NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2758 7.8827 121.4550 61.2492 38.6030 173.7804 17 V 4.3284 8.8164 126.2662 61.8105 32.8078 174.6102 18 G 3.9777 8.5234 113.9057 46.6737 0.0000 173.5166 19 G 4.1634 7.6694 109.7866 44.4712 0.0000 172.6467 20 Y 4.9551 7.9668 117.2009 55.3165 42.1985 174.9280 21 T 4.1913 8.6312 117.3766 64.1575 68.4209 174.9699 22 C 4.3293 8.5516 125.2179 61.0117 36.0761 174.7718 23 G 4.0910 8.7942 106.3739 43.7825 0.0000 172.5879 24 A 4.1587 8.6318 124.7158 52.7399 18.3029 176.8170 25 N 4.2657 8.8809 119.6141 54.8402 36.1609 175.6508 26 T 4.1581 7.7438 108.0730 62.9690 69.8864 175.0048 27 V 4.0965 7.0653 121.9702 59.6500 31.3741 173.5737 28 P 4.4971 0.0000 0.0000 64.2330 31.6662 178.2188 29 Y 5.0402 6.9219 114.9850 56.6348 38.8377 174.5801 30 Q 4.6309 7.3714 123.5813 56.2318 29.7062 175.4148 31 V 4.9054 8.9928 118.7366 59.6850 36.4338 174.1233 32 S 5.0339 8.7187 116.6409 56.6051 65.0711 172.6210 33 L 4.6081 8.6189 127.2572 53.2971 43.2200 174.9325 34 N 5.6982 8.8654 122.8105 50.1704 41.8833 174.8296 *37 S 4.1941 8.4270 120.6636 58.4173 63.3644 174.1036 38 G 4.0528 9.5458 108.3853 44.9337 0.0000 172.8362 39 Y 4.4382 6.7641 115.8609 56.4591 39.7621 172.1823 40 H 4.6115 8.9268 121.3062 55.9420 30.2357 174.7248 41 F 4.9071 7.7307 120.1033 56.7078 39.5872 173.7173 42 C 4.6060 6.4832 116.8950 56.1894 44.7709 172.9070 43 G 4.3058 8.7794 108.9539 45.4137 0.0000 172.2208 44 G 4.6415 8.1625 104.7323 46.3222 0.0000 172.7157 45 S 5.4588 8.8717 116.1377 56.3603 66.3833 173.5603 46 L 4.8482 9.2893 128.2587 54.8701 42.3988 177.0610 47 I 4.4986 8.6141 119.1817 60.9602 39.4001 174.6317 48 N 4.9299 7.7199 118.4409 52.3070 41.7315 174.8548 49 S 4.3175 8.8084 116.1567 60.7089 63.2790 175.1528 50 Q 4.6413 8.8516 118.1919 55.1206 30.8384 174.9693 51 W 5.5259 8.3828 119.0459 54.8295 33.6676 174.3972 52 V 5.0431 9.1028 122.9016 61.1751 34.6553 174.1159 53 V 4.8810 9.0058 127.0191 61.7687 33.8134 174.7437 54 S 4.7889 9.0608 120.8679 57.6860 66.1141 172.2649 55 A 4.6543 8.4740 120.6675 50.7772 20.3239 178.4919 56 A 3.8241 8.4062 124.1882 55.2815 18.3928 179.5360 57 H 4.4709 8.0258 108.6650 57.3154 28.8055 176.3747 58 C 4.7584 7.6807 117.4223 57.0369 40.2704 173.0669 59 Y 4.1934 7.7484 122.6452 57.6855 38.6974 175.4183 60 K 4.2183 7.2202 124.8695 54.8194 36.2687 175.6218 61 S 4.2291 8.0861 115.6813 58.3897 64.2470 173.6879 62 G 3.8267 8.4047 107.9722 46.7247 0.0000 173.9365 63 I 4.0932 7.5089 119.8005 60.8176 38.8231 175.1225 64 Q 4.7456 8.9611 127.7101 54.2106 31.7354 174.1476 65 V 4.4205 8.8821 127.2093 61.9223 33.5448 174.6185 66 R 5.0539 8.9344 127.3742 54.7273 32.2777 175.2138 67 L 4.7557 9.0402 124.6884 52.6356 44.9336 177.5741 *69 G 3.9188 8.2413 107.1172 45.4393 0.0000 172.7648 70 E 4.5116 8.1882 118.2245 55.2640 30.4033 174.1924 71 D 4.7655 7.8104 117.6582 55.3337 43.7356 174.2660 72 N 4.7874 8.8565 123.4111 52.9293 38.8217 176.0543 73 I 3.5893 8.6807 127.1978 62.5403 38.1026 175.9945 74 N 4.8287 8.4318 115.7044 53.4261 39.4007 174.8168 75 V 4.3674 7.4120 117.2264 60.6768 34.6370 174.8384 76 V 4.0287 8.4554 126.5196 62.9650 31.2409 175.3469 77 E 4.3861 9.9817 127.7132 55.8986 30.1974 177.1275 78 G 4.0327 8.5210 106.9290 45.3221 0.0000 174.0765 79 N 4.9021 8.0495 115.4031 52.8287 39.6279 173.9201 80 E 4.5471 7.7806 117.8095 56.3556 30.9117 176.4275 81 Q 4.3276 8.9968 120.3999 54.5081 32.7678 174.1970 82 F 5.4681 8.8270 123.7415 56.1368 40.5856 175.5590 83 I 4.6504 8.8091 125.1613 59.3431 40.6507 175.6540 84 S 4.7053 8.6898 122.5099 58.1847 64.2467 173.3639 85 A 4.5802 8.5285 125.6241 52.1596 18.2523 177.6796 86 S 4.5828 8.9456 116.3012 58.9761 65.0689 174.7562 87 K 4.6378 7.5472 118.8229 55.1492 36.6582 175.4834 88 S 5.0086 8.7983 119.4065 57.0056 65.3916 173.0624 89 I 4.3874 9.1849 127.0618 