NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2532 7.8827 121.4437 61.1947 38.5798 173.8771 17 V 4.2347 7.9843 125.8620 61.5063 32.2097 174.6886 18 G 3.7027 9.0767 114.9448 46.2346 0.0000 173.5755 19 G 4.1548 7.7276 110.3434 44.6282 0.0000 172.6772 20 Y 4.9869 7.7394 118.0359 55.1987 42.2364 175.1904 21 T 4.2174 8.6279 117.1742 64.3506 68.4055 175.3211 22 C 4.3785 8.8939 125.0770 59.6359 40.1709 175.2097 23 G 4.0353 8.7525 106.7440 44.6348 0.0000 172.6189 24 A 4.4092 8.6702 125.3514 53.2918 18.5036 176.7327 25 N 4.2299 8.8346 120.3305 54.4519 36.3736 175.4131 26 T 4.1836 7.8022 107.6508 62.7037 70.0351 175.1194 27 V 4.0305 7.0647 122.6274 60.3260 31.0761 173.6935 28 P 4.5065 0.0000 0.0000 64.1358 32.0954 178.0607 29 Y 5.0303 6.9590 116.1136 56.6402 38.7759 174.6497 30 Q 4.4908 7.3991 123.2097 56.0704 29.6862 175.1308 31 V 4.8216 8.4034 124.8635 61.1817 34.8734 174.2758 32 S 4.9030 8.9805 120.5548 56.4982 64.9168 172.6028 33 L 4.6985 8.5426 127.6774 53.5741 43.1539 175.0836 34 N 5.8937 9.2531 122.7546 49.9786 41.9424 174.6558 *37 S 4.2314 8.2724 120.0307 58.0734 63.8707 174.2420 38 G 3.8713 9.6485 108.2447 45.8667 0.0000 171.7957 39 Y 4.5160 6.3000 115.0925 56.0862 40.0601 172.8266 40 H 4.6243 8.8324 121.4633 56.3876 30.3762 174.8166 41 F 5.0793 8.0096 119.1308 56.7557 39.5541 173.7500 42 C 4.7066 6.9452 115.1498 55.9990 44.8266 173.3504 43 G 4.3092 8.8331 109.3611 45.6264 0.0000 172.0547 44 G 4.5849 7.7783 103.6716 46.4022 0.0000 172.4853 45 S 5.3702 8.7525 114.9228 56.6048 67.2299 173.6284 46 L 4.8063 9.1413 127.6028 54.6801 42.6397 177.0401 47 I 4.3711 8.4190 119.2684 60.4469 38.9765 174.5455 48 N 4.3574 7.6529 117.6859 52.3405 39.0298 175.2311 49 S 4.3110 8.3595 112.8162 60.5932 63.0730 175.0650 50 Q 4.6449 8.1261 117.9653 55.1592 31.4144 174.7920 51 W 5.4686 8.5962 119.5074 54.7468 33.3466 174.3578 52 V 5.0437 9.1951 124.3669 61.0295 34.3735 174.3132 53 V 4.9274 8.8016 126.7952 60.5082 33.8481 174.8591 54 S 5.0102 9.1029 118.0940 57.5684 66.0938 172.1928 55 A 4.6941 8.5220 119.8258 50.8183 20.5110 178.5713 56 A 3.8570 8.2189 123.6677 55.1183 18.5089 179.4119 57 H 4.5019 8.3485 109.9278 57.5521 28.6751 175.4385 58 C 4.6650 7.7762 116.9878 57.1279 40.5729 173.2830 59 Y 4.2227 7.5612 121.6138 58.2545 38.6709 175.4793 60 K 3.8502 7.1725 123.7380 55.1991 36.2487 174.6948 61 S 4.4225 8.0153 115.0884 58.0680 63.5255 174.2114 62 G 3.9589 8.7657 115.9890 45.5453 0.0000 173.1733 63 I 4.2776 7.7102 119.7662 60.6531 38.8794 174.8003 64 Q 4.6617 8.8962 127.2212 54.2494 31.9298 174.0870 65 V 4.4736 8.9361 127.0257 61.7836 33.4117 174.5775 66 R 5.0838 8.9878 127.7771 54.8116 32.0842 175.3661 67 L 4.6879 8.9717 124.8187 52.8965 44.4697 177.8457 *69 G 4.1453 8.2671 107.6292 45.3401 0.0000 172.6426 70 E 4.3451 8.2324 118.9089 55.6758 29.9381 174.2981 71 D 4.9010 8.1592 119.6948 55.1752 44.0424 174.4212 72 N 4.9410 8.8296 117.8497 52.8356 39.3377 176.0049 73 I 4.0100 8.4040 119.1302 61.8400 37.7297 176.0568 74 N 4.8267 8.7479 117.8231 52.9615 39.8889 174.5132 75 V 4.3641 7.4134 117.2837 60.6099 33.9460 174.9171 76 V 4.1271 8.4161 127.0867 62.7908 31.9582 175.1561 77 E 4.5915 9.7010 124.7707 55.3158 31.1384 176.0403 78 G 4.0865 7.9463 107.7054 45.3931 0.0000 174.5766 79 N 4.8982 8.2607 114.8967 53.0294 39.9603 174.3348 80 E 5.4705 7.8872 118.0909 54.8652 31.5190 175.6550 81 Q 4.3789 8.4694 120.1483 54.2435 32.4118 174.1095 82 F 5.5292 8.6931 123.1801 56.1882 40.6520 175.4959 83 I 4.7572 8.8180 124.0315 59.7443 41.7223 174.8519 84 S 4.8839 8.5835 121.0188 57.2719 65.0303 173.2311 85 A 4.5610 8.1021 125.5099 52.2042 18.1559 177.8032 86 S 4.5959 9.0539 117.5316 59.6356 64.6514 174.5418 87 K 4.6941 7.5419 117.4495 55.6228 35.7566 174.7130 88 S 5.1631 8.7021 115.6455 56.7071 65.5108 173.0984 89 I 4.5772 9.0966 127.8167 59.4403 39.5475 175.0810 90 V 4.1455 8.4015 127.3838 62.2898 32.7145 175.1615 