NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7639 8.3544 109.7334 45.4325 0.0000 174.5028 *2 K 4.0455 8.9059 123.7131 55.3995 33.2864 175.0149 3 Y 4.9894 7.4045 113.5308 56.2956 41.2485 175.3722 4 K 4.4696 9.0846 123.2254 57.5230 33.7910 176.4321 5 A 5.2753 7.9862 121.2216 49.9928 23.0390 174.5906 6 A 4.7409 9.3363 123.5455 50.0768 22.0214 175.0339 7 I 4.6735 8.2982 124.2268 59.7062 39.7288 174.8078 8 F 4.6371 8.9184 126.5939 55.5063 41.2415 176.7410 9 D 5.3267 8.0168 122.5943 53.4773 43.5334 173.8669 *11 D 4.4089 8.6656 115.8465 55.6253 41.6204 176.5051 12 G 3.9121 9.0309 111.7962 46.0764 0.0000 173.5742 13 T 4.4366 7.4921 113.2856 63.7228 71.4423 175.6861 14 I 4.4716 7.9095 110.8912 61.1073 39.4922 175.6002 15 L 4.9117 7.9470 120.6567 52.7925 44.5314 175.2310 16 D 4.2508 8.3935 124.0342 53.3367 39.7485 176.1900 17 T 4.6799 8.3962 116.4505 60.7320 70.0420 176.2705 18 S 4.0523 8.1984 117.4778 61.3731 62.9653 176.1104 19 A 3.9843 7.9393 123.8728 55.2765 18.2996 179.2533 20 D 4.4305 8.1105 116.9245 57.3822 40.9148 178.8107 21 L 3.9631 8.2038 119.7034 57.9523 41.3908 179.7022 22 T 3.9376 8.0301 115.6174 66.7305 68.4149 176.5737 23 S 4.2087 8.3531 114.8018 61.5450 62.4453 176.1441 24 A 4.2757 8.4733 123.4305 55.0499 18.1319 179.3589 25 L 4.2939 8.8576 119.3801 58.6657 42.1707 178.9914 26 N 4.5202 8.6840 116.6066 56.3759 38.3779 176.5731 27 Y 3.9415 8.3804 120.8611 60.7423 38.6623 178.2250 28 A 4.0554 8.4181 121.3909 55.2419 18.4898 179.5428 29 F 3.9080 8.7973 116.3758 60.6934 39.1253 177.4833 30 E 3.8482 8.5642 119.1180 59.5129 29.2131 178.8991 31 Q 3.9456 7.9198 116.9886 58.0570 28.6417 177.9740 32 T 4.5004 7.2894 108.8730 61.0820 69.1508 175.0491 33 G 3.7621 7.7948 108.2065 46.3695 0.0000 173.3773 34 H 4.8786 7.9760 116.6192 53.0223 30.8560 174.9071 35 R 4.0202 8.9315 118.2390 57.4802 29.5240 176.8760 36 H 4.9597 7.9376 115.4017 55.1222 28.3331 172.8705 37 D 4.9428 7.3414 114.0333 53.8269 40.0886 176.1420 38 F 4.6613 8.1960 118.4250 59.0458 39.7156 175.9834 39 T 4.5185 8.8040 114.8851 60.2938 71.8854 176.1315 40 V 3.6883 8.0670 121.6946 65.6790 31.1426 177.9126 41 E 3.8090 7.9083 116.9675 59.0874 29.6159 178.5643 42 D 3.7589 7.6850 119.0372 57.2035 40.8438 178.8309 43 I 3.3621 7.1598 120.0843 64.1551 36.8132 178.6257 44 K 3.2706 7.2461 118.1646 58.6030 31.7916 178.3303 45 N 4.3730 7.2617 115.3125 54.5100 39.0972 176.7784 46 F 4.5243 7.2651 118.8915 58.5956 39.4241 176.0402 47 F 4.7165 7.8725 115.7888 56.6204 40.0561 174.2778 48 G 3.7133 8.4685 113.3531 45.8068 0.0000 175.1726 49 S 4.5921 8.2686 114.5653 57.8575 63.7421 174.8549 50 G 4.1449 8.1817 105.8705 45.5772 0.0000 175.5601 51 V 3.6558 8.2377 111.5249 63.9296 31.4366 179.2487 52 V 3.5287 7.7168 117.7988 66.0809 31.4638 178.1344 53 V 3.5897 7.7513 117.2718 65.7204 31.3345 177.6026 54 A 4.1177 7.8203 121.9291 54.6388 18.0148 179.8878 55 V 3.3335 7.6084 116.7003 66.0280 31.5415 178.3938 56 T 3.8493 7.9464 115.6828 66.6600 68.2951 176.6060 57 R 3.6835 8.2650 120.0478 59.2753 29.9821 179.0356 58 A 2.5800 7.2729 120.3170 54.5159 18.1661 179.7075 59 L 4.1346 8.3255 117.7265 57.9121 41.6439 179.6268 60 A 4.1099 8.2375 120.8274 55.2650 18.3499 179.0575 61 Y 4.0434 8.4784 118.5665 60.8795 38.7137 177.7197 62 E 4.0176 8.6167 119.1970 59.3231 29.8434 178.1023 63 A 4.3078 7.7526 118.2381 52.2041 18.7542 177.6910 64 G 3.9846 7.5791 104.9791 45.0738 0.0000 174.7884 65 S 4.3138 8.0618 116.5965 58.0577 63.3718 174.6383 66 S 4.4943 8.4184 118.3663 58.0468 63.9760 175.1040 67 R 4.0380 8.8014 120.9412 59.3911 29.6787 178.7206 68 E 3.9866 8.3236 118.9109 59.5484 29.3808 179.0291 69 S 4.2961 7.9296 112.5100 61.0916 63.3672 176.0407 70 L 2.9578 7.6310 122.4771 56.7074 40.9998 179.2037 71 V 3.5341 7.3281 118.0276 65.8964 31.7211 176.9268 72 A 4.3076 8.0426 120.6623 53.3284 18.7932 177.0893 73 F 4.4689 7.9632 115.4551 59.4100 39.2470 175.9935 74 G 3.9959 9.7636 114.3743 45.2272 0.0000 172.8302 75 T 4.6927 7.6952 109.5066 58.8716 71.4263 175.3021 76 K 3.9666 8.5934 120.5791 59.4975 32.4539 177.3086 77 D 4.7683 7.7554 117.8605 53.6357 40.9952 176.3637 78 E 4.1545 8.0450 118.4211 56.8540 29.8851 177.4928 79 Q 4.4727 8.3234 120.7919 54.1181 28.6664 173.3656 80 I 3.5794 7.4212 120.4753 