NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5527 8.3049 118.1868 54.7853 32.5849 174.8465 2 R 4.0894 8.8434 119.7774 56.0696 32.5030 173.7525 3 L 3.2554 9.1551 114.3227 52.6947 43.1655 177.4927 4 P 4.6896 0.0000 0.0000 63.3468 32.3975 176.0828 5 I 4.8502 8.7286 124.0028 59.0349 42.1639 173.6971 6 L 5.0923 8.5630 128.5386 53.4631 45.0460 174.9327 7 I 4.7639 8.8008 127.9601 59.6688 39.7298 174.8052 8 I 4.6763 8.7966 129.3246 59.9722 38.2659 174.5818 9 N 4.9630 9.3581 128.3045 52.3841 39.3692 175.9078 10 F 4.6867 9.4886 126.3120 58.2659 40.3197 177.2185 11 K 3.4371 8.0266 120.5109 57.9935 31.0181 175.6248 12 A 4.7154 7.9224 126.9684 52.8544 19.6894 175.9128 13 Y 4.3652 7.5679 117.8549 59.5108 38.6166 178.2281 14 G 3.7127 8.9369 113.1481 48.5848 0.0000 175.4940 15 E 3.9380 8.3660 118.1783 58.4178 29.7993 177.4283 16 A 4.4197 8.0925 120.1496 51.5277 19.6682 175.7203 17 A 4.5899 7.9789 122.3255 52.0448 21.4264 179.2213 18 G 3.8723 8.5859 107.6441 46.2977 0.0000 176.6835 19 K 3.9530 8.6890 118.7241 59.5998 31.8508 178.8399 20 R 3.9560 7.9778 117.5410 58.9010 29.8375 178.9077 21 A 4.2452 8.0159 122.2848 54.6955 18.4085 179.8760 22 V 3.6288 7.7844 116.2956 66.0912 31.7140 177.8367 23 E 3.9612 8.2725 118.3855 59.3924 29.3557 179.1401 24 L 3.8756 8.2519 120.3585 58.1044 42.0239 178.8198 25 A 4.2424 8.2667 120.7642 55.2934 18.2305 179.8200 26 K 3.9701 8.4262 116.8697 59.4181 32.0929 179.5259 27 A 4.0837 8.1831 121.0797 55.0561 18.2406 179.5501 28 A 3.9994 8.2293 119.4110 55.2075 18.4764 179.4848 29 E 3.8901 8.5114 118.1934 59.4302 29.7216 179.2435 30 R 3.9621 8.4202 118.1455 59.3195 30.1227 178.7966 31 A 4.0451 8.4214 120.2923 55.2524 18.3341 179.5069 32 A 4.0092 8.2833 119.3020 55.3744 18.2071 180.1943 33 R 3.9047 7.9552 115.5774 59.4784 30.2966 178.7358 34 E 4.1460 8.7399 117.5343 58.9963 29.5777 178.6418 35 L 4.4442 8.1801 116.8572 53.7309 42.4120 176.7433 36 G 3.8862 8.2484 106.7961 46.7766 0.0000 173.6838 37 V 4.3043 7.6406 117.2573 60.3712 34.4719 174.8306 38 N 4.6080 8.5071 124.6833 53.2302 38.9437 172.6019 39 I 4.7871 8.0804 126.1409 59.4790 38.9249 175.2735 40 V 4.5058 8.9497 127.5702 60.8533 34.5117 174.5613 41 V 4.6843 8.0261 124.2730 59.8790 34.5557 174.4161 42 A 5.5942 8.5790 125.5031 48.2349 19.7016 173.7645 43 P 4.6416 0.0000 0.0000 61.7883 33.1487 176.1887 44 N 4.5174 8.7589 117.3613 52.7914 38.2722 175.4911 45 H 4.1764 8.8664 116.5273 59.5597 28.4954 177.8556 46 L 4.1117 7.8683 118.5989 56.9511 41.5839 178.3598 47 E 4.5755 8.2318 116.4031 55.6773 30.0182 177.3071 48 L 4.0636 7.8153 122.4784 58.2441 42.1697 179.1339 49 G 3.5751 8.0194 104.8584 47.6729 0.0000 175.0419 50 L 3.9397 7.8439 121.4078 57.9036 42.4135 178.7833 51 V 3.7648 8.3091 118.4054 66.1617 31.2500 178.0334 52 S 4.1592 8.1537 114.1199 61.4779 62.7392 175.8129 53 Q 4.3996 7.8076 117.6127 56.2046 28.7265 176.3732 54 S 4.7011 8.0793 115.7960 58.4160 64.8688 174.1416 55 V 4.5974 7.4618 111.3749 59.9367 35.3201 174.6909 56 D 4.8141 10.1925 120.3656 54.1447 41.7565 177.3679 57 I 4.0396 7.5404 112.5742 59.4924 38.8680 173.8001 58 P 4.4141 0.0000 0.0000 62.7912 32.6317 175.4403 59 V 4.7149 8.4748 123.2013 61.4465 34.0550 173.6505 60 Y 5.4774 8.9678 125.7951 56.3170 40.5996 175.1685 61 A 4.6077 8.7795 124.7783 51.7164 19.5155 178.9774 62 Q 3.9722 9.0508 119.3750 57.5115 29.1450 176.1796 63 G 4.4044 7.5610 104.2280 45.7148 0.0000 171.4421 64 A 4.5316 8.0251 119.8383 51.5498 21.4454 175.7816 65 D 4.8937 8.9360 116.9096 52.7729 41.4256 175.5583 66 V 4.3228 7.4423 118.7208 61.7630 35.0427 175.3092 67 E 4.0002 9.0968 126.7904 58.9775 29.9919 176.7608 68 A 5.0239 7.6972 119.5505 49.6086 21.9352 175.8408 69 G 3.8569 8.5584 109.1872 45.0758 0.0000 174.6734 70 G 3.6056 7.9326 104.7452 45.2018 0.0000 173.4734 71 A 4.2911 7.7257 119.7549 51.3916 17.5497 177.4684 72 H 5.0103 7.5314 120.5786 52.9855 29.6664 173.5103 73 T 3.9159 7.8636 115.7484 65.2460 69.1912 174.3965 74 A 3.6740 8.7333 126.3100 53.0935 16.2238 176.4030 75 