91 H 3.3279 8.7208 126.5616 55.9312 29.8633 174.1232 92 P 4.2492 0.0000 0.0000 65.4852 30.8652 176.8613 93 S 4.7043 7.7758 112.8534 57.9724 63.4600 173.1158 94 Y 4.3373 8.0127 122.8298 57.6383 39.0502 174.2580 95 N 4.7525 8.2636 125.7337 51.5241 40.5314 175.0698 96 S 3.9099 7.8889 119.2552 59.0845 63.9337 175.0442 97 N 4.3827 8.3059 119.3026 55.5227 38.5181 176.0907 98 T 3.9996 7.6325 105.4355 60.5913 70.1156 174.1925 99 L 3.6247 7.6397 121.2927 55.7490 39.4439 173.7513 100 N 4.6420 7.5294 115.8827 53.7923 40.0329 174.2973 101 N 4.9519 8.7861 120.9258 54.4541 35.6935 175.8754 102 D 4.8504 7.9683 117.1116 53.4355 38.9400 174.7516 103 I 4.7093 7.1818 120.5279 59.8133 42.1334 172.6461 104 M 5.5027 9.0315 126.4491 54.3723 36.3397 173.1637 105 L 5.5063 9.0560 123.4391 53.1225 45.5037 175.6008 106 I 5.0500 9.0326 123.1759 59.5000 41.2264 174.0803 107 K 3.8181 8.4744 128.5872 54.4713 33.6491 175.5859 108 L 4.4711 8.2476 127.9722 54.3565 41.7895 177.5825 109 K 4.1117 9.1062 122.7619 59.1730 32.5352 177.7490 110 S 4.5742 7.7314 113.1179 56.0661 66.9028 173.4102 111 A 4.4500 8.4880 124.9981 52.2076 18.6356 177.4842 112 A 4.2599 8.8581 124.0489 52.1707 19.5975 177.2750 113 S 4.5943 8.8162 116.4145 57.1946 63.5954 174.8856 114 L 4.4900 8.5363 125.3087 54.6090 42.6782 176.8053 115 N 4.4860 8.5345 116.0960 53.4494 41.0296 175.1859 116 S 4.3214 9.0265 112.7384 61.9418 63.0495 175.3508 117 R 4.2688 7.8670 116.4692 56.3826 30.7876 176.2272 118 V 4.4615 7.5192 118.1080 60.9107 33.7639 173.7448 119 A 5.1431 8.6825 128.3960 50.4610 22.9608 175.1106 120 S 5.2082 8.6958 114.4142 57.3074 65.4765 172.8853 121 I 4.4245 8.0236 120.4238 58.9811 39.8718 175.3833 122 S 4.3802 8.3993 124.3686 58.4150 63.9655 173.9119 123 L 4.2682 8.3776 123.5753 53.4359 42.4178 175.2637 124 P 4.4760 0.0000 0.0000 63.0094 32.1109 176.5638 125 T 4.0425 8.2644 109.6043 63.0165 69.6167 174.5320 *127 S 4.7448 7.5509 114.9584 58.1890 64.0511 173.6996 128 C 4.4984 8.3619 117.3827 56.2737 40.8995 173.5547 129 A 4.4733 7.9982 124.6612 51.2186 19.8541 177.4414 130 S 4.3150 8.0656 114.1556 57.1123 64.7820 173.3162 *132 A 4.3115 8.1828 123.5634 53.3993 19.3278 176.0646 133 G 4.1000 9.0347 109.5366 45.6151 0.0000 174.7674 134 T 3.9301 7.6348 116.4460 63.7788 69.4717 173.5859 135 Q 4.7097 8.5416 127.0013 55.8346 30.2133 175.2982 136 C 5.3276 9.1482 122.1677 55.1516 46.5431 172.3087 137 L 5.2160 8.7308 122.3621 53.4901 44.1881 175.1483 138 I 5.3976 8.9391 126.7100 58.9381 40.3970 174.7048 139 S 4.8004 8.0347 118.6062 57.0274 66.1397 173.1576 140 G 3.7105 7.7696 108.0881 46.1321 0.0000 173.1606 141 W 4.6720 8.8848 117.4324 56.3485 29.5333 176.9311 142 G 4.1511 7.9394 108.5840 43.6152 0.0000 173.6723 143 N 3.6671 8.2380 118.1940 54.1918 38.7499 174.5281 144 T 4.9660 8.2237 111.8877 60.4652 70.3068 173.8450 145 K 4.7161 7.8174 122.1823 54.4892 34.1793 176.1976 146 S 4.1788 8.8979 119.0100 61.0248 63.2361 174.9228 147 S 4.4473 8.7020 120.5598 57.4092 62.5075 173.0350 148 G 4.1650 7.5160 110.8606 43.3186 0.0000 170.4943 149 T 4.8047 7.8473 115.7899 61.8074 72.1161 174.4221 150 S 4.4468 9.4546 121.0019 57.8951 65.9193 172.4873 151 Y 4.9553 8.7930 126.0883 55.9166 38.8696 174.2999 152 P 4.6289 0.0000 0.0000 62.9314 32.5947 175.5443 153 D 4.9070 8.6935 117.6642 54.7320 42.9048 176.5676 154 V 5.4122 7.7076 110.2297 58.2142 34.7367 175.4521 155 L 3.2797 8.6537 124.5897 55.1779 43.0747 175.7682 156 K 4.8603 8.2393 125.2321 54.9406 34.9259 174.6793 157 C 5.2927 8.4052 119.9875 55.0816 44.7508 172.9449 158 L 4.9266 8.5863 122.9982 53.6100 45.5178 174.7794 159 K 5.0368 9.0065 125.5921 55.4975 33.2803 175.9666 160 A 4.8270 9.0122 126.4841 49.7038 23.2333 173.4416 161 P 4.9503 0.0000 0.0000 62.0761 33.6115 175.5399 162 I 4.2311 8.5623 123.2008 61.5768 38.0531 175.3404 163 L 4.9973 8.5406 126.5628 52.5368 44.1156 176.7761 164 S 4.2243 8.5332 115.4349 58.7180 