NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 V 4.1252 7.9127 120.3831 62.7149 32.8310 173.7398 17 V 4.2703 7.9906 127.2757 61.2461 32.5318 174.4763 18 G 3.6443 8.7916 114.4270 46.4484 0.0000 173.4811 19 G 3.9968 7.5807 109.8119 44.1174 0.0000 172.8424 20 E 4.6759 7.7007 117.8651 54.1470 34.6165 174.9235 21 D 4.9278 8.5834 120.9087 54.6466 41.2358 176.7434 22 A 4.7951 9.0653 126.0683 51.6703 19.9726 176.7576 23 K 4.5442 8.9524 118.6003 53.8468 34.1179 175.0123 24 P 4.4132 0.0000 0.0000 64.3503 31.5241 177.2823 25 G 3.7204 9.0368 110.2508 45.5869 0.0000 174.1155 26 Q 3.5699 7.7835 121.1785 58.0107 29.6853 176.2892 27 F 3.3405 7.0553 115.4293 54.1197 39.3706 173.4328 28 P 4.3718 0.0000 0.0000 64.1696 31.8091 178.7995 29 W 5.2346 6.5184 115.0265 56.8125 29.0234 175.6631 30 Q 4.7272 7.5993 121.8666 56.3363 29.1212 175.4895 31 V 5.0266 9.0644 118.6451 59.5965 36.5024 174.6404 32 V 4.6991 8.2931 121.1044 59.9730 34.4678 174.3492 33 L 5.0639 8.3266 122.4254 53.1022 44.0845 175.1138 34 N 5.3484 9.1550 121.0646 50.7279 41.6502 172.4347 35 G 4.0494 9.2522 113.1551 45.3230 0.0000 175.8058 36 K 4.0211 8.8435 123.7898 58.5805 32.4273 176.6749 *38 V 4.6062 7.4200 117.3804 62.6866 32.3385 174.2415 39 D 4.7946 8.6517 125.5160 54.8746 41.8446 175.6848 40 A 3.7484 8.9528 123.3627 53.3057 16.5094 178.0780 41 F 4.6556 7.8828 115.0790 59.7234 39.3582 175.5999 42 C 4.8907 7.1775 115.5621 56.3920 44.9580 172.3241 43 G 4.5961 8.7201 108.0834 45.3055 0.0000 171.6741 44 G 4.6673 8.2661 105.1136 46.3727 0.0000 172.5768 45 S 5.5920 8.9257 114.9806 56.5455 67.3256 174.1255 46 I 4.1856 8.9680 125.3243 61.6327 37.3449 177.0923 47 V 3.7672 9.0282 128.3253 64.9047 32.0382 174.8634 48 N 4.8568 7.6794 114.2089 52.1222 39.5878 174.1488 49 E 4.0281 8.9608 116.4753 59.0541 29.6047 178.6578 50 K 4.4328 8.7536 115.7964 55.6410 33.6047 175.3666 51 W 5.6368 8.3012 119.1056 54.8881 33.5679 174.1818 52 I 5.2380 9.0658 124.2370 59.4924 40.2069 174.7249 53 V 4.9103 8.8388 125.9729 60.7599 33.9281 175.0141 54 T 5.2212 8.8316 117.0652 61.5794 71.1251 171.7396 55 A 4.7272 8.5670 122.1959 50.7654 20.8218 178.5426 56 A 3.7854 8.2895 124.4408 55.2076 18.4876 179.2561 57 H 4.5533 8.5364 109.8713 57.3261 28.8215 175.7710 58 C 4.5917 7.8172 117.2364 58.5564 40.4724 173.7248 59 V 4.7269 7.4033 110.8706 59.4406 34.7912 174.8040 60 E 4.7053 8.2994 119.7276 54.6214 33.1961 175.4430 60A T 4.1371 8.5144 114.1746 63.2679 69.1472 174.6890 61 G 3.8856 9.0102 112.3814 45.2218 0.0000 172.9880 62 V 4.2378 7.3532 119.7534 60.4442 32.6609 175.6581 63 K 4.1925 8.4988 126.8188 56.9810 32.8113 176.2957 64 I 4.9698 8.0489 121.1790 60.2477 41.9126 173.8397 65 T 4.9799 8.9315 122.7426 61.7819 71.3034 173.3388 66 V 4.6903 8.9502 126.0361 61.0535 34.5183 174.4282 67 V 4.8209 8.4875 126.7248 61.2385 33.9804 174.5191 68 A 4.7096 9.1392 130.4197 50.6624 21.7605 176.7413 69 G 4.3313 8.5734 104.1717 45.4377 0.0000 173.5226 70 E 4.4370 8.1997 119.0791 55.3972 30.7868 173.7840 71 H 5.0612 8.7351 122.4450 56.9267 32.4320 171.6911 72 N 5.5477 9.0525 119.7731 51.5989 40.4915 174.4169 73 I 4.0242 8.7001 119.7095 61.8700 37.8372 176.3936 74 E 4.6573 9.0000 121.3905 56.0755 30.4248 175.1082 75 E 4.7221 8.0297 117.0163 54.9100 33.5713 174.9432 76 T 4.6069 8.3707 117.2377 62.5331 69.3521 174.8214 77 E 4.2814 9.6381 125.9472 55.8421 30.4295 177.0421 78 H 4.3154 8.4547 114.9739 56.5334 26.7700 175.1647 79 T 4.4182 7.0826 108.9789 61.3521 70.4595 173.9532 80 E 4.4361 8.1221 122.3578 56.5767 30.5985 176.2780 81 Q 4.4860 9.1161 122.3885 54.0970 32.1449 174.0951 82 K 4.9827 8.6865 125.7282 55.0127 33.9828 175.6467 83 R 4.7392 9.0768 125.1710 54.5210 35.0289 173.4494 84 N 5.0159 8.8470 120.5992 52.2843 41.0326 173.9823 85 V 4.4507 8.2247 126.3731 62.5051 32.0030 175.6123 86 I 4.4099 8.6490 120.7412 60.8532 38.9212 175.5875 87 R 4.6323 7.5270 123.0961 55.3590 33.6137 173.1776 88 I 4.8665 8.5247 126.5080 59.7811 39.9799 175.3241 89 I 4.5879 9.1907 128.7926 58.7443 38.5899 173.3684 90 P 4.8115 0.0000 0.0000 61.8489 32.5383 175.9324 91 H 3.7121 8.7378 122.4861 56.1832 30.1779 176.3127 92 H 4.2336 8.1070 120.8833 58.2991 28.3530 175.8947 93 N 4.4942 7.7271 115.2652 53.7354 38.9886 174.6403 94 Y 3.9967 7.6283 120.7888 