NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2252 7.8827 121.4499 61.1926 38.7009 173.7473 17 V 4.3310 8.7022 126.1641 61.7845 32.6606 174.4057 18 G 3.7476 9.1229 115.2812 46.3019 0.0000 173.0813 19 G 4.2252 7.7266 110.0582 44.0680 0.0000 172.7831 20 Y 4.9375 7.8482 116.5944 55.1356 42.1346 174.8980 21 T 4.0670 8.6941 117.2368 64.5158 68.4653 174.6092 22 C 4.2311 8.5650 125.2669 61.1487 35.4709 174.2810 23 G 4.0703 8.8219 105.8640 43.4212 0.0000 172.8809 24 A 4.2118 8.8094 125.5631 54.0555 18.4563 176.8491 25 N 4.2330 8.8548 119.9131 54.4520 36.3565 175.3786 26 T 4.1911 7.6699 107.2446 62.7027 69.9968 175.0247 27 V 4.0629 7.0403 122.0057 59.6254 31.4588 173.5364 28 P 4.4637 0.0000 0.0000 64.3585 31.7224 178.2089 29 Y 5.2136 6.8434 114.7243 56.6401 38.7622 174.5433 30 Q 4.7278 7.4088 123.5764 56.3057 29.7372 175.4308 31 V 4.8986 8.9639 118.6415 59.6424 36.3444 174.1736 32 S 5.0191 8.7489 117.0347 56.5498 64.9745 172.7403 33 L 4.4476 8.6332 127.9442 53.7257 42.9579 175.1344 34 N 5.9332 9.1127 122.9682 50.0234 41.9360 174.9784 *37 S 4.2242 8.4069 120.7689 58.4002 64.1395 174.4156 38 G 3.9734 9.6811 109.2804 46.5180 0.0000 172.9327 39 Y 4.5654 6.4244 115.1393 56.1082 40.1446 172.8014 40 H 4.6393 8.7898 121.5197 56.2346 30.3697 174.7678 41 F 5.0771 7.7790 119.1965 56.5483 39.4995 173.6844 42 C 4.7660 6.8486 114.9220 56.3483 44.5991 173.3335 43 G 4.2988 8.7162 109.6365 45.5989 0.0000 172.1743 44 G 4.5317 8.3834 105.3079 46.3083 0.0000 172.5341 45 S 5.4817 9.0117 115.5443 56.4753 66.9367 173.5834 46 L 4.9142 8.9998 127.0667 54.5991 42.4646 177.0072 47 I 4.3942 8.3895 119.7755 60.8939 38.5370 174.4565 48 N 4.4881 7.5008 117.5398 52.3746 39.3936 175.1239 49 S 3.9951 8.4637 111.9660 60.5998 63.2466 175.3898 50 Q 4.5986 7.9112 117.9793 55.0588 30.5633 174.7636 51 W 5.5101 8.1020 116.8190 54.7235 33.2898 174.5307 52 V 5.0761 9.1330 122.6148 61.1717 34.6516 174.2020 53 V 4.9361 9.0603 126.5696 61.6635 34.0390 174.6454 54 S 4.7331 8.9270 120.3554 57.5935 66.1958 172.2639 55 A 4.6376 8.5541 120.9458 51.0546 20.0028 178.5949 56 A 3.8063 8.3626 124.1559 55.3132 18.4659 179.2330 57 H 4.5896 8.5761 109.1531 57.1577 28.6608 175.2352 58 C 4.7006 7.6944 117.1874 57.0678 40.5438 173.3297 59 Y 4.2378 7.6913 122.0742 57.8655 38.8241 175.0656 60 K 3.6604 7.0028 124.9015 55.4701 34.9183 174.2791 61 S 4.4533 8.0492 117.5408 57.9511 64.7030 173.6230 62 G 3.7002 8.5151 107.8907 46.5945 0.0000 173.5841 63 I 4.0574 7.6045 120.1078 60.6183 38.7667 174.9275 64 Q 4.7696 8.8640 127.9488 54.1688 31.6761 174.2555 65 V 4.1879 9.0738 127.3531 62.2262 33.3988 174.6950 66 R 5.1250 8.9208 127.1955 54.7647 32.2487 175.1421 67 L 4.7728 9.1069 124.8351 52.6622 44.8225 177.6201 *69 G 4.2536 8.2449 107.4695 45.4665 0.0000 172.8257 70 E 4.5257 8.2023 118.2056 55.4978 30.1541 174.0812 71 D 4.8553 7.8671 117.7094 54.9099 43.4475 173.7643 72 N 5.8204 9.1835 121.0744 52.0903 40.0360 175.4773 73 I 4.1100 8.5104 119.2492 61.9503 37.8335 176.1418 74 N 4.8690 9.2630 119.3151 53.0356 39.5963 174.4988 75 V 4.2817 7.5275 118.0450 60.6326 34.2133 174.9696 76 V 3.9758 8.5141 126.9802 63.1247 30.9308 175.1183 77 E 4.3054 9.9401 128.7867 55.9647 30.0838 177.2473 78 G 4.0191 8.3523 106.0461 45.5843 0.0000 174.4099 79 N 4.8555 8.2384 115.8845 52.9647 39.1953 173.9631 80 E 4.7587 7.7433 117.6946 56.1808 31.0698 176.2337 81 Q 4.2568 8.9758 120.3306 54.4557 32.8626 174.1360 82 F 5.5498 8.7302 123.5745 56.1448 40.5406 175.4326 83 I 4.6811 8.8473 125.1349 59.3564 40.7752 175.6557 84 S 4.6371 8.6815 122.0479 58.2816 64.3186 173.0463 85 A 4.6665 8.3522 125.5083 51.7559 18.6137 177.7003 86 S 4.5151 8.8447 116.9265 59.2451 64.6882 174.4262 87 K 4.6255 7.5078 120.0074 55.3668 35.4196 174.3018 88 S 5.2818 8.7722 121.5346 56.9045 66.6670 173.7196 89 I 4.5922 9.1588 124.4982 59.4777 40.0200 174.8917 90 V 4.1840 