59.6888 38.0682 175.5035 90 V 4.2572 8.3458 127.5591 62.1469 32.7684 175.2090 91 H 4.0161 8.7608 127.0093 55.8517 29.9904 174.4757 92 P 4.3241 0.0000 0.0000 65.3270 31.1343 177.0403 93 S 4.6678 7.9751 112.7873 58.0321 63.2314 173.2356 94 Y 4.2711 7.9124 122.7485 57.8611 38.9095 175.0062 95 N 4.4646 8.1052 125.9545 51.4599 39.7090 175.0905 96 S 3.8698 8.0288 120.2376 59.6577 63.6147 174.5555 97 N 4.5208 8.0652 118.1712 55.2951 39.3233 176.1882 98 T 3.9034 8.2039 106.0681 61.5990 69.4579 175.6272 99 L 3.7321 7.8534 120.7861 54.8931 39.9275 174.0208 100 N 4.4274 7.5944 118.4449 54.7388 39.4965 174.4190 101 N 4.7928 8.6785 119.3227 54.2585 35.9578 175.4926 102 D 4.7303 7.9821 117.1719 53.1907 39.3686 174.8549 103 I 4.8423 7.1363 120.8088 59.3126 42.5282 173.2565 104 M 5.4519 9.2794 126.8671 54.1101 36.3609 173.2532 105 L 5.3876 9.3566 125.2912 53.1573 44.7180 175.2701 106 I 4.9655 9.1595 124.8887 59.4103 39.9636 174.5206 107 K 3.4140 8.6427 129.2189 54.7696 33.5288 175.4573 108 L 4.4306 8.0271 127.6369 53.7574 42.0270 177.1023 109 K 4.1268 8.9024 125.3932 58.8865 32.6207 177.0274 110 S 4.6543 7.7153 111.4701 55.7435 66.1380 173.1493 111 A 4.3825 8.3889 123.4217 51.9362 18.7461 177.3571 112 A 4.2284 9.0013 124.4038 51.8435 19.6507 177.5086 113 S 4.4717 9.0967 117.7564 57.6688 63.5242 174.0701 114 L 4.5915 8.2895 125.5638 53.4053 42.6094 176.3715 115 N 4.3490 8.7278 118.2389 54.0168 40.7995 172.3788 116 S 4.1324 8.4131 120.0269 58.8141 61.8809 171.8168 117 R 4.1012 7.5256 117.8986 57.4449 30.7863 176.3860 118 V 4.6585 7.6363 117.0174 61.0005 33.7860 173.5018 119 A 5.1591 8.5090 128.2563 50.4343 22.9835 175.1104 120 S 5.0956 8.6932 113.9441 57.7612 64.9155 173.1085 121 I 4.4434 8.2867 121.4683 59.1013 39.7705 175.5380 122 S 4.4026 8.4333 124.3609 58.4525 64.0327 173.9616 123 L 4.2879 8.3272 122.9131 53.2301 42.5951 175.1533 124 P 4.5145 0.0000 0.0000 63.0390 32.1179 176.3387 125 T 4.2078 8.2334 108.7559 62.2738 70.0949 174.5426 *127 S 4.4174 7.5716 114.8818 58.0000 64.0230 174.1483 128 C 4.4244 8.4506 118.2099 56.8410 40.6958 173.2663 129 A 4.5194 8.0180 124.6398 51.0896 20.0091 177.4079 130 S 4.3552 8.0821 114.7716 56.9339 64.9608 173.2023 *132 A 4.2221 8.1849 123.3820 53.5010 19.2224 177.1928 133 G 3.9610 9.0825 110.5306 45.2864 0.0000 174.2978 134 T 3.9257 7.5373 117.5999 63.7240 69.3371 173.4798 135 Q 4.5261 8.6210 128.1021 56.1187 30.0930 175.3645 136 C 5.2498 9.2830 122.5588 55.2028 46.8034 172.3208 137 L 5.1720 9.1588 122.4036 53.6143 43.9022 174.9515 138 I 5.3364 9.1543 127.6594 58.8679 39.8200 174.9615 139 S 4.9234 8.7446 119.5164 56.3433 66.6518 172.9644 140 G 3.7744 7.2284 108.1533 46.2249 0.0000 173.0058 141 W 4.5582 8.5431 116.8454 56.2390 29.3669 176.8959 142 G 4.0942 8.4593 109.1846 44.3586 0.0000 173.4565 143 N 4.1505 8.8499 118.3386 54.5660 38.9721 174.4697 144 T 5.0674 8.3163 113.0211 60.4744 69.4433 174.1731 145 K 4.6207 7.8481 121.5014 54.8117 34.4792 176.4054 146 S 4.3002 8.6321 117.3607 59.7152 63.6615 174.1801 147 S 4.3435 8.0034 114.5132 59.4970 64.4069 172.7390 148 G 3.8256 9.4103 112.7380 43.8456 0.0000 170.9885 149 T 4.6171 7.8713 107.5561 60.0210 71.8048 173.9083 150 S 4.1975 8.9277 120.4258 57.7755 65.6396 172.2018 151 Y 5.0166 8.3526 125.9982 55.7258 38.9886 174.3947 152 P 4.6003 0.0000 0.0000 62.7135 32.8204 176.2204 153 D 4.5360 8.8541 119.7052 57.0816 41.2750 177.1994 154 V 5.4196 7.4077 109.6867 58.7522 34.1790 175.7898 155 L 3.1660 8.6819 124.3346 55.1179 43.0887 175.7491 156 K 4.8287 8.1512 124.9415 54.8845 35.0910 174.6143 157 C 5.1650 8.7768 120.0762 55.1303 41.6737 172.9906 158 L 4.9387 8.4507 122.7249 53.8509 45.5556 174.4530 159 K 5.1586 8.9792 125.6809 55.3240 33.3831 175.8280 160 A 4.9003 8.9688 125.9724 49.9362 23.2272 173.3245 161 P 5.0400 0.0000 0.0000 61.7624 33.8849 