57.5186 39.3766 175.2648 95 N 4.2671 7.5376 125.2349 52.0933 40.1370 174.0817 95A A 3.7313 8.2271 129.2751 54.1368 18.6636 179.4593 95B A 4.0076 7.7331 117.4770 54.4314 18.4873 178.1509 96 I 4.2572 7.3547 116.0461 61.0540 38.0699 173.7147 97 N 4.0326 7.3214 118.4022 52.4529 40.9088 174.9167 98 K 3.9339 8.1086 124.4496 57.5121 32.0504 176.8697 99 Y 4.8676 8.7499 115.5249 57.0700 39.9375 174.7716 100 N 4.5721 8.0807 119.0785 54.0662 39.7881 173.9821 101 H 4.3948 8.6141 120.4587 56.7932 26.0794 175.8700 102 D 4.6714 8.0453 119.1731 53.2122 39.0333 174.1675 103 I 4.7970 7.2033 120.5016 59.4181 41.9861 172.6336 104 A 5.4783 9.2741 128.8956 50.8456 23.3563 174.7850 105 L 5.3650 9.2244 119.1327 52.9640 45.4191 175.7463 106 L 5.2618 9.3353 122.6091 52.9887 45.0111 174.9554 107 E 3.7353 8.7449 125.1300 54.4069 31.1445 174.9642 108 L 4.7916 8.0032 127.2406 53.8466 42.7823 176.7866 109 D 4.4020 8.8080 122.6380 56.0734 39.6481 176.1959 110 E 4.6389 7.8193 119.1672 52.2799 31.9781 173.3995 111 P 4.6344 0.0000 0.0000 63.0052 31.9324 176.0700 112 L 4.3192 8.7224 122.2671 54.8767 42.7469 176.8132 113 V 4.2415 8.9380 122.1614 61.0536 32.3104 175.7851 114 L 4.4255 8.5396 129.0705 55.0418 42.6100 176.5330 115 N 4.7830 8.7073 118.6714 52.5946 39.8168 174.9462 116 S 4.0032 8.7277 113.1581 61.4680 62.9141 174.6751 117 Y 4.3912 8.5815 116.6713 57.7159 38.7234 175.3514 118 V 4.7791 7.8628 119.3386 61.3151 32.8190 173.3477 119 T 5.0418 8.6658 122.5282 60.8850 72.8931 172.2025 120 P 4.9932 0.0000 0.0000 62.6457 32.4335 175.4731 121 I 3.9373 8.2933 122.2324 60.0649 39.1737 175.3161 122 C 4.2633 7.7113 125.9217 59.4710 29.5054 173.1816 123 I 4.7040 8.0944 121.5092 59.6147 39.2604 175.5104 124 A 4.5402 8.8437 129.0566 50.7643 20.0379 176.1750 125 D 4.7238 8.2647 119.7601 52.7684 41.7609 177.2792 126 K 3.9130 8.4987 118.8321 60.1275 32.3213 178.7426 127 E 3.7668 8.0954 119.1046 59.6561 29.5276 178.9480 128 Y 3.2775 8.9139 116.6567 60.6826 37.7691 178.4963 129 T 3.8079 7.8732 117.1257 66.6094 68.5485 176.1227 129A N 4.1845 7.8236 118.4380 56.5073 38.7052 177.0423 129B I 3.4440 6.8939 120.3979 64.2984 37.3909 178.1268 130 F 3.3238 7.8413 118.9321 59.9947 38.6253 177.4708 131 L 3.8045 7.8458 120.0568 57.9242 41.6776 178.5612 132 K 4.2026 7.5851 115.0350 57.4356 32.0292 178.6546 133 F 4.7299 7.8546 119.2078 58.8356 39.1095 176.3893 134 G 3.9194 9.2936 106.6662 44.8664 0.0000 172.5291 135 S 4.8598 7.7105 113.8283 56.7344 65.2764 172.9889 136 G 4.1136 8.9273 113.2593 44.6946 0.0000 170.2141 137 Y 5.7217 8.9674 117.4567 56.2878 40.5852 175.8096 138 V 5.3157 9.2250 116.7284 59.0302 35.2771 174.8132 139 S 4.7771 8.2211 116.3238 56.5916 66.2004 173.2008 140 G 3.7979 7.4272 108.7399 46.1655 0.0000 172.5334 141 W 4.5554 8.4849 116.8241 56.4385 30.2900 177.2250 142 G 3.9940 8.5010 109.5895 45.6579 0.0000 173.5760 143 R 4.9981 8.6926 119.2212 56.3032 30.1880 178.1941 144 V 4.5732 8.3125 113.9745 61.1996 32.7775 175.8176 145 F 4.8498 7.3399 118.1525 55.9813 43.2454 172.8250 142 H 4.7640 8.5910 118.9895 55.5579 29.9510 172.7760 143 K 4.9781 8.7526 119.1212 56.5032 32.3880 178.4941 144 G 4.4132 8.6125 103.5745 44.0996 0.0000 174.4176 145 R 4.5698 7.2699 118.3525 54.2813 34.5454 173.3250 151 S 4.4897 8.6314 116.9364 57.9630 63.3638 173.5830 152 A 4.2233 8.2745 126.3631 52.3882 18.7954 177.4274 153 L 4.3791 8.7191 119.9240 56.6824 43.4292 176.8778 154 V 4.7569 7.6096 117.0948 60.7387 33.2820 175.3619 155 L 2.8199 8.3579 129.3182 55.8306 42.8144 175.8466 156 Q 5.2018 8.2119 124.7977 54.4686 31.7835 174.1462 157 Y 5.1089 8.3290 118.7768 55.6251 42.1461 173.7357 158 L 4.7942 8.8475 121.5412 53.9138 46.2312 174.1058 159 R 5.1338 8.9054 126.7209 55.8776 31.2368 175.6385 160 V 4.4729 9.0450 120.0032 58.8252 35.3548 173.2717 161 P 4.9269 0.0000 0.0000 61.7366 33.2001 175.0805 162 L 4.3648 8.3733 124.4894 55.1962 42.8159 176.0779 163 V 4.3337 8.1563 125.9674 60.4646 33.4608 175.2233 164 D 4.4257 8.6350 127.0872 53.4579 40.0374 177.1251 165 R 3.8382 8.8577 121.3045 59.7269 30.0151 178.2826 166 A 3.9947 8.0827 119.8178 55.9594 18.0559 179.5081 167 T 3.8709 8.9134 113.2465 66.9022 68.7257 175.8345 168 C 4.6433 7.8810 121.1365 59.2486 41.9984 175.5247 169 L 3.8941 8.2743 120.9032 57.8496 