8.4226 127.2790 62.2451 32.6237 175.2104 91 H 3.5703 8.5906 126.9187 55.6843 30.0240 174.3642 92 P 4.2387 0.0000 0.0000 65.4109 31.0002 177.0881 93 S 4.6859 7.8940 112.3027 57.9934 62.9659 173.2168 94 Y 4.4164 8.0001 123.1522 57.8951 39.0735 174.7813 95 N 4.4951 8.0318 124.9751 51.2411 40.0585 174.9626 96 S 4.1631 7.6683 120.4449 59.9821 63.5172 175.6706 97 N 4.3419 8.2939 119.2223 55.7852 38.2806 176.0041 98 T 4.0549 7.6056 104.4699 60.4124 70.2194 174.4007 99 L 3.7318 8.0932 121.2529 55.5970 39.7085 173.8929 100 N 4.4773 7.8382 117.1970 54.5991 39.6798 174.3730 101 N 4.7878 8.7123 120.3940 54.2654 35.8611 175.5388 102 D 4.7371 7.9566 117.5147 53.0386 39.6105 174.8738 103 I 4.8347 7.1385 120.9201 59.5165 42.4035 172.9296 104 M 5.4060 9.1040 125.8351 54.4316 36.2475 173.1782 105 L 5.3865 9.1348 124.0347 53.1583 45.1171 175.4718 106 I 5.0553 9.1427 123.1442 59.4876 40.8665 174.1673 107 K 3.9264 8.6925 128.7522 54.4357 33.7270 175.5065 108 L 4.5406 8.2475 127.7315 54.1908 42.0359 177.3660 109 K 4.2051 8.7891 122.6424 58.8627 32.5193 177.8577 110 S 4.5971 7.7265 111.6261 55.6798 65.9955 173.3627 111 A 4.3383 8.4648 124.1835 52.1384 18.6816 177.3279 112 A 4.2150 9.0389 123.9738 51.9598 19.7247 177.5325 113 S 4.5679 8.9880 116.7393 57.0275 63.5486 174.6278 114 L 4.4499 8.5014 126.0800 54.5270 42.1401 176.5174 115 N 4.8647 8.9076 119.6691 52.2405 39.6632 174.8298 116 S 4.1709 8.7812 111.5806 61.1807 62.8722 174.9255 117 R 4.3329 7.9452 118.1348 55.8701 31.2022 175.4450 118 V 4.3304 7.6865 116.8546 60.8909 33.0056 173.6214 119 A 5.2255 8.4321 128.0243 50.1291 23.0115 174.8398 120 S 5.0927 8.6981 113.5754 57.5504 65.0683 173.1617 121 I 4.4315 8.3198 121.5583 59.2229 39.3709 175.4398 122 S 4.4287 8.3717 124.2002 58.2897 64.0321 173.9911 123 L 4.2375 8.3398 123.1497 53.5664 42.4287 175.3047 124 P 4.5096 0.0000 0.0000 62.8921 32.1736 176.4612 125 T 4.1706 8.2866 109.8565 62.7435 70.1863 174.8231 *127 S 4.7524 7.5363 113.7761 57.8438 63.9723 173.6566 128 C 4.4854 8.4532 118.1559 56.7165 40.7596 172.8315 129 A 4.7246 7.9502 123.6660 50.4555 20.7694 177.0648 130 S 4.2570 8.0995 115.3999 57.3175 64.6248 173.1998 *132 A 4.2210 8.2059 123.5877 53.4566 19.3382 176.0066 133 G 4.1168 8.9026 109.9754 45.9480 0.0000 174.9571 134 T 3.9486 7.6060 115.9062 63.9980 69.4928 173.8017 135 Q 4.7004 8.5299 124.3100 55.5535 30.0603 175.8266 136 C 5.2499 9.2581 119.6925 55.1416 46.1888 172.4521 137 L 5.1283 9.1361 123.3876 53.5454 43.9865 175.0701 138 I 5.2240 9.2103 127.3391 58.7006 40.0512 174.8460 139 S 4.9537 8.7012 119.8171 56.4332 66.4974 173.0589 140 G 3.7934 7.4889 108.0961 46.2230 0.0000 173.1528 141 W 4.5629 8.7637 117.0661 56.2477 29.3077 176.9979 142 G 4.1101 8.6568 109.2923 44.3931 0.0000 173.4770 143 N 3.5992 8.7092 118.4293 54.3158 38.8774 174.5685 144 T 5.0834 8.0978 113.4096 60.8377 69.8916 174.6955 145 K 4.4443 7.7464 121.7872 55.2679 33.7174 176.4576 146 S 4.3262 8.6136 117.0997 60.5492 63.1408 174.6653 147 S 4.7581 8.6079 113.7122 54.3393 63.1723 173.7393 148 G 3.9583 6.8340 107.0117 46.3253 0.0000 169.1364 149 T 4.7227 7.8434 116.4397 62.1867 72.6824 173.9938 150 S 4.3397 9.2025 119.0912 58.0286 66.0691 173.0386 151 Y 4.9538 8.7280 126.1196 55.6699 39.0750 174.3775 152 P 4.6485 0.0000 0.0000 62.8217 32.7179 175.5889 153 D 4.8602 8.6736 117.7758 54.9954 42.5687 176.6185 154 V 5.3317 7.7198 110.5799 58.4280 34.4074 175.5733 155 L 3.1760 8.2201 125.4256 54.9884 43.1191 175.9216 156 K 4.8002 8.2295 125.1929 54.8943 34.9886 174.6476 157 C 5.1758 8.6636 120.5248 55.2206 41.4418 173.0698 158 L 4.7963 8.2936 122.4737 54.1360 45.5052 174.1648 159 K 5.1425 8.9740 125.9777 55.3464 33.4327 175.8760 160 A 4.8986 9.3062 125.7486 49.8273 23.1934 173.5575 161 P 5.0511 0.0000 0.0000 61.6865 34.1699 174.7531 162 I 4.3467 8.1340 121.9659 61.0758 38.0906 175.5026 163 L 4.9091 