H 4.9412 7.8995 114.1130 55.0419 31.9641 174.3475 76 V 4.3438 8.8333 120.1980 61.3822 33.3988 174.6046 77 S 5.6215 8.3310 122.6468 56.4213 65.2520 175.3475 78 L 3.9550 8.5459 121.8692 58.1230 41.3657 179.6501 79 E 3.9734 7.9923 118.1285 59.5979 29.4261 179.2252 80 N 4.5828 8.0963 117.7713 55.7000 38.5418 177.5100 81 I 3.6956 7.6696 121.3564 64.1717 37.1531 178.3703 82 K 3.9255 8.0445 120.3250 59.6860 31.6505 178.7948 83 E 3.9880 8.6251 118.5786 58.6503 29.1100 178.2713 84 A 4.4381 7.7388 119.0255 52.1521 19.0671 177.8571 85 G 4.0052 8.0252 106.0556 44.9297 0.0000 174.4622 86 G 3.8528 7.9150 108.1667 45.5549 0.0000 174.2188 87 S 4.6634 8.8114 115.9329 57.9731 65.1389 173.7910 88 G 3.7287 7.5789 105.9689 46.0266 0.0000 172.3642 89 V 4.9448 7.8126 118.2234 60.3381 35.1496 173.6953 90 I 4.9379 8.8330 124.1377 59.9587 39.2978 174.7556 91 L 4.9116 8.6637 125.7953 53.3631 45.9095 176.1708 92 N 4.3906 8.9652 117.8908 54.6666 37.5150 173.8569 93 H 4.2379 8.0746 114.9893 55.5149 30.5742 175.8252 94 S 4.1852 8.4215 121.0593 61.9666 62.6751 175.7263 95 E 4.2218 8.4256 116.4024 57.5165 30.1843 176.2537 96 A 4.7393 8.2888 121.9605 49.7953 19.1171 174.7598 97 P 4.5119 0.0000 0.0000 62.9494 32.2887 176.3732 98 L 4.7895 8.4212 120.6932 52.5112 44.3803 177.1943 99 K 4.1291 8.2587 120.3776 56.0286 33.7866 177.8760 100 L 3.9091 8.6027 125.2498 58.6802 41.8264 179.2271 101 N 4.3432 8.0813 115.5811 56.3559 38.5445 177.0613 102 D 4.3141 7.9610 119.7855 57.1389 41.0691 178.0654 103 L 3.8542 8.1582 120.9998 58.2758 41.9381 178.7849 104 A 3.9381 7.9672 120.3162 55.5085 18.2380 179.9238 105 R 3.8960 7.7122 116.4052 59.2454 30.0684 179.3547 106 L 3.9439 8.3874 119.3513 57.6210 41.5925 179.6468 107 V 3.5106 8.3268 118.4199 65.8077 31.3987 178.0330 108 A 3.8960 7.7508 120.1860 54.9508 18.0493 179.4545 109 K 3.7858 7.9769 116.7379 59.5962 32.5971 178.3179 110 A 4.1103 8.0365 120.9809 55.2779 18.2066 179.7823 111 K 3.9463 8.0290 117.0887 59.5184 31.9816 179.4084 112 S 4.2901 8.1133 112.2214 59.9657 63.0569 175.1822 113 L 4.4725 7.6400 121.7065 54.3856 41.9060 177.1415 114 G 3.9236 8.0892 107.6530 45.1936 0.0000 173.4013 115 L 4.5841 7.3867 118.5860 53.6526 42.9530 176.5098 116 D 4.4269 8.7094 122.8334 54.4097 42.5663 175.8763 117 V 4.7753 8.4735 113.8023 59.6672 36.1032 174.3178 118 V 4.8481 8.6434 125.0471 61.0229 34.4454 174.1009 119 V 4.8230 8.7392 128.2596 61.4101 33.3386 174.8511 120 C 5.0196 8.9012 125.8556 59.8103 29.4084 172.9513 121 A 4.6110 8.4199 120.8409 50.5192 21.6937 176.2224 122 P 4.6405 0.0000 0.0000 64.6413 31.9899 175.8265 123 D 4.6533 7.6083 116.4115 50.3446 43.4943 174.0787 124 P 4.3596 0.0000 0.0000 65.1615 31.2522 178.7129 125 R 3.8965 7.9822 116.7466 60.0310 29.9910 178.5638 126 T 3.9650 8.4780 115.4409 66.5928 68.3447 177.0051 127 S 4.1912 8.2180 117.4340 61.2793 62.7821 176.3980 128 L 4.0506 8.3091 123.3539 58.1274 41.6492 178.8730 129 A 3.9865 7.8589 119.3213 55.1015 18.5495 179.1643 130 A 4.0057 8.4656 119.4619 55.3024 18.5208 179.6717 131 A 3.8959 8.5007 119.4473 55.1881 18.1986 179.4618 132 A 2.5800 7.3876 117.8255 53.6955 18.4375 178.8186 133 L 4.1434 7.7019 116.4788 54.6134 42.0384 177.0854 134 G 3.6532 7.6951 107.2243 45.5863 0.0000 172.2373 135 P 4.5091 0.0000 0.0000 61.7504 32.8277 175.7929 136 H 4.4549 8.6710 114.9087 58.5369 29.4593 175.8646 137 A 5.2526 7.8969 117.5485 50.3042 23.1277 174.9219 138 V 4.7528 8.8873 119.1603 60.9970 34.8830 174.4824 139 A 5.7109 9.3021 130.0665 49.3759 20.7851 175.6854 140 V 4.2592 8.2391 122.3080 62.2837 33.3514 175.3055 141 E 5.0796 9.1947 125.2476 52.4122 33.1950 173.7179 142 P 4.7975 0.0000 0.0000 61.2482 31.8742 175.9705 143 P 4.3100 0.0000 0.0000 65.4546 31.5025 178.6706 144 E 4.0450 8.1823 116.5358 58.6815 29.6780 177.6195 145 L 4.2934 7.9510 117.6708 55.1043 42.4534 176.6196 146 I 3.8240 7.2038 120.0137 62.8831 37.1162 176.5823 147 G 4.0078 8.9769 113.3619 45.9052 0.0000 173.8402 148 T 4.0247 7.9655 109.1103 61.6171 69.3394 176.2617 