NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.9170 8.3544 109.7366 44.9860 0.0000 173.5599 1 M 4.3881 7.7848 118.8815 52.9082 34.6131 172.5051 2 A 4.3565 9.4636 131.0293 51.3963 20.4853 175.7836 3 L 4.8887 8.3070 122.5153 52.9419 44.9411 175.8525 4 Q 4.4388 8.1702 120.9823 54.1067 32.1047 174.1355 5 L 4.1400 8.4898 127.0164 54.2988 42.5568 176.5486 6 S 4.0314 8.7611 122.1366 59.4341 63.0481 174.3763 7 R 4.2531 8.2301 124.3214 53.7367 30.6561 172.8236 8 E 3.8462 8.7291 124.9610 56.7681 29.2064 176.1764 9 Q 4.3818 8.3643 125.6747 54.6792 31.1990 176.0594 10 G 3.9445 8.3916 108.8092 45.2666 0.0000 172.4739 11 I 4.3917 8.4870 119.6507 59.8426 38.6772 176.0024 12 T 4.7423 8.1034 114.7046 59.5775 72.5860 175.4445 13 A 4.0846 8.4303 122.0931 55.5053 18.4142 180.0005 14 R 4.0639 8.2785 116.2581 59.3061 30.2211 179.3200 15 G 3.6799 8.3285 105.5798 47.8698 0.0000 175.6249 16 S 4.2028 8.5926 115.9732 61.0464 62.4185 175.9651 17 A 4.0604 8.2482 123.4570 55.2123 18.1246 179.2317 18 E 3.9156 8.3265 117.6501 59.5244 29.7743 178.9716 19 I 3.8188 7.8931 119.8216 64.5738 37.2052 178.6688 20 V 3.8421 8.2290 118.8136 66.0485 31.4271 177.9442 21 A 4.3336 8.4731 120.7641 55.1240 18.2059 179.2395 22 E 3.9660 8.5823 117.9669 59.4211 29.7625 178.6361 23 F 4.3773 8.4526 122.0692 60.9075 39.2938 177.1374 24 F 3.8439 8.2055 117.2278 60.2287 38.6636 177.4680 25 S 3.9786 8.0823 112.8194 61.5422 62.1181 176.4126 26 F 4.1693 8.1312 120.4103 60.4046 38.6919 177.9315 27 G 3.2625 8.0758 105.7825 47.6881 0.0000 175.8339 28 I 3.6346 7.9005 122.6063 64.0912 37.1731 178.0615 29 N 4.3069 7.9024 117.2284 56.6763 38.4068 177.5614 30 S 4.0724 8.1891 116.3202 61.5540 62.8092 176.8973 31 I 3.2430 7.5337 122.3251 64.2340 36.8080 178.3410 32 L 3.9509 7.8778 119.8858 57.9636 41.5674 179.1270 33 Y 3.5581 7.8214 119.1187 60.7864 38.5037 178.0618 34 Q 3.8049 8.2109 117.7649 58.1832 28.7790 178.0312 35 R 4.5168 7.9702 117.0980 54.7602 30.4163 176.3237 36 G 3.9874 7.6912 105.8774 46.5415 0.0000 175.8119 37 I 3.9304 8.0065 122.8392 63.3273 37.3838 176.5205 38 Y 4.7330 7.7995 115.4857 55.0403 41.6480 173.4775 39 P 4.5508 0.0000 0.0000 62.4003 32.3919 177.6644 40 S 4.6633 8.9950 115.9994 61.8090 62.8975 176.5822 41 E 4.1148 8.3687 119.3615 59.0184 29.4750 177.4404 42 T 4.3358 8.3208 108.2930 61.4784 69.0352 173.7366 43 F 5.3432 8.0274 120.1376 56.2688 42.1026 174.4849 44 T 4.7540 8.9946 115.6906 60.3089 71.1394 172.7502 45 R 4.9067 8.5241 125.2597 55.5947 31.3117 176.2135 46 V 4.5897 9.0212 122.4369 60.1626 35.6204 173.9823 47 Q 4.9610 8.4196 120.4733 54.4879 30.1427 175.3495 48 K 3.8617 9.0147 123.1609 56.6248 35.1816 174.8339 49 Y 3.7546 8.8076 121.6587 59.1500 35.3942 171.4536 50 G 3.9369 8.4366 104.8807 45.7832 0.0000 173.6557 51 L 4.7339 7.8220 118.7952 52.8203 45.1795 175.6609 52 T 4.8793 8.2764 116.8399 62.5759 69.2081 174.3351 53 L 4.7815 9.0501 127.0251 52.8280 45.2614 175.5564 54 L 5.0856 8.1955 120.8440 53.4793 43.1057 176.4720 55 V 4.8364 8.6934 116.5190 59.4050 35.6881 175.2956 56 T 3.9344 8.9303 118.8841 62.4298 67.6597 174.0770 57 T 4.4298 8.2927 115.8078 61.2122 70.2482 173.5644 58 D 4.3565 7.8245 123.9907 53.9717 41.5943 176.1504 59 L 3.9356 8.8556 127.5564 58.3014 41.5726 179.4186 60 E 3.9569 8.0899 117.4863 59.4268 29.4546 179.1228 61 L 3.9899 8.4321 120.5054 57.9702 42.0007 179.0024 62 I 3.5867 7.9738 120.2512 64.1674 37.0421 178.2748 63 K 3.8756 7.9722 120.3601 59.5763 32.0172 178.0251 64 Y 3.9984 8.2210 119.8791 60.8581 38.7874 178.0163 65 L 3.8913 8.4083 120.1863 57.8194 41.6448 179.1089 66 N 4.2439 8.2966 116.9668 56.7698 38.9257 176.6850 67 N 4.2563 8.1827 117.8887 56.1498 38.5100 177.6001 68 V 3.6998 7.6250 119.6603 66.0751 31.6807 178.2276 69 V 3.5961 8.1743 118.3362 66.1493 31.1846 177.8511 70 E 3.9484 8.4300 118.5868 59.2990 29.2638 179.1678 71 Q 3.5562 7.8483 119.2690 58.7350 28.9539 177.7305 72 L 3.9758 7.9712 121.6392 58.0832 42.1852 179.0891 73 K 3.9946 8.0635 