8.6325 127.5389 53.0733 43.5036 177.0213 164 S 4.3482 8.4470 115.8835 58.0915 64.1237 174.9562 165 D 4.4374 8.8959 122.7891 57.6157 40.5823 179.2377 166 S 4.1422 8.0860 114.3845 61.7298 63.0663 176.7036 167 S 4.1480 7.9086 118.1507 60.7081 62.6251 175.6000 168 C 4.1992 8.2799 122.1964 59.5785 43.6533 175.5631 169 K 3.8977 8.3637 120.3532 59.5285 31.4397 179.2715 170 S 4.0410 8.0033 112.0340 61.4276 62.4102 175.8173 171 A 4.1172 7.7768 122.2369 54.4228 18.3096 178.8890 172 S 4.1894 8.0175 110.8719 57.7475 63.8311 175.4271 173 S 4.0226 8.0469 116.6099 59.1989 60.6754 170.4619 174 Y 4.6546 7.5037 118.1365 58.2885 38.0369 176.1811 175 I 4.3346 8.4705 124.3467 60.2528 36.9388 175.0474 176 I 4.6627 8.2630 126.1901 59.5572 39.5138 175.9688 177 T 4.5608 8.1680 114.2750 59.7611 70.7978 175.3922 178 S 4.3407 8.5353 115.1420 60.3435 63.2392 174.4295 179 N 4.9046 8.2547 118.6624 53.4115 38.5287 173.8647 180 M 5.5836 8.0221 117.5379 53.7424 36.1728 174.5800 181 F 5.1362 8.6367 114.4478 55.8934 42.0485 172.5517 182 C 5.6163 9.0952 116.5488 55.5939 41.4059 172.6696 183 A 5.0137 9.5176 122.3301 50.7684 22.4750 176.3279 184 G 4.0425 6.8220 106.8938 44.8111 0.0000 172.1482 184A Y 4.6560 8.3421 118.5216 55.9801 41.3319 176.5046 185 L 4.1242 8.6678 124.8186 57.2994 41.9729 178.4908 186 E 4.0958 8.2860 114.8624 56.4135 30.0539 177.8332 187 G 3.8057 8.3327 109.6216 44.9558 0.0000 172.5060 188 G 4.0876 9.4825 106.5621 44.7429 0.0000 174.0976 188A K 5.3733 7.2278 117.0501 53.6871 35.6711 175.2812 189 D 4.6077 8.2900 122.5556 53.8588 44.6408 175.1058 190 S 4.8474 8.8434 117.2600 58.4023 65.0895 172.8732 191 C 4.7012 9.1476 118.3033 55.5617 44.3195 171.9046 192 Q 4.3289 8.6827 120.7557 58.0674 28.6725 177.4043 193 G 4.4156 9.3036 113.4191 45.7638 0.0000 173.8731 194 D 4.6905 8.4476 118.7246 55.3997 41.6772 176.7520 195 S 4.4586 8.0773 115.2663 60.5742 63.2908 175.5578 196 G 4.0159 8.9659 112.8737 46.2919 0.0000 173.6876 197 G 4.2728 7.9951 107.4865 45.2725 0.0000 171.4589 198 P 5.0968 0.0000 0.0000 62.4571 33.5438 175.6525 199 V 4.6517 8.4903 120.7048 61.3196 33.7304 173.4854 200 V 4.7355 8.7539 128.2493 61.3405 33.5504 173.7596 201 C 5.1173 8.6110 124.6920 55.5301 43.8683 174.6367 202 S 3.3169 9.6548 120.5790 59.7249 59.8954 173.6137 203 G 3.9337 8.3264 105.6756 45.6179 0.0000 173.7242 204 K 4.7163 7.4973 118.4249 53.4775 34.7143 175.4224 *209 L 4.3553 8.1296 122.1734 55.4560 41.8682 175.8617 210 Q 4.4370 8.7103 125.7250 56.9035 30.6354 175.7688 211 G 5.2800 8.0498 104.4977 45.6515 0.0000 171.4216 212 I 5.2505 8.1966 119.5636 58.8791 41.1725 175.1915 213 V 3.5699 9.0381 127.6700 64.0174 31.7776 174.4826 214 S 4.8152 8.4264 121.9372 58.7833 63.7462 174.9952 215 W 4.9506 7.2232 114.9777 57.4110 31.6498 172.0359 216 G 3.8011 7.9652 104.8951 47.1449 0.0000 172.2288 217 S 4.6885 8.0755 115.0660 56.4594 63.6207 172.8266 *219 G 4.3252 8.0957 118.7938 45.6015 0.0000 171.2538 220 C 4.8846 8.2932 117.0778 56.6473 41.9834 173.8443 221 A 3.9365 8.9584 125.6811 53.2055 16.6667 177.0945 221A Q 4.5117 7.3437 117.8836 56.3172 29.6911 175.8782 222 K 4.2428 8.4272 122.2093 57.8727 32.6642 176.4083 223 N 4.3085 9.2191 122.1774 53.9573 36.7333 175.2303 224 K 4.3026 7.5893 117.9781 53.7517 32.3191 173.9765 225 P 4.6689 0.0000 0.0000 61.7112 33.3813 176.7636 226 G 3.6948 8.5040 106.8699 46.0815 0.0000 172.7365 227 V 4.4464 7.6059 122.2218 60.7667 33.7996 174.2029 228 Y 4.8435 8.2449 124.4515 55.9915 42.2710 174.8671 229 T 4.4687 8.5309 119.3289 63.4722 70.0848 174.5560 230 K 5.0237 9.4943 128.5764 55.5236 31.2717 177.1314 231 V 3.9648 8.8599 126.2592 65.8777 31.4186 174.7872 232 C 4.5328 8.4176 112.6917 58.5470 41.3161 174.8928 233 N 4.2848 7.9663 116.3675 54.2981 38.5724 175.4959 234 Y 4.8757 8.2490 117.6400 57.2080 39.1491 177.1728 235 V 3.6738 7.9351 121.1041 66.3126 31.4861 177.8904 236 S 