175.2482 162 I 4.3175 8.3298 122.6138 61.4736 38.1614 175.3812 163 L 5.0312 8.7001 126.5120 52.6149 44.2185 176.7685 164 S 4.2827 8.4220 115.0621 58.1491 63.8748 174.8652 165 D 4.3731 8.7863 121.4803 57.6311 40.9428 178.6203 166 S 4.1024 8.0634 113.4279 61.4807 62.4860 176.2234 167 S 4.1716 8.2416 116.9555 61.3216 62.7348 175.6389 168 C 4.3176 8.4017 122.1700 59.6455 41.7175 175.8311 169 K 3.9446 8.4119 120.1663 59.4266 31.3330 179.6506 170 S 4.2390 7.8201 114.8368 61.3699 62.7886 176.1960 171 A 4.0131 7.9344 122.7120 53.7804 19.7313 177.4032 172 Y 4.7748 7.9040 115.2469 54.5753 38.2312 171.8501 173 P 4.5181 0.0000 0.0000 63.2295 32.1288 176.5804 174 G 4.0387 9.0535 110.0090 46.4364 0.0000 173.8032 175 Q 4.5251 8.1443 116.9955 55.1523 30.8528 175.6801 176 I 4.3551 7.9207 119.3386 60.1729 38.0365 175.6171 177 T 4.5095 8.2742 116.1596 59.8338 70.6022 175.4943 178 S 4.3579 8.5515 115.1413 60.3259 63.1613 174.4506 179 N 5.0314 8.1684 118.4008 53.2604 38.6001 173.7373 180 M 5.5904 7.9414 116.6716 53.7852 36.1884 174.7608 181 F 5.1207 8.7619 115.3191 55.8287 41.9941 172.9097 182 C 5.3839 9.0463 117.2834 56.3689 41.4094 172.3542 183 A 5.0279 8.9372 121.5134 51.4687 22.4864 176.0874 184 G 4.1429 7.0515 107.3698 44.6162 0.0000 172.2262 184A Y 4.6706 8.4978 118.4173 55.9374 41.1217 176.6044 185 L 4.1534 8.6748 124.8931 57.3593 42.0380 179.0756 186 E 4.1031 8.2018 115.7306 57.4089 29.8431 177.5097 187 G 3.8973 7.5088 105.1654 45.1911 0.0000 172.7146 188 G 4.0381 9.5172 106.3459 44.5758 0.0000 173.5033 188A K 4.9181 7.3125 117.5271 55.0413 35.4177 175.1565 189 D 4.6398 8.7896 123.4386 53.8165 45.5612 174.7232 190 S 5.0000 8.7994 116.0172 57.9892 64.9250 173.4863 191 C 4.8041 9.7653 120.0001 54.8473 46.5703 172.6465 192 Q 4.2001 8.7253 120.1205 58.4032 28.1021 178.2390 193 G 4.1752 9.0841 110.6181 45.8517 0.0000 173.8329 194 D 4.6798 8.6013 119.3203 55.3647 41.7633 176.7791 195 S 4.4684 8.0721 115.1340 60.3851 63.5450 175.6386 196 G 4.0068 8.9340 112.1660 46.4607 0.0000 173.7524 197 G 4.4103 7.8201 107.5848 45.1972 0.0000 171.0711 198 P 5.2263 0.0000 0.0000 62.2408 33.6503 175.7848 199 V 4.4593 8.4277 120.7618 61.4294 34.1147 173.7037 200 V 4.8429 8.7286 128.4413 61.2018 34.0235 173.7137 201 C 5.0712 8.8261 124.6606 55.5434 43.8125 174.5915 202 S 3.5498 9.7228 120.7756 59.7524 60.0334 173.2308 203 G 3.9178 8.4158 103.9894 45.7568 0.0000 173.7719 204 K 4.7231 7.5755 118.1250 53.0786 34.9202 175.4550 *209 L 4.2223 8.2738 123.5027 55.3599 41.9920 175.6896 210 Q 4.4369 8.7272 126.0127 57.0299 30.3914 175.8722 211 G 5.2914 8.0378 104.4871 45.7505 0.0000 171.4393 212 I 5.1111 8.1811 119.7954 58.8363 41.0446 175.3393 213 V 3.7849 8.7999 127.2739 63.9675 31.8004 174.1312 214 S 4.8467 8.4992 120.7571 58.6694 64.5021 174.3038 215 W 4.9308 7.4935 114.2882 56.6887 31.7914 171.9996 216 G 3.5240 8.1081 105.3180 46.1899 0.0000 173.3304 217 S 4.3162 8.0895 114.9125 56.5947 63.6099 174.0264 *219 G 4.2167 8.0359 115.9997 45.3760 0.0000 170.0334 220 C 4.8456 8.1612 114.9240 56.0910 43.1970 174.1357 221 A 3.7724 8.9946 127.3249 53.1940 16.7838 176.6700 221A Q 4.6049 7.2922 115.4575 55.8627 30.0638 175.9848 222 K 4.2031 8.4657 122.0951 58.1381 32.6234 176.2863 223 N 4.2792 9.1825 121.5165 53.9535 36.9588 175.3020 224 K 4.4020 7.6248 117.2800 53.6779 32.3162 173.8867 225 P 4.6252 0.0000 0.0000 62.0472 33.1170 177.2232 226 G 3.6454 8.5036 106.8851 46.1036 0.0000 172.6985 227 V 4.3839 7.7566 121.6419 60.7336 33.9363 174.1869 228 Y 4.8743 8.2675 124.0629 56.0139 42.4037 174.8515 229 T 4.3451 8.5698 119.5512 63.5588 69.9825 174.5423 230 K 5.1872 9.3134 128.3794 55.3041 30.9336 177.0727 231 V 3.9369 8.8432 125.5870 65.9339 31.4097 174.8315 232 C 4.3490 8.3483 112.4841 58.2177 41.5155 174.7418 233 N 4.3050 8.0774 116.9821 54.2717 38.6021 175.5039 234 Y 