NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.1035 8.1844 120.9391 55.4674 41.6669 175.3354 2 R 4.3538 8.2602 120.1941 54.1264 34.5352 173.9134 3 G 3.9902 9.7093 114.1704 43.7584 0.0000 174.0293 4 E 4.7109 8.7058 112.8697 54.2563 34.3670 176.5394 5 L 4.3919 8.6967 123.2063 53.9014 43.4156 175.3740 6 R 4.9468 8.6872 126.1329 55.3106 32.0806 175.9218 7 V 4.5682 8.6549 122.9376 61.0668 34.6574 174.1469 8 G 3.1106 8.3487 115.8894 44.2610 0.0000 172.4140 9 L 4.7610 8.1166 123.7709 54.4110 44.5192 174.0626 10 E 5.0286 8.7389 121.6273 53.8491 30.8742 173.9293 11 P 4.4159 0.0000 0.0000 62.6435 31.9857 175.2548 12 G 3.5547 8.3218 116.4557 45.8407 0.0000 173.5426 13 Y 4.9547 7.9055 123.2349 56.0517 37.7726 173.3148 14 L 4.4496 8.7481 125.3864 53.9453 42.7659 176.1251 15 P 4.7946 0.0000 0.0000 62.4701 32.1562 177.7039 16 F 3.9072 8.5941 119.6419 60.6685 39.7206 175.9639 17 E 5.5829 7.5398 117.3403 53.7708 33.4645 174.1541 *19 K 4.2417 8.3952 121.5717 56.3607 33.0472 175.5367 20 D 4.8606 8.4334 126.3743 51.5783 41.5645 176.1194 21 K 4.0322 8.7504 117.6072 60.1704 32.2442 178.2430 22 K 3.9645 8.0445 119.2920 57.6066 32.3174 177.2660 23 G 4.1816 8.2217 106.0703 45.2766 0.0000 173.0700 24 N 4.7351 8.2387 117.3793 51.8397 39.7671 174.6203 25 V 4.2567 8.1782 121.9587 61.0350 32.8150 175.3189 26 I 4.4500 8.2654 116.5266 58.3448 40.7639 172.6657 27 G 2.2065 8.0877 104.7547 42.7807 0.0000 174.1927 28 F 3.5112 6.5485 120.4826 61.5568 38.8489 176.9542 29 D 4.4140 8.1889 118.4568 56.8054 40.6024 179.0181 30 V 3.4881 7.3522 118.5207 66.0924 31.6907 177.7581 31 D 4.3733 8.0218 118.4370 56.9542 40.3444 178.4747 32 L 3.9717 7.2255 119.5720 57.7194 42.1646 178.3459 33 A 3.9462 7.6126 120.0770 54.9880 18.6082 179.1929 34 R 4.0219 8.3024 117.6214 59.4146 30.0423 178.7761 35 E 4.4138 8.1391 116.2687 56.8353 29.3390 178.6330 *37 A 4.1149 7.9917 124.3209 52.1368 20.6407 179.6347 38 K 3.8186 7.9259 115.2852 59.7981 32.1668 180.7330 39 A 4.2685 7.9281 120.8182 52.1067 17.2607 178.1135 *41 G 3.8974 8.1203 106.2200 46.3554 0.0000 173.5555 42 V 4.5401 7.8693 117.8170 59.5310 34.8525 175.0117 43 K 4.3911 8.2532 120.3900 55.8600 33.9630 175.4546 44 L 5.0400 8.2851 122.9851 53.1686 44.6823 175.3180 45 K 4.4889 8.8120 127.0676 54.4503 34.7666 174.8150 46 L 4.5170 8.5538 128.2391 54.5943 42.6302 177.3615 47 V 4.3032 9.0145 125.6900 59.9038 32.3256 172.2748 48 P 4.7615 0.0000 0.0000 63.1812 31.9864 176.0741 49 T 4.8694 8.8952 119.2578 61.7784 72.9410 174.1441 50 S 4.4715 8.9307 120.4776 58.1139 64.0007 175.0585 51 W 4.1391 9.4113 133.3126 60.8027 30.6079 177.3461 52 D 4.8512 8.5761 113.0570 54.1493 38.6894 176.4436 53 G 4.1198 8.1592 107.7356 45.2499 0.0000 175.2858 54 L 4.2511 7.6288 120.6198 57.4477 41.5811 178.8210 55 I 3.6325 7.5749 118.9398 64.5190 37.2487 176.6724 56 P 4.3480 0.0000 0.0000 65.2062 31.1588 178.9734 57 G 3.3364 8.4916 105.3601 47.1287 0.0000 175.7322 58 L 3.3594 8.1986 122.9306 57.8574 41.9744 179.2083 59 V 3.5010 7.4129 116.6540 66.3391 31.6281 177.9078 60 T 3.8860 7.5083 113.3582 64.4390 68.1605 174.6805 61 E 3.7810 7.6843 119.0301 57.0170 27.1535 175.9450 62 K 4.0436 8.0458 121.2705 58.9325 32.1830 176.4735 63 F 4.8293 6.6261 111.1394 56.4551 40.0963 172.6661 64 D 4.9724 8.7042 118.7605 54.8197 42.3116 176.8019 65 I 4.7542 7.8151 117.2612 59.8889 41.8166 173.1538 66 I 4.7829 8.5581 128.3642 59.0416 39.3264 174.9083 67 I 4.7062 8.3278 128.9689 59.4817 38.4285 175.6741 68 S 5.1694 8.1090 119.3605 57.3802 63.5733 169.6885 69 G 3.7402 8.5031 115.5849 44.8014 0.0000 173.8900 *71 T 4.0954 8.1863 120.8268 63.2489 69.9529 174.0570 72 I 2.9990 8.1745 127.0886 60.4160 37.3993 175.4191 73 S 4.7285 8.0843 121.1603 55.8506 66.2077 175.2556 74 Q 4.0569 8.8252 119.8434 59.0163 28.8127 178.3658 75 E 4.0762 8.1881 119.8313 59.5963 29.6699 