NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2940 7.8827 121.4508 61.1878 38.7811 173.7662 17 V 4.4182 8.6000 125.6443 61.6518 32.9574 174.3376 18 G 3.9665 9.0123 114.5688 46.4488 0.0000 173.2063 19 G 4.2467 7.7938 110.0738 43.8602 0.0000 172.3480 20 Y 4.9786 7.6773 116.8685 55.0381 42.2157 174.8934 21 T 4.1842 8.5641 116.7886 63.8355 68.4238 175.6427 22 C 4.3422 8.7276 125.1892 60.1296 37.6172 174.9534 23 G 4.1160 8.6358 106.4444 44.1629 0.0000 172.8489 24 A 4.0641 8.6535 125.6694 53.8909 18.6156 176.8590 25 N 4.2386 8.8231 119.2764 54.5079 36.2515 175.1746 26 T 4.2719 7.5073 106.7490 62.3070 69.9225 175.1670 27 V 4.1125 7.0035 122.0224 60.3087 31.3401 173.6911 28 P 4.4823 0.0000 0.0000 64.3467 32.0981 178.1045 29 Y 4.9323 6.8378 115.7886 56.3709 38.7809 174.6500 30 Q 4.6075 7.3559 123.5951 56.3753 29.5063 175.4369 31 V 4.8528 8.9673 118.6700 59.6426 36.3405 174.1304 32 S 4.8247 8.6341 116.6751 56.5690 65.1415 172.5878 33 L 4.5626 8.3562 127.2832 53.1676 43.4861 174.9838 34 N 5.6642 8.9750 122.3681 49.9561 42.1876 174.9256 *37 S 4.4228 8.4660 120.3078 58.4164 64.1974 174.5369 38 G 4.0351 9.7783 109.1039 46.2921 0.0000 172.8502 39 Y 4.5272 6.7516 115.4888 56.3180 40.1052 172.4853 40 H 4.6494 8.7451 121.1959 55.5411 30.4567 174.7274 41 F 4.8927 7.5552 119.8823 57.0742 39.7528 173.8900 42 C 4.7230 6.5751 116.6182 56.0332 44.9135 173.1327 43 G 4.2432 8.4128 108.8670 45.4336 0.0000 172.1531 44 G 4.4502 7.9607 105.5085 46.4282 0.0000 172.6135 45 S 5.4825 8.6939 115.4024 56.4295 66.7765 173.6358 46 L 4.6871 9.0733 127.3828 54.7366 42.4815 177.0479 47 I 4.3697 8.4818 119.4274 60.8528 39.1509 174.3851 48 N 4.6610 7.5220 117.5870 52.2249 39.5117 174.9828 49 S 4.4135 8.5465 111.8280 60.2537 63.2749 174.6031 50 Q 4.5462 9.2392 121.5323 55.3503 30.8712 174.2946 51 W 5.6032 8.3869 116.1333 55.5528 33.5853 174.3198 52 V 5.1808 9.0089 122.8230 61.0709 34.6762 174.3637 53 V 4.9556 8.7978 126.1908 60.5079 33.8706 174.8886 54 S 5.1148 8.9860 117.0475 57.7999 66.0568 171.9509 55 A 4.8204 8.5068 120.2258 50.3899 20.9046 178.1970 56 A 3.8124 8.3275 124.3039 55.3908 18.4107 179.1845 57 H 4.5428 8.3373 108.7893 57.1489 28.6561 175.2000 58 C 4.7403 7.8234 117.1801 57.0178 40.5058 173.3170 59 Y 4.1745 7.7815 122.3013 57.5617 38.8134 174.9048 60 K 3.6746 6.5828 123.3616 56.2871 34.6609 174.2177 61 S 4.3392 8.1392 114.5613 57.7514 64.9269 173.1369 62 G 3.6471 8.3188 105.7421 46.7060 0.0000 173.6183 63 I 4.3988 7.4109 119.0756 59.5789 39.7500 175.4150 64 Q 4.7875 8.7196 127.4829 54.2170 31.6869 174.1201 65 V 4.4146 8.8045 127.0543 61.7378 33.6318 174.5760 65A R 5.0243 8.7595 127.0114 54.6871 32.4198 175.1796 66 L 4.7096 9.0112 124.7407 52.7450 44.7494 177.2132 *69 G 3.7887 8.2132 105.6953 46.3196 0.0000 172.8156 70 E 4.7018 8.4523 118.7016 55.1057 30.8241 174.2174 71 D 4.7409 7.8596 116.8710 55.2591 43.5983 174.2293 72 N 4.9048 8.5221 119.2885 53.0328 39.3781 175.9916 73 I 3.9975 8.3790 119.5680 62.0935 37.8989 176.1831 74 N 4.8048 8.7800 118.0837 53.0036 39.2790 174.6568 75 V 4.3123 7.3640 117.0969 60.7239 34.2359 174.9509 76 V 4.1171 8.4513 126.8921 62.5286 31.1714 175.1184 77 E 4.4338 9.2405 127.0597 55.3083 30.8225 176.8650 78 G 3.9832 8.5309 106.6859 46.0855 0.0000 173.9956 79 N 4.6341 8.9743 117.4276 52.5644 36.7390 174.5370 80 E 4.5067 7.6143 116.9294 56.4459 30.6248 176.4359 81 Q 4.4064 8.9277 121.0986 54.3384 32.9735 173.9223 82 F 5.5311 8.8802 122.9572 55.9764 40.9922 175.2002 83 I 4.7216 8.7937 124.5679 59.4204 41.0927 175.4915 84 S 4.6436 8.6381 121.5244 58.1990 64.3207 173.2223 85 A 4.3791 8.1453 124.4905 52.1636 18.5153 177.6196 86 S 4.4659 9.0893 117.5680 60.2753 63.3779 174.3802 87 K 4.7498 7.5919 116.2987 55.7461 35.8042 174.8493 88 S 5.2318 8.7791 116.9789 56.9479 66.1968 173.8398 89 I 4.4854 9.1524 125.2914 59.4602 39.0545 175.0450 90 V 4.2058 8.2950 127.1557 62.1267 32.7394 