118.3917 59.5022 31.7994 178.7878 74 D 4.3587 7.5704 116.7589 57.2457 41.1574 178.3625 75 W 4.5065 8.0547 119.4762 59.7954 28.9453 178.5600 76 L 4.1533 8.5641 119.4625 58.0237 40.8573 178.8109 77 Y 4.2847 7.9307 118.0735 60.4210 38.8006 177.5005 78 K 4.1444 7.8144 116.1551 55.3464 32.5987 176.6352 79 S 3.8553 8.0228 114.4840 59.9106 61.0287 173.1539 80 S 4.6853 8.4808 116.5895 58.4873 64.2452 174.2677 81 V 4.3971 7.7754 120.2511 61.8977 31.8284 175.4090 82 Q 4.5388 9.2718 127.6867 57.7837 30.5085 175.6961 83 K 4.9619 7.5954 114.9286 56.0241 35.7800 174.1082 84 L 5.3734 8.9434 123.1847 53.4055 45.2841 175.2476 85 V 5.1525 9.5044 125.6747 61.2569 35.1743 174.1138 86 V 4.8891 9.2814 128.2192 61.5919 33.2633 174.3945 87 V 4.7724 9.1348 129.8190 61.9481 33.1520 174.4784 88 I 5.1861 9.1901 129.4068 59.8866 39.3917 174.9108 89 S 5.2523 8.8957 122.6166 56.1613 67.2502 173.1453 90 N 4.5516 9.2031 122.6202 53.9431 39.0066 175.6245 91 I 3.6166 8.6799 127.7035 64.1222 38.1497 176.7979 92 E 4.1567 8.7526 122.5746 57.9665 29.6974 177.1246 93 S 4.4912 8.3238 110.9330 57.5168 64.5312 175.1395 94 G 3.9057 8.4446 108.7247 44.8490 0.0000 173.0636 95 E 4.0123 7.9146 122.0160 56.2927 30.6772 176.0116 96 V 4.1269 8.5418 127.4950 63.2052 31.5912 175.1188 97 L 4.6655 9.1897 128.5712 56.0796 43.8799 176.4761 98 E 5.2140 8.0082 115.9735 55.0765 34.6183 174.9112 99 R 5.0972 8.9653 120.9702 54.4998 33.9971 174.9517 100 W 4.6328 9.8065 126.7274 55.8222 30.0407 175.1501 101 Q 4.8992 8.7513 127.5637 54.2767 30.8580 174.2031 102 F 5.8323 9.2611 125.5526 55.2257 41.5849 174.0060 103 D 5.0292 8.7470 124.7520 53.5541 42.2475 175.5781 104 I 4.9574 8.5886 125.0214 59.7192 39.1193 174.9237 105 E 4.7808 9.2283 126.8980 54.6511 31.9870 175.2559 106 S 5.0672 8.6471 119.2431 56.7387 66.5690 173.5155 107 D 4.6524 8.9643 124.0903 52.8042 41.2746 177.0193 108 K 4.2467 8.6864 125.1841 57.7239 32.3082 178.1850 109 T 4.1535 8.1817 108.7503 61.9604 69.4410 175.1186 110 A 3.8614 7.4230 126.6485 52.0572 18.7778 176.8132 *115 A 4.1359 8.3267 125.4674 50.7599 19.8112 174.4285 116 P 4.5538 0.0000 0.0000 63.3917 31.9186 176.4076 117 R 4.0750 9.2978 121.1131 56.6331 31.4609 176.0360 118 E 4.5242 8.6872 122.6819 54.9430 28.9193 174.6422 119 K 4.5114 7.9888 123.3779 53.6180 35.8183 176.5150 120 S 4.4455 8.5531 121.1754 58.1190 65.2442 175.3219 121 Q 4.0194 8.5491 122.3722 58.9581 28.4954 178.8974 122 K 3.8697 8.0742 119.9582 59.6211 32.1889 178.4980 123 A 3.9926 7.9345 120.7042 55.1887 18.1639 179.7617 124 I 3.7087 7.6988 117.9066 64.6320 37.2418 178.6465 125 Q 3.9869 8.4028 119.2222 59.0154 28.3603 178.6382 126 D 4.3782 8.2966 120.0891 57.3025 40.9229 178.7487 127 E 3.9416 7.9287 118.8231 59.4403 29.4436 179.3440 128 I 2.9538 7.5996 120.1813 64.0041 36.9829 178.2045 129 R 3.7198 8.1409 119.7790 59.7130 29.7935 178.7252 130 S 4.1268 7.7056 114.7606 61.4955 62.8435 176.8532 131 V 3.6870 7.6370 120.6894 66.1129 31.1035 178.1281 132 I 3.8052 7.9829 119.7149 64.5093 36.9641 178.6042 133 R 4.0584 8.0811 118.8385 59.5322 29.8596 179.2309 134 Q 4.1843 8.3592 117.6604 58.7006 28.3851 178.9444 135 I 4.0892 7.5932 120.4750 64.8577 37.6579 178.2520 136 T 4.0917 7.7235 114.9656 66.5808 68.4167 176.7354 137 A 4.1944 8.2751 122.7343 55.4911 18.3293 179.5934 138 T 4.0542 8.5522 114.7199 67.0992 68.6970 176.6611 139 V 3.7185 7.7637 118.9841 66.3668 31.2638 178.0682 140 T 3.8879 7.8038 107.8629 63.7996 68.6213 175.5107 141 F 4.5269 8.0202 119.0522 56.8954 39.8214 175.9382 142 L 3.9515 6.8192 118.1619 52.6813 42.4719 174.8798 143 P 4.2802 0.0000 0.0000 62.5895 31.7894 176.3504 144 L 3.8688 8.3938 123.5444 55.1420 42.4062 176.1106 145 L 4.4808 8.4291 128.2248 54.1612 41.8957 175.3334 146 E 4.7699 8.6863 126.3168 55.9945 30.4487 176.3317 147 V 4.5612 7.5798 110.2472 59.3780 35.5384 175.4113 148 S 4.4844 8.4542 118.5223 58.7420 63.8829 173.1544 149 C 5.6554 8.7251 120.9619 57.9907 32.2740 172.7068 150 S 5.0942 9.0959 