59.2853 38.3841 174.5997 81 P 4.4191 0.0000 0.0000 62.5180 31.7584 177.3744 82 E 3.9756 8.7200 120.3597 58.9049 29.5562 178.4336 83 A 4.0615 7.9969 120.6591 53.7662 18.7492 177.2052 84 V 4.2881 7.7265 116.5123 61.4140 32.9684 175.5992 85 T 4.6913 8.0082 117.0288 59.6964 72.6572 175.1373 86 Q 4.0143 8.5187 121.3839 59.1851 28.8632 179.2583 87 T 3.8304 7.8290 116.6904 66.6311 68.5428 176.0294 88 E 3.9021 8.2660 121.2006 58.9693 29.6119 178.6483 89 V 3.5234 7.8084 118.4441 66.4671 31.5588 177.9067 90 N 4.4788 8.4051 116.0204 56.1599 36.7056 177.5205 91 R 3.9079 7.8307 120.1081 59.2578 30.1005 178.7566 92 V 3.7371 7.9161 118.1705 66.0427 31.4820 178.0648 93 L 4.1880 8.4747 119.1255 57.7136 41.1622 178.9908 94 E 3.9741 8.0558 118.7880 58.9890 29.8663 178.7381 95 V 3.9998 7.4319 117.0247 65.5589 31.9157 177.7130 96 F 4.3717 8.6431 120.6402 61.3336 39.2807 177.0831 97 K 4.0168 8.6136 118.4267 59.1490 31.9877 177.6440 98 P 4.2896 0.0000 0.0000 65.8232 31.0864 177.7114 99 Y 3.8379 7.7570 118.0800 60.5631 39.0493 176.9984 100 Y 4.1383 8.3514 120.4624 60.7742 38.5888 177.7211 101 A 3.7160 7.6406 119.9980 55.3767 18.5189 178.6961 102 D 4.4164 7.6611 113.9256 55.2812 41.1761 176.6091 103 H 4.6657 7.5103 116.6840 55.5744 29.9722 173.5775 104 C 4.1316 7.7797 112.1260 58.1620 29.9131 172.9523 105 Q 4.4598 7.3444 120.5733 56.0845 28.4485 175.2504 106 I 4.0868 7.5116 118.0579 62.4029 38.6105 177.5144 107 K 4.2184 8.8824 121.9240 57.7584 32.7350 177.5619 108 T 4.5303 7.3024 117.2579 62.8104 69.7549 174.0697 109 G 4.1648 8.1870 112.0782 44.0253 0.0000 169.7055 110 P 5.0505 0.0000 0.0000 62.4327 32.1949 176.6730 111 F 4.3459 8.6063 120.3774 56.6622 40.2554 173.2389 112 P 4.3282 0.0000 0.0000 64.7278 31.7393 176.5168 113 G 4.0205 8.9350 110.9953 45.9295 0.0000 175.6754 114 I 3.7483 7.5555 119.9740 64.3648 37.1299 177.8210 115 L 4.2070 7.9354 118.1595 58.0815 41.7281 178.9284 116 D 4.5320 8.0232 118.1505 57.0948 40.7229 178.5274 117 L 4.0765 7.7182 117.3844 56.1808 42.1218 178.2491 *119 K 4.1661 7.9326 119.6754 56.2542 34.0687 177.6447 120 N 4.3736 8.3473 116.2174 56.3004 38.4043 177.5212 121 L 4.0692 8.3213 120.8259 57.8899 41.7337 179.8074 122 R 4.0378 8.0813 120.0561 59.9310 29.8337 179.5876 123 Q 4.1096 7.9500 119.6945 59.6064 28.1425 180.0957 124 K 4.6264 7.6359 116.1516 56.1899 32.3178 177.5174 125 G 3.8732 7.9379 107.5070 45.5435 0.0000 173.4702 126 V 4.1899 7.5925 119.6104 61.7887 32.3846 176.1316 127 K 4.5092 9.1924 128.0613 56.3657 33.4950 175.9194 128 L 5.6300 9.0394 123.0580 53.1851 45.2501 175.4867 129 A 5.4062 9.3192 123.3239 50.5359 23.6247 174.8090 130 V 4.6592 8.4279 118.9154 60.9800 34.0871 174.7377 131 V 4.9672 8.8503 127.0782 61.4184 34.5306 173.9840 132 S 5.0206 8.8620 121.8574 55.6743 66.0444 173.8475 133 N 4.8002 8.9647 121.0040 53.5429 39.1813 175.5085 134 K 4.1717 8.2985 122.2463 55.3622 33.1617 174.3220 135 P 4.7064 0.0000 0.0000 63.1118 32.9260 176.8657 136 N 4.2855 9.1671 120.8894 56.9586 38.7332 176.9888 137 E 3.9132 8.2585 118.1471 59.5595 29.5489 178.9622 138 A 3.9501 7.9390 121.1675 54.4471 18.6011 179.4421 139 V 3.5264 7.8282 116.8480 66.4251 31.6328 178.2622 140 Q 3.9550 8.2658 117.8298 58.9195 28.5443 179.0392 141 V 3.5622 7.5460 118.8868 66.0950 31.5148 178.1558 142 L 4.0045 7.9365 118.7008 57.7096 41.3660 179.6980 143 V 3.9458 8.0639 118.3753 66.0914 31.2873 177.7584 144 E 3.9605 8.1343 118.0666 59.1368 29.5269 178.1566 145 E 4.1700 8.1075 117.6439 58.3237 29.9385 177.9845 146 L 4.3177 8.1506 117.0142 54.4950 43.9355 176.5667 147 F 5.0603 8.3912 118.2350 55.7601 39.8581 173.2558 148 P 4.4982 0.0000 0.0000 63.9854 31.8825 177.2376 149 G 3.9546 8.8688 109.2782 46.0548 0.0000 174.4937 150 S 4.0987 7.9489 115.6639 60.1604 63.1565 174.6367 151 F 5.1142 7.6866 117.2832 55.8520 40.5984 175.4909 152 D 4.7415 9.2158 124.7195 56.5163 41.5813 176.4767 153 F 4.8924 8.1304 118.9129 57.1330 42.9062 172.6291 154 A 4.9405 7.5083 126.4654 50.3951 22.2102 175.1486 155 L 4.4978 8.8928 124.1190 53.6279 46.0542 175.4780 156 G 4.8748 9.0546 113.8553 43.4593 0.0000 172.1773 157 E 4.3785 8.8502 120.8255 56.1873 31.0015 176.4516 158 K 4.8746 8.4408 124.1655 54.1000 36.2188 175.7020 159 S 4.2092 8.7431 116.8785 60.4524 62.4297 174.6926 