149 G 3.8081 8.1301 109.4459 45.7172 0.0000 174.0971 150 R 3.9886 7.5279 119.8231 53.8056 29.2361 174.9651 151 A 4.2202 8.4626 124.6085 52.3260 19.8776 177.9308 152 V 3.7022 8.6268 124.9685 65.0591 31.2344 179.0036 153 S 4.2272 8.1779 112.7011 60.1297 62.8787 175.3121 154 R 4.4202 7.8708 119.9304 57.2644 31.9468 176.7275 155 Y 4.2666 8.5578 115.4331 58.7655 39.3527 176.0755 156 K 5.0372 8.6741 120.7742 52.9861 32.6286 175.2755 157 P 4.3168 0.0000 0.0000 66.0121 31.2168 177.9928 158 E 3.9253 8.2378 117.9761 59.3294 29.2817 178.8507 159 A 4.0405 7.7872 120.3812 55.0401 18.3736 179.9012 160 I 3.6461 7.5377 117.8724 64.5868 37.4571 178.3723 161 V 3.5954 7.9789 119.3152 66.2732 31.2226 177.7242 162 E 3.9962 8.8111 119.1523 59.3791 29.2940 178.9627 163 T 3.8803 7.7859 115.8811 66.5545 68.5350 176.8448 164 V 3.7256 8.0069 120.3506 65.8330 31.6137 178.3938 165 G 3.5473 8.0731 105.3382 47.7548 0.0000 175.6401 166 L 4.0133 8.0948 122.3139 57.4706 41.6323 179.9000 167 V 3.7212 8.1141 118.5895 66.0492 31.3194 178.1037 168 S 4.1955 8.0768 112.3409 60.7261 62.9424 175.8441 169 R 3.9899 7.5647 121.6506 58.4866 29.9133 176.8813 170 H 4.2450 7.4981 113.6956 56.0241 31.3535 175.4588 171 F 5.1369 8.1530 117.6318 53.5501 39.0847 173.9023 172 P 4.3145 0.0000 0.0000 65.1868 31.7866 178.4871 173 E 4.0884 8.2212 118.4243 58.6064 29.7711 176.3744 174 V 4.0885 7.9135 119.9735 62.5740 32.1258 176.0687 175 S 4.7274 9.1363 124.3423 57.7685 65.0475 173.0723 176 V 4.9502 8.3017 121.8226 61.2238 34.1892 174.3991 177 I 5.0758 8.8430 120.2806 59.6220 41.7312 173.4571 178 T 5.0478 8.3281 115.2198 61.2782 71.4973 171.9774 179 G 4.4417 9.0448 109.8125 46.3380 0.0000 172.7932 180 A 4.0459 8.9421 121.5182 53.6899 17.3379 179.3229 181 G 4.0325 8.7131 109.5322 46.2630 0.0000 173.2451 182 I 3.9124 7.7119 121.1499 61.6598 37.2596 175.4135 183 E 4.6186 10.3668 123.4694 55.0932 31.1987 175.8828 184 S 5.0281 7.9472 113.4769 55.5275 67.6417 174.7817 185 G 3.6193 9.2284 108.6849 48.0398 0.0000 175.6716 186 D 4.3975 8.0762 120.6584 57.3269 40.9248 178.3877 187 D 4.3640 7.9486 119.3683 57.3142 40.7785 179.1272 188 V 3.5615 7.5913 118.4117 65.9808 31.5081 177.9910 189 A 4.0005 8.4223 120.7517 55.0587 18.1904 179.4472 190 A 3.9065 8.3636 119.3866 55.0872 18.3016 179.6659 191 A 3.9488 7.8611 119.1398 55.4484 18.5298 179.8928 192 L 4.1251 7.9149 117.4541 58.1008 41.4547 180.0218 193 R 4.0163 8.0973 117.3162 59.0295 30.0572 178.3421 194 L 4.3213 7.5964 115.7111 55.1463 41.6432 177.7251 195 G 4.0795 7.8967 107.3388 45.4185 0.0000 174.7007 196 T 4.2951 7.3942 116.3020 63.8244 69.1908 174.3839 197 R 4.5582 10.0567 122.0788 54.1598 30.4172 176.9807 198 G 4.1382 6.9169 106.5590 45.7854 0.0000 171.5117 199 V 4.6948 8.0399 118.1227 61.3068 35.4423 173.8364 200 L 5.3392 9.0327 127.1897 53.2026 45.0446 175.2025 201 L 4.3083 9.0856 124.9368 55.1940 43.9882 173.9913 202 A 4.8498 8.5977 118.1382 50.6936 21.8421 178.5575 203 S 3.7871 8.0793 108.9050 61.2146 63.2041 176.7419 204 A 3.9393 7.9931 121.7375 55.2680 18.2437 179.0655 205 A 4.0890 7.7721 118.1767 55.1205 18.8525 179.7018 206 V 3.3577 7.7241 115.5855 65.4588 31.5874 177.3752 207 K 4.2084 7.9186 115.0083 54.9912 32.6665 176.6328 208 A 4.1420 7.0308 123.1027 51.8438 18.8978 178.5576 209 K 4.1063 8.5905 121.0432 58.6760 32.5639 176.9685 210 D 4.7720 7.5787 118.0059 50.2893 41.5028 173.4070 211 P 4.2051 0.0000 0.0000 65.4214 31.5738 176.7233 212 Y 4.0169 8.1248 117.0210 60.8120 38.7480 177.9299 213 A 3.7565 8.3160 121.4439 54.9647 18.4180 179.4838 214 K 3.8258 8.2710 118.3802 59.7971 32.2684 179.1072 215 I 3.6452 8.1974 120.3980 64.1759 36.9504 178.6155 216 V 3.3803 7.6133 119.2473 65.7582 31.0915 177.5481 217 E 3.8685 7.7905 117.7101 59.4899 29.5494 178.5806 218 L 4.0877 7.9840 117.5768 57.5608 41.9077 178.8724 219 A 4.2150 8.4553 120.4014 53.5826 18.6786 179.1275 220 K 3.7122 8.0217 118.9562 59.5925 32.0365 176.9281 221 P 4.6253 0.0000 0.0000 64.7700 30.9476 178.4675 222 L 4.1186 7.9752 117.8409 