114.8525 56.5750 66.1351 172.6833 151 F 6.2852 8.6397 113.9086 54.3099 41.0583 174.0574 152 D 4.4495 8.6428 118.3670 52.4903 45.1181 174.0792 153 L 5.2254 8.7313 125.2803 53.7532 43.5779 175.0299 154 L 4.9007 9.1674 127.5384 53.0439 44.3142 175.7513 155 I 5.0559 8.5566 123.8545 59.8951 39.7580 174.4613 156 Y 4.5430 9.4750 126.6632 57.0198 39.2710 175.2677 157 T 4.8891 8.0971 113.8148 59.1115 72.5194 173.2962 158 D 4.4037 8.2496 121.1708 54.3515 41.1463 178.6023 159 K 3.9148 8.8996 122.1362 59.2194 32.2305 177.3776 160 D 4.7043 7.7953 115.6914 52.6795 39.6656 176.1191 161 L 3.9095 7.3008 121.7106 55.0746 42.5014 176.6009 162 V 3.7425 8.1100 125.4022 62.0319 31.8047 175.6630 163 V 3.7547 8.2839 127.9086 62.0876 31.8300 173.9687 164 P 4.6664 0.0000 0.0000 61.6174 32.1985 175.7237 165 E 4.2758 8.4428 119.1972 58.1175 29.7696 178.0638 166 K 4.1866 8.9140 120.0817 56.1708 30.7406 176.5883 167 W 4.8151 7.8289 117.3864 54.9677 30.9845 175.1496 168 E 4.8415 8.3978 117.1326 54.4959 32.1732 174.7868 169 E 4.1003 8.7420 120.2315 56.3151 30.0838 176.5917 170 S 4.6777 8.2948 118.0166 56.0152 64.7206 173.4790 171 G 3.7822 8.1645 113.1430 44.5670 0.0000 172.0121 172 P 4.2073 0.0000 0.0000 62.3317 32.2073 175.8121 173 Q 3.3323 7.7420 117.2135 56.6936 26.1098 174.0936 174 F 4.5038 7.6184 114.4791 58.0753 40.0095 175.3574 175 I 4.5864 8.3387 123.8591 59.5186 40.0738 174.2606 176 T 4.6164 7.6657 113.2342 60.1512 72.2523 172.3230 177 N 4.0533 8.4852 116.9978 55.0097 37.2486 172.9646 178 S 5.1356 7.7270 109.5578 56.6135 66.4316 173.3898 179 E 4.6424 8.0966 119.2793 54.4879 33.2815 174.7773 180 E 5.1995 8.5130 119.2835 54.6119 33.4529 175.8730 181 V 4.3041 8.6692 122.2407 61.1491 34.2564 174.2375 182 R 4.6245 8.6267 128.9657 55.6051 30.8771 175.7097 183 L 4.7867 8.4581 126.5599 52.6991 44.2121 176.3220 184 R 4.0250 9.2735 121.2340 56.6477 30.4403 175.9272 185 S 5.0457 8.3155 118.3374 57.2843 65.4363 172.6965 186 F 5.2132 8.3722 114.0826 55.8639 41.3540 173.3099 187 T 5.0927 9.2547 113.8247 61.1669 70.3176 173.6510 188 T 4.4456 8.8884 115.4471 61.4386 69.7691 175.1297 189 T 3.6300 8.2512 112.3405 61.4209 69.0831 172.6380 190 I 4.2044 7.6271 121.5463 62.6259 39.2622 175.4671 191 H 5.4002 8.4831 117.8308 53.6376 32.7898 172.7989 192 K 4.7789 9.1679 123.2082 54.4894 35.2912 174.6690 193 V 4.5982 8.0769 127.6800 61.2303 33.6307 173.8942 194 N 5.1997 9.2725 126.1826 52.0775 40.8760 174.3872 195 S 5.2816 8.4550 117.7022 57.1397 67.0806 172.8326 196 M 5.1685 8.3428 120.1037 54.3578 35.1206 173.6934 197 V 4.3845 8.4093 118.5035 59.7184 34.5951 174.0773 198 A 5.0834 8.6973 127.4355 50.2845 20.9683 175.0721 199 Y 5.1299 8.6991 121.1592 54.8167 41.4339 174.9117 200 K 4.5011 8.9118 124.6178 56.3241 33.1477 176.2822 201 I 4.1488 8.2770 128.9919 60.3106 37.6043 174.5722 202 P 4.5393 0.0000 0.0000 62.3151 32.1457 175.6499 203 V 4.3968 7.8761 118.4439 60.4127 33.4073 176.4353 204 N 4.7011 8.3662 120.0756 51.8288 37.0124 175.1901 205 D 4.5571 7.9319 120.5593 53.1645 39.6193 176.9592 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 0 G 8.35 3.92 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 1 M 7.78 4.39 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 2 A 9.46 4.36 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.31 4.89 0.00 1.60 1.55 0.92 0.87 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 4 Q 8.17 4.44 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.97 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 5 L 8.49 4.14 0.00 1.63 1.57 0.92 0.95 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 6 S 8.76 4.03 0.00 3.90 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.23 4.25 0.00 1.70 1.80 0.00 3.25 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 8 E 8.73 3.85 0.00 1.97 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 2.31 2.36 0.00 9 Q 8.36 4.38 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.72 0.00 0.00 0.00 0.00 0.00 2.29 