4.8064 8.0141 117.7819 57.2977 38.9722 177.1737 235 V 3.6710 7.9380 121.2583 66.2650 31.5743 177.7079 236 S 4.0971 8.1120 112.1029 61.1833 62.2510 175.7171 237 W 4.1714 8.3263 130.5136 60.4656 30.4682 177.6756 238 I 3.1967 8.5347 120.0264 64.2656 36.6328 178.4657 239 K 3.7189 7.9389 119.0582 59.5975 31.9039 179.2860 240 Q 3.8448 7.9736 119.6504 59.2316 28.7002 178.3276 241 T 3.5107 7.3152 116.2598 66.4409 68.1214 176.4595 242 I 2.0921 7.0738 121.5195 63.7513 36.7305 178.3799 243 A 4.0866 7.4982 120.3120 53.8084 18.1312 178.6680 244 S 4.7382 7.1639 111.1685 58.0833 63.9425 174.0483 245 N 4.6347 7.8155 124.6089 54.4233 39.6623 174.2613 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 4.28 1.80 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 0.74 0.86 0.00 0.00 17 V 8.82 4.33 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 1.05 0.00 0.00 0.97 0.00 0.00 18 G 8.52 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 19 G 7.67 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.97 4.96 0.00 2.99 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 21 T 8.63 4.19 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 1.24 0.00 0.00 22 C 8.55 4.33 0.00 2.79 3.07 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 23 G 8.79 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 24 A 8.63 4.16 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 25 N 8.88 4.27 0.00 2.87 2.91 0.00 0.00 7.21 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 7.74 4.16 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 1.24 0.00 0.00 27 V 7.07 4.10 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.50 0.00 2.39 2.46 0.00 3.82 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.98 0.00 29 Y 6.92 5.04 0.00 3.26 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 0.00 30 Q 7.37 4.63 0.00 1.77 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.74 0.00 0.00 0.00 0.00 0.00 1.80 2.42 0.00 31 V 8.99 4.91 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.02 0.00 0.00 32 S 8.72 5.03 0.00 3.19 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.62 4.61 0.00 0.56 1.04 0.74 0.30 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 8.87 5.70 0.00 2.41 2.47 0.00 0.00 6.66 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 8.43 4.19 0.00 3.51 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 38 G 9.55 4.05 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 0.00 39 Y 6.76 4.44 0.00 3.06 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 40 H 8.93 4.61 0.00 2.90 3.20 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.73 4.91 0.00 3.10 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.48 4.61 0.00 1.89 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.78 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.16 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.87 5.46 0.00 3.81 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 46 L 9.29 4.85 0.00 1.86 1.68 1.10 0.77 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 47 I 8.61 4.50 1.90 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 1.42 0.92 0.95 0.00 0.00 48 N 7.72 4.93 0.00 2.79 2.87 0.00 0.00 6.95 7.14 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 49 S 8.81 4.32 0.00 4.23 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 50 Q 8.85 4.64 0.00 2.05 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 51 W 8.38 5.53 0.00 3.27 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 9.10 5.04 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 1.04 0.00 0.00 0.98 0.00 0.00 53 V 9.01 4.88 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 1.04 0.00 0.00 1.01 0.00 0.00 54 S 9.06 4.79 0.00 3.87 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 55 A 8.47 4.65 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 