40.9894 179.2509 170 R 4.0990 7.7958 115.6281 57.5483 30.3509 177.9969 171 S 4.5208 8.2949 114.0537 58.8944 63.5954 173.5164 172 T 4.7779 6.8988 115.6161 60.3763 70.3134 173.4416 173 K 4.1658 8.3262 124.1797 57.4236 33.4056 176.9940 174 F 4.7051 7.7838 118.8475 56.8802 39.9607 175.3585 175 T 3.9514 8.4959 119.9260 63.4670 68.6897 174.7764 176 I 4.4609 8.0154 127.6102 59.7097 37.4522 175.1130 177 Y 4.4213 8.3156 123.4124 57.2568 38.5741 177.0148 178 N 4.5863 8.8191 118.0347 55.8063 38.9151 175.8488 179 N 4.9046 8.3095 115.2684 53.4318 38.8707 173.8361 180 M 5.6327 8.1880 117.6186 53.6236 36.2419 174.4070 181 F 5.1911 8.9902 115.0060 55.6552 42.2993 172.6169 182 C 5.6439 8.8867 115.4752 55.5303 40.6821 172.9639 183 A 4.9020 8.7037 122.2397 50.8242 22.7389 177.4149 184 G 4.0681 6.8996 107.3745 44.5792 0.0000 171.7263 184A F 4.9016 8.3575 118.1893 55.6560 41.3976 176.5364 185 H 4.4036 9.0301 122.4527 58.9091 28.7365 177.0952 186 E 4.0162 8.3538 115.3030 56.7592 30.0318 177.2260 187 G 3.8119 7.6005 107.1940 44.9603 0.0000 172.7494 188 G 4.0660 9.6469 106.6193 44.9247 0.0000 174.2409 188A R 5.3053 7.1530 116.7035 53.7653 33.9326 174.0182 189 D 4.6327 8.2995 121.6847 53.9102 44.6436 175.0374 190 S 4.8551 8.8298 116.5311 58.2975 64.9020 173.4349 191 C 4.7947 9.4043 119.2141 55.3352 46.5116 172.5808 192 Q 4.3915 8.5587 118.9531 57.7538 28.5214 176.7440 193 G 4.1842 9.1501 110.3144 45.7582 0.0000 174.2277 194 D 4.5247 8.3389 118.5821 55.5336 41.7291 176.5643 195 A 4.3941 7.9436 121.9881 54.0705 19.0092 177.9011 196 G 4.4142 8.8241 109.7630 46.4741 0.0000 174.0833 197 G 4.4029 7.9673 107.0823 45.3979 0.0000 171.2194 198 P 5.3550 0.0000 0.0000 62.2136 33.8668 174.4462 199 H 5.2656 9.0868 120.8370 54.8000 32.2552 172.9009 200 V 5.0556 9.0119 119.0607 59.8283 35.8731 174.8280 201 T 4.7717 8.7659 119.2870 61.7333 71.4517 172.8009 202 E 4.5739 8.7778 128.1049 55.2976 30.8750 175.7462 203 V 4.1012 8.9579 127.7206 61.5209 32.2475 174.7534 204 E 3.8940 9.7806 130.5033 57.1673 27.7453 175.4103 205 G 3.9687 8.6357 105.0959 45.0501 0.0000 173.5340 206 T 4.5127 7.7472 117.1929 61.7224 70.9829 173.6633 207 S 4.8382 8.3335 122.8516 57.8587 64.5940 173.2032 208 F 4.8572 8.9209 122.5807 55.2209 42.4915 174.2932 209 L 4.5382 8.8962 126.0550 55.4769 41.4229 176.4149 210 T 4.6490 9.2518 116.5204 61.9765 71.4634 173.7548 211 G 4.8372 7.9900 107.9378 46.6864 0.0000 171.8011 212 I 5.2491 8.2314 119.8874 58.9946 40.6451 175.5214 213 I 3.5092 8.8514 128.3458 62.1622 37.3715 174.5008 214 S 4.8702 8.4554 120.3937 58.4223 64.4296 175.2000 215 W 4.8974 7.7727 114.9258 56.3984 32.1181 172.5845 216 G 3.7087 7.9682 105.3267 47.0404 0.0000 172.6950 217 E 4.5840 8.7318 119.7978 54.6585 30.0268 175.5605 217 E 4.5840 8.7318 119.7978 54.6585 30.0268 175.5605 220 C 4.9183 7.8580 116.2451 57.5231 43.1135 173.5504 221 A 4.3830 9.1132 124.1876 53.3252 16.8751 176.8104 221A M 4.5793 7.2394 117.6121 55.3412 33.0939 176.2551 222 K 4.0119 8.4165 123.6944 58.0246 32.7103 177.0719 223 G 3.8617 8.8629 113.7234 45.4656 0.0000 173.1948 224 K 4.3403 7.3313 117.2134 54.3370 35.4205 174.9497 225 Y 4.9240 7.9052 118.0025 55.8347 42.0703 175.4761 226 G 3.7058 8.8629 108.6657 46.3034 0.0000 172.5982 227 I 4.6590 7.8975 124.1766 59.2629 39.4890 174.4518 228 Y 4.7966 8.4602 123.6091 56.0080 42.0826 174.9226 229 T 4.5346 8.6615 119.2499 63.2787 69.7793 174.1329 230 K 4.4735 9.4767 129.0215 55.9197 32.2904 177.5021 231 V 3.9444 8.7294 128.5696 65.9992 31.6163 177.5930 232 S 4.2708 8.3690 113.7034 61.8562 62.2682 176.5322 233 R 3.9965 7.6247 119.1702 57.6784 30.1403 176.6883 234 Y 4.8259 8.1758 115.1221 57.2706 39.5660 177.7209 235 V 3.8075 7.7621 114.3342 64.6889 31.5645 178.0555 236 N 4.3662 8.2568 115.6422 56.0876 38.3894 177.0910 237 W 4.2322 8.3727 129.2526 60.4474 30.9390 177.8971 238 I 3.1955 8.2597 119.7837 64.2902 36.1237 178.5243 239 K 3.8489 8.2077 119.4274 59.3191 31.6252 179.0698 240 E 3.8431 7.9265 118.4200 59.3464 29.7106 178.8343 241 K 3.7318 7.5558 117.4428 58.5425 32.0623 178.5056 242 T 2.5916 6.7932 107.1268 59.5342 69.4063 174.9345 243 K 3.7986 6.7241 122.8412 57.2665 32.5069 176.2182 244 L 4.5103 8.4003 125.3014 55.9224 42.8347 176.6114 245 T 4.0586 7.8238 112.6893 61.8425 