63.6073 175.3684 165 D 4.4450 8.8065 122.9406 57.3970 40.4472 179.2075 166 S 4.1684 8.0729 114.7916 61.5757 62.8089 176.5835 167 S 4.3692 7.8808 119.1065 59.8609 62.7134 175.7095 168 C 4.3455 8.2361 122.7610 59.8196 43.3059 175.6028 169 K 3.9635 8.4128 118.7519 58.7492 31.7934 179.2582 170 S 4.2782 8.5072 115.4427 61.3079 62.8914 176.3942 171 A 3.9439 7.5842 123.2227 53.4391 19.5946 177.1875 172 Y 4.7796 7.5335 114.8168 54.8458 38.3808 171.9243 173 P 4.4913 0.0000 0.0000 63.9648 32.1774 176.6654 174 G 4.0409 8.9897 109.9259 46.4302 0.0000 173.7802 175 Q 4.5639 8.1022 118.1454 55.7101 30.7727 176.2250 176 I 4.2094 7.8942 119.0789 60.8364 37.6501 175.1654 177 T 4.7015 8.1896 114.5280 59.3216 71.3235 174.9943 178 S 4.2207 8.6067 115.0419 61.0253 63.1562 174.4381 179 N 5.0047 8.0893 118.2519 53.3068 38.5014 173.8882 180 M 5.6010 7.7985 116.4132 53.7471 36.1331 174.5505 181 F 5.1377 8.6755 116.0789 55.5892 42.3034 172.6021 182 C 6.0175 9.1931 115.8652 55.1386 41.1387 172.7834 183 A 4.9630 8.8785 122.5408 49.9915 22.1944 176.4920 184A G 3.7451 6.6062 108.2287 45.4164 0.0000 171.4650 184 Y 4.6235 8.0235 118.7511 56.0608 41.2193 176.4353 185 L 4.1175 8.6843 125.2591 57.4652 42.0186 178.4597 186 E 4.1863 8.2979 114.1699 56.4210 30.2858 178.6321 187 G 3.7693 8.4498 109.5356 46.4504 0.0000 174.1454 188A G 4.1572 8.9747 108.0688 45.3186 0.0000 174.1153 188 K 4.8618 7.5106 117.4045 54.8903 35.4658 175.5577 189 D 4.5646 8.5900 122.4485 53.6737 45.5931 175.2306 190 S 4.8959 8.2465 116.8516 59.0191 64.3853 171.9653 191 C 4.7389 8.6701 119.4457 55.8190 45.7335 172.5025 192 Q 4.4596 8.4058 118.3891 57.5496 28.6932 176.7096 193 G 4.2215 9.2426 108.8199 45.7609 0.0000 174.0408 194 D 4.6753 8.2475 118.3236 55.3254 41.8082 176.4501 195 S 4.2680 7.8962 114.7799 59.8426 63.2598 175.5344 196 G 4.1828 8.9386 113.7670 46.2994 0.0000 173.4670 197 G 4.4991 8.0885 108.0266 44.7345 0.0000 171.2181 198 P 5.0095 0.0000 0.0000 62.4258 33.3580 175.6118 199 V 4.7583 8.6137 121.4212 61.3516 34.4092 174.1503 200 V 4.9084 8.7972 128.5610 61.2874 34.0987 173.5782 201 C 5.1638 8.5323 124.6376 55.5408 43.8282 174.6251 202 S 3.5679 9.7244 120.6311 59.7745 59.9892 173.2542 203 G 3.9178 8.4815 104.5572 45.7323 0.0000 173.9080 204 K 4.7655 7.3984 117.6838 52.9346 35.5192 175.5448 *209 L 3.9635 8.2406 121.8502 55.5223 42.1925 176.0324 210 Q 4.5802 8.8420 125.6758 56.3847 30.9168 175.8411 211 G 5.3296 8.0605 104.8167 45.6722 0.0000 171.4727 212 I 5.2325 8.1807 120.1185 58.8208 41.1344 174.8625 213 V 3.5219 8.8569 127.2079 64.1510 31.8109 174.3442 214 S 4.8207 8.2960 120.5801 58.3441 64.2138 173.7274 215 W 4.7595 7.8061 114.0421 56.3330 31.7864 172.5752 216 G 3.5934 8.0315 106.6355 45.5969 0.0000 172.8717 217 S 4.5826 8.5707 116.7992 56.5383 64.8052 173.1893 *219 G 4.2355 8.1904 118.4140 45.5139 0.0000 172.3262 220 C 4.8174 8.2787 118.7828 56.5891 44.1631 174.0434 221A A 4.0006 9.3422 125.8057 52.9265 16.5664 177.2911 221 Q 4.3789 7.4106 117.1402 56.4309 29.3617 175.9876 222 K 4.1954 8.3588 122.4375 57.8432 32.7035 176.7840 223 N 4.4194 9.4942 122.5396 53.6783 36.9317 175.1829 224 K 4.3179 7.3699 118.2109 53.5567 31.9809 173.5434 225 P 4.6201 0.0000 0.0000 62.0567 33.1455 177.0970 226 G 3.6410 8.4673 105.9568 46.0498 0.0000 172.8704 227 V 4.6420 8.0208 122.4358 60.8555 34.1314 174.1785 228 Y 4.9461 8.0916 123.3993 56.0775 42.3604 174.8654 229 T 4.4223 8.6728 120.1972 63.7422 70.0616 174.0887 230 K 5.1132 9.1049 128.5879 55.1241 31.3451 176.8891 231 V 3.9833 8.9806 126.2807 65.8765 31.4179 174.7545 232 C 4.5714 8.4388 112.5695 58.5524 41.3492 175.0150 233 N 4.2084 8.1580 117.0953 54.6600 38.4362 175.4498 234 Y 4.7912 8.3387 117.3360 57.2565 39.2773 177.2546 235 V 3.6751 7.9841 120.2769 66.3124 31.4579 177.8672 236 S 4.1091 8.0649 114.1055 61.4676 62.8596 176.3189 237 W 4.1614 8.3169 130.5222 60.4171 30.3766 177.8618 238 I 3.0323 8.3095 