2536 194 S 4.2324 9.4040 120.6171 61.2153 62.5857 177.1779 195 T 4.0340 7.9905 112.4934 65.3441 68.3983 176.0624 196 M 4.3978 8.2741 121.3828 57.4209 32.2938 178.0730 197 N 4.3981 8.4138 117.4000 56.9568 38.9667 176.8889 198 E 4.1823 8.8220 118.9641 59.3222 29.7992 178.5181 199 Y 4.0661 8.1612 119.4918 60.8079 38.8009 178.0146 200 I 3.5702 8.0696 120.7925 64.2847 36.9723 177.9852 201 E 4.0061 8.0728 118.9652 58.4891 29.5015 177.1873 202 Q 4.6635 7.7180 116.9478 55.4951 30.3339 175.0286 203 R 4.7794 7.8929 118.8662 53.8120 33.1386 175.9022 204 K 4.4013 8.6562 122.7447 55.5844 32.9011 175.0518 205 P 4.5339 0.0000 0.0000 62.9325 31.3761 176.8568 206 C 4.3100 7.9655 113.9763 59.3913 36.0458 173.2430 207 D 4.9876 8.0241 115.4388 53.2497 40.7248 175.9137 208 T 5.1757 7.7632 108.5551 60.7933 72.0212 172.7642 209 M 4.9367 8.7756 120.0954 54.3739 36.1997 173.1111 210 K 4.8960 8.6159 126.2405 55.7581 33.3126 176.2633 211 V 4.3733 8.2663 120.0697 60.7268 35.0591 177.1537 212 G 3.7345 8.8005 112.6339 44.8635 0.0000 172.6321 213 G 4.0041 8.1288 107.7844 43.6258 0.0000 173.1708 214 N 4.6384 8.2372 116.5059 52.9750 38.9959 176.1175 215 L 4.2213 8.6273 122.2816 57.1139 42.0641 176.2139 216 D 4.6054 7.1994 116.0240 52.4610 41.8570 173.4874 217 S 4.6838 8.1942 114.3481 57.1116 66.3252 173.4919 218 K 4.3582 8.8450 124.7580 56.7618 35.8072 174.3138 219 G 4.1991 8.1788 105.2160 45.8179 0.0000 171.3221 220 Y 5.2082 7.9748 117.6110 56.5442 39.9909 175.5274 221 G 4.6982 8.5437 108.4774 44.7128 0.0000 172.2499 222 I 4.5395 8.9017 122.6565 60.9320 38.4103 174.9512 223 A 5.1515 8.6965 128.5569 50.3463 21.6030 175.5221 224 T 4.8255 8.4664 110.4619 58.8720 72.9131 171.7669 225 P 4.4645 0.0000 0.0000 61.9479 32.8285 175.9683 226 K 3.9805 8.3823 123.7930 58.3486 32.2998 176.8892 227 G 3.8454 8.5578 113.0533 45.8153 0.0000 173.4903 228 S 4.2208 7.6843 114.2400 58.0509 62.8009 175.3304 229 S 4.0292 8.3971 120.1573 60.2923 63.2055 175.9724 230 L 4.4004 8.2640 120.8157 56.8035 41.5647 178.6844 231 G 3.8835 7.5048 104.9047 48.0860 0.0000 175.0630 232 N 4.2729 8.1314 118.6024 56.0149 39.2328 176.9382 233 A 4.0076 7.9695 121.5144 55.1205 18.4608 179.5193 234 V 3.5854 8.0356 116.8416 66.1058 31.6324 177.6495 235 N 4.3137 8.2244 116.6970 56.9612 38.8371 176.8924 236 L 4.0596 7.9935 119.9534 57.5147 41.5653 179.4180 237 A 3.9314 8.0853 121.0424 54.9715 18.3405 179.7264 238 V 3.5517 8.0710 117.0515 66.2863 31.6260 178.2447 239 L 4.0357 7.8017 118.1703 57.5199 41.3238 179.5418 240 K 3.8980 8.0806 119.5319 59.5191 32.2380 178.7018 241 L 3.9133 8.1008 119.6693 57.8662 41.4765 179.1296 242 N 4.3056 8.2423 116.6021 56.9673 38.7832 176.8630 243 E 3.9840 8.0203 118.1873 59.1198 29.5931 178.5699 244 Q 4.2859 8.0973 116.1744 55.9751 29.2791 176.9711 245 G 3.9765 8.3252 109.4979 45.7012 0.0000 175.4101 246 L 3.9282 7.8477 121.7914 58.1683 42.1099 178.8337 247 L 4.1284 7.9428 118.4406 57.9918 41.7091 179.1541 248 D 4.4391 8.1049 118.4326 56.9915 40.8807 178.4032 249 K 3.9556 8.2726 120.3842 59.7483 32.3398 178.8743 250 L 4.1980 8.4557 119.5619 57.6573 41.4753 179.5312 251 K 4.2194 8.3955 119.7380 59.7340 32.1776 178.7599 252 N 4.9586 8.3930 116.4275 56.1124 38.2266 177.4146 253 K 3.9974 8.2702 121.2128 58.9583 32.1068 178.3467 254 W 4.6638 8.1663 116.1582 57.2355 29.5556 177.3727 255 W 4.4323 8.2879 117.2368 58.5823 29.8909 177.3768 256 Y 4.5513 7.2626 115.4280 60.7535 37.6742 177.7659 257 D 4.4692 8.5861 119.0769 56.9975 41.1192 177.8749 258 K 4.1326 7.5521 114.8181 57.8682 32.4801 177.5909 259 G 3.8997 7.1517 107.0181 46.2247 0.0000 173.0522 260 E 4.5378 9.3257 121.5875 56.0471 30.6378 175.7121 261 C 4.5010 8.0532 121.7994 57.0055 41.5841 173.4946 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 *3 N 8.52 4.67 0.00 2.76 2.71 0.00 0.00 6.48 6.56 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 *4 K 8.31 4.48 0.00 1.83 1.60 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.27 1.09 7.81 5 T 8.38 4.33 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 6 V 9.17 3.75 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 0.66 0.00 0.00 0.39 0.00 0.00 7 V 9.35 4.28 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 0.93 0.00 0.00 0.93 0.00 0.00 8 V 8.63 4.55 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.01 0.00 0.00 9 T 8.78 4.90 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 1.21 0.00 0.00 10 T 8.75 4.96 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 1.05 0.00 0.00 11 I 7.85 4.64 1.51 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.84 0.60 0.00 0.00 12 L 8.52 4.23 0.00 1.66 1.66 0.99 0.88 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 13 E 8.60 4.54 0.00 1.99 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 2.32 2.45 0.00 14 S 8.67 4.36 0.00 3.90 