175.3411 91 H 3.9121 8.5699 126.1611 55.7382 30.1508 174.6254 92 P 4.3190 0.0000 0.0000 65.3567 31.3343 177.1750 93 S 4.7169 7.9171 112.0484 58.1986 63.1046 173.2857 94 Y 4.2564 7.9685 123.0514 57.6235 39.0237 174.3370 95 N 4.5682 8.0922 125.9584 51.3735 39.4881 175.2124 96 S 3.9312 7.7274 120.5011 59.8205 63.4907 175.2862 97 N 4.3951 8.5670 119.2434 55.3110 38.5973 176.1047 98 T 3.9579 7.7628 105.5870 60.8353 69.9180 175.0491 99 L 3.7817 7.9905 121.0325 55.4218 39.7943 173.9028 100 N 4.4780 7.6589 117.7528 54.6040 39.5607 174.5125 101 N 4.8194 8.6602 119.5637 54.3795 35.7068 175.6057 102 D 4.7374 7.9171 117.7594 53.0257 39.8573 174.8168 103 I 4.8213 7.1921 121.0343 59.2844 42.3783 172.8940 104 M 5.4044 9.1301 126.1717 54.1995 36.3483 173.2945 105 L 5.3897 9.0201 123.9156 53.1124 45.2743 175.3995 106 I 5.0185 9.1537 123.4866 59.4459 40.5940 174.2843 107 K 3.7593 8.7001 128.5704 54.5242 33.6936 175.5432 108 L 4.5589 8.0972 127.5172 53.9417 42.3002 177.0324 109 K 4.0704 8.8082 124.1970 59.1066 32.5161 177.2656 110 S 4.7044 7.7438 112.4697 56.0608 66.6863 173.3829 111 A 4.4354 8.3231 123.5306 52.0136 18.8991 177.2589 112 A 4.4721 8.8220 122.4776 51.4534 20.2527 177.4219 113 S 4.5338 8.8212 116.4591 57.5447 63.5323 174.4275 114 L 4.7470 8.4830 125.3478 53.9400 43.5295 176.5199 115 N 4.6119 8.7035 119.7640 52.9119 39.7852 175.1102 116 S 4.3872 8.7495 109.8769 60.5914 63.8749 175.5736 117 R 4.1732 8.7039 119.2370 56.9724 30.5347 176.4624 118 V 4.4737 7.8984 117.2420 60.8523 33.8052 173.6457 119 A 5.1037 8.5543 127.9078 50.6461 23.0304 175.1834 120 S 5.0380 8.6591 114.2345 57.5906 65.1016 172.9939 121 I 4.4636 8.1127 120.3985 59.1908 39.8183 175.3737 122 S 4.4723 8.3018 122.4950 57.8766 63.8180 173.9885 123 L 4.3413 8.0843 122.9649 53.4792 42.4251 175.2653 124 P 4.5840 0.0000 0.0000 62.8014 32.5511 176.1053 125 T 4.2636 8.1820 107.7596 61.9519 70.2452 174.2971 *127 S 4.9354 7.5775 115.0086 58.2815 64.0253 173.9696 128 C 4.4698 8.3964 117.9909 56.4474 40.9215 173.3844 129 A 4.4809 7.9336 124.1320 51.3256 19.9833 177.3605 130 S 4.3535 8.0323 115.4253 57.2254 64.6417 173.5430 *132 A 4.2740 8.1365 123.7801 53.3983 19.1776 177.2002 133 G 4.0117 9.1241 109.6172 45.4956 0.0000 174.5620 134 T 3.9334 7.5632 117.2432 63.8797 69.4669 173.1628 135 Q 4.6933 8.5590 127.0995 55.4138 30.4270 175.1053 136 C 5.2887 9.1595 122.3939 55.1317 46.7257 172.2517 137 L 5.2041 8.9572 122.3069 53.5151 44.1493 174.9847 138 I 5.1861 8.9808 127.0810 58.8071 40.0216 174.8364 139 S 4.9276 8.9449 119.3466 56.1074 66.7325 173.0658 140 G 3.9065 7.2080 108.8752 45.8053 0.0000 172.5976 141 W 4.7972 8.3927 117.3846 56.2727 29.4592 177.1305 142 G 4.1513 8.3291 108.8104 44.2830 0.0000 173.5901 143 N 3.9031 8.5564 118.1380 54.3228 38.9568 174.5643 144 T 5.1061 8.1493 112.5719 60.5440 69.7126 174.3205 145 K 4.6238 7.8622 121.7147 54.7757 34.5688 176.2212 146 S 4.3887 8.6128 116.8544 59.7238 63.7417 174.3726 147 S 4.4435 7.8879 116.7356 55.6850 62.6559 171.9612 148 G 3.8883 7.9313 110.1552 43.4737 0.0000 170.5165 149 T 4.5403 8.2194 109.4859 59.7357 70.7897 173.8360 150 S 4.4588 9.3707 121.4406 56.7735 65.4520 171.8560 151 Y 4.9925 8.6973 125.3346 55.7921 39.4144 174.3335 152 P 4.7464 0.0000 0.0000 62.2569 33.2578 175.4899 153 D 4.6459 8.6938 117.6340 55.8615 41.6305 177.2488 154 V 5.6188 7.3890 109.8765 58.4581 34.6064 175.7101 155 L 3.1279 8.2474 123.7449 55.0375 42.8600 176.0019 156 K 4.8976 8.1065 125.0024 54.9484 35.0947 174.6241 157 C 5.3089 8.4323 119.3339 55.1911 44.8519 172.9621 158 L 4.9937 8.5972 122.4258 53.7506 45.6370 174.5021 159 K 5.0868 8.9674 125.0729 55.0630 33.7172 175.7108 160 A 4.8062 8.9600 126.0192 49.7048 23.0968 173.5103 161 P 4.9999 0.0000 0.0000 61.9872 33.8717 175.1435 162 I 4.3836 8.3012 122.4414 61.3242 38.1816 175.9297 163 L 4.8202 8.7724 127.4677 53.2916 43.4540 176.7818 164 S 4.4248 