68.6731 173.9716 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 16 V 7.91 4.13 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 0.92 0.00 0.00 0.90 0.00 0.00 17 V 7.99 4.27 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 1.28 0.00 0.00 0.98 0.00 0.00 18 G 8.79 3.64 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 0.00 0.00 0.00 19 G 7.58 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 20 E 7.70 4.68 0.00 1.29 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 0.00 2.00 2.25 0.00 21 D 8.58 4.93 0.00 2.57 2.66 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 22 A 9.07 4.80 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 23 K 8.95 4.54 0.00 1.72 1.68 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.40 7.81 24 P 0.00 4.41 0.00 2.10 2.01 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.60 0.00 25 G 9.04 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 7.78 3.57 0.00 1.78 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 7.17 0.00 0.00 0.00 0.00 0.00 1.16 1.63 0.00 27 F 7.06 3.34 0.00 2.77 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 0.00 0.00 0.00 0.00 28 P 0.00 4.37 0.00 2.22 2.24 0.00 2.20 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.75 0.00 29 W 6.52 5.23 0.00 3.63 3.69 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 30 Q 7.60 4.73 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.74 0.00 0.00 0.00 0.00 0.00 2.10 2.67 0.00 31 V 9.06 5.03 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 0.93 0.00 0.00 1.04 0.00 0.00 32 V 8.29 4.70 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 0.38 0.00 0.00 0.68 0.00 0.00 33 L 8.33 5.06 0.00 0.59 1.17 0.79 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.15 5.35 0.00 2.60 2.84 0.00 0.00 6.28 8.22 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 35 G 9.25 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.84 4.02 0.00 1.73 1.83 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.49 1.35 7.81 *38 V 7.42 4.61 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 1.44 0.00 0.00 0.97 0.00 0.00 39 D 8.65 4.79 0.00 2.71 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 40 A 8.95 3.75 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 41 F 7.88 4.66 0.00 3.06 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 42 C 7.18 4.89 0.00 2.18 2.87 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 43 G 8.72 4.60 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 0.00 0.00 0.00 44 G 8.27 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.93 5.59 0.00 3.87 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 46 I 8.97 4.19 2.05 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 1.22 0.91 1.08 0.00 0.00 47 V 9.03 3.77 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.01 0.00 0.00 48 N 7.68 4.86 0.00 3.02 2.96 0.00 0.00 6.21 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.96 4.03 0.00 2.14 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 0.00 2.43 2.45 0.00 50 K 8.75 4.43 0.00 1.80 1.42 0.00 1.49 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.34 1.51 7.81 51 W 8.30 5.64 0.00 3.17 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 52 I 9.07 5.24 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.02 1.05 0.00 0.00 53 V 8.84 4.91 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 0.85 0.00 0.00 1.15 0.00 0.00 54 T 8.83 5.22 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 1.31 0.00 0.00 55 A 8.57 4.73 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.29 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.54 4.55 0.00 3.27 3.61 0.00 5.56 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.82 4.59 0.00 3.24 3.40 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 59 V 7.40 4.73 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 0.82 0.00 0.00 1.00 0.00 0.00 60 E 8.30 4.71 0.00 1.96 1.79 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 2.31 2.29 0.00 60A T 8.51 4.14 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 1.27 0.00 0.00 61 G 9.01 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 62 V 7.35 4.24 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 0.77 0.00 0.00 0.97 0.00 0.00 63 K 8.50 4.19 0.00 1.78 1.74 