56.9121 41.6005 178.3769 223 S 4.5525 7.7713 111.7906 58.6726 63.3959 174.3314 224 E 4.4072 7.9203 122.7324 56.9943 30.8634 175.0870 225 L 4.5860 7.6238 123.0488 53.5028 41.2949 176.6683 *226 R 4.1530 7.9217 120.1264 55.8993 30.0397 176.0422 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 M 8.30 4.55 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 R 8.84 4.09 0.00 1.92 1.91 0.00 3.24 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 3 L 9.16 3.26 0.00 1.64 1.22 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.69 0.00 1.94 2.00 0.00 3.62 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 5 I 8.73 4.85 2.05 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 1.08 1.84 0.95 0.00 0.00 6 L 8.56 5.09 0.00 1.79 1.44 0.92 0.89 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 7 I 8.80 4.76 1.89 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 1.10 0.61 0.86 0.00 0.00 8 I 8.80 4.68 2.14 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 1.32 1.15 1.11 0.00 0.00 9 N 9.36 4.96 0.00 2.85 2.79 0.00 0.00 6.83 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 10 F 9.49 4.69 0.00 3.21 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 11 K 8.03 3.44 0.00 1.48 1.27 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.60 7.81 12 A 7.92 4.72 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 7.57 4.37 0.00 3.18 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 14 G 8.94 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.37 3.94 0.00 1.85 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 2.21 2.33 0.00 16 A 8.09 4.42 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.98 4.59 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 18 G 8.59 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 19 K 8.69 3.95 0.00 1.86 1.89 0.00 1.59 0.00 0.00 1.83 0.00 0.00 3.14 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.61 7.81 20 R 7.98 3.96 0.00 2.11 2.06 0.00 3.24 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 21 A 8.02 4.25 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 22 V 7.78 3.63 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.98 0.00 0.00 23 E 8.27 3.96 0.00 2.21 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 2.33 2.45 0.00 24 L 8.25 3.88 0.00 1.58 1.50 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.27 4.24 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 0.00 0.00 0.00 0.00 0.00 26 K 8.43 3.97 0.00 2.06 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.60 7.81 27 A 8.18 4.08 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.23 4.00 1.49 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 0.00 0.00 29 E 8.51 3.89 0.00 2.17 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 2.33 2.37 0.00 30 R 8.42 3.96 0.00 2.25 2.07 0.00 3.04 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.83 0.00 31 A 8.42 4.05 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 32 A 8.28 4.01 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.96 3.90 0.00 1.97 2.02 0.00 3.19 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 34 E 8.74 4.15 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 35 L 8.18 4.44 0.00 1.59 1.70 0.89 1.06 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 36 G 8.25 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 37 V 7.64 4.30 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 0.83 0.00 0.00 0.94 0.00 0.00 38 N 8.51 4.61 0.00 2.89 2.90 0.00 0.00 7.01 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.08 4.79 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.88 0.91 0.00 0.00 40 V 8.95 4.51 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.60 0.00 0.00 41 V 8.03 4.68 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 0.53 0.00 0.00 1.09 0.00 0.00 42 A 8.58 5.59 1.18 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 43 P 0.00 4.64 0.00 2.09 1.86 0.00 3.78 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.85 0.00 44 N 8.76 4.52 0.00 2.95 