120.2504 63.9671 36.6111 178.1148 239 K 3.6382 8.1671 119.5745 59.8072 31.7583 179.1019 240 Q 3.8422 7.7969 117.9497 59.4282 29.1577 178.0241 241 T 3.7573 7.3864 116.6906 66.5925 68.1460 176.8885 242 I 2.4011 6.9668 120.4657 63.7101 36.9790 178.1042 243 A 4.1645 7.5252 120.6405 53.6714 18.2218 178.0543 244 S 4.7974 7.4541 111.6243 57.8123 63.6376 174.0699 245 N 4.6493 8.0535 123.8343 54.7244 39.4807 174.4003 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 I 7.88 4.25 1.79 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 1.44 1.05 0.85 0.00 0.00 17 V 7.98 4.23 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 1.25 0.00 0.00 0.91 0.00 0.00 18 G 9.08 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 0.00 0.00 0.00 0.00 19 G 7.73 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.74 4.99 0.00 3.03 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.63 4.22 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 22 C 8.89 4.38 0.00 2.75 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 23 G 8.75 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 0.00 0.00 0.00 24 A 8.67 4.41 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 25 N 8.83 4.23 0.00 2.84 2.88 0.00 0.00 7.18 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 26 T 7.80 4.18 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 1.26 0.00 0.00 27 V 7.06 4.03 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.51 0.00 2.28 2.36 0.00 3.64 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 2.16 1.99 0.00 29 Y 6.96 5.03 0.00 3.25 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 30 Q 7.40 4.49 0.00 1.79 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.47 0.00 0.00 0.00 0.00 0.00 1.91 2.36 0.00 31 V 8.40 4.82 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 0.84 0.00 0.00 1.02 0.00 0.00 32 S 8.98 4.90 0.00 3.18 3.37 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 33 L 8.54 4.70 0.00 0.78 0.97 0.79 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.25 5.89 0.00 2.43 2.51 0.00 0.00 6.56 7.11 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 *37 S 8.27 4.23 0.00 3.71 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 0.00 38 G 9.65 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 39 Y 6.30 4.52 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.83 4.62 0.00 2.86 3.18 0.00 5.86 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 41 F 8.01 5.08 0.00 3.15 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.95 4.71 0.00 2.13 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 43 G 8.83 4.31 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 0.00 44 G 7.78 4.58 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 45 S 8.75 5.37 0.00 3.83 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 46 L 9.14 4.81 0.00 1.87 1.66 1.08 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.42 4.37 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.05 0.95 0.00 0.00 48 N 7.65 4.36 0.00 2.93 2.98 0.00 0.00 6.55 8.04 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 49 S 8.36 4.31 0.00 4.13 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 50 Q 8.13 4.64 0.00 2.06 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 51 W 8.60 5.47 0.00 3.23 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 52 V 9.20 5.04 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 1.12 0.00 0.00 0.99 0.00 0.00 53 V 8.80 4.93 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.07 0.00 0.00 54 S 9.10 5.01 0.00 3.86 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.52 4.69 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 56 A 8.22 3.86 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.35 4.50 0.00 3.37 3.58 0.00 5.55 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 7.78 4.66 0.00 3.21 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 59 Y 7.56 4.22 0.00 2.98 