160 G 4.0266 9.3134 115.5493 45.1169 0.0000 172.8822 161 I 4.5563 7.1864 119.6217 58.8771 39.9328 175.7564 162 R 4.0007 8.6236 124.5025 56.2188 30.7465 176.8905 163 R 4.2711 8.3408 118.2315 55.1769 30.5738 176.0000 164 K 4.4335 8.6187 118.7777 56.3838 32.3576 175.3487 165 P 4.9467 0.0000 0.0000 61.7749 31.5477 175.9090 166 A 4.1148 7.5560 121.8258 52.2075 18.7315 176.8732 167 P 4.4169 0.0000 0.0000 64.1589 32.1440 178.2903 168 D 4.4933 7.9963 116.8186 56.0823 40.5428 177.9822 *170 T 4.3565 7.8938 118.4916 63.7840 70.6250 176.5466 171 S 4.1249 8.2734 117.9161 61.4007 62.5624 176.3218 172 E 3.9081 8.2463 121.4233 59.4618 29.1346 179.0359 173 C 2.4500 7.5772 117.9196 61.9003 31.6811 175.3347 174 V 3.4701 7.8185 120.2255 65.9197 30.7810 177.7022 175 K 3.8068 7.7589 117.8909 59.6317 32.1046 178.6156 176 V 3.7206 7.0332 116.9136 66.0538 31.5656 177.7648 177 L 4.1900 8.0064 118.1417 55.6077 41.4156 178.2767 178 G 3.8513 7.9916 105.2872 45.9286 0.0000 172.8775 179 V 4.2874 7.4406 118.2662 59.8274 33.1868 173.9992 180 P 4.4222 0.0000 0.0000 62.5153 32.1814 177.6795 181 R 3.9223 8.6806 120.7523 59.2855 30.1396 178.3141 182 D 4.6198 8.0912 115.1735 54.8484 40.0126 176.6436 183 K 4.7111 8.3609 119.4641 56.4419 33.4134 175.1635 184 C 5.4068 7.9840 117.7551 58.0272 30.5342 173.7444 185 V 4.2827 8.0446 120.6093 59.9256 34.4415 173.5423 186 Y 4.6819 8.5910 124.2474 55.8990 41.2798 174.1989 187 I 4.7613 7.2411 126.6675 59.5874 40.6742 174.9550 188 G 4.5633 8.6842 113.0088 45.4168 0.0000 172.8015 189 D 5.0637 8.6540 116.7630 52.8879 41.0657 175.7278 190 S 4.9974 8.3127 113.8344 55.6021 66.6012 174.6650 191 E 4.0802 8.8778 118.2365 59.6466 28.9618 179.1772 192 I 3.7198 7.6763 120.6649 64.2121 37.1133 178.1261 193 D 4.1991 8.0228 119.3564 57.2281 40.8168 178.3333 194 I 3.6849 7.5774 119.9876 64.8101 37.0980 178.5032 195 Q 3.9709 8.1905 118.5118 59.1006 28.6460 178.7828 196 T 3.8198 8.0590 116.8979 66.4827 68.5473 176.2680 197 A 3.8452 7.6814 122.3992 55.2716 18.5672 179.6462 198 R 3.8155 7.6888 116.5550 59.7147 29.9649 178.4266 199 N 4.4862 8.3666 115.0410 55.2092 38.5116 176.4918 200 S 4.6121 7.4068 114.3940 56.6010 64.6824 173.7064 201 E 3.5472 7.4619 121.6938 57.0738 26.5213 173.1657 *203 D 4.5532 7.4608 120.4113 54.0831 43.4070 174.2593 204 E 5.1089 8.4954 119.4194 54.7149 33.1900 174.3019 205 I 4.5930 8.7369 126.3468 59.4232 40.4275 174.2498 206 A 5.1540 8.9648 128.6926 50.4455 21.2736 176.0560 207 V 4.2793 7.8382 114.6347 59.3743 34.0250 175.7211 208 N 4.6922 8.1496 119.7054 52.3080 38.4484 175.8148 209 W 4.6952 7.1543 115.6432 56.3279 29.3609 176.9401 210 G 4.2915 7.1841 107.7514 45.3398 0.0000 175.1165 211 F 4.6506 9.6470 120.7024 58.5028 39.5264 175.8454 212 R 4.4691 7.1161 119.3968 53.7763 32.6925 176.4134 213 S 4.4880 8.1238 115.5704 57.7111 65.4149 175.7032 214 V 3.5850 8.1955 121.5344 65.8982 31.4172 176.3720 215 P 4.2515 0.0000 0.0000 65.3568 31.1171 178.3992 216 F 4.0282 8.3915 119.5617 61.3302 39.3967 177.1664 217 L 4.1207 8.5113 119.0085 57.9433 41.3692 179.5484 218 Q 3.9713 8.3951 118.2117 58.9406 28.4686 178.7712 219 K 3.8526 7.8585 119.2323 59.2770 32.1413 177.4359 220 H 4.5594 7.6056 113.9261 55.2529 28.8116 175.7086 221 G 3.8936 7.6735 108.2719 45.1478 0.0000 174.0544 222 A 4.1970 7.8343 122.5588 52.0520 18.8918 178.2035 223 T 4.3797 8.4845 110.6865 61.5463 71.1180 174.3849 224 V 4.3941 7.6593 122.1091 60.8844 33.9397 174.4319 225 I 5.0377 8.4349 128.1624 59.6304 40.0853 175.3217 226 V 4.7295 8.7969 120.2108 59.5132 35.0007 175.9798 227 D 5.8500 9.2188 119.4035 51.9009 40.6066 175.8769 228 T 4.5355 7.7243 109.6145 59.1881 73.2845 174.2589 229 A 4.0194 8.0689 123.3364 55.2596 18.3763 179.7367 230 E 3.8920 8.0628 117.3457 59.5121 29.7850 179.1046 231 K 4.0735 8.2452 118.5333 59.2303 32.0269 179.1634 232 L 4.0441 8.2700 120.8253 58.0285 42.0372 178.4850 233 E 4.0087 8.6380 119.6901 59.5904 29.6048 178.6738 234 E 3.9893 8.3976 118.2164 59.4039 29.2630 179.2900 235 A 4.0776 8.1221 120.0962 55.2932 18.5336 179.4967 236 I 4.0738 7.9138 117.5005 64.2071 37.3305 177.9727 237 L 4.3855 8.2211 117.8754 54.5126 41.7664 177.7552 238 G 3.8917 7.8076 106.7638 45.9559 0.0000 173.6452 239 E 4.1779 8.1282 122.6985 56.1661 29.9525 176.1276 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 0 G 8.35 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 *2 K 8.91 4.05 0.00 1.53 1.68 0.00 1.57 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 1.02 7.81 3 Y 7.40 4.99 0.00 2.98 2.90 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 4 K 9.08 4.47 0.00 1.76 1.87 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.42 7.81 5 A 7.99 5.28 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 6 A 9.34 4.