2.60 0.00 10 G 8.39 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 11 I 8.49 4.39 1.91 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 1.50 1.21 0.97 0.00 0.00 12 T 8.10 4.74 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 1.25 0.00 0.00 13 A 8.43 4.08 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 14 R 8.28 4.06 0.00 1.85 1.94 0.00 3.01 0.00 0.00 2.66 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 15 G 8.33 3.68 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 0.00 0.00 0.00 16 S 8.59 4.20 0.00 4.06 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 17 A 8.25 4.06 1.61 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 18 E 8.33 3.92 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 19 I 7.89 3.82 2.14 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 1.50 0.69 1.03 0.00 0.00 20 V 8.23 3.84 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1.10 0.00 0.00 21 A 8.47 4.33 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 22 E 8.58 3.97 0.00 2.27 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.60 0.00 23 F 8.45 4.38 0.00 2.89 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 24 F 8.21 3.84 0.00 3.42 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 25 S 8.08 3.98 0.00 3.81 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 26 F 8.13 4.17 0.00 3.19 3.09 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 27 G 8.08 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 0.00 0.00 0.00 28 I 7.90 3.63 1.86 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 1.57 0.64 0.83 0.00 0.00 29 N 7.90 4.31 0.00 2.96 3.13 0.00 0.00 7.09 7.58 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 30 S 8.19 4.07 0.00 3.93 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 31 I 7.53 3.24 1.69 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 -0.02 0.35 0.32 0.00 0.00 32 L 7.88 3.95 0.00 1.94 1.89 0.36 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 7.82 3.56 0.00 1.43 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 34 Q 8.21 3.80 0.00 1.95 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.84 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 35 R 7.97 4.52 0.00 1.78 2.01 0.00 3.53 0.00 0.00 3.37 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.08 0.00 36 G 7.69 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 37 I 8.01 3.93 2.08 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.95 1.15 0.00 0.00 38 Y 7.80 4.73 0.00 3.09 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.55 0.00 2.27 2.09 0.00 3.76 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 2.16 2.11 0.00 40 S 9.00 4.66 0.00 4.29 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 0.00 41 E 8.37 4.11 0.00 2.02 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 2.36 2.42 0.00 42 T 8.32 4.34 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 1.26 0.00 0.00 43 F 8.03 5.34 0.00 3.07 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 44 T 8.99 4.75 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 1.23 0.00 0.00 45 R 8.52 4.91 0.00 1.71 1.81 0.00 3.18 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 46 V 9.02 4.59 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.96 0.00 0.00 47 Q 8.42 4.96 0.00 1.88 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 48 K 9.01 3.86 0.00 1.00 0.74 0.00 1.12 0.00 0.00 1.21 0.00 0.00 2.59 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 49 Y 8.81 3.75 0.00 3.10 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 50 G 8.44 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 51 L 7.82 4.73 0.00 1.75 1.51 0.94 0.83 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 52 T 8.28 4.88 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 1.17 0.00 0.00 53 L 9.05 4.78 0.00 1.57 1.60 0.76 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.20 5.09 0.00 0.94 1.14 -0.35 0.60 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 55 V 