178.9456 76 R 4.0625 8.1886 117.8832 59.3544 30.0575 178.4518 77 N 5.1272 8.6196 116.8365 55.4594 38.9925 176.4380 78 L 4.1685 7.8677 119.4427 57.4888 41.7392 177.8665 79 R 4.4457 7.9918 116.4914 57.0212 31.4997 176.6897 80 V 4.5050 7.1348 109.1512 59.8396 36.3665 174.0075 81 N 4.9156 8.8267 120.9560 52.8362 40.3606 174.0911 82 F 5.3455 8.4863 119.1718 55.4629 41.9630 175.4266 83 V 3.9532 8.6159 123.6958 62.5248 32.3499 175.3961 84 E 4.1691 8.7673 123.0255 55.2637 29.8003 175.7312 85 P 5.0751 0.0000 0.0000 62.7575 31.9582 175.7396 86 Y 4.5307 8.3301 117.1246 57.4980 39.4669 174.8732 87 I 4.3007 6.9586 118.5919 60.0900 41.6957 172.7096 88 V 4.5204 8.1651 125.9947 61.0325 33.6248 174.6758 89 V 4.4901 8.9175 127.3789 61.1605 35.3973 174.0687 90 G 4.4428 8.1301 108.5206 44.4361 0.0000 171.9222 91 Q 4.7328 8.8480 124.5258 56.0317 30.4513 174.9189 92 S 5.0153 9.1514 119.0878 57.5948 67.2486 172.4460 93 L 5.0388 8.5117 119.8551 53.1293 44.1307 176.0894 94 L 5.2091 9.3260 123.2671 53.5299 43.5119 176.2948 95 V 4.7251 9.0487 117.8039 58.7527 34.9204 175.6149 96 K 4.2486 8.5147 124.2354 56.4287 33.2970 175.9497 97 K 3.8184 8.0817 127.1351 58.2184 31.6815 175.0340 98 G 4.1946 9.5620 120.0377 46.3948 0.0000 175.4236 99 L 4.4620 7.4458 118.8029 55.3965 41.0960 177.5720 100 E 4.2421 7.8818 119.5722 59.0024 30.2647 176.8909 101 K 4.2376 7.8018 118.5668 57.2892 32.8963 175.6048 102 G 4.3581 8.9406 112.4160 45.7862 0.0000 174.9868 103 V 3.9613 6.9381 111.0149 61.4770 31.9683 176.1947 104 K 4.5504 8.5415 119.8510 56.2731 34.0487 176.0322 105 S 4.6735 7.7498 111.0530 56.5520 65.8897 174.1933 106 Y 4.0863 8.6373 121.2517 59.7953 38.0681 178.4666 107 K 3.3501 7.0221 119.8783 59.1984 32.1122 177.7207 108 D 4.8154 7.4559 114.8432 53.8465 38.9741 176.5571 109 L 4.6577 8.0096 117.8901 55.0994 42.6972 177.0490 110 D 4.9939 7.9854 121.2449 52.5836 39.6020 175.1200 111 K 4.7367 7.5546 120.8207 53.4168 35.6953 175.9381 112 P 4.3867 0.0000 0.0000 64.7829 31.4531 177.5149 113 E 4.1523 8.1420 117.2111 58.1726 30.0359 176.6166 114 L 5.0588 8.1431 118.8052 53.5396 44.7605 175.8344 115 T 4.9296 9.4323 119.4408 61.9784 70.6181 173.1141 116 L 4.8727 9.1157 129.4463 53.4080 44.5162 175.5783 117 V 5.4867 7.9830 117.2340 59.5306 36.6165 174.2242 118 T 4.8496 7.9938 116.0261 61.3765 70.7931 171.7977 119 K 4.6693 8.5373 123.6796 55.7587 33.1129 176.4041 120 F 3.9655 9.5632 129.9834 58.3061 39.8347 175.2207 121 G 3.1085 7.6006 113.8898 45.0721 0.0000 173.4679 122 V 3.9339 5.7800 116.3417 58.8194 34.3922 175.7512 123 S 3.8556 8.1637 116.8223 60.9916 62.4081 176.5869 124 A 3.7208 7.0761 124.5446 54.9157 18.0972 178.9512 125 E 3.7322 7.9597 118.2792 59.2718 29.5150 178.8322 126 Y 4.2399 7.1781 116.2023 61.0900 38.0423 177.5287 127 A 3.9131 7.7409 121.3704 55.2288 18.2814 179.5898 128 A 4.1680 7.7137 118.7060 55.2611 18.2527 180.0475 129 K 3.9537 8.0300 115.8614 59.5840 32.2519 179.1294 130 R 4.0342 8.4583 117.9523 59.4215 30.1102 177.8931 131 L 4.5523 8.7353 117.2459 54.2853 42.2234 176.4252 132 F 4.9233 8.1409 117.4153 55.7368 39.6709 175.3934 133 K 4.2205 9.0905 126.2756 59.0623 32.3595 178.7975 134 N 4.5101 8.4758 114.1684 55.6816 39.1144 175.3688 135 A 4.3976 7.8636 119.6777 52.2220 19.4096 176.9514 136 K 4.0928 8.8338 121.4468 56.4326 33.2630 175.7377 137 L 5.0454 8.5278 127.2750 53.3760 43.6757 175.4324 138 K 4.7281 9.0633 125.8354 54.5949 35.6636 175.0866 139 T 4.9990 8.0532 113.0876 60.2308 71.3695 172.5158 140 Y 4.9514 8.6116 121.5527 56.2661 41.7483 175.8720 141 D 4.2576 9.0912 118.6533 56.8843 41.6090 177.5159 142 T 4.6375 7.6784 108.3154 58.9879 72.6461 173.7376 143 E 3.5315 8.7112 123.4932 59.9269 29.2980 179.6910 144 A 3.9635 8.0011 119.6933 55.3653 18.1586 179.1307 145 E 3.7815 7.9307 116.5386 58.8965 29.9609 178.7062 146 A 3.9975 7.8674 121.0029 