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.46 7.81 64 I 8.05 4.97 1.93 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 1.56 0.88 1.02 0.00 0.00 65 T 8.93 4.98 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 66 V 8.95 4.69 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 0.97 0.00 0.00 0.92 0.00 0.00 67 V 8.49 4.82 1.90 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 0.87 0.00 0.00 0.83 0.00 0.00 68 A 9.14 4.71 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 69 G 8.57 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.20 4.44 0.00 1.77 1.79 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 1.47 2.04 0.00 71 H 8.74 5.06 0.00 3.34 3.45 0.00 5.87 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.05 5.55 0.00 2.85 2.89 0.00 0.00 7.12 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.70 4.02 1.60 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.64 -0.10 0.00 0.00 74 E 9.00 4.66 0.00 2.00 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 2.20 2.22 0.00 75 E 8.03 4.72 0.00 1.98 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00 76 T 8.37 4.61 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 1.28 0.00 0.00 77 E 9.64 4.28 0.00 1.96 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 78 H 8.45 4.32 0.00 3.22 3.36 0.00 5.62 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 7.08 4.42 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 0.26 0.00 0.00 80 E 8.12 4.44 0.00 1.81 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 2.25 2.55 0.00 81 Q 9.12 4.49 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 82 K 8.69 4.98 0.00 1.98 1.66 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.34 1.02 7.81 83 R 9.08 4.74 0.00 1.64 1.80 0.00 3.52 0.00 0.00 3.07 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 84 N 8.85 5.02 0.00 2.80 2.77 0.00 0.00 6.95 7.81 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 85 V 8.22 4.45 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 0.87 0.00 0.00 0.96 0.00 0.00 86 I 8.65 4.41 1.81 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 1.08 0.66 0.85 0.00 0.00 87 R 7.53 4.63 0.00 1.80 1.63 0.00 3.26 0.00 0.00 3.57 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 88 I 8.52 4.87 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.82 0.98 0.00 0.00 89 I 9.19 4.59 2.05 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 1.40 1.11 1.15 0.00 0.00 90 P 0.00 4.81 0.00 2.04 1.93 0.00 3.81 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 2.11 2.13 0.00 91 H 8.74 3.71 0.00 2.36 2.79 0.00 5.59 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.11 4.23 0.00 3.28 3.43 0.00 5.57 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 N 7.73 4.49 0.00 2.35 2.39 0.00 0.00 6.86 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.63 4.00 0.00 2.97 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 95 N 7.54 4.27 0.00 2.54 2.41 0.00 0.00 7.09 8.36 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 95A A 8.23 3.73 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 95B A 7.73 4.01 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 96 I 7.35 4.26 1.75 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 1.08 0.90 0.87 0.00 0.00 97 N 7.32 4.03 0.00 2.72 2.80 0.00 0.00 7.27 7.41 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 98 K 8.11 3.93 0.00 0.79 1.08 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.18 1.24 7.81 99 Y 8.75 4.87 0.00 2.43 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 0.00 100 N 8.08 4.57 0.00 2.21 2.38 0.00 0.00 7.11 7.89 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 0.00 101 H 8.61 4.39 0.00 3.40 3.24 0.00 5.80 0.00 0.00 0.00 0.00 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.05 4.67 0.00 3.