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.30 4.67 1.78 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 1.23 0.76 0.98 0.00 0.00 8 F 8.92 4.64 0.00 2.79 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 9 D 8.02 5.33 0.00 2.92 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 *11 D 8.67 4.41 0.00 2.53 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 12 G 9.03 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 0.00 0.00 0.00 13 T 7.49 4.44 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 14 I 7.91 4.47 1.89 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.04 0.75 0.00 0.00 15 L 7.95 4.91 0.00 1.79 1.60 1.07 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.39 4.25 0.00 1.58 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 0.00 0.00 0.00 17 T 8.40 4.68 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 1.34 0.00 0.00 18 S 8.20 4.05 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 19 A 7.94 3.98 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 20 D 8.11 4.43 0.00 2.84 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 21 L 8.20 3.96 0.00 1.68 1.29 0.60 -0.47 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 22 T 8.03 3.94 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 1.30 0.00 0.00 23 S 8.35 4.21 0.00 4.00 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 24 A 8.47 4.28 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 0.00 0.00 0.00 0.00 0.00 25 L 8.86 4.29 0.00 2.13 1.86 0.69 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.68 4.52 0.00 3.00 3.06 0.00 0.00 6.70 7.40 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 27 Y 8.38 3.94 0.00 2.82 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.42 4.06 1.82 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 29 F 8.80 3.91 0.00 3.36 3.39 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 30 E 8.56 3.85 0.00 1.83 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 31 Q 7.92 3.95 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.90 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 32 T 7.29 4.50 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 1.23 0.00 0.00 33 G 7.79 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 34 H 7.98 4.88 0.00 3.24 3.54 0.00 5.68 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.93 4.02 0.00 1.78 2.15 0.00 2.95 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.36 0.00 36 H 7.94 4.96 0.00 3.37 3.52 0.00 5.47 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 D 7.34 4.94 0.00 2.70 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 38 F 8.20 4.66 0.00 3.18 2.90 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 39 T 8.80 4.52 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 40 V 8.07 3.69 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 1.27 0.00 0.00 0.90 0.00 0.00 41 E 7.91 3.81 0.00 1.85 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 2.24 2.28 0.00 42 D 7.69 3.76 0.00 2.57 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 0.00 0.00 0.00 43 I 7.16 3.36 1.77 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 1.64 0.70 0.69 0.00 0.00 44 K 7.25 3.27 0.00 1.55 1.77 0.00 1.63 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.32 1.10 7.81 45 N 7.26 4.37 0.00 2.25 2.57 0.00 0.00 6.98 6.76 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 46 F 7.27 4.52 0.00 2.60 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 F 7.87 4.72 0.00 3.33 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 48 G 8.47 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 49 S 8.27 4.59 0.00 3.85 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 50 G 8.18 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 51 V 8.24 3.66 