55.1770 18.4413 179.7755 147 V 2.9325 6.9094 110.9288 64.4704 31.6683 178.3962 148 Q 3.5631 7.5011 118.4304 58.3569 28.6359 177.3530 149 E 4.4820 7.8440 118.5175 56.4637 29.5079 177.2302 150 V 3.9734 8.3188 119.7527 61.2859 33.5139 177.2698 151 L 4.1717 8.0503 120.0826 56.8767 41.7322 176.3790 152 N 4.9076 7.3503 114.1090 50.9292 39.6989 174.6918 153 G 3.7284 8.8403 106.1763 49.2493 0.0000 175.2835 154 K 4.0546 7.8231 118.6805 58.0274 32.0699 176.1520 155 A 4.8477 8.9894 119.5677 50.4331 22.2660 175.4401 156 D 4.6316 8.5679 115.8436 55.3662 43.4837 177.1301 *158 F 4.9687 7.8278 119.9580 57.9058 40.9459 173.4034 159 I 4.5272 7.1018 125.5969 59.2613 40.0251 174.1126 160 F 4.5664 8.0574 129.7155 58.2385 43.8369 172.3134 161 D 4.5686 7.2007 120.1860 53.8868 41.2611 177.0433 162 L 4.2751 9.1597 128.1972 57.6138 41.9806 177.7477 163 P 4.4888 0.0000 0.0000 65.4577 31.2065 178.3016 164 F 4.8808 9.1883 121.4998 61.0069 39.1590 177.0238 165 N 4.6403 8.4529 114.2719 56.5730 38.6124 177.2143 166 V 3.8190 8.0260 112.5363 64.4055 31.9459 178.2844 167 A 4.2970 8.3206 120.3420 55.1062 18.2895 180.6296 168 F 3.4854 8.5161 117.8025 58.9215 39.4902 176.6014 *170 A 4.2943 7.9848 121.1161 51.4438 20.4232 178.8111 171 Q 3.9162 7.7396 116.2396 58.1488 29.3420 176.8378 172 K 4.1226 7.7930 113.2360 56.9771 35.3289 178.0618 173 G 3.7772 7.9091 107.3870 48.5774 0.0000 175.8102 174 Q 3.8772 8.0363 118.6348 58.8016 28.7549 178.8754 175 G 3.9410 8.2677 103.6758 46.5943 0.0000 173.9555 176 Y 4.2759 9.1227 117.9067 59.1984 38.9168 175.3111 177 L 5.0064 7.8671 116.1443 52.8408 45.5059 175.8476 178 V 4.5287 9.3052 119.5586 61.4874 34.9578 173.8450 179 H 5.5713 8.8639 126.5581 53.4620 31.4279 173.0485 180 L 4.3194 8.5975 129.7676 54.5772 42.6540 176.3819 181 D 4.7196 8.5690 125.2834 53.1857 39.9418 176.4412 182 T 3.9281 7.7552 117.6188 63.6091 68.4252 174.1703 183 S 4.4273 8.6535 122.4814 58.4914 63.3997 174.2532 184 L 4.2652 9.0206 125.5975 55.6214 42.0366 175.8704 185 T 4.7440 7.4942 106.8410 60.0022 72.6121 172.7336 186 Y 4.4859 8.5831 121.4122 55.9251 40.9512 174.3648 187 E 4.6012 9.0645 127.7448 53.4572 32.8927 173.8651 188 P 4.5792 0.0000 0.0000 62.4645 32.5700 175.9199 189 L 4.6619 8.5445 125.4260 54.3799 43.2259 176.2240 190 G 4.6194 8.5482 106.9369 44.8758 0.0000 172.2566 191 W 5.2505 8.6312 120.5753 56.0776 30.9495 175.1573 192 A 5.1728 8.6280 125.8190 50.0405 21.2780 175.5172 193 I 4.8757 8.1529 114.2515 58.3123 41.4352 174.9012 194 K 4.3402 8.5776 124.0615 56.3208 32.6965 176.8019 195 K 4.1615 8.4515 125.2402 56.9754 32.6769 177.4856 196 G 3.9685 8.9942 108.9561 45.2665 0.0000 173.7240 197 D 4.8381 7.6057 119.9382 51.5274 40.6576 174.2266 198 P 4.4330 0.0000 0.0000 65.3153 31.5039 178.3056 199 D 4.4382 8.2528 118.4772 57.2974 40.8935 178.2220 200 F 4.6927 8.4440 121.0644 61.1608 39.1836 177.2360 201 L 3.9889 7.8195 117.7642 57.7729 41.6088 178.6169 202 N 4.2489 8.2451 116.9166 56.6218 38.7718 176.3033 203 W 4.1613 8.5796 129.4957 60.8582 30.8935 177.8984 204 L 4.4032 8.9597 119.0359 58.0116 40.9309 179.2923 205 N 4.5077 8.6088 116.6294 56.1905 38.6014 177.2832 206 H 4.2879 8.0977 117.6820 58.5332 28.6442 177.5285 207 F 3.9911 8.2260 122.8669 61.0708 38.9251 176.9382 208 L 3.7715 7.8908 118.6487 58.0616 41.9029 178.3938 209 A 4.0948 7.6912 120.8230 55.2605 18.2615 179.4538 210 Q 3.9817 7.9361 116.7228 59.1703 28.8354 179.1227 211 I 4.0401 7.3757 113.5837 63.2890 37.3250 177.5097 212 K 4.0640 7.3983 118.6413 57.5575 32.2467 176.7619 213 H 4.7852 8.3294 114.5967 55.6528 30.5895 174.9870 214 D 4.4669 8.1370 118.9486 55.7346 41.3363 176.9085 215 G 4.2095 8.4186 106.8257 45.8715 0.0000 175.8917 216 S 4.1475 8.3177 114.7742 61.6172 63.1618 175.5110 217 Y 4.1598 8.3257 123.8833 60.6625 38.5584 178.0206 218 D 4.6743 8.4508 119.0622 57.3405 