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.20 4.80 1.56 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.26 0.03 0.00 0.00 104 A 9.27 5.48 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 0.00 105 L 9.22 5.36 0.00 1.59 1.75 -0.33 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 106 L 9.34 5.26 0.00 1.55 1.53 0.96 0.76 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 0.00 107 E 8.74 3.74 0.00 1.16 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.47 0.00 108 L 8.00 4.79 0.00 1.41 1.48 0.94 1.08 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 0.00 109 D 8.81 4.40 0.00 2.63 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 E 7.82 4.64 0.00 1.88 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 2.15 2.17 0.00 111 P 0.00 4.63 0.00 2.11 2.03 0.00 3.79 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 112 L 8.72 4.32 0.00 1.54 1.67 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.94 4.24 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 0.78 0.00 0.00 0.94 0.00 0.00 114 L 8.54 4.43 0.00 1.70 1.62 0.95 1.15 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 0.00 115 N 8.71 4.78 0.00 2.96 2.96 0.00 0.00 6.77 6.73 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 0.00 116 S 8.73 4.00 0.00 3.44 3.46 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 0.00 117 Y 8.58 4.39 0.00 3.10 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 0.00 118 V 7.86 4.78 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.04 0.00 0.00 119 T 8.67 5.04 4.38 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 1.32 0.00 0.00 120 P 0.00 4.99 0.00 1.96 2.13 0.00 3.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 121 I 8.29 3.94 1.60 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.32 0.94 0.00 0.00 122 C 7.71 4.26 0.00 1.65 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 0.00 0.00 0.00 123 I 8.09 4.70 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.76 1.00 0.00 0.00 124 A 8.84 4.54 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 0.00 125 D 8.26 4.72 0.00 2.98 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 K 8.50 3.91 0.00 2.04 2.16 0.00 1.48 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.49 7.81 127 E 8.10 3.77 0.00 2.17 1.79 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 2.33 2.37 0.00 128 Y 8.91 3.28 0.00 2.78 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.87 3.81 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 1.30 0.00 0.00 129A N 7.82 4.18 0.00 2.74 2.78 0.00 0.00 7.25 7.56 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 129B I 6.89 3.44 1.25 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.39 0.61 0.00 0.00 130 F 7.84 3.32 0.00 2.87 2.60 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 0.00 131 L 7.85 3.80 0.00 1.61 1.62 -0.23 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 132 K 7.59 4.20 0.00 1.87 1.81 0.00 1.69 0.00 0.00 1.57 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.64 1.52 7.81 133 F 7.85 4.73 0.00 3.11 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 9.29 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 0.00 135 S 7.71 4.86 0.00 3.78 3.64 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 0.00 136 G 8.93 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 8.97 5.72 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 0.00 138 V 9.22 5.32 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 1.11 0.00 0.00 139 S 8.22 4.78 0.00 3.30 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 0.00 140 G 7.43 3.80 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 0.00 0.00 0.00 0.00 141 W 8.48 4.56 0.00 3.29 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.50 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.69 5.00 0.00 1.70 2.13 0.00 3.16 0.00 0.00 3.13 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 144 V 8.31 4.57 1.52 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 0.49 0.00 0.00 0.31 0.00 0.00 145 F 7.34 4.85 0.00 3.07 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 0.00 142 H 8.59 4.76 0.00 3.01 3.03 0.00 7.07 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 8.75 4.98 0.00 1.68 2.12 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.46 7.81 144 G 8.61 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 0.00 0.00 0.00 0.00 145 R 7.27 4.57 0.00 1.79 1.53 0.00 2.21 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 151 S 8.63 4.49 0.00 3.95 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 0.00 152 A 8.27 4.22 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 L 8.72 4.38 0.00 1.66 1.76 0.95 0.86 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 0.00 154 V 7.61 4.76 