8.4039 114.6225 58.0216 64.0326 175.1381 165 D 4.4667 8.6618 121.5920 57.4201 40.5100 179.2405 166 S 4.1361 8.0066 114.5511 61.6469 63.1213 176.6704 167 S 4.1344 8.0574 118.6950 61.0972 62.5337 175.8015 168 C 4.2853 8.2659 121.2334 59.8784 38.5136 175.9599 169 K 3.9805 8.3774 120.0711 59.4738 31.3253 179.6348 170 S 4.1547 7.9334 114.8239 61.3471 62.7847 176.1316 171 A 3.9987 7.7523 122.8627 53.7687 19.6884 177.3931 172 Y 4.9264 7.8697 113.6555 55.6380 38.3307 173.8077 173 P 4.7665 0.0000 0.0000 63.6613 32.1338 177.8378 174 G 3.9818 9.0040 108.8391 46.0655 0.0000 173.6513 175 Q 4.5222 8.2201 116.6107 55.3978 30.1960 175.3059 176 I 4.4147 7.8486 119.9188 60.0028 38.2959 175.4878 177 T 4.5349 8.2206 115.8857 59.7703 70.8647 175.1131 178 S 4.4340 8.5324 114.2090 59.8855 63.1845 174.1757 179 N 5.0067 8.1949 118.4823 53.4216 38.5842 173.8221 180 M 6.0565 8.0362 116.9673 52.8701 36.2638 174.4463 181 F 5.0820 8.1875 114.1144 56.0394 41.9259 173.5108 182 C 5.5673 9.0504 116.2248 55.5883 42.6016 172.7730 183 A 5.0566 9.2542 122.0289 51.1174 22.6085 176.5009 184 G 3.9786 6.9253 106.4783 44.5306 0.0000 172.0910 184A Y 4.6485 8.3735 118.8607 55.9889 40.4696 176.6227 185 L 4.1522 8.6221 125.5855 57.2257 42.0073 178.7896 186 E 4.1011 8.2089 115.1999 57.0357 29.9834 177.3178 187 G 3.7806 7.7357 107.4393 45.1477 0.0000 171.8469 188 G 4.1993 8.9114 106.5500 44.6077 0.0000 174.1797 188A K 4.8040 7.2490 117.4550 54.7689 35.1454 175.3338 189 D 4.6413 8.8668 123.4154 54.0230 45.6914 174.5446 190 S 4.9716 8.7119 116.3221 57.7795 65.5653 172.9866 191 C 4.7328 9.2382 118.7936 55.3455 47.7722 172.1504 192 Q 4.3972 8.6341 121.0086 58.1823 28.7983 176.3757 193 G 4.2790 9.2976 111.7767 45.9952 0.0000 174.2299 194 D 4.6742 8.4327 118.4824 55.5488 41.6402 176.6449 195 S 4.4073 8.0208 114.7722 60.2550 63.3578 175.0382 196 G 3.9575 8.9742 112.9147 46.5048 0.0000 173.8163 197 G 4.4079 7.9558 107.2140 44.8195 0.0000 171.1101 198 P 5.2155 0.0000 0.0000 62.2399 33.6151 175.7619 199 V 4.5546 8.4495 120.7293 61.4474 34.2451 173.9585 200 V 4.8879 8.6614 128.7393 61.2740 33.8806 173.7396 201 C 5.1285 8.7362 124.4384 55.7621 43.9222 174.5699 202 S 3.5365 9.7342 119.6848 59.7327 60.1288 173.0564 203 G 3.9190 8.3078 103.4756 45.8486 0.0000 173.6447 204 K 4.6706 7.7173 118.0509 53.0243 35.0998 175.4802 *209 L 4.2992 8.2618 122.6637 55.4383 42.2708 175.8340 210 Q 4.5093 8.8112 125.9557 56.6528 30.9590 175.8321 211 G 5.3655 8.0402 104.4135 45.6647 0.0000 171.3532 212 I 5.1652 8.1728 119.3658 58.8760 41.1677 175.2714 213 V 3.7594 8.8491 127.0728 64.0048 31.7615 174.1512 214 S 4.9263 8.5370 121.3293 58.4716 64.3348 174.3801 215 W 5.0923 7.5434 113.8462 55.4743 32.3223 172.6103 216 G 3.9019 8.3411 106.0165 46.4077 0.0000 173.4630 217 S 4.6553 8.5862 116.9629 57.0756 62.8329 173.9098 *219 G 4.3495 7.9919 115.4907 45.5354 0.0000 170.9233 220 C 4.9713 8.0559 114.8543 56.3697 44.7461 173.8868 221 A 3.9717 9.0943 125.3906 53.2297 16.5305 177.1089 221A Q 4.5472 7.2917 116.4222 56.1247 29.8955 175.9418 222 K 4.0840 8.4442 121.8976 58.0004 32.7221 176.0311 223 N 4.2614 9.2459 121.3640 54.0818 37.0248 175.3879 224 K 4.2811 7.4895 116.7700 53.6342 32.3130 173.6228 225 P 4.5924 0.0000 0.0000 62.3156 33.1715 177.1462 226 G 3.7248 8.4378 106.0430 45.7004 0.0000 172.8775 227 V 4.4029 7.3704 121.1828 60.6511 34.2203 174.0663 228 Y 4.9160 8.0261 124.3906 56.0185 41.8239 175.0703 229 T 4.4080 8.4979 119.6406 63.5441 70.1032 174.4494 230 K 5.1175 9.3032 128.1343 55.3724 31.3305 177.2599 231 V 3.9491 8.7999 126.2306 65.8175 31.4144 174.8553 232 C 4.3954 8.3681 112.6890 58.2652 41.4251 174.7688 233 N 4.3099 8.0376 116.8735 54.1572 38.6301 174.9965 234 Y 4.7856 8.0351 117.8684 57.5485 39.2415 177.5838 235 V 3.6876 8.0640 121.3602 66.3692 31.5514 178.0542 236 S 4.1270 8.1040 114.3345 61.1795 62.6471 176.3427 237 W 4.1145 8.2508 130.5466 60.5153 