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 1.13 0.00 0.00 1.06 0.00 0.00 52 V 7.72 3.53 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 1.05 0.00 0.00 0.95 0.00 0.00 53 V 7.75 3.59 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.99 0.00 0.00 54 A 7.82 4.12 0.29 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 55 V 7.61 3.33 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 1.09 0.00 0.00 0.76 0.00 0.00 56 T 7.95 3.85 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 1.17 0.00 0.00 57 R 8.27 3.68 0.00 1.72 1.65 0.00 3.17 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.73 0.00 58 A 7.27 2.58 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 59 L 8.33 4.13 0.00 1.86 1.76 0.82 0.59 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 60 A 8.24 4.11 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 61 Y 8.48 4.04 0.00 3.21 3.29 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 62 E 8.62 4.02 0.00 2.32 2.38 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 2.41 2.42 0.00 63 A 7.75 4.31 1.43 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 64 G 7.58 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 65 S 8.06 4.31 0.00 3.99 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 66 S 8.42 4.49 0.00 4.03 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 67 R 8.80 4.04 0.00 1.89 1.96 0.00 3.12 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.82 0.00 68 E 8.32 3.99 0.00 2.04 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 2.44 2.37 0.00 69 S 7.93 4.30 0.00 4.21 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 70 L 7.63 2.96 0.00 1.62 1.31 0.89 0.26 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 71 V 7.33 3.53 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 0.93 0.00 0.00 1.07 0.00 0.00 72 A 8.04 4.31 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 0.00 0.00 0.00 0.00 0.00 0.00 73 F 7.96 4.47 0.00 2.97 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 74 G 9.76 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 75 T 7.70 4.69 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 1.29 0.00 0.00 76 K 8.59 3.97 0.00 2.14 2.00 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.04 7.81 77 D 7.76 4.77 0.00 2.76 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 78 E 8.04 4.15 0.00 1.87 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 2.34 2.14 0.00 79 Q 8.32 4.47 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.96 0.00 0.00 0.00 0.00 0.00 2.46 2.33 0.00 80 I 7.42 3.58 1.60 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.36 0.70 0.00 0.00 81 P 0.00 4.42 0.00 2.21 2.02 0.00 3.66 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 82 E 8.72 3.98 0.00 1.95 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 2.30 2.30 0.00 83 A 8.00 4.06 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 84 V 7.73 4.29 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 0.88 0.00 0.00 0.99 0.00 0.00 85 T 8.01 4.69 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 86 Q 8.52 4.01 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 87 T 7.83 3.83 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 1.20 0.00 0.00 88 E 8.27 3.90 0.00 2.06 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 2.28 2.26 0.00 89 V 7.81 3.52 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 1.00 0.00 0.00 0.89 0.00 0.00 90 N 8.41 4.48 0.00 2.90 2.87 0.00 0.00 6.75 8.51 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 91 R 7.83 3.91 0.00 2.02 2.03 0.00 3.08 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 92 V 7.92 3.74 2.11 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 1.07 0.00 0.00 0.60 0.00 0.00 93 L 8.47 4.19 0.00 1.91 1.84 0.96 0.86 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 94 E 8.06 3.97 0.00 2.16 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 2.39 2.38 0.00 95 V 7.43 4.00 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 0.99 0.00 0.00 96 F 8.64 4.37 0.00 3.34 3.21 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 97 K 8.61 4.02 0.00 2.05 1.97 0.00 1.88 0.00 0.00 1.83 0.00 0.00 3.10 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.76 1.87 7.81 98 P 0.00 4.29 0.00 2.33 2.35 0.00 3.79 