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 15 P 0.00 4.34 0.00 1.69 1.26 0.00 2.45 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 0.49 0.44 0.00 16 Y 7.71 3.83 0.00 3.12 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 17 V 8.18 4.78 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 0.76 0.00 0.00 0.85 0.00 0.00 18 M 9.16 4.90 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 19 M 8.71 4.53 0.00 2.05 2.05 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 2.70 0.00 20 K 8.96 4.06 0.00 1.42 1.40 0.00 1.75 0.00 0.00 1.38 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.43 7.81 21 K 8.79 3.94 0.00 1.74 1.78 0.00 1.94 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.52 7.81 22 N 8.78 4.44 0.00 2.95 2.89 0.00 0.00 7.12 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 7.94 4.73 0.00 3.41 3.19 0.00 5.83 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 24 E 8.19 3.90 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 2.41 2.40 0.00 25 M 7.80 4.34 0.00 1.98 2.07 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 2.54 2.53 0.00 26 L 7.55 4.37 0.00 1.77 1.58 0.69 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 *27 E 7.95 4.65 0.00 1.92 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 2.11 1.85 0.00 28 G 8.49 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.52 4.60 0.00 2.74 2.97 0.00 0.00 6.61 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 30 E 8.10 4.16 0.00 2.08 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 2.28 2.39 0.00 31 R 7.74 3.89 0.00 1.33 1.24 0.00 2.83 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.46 0.00 32 Y 7.18 5.25 0.00 2.96 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 33 E 9.07 4.68 0.00 2.32 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 34 G 8.35 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 0.00 0.00 0.00 35 Y 7.04 3.82 0.00 2.94 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 36 C 8.26 4.24 0.00 3.26 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 37 V 7.44 3.60 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 1.18 0.00 0.00 0.96 0.00 0.00 38 D 8.27 4.38 0.00 2.92 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.04 3.74 0.00 1.40 1.63 0.70 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.15 3.71 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.68 4.03 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 42 E 7.95 3.87 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 43 I 7.83 3.56 1.84 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 1.59 0.88 0.96 0.00 0.00 44 A 7.70 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *45 K 7.77 3.94 0.00 1.79 1.83 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 46 H 8.07 4.34 0.00 3.16 3.35 0.00 5.61 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 8.14 4.41 0.00 2.77 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.55 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 7.69 5.20 0.00 2.91 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.87 4.94 0.00 1.82 1.79 0.00 1.68 0.00 0.00 1.88 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 51 Y 7.98 5.50 0.00 3.19 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 52 K 9.22 4.74 0.00 1.80 1.70 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.39 7.81 53 L 9.54 4.61 0.00 1.74 1.47 1.10 0.93 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 54 T 8.61 4.69 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 1.20 0.00 0.00 55 I 8.33 4.57 1.85 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.77 0.85 0.00 0.00 56 V 8.92 3.69 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 0.63 0.00 0.00 0.97 0.00 0.00 57 G 9.09 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 58 D 8.09 4.57 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 G 8.00 3.86 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 0.00 0.00 0.00 60 K 7.90 4.67 0.00 1.96 1.77 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.61 7.81 61 Y 8.52 3.60 0.00 3.20 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 62 G 6.71 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 9.31 4.94 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 64 R 7.55 4.07 0.00 0.67 0.90 0.00 3.07 0.00 0.00 2.47 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.71 0.00 65 D 8.58 4.32 0.00 2.71 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.85 3.84 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 *67 D 8.20 4.54 0.00 2.70 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 68 T 7.89 3.98 4.21 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 1.18 0.00 0.00 69 K 7.98 3.86 0.00 1.93 1.95 0.00 1.63 0.00 0.00 1.89 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.52 7.81 70 I 7.22 4.46 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.89 