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 60 K 7.17 3.85 0.00 1.31 1.21 0.00 0.61 0.00 0.00 0.95 0.00 0.00 2.55 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 0.84 7.81 61 S 8.02 4.42 0.00 3.75 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 62 G 8.77 3.96 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 0.00 63 I 7.71 4.28 1.88 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 1.43 0.64 0.95 0.00 0.00 64 Q 8.90 4.66 0.00 1.99 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.87 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 65 V 8.94 4.47 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 0.99 0.00 0.00 0.91 0.00 0.00 66 R 8.99 5.08 0.00 1.72 1.76 0.00 2.69 0.00 0.00 2.36 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.24 0.00 67 L 8.97 4.69 0.00 1.65 1.64 0.99 0.97 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 *69 G 8.27 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.23 4.35 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.15 0.00 71 D 8.16 4.90 0.00 2.79 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.83 4.94 0.00 2.87 2.85 0.00 0.00 7.19 7.67 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 73 I 8.40 4.01 1.41 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.51 -0.52 0.00 0.00 74 N 8.75 4.83 0.00 2.84 2.86 0.00 0.00 6.58 7.54 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 75 V 7.41 4.36 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.42 4.13 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 0.80 0.00 0.00 1.04 0.00 0.00 77 E 9.70 4.59 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 78 G 7.95 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 0.00 0.00 0.00 79 N 8.26 4.90 0.00 2.84 2.81 0.00 0.00 7.13 7.65 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 80 E 7.89 5.47 0.00 1.34 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.31 0.00 81 Q 8.47 4.38 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 82 F 8.69 5.53 0.00 2.84 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 83 I 8.82 4.76 1.88 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 1.24 0.69 0.94 0.00 0.00 84 S 8.58 4.88 0.00 3.75 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 85 A 8.10 4.56 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 86 S 9.05 4.60 0.00 3.76 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 87 K 7.54 4.69 0.00 1.85 1.89 0.00 1.45 0.00 0.00 1.88 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.51 7.81 88 S 8.70 5.16 0.00 3.98 3.96 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 89 I 9.10 4.58 2.08 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 1.25 0.79 1.18 0.00 0.00 90 V 8.40 4.15 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 0.60 0.00 0.00 0.76 0.00 0.00 91 H 8.72 3.33 0.00 2.87 3.09 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.25 0.00 2.13 2.17 0.00 2.53 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.81 0.00 93 S 7.78 4.70 0.00 4.03 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 94 Y 8.01 4.34 0.00 3.08 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 95 N 8.26 4.75 0.00 2.54 2.37 0.00 0.00 6.53 7.13 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 96 S 7.89 3.91 0.00 4.02 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 97 N 8.31 4.38 0.00 2.78 2.78 0.00 0.00 6.80 7.49 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 98 T 7.63 4.00 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 1.08 0.00 0.00 99 L 7.64 3.62 0.00 1.47 1.87 0.83 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.53 4.64 0.00 2.76 2.62 0.00 0.00 7.35 6.67 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 0.00 101 N 8.79 4.95 0.00 2.94 2.68 0.00 0.00 7.29 8.44 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 0.00 102 D 7.97 4.85 0.00 3.06 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 0.00 