40.9300 178.2541 219 E 4.0361 8.7812 119.5668 59.8573 29.4701 179.6991 220 L 4.2735 8.4175 118.7648 57.6294 41.6449 179.1140 221 Y 4.0164 8.6829 120.2258 60.8007 38.7928 177.5461 222 E 4.0162 8.4733 119.5518 59.5508 29.3707 179.2370 223 R 3.6242 7.6805 117.3546 58.8648 30.1000 177.6176 224 W 4.0140 7.3444 115.7885 57.0961 30.7603 177.1014 225 F 4.2022 7.4974 116.2717 58.4690 38.9817 176.1645 226 V 4.2548 7.5825 117.0284 64.5248 33.2620 176.1325 227 D 4.3729 8.2796 118.7211 56.4777 40.6962 178.0923 228 T 3.1146 8.2188 106.4006 61.6400 67.2818 173.2414 229 K 3.9313 7.7760 123.8251 59.3996 32.1689 178.3573 230 W 4.1715 7.9189 116.6447 59.4683 27.7309 178.0979 231 L 3.4848 6.4610 117.7087 57.4585 40.9978 178.1019 232 E 3.7859 7.2887 117.5856 57.5860 29.7733 177.1411 233 K 4.4341 8.0465 123.3714 56.5019 33.8326 175.5465 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 1 L 8.18 4.10 0.00 1.56 1.51 0.60 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 2 R 8.26 4.35 0.00 1.73 1.73 0.00 3.15 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.60 0.00 3 G 9.71 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 4 E 8.71 4.71 0.00 2.02 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 2.11 2.24 0.00 5 L 8.70 4.39 0.00 1.65 1.51 0.90 0.88 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 6 R 8.69 4.95 0.00 1.94 1.91 0.00 3.14 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 7 V 8.65 4.57 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 0.81 0.00 0.00 0.83 0.00 0.00 8 G 8.35 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 0.00 0.00 0.00 9 L 8.12 4.76 0.00 1.71 1.86 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.74 5.03 0.00 2.40 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 11 P 0.00 4.42 0.00 2.15 2.02 0.00 3.80 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 2.07 2.12 0.00 12 G 8.32 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 13 Y 7.91 4.95 0.00 3.25 3.23 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 14 L 8.75 4.45 0.00 1.76 1.62 1.11 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.79 0.00 1.16 1.59 0.00 3.27 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 1.35 0.00 16 F 8.59 3.91 0.00 2.90 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 17 E 7.54 5.58 0.00 2.23 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 2.37 2.35 0.00 *19 K 8.40 4.24 0.00 1.78 1.80 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.46 7.81 20 D 8.43 4.86 0.00 2.92 2.78 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 21 K 8.75 4.03 0.00 1.89 2.01 0.00 1.57 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.46 7.81 22 K 8.04 3.96 0.00 1.75 1.90 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.15 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.45 7.81 23 G 8.22 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 24 N 8.24 4.74 0.00 2.79 2.75 0.00 0.00 6.80 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 25 V 8.18 4.26 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 0.73 0.00 0.00 0.92 0.00 0.00 26 I 8.27 4.45 1.98 0.00 0.00 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 1.41 0.74 0.99 0.00 0.00 27 G 8.09 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 0.00 0.00 0.00 0.00 0.00 0.00 28 F 6.55 3.51 0.00 2.19 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.19 4.41 0.00 3.12 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 30 V 7.35 3.49 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 1.12 0.00 0.00 0.87 0.00 0.00 31 D 8.02 4.37 0.00 2.81 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 32 L 7.23 3.97 0.00 1.62 1.66 0.91 0.92 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 33 A 7.61 3.95 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.30 4.02 0.00 2.08 2.11 0.00 3.13 