30.5208 177.8191 238 I 3.2066 8.3602 120.0819 64.2726 36.5830 178.5407 239 K 3.7554 8.1539 119.3579 59.5566 31.9913 179.5128 240 Q 3.8721 8.2929 118.5934 59.1705 28.3985 178.9292 241 T 3.5568 7.3670 115.9100 66.4821 68.7281 176.5380 242 I 2.8202 7.2875 121.5932 63.9701 36.7811 178.3946 243 A 4.0236 7.7152 120.6572 54.3363 18.1821 178.7610 244 S 4.6235 7.4455 109.7210 58.3222 63.5154 174.1318 245 N 4.6693 7.9691 125.1380 53.8953 39.3321 174.0341 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 4.29 1.79 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.69 0.93 0.00 0.00 17 V 8.60 4.42 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 1.03 0.00 0.00 0.96 0.00 0.00 18 G 9.01 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 19 G 7.79 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 20 Y 7.68 4.98 0.00 2.95 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 21 T 8.56 4.18 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 1.22 0.00 0.00 22 C 8.73 4.34 0.00 2.75 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.64 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 24 A 8.65 4.06 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.82 4.24 0.00 2.85 2.90 0.00 0.00 7.28 7.57 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 26 T 7.51 4.27 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 1.31 0.00 0.00 27 V 7.00 4.11 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 0.33 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.48 0.00 2.39 2.41 0.00 3.66 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 2.20 2.00 0.00 29 Y 6.84 4.93 0.00 3.17 3.38 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 0.00 0.00 0.00 0.00 30 Q 7.36 4.61 0.00 1.79 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.52 0.00 0.00 0.00 0.00 0.00 1.93 2.53 0.00 31 V 8.97 4.85 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 0.75 0.00 0.00 0.97 0.00 0.00 32 S 8.63 4.82 0.00 3.02 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 33 L 8.36 4.56 0.00 0.52 0.93 0.80 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.97 5.66 0.00 2.36 2.41 0.00 0.00 6.52 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 *37 S 8.47 4.42 0.00 3.84 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 38 G 9.78 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 39 Y 6.75 4.53 0.00 3.03 2.93 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 40 H 8.75 4.65 0.00 2.83 3.13 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.56 4.89 0.00 3.15 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 42 C 6.58 4.72 0.00 2.36 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 43 G 8.41 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 44 G 7.96 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.69 5.48 0.00 3.83 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 46 L 9.07 4.69 0.00 1.88 1.67 1.07 0.79 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 47 I 8.48 4.37 1.90 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 1.55 0.91 1.01 0.00 0.00 48 N 7.52 4.66 0.00 2.99 2.99 0.00 0.00 6.16 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 49 S 8.55 4.41 0.00 4.05 4.19 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 50 Q 9.24 4.55 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.89 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 51 W 8.39 5.60 0.00 3.27 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 9.01 5.18 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 1.13 0.00 0.00 0.98 0.00 0.00 53 V 8.80 4.96 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.01 0.00 0.00 54 S 8.99 5.11 0.00 3.89 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 8.51 4.82 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 56 A 8.33 3.81 0.24 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 57 H 8.34 4.54 0.00 3.37 3.56 