103 I 7.18 4.71 1.51 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 1.33 1.00 0.17 0.00 0.00 104 M 9.03 5.50 0.00 2.17 1.83 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.67 0.00 105 L 9.06 5.51 0.00 1.99 1.76 0.90 -0.18 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 0.00 106 I 9.03 5.05 1.93 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 1.20 0.97 0.89 0.00 0.00 107 K 8.47 3.82 0.00 0.79 1.14 0.00 1.36 0.00 0.00 1.38 0.00 0.00 2.61 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.76 0.21 7.81 108 L 8.25 4.47 0.00 1.44 1.59 1.00 0.88 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 0.00 109 K 9.11 4.11 0.00 1.68 1.84 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.38 7.81 110 S 7.73 4.57 0.00 3.77 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.49 4.45 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 0.00 112 A 8.86 4.26 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 0.00 0.00 0.00 0.00 0.00 113 S 8.82 4.59 0.00 3.76 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.54 4.49 0.00 1.66 1.62 0.96 1.09 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 0.00 115 N 8.53 4.49 0.00 2.77 2.91 0.00 0.00 7.22 7.54 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 0.00 116 S 9.03 4.32 0.00 3.89 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 0.00 117 R 7.87 4.27 0.00 1.80 2.14 0.00 3.15 0.00 0.00 3.30 7.33 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.74 0.00 4.00 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 0.00 128 C 8.36 4.50 0.00 2.95 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.00 4.47 1.11 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 0.00 130 S 8.07 4.31 0.00 3.98 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 *132 A 8.18 4.31 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 0.00 0.00 0.00 0.00 0.00 133 G 9.03 4.10 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 0.00 0.00 0.00 134 T 7.63 3.93 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 135 Q 8.54 4.71 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 136 C 9.15 5.33 0.00 2.87 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 0.00 137 L 8.73 5.22 0.00 1.80 1.56 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.94 5.40 1.89 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 1.64 1.03 0.00 0.00 139 S 8.03 4.80 0.00 3.60 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.77 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 0.00 141 W 8.88 4.67 0.00 3.22 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 0.00 142 G 7.94 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.24 3.67 0.00 2.12 2.55 0.00 0.00 7.36 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 0.00 144 T 8.22 4.97 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 1.19 0.00 0.00 145 K 7.82 4.72 0.00 1.80 1.74 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.30 1.32 7.81 146 S 8.90 4.18 0.00 4.03 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 0.00 147 S 8.70 4.45 0.00 3.85 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 0.00 148 G 7.52 4.17 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 0.00 149 T 7.85 4.80 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 150 S 9.45 4.45 0.00 3.83 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 0.00 151 Y 8.79 4.96 0.00 2.92 2.95 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 0.00 152 P 0.00 4.63 0.00 2.45 2.09 0.00 4.06 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.09 0.00 153 D 8.69 4.91 0.00 2.68 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 0.00 154 V 7.71 5.41 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 1.10 0.00 0.00 0.98 0.00 0.00 155 L 8.65 3.28 0.00 1.50 1.23 0.55 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.24 4.86 0.00 1.83 1.51 0.00 1.48 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.30 