4.1180 8.1240 114.1501 61.4277 62.6946 176.3421 237 W 4.2035 8.3247 130.4323 60.4651 30.5297 177.8116 238 I 2.9674 8.2469 120.0197 64.1584 36.7042 178.4917 239 K 3.7483 8.3090 119.4778 59.5335 31.9497 179.4491 240 Q 3.8912 8.1645 118.4139 59.3213 28.4406 179.0360 241 T 3.6304 7.6671 117.2790 66.3728 68.1005 176.7225 242 I 2.6595 7.0069 113.6948 63.1491 37.6429 177.8441 243 A 4.0990 7.5042 121.8493 54.3196 18.2602 178.7061 244 S 4.6418 7.4891 110.2975 58.4369 63.3089 174.1945 245 N 4.7156 7.7173 125.0170 53.5407 39.3551 174.0953 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 4.23 1.79 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 1.38 0.57 0.85 0.00 0.00 17 V 8.70 4.33 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 1.04 0.00 0.00 1.02 0.00 0.00 18 G 9.12 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 19 G 7.73 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 0.00 0.00 0.00 0.00 20 Y 7.85 4.94 0.00 3.00 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 8.69 4.07 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 1.26 0.00 0.00 22 C 8.56 4.23 0.00 2.78 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 23 G 8.82 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.81 4.21 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.85 4.23 0.00 2.84 2.88 0.00 0.00 7.15 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 26 T 7.67 4.19 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 1.26 0.00 0.00 27 V 7.04 4.06 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 0.27 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.46 0.00 2.36 2.30 0.00 3.78 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 2.14 1.96 0.00 29 Y 6.84 5.21 0.00 3.26 3.41 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 30 Q 7.41 4.73 0.00 1.84 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.73 0.00 0.00 0.00 0.00 0.00 1.93 2.47 0.00 31 V 8.96 4.90 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 0.94 0.00 0.00 1.00 0.00 0.00 32 S 8.75 5.02 0.00 3.11 3.36 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 33 L 8.63 4.45 0.00 0.48 0.97 0.73 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.11 5.93 0.00 2.45 2.49 0.00 0.00 6.78 7.85 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 *37 S 8.41 4.22 0.00 3.68 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 38 G 9.68 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.42 4.57 0.00 3.07 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 8.79 4.64 0.00 2.86 3.16 0.00 5.87 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.78 5.08 0.00 3.09 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.85 4.77 0.00 2.12 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 43 G 8.72 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.38 4.53 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 0.00 45 S 9.01 5.48 0.00 3.80 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 9.00 4.91 0.00 1.89 1.80 1.07 0.70 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 47 I 8.39 4.39 1.89 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.90 0.95 0.00 0.00 48 N 7.50 4.49 0.00 2.91 3.00 0.00 0.00 6.01 7.64 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 49 S 8.46 4.00 0.00 4.05 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 7.91 4.60 0.00 1.89 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 51 W 8.10 5.51 0.00 3.54 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 52 V 9.13 5.