56 A 8.41 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.03 4.47 0.00 3.35 3.52 0.00 5.52 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.68 4.76 0.00 3.19 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 59 Y 7.75 4.19 0.00 3.02 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.22 4.22 0.00 1.33 1.19 0.00 0.61 0.00 0.00 0.81 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.95 0.98 7.81 61 S 8.09 4.23 0.00 3.90 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 8.40 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 0.00 0.00 0.00 63 I 7.51 4.09 1.81 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.61 0.89 0.00 0.00 64 Q 8.96 4.75 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 65 V 8.88 4.42 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 0.97 0.00 0.00 0.88 0.00 0.00 66 R 8.93 5.05 0.00 1.51 1.84 0.00 2.62 0.00 0.00 2.42 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.13 0.00 67 L 9.04 4.76 0.00 1.67 1.63 1.05 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 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 70 E 8.19 4.51 0.00 2.09 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 2.36 2.09 0.00 71 D 7.81 4.77 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.86 4.79 0.00 2.84 2.83 0.00 0.00 7.06 7.09 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 73 I 8.68 3.59 0.87 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.41 0.72 0.00 0.00 74 N 8.43 4.83 0.00 2.86 2.82 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 7.41 4.37 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 0.77 0.00 0.00 0.95 0.00 0.00 76 V 8.46 4.03 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 0.81 0.00 0.00 0.95 0.00 0.00 77 E 9.98 4.39 0.00 1.95 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 2.28 2.45 0.00 78 G 8.52 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.05 4.90 0.00 2.74 2.80 0.00 0.00 7.15 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 7.78 4.55 0.00 1.52 1.83 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 2.73 2.45 0.00 81 Q 9.00 4.33 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 82 F 8.83 5.47 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 83 I 8.81 4.65 1.87 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 1.24 0.70 0.94 0.00 0.00 84 S 8.69 4.71 0.00 3.75 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.53 4.58 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 8.95 4.58 0.00 3.74 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 87 K 7.55 4.64 0.00 1.56 1.73 0.00 1.65 0.00 0.00 1.91 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.41 7.81 88 S 8.80 5.01 0.00 3.91 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 89 I 9.18 4.39 2.07 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 1.26 0.96 1.10 0.00 0.00 90 V 8.35 4.26 2.03 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 0.65 0.00 0.00 0.85 0.00 0.00 91 H 8.76 4.02 0.00 2.95 3.09 0.00 5.65 0.00 0.00 0.00 0.00 6.68 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 2.23 2.24 0.00 2.93 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 1.75 2.03 0.00 93 S 7.98 4.67 0.00 3.92 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 94 Y 7.91 4.27 0.00 2.95 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 95 N 8.11 4.46 0.00 2.57 2.42 0.00 0.00 6.62 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.03 3.87 0.00 3.97 3.88 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 97 N 8.07 4.52 0.00 2.74 2.78 0.00 0.00 6.96 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 98 T 8.20 3.90 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 99 L 7.85 3.73 0.00 1.56 1.82 0.09 1.21 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 0.00 100 N 7.59 4.43 0.00 2.72 2.63 0.00 0.00 7.22 7.02 