3.24 0.00 0.00 5.90 7.90 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 45 H 8.87 4.18 0.00 3.22 3.39 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.87 4.11 0.00 1.82 1.77 0.94 0.71 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 47 E 8.23 4.58 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 2.51 2.51 0.00 48 L 7.82 4.06 0.00 1.80 1.69 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.02 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 0.00 0.00 0.00 50 L 7.84 3.94 0.00 1.65 1.90 0.94 0.96 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 51 V 8.31 3.76 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 0.98 0.00 0.00 1.08 0.00 0.00 52 S 8.15 4.16 0.00 4.12 4.04 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 53 Q 7.81 4.40 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 54 S 8.08 4.70 0.00 3.95 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 55 V 7.46 4.60 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 0.78 0.00 0.00 0.96 0.00 0.00 56 D 10.19 4.81 0.00 2.75 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 57 I 7.54 4.04 2.01 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 1.42 0.50 0.91 0.00 0.00 58 P 0.00 4.41 0.00 1.92 2.09 0.00 3.46 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.09 0.00 59 V 8.47 4.71 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 1.02 0.00 0.00 0.90 0.00 0.00 60 Y 8.97 5.48 0.00 2.78 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 61 A 8.78 4.61 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 62 Q 9.05 3.97 0.00 1.92 2.11 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 2.43 2.43 0.00 63 G 7.56 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 64 A 8.03 4.53 1.17 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 0.00 0.00 65 D 8.94 4.89 0.00 2.62 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 66 V 7.44 4.32 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 0.85 0.00 0.00 0.69 0.00 0.00 67 E 9.10 4.00 0.00 1.93 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 2.36 2.27 0.00 68 A 7.70 5.02 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 69 G 8.56 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 70 G 7.93 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.73 4.29 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 H 7.53 5.01 0.00 3.19 3.22 0.00 5.65 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 73 T 7.86 3.92 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 1.20 0.00 0.00 74 A 8.73 3.67 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 75 H 7.90 4.94 0.00 3.26 3.35 0.00 5.61 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 76 V 8.83 4.34 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 1.04 0.00 0.00 0.64 0.00 0.00 77 S 8.33 5.62 0.00 4.04 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 78 L 8.55 3.96 0.00 1.85 1.73 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.99 3.97 0.00 1.98 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 2.32 2.54 0.00 80 N 8.10 4.58 0.00 2.95 2.86 0.00 0.00 6.60 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.67 3.70 2.05 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.94 0.90 0.00 0.00 82 K 8.04 3.93 0.00 1.82 1.95 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.47 7.81 83 E 8.63 3.99 0.00 2.14 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 2.33 2.46 0.00 84 A 7.74 4.44 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 85 G 8.03 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.91 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 87 S 8.81 4.66 0.00 3.94 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 88 G 7.58 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 89 V 7.81 4.94 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 0.63 0.00 0.00 0.95 0.00 0.00 90 I 8.83 4.94 2.07 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 1.36 0.89 0.97 0.00 0.00 91 L 8.66 4.91 0.00 1.49 1.49 0.88 