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 35 E 8.14 4.41 0.00 2.38 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 2.55 2.60 0.00 *37 A 7.99 4.11 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 38 K 7.93 3.82 0.00 1.98 1.92 0.00 1.88 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.58 7.81 39 A 7.93 4.27 1.50 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 0.00 0.00 0.00 *41 G 8.12 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 42 V 7.87 4.54 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 0.61 0.00 0.00 0.82 0.00 0.00 43 K 8.25 4.39 0.00 1.73 1.73 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.36 7.81 44 L 8.29 5.04 0.00 1.54 1.48 0.91 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.81 4.49 0.00 1.81 1.60 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.36 7.81 46 L 8.55 4.52 0.00 1.53 1.53 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 47 V 9.01 4.30 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.97 0.00 0.00 48 P 0.00 4.76 0.00 2.11 2.05 0.00 3.53 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.11 0.00 49 T 8.90 4.87 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 1.31 0.00 0.00 50 S 8.93 4.47 0.00 4.12 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 W 9.41 4.14 0.00 3.85 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.58 4.85 0.00 3.00 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 53 G 8.16 4.12 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 0.00 0.00 0.00 54 L 7.63 4.25 0.00 1.42 1.61 0.32 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.57 3.63 1.83 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.56 0.87 0.00 0.00 56 P 0.00 4.35 0.00 2.06 2.08 0.00 3.83 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.04 0.00 57 G 8.49 3.34 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 0.00 58 L 8.20 3.36 0.00 1.78 1.72 1.04 1.06 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 59 V 7.41 3.50 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 0.84 0.00 0.00 0.89 0.00 0.00 60 T 7.51 3.89 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 61 E 7.68 3.78 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 62 K 8.05 4.04 0.00 1.36 1.85 0.00 1.55 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.42 7.81 63 F 6.63 4.83 0.00 3.15 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 64 D 8.70 4.97 0.00 2.64 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 65 I 7.82 4.75 1.93 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.27 0.87 0.00 0.00 66 I 8.56 4.78 1.91 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 1.36 1.26 0.88 0.00 0.00 67 I 8.33 4.71 1.76 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.24 1.03 0.00 0.00 68 S 8.11 5.17 0.00 3.88 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 69 G 8.50 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *71 T 8.19 4.10 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 1.15 0.00 0.00 72 I 8.17 3.00 1.63 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 0.43 0.33 0.46 0.00 0.00 73 S 8.08 4.73 0.00 3.85 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 74 Q 8.83 4.06 0.00 2.02 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.07 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 75 E 8.19 4.08 0.00 2.01 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 2.40 2.40 0.00 76 R 8.19 4.06 0.00 2.34 2.42 0.00 3.37 0.00 0.00 3.53 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.82 0.00 77 N 8.62 5.13 0.00 3.13 2.98 0.00 0.00 7.18 7.38 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 78 L 7.87 4.17 0.00 1.89 1.74 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 79 R 7.99 4.45 0.00 1.89 1.95 0.00 3.15 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 80 V 7.13 4.50 