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 0.00 101 N 8.68 4.79 0.00 2.93 2.62 0.00 0.00 7.24 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 7.98 4.73 0.00 3.11 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.14 4.84 1.48 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 1.37 1.41 0.21 0.00 0.00 104 M 9.28 5.45 0.00 2.23 1.84 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.64 0.00 105 L 9.36 5.39 0.00 1.76 1.84 0.14 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.16 4.97 1.90 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 1.16 0.88 0.89 0.00 0.00 107 K 8.64 3.41 0.00 0.79 1.03 0.00 1.46 0.00 0.00 1.40 0.00 0.00 2.68 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.79 0.21 7.81 108 L 8.03 4.43 0.00 1.42 1.55 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.90 4.13 0.00 1.88 1.79 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.35 7.81 110 S 7.72 4.65 0.00 3.93 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 0.00 111 A 8.39 4.38 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 0.00 112 A 9.00 4.23 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.10 4.47 0.00 3.76 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 0.00 114 L 8.29 4.59 0.00 1.65 1.71 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.73 4.35 0.00 2.65 2.70 0.00 0.00 7.23 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 0.00 116 S 8.41 4.13 0.00 4.06 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 0.00 117 R 7.53 4.10 0.00 1.93 1.97 0.00 3.13 0.00 0.00 3.28 7.35 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.42 0.00 4.00 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 0.00 128 C 8.45 4.42 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 8.02 4.52 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 8.08 4.36 0.00 3.97 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.18 4.22 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 9.08 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 0.00 134 T 7.54 3.93 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 135 Q 8.62 4.53 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 136 C 9.28 5.25 0.00 2.80 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 0.00 137 L 9.16 5.17 0.00 1.75 1.57 1.01 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.15 5.34 1.86 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.69 1.01 0.00 0.00 139 S 8.74 4.92 0.00 3.53 3.57 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 0.00 0.00 0.00 140 G 7.23 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.54 4.56 0.00 3.14 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 0.00 142 G 8.46 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 0.00 143 N 8.85 4.15 0.00 2.66 2.77 0.00 0.00 7.10 8.00 0.00 0.00 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 8.32 5.07 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 1.28 0.00 0.00 145 K 7.85 4.62 0.00 1.78 1.85 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.26 1.27 7.81 146 S 8.63 4.30 0.00 4.09 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.00 4.34 0.00 3.93 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 0.00 148 G 9.41 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 0.00 0.00 0.00 149 T 7.87 4.62 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 1.22 0.00 0.00 150 S 8.93 4.20 0.00 3.78 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.35 5.02 0.00 3.00 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 4.60 0.00 2.48 2.11 0.00 4.15 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.07 0.00 153 D 8.85 4.54 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 0.00 154 V 7.41 5.42 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 0.85 0.00 0.00 0.98 0.00 0.00 155 L 8.68 3.17 0.00 1.31 1.26 -0.82 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.15 4.83 0.00 1.69 1.51 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.49 7.81 157 C 8.78 5.17 0.00 1.66 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.45 4.94 0.00 1.69 1.43 1.