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 7.82 4.74 0.00 3.21 3.32 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 Y 7.78 4.17 0.00 2.98 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 60 K 6.58 3.67 0.00 1.49 1.33 0.00 0.73 0.00 0.00 1.30 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.71 0.97 7.81 61 S 8.14 4.34 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 62 G 8.32 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.41 4.40 1.85 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 1.37 1.04 0.90 0.00 0.00 64 Q 8.72 4.79 0.00 1.99 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.88 0.00 0.00 0.00 0.00 0.00 2.05 2.19 0.00 65 V 8.80 4.41 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 0.93 0.00 0.00 0.88 0.00 0.00 65A R 8.76 5.02 0.00 1.61 1.68 0.00 2.64 0.00 0.00 2.33 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.14 0.00 66 L 9.01 4.71 0.00 1.63 1.62 0.95 0.95 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 8.21 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 70 E 8.45 4.70 0.00 2.12 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 2.33 2.04 0.00 71 D 7.86 4.74 0.00 2.72 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.52 4.90 0.00 2.85 2.84 0.00 0.00 7.23 7.27 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 73 I 8.38 4.00 1.42 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.55 -0.46 0.00 0.00 74 N 8.78 4.80 0.00 2.79 2.87 0.00 0.00 6.63 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.36 4.31 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 0.73 0.00 0.00 0.99 0.00 0.00 76 V 8.45 4.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.95 0.00 0.00 77 E 9.24 4.43 0.00 1.98 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 2.27 2.44 0.00 78 G 8.53 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 0.00 0.00 0.00 79 N 8.97 4.63 0.00 2.89 3.20 0.00 0.00 6.99 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 80 E 7.61 4.51 0.00 1.54 1.67 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 2.62 2.47 0.00 81 Q 8.93 4.41 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.88 5.53 0.00 2.78 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 83 I 8.79 4.72 1.87 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 1.25 0.73 0.94 0.00 0.00 84 S 8.64 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 8.15 4.38 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 86 S 9.09 4.47 0.00 3.72 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 87 K 7.59 4.75 0.00 1.87 1.84 0.00 1.61 0.00 0.00 1.93 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.40 7.81 88 S 8.78 5.23 0.00 4.10 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 89 I 9.15 4.49 2.05 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 1.24 1.19 1.08 0.00 0.00 90 V 8.29 4.21 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 0.59 0.00 0.00 0.74 0.00 0.00 91 H 8.57 3.91 0.00 2.81 2.99 0.00 5.65 0.00 0.00 0.00 0.00 6.76 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 4.32 0.00 2.07 2.14 0.00 3.09 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 93 S 7.92 4.72 0.00 3.91 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 94 Y 7.97 4.26 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 95 N 8.09 4.57 0.00 2.61 2.46 0.00 0.00 6.51 7.39 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 96 S 7.73 3.93 0.00 3.94 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 8.57 4.40 0.00 2.69 2.78 0.00 0.00 6.81 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.76 3.96 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 1.13 0.00 0.00 99 L 7.99 3.78 0.00 1.44 1.91 0.78 0.97 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 0.00 100 N 7.66 4.48 0.00 2.73 2.64 0.00 0.00 7.27 7.52 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 0.00 101 N 8.66 4.82 0.00 3.05 2.66 0.00 