0.86 0.00 0.00 71 W 9.31 4.98 0.00 3.49 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.28 4.92 0.00 3.13 3.02 0.00 0.00 6.58 6.45 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 73 G 9.22 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.01 4.05 0.00 2.01 2.21 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.45 0.00 75 V 7.67 3.49 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.98 0.00 0.00 76 G 8.13 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 77 E 8.39 4.06 0.00 2.17 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 2.37 2.56 0.00 78 L 7.74 4.03 0.00 1.79 1.49 0.84 0.41 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 79 V 7.41 3.22 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.00 0.00 0.42 0.00 0.00 80 Y 7.88 4.41 0.00 3.07 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 81 G 7.87 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 82 K 8.22 4.15 0.00 1.88 1.90 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.56 1.58 7.81 83 A 7.46 4.73 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.61 4.67 0.00 2.53 2.59 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 85 I 7.35 4.54 1.71 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 1.24 1.46 0.81 0.00 0.00 86 A 8.87 5.50 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 87 I 8.23 4.35 1.80 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 1.24 0.68 0.77 0.00 0.00 88 A 8.11 4.41 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.40 0.00 0.93 0.49 0.00 3.53 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.03 0.00 90 L 7.17 4.61 0.00 1.90 1.75 1.16 0.91 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 91 T 8.46 4.59 4.21 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 1.15 0.00 0.00 92 I 7.99 2.63 1.48 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 -0.35 0.63 0.00 0.00 93 T 8.07 4.66 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 94 L 8.56 3.94 0.00 1.79 1.72 0.94 0.91 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 95 V 7.85 4.00 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 0.91 0.00 0.00 1.17 0.00 0.00 96 R 7.93 3.85 0.00 2.28 2.11 0.00 3.44 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.86 0.00 97 E 8.44 4.40 0.00 2.19 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 2.82 2.55 0.00 98 E 8.09 4.14 0.00 2.22 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 2.38 2.56 0.00 99 V 7.63 4.15 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 -0.08 0.00 0.00 100 I 6.95 4.54 1.60 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.51 0.52 0.00 0.00 101 D 8.68 4.95 0.00 2.48 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 0.00 102 F 8.55 5.51 0.00 3.07 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.98 4.64 0.00 3.97 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 0.00 104 K 9.10 4.35 0.00 1.68 1.82 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.69 1.56 7.81 105 P 0.00 4.60 0.00 2.04 1.90 0.00 3.73 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 1.94 1.87 0.00 106 F 8.38 4.96 0.00 3.11 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 0.00 107 M 7.20 4.72 0.00 1.69 1.80 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.36 0.00 108 S 8.09 5.13 0.00 3.64 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 0.00 109 L 8.36 4.18 0.00 1.39 1.44 -0.24 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 110 G 8.03 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.83 4.19 1.28 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.11 0.76 0.00 0.00 112 S 9.23 4.88 0.00 3.75 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 0.00 113 I 8.21 4.65 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.94 0.86 0.00 0.00 114 M 9.16 5.24 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 115 I 8.77 5.01 1.89 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 1.25 0.67 0.90 0.00 0.00 116 K 8.51 4.57 0.00 1.96 1.74 0.00 1.80 0.00 0.00 2.01 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.56 7.81 117 K 8.79 4.13 0.00 1.76 1.77 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.50 7.81 118 G 9.01 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 T 7.35 4.08 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 1.29 0.00 0.00 120 P 0.00 4.68 0.00 2.06 2.07 0.00 3.65 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 2.03 2.10 0.00 121 I 7.23 4.62 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.32 0.90 0.00 0.00 *122 E 9.08 4.70 0.00 1.94 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 2.14 2.08 0.00 123 S 7.45 4.63 0.00 4.01 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 0.00 124 A 8.46 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.22 3.89 0.00 2.04 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 