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.99 0.00 0.00 53 V 9.06 4.94 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 0.99 0.00 0.00 54 S 8.93 4.73 0.00 3.91 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 55 A 8.55 4.64 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.36 3.81 0.18 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 57 H 8.58 4.59 0.00 3.40 3.59 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.69 4.70 0.00 3.26 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 59 Y 7.69 4.24 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 7.00 3.66 0.00 1.23 1.16 0.00 0.94 0.00 0.00 1.30 0.00 0.00 2.59 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 1.02 7.81 61 S 8.05 4.45 0.00 3.94 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 62 G 8.52 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 63 I 7.60 4.06 1.86 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 1.26 0.82 0.93 0.00 0.00 64 Q 8.86 4.77 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 65 V 9.07 4.19 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 0.98 0.00 0.00 0.91 0.00 0.00 66 R 8.92 5.13 0.00 1.71 1.95 0.00 2.71 0.00 0.00 2.74 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.29 0.00 67 L 9.11 4.77 0.00 1.62 1.63 0.96 0.64 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 *69 G 8.24 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 0.00 0.00 0.00 0.00 70 E 8.20 4.53 0.00 2.19 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 2.56 2.21 0.00 71 D 7.87 4.86 0.00 2.83 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.18 5.82 0.00 2.91 2.85 0.00 0.00 6.72 7.98 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 73 I 8.51 4.11 1.44 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 1.25 0.52 -0.38 0.00 0.00 74 N 9.26 4.87 0.00 2.79 2.85 0.00 0.00 6.59 7.88 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 75 V 7.53 4.28 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 8.51 3.98 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 0.82 0.00 0.00 1.00 0.00 0.00 77 E 9.94 4.31 0.00 1.94 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 0.00 2.31 2.52 0.00 78 G 8.35 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.24 4.86 0.00 2.74 2.80 0.00 0.00 7.16 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.74 4.76 0.00 1.46 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 2.58 2.60 0.00 81 Q 8.98 4.26 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 82 F 8.73 5.55 0.00 2.85 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 83 I 8.85 4.68 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 0.93 0.93 0.00 0.00 84 S 8.68 4.64 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.35 4.67 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 86 S 8.84 4.52 0.00 3.78 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 87 K 7.51 4.63 0.00 1.76 1.53 0.00 1.68 0.00 0.00 1.91 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.50 7.81 88 S 8.77 5.28 0.00 3.96 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 89 I 9.16 4.59 2.09 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.01 1.18 0.00 0.00 90 V 8.42 4.18 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 0.78 0.00 0.00 91 H 8.59 3.57 0.00 2.89 3.04 0.00 5.66 0.00 0.00 0.00 0.00 6.64 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 4.24 0.00 2.12 2.14 0.00 2.41 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.71 0.00 93 S 7.89 4.69 0.00 4.00 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 94 Y 8.00 4.42 0.00 2.98 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.03 4.50 0.00 2.57 2.42 0.00 0.00 6.69 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 7.67 4.16 0.00 3.97 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 97 N 8.29 4.34 0.00 2.80 2.78 0.00 0.00 6.82 7.08 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 98 T 7.61 4.05 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 8.09 3.73 0.00 1.43 1.87 0.74 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.84 4.48 0.00 2.73 2.64 0.00 0.00 7.10 6.71 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 0.00 101 N 8.71 4.79 0.00 2.95 2.64 0.00 0.00 7.23 