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.98 5.16 0.00 1.82 1.84 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.66 1.49 7.81 160 A 8.97 4.90 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 0.00 161 P 0.00 5.04 0.00 1.99 2.04 0.00 3.00 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.56 0.00 162 I 8.33 4.32 1.72 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.65 0.67 0.00 0.00 163 L 8.70 5.03 0.00 1.53 1.58 0.93 0.73 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 0.00 164 S 8.42 4.28 0.00 4.00 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 8.79 4.37 0.00 2.85 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 0.00 166 S 8.06 4.10 0.00 3.94 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 0.00 167 S 8.24 4.17 0.00 4.10 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.40 4.32 0.00 3.26 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 0.00 169 K 8.41 3.94 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.54 1.70 7.81 170 S 7.82 4.24 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 0.00 171 A 7.93 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.90 4.77 0.00 3.22 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.52 0.00 2.08 2.06 0.00 3.93 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 174 G 9.05 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.14 4.53 0.00 2.50 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.23 6.68 0.00 0.00 0.00 0.00 0.00 2.26 2.59 0.00 176 I 7.92 4.36 1.99 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.97 1.02 0.00 0.00 177 T 8.27 4.51 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 0.00 178 S 8.55 4.36 0.00 4.01 4.05 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 0.00 179 N 8.17 5.03 0.00 3.05 3.11 0.00 0.00 6.61 8.23 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 0.00 180 M 7.94 5.59 0.00 1.89 2.02 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 181 F 8.76 5.12 0.00 3.07 3.14 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 0.00 182 C 9.05 5.38 0.00 3.00 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 0.00 183 A 8.94 5.03 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 0.00 184 G 7.05 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 0.00 0.00 0.00 184A Y 8.50 4.67 0.00 3.04 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 0.00 185 L 8.67 4.15 0.00 1.74 1.73 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.20 4.10 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 187 G 7.51 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 0.00 188 G 9.52 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 188A K 7.31 4.92 0.00 1.66 1.78 0.00 0.84 0.00 0.00 1.37 0.00 0.00 2.59 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.42 1.24 7.81 189 D 8.79 4.64 0.00 2.79 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 8.80 5.00 0.00 4.00 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 0.00 191 C 9.77 4.80 0.00 2.92 3.14 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 0.00 192 Q 8.73 4.20 0.00 2.35 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.82 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 193 G 9.08 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.60 4.68 0.00 2.93 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 8.07 4.47 0.00 3.98 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 8.93 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 0.00 197 G 7.82 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 5.23 0.00 2.34 2.38 