2.37 2.39 0.00 126 D 7.73 4.31 0.00 2.92 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 0.00 127 L 7.87 4.74 0.00 1.45 0.48 0.48 0.32 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 0.00 128 S 8.21 4.31 0.00 4.07 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 K 7.52 4.41 0.00 1.71 1.87 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.66 7.81 130 Q 7.58 4.78 0.00 2.17 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.57 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 131 T 8.06 4.38 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 1.21 0.00 0.00 132 E 8.35 3.83 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 133 I 6.93 4.55 1.90 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 1.34 0.63 0.99 0.00 0.00 134 A 9.13 4.62 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Y 7.49 4.94 0.00 2.88 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 0.00 136 G 8.33 4.69 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 0.00 0.00 0.00 137 T 8.60 5.80 4.52 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 0.00 0.00 0.00 1.52 0.00 0.00 138 T 8.81 4.75 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 1.44 0.00 0.00 139 D 9.23 4.44 0.00 3.05 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 S 7.74 4.76 0.00 3.89 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 0.00 141 G 7.36 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 0.00 142 S 8.81 4.19 0.00 4.05 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 0.00 143 T 7.83 3.85 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 1.36 0.00 0.00 144 K 8.14 4.26 0.00 2.14 1.85 0.00 1.53 0.00 0.00 1.89 0.00 0.00 2.71 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.53 1.73 7.81 145 E 8.07 3.81 0.00 2.15 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 2.57 2.48 0.00 146 F 8.31 3.77 0.00 3.04 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 0.00 147 F 7.63 4.08 0.00 3.25 3.47 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 0.00 148 R 7.16 2.00 0.00 0.67 1.51 0.00 3.18 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.34 0.00 *149 R 7.35 4.40 0.00 1.94 1.80 0.00 3.32 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 150 S 7.16 4.14 0.00 3.25 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *151 K 8.31 4.43 0.00 1.80 1.68 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.28 1.00 7.81 152 I 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9.10 3.92 0.00 1.90 1.89 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.43 7.81 186 G 8.60 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 K 8.23 4.40 0.00 1.92 1.89 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.59 1.54 7.81 188 Y 7.76 5.48 0.00 2.87 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 0.00 189 A 8.39 4.85 1.13 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 0.00 190 Y 8.72 5.06 0.00 3.03 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 0.00 191 L 8.85 4.78 0.00 1.77 1.75 0.72 1.09 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 0.00 192 L 8.29 4.44 0.00 1.37 0.65 0.96 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 193 E 8.63 4.43 0.00 2.08 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 2.27 2.19 0.00 194 S 9.40 4.23 0.00 4.19 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 0.00 195 T 7.99 4.03 4.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 196 M 8.27 4.40 0.00 2.25 2.32 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.75 0.00 197 N 8.41 4.40 0.00 2.91 3.00 0.00 0.00 7.16 6.95 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 0.00 198 E 8.82 4.18 0.00 2.29 2.29 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 2.47 2.49 0.00 199 Y 8.16 4.07 0.00 2.52 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 I 8.07 3.57 1.96 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 1.90 1.00 0.96 0.00 0.00 201 E 8.07 4.01 0.00 2.17 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 202 Q 7.72 4.66 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.53 0.00 0.00 0.00 0.00 0.00 2.55 2.60 0.00 203 R 7.89 4.78 0.00 1.62 1.62 0.00 2.88 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.97 0.00 204 K 8.66 4.40 0.00 1.73 1.74 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.38 7.81 205 P 0.00 4.53 0.00 2.18 2.13 0.00 3.92 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 2.30 1.99 0.00 206 C 7.97 4.31 0.00 3.10 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 0.00 207 D 8.02 4.99 0.00 2.70 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 0.00 208 T 7.76 5.18 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 1.27 0.00 0.00 209 M 8.78 4.94 0.00 2.10 1.90 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 2.66 2.50 0.00 210 K 8.62 4.90 0.00 2.00 1.73 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.71 