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 0.66 0.00 0.00 0.95 0.00 0.00 155 L 8.36 2.82 0.00 1.11 1.30 -0.54 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 8.21 5.20 0.00 1.94 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.48 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 157 Y 8.33 5.11 0.00 2.53 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.85 4.79 0.00 1.69 1.53 0.98 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 159 R 8.91 5.13 0.00 2.33 2.07 0.00 3.40 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 160 V 9.04 4.47 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 0.82 0.00 0.00 0.93 0.00 0.00 161 P 0.00 4.93 0.00 1.93 1.99 0.00 2.71 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.37 0.00 162 L 8.37 4.36 0.00 1.54 1.50 0.68 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 163 V 8.16 4.33 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 0.21 0.00 0.00 0.39 0.00 0.00 164 D 8.64 4.43 0.00 2.90 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 0.00 165 R 8.86 3.84 0.00 1.90 1.98 0.00 3.23 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 166 A 8.08 3.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 T 8.91 3.87 4.35 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 1.30 0.00 0.00 168 C 7.88 4.64 0.00 2.95 3.22 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 0.00 169 L 8.27 3.89 0.00 1.94 1.73 0.99 1.03 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 0.00 170 R 7.80 4.10 0.00 1.97 2.01 0.00 3.17 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 171 S 8.29 4.52 0.00 4.31 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 0.00 172 T 6.90 4.78 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 173 K 8.33 4.17 0.00 1.95 1.72 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.72 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.37 1.02 7.81 174 F 7.78 4.71 0.00 3.39 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 T 8.50 3.95 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 0.14 0.00 0.00 176 I 8.02 4.46 1.93 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.93 1.01 0.00 0.00 177 Y 8.32 4.42 0.00 3.17 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 0.00 178 N 8.82 4.59 0.00 2.79 2.93 0.00 0.00 6.91 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.31 4.90 0.00 2.99 3.06 0.00 0.00 6.90 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 0.00 180 M 8.19 5.63 0.00 1.98 2.19 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.72 0.00 181 F 8.99 5.19 0.00 2.99 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 0.00 182 C 8.89 5.64 0.00 2.77 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 8.70 4.90 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 0.00 184 G 6.90 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 0.00 0.00 0.00 184A F 8.36 4.90 0.00 3.16 3.35 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 0.00 185 H 9.03 4.40 0.00 3.33 3.47 0.00 5.61 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.35 4.02 0.00 2.11 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 0.00 2.31 2.26 0.00 187 G 7.60 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 0.00 0.00 0.00 188 G 9.65 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 0.00 0.00 0.00 188A R 7.15 5.31 0.00 1.42 1.82 0.00 3.06 0.00 0.00 3.59 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.24 0.00 189 D 8.30 4.63 0.00 2.84 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 0.00 190 S 8.83 4.86 0.00 3.94 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 0.00 191 C 9.40 4.79 0.00 2.90 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 0.00 192 Q 8.56 4.39 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.49 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 193 G 9.15 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 0.00 0.00 0.00 0.00 194 D 8.34 4.52 0.00 2.90 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 0.00 195 A 7.94 4.39 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.82 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 0.00 0.00 0.00 0.00 197 G 7.97 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.36 0.00 2.30 2.37 0.00 3.86 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 