0.00 7.21 8.26 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 0.00 102 D 7.92 4.74 0.00 3.08 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.19 4.82 1.45 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.20 0.17 0.00 0.00 104 M 9.13 5.40 0.00 2.13 1.82 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.65 0.00 105 L 9.02 5.39 0.00 1.80 1.82 0.27 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.15 5.02 1.92 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 1.20 0.99 0.89 0.00 0.00 107 K 8.70 3.76 0.00 0.79 1.11 0.00 1.22 0.00 0.00 1.34 0.00 0.00 2.60 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.65 0.21 7.81 108 L 8.10 4.56 0.00 1.48 1.54 0.96 0.69 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 0.00 109 K 8.81 4.07 0.00 1.79 1.79 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.38 7.81 110 S 7.74 4.70 0.00 3.82 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 8.32 4.44 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 8.82 4.47 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.82 4.53 0.00 3.78 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 8.48 4.75 0.00 1.65 1.62 0.99 1.07 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 0.00 115 N 8.70 4.61 0.00 2.73 2.69 0.00 0.00 6.96 7.57 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 0.00 116 S 8.75 4.39 0.00 4.01 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 0.00 117 R 8.70 4.17 0.00 1.88 2.04 0.00 3.16 0.00 0.00 3.16 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.58 4.94 0.00 4.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.40 4.47 0.00 2.94 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 0.00 129 A 7.93 4.48 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.03 4.35 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 *132 A 8.14 4.27 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 9.12 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.56 3.93 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 1.14 0.00 0.00 135 Q 8.56 4.69 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.88 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 136 C 9.16 5.29 0.00 2.80 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 0.00 137 L 8.96 5.20 0.00 1.76 1.56 1.05 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 138 I 8.98 5.19 1.87 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.23 0.96 0.00 0.00 139 S 8.94 4.93 0.00 3.50 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 0.00 140 G 7.21 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 0.00 141 W 8.39 4.80 0.00 3.10 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 0.00 142 G 8.33 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 8.56 3.90 0.00 2.33 2.65 0.00 0.00 7.01 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 0.00 144 T 8.15 5.11 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 1.24 0.00 0.00 145 K 7.86 4.62 0.00 1.83 1.69 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.30 1.32 7.81 146 S 8.61 4.39 0.00 3.99 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 0.00 147 S 7.89 4.44 0.00 3.83 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 0.00 148 G 7.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.22 4.54 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 1.25 0.00 0.00 150 S 9.37 4.46 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 0.00 151 Y 8.70 4.99 0.00 2.98 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 4.75 0.00 2.42 2.11 0.00 4.20 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 2.04 0.00 153 D 8.69 4.65 0.00 2.80 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 0.00 154 V 7.39 5.62 2.30 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 1.05 0.00 0.00 0.96 0.00 0.00 155 L 8.25 3.13 0.00 1.36 1.25 -0.83 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.11 4.90 0.00 