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 0.00 102 D 7.96 4.74 0.00 3.09 2.70 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 0.00 103 I 7.14 4.83 1.56 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 1.39 1.36 0.15 0.00 0.00 104 M 9.10 5.41 0.00 2.29 1.85 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 2.76 2.65 0.00 105 L 9.13 5.39 0.00 1.75 1.83 0.01 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.14 5.06 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.97 0.93 0.00 0.00 107 K 8.69 3.93 0.00 0.79 1.04 0.00 1.12 0.00 0.00 1.31 0.00 0.00 2.88 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.74 0.21 7.81 108 L 8.25 4.54 0.00 1.45 1.57 0.90 0.84 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 8.79 4.21 0.00 1.67 1.83 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.50 7.81 110 S 7.73 4.60 0.00 3.89 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 0.00 111 A 8.46 4.34 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 0.00 112 A 9.04 4.22 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.99 4.57 0.00 3.85 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 0.00 114 L 8.50 4.45 0.00 1.66 1.63 0.96 1.11 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 0.00 115 N 8.91 4.86 0.00 2.84 2.92 0.00 0.00 6.46 7.33 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 0.00 116 S 8.78 4.17 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.95 4.33 0.00 1.89 2.14 0.00 3.10 0.00 0.00 3.29 7.33 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.54 4.75 0.00 4.00 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 C 8.45 4.49 0.00 2.94 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.95 4.72 1.04 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 0.00 130 S 8.10 4.26 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 8.21 4.22 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 0.00 133 G 8.90 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.61 3.95 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 135 Q 8.53 4.70 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 136 C 9.26 5.25 0.00 2.82 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 0.00 137 L 9.14 5.13 0.00 1.76 1.58 1.01 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.21 5.22 1.89 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.33 1.01 0.00 0.00 139 S 8.70 4.95 0.00 3.51 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 0.00 140 G 7.49 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 0.00 0.00 0.00 141 W 8.76 4.56 0.00 3.23 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.66 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.71 3.60 0.00 2.09 2.61 0.00 0.00 7.13 7.40 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 0.00 144 T 8.10 5.08 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 1.23 0.00 0.00 145 K 7.75 4.44 0.00 1.77 1.73 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.31 1.31 7.81 146 S 8.61 4.33 0.00 3.83 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 0.00 147 S 8.61 4.76 0.00 3.84 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 0.00 148 G 6.83 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 0.00 149 T 7.84 4.72 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 1.35 0.00 0.00 150 S 9.20 4.34 0.00 3.80 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 0.00 151 Y 8.73 4.95 0.00 2.97 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.65 0.00 2.43 2.09 0.00 4.12 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.04 0.00 153 D 8.67 4.86 0.00 2.69 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 0.00 154 V 7.72 5.33 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 1.09 0.00 0.00 0.97 0.00 0.00 155 L 8.22 3.18 0.00 1.24 1.23 -0.66 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.23 4.80 0.00 1.69 1.51 