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 199 V 8.43 4.46 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.55 0.00 0.00 200 V 8.73 4.84 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 0.86 0.00 0.00 0.68 0.00 0.00 201 C 8.83 5.07 0.00 2.79 2.86 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 0.00 202 S 9.72 3.55 0.00 3.96 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.42 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 7.58 4.72 0.00 1.82 1.63 0.00 1.91 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 8.27 4.22 0.00 1.50 1.65 0.99 0.78 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 8.73 4.44 0.00 2.02 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 2.46 2.36 0.00 211 G 8.04 5.29 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 0.00 212 I 8.18 5.11 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.82 0.92 0.00 0.00 213 V 8.80 3.78 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 0.93 0.00 0.00 1.24 0.00 0.00 214 S 8.50 4.85 0.00 3.90 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 0.00 215 W 7.49 4.93 0.00 3.35 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 0.00 216 G 8.11 3.52 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 0.00 0.00 0.00 217 S 8.09 4.32 0.00 4.20 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 8.04 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.16 4.85 0.00 2.97 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 0.00 221 A 8.99 3.77 1.42 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 221A Q 7.29 4.60 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 222 K 8.47 4.20 0.00 1.72 1.73 0.00 1.92 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.63 7.81 223 N 9.18 4.28 0.00 2.83 2.84 0.00 0.00 6.77 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 0.00 224 K 7.62 4.40 0.00 1.89 1.84 0.00 1.75 0.00 0.00 1.95 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.49 7.81 225 P 0.00 4.63 0.00 2.14 2.11 0.00 3.63 0.00 0.00 3.63 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 8.50 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 0.00 227 V 7.76 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 0.36 0.00 0.00 -0.75 0.00 0.00 228 Y 8.27 4.87 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.57 4.35 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 230 K 9.31 5.19 0.00 2.13 1.93 0.00 1.83 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.66 7.81 231 V 8.84 3.94 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 1.24 0.00 0.00 1.15 0.00 0.00 232 C 8.35 4.35 0.00 3.17 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.08 4.30 0.00 2.42 2.44 0.00 0.00 6.81 7.62 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 0.00 234 Y 8.01 4.81 0.00 3.23 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 0.00 235 V 7.94 3.67 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 1.05 0.00 0.00 1.07 0.00 0.00 236 S 8.11 4.10 0.00 3.97 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 0.00 237 W 8.33 4.17 0.00 3.55 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 8.53 3.20 2.04 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 1.71 1.02 0.80 0.00 0.00 239 K 7.94 3.72 0.00 1.74 1.77 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.53 7.81 240 Q 7.97 3.84 0.00 2.17 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 241 T 7.32 3.51 3.21 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 0.74 0.00 0.00 242 I 7.07 2.09 1.31 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.23 -0.06 0.00 0.00 243 A 7.50 4.09 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 0.00 244 S 7.16 4.74 0.00 3.98 3.88 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 0.00 245 N 7.82 4.63 0.00 3.05 3.03 0.00 0.00 6.70 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.