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.15 0.00 99 Y 7.76 3.84 0.00 3.17 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 8.35 4.14 0.00 2.15 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 0.00 101 A 7.64 3.72 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 0.00 102 D 7.66 4.42 0.00 2.47 2.36 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 0.00 103 H 7.51 4.67 0.00 2.67 3.00 0.00 5.84 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 C 7.78 4.13 0.00 2.51 1.75 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 0.00 105 Q 7.34 4.46 0.00 1.84 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.94 0.00 0.00 0.00 0.00 0.00 2.14 2.26 0.00 106 I 7.51 4.09 2.05 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 1.23 0.64 0.90 0.00 0.00 107 K 8.88 4.22 0.00 1.83 1.84 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.56 7.81 108 T 7.30 4.53 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 1.21 0.00 0.00 109 G 8.19 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 0.00 110 P 0.00 5.05 0.00 2.10 1.97 0.00 3.63 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.80 0.00 111 F 8.61 4.35 0.00 2.83 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 0.00 112 P 0.00 4.33 0.00 1.95 1.98 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 113 G 8.93 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 0.00 114 I 7.56 3.75 2.11 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 1.72 1.12 1.12 0.00 0.00 115 L 7.94 4.21 0.00 1.59 1.73 0.81 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.02 4.53 0.00 2.83 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 0.00 117 L 7.72 4.08 0.00 1.90 1.88 1.09 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 *119 K 7.93 4.17 0.00 1.90 1.98 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.45 7.81 120 N 8.35 4.37 0.00 2.98 2.97 0.00 0.00 7.09 6.28 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 0.00 121 L 8.32 4.07 0.00 1.71 1.79 1.13 0.92 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 0.00 122 R 8.08 4.04 0.00 1.96 1.96 0.00 3.17 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 123 Q 7.95 4.11 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.98 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 124 K 7.64 4.63 0.00 1.87 1.89 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.61 7.81 125 G 7.94 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 0.00 126 V 7.59 4.19 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 0.86 0.00 0.00 1.05 0.00 0.00 127 K 9.19 4.51 0.00 1.87 1.84 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.50 1.46 7.81 128 L 9.04 5.63 0.00 1.70 1.85 0.79 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 129 A 9.32 5.41 1.43 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 0.00 130 V 8.43 4.66 1.63 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 0.75 0.00 0.00 -0.43 0.00 0.00 131 V 8.85 4.97 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 1.02 0.00 0.00 1.18 0.00 0.00 132 S 8.86 5.02 0.00 3.91 3.63 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 0.00 133 N 8.96 4.80 0.00 2.72 2.98 0.00 0.00 6.91 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 K 8.30 4.17 0.00 2.05 1.75 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.59 1.61 7.81 135 P 0.00 4.71 0.00 2.37 2.13 0.00 3.88 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 2.34 2.33 0.00 136 N 9.17 4.29 0.00 3.01 2.84 0.00 0.00 6.76 7.40 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 0.00 137 E 8.26 3.91 0.00 2.19 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 2.39 2.34 0.00 138 A 7.94 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 139 V 7.83 3.53 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 0.95 0.00 0.00 1.01 0.00 0.00 140 Q 8.27 3.95 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 141 V 7.55 3.56 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.93 0.00 0.00 142 L 7.94 4.00 0.00 1.98 1.77 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 143 V 8.06 3.95 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.89 0.00 0.00 144 E 8.13 3.96 0.00 2.34 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 0.00 2.32 2.22 0.00 145 E 8.11 4.17 