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.48 7.81 157 C 8.66 5.18 0.00 1.73 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 0.00 158 L 8.29 4.80 0.00 1.70 1.57 1.02 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.97 5.14 0.00 1.82 1.82 0.00 1.86 0.00 0.00 1.77 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.52 1.69 7.81 160 A 9.31 4.90 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 0.00 161 P 0.00 5.05 0.00 1.99 2.19 0.00 2.95 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 162 I 8.13 4.35 1.73 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.63 0.71 0.00 0.00 163 L 8.63 4.91 0.00 1.54 1.58 0.91 1.11 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 8.45 4.35 0.00 4.00 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 0.00 165 D 8.90 4.44 0.00 2.77 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 0.00 166 S 8.09 4.14 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 7.91 4.15 0.00 4.03 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 8.28 4.20 0.00 3.16 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 0.00 169 K 8.36 3.90 0.00 1.85 1.90 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.69 7.81 170 S 8.00 4.04 0.00 3.89 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 0.00 171 A 7.78 4.12 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 S 8.02 4.19 0.00 2.72 3.51 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 0.00 173 S 8.05 4.02 0.00 4.07 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 0.00 174 Y 7.50 4.65 0.00 2.98 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 0.00 175 I 8.47 4.33 1.90 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 1.49 0.82 0.94 0.00 0.00 176 I 8.26 4.66 2.00 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 1.71 0.99 1.02 0.00 0.00 177 T 8.17 4.56 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 S 8.54 4.34 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.25 4.90 0.00 2.94 3.11 0.00 0.00 6.62 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 0.00 180 M 8.02 5.58 0.00 1.89 2.01 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 181 F 8.64 5.14 0.00 3.08 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 9.10 5.62 0.00 2.97 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 0.00 183 A 9.52 5.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 6.82 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 184A Y 8.34 4.66 0.00 3.04 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 0.00 185 L 8.67 4.12 0.00 1.73 1.73 0.91 0.88 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 0.00 186 E 8.29 4.10 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 2.34 2.26 0.00 187 G 8.33 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 G 9.48 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 188A K 7.23 5.37 0.00 1.60 1.73 0.00 0.95 0.00 0.00 2.04 0.00 0.00 2.55 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.24 1.07 7.81 189 D 8.29 4.61 0.00 2.78 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.84 4.85 0.00 3.99 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 0.00 191 C 9.15 4.70 0.00 2.95 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.68 4.33 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.31 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 193 G 9.30 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 0.00 0.00 0.00 0.00 194 D 8.45 4.69 0.00 3.00 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 0.00 195 S 8.08 4.46 0.00 3.95 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 0.00 196 G 8.97 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 8.00 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 0.00 0.00 0.00 0.00 198 P 0.00 5.10 0.00 2.30 2.35 0.00 3.72 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 2.24 2.26 0.00 199 V 8.49 4.65 2.27 