8.69 4.84 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 0.75 0.00 0.00 1.00 0.00 0.00 56 T 8.93 3.93 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 1.00 0.00 0.00 57 T 8.29 4.43 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 1.16 0.00 0.00 58 D 7.82 4.36 0.00 2.63 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.86 3.94 0.00 1.70 1.70 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.09 3.96 0.00 2.18 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 2.40 2.37 0.00 61 L 8.43 3.99 0.00 1.62 1.50 0.93 0.10 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 62 I 7.97 3.59 1.96 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.40 0.85 0.00 0.00 63 K 7.97 3.88 0.00 1.97 1.97 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.43 7.81 64 Y 8.22 4.00 0.00 3.16 3.12 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 65 L 8.41 3.89 0.00 1.68 1.64 0.80 0.56 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 66 N 8.30 4.24 0.00 2.77 2.93 0.00 0.00 7.24 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 8.18 4.26 0.00 2.80 2.72 0.00 0.00 6.68 7.24 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 68 V 7.62 3.70 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 1.20 0.00 0.00 0.32 0.00 0.00 69 V 8.17 3.60 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 0.99 0.00 0.00 0.98 0.00 0.00 70 E 8.43 3.95 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 2.48 2.42 0.00 71 Q 7.85 3.56 0.00 1.95 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.78 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 72 L 7.97 3.98 0.00 2.01 1.86 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.06 3.99 0.00 2.03 1.84 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.65 1.61 7.81 74 D 7.57 4.36 0.00 2.65 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 W 8.05 4.51 0.00 3.55 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.56 4.15 0.00 1.93 1.73 1.17 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 7.93 4.28 0.00 3.07 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 78 K 7.81 4.14 0.00 1.96 1.85 0.00 2.10 0.00 0.00 1.81 0.00 0.00 3.17 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.85 7.81 79 S 8.02 3.86 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 80 S 8.48 4.69 0.00 3.89 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 81 V 7.78 4.40 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.12 0.00 0.00 82 Q 9.27 4.54 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.46 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 83 K 7.60 4.96 0.00 1.94 1.81 0.00 1.04 0.00 0.00 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0.00 1.09 0.93 0.90 0.00 0.00 92 E 8.75 4.16 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 93 S 8.32 4.49 0.00 4.01 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 94 G 8.44 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 7.91 4.01 0.00 2.14 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 2.35 2.30 0.00 96 V 8.54 4.13 2.26 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 0.92 0.00 0.00 1.03 0.00 0.00 97 L 9.19 4.67 0.00 1.72 1.77 0.98 1.02 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 98 E 8.01 5.21 0.00 2.12 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 2.40 2.49 0.00 99 R 8.97 5.10 0.00 1.73 1.88 0.00 3.40 0.00 0.00 3.25 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 100 W 9.81 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0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.39 7.81 109 T 8.18 4.15 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 110 A 7.42 3.86 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 *115 A 8.33 4.14 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 0.00 116 P 0.00 4.55 0.00 2.19 2.12 0.00 3.79 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 2.01 2.04 0.00 117 R 9.30 4.08 0.00 1.97 1.90 0.00 3.17 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 