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 146 L 8.15 4.32 0.00 1.23 1.02 0.80 0.47 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 0.00 147 F 8.39 5.06 0.00 3.29 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 0.00 148 P 0.00 4.50 0.00 2.18 2.23 0.00 3.84 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 1.98 1.95 0.00 149 G 8.87 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 0.00 150 S 7.95 4.10 0.00 3.65 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 0.00 151 F 7.69 5.11 0.00 3.06 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 0.00 152 D 9.22 4.74 0.00 2.77 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 0.00 153 F 8.13 4.89 0.00 3.14 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 0.00 154 A 7.51 4.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 L 8.89 4.50 0.00 1.35 1.53 0.94 0.93 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 0.00 156 G 9.05 4.87 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 0.00 157 E 8.85 4.38 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 158 K 8.44 4.87 0.00 1.82 1.64 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.59 7.81 159 S 8.74 4.21 0.00 3.85 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 0.00 160 G 9.31 4.03 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 0.00 0.00 0.00 161 I 7.19 4.56 1.90 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 1.32 1.02 0.94 0.00 0.00 162 R 8.62 4.00 0.00 1.80 1.88 0.00 3.21 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 163 R 8.34 4.27 0.00 2.23 2.09 0.00 3.05 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 164 K 8.62 4.43 0.00 1.85 1.73 0.00 1.90 0.00 0.00 1.91 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.38 7.81 165 P 0.00 4.95 0.00 2.12 2.22 0.00 3.37 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.05 0.00 166 A 7.56 4.11 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 0.00 167 P 0.00 4.42 0.00 2.20 2.43 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 168 D 8.00 4.49 0.00 2.82 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 *170 T 7.89 4.36 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 1.21 0.00 0.00 171 S 8.27 4.12 0.00 3.99 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 0.00 172 E 8.25 3.91 0.00 2.08 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 2.55 2.58 0.00 173 C 7.58 2.45 0.00 2.60 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 V 7.82 3.47 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 0.97 0.00 0.00 0.93 0.00 0.00 175 K 7.76 3.81 0.00 1.82 1.99 0.00 1.85 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.44 7.81 176 V 7.03 3.72 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 1.02 0.00 0.00 1.02 0.00 0.00 177 L 8.01 4.19 0.00 1.59 1.71 0.94 0.89 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 0.00 178 G 7.99 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 0.00 179 V 7.44 4.29 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 0.92 0.00 0.00 0.95 0.00 0.00 180 P 0.00 4.42 0.00 2.31 1.96 0.00 3.68 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 2.12 2.11 0.00 181 R 8.68 3.92 0.00 1.87 2.14 0.00 3.11 0.00 0.00 3.55 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 182 D 8.09 4.62 0.00 2.81 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 0.00 183 K 8.36 4.71 0.00 1.85 1.88 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.55 7.81 184 C 7.98 5.41 0.00 3.02 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 0.00 185 V 8.04 4.28 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.47 0.00 0.00 186 Y 8.59 4.68 0.00 3.04 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 0.00 187 I 7.24 4.76 1.25 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.09 0.86 0.00 0.00 188 G 8.68 4.56 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 0.00 0.00 0.00 189 D 8.65 5.06 0.00 2.50 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.31 5.00 0.00 4.00 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 0.00 191 E 8.88 4.08 0.00 2.22 2.40 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 2.43 2.41 0.00 192 I 7.68 3.72 1.88 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 1.55 1.15 0.94 0.00 0.00 193 D 8.02 4.20 0.00 