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.97 4.39 0.00 2.82 3.02 0.00 0.00 6.97 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 93 H 8.07 4.24 0.00 3.28 3.17 0.00 5.95 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.42 4.19 0.00 3.74 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 95 E 8.43 4.22 0.00 1.99 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 2.31 2.36 0.00 96 A 8.29 4.74 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 97 P 0.00 4.51 0.00 2.19 2.08 0.00 3.73 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 98 L 8.42 4.79 0.00 1.62 1.59 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.26 4.13 0.00 1.93 1.72 0.00 1.85 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.49 7.81 100 L 8.60 3.91 0.00 1.73 1.67 0.89 0.66 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 0.00 101 N 8.08 4.34 0.00 2.75 2.83 0.00 0.00 7.11 8.08 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 0.00 102 D 7.96 4.31 0.00 2.78 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 0.00 103 L 8.16 3.85 0.00 1.80 1.90 0.90 1.10 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 0.00 104 A 7.97 3.94 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 0.00 105 R 7.71 3.90 0.00 1.95 2.13 0.00 3.10 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 106 L 8.39 3.94 0.00 1.74 1.68 0.95 0.76 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 0.00 107 V 8.33 3.51 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 0.98 0.00 0.00 0.93 0.00 0.00 108 A 7.75 3.90 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 0.00 109 K 7.98 3.79 0.00 1.87 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.48 7.81 110 A 8.04 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 0.00 111 K 8.03 3.95 0.00 1.92 1.83 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.37 1.56 7.81 112 S 8.11 4.29 0.00 4.00 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 0.00 113 L 7.64 4.47 0.00 1.83 1.72 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.09 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 0.00 115 L 7.39 4.58 0.00 1.61 1.48 0.87 1.01 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 0.00 116 D 8.71 4.43 0.00 1.99 2.34 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 0.00 117 V 8.47 4.78 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 0.92 0.00 0.00 0.88 0.00 0.00 118 V 8.64 4.85 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 1.03 0.00 0.00 1.05 0.00 0.00 119 V 8.74 4.82 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 0.80 0.00 0.00 0.90 0.00 0.00 120 C 8.90 5.02 0.00 2.99 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 0.00 121 A 8.42 4.61 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 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.64 0.00 2.19 2.10 0.00 3.87 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 2.10 2.01 0.00 123 D 7.61 4.65 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 0.00 124 P 0.00 4.36 0.00 2.19 2.16 0.00 3.89 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 125 R 7.98 3.90 0.00 1.88 1.94 0.00 3.19 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 126 T 8.48 3.96 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 127 S 8.22 4.19 0.00 4.10 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 0.00 128 L 8.31 4.05 0.00 1.78 1.92 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.86 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 0.00 130 A 8.47 4.01 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 0.00 131 A 8.50 3.90 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 132 A 7.39 2.58 1.09 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 0.00 0.00 133 L 7.70 4.14 0.00 1.64 1.63 0.87 0.71 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 0.00 134 G 7.70 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 P 0.00 4.51 0.00 2.43 2.03 0.00 3.81 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 136 H 8.67 4.45 0.00 3.30 3.40 0.00 