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 0.88 0.00 0.00 0.80 0.00 0.00 200 V 8.75 4.74 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 0.87 0.00 0.00 0.63 0.00 0.00 201 C 8.61 5.12 0.00 2.80 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 0.00 202 S 9.65 3.32 0.00 3.95 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 0.00 203 G 8.33 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 0.00 0.00 0.00 204 K 7.50 4.72 0.00 1.74 1.67 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.40 7.81 *209 L 8.13 4.36 0.00 1.49 1.64 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.71 4.44 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.40 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 211 G 8.05 5.28 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 0.00 212 I 8.20 5.25 1.94 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 1.31 0.93 0.97 0.00 0.00 213 V 9.04 3.57 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 0.96 0.00 0.00 1.19 0.00 0.00 214 S 8.43 4.82 0.00 3.89 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 0.00 215 W 7.22 4.95 0.00 3.39 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 0.00 216 G 7.97 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.08 4.69 0.00 4.20 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 *219 G 8.10 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.29 4.88 0.00 2.95 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 0.00 221 A 8.96 3.94 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.34 4.51 0.00 2.31 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 222 K 8.43 4.24 0.00 1.72 1.72 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.58 7.81 223 N 9.22 4.31 0.00 2.83 3.03 0.00 0.00 6.81 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 0.00 224 K 7.59 4.30 0.00 1.84 1.81 0.00 1.77 0.00 0.00 1.47 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.52 7.81 225 P 0.00 4.67 0.00 2.12 2.09 0.00 3.58 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 2.02 1.96 0.00 226 G 8.50 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.61 4.45 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 0.40 0.00 0.00 -0.65 0.00 0.00 228 Y 8.24 4.84 0.00 1.43 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.53 4.47 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 230 K 9.49 5.02 0.00 2.07 1.95 0.00 1.83 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.70 7.81 231 V 8.86 3.96 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.12 0.00 0.00 232 C 8.42 4.53 0.00 3.17 3.24 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 0.00 233 N 7.97 4.28 0.00 2.44 2.36 0.00 0.00 6.79 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 0.00 234 Y 8.25 4.88 0.00 3.10 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 0.00 235 V 7.94 3.67 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 1.00 0.00 0.00 1.07 0.00 0.00 236 S 8.12 4.12 0.00 3.99 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 0.00 237 W 8.32 4.20 0.00 3.51 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 0.00 238 I 8.25 2.97 1.97 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.03 0.69 0.00 0.00 239 K 8.31 3.75 0.00 1.67 1.77 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.59 7.81 240 Q 8.16 3.89 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.64 0.00 241 T 7.67 3.63 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 242 I 7.01 2.66 0.98 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.23 -0.49 0.00 0.00 243 A 7.50 4.10 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 0.00 244 S 7.49 4.64 0.00 3.83 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 0.00 245 N 7.72 4.72 0.00 3.18 3.03 0.00 0.00 6.75 7.44 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 * Residues marked with a * may have inaccurate shift predictions.