118 E 8.69 4.52 0.00 1.85 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 119 K 7.99 4.51 0.00 1.68 1.65 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.44 7.81 120 S 8.55 4.45 0.00 4.10 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 0.00 121 Q 8.55 4.02 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.93 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 122 K 8.07 3.87 0.00 1.82 1.81 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.52 7.81 123 A 7.93 3.99 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 0.00 124 I 7.70 3.71 2.02 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 1.76 0.84 0.94 0.00 0.00 125 Q 8.40 3.99 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 126 D 8.30 4.38 0.00 2.85 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 0.00 127 E 7.93 3.94 0.00 2.08 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 2.33 2.51 0.00 128 I 7.60 2.95 1.24 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.33 0.00 0.00 129 R 8.14 3.72 0.00 1.88 2.07 0.00 3.10 0.00 0.00 3.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 130 S 7.71 4.13 0.00 4.01 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 0.00 131 V 7.64 3.69 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 1.08 0.00 0.00 132 I 7.98 3.81 1.83 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 1.63 1.09 0.94 0.00 0.00 133 R 8.08 4.06 0.00 2.08 2.02 0.00 3.13 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 134 Q 8.36 4.18 0.00 2.38 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.66 0.00 135 I 7.59 4.09 2.14 0.00 0.00 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 1.97 0.96 0.77 0.00 0.00 136 T 7.72 4.09 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 1.26 0.00 0.00 137 A 8.28 4.19 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 0.00 138 T 8.55 4.05 4.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 139 V 7.76 3.72 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.19 0.00 0.00 140 T 7.80 3.89 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 1.20 0.00 0.00 141 F 8.02 4.53 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 0.00 142 L 6.82 3.95 0.00 1.59 1.34 0.97 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 143 P 0.00 4.28 0.00 2.08 2.06 0.00 3.48 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 2.23 2.20 0.00 144 L 8.39 3.87 0.00 1.57 1.59 0.90 0.95 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 0.00 145 L 8.43 4.48 0.00 1.65 1.60 0.97 1.03 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 0.00 146 E 8.69 4.77 0.00 1.96 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.28 0.00 147 V 7.58 4.56 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 0.76 0.00 0.00 0.96 0.00 0.00 148 S 8.45 4.48 0.00 3.78 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 0.00 149 C 8.73 5.66 0.00 2.87 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 0.00 150 S 9.10 5.09 0.00 3.82 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 0.00 151 F 8.64 6.29 0.00 3.13 3.09 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 0.00 152 D 8.64 4.45 0.00 2.59 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 L 8.73 5.23 0.00 2.01 1.81 1.15 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 154 L 9.17 4.90 0.00 1.84 1.52 1.00 0.77 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 0.00 155 I 8.56 5.06 2.11 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.37 1.09 0.00 0.00 156 Y 9.47 4.54 0.00 2.85 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 T 8.10 4.89 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 0.31 0.00 0.00 158 D 8.25 4.40 0.00 2.52 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 0.00 159 K 8.90 3.91 0.00 1.71 1.86 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.43 7.81 160 D 7.80 4.70 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 7.30 3.91 0.00 1.60 1.41 0.36 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 