2.95 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 0.00 194 I 7.58 3.68 2.04 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 1.64 1.13 0.94 0.00 0.00 195 Q 8.19 3.97 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 196 T 8.06 3.82 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 0.67 0.00 0.00 197 A 7.68 3.85 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 0.00 198 R 7.69 3.82 0.00 1.86 1.90 0.00 3.08 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 199 N 8.37 4.49 0.00 2.74 2.82 0.00 0.00 6.97 7.55 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 0.00 200 S 7.41 4.61 0.00 3.82 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 E 7.46 3.55 0.00 2.13 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 2.39 0.00 *203 D 7.46 4.55 0.00 2.55 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 E 8.50 5.11 0.00 1.90 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 205 I 8.74 4.59 1.75 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 1.15 0.72 0.87 0.00 0.00 206 A 8.96 5.15 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 0.00 207 V 7.84 4.28 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.01 0.00 0.00 208 N 8.15 4.69 0.00 2.78 3.00 0.00 0.00 6.73 8.46 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 0.00 209 W 7.15 4.70 0.00 3.08 3.21 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 0.00 210 G 7.18 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 0.00 0.00 0.00 0.00 211 F 9.65 4.65 0.00 2.86 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 0.00 212 R 7.12 4.47 0.00 1.84 1.64 0.00 2.21 0.00 0.00 2.84 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.48 0.00 213 S 8.12 4.49 0.00 4.08 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 0.00 214 V 8.20 3.58 2.11 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 1.21 0.00 0.00 0.95 0.00 0.00 215 P 0.00 4.25 0.00 2.26 2.12 0.00 3.71 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 2.15 2.17 0.00 216 F 8.39 4.03 0.00 3.13 3.21 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 0.00 217 L 8.51 4.12 0.00 1.89 1.74 0.92 0.99 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 0.00 218 Q 8.40 3.97 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 219 K 7.86 3.85 0.00 1.74 1.80 0.00 1.65 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.09 1.32 7.81 220 H 7.61 4.56 0.00 3.06 3.22 0.00 5.87 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 0.00 221 G 7.67 3.89 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 0.00 0.00 0.00 222 A 7.83 4.20 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 0.00 223 T 8.48 4.38 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 1.25 0.00 0.00 224 V 7.66 4.39 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 1.09 0.00 0.00 0.96 0.00 0.00 225 I 8.43 5.04 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.78 0.87 0.00 0.00 226 V 8.80 4.73 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 0.92 0.00 0.00 1.03 0.00 0.00 227 D 9.22 5.85 0.00 2.92 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 0.00 228 T 7.72 4.54 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 1.22 0.00 0.00 229 A 8.07 4.02 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 0.00 230 E 8.06 3.89 0.00 2.14 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 0.00 2.37 1.97 0.00 231 K 8.25 4.07 0.00 2.07 1.92 0.00 1.82 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.64 7.81 232 L 8.27 4.04 0.00 2.10 2.09 1.00 1.06 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 0.00 233 E 8.64 4.01 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 234 E 8.40 3.99 0.00 2.26 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 2.36 2.55 0.00 235 A 8.12 4.08 1.43 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 0.00 236 I 7.91 4.07 1.98 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 1.47 0.72 1.04 0.00 0.00 237 L 8.22 4.39 0.00 1.65 1.74 0.96 0.82 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 0.00 238 G 7.81 3.89 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 0.00 0.00 0.00 239 E 8.13 4.18 0.00 2.36 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.86 0.00 * Residues marked with a * may have inaccurate shift predictions.