1.34 7.81 157 C 8.41 5.29 0.00 1.65 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.59 4.93 0.00 1.67 1.43 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.01 5.04 0.00 1.84 1.84 0.00 1.88 0.00 0.00 1.78 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.66 7.81 160 A 9.01 4.83 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 0.00 161 P 0.00 4.95 0.00 2.00 2.08 0.00 2.95 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 1.82 1.74 0.00 162 I 8.56 4.23 1.69 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.29 0.70 0.00 0.00 163 L 8.54 5.00 0.00 1.53 1.57 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.53 4.22 0.00 4.00 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 0.00 165 D 8.81 4.45 0.00 2.73 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 0.00 166 S 8.07 4.17 0.00 4.05 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 0.00 167 S 7.88 4.37 0.00 4.02 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.24 4.35 0.00 3.19 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 0.00 169 K 8.41 3.96 0.00 1.84 1.91 0.00 1.90 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.57 7.81 170 S 8.51 4.28 0.00 4.01 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 0.00 171 A 7.58 3.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.53 4.78 0.00 3.05 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 0.00 173 P 0.00 4.49 0.00 2.08 2.05 0.00 3.89 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 174 G 8.99 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 0.00 0.00 0.00 175 Q 8.10 4.56 0.00 2.50 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.28 6.50 0.00 0.00 0.00 0.00 0.00 2.30 2.58 0.00 176 I 7.89 4.21 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.89 1.00 0.00 0.00 177 T 8.19 4.70 4.28 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 1.24 0.00 0.00 178 S 8.61 4.22 0.00 4.01 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 0.00 179 N 8.09 5.00 0.00 2.88 3.10 0.00 0.00 6.58 9.03 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 0.00 180 M 7.80 5.60 0.00 1.88 2.13 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 2.64 2.59 0.00 181 F 8.68 5.14 0.00 3.09 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 9.19 6.02 0.00 2.99 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 0.00 183 A 8.88 4.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.61 3.75 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 0.00 0.00 0.00 184 Y 8.02 4.62 0.00 3.02 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 0.00 185 L 8.68 4.12 0.00 1.74 1.73 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.30 4.19 0.00 2.10 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 2.37 2.34 0.00 187 G 8.45 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 8.97 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.51 4.86 0.00 1.65 1.77 0.00 0.61 0.00 0.00 1.22 0.00 0.00 2.27 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.43 1.22 7.81 189 D 8.59 4.56 0.00 2.84 2.51 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 0.00 190 S 8.25 4.90 0.00 3.78 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 0.00 191 C 8.67 4.74 0.00 2.94 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 0.00 192 Q 8.41 4.46 0.00 2.41 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 5.14 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 193 G 9.24 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.25 4.68 0.00 2.96 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 7.90 4.27 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 0.00 196 G 8.94 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 0.00 197 G 8.09 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 0.00 0.00 0.00 0.00 198 P 0.00 5.01 0.00 2.36 2.37 0.00 3.70 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 199 V 8.61 4.76 