162 V 8.11 3.74 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 0.85 0.00 0.00 0.93 0.00 0.00 163 V 8.28 3.75 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.92 0.00 0.00 164 P 0.00 4.67 0.00 2.34 2.00 0.00 3.74 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.23 0.00 165 E 8.44 4.28 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 166 K 8.91 4.19 0.00 1.99 1.97 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.47 7.81 167 W 7.83 4.82 0.00 3.54 3.30 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 0.00 168 E 8.40 4.84 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 169 E 8.74 4.10 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 170 S 8.29 4.68 0.00 3.78 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 0.00 171 G 8.16 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 0.00 172 P 0.00 4.21 0.00 1.40 1.88 0.00 3.58 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.18 0.00 173 Q 7.74 3.33 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 174 F 7.62 4.50 0.00 3.11 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 I 8.34 4.59 1.95 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 1.49 1.06 0.95 0.00 0.00 176 T 7.67 4.62 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 177 N 8.49 4.05 0.00 2.92 2.81 0.00 0.00 6.45 7.63 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 0.00 178 S 7.73 5.14 0.00 3.82 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 0.00 179 E 8.10 4.64 0.00 1.16 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.22 0.00 180 E 8.51 5.20 0.00 1.75 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 181 V 8.67 4.30 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 0.89 0.00 0.00 0.95 0.00 0.00 182 R 8.63 4.62 0.00 1.81 1.79 0.00 3.29 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 183 L 8.46 4.79 0.00 1.81 1.77 0.99 1.45 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 0.00 184 R 9.27 4.02 0.00 1.86 1.88 0.00 3.27 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 185 S 8.32 5.05 0.00 3.94 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 F 8.37 5.21 0.00 3.05 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 0.00 187 T 9.25 5.09 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 188 T 8.89 4.45 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 189 T 8.25 3.63 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 190 I 7.63 4.20 1.90 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 1.34 0.56 0.80 0.00 0.00 191 H 8.48 5.40 0.00 3.12 3.11 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 K 9.17 4.78 0.00 1.68 1.55 0.00 1.54 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.20 1.35 7.81 193 V 8.08 4.60 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 0.91 0.00 0.00 0.52 0.00 0.00 194 N 9.27 5.20 0.00 2.75 2.71 0.00 0.00 6.32 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 0.00 195 S 8.45 5.28 0.00 3.92 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 0.00 196 M 8.34 5.17 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 197 V 8.41 4.38 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 0.37 0.00 0.00 -0.31 0.00 0.00 198 A 8.70 5.08 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 0.00 199 Y 8.70 5.13 0.00 2.97 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 0.00 200 K 8.91 4.50 0.00 1.82 1.80 0.00 2.00 0.00 0.00 1.85 0.00 0.00 2.83 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.47 1.60 7.81 201 I 8.28 4.15 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.85 0.94 0.00 0.00 202 P 0.00 4.54 0.00 2.07 2.04 0.00 3.73 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 203 V 7.88 4.40 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 0.76 0.00 0.00 0.94 0.00 0.00 204 N 8.37 4.70 0.00 2.74 2.83 0.00 0.00 6.75 8.06 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 0.00 205 D 7.93 4.56 0.00 2.72 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.