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.42 7.81 211 V 8.27 4.37 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 0.73 0.00 0.00 0.97 0.00 0.00 212 G 8.80 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 0.00 213 G 8.13 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 0.00 214 N 8.24 4.64 0.00 2.66 2.76 0.00 0.00 6.91 7.85 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 0.00 215 L 8.63 4.22 0.00 1.01 1.14 0.89 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 216 D 7.20 4.61 0.00 2.76 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 0.00 217 S 8.19 4.68 0.00 3.75 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 0.00 218 K 8.84 4.36 0.00 1.58 1.78 0.00 1.18 0.00 0.00 1.60 0.00 0.00 2.72 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.28 1.18 7.81 219 G 8.18 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 Y 7.97 5.21 0.00 1.65 2.14 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.54 4.70 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 0.00 0.00 0.00 222 I 8.90 4.54 1.99 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 1.18 0.74 0.96 0.00 0.00 223 A 8.70 5.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 T 8.47 4.83 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 225 P 0.00 4.46 0.00 1.99 2.01 0.00 3.50 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 226 K 8.38 3.98 0.00 1.59 1.66 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.37 7.81 227 G 8.56 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 0.00 228 S 7.68 4.22 0.00 3.84 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 0.00 229 S 8.40 4.03 0.00 3.87 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 0.00 230 L 8.26 4.40 0.00 1.60 1.66 0.53 0.45 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 0.00 231 G 7.50 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 0.00 0.00 0.00 232 N 8.13 4.27 0.00 2.85 2.84 0.00 0.00 6.88 8.55 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 0.00 233 A 7.97 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.04 3.59 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 1.13 0.00 0.00 1.06 0.00 0.00 235 N 8.22 4.31 0.00 3.00 2.99 0.00 0.00 7.27 6.10 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 0.00 236 L 7.99 4.06 0.00 1.77 1.71 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 237 A 8.09 3.93 1.37 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 0.00 238 V 8.07 3.55 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.04 0.00 0.00 239 L 7.80 4.04 0.00 1.92 1.72 0.94 0.90 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 0.00 240 K 8.08 3.90 0.00 1.96 1.87 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.47 7.81 241 L 8.10 3.91 0.00 1.84 1.70 0.84 0.42 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 0.00 242 N 8.24 4.31 0.00 2.99 2.96 0.00 0.00 7.27 6.95 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 0.00 243 E 8.02 3.98 0.00 2.19 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 2.35 2.45 0.00 244 Q 8.10 4.29 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.66 0.00 0.00 0.00 0.00 0.00 2.65 2.47 0.00 245 G 8.33 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 0.00 246 L 7.85 3.93 0.00 1.77 1.77 0.92 0.86 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 0.00 247 L 7.94 4.13 0.00 1.83 1.91 1.12 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 248 D 8.10 4.44 0.00 2.88 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 0.00 249 K 8.27 3.96 0.00 2.05 2.01 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.51 7.81 250 L 8.46 4.20 0.00 1.81 1.66 0.49 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 251 K 8.40 4.22 0.00 1.96 2.10 0.00 0.61 0.00 0.00 0.84 0.00 0.00 2.66 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.57 7.81 252 N 8.39 4.96 0.00 2.95 3.06 0.00 0.00 6.68 7.19 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 0.00 253 K 8.27 4.00 0.00 1.74 1.86 0.00 1.41 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 0.98 7.81 254 W 8.17 4.66 0.00 3.72 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 0.00 255 W 8.29 4.43 0.00 2.81 1.74 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 0.00 256 Y 7.26 4.55 0.00 3.15 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 0.00 257 D 8.59 4.47 0.00 2.84 2.71 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 0.00 258 K 7.55 4.13 0.00 1.89 1.93 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.62 1.75 7.81 259 G 7.15 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 260 E 9.33 4.54 0.00 1.85 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 2.22 2.18 0.00 261 C 8.05 4.50 0.00 3.13 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 * Residues marked with a * may have inaccurate shift predictions.