199 H 9.09 5.27 0.00 3.31 3.48 0.00 5.52 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 9.01 5.06 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 0.64 0.00 0.00 1.24 0.00 0.00 201 T 8.77 4.77 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 1.25 0.00 0.00 202 E 8.78 4.57 0.00 2.03 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 2.29 2.35 0.00 203 V 8.96 4.10 1.90 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 0.87 0.00 0.00 -0.09 0.00 0.00 204 E 9.78 3.89 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 205 G 8.64 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 0.00 206 T 7.75 4.51 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 0.86 0.00 0.00 207 S 8.33 4.84 0.00 2.89 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 F 8.92 4.86 0.00 2.85 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 L 8.90 4.54 0.00 1.62 1.66 1.09 1.09 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 0.00 210 T 9.25 4.65 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 1.33 0.00 0.00 211 G 7.99 4.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.23 5.25 1.96 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 1.48 1.15 0.99 0.00 0.00 213 I 8.85 3.51 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.08 0.85 0.00 0.00 214 S 8.46 4.87 0.00 3.89 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 0.00 215 W 7.77 4.90 0.00 2.86 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 0.00 0.00 0.00 0.00 216 G 7.97 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 0.00 217 E 8.73 4.58 0.00 2.02 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 2.49 2.59 0.00 217 E 8.73 4.58 0.00 2.02 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 2.49 2.59 0.00 220 C 7.86 4.92 0.00 2.95 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 9.11 4.38 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 221A M 7.24 4.58 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.70 0.00 222 K 8.42 4.01 0.00 1.70 1.71 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.46 7.81 223 G 8.86 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 0.00 224 K 7.33 4.34 0.00 1.76 1.55 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.26 1.46 7.81 225 Y 7.91 4.92 0.00 2.79 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 G 8.86 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 0.00 227 I 7.90 4.66 0.56 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.05 -0.36 0.61 0.00 0.00 228 Y 8.46 4.80 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.66 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 1.28 0.00 0.00 230 K 9.48 4.47 0.00 2.09 1.91 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.54 1.55 7.81 231 V 8.73 3.94 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.12 0.00 0.00 232 S 8.37 4.27 0.00 4.20 4.11 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 0.00 233 R 7.62 4.00 0.00 0.92 1.53 0.00 3.16 0.00 0.00 3.19 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.80 0.00 234 Y 8.18 4.83 0.00 3.09 3.15 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 0.00 235 V 7.76 3.81 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 1.01 0.00 0.00 1.04 0.00 0.00 236 N 8.26 4.37 0.00 2.82 2.94 0.00 0.00 6.76 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.37 4.23 0.00 3.50 3.58 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 0.00 238 I 8.26 3.20 2.09 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 1.66 1.32 0.84 0.00 0.00 239 K 8.21 3.85 0.00 1.87 1.82 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.66 1.61 7.81 240 E 7.93 3.84 0.00 2.07 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 2.28 2.48 0.00 241 K 7.56 3.73 0.00 0.87 1.00 0.00 1.53 0.00 0.00 1.54 0.00 0.00 3.11 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.91 0.45 7.81 242 T 6.79 2.59 3.70 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 0.48 0.00 0.00 243 K 6.72 3.80 0.00 1.84 1.70 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.38 7.81 244 L 8.40 4.51 0.00 1.71 1.76 1.01 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 245 T 7.82 4.06 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 * Residues marked with a * may have inaccurate shift predictions.