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 0.90 0.00 0.00 0.86 0.00 0.00 200 V 8.80 4.91 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 0.90 0.00 0.00 0.69 0.00 0.00 201 C 8.53 5.16 0.00 2.80 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.72 3.57 0.00 3.96 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 0.00 203 G 8.48 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 0.00 204 K 7.40 4.77 0.00 1.65 1.64 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.24 3.96 0.00 1.52 1.65 1.03 0.75 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 0.00 210 Q 8.84 4.58 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.43 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 211 G 8.06 5.33 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 0.00 212 I 8.18 5.23 1.91 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 1.30 0.78 0.96 0.00 0.00 213 V 8.86 3.52 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 0.96 0.00 0.00 1.12 0.00 0.00 214 S 8.30 4.82 0.00 4.01 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 0.00 215 W 7.81 4.76 0.00 3.31 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 0.00 216 G 8.03 3.59 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 0.00 217 S 8.57 4.58 0.00 4.26 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 *219 G 8.19 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 0.00 0.00 0.00 0.00 220 C 8.28 4.82 0.00 2.94 2.95 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 221A A 9.34 4.00 1.41 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 0.00 221 Q 7.41 4.38 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 222 K 8.36 4.20 0.00 1.72 1.72 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.47 7.81 223 N 9.49 4.42 0.00 2.86 2.89 0.00 0.00 6.80 7.73 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 0.00 224 K 7.37 4.32 0.00 1.66 1.78 0.00 1.73 0.00 0.00 1.34 0.00 0.00 2.72 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.47 7.81 225 P 0.00 4.62 0.00 2.14 2.11 0.00 3.73 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 226 G 8.47 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 0.00 227 V 8.02 4.64 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 -0.66 0.00 0.00 228 Y 8.09 4.95 0.00 1.43 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.67 4.42 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 230 K 9.10 5.11 0.00 2.14 1.91 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.61 1.77 7.81 231 V 8.98 3.98 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 0.97 0.00 0.00 1.07 0.00 0.00 232 C 8.44 4.57 0.00 3.17 3.25 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 0.00 233 N 8.16 4.21 0.00 2.24 2.38 0.00 0.00 6.95 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 0.00 234 Y 8.34 4.79 0.00 3.21 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.98 3.68 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 1.21 0.00 0.00 1.09 0.00 0.00 236 S 8.06 4.11 0.00 3.97 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 0.00 237 W 8.32 4.16 0.00 3.49 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 8.31 3.03 1.97 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 0.89 0.70 0.00 0.00 239 K 8.17 3.64 0.00 1.89 1.80 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.60 7.81 240 Q 7.80 3.84 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 241 T 7.39 3.76 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 0.86 0.00 0.00 242 I 6.97 2.40 1.38 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 -0.36 0.43 0.00 0.00 243 A 7.53 4.16 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 0.00 0.00 0.00 0.00 0.00 244 S 7.45 4.80 0.00 3.91 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 8.05 4.65 0.00 3.03 3.08 0.00 0.00 6.99 7.80 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 * Residues marked with a * may have inaccurate shift predictions.