5.58 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 A 7.90 5.25 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 0.00 138 V 8.89 4.75 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 1.06 0.00 0.00 1.01 0.00 0.00 139 A 9.30 5.71 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 0.00 140 V 8.24 4.26 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 0.95 0.00 0.00 141 E 9.19 5.08 0.00 1.83 1.86 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 2.41 2.26 0.00 142 P 0.00 4.80 0.00 2.19 2.12 0.00 3.99 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 2.13 2.08 0.00 143 P 0.00 4.31 0.00 2.17 2.10 0.00 3.60 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 2.10 2.09 0.00 144 E 8.18 4.05 0.00 1.93 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 2.32 2.40 0.00 145 L 7.95 4.29 0.00 1.71 1.80 0.96 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 146 I 7.20 3.82 2.00 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 1.26 0.64 1.02 0.00 0.00 147 G 8.98 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 T 7.97 4.02 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 149 G 8.13 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 0.00 150 R 7.53 3.99 0.00 1.39 0.66 0.00 2.91 0.00 0.00 2.92 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.18 0.00 151 A 8.46 4.22 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 V 8.63 3.70 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.00 0.00 0.00 153 S 8.18 4.23 0.00 4.06 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 0.00 154 R 7.87 4.42 0.00 1.84 1.82 0.00 3.16 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 155 Y 8.56 4.27 0.00 3.03 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 0.00 156 K 8.67 5.04 0.00 1.78 1.69 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.46 7.81 157 P 0.00 4.32 0.00 2.30 2.46 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 158 E 8.24 3.93 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 159 A 7.79 4.04 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 0.00 160 I 7.54 3.65 2.05 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 0.86 0.93 0.00 0.00 161 V 7.98 3.60 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 1.00 0.00 0.00 1.02 0.00 0.00 162 E 8.81 4.00 0.00 2.20 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 2.32 2.36 0.00 163 T 7.79 3.88 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 164 V 8.01 3.73 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 1.02 0.00 0.00 1.01 0.00 0.00 165 G 8.07 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 0.00 166 L 8.09 4.01 0.00 1.77 1.77 0.94 1.13 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 0.00 167 V 8.11 3.72 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 1.25 0.00 0.00 1.03 0.00 0.00 168 S 8.08 4.20 0.00 4.07 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 R 7.56 3.99 0.00 2.10 1.76 0.00 3.19 0.00 0.00 3.31 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 170 H 7.50 4.25 0.00 2.27 1.43 0.00 5.65 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 F 8.15 5.14 0.00 3.12 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 P 0.00 4.31 0.00 2.19 2.37 0.00 3.86 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 173 E 8.22 4.09 0.00 2.13 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 0.00 2.43 2.40 0.00 174 V 7.91 4.09 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 0.77 0.00 0.00 1.04 0.00 0.00 175 S 9.14 4.73 0.00 3.95 3.79 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 0.00 176 V 8.30 4.95 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 1.15 0.00 0.00 0.97 0.00 0.00 177 I 8.84 5.08 1.94 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.64 0.95 0.00 0.00 178 T 8.33 5.05 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 179 G 9.04 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 A 8.94 4.05 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 G 8.71 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 