1.68 1.50 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.47 7.81 157 C 8.43 5.31 0.00 1.45 2.30 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 0.00 158 L 8.60 4.99 0.00 1.70 1.44 1.01 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.97 5.09 0.00 1.82 1.82 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.64 7.81 160 A 8.96 4.81 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 0.00 161 P 0.00 5.00 0.00 2.03 2.26 0.00 3.13 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 1.86 1.77 0.00 162 I 8.30 4.38 1.88 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.73 0.78 0.00 0.00 163 L 8.77 4.82 0.00 1.55 1.61 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.40 4.42 0.00 4.01 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 0.00 165 D 8.66 4.47 0.00 2.77 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 8.01 4.14 0.00 4.06 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.06 4.13 0.00 3.94 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 0.00 168 C 8.27 4.29 0.00 3.21 3.33 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 0.00 169 K 8.38 3.98 0.00 1.95 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.66 7.81 170 S 7.93 4.15 0.00 4.04 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 0.00 171 A 7.75 4.00 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 0.00 172 Y 7.87 4.93 0.00 3.12 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.77 0.00 2.21 2.11 0.00 3.60 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.00 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 0.00 0.00 0.00 175 Q 8.22 4.52 0.00 2.34 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.03 0.00 0.00 0.00 0.00 0.00 2.27 2.54 0.00 176 I 7.85 4.41 1.98 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.97 1.00 0.00 0.00 177 T 8.22 4.53 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 1.24 0.00 0.00 178 S 8.53 4.43 0.00 4.01 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 0.00 179 N 8.19 5.01 0.00 3.08 3.10 0.00 0.00 6.65 7.42 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 0.00 180 M 8.04 6.06 0.00 1.80 1.99 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.44 0.00 181 F 8.19 5.08 0.00 2.98 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 0.00 182 C 9.05 5.57 0.00 2.98 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 0.00 183 A 9.25 5.06 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 6.93 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 0.00 0.00 0.00 184A Y 8.37 4.65 0.00 3.00 3.04 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 0.00 185 L 8.62 4.15 0.00 1.73 1.73 0.92 0.87 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 0.00 186 E 8.21 4.10 0.00 2.10 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 0.00 2.33 2.26 0.00 187 G 7.74 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 0.00 188 G 8.91 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 0.00 0.00 0.00 0.00 188A K 7.25 4.80 0.00 1.38 1.63 0.00 0.85 0.00 0.00 1.39 0.00 0.00 2.42 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.18 1.12 7.81 189 D 8.87 4.64 0.00 2.79 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.71 4.97 0.00 4.02 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 0.00 191 C 9.24 4.73 0.00 2.95 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 0.00 192 Q 8.63 4.40 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 5.30 0.00 0.00 0.00 0.00 0.00 2.66 2.53 0.00 193 G 9.30 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 0.00 0.00 0.00 0.00 194 D 8.43 4.67 0.00 2.96 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 0.00 195 S 8.02 4.41 0.00 3.99 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 8.97 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 0.00 197 G 7.96 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.22 0.00 2.32 2.35 0.00 3.69 