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 0.85 0.00 0.00 0.56 0.00 0.00 81 N 8.83 4.92 0.00 2.75 2.74 0.00 0.00 6.87 7.75 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 82 F 8.49 5.35 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 83 V 8.62 3.95 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 0.87 0.00 0.00 1.26 0.00 0.00 84 E 8.77 4.17 0.00 1.97 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 2.49 2.36 0.00 85 P 0.00 5.08 0.00 2.08 1.98 0.00 3.28 0.00 0.00 4.31 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 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 V 6.94 3.96 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 0.76 0.00 0.00 1.03 0.00 0.00 104 K 8.54 4.55 0.00 1.69 1.78 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.47 7.81 105 S 7.75 4.67 0.00 3.82 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.64 4.09 0.00 3.28 3.26 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 0.00 107 K 7.02 3.35 0.00 1.41 1.61 0.00 1.17 0.00 0.00 1.59 0.00 0.00 2.75 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.06 0.21 7.81 108 D 7.46 4.82 0.00 2.59 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 0.00 109 L 8.01 4.66 0.00 2.04 1.89 1.03 0.99 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 0.00 110 D 7.99 4.99 0.00 2.60 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 0.00 111 K 7.55 4.74 0.00 1.82 1.86 0.00 1.76 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.39 7.81 112 P 0.00 4.39 0.00 2.06 2.14 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 113 E 8.14 4.15 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 114 L 8.14 5.06 0.00 1.62 1.65 1.06 0.98 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 0.00 115 T 9.43 4.93 4.42 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 1.25 0.00 0.00 116 L 9.12 4.87 0.00 1.36 1.27 0.58 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.98 5.49 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 0.87 0.00 0.00 1.16 0.00 0.00 118 T 7.99 4.85 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 1.06 0.00 0.00 119 K 8.54 4.67 0.00 1.82 1.66 0.00 1.79 0.00 0.00 1.48 0.00 0.00 2.67 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.31 1.43 7.81 120 F 9.56 3.97 0.00 3.01 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 0.00 121 G 7.60 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 0.00 0.00 0.00 122 V 5.78 3.93 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 -0.12 0.00 0.00 123 S 8.16 3.86 0.00 3.99 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 0.00 124 A 7.08 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 E 7.96 3.73 0.00 1.72 1.53 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 0.00 2.22 2.25 0.00 126 Y 7.18 4.24 0.00 2.94 2.80 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 0.00 127 A 7.74 3.91 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 0.00 128 A 7.71 4.17 1.32 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 0.00 129 K 8.03 3.95 0.00 1.94 1.93 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.56 7.81 130 R 8.46 4.03 0.00 2.02 2.08 0.00 3.23 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 131 L 8.74 4.55 0.00 1.58 1.23 0.82 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.14 4.92 0.00 3.24 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 0.00 133 K 9.09 4.22 0.00 1.79 1.88 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.55 7.81 134 N 8.48 4.51 0.00 2.78 2.95 0.00 0.00 6.83 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 7.86 4.40 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 0.00 136 K 8.83 4.09 0.00 1.76 1.76 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.41 7.81 137 L 8.53 5.05 0.00 1.60 1.55 0.84 0.57 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 0.00 138 K 9.06 4.73 0.00 1.63 1.31 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.34 7.81 139 T 8.05 5.