0.00 182 I 7.71 3.91 1.89 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 1.50 0.87 0.93 0.00 0.00 183 E 10.37 4.62 0.00 1.90 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 2.40 2.21 0.00 184 S 7.95 5.03 0.00 4.09 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 0.00 185 G 9.23 3.62 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 0.00 186 D 8.08 4.40 0.00 2.70 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 0.00 187 D 7.95 4.36 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 V 7.59 3.56 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.00 0.00 0.00 189 A 8.42 4.00 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 0.00 190 A 8.36 3.91 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 0.00 191 A 7.86 3.95 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 0.00 192 L 7.91 4.13 0.00 1.85 1.74 0.92 1.06 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 0.00 193 R 8.10 4.02 0.00 1.93 2.00 0.00 3.16 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 194 L 7.60 4.32 0.00 1.79 1.71 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 195 G 7.90 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 T 7.39 4.30 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 197 R 10.06 4.56 0.00 1.81 1.90 0.00 3.44 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 198 G 6.92 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 0.00 199 V 8.04 4.69 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 1.00 0.00 0.00 0.95 0.00 0.00 200 L 9.03 5.34 0.00 1.79 1.49 1.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 201 L 9.09 4.31 0.00 1.77 1.72 0.95 0.86 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 0.00 202 A 8.60 4.85 1.48 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 0.00 0.00 203 S 8.08 3.79 0.00 3.86 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 0.00 204 A 7.99 3.94 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 0.00 205 A 7.77 4.09 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 0.00 206 V 7.72 3.36 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 0.61 0.00 0.00 0.96 0.00 0.00 207 K 7.92 4.21 0.00 1.67 1.67 0.00 1.46 0.00 0.00 1.53 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 0.96 7.81 208 A 7.03 4.14 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 0.00 209 K 8.59 4.11 0.00 1.74 1.87 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.39 7.81 210 D 7.58 4.77 0.00 2.63 2.50 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 0.00 211 P 0.00 4.21 0.00 2.21 2.08 0.00 3.68 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.25 0.00 212 Y 8.12 4.02 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 0.00 213 A 8.32 3.76 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 K 8.27 3.83 0.00 1.90 1.91 0.00 1.59 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.49 7.81 215 I 8.20 3.65 1.81 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 1.39 0.56 0.88 0.00 0.00 216 V 7.61 3.38 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 0.86 0.00 0.00 0.22 0.00 0.00 217 E 7.79 3.87 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 2.30 2.33 0.00 218 L 7.98 4.09 0.00 1.74 1.70 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 219 A 8.46 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 0.00 220 K 8.02 3.71 0.00 2.03 1.82 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.63 1.49 7.81 221 P 0.00 4.63 0.00 2.19 2.09 0.00 4.04 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.03 0.00 222 L 7.98 4.12 0.00 1.71 1.73 0.89 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 223 S 7.77 4.55 0.00 4.12 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 0.00 224 E 7.92 4.41 0.00 2.14 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 2.24 2.38 0.00 225 L 7.62 4.59 0.00 1.57 1.56 0.92 0.86 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 *226 R 7.92 4.15 0.00 1.62 1.73 0.00 3.28 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.