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 2.22 2.21 0.00 199 V 8.45 4.55 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.62 0.00 0.00 200 V 8.66 4.89 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 0.86 0.00 0.00 0.69 0.00 0.00 201 C 8.74 5.13 0.00 2.81 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.73 3.54 0.00 3.92 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 0.00 203 G 8.31 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 7.72 4.67 0.00 1.70 1.64 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.26 4.30 0.00 1.52 1.64 1.02 0.76 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 8.81 4.51 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.35 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 8.04 5.37 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 0.00 212 I 8.17 5.17 1.92 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 1.29 1.11 1.03 0.00 0.00 213 V 8.85 3.76 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 0.98 0.00 0.00 1.18 0.00 0.00 214 S 8.54 4.93 0.00 3.90 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 0.00 215 W 7.54 5.09 0.00 3.41 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 0.00 216 G 8.34 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.59 4.66 0.00 4.13 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 *219 G 7.99 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.06 4.97 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 9.09 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.29 4.55 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.94 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.44 4.08 0.00 1.72 1.71 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.57 7.81 223 N 9.25 4.26 0.00 2.80 2.79 0.00 0.00 6.75 7.52 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 0.00 224 K 7.49 4.28 0.00 1.67 1.78 0.00 1.63 0.00 0.00 1.33 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 225 P 0.00 4.59 0.00 2.14 2.12 0.00 3.63 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 226 G 8.44 3.72 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 0.00 0.00 0.00 227 V 7.37 4.40 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 0.48 0.00 0.00 -0.63 0.00 0.00 228 Y 8.03 4.92 0.00 1.43 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.50 4.41 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 1.20 0.00 0.00 230 K 9.30 5.12 0.00 2.06 1.92 0.00 1.82 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.66 7.81 231 V 8.80 3.95 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 1.13 0.00 0.00 1.11 0.00 0.00 232 C 8.37 4.40 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 8.04 4.31 0.00 2.38 2.43 0.00 0.00 6.94 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 0.00 234 Y 8.04 4.79 0.00 3.08 3.18 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 0.00 235 V 8.06 3.69 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 1.13 0.00 0.00 1.11 0.00 0.00 236 S 8.10 4.13 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 8.25 4.11 0.00 3.48 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 0.00 238 I 8.36 3.21 2.03 0.00 0.00 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 1.65 1.01 0.76 0.00 0.00 239 K 8.15 3.76 0.00 1.84 1.78 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.60 7.81 240 Q 8.29 3.87 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 241 T 7.37 3.56 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 242 I 7.29 2.82 1.44 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.17 0.45 0.00 0.00 243 A 7.72 4.02 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 S 7.45 4.62 0.00 4.04 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 0.00 245 N 7.97 4.67 0.00 3.05 3.03 0.00 0.00 6.75 7.50 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 * Residues marked with a * may have inaccurate shift predictions.