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 140 Y 8.61 4.95 0.00 2.94 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 0.00 141 D 9.09 4.26 0.00 2.74 2.78 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 0.00 142 T 7.68 4.64 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 143 E 8.71 3.53 0.00 1.71 1.12 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 1.47 1.74 0.00 144 A 8.00 3.96 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 0.00 145 E 7.93 3.78 0.00 1.96 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 0.00 2.08 2.18 0.00 146 A 7.87 4.00 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 0.00 147 V 6.91 2.93 1.21 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 -1.13 0.00 0.00 0.38 0.00 0.00 148 Q 7.50 3.56 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 149 E 7.84 4.48 0.00 2.05 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.75 0.00 150 V 8.32 3.97 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 0.96 0.00 0.00 1.05 0.00 0.00 151 L 8.05 4.17 0.00 1.68 1.83 1.09 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 152 N 7.35 4.91 0.00 2.88 2.86 0.00 0.00 6.98 6.88 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 0.00 153 G 8.84 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 0.00 154 K 7.82 4.05 0.00 1.78 1.92 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.79 1.77 7.81 155 A 8.99 4.85 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 0.00 156 D 8.57 4.63 0.00 2.79 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 *158 F 7.83 4.97 0.00 3.10 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 7.10 4.53 1.61 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 0.89 0.94 0.67 0.00 0.00 160 F 8.06 4.57 0.00 2.18 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 Q 7.74 3.92 0.00 1.87 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.71 0.00 0.00 0.00 0.00 0.00 2.08 2.05 0.00 172 K 7.79 4.12 0.00 0.79 1.24 0.00 1.35 0.00 0.00 0.61 0.00 0.00 3.01 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.99 0.86 7.81 173 G 7.91 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 Q 8.04 3.88 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 175 G 8.27 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 Y 9.12 4.28 0.00 2.99 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 0.00 177 L 7.87 5.01 0.00 1.65 1.72 1.05 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 178 V 9.31 4.53 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 1.11 0.00 0.00 179 H 8.86 5.57 0.00 3.26 3.29 0.00 5.62 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 8.60 4.32 0.00 1.88 1.63 0.97 1.25 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 0.00 181 D 8.57 4.72 0.00 2.81 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 0.00 182 T 7.76 3.93 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 183 S 8.65 4.43 0.00 3.99 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 0.00 184 L 9.02 4.27 0.00 1.46 1.46 0.64 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 185 T 7.49 4.74 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 1.12 0.00 0.00 186 Y 8.58 4.49 0.00 2.89 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 0.00 187 E 9.06 4.60 0.00 1.83 1.71 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 2.14 2.14 0.00 188 P 0.00 4.58 0.00 2.01 2.09 0.00 3.75 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 189 L 8.54 4.66 0.00 1.49 1.72 0.88 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 190 G 8.55 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.63 5.25 0.00 3.36 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 A 8.63 5.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 I 8.15 4.88 1.98 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 1.07 0.92 0.82 0.00 0.00 194 K 8.58 4.34 0.00 1.74 1.75 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.45 7.81 195 K 8.45 4.16 0.00 1.78 1.73 0.00 1.78 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.53 7.81 196 G 8.99 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 0.00 197 D 7.61 4.84 0.00 2.76 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 0.00 198 P 0.00 4.43 0.00 2.35 2.34 0.00 3.79 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 199 D 8.25 4.44 0.00 2.94 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 F 8.44 4.69 0.00 3.14 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 0.00 201 L 7.82 3.99 0.00 1.99 1.76 0.97 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 202 N 8.25 4.25 0.00 2.85 3.12 0.00 0.00 6.94 8.07 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 0.00 203 W 8.58 4.16 0.00 3.73 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 0.00 204 L 8.96 4.40 0.00 2.04 1.95 1.07 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 205 N 8.61 4.51 0.00 2.84 2.79 0.00 0.00 6.95 9.01 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 0.00 206 H 8.10 4.29 0.00 3.22 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 F 8.23 3.99 0.00 1.89 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 0.00 208 L 7.89 3.77 0.00 1.72 1.76 0.73 0.68 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 0.00 209 A 7.69 4.09 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 0.00 210 Q 7.94 3.98 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 211 I 7.38 4.04 1.91 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 1.30 0.73 0.69 0.00 0.00 212 K 7.40 4.06 0.00 1.68 1.58 0.00 0.91 0.00 0.00 0.67 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.15 1.47 7.81 213 H 8.33 4.79 0.00 3.22 3.29 0.00 5.84 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 D 8.14 4.47 0.00 2.83 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 0.00 215 G 8.42 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 0.00 0.00 0.00 0.00 216 S 8.32 4.15 0.00 4.15 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 0.00 217 Y 8.33 4.16 0.00 3.18 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 0.00 218 D 8.45 4.67 0.00 3.01 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 0.00 219 E 8.78 4.04 0.00 2.31 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 2.38 2.43 0.00 220 L 8.42 4.27 0.00 2.00 2.05 0.93 1.23 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 0.00 221 Y 8.68 4.02 0.00 3.06 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 0.00 222 E 8.47 4.02 0.00 2.25 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 2.46 2.56 0.00 223 R 7.68 3.62 0.00 1.75 1.85 0.00 2.87 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.76 0.00 224 W 7.34 4.01 0.00 2.17 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 0.00 0.00 0.00 0.00 225 F 7.50 4.20 0.00 1.94 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 0.00 226 V 7.58 4.25 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 0.88 0.00 0.00 0.97 0.00 0.00 227 D 8.28 4.37 0.00 2.62 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 0.00 228 T 8.22 3.11 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 1.16 0.00 0.00 229 K 7.78 3.93 0.00 1.81 1.76 0.00 1.53 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.49 7.81 230 W 7.92 4.17 0.00 3.61 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 0.00 231 L 6.46 3.48 0.00 1.25 1.31 -0.07 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 232 E 7.29 3.79 0.00 2.02 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 2.37 0.00 233 K 8.05 4.43 0.00 2.06 2.02 0.00 1.93 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.54 7.81 * Residues marked with a * may have inaccurate shift predictions.