NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.2922 8.2549 120.8631 55.8662 30.1046 172.6965 5 K 4.8086 8.3351 121.4239 53.2014 34.7708 169.9475 6 V 4.5580 9.4060 127.1631 60.9588 34.6469 173.6842 7 A 5.7098 9.0465 128.9747 49.3658 21.3051 174.9182 8 R 4.8430 8.5617 117.6858 55.0873 33.8305 173.9870 9 I 4.4510 8.4934 119.8291 61.3273 37.6789 176.0512 10 L 4.7439 8.6846 126.5658 53.3280 43.6410 176.1968 *12 A 4.1087 8.2871 123.5759 51.3975 19.8499 176.0616 13 P 4.2831 0.0000 0.0000 65.6322 31.5730 178.7937 14 N 4.4526 8.1170 115.1697 55.6301 37.3936 177.1211 15 E 4.0701 8.1077 120.9096 59.4052 29.7414 179.1537 16 R 3.9908 8.0293 118.0889 59.1573 29.9915 178.7847 17 D 4.3898 8.0361 118.6601 56.9869 40.6863 178.6000 18 A 4.0145 7.9817 120.8743 54.9079 18.4138 179.5055 19 A 3.8933 8.0712 119.3912 54.9554 18.4239 179.7942 20 R 3.8408 7.8565 117.4251 59.3377 30.1081 178.9100 21 R 3.9473 7.6926 117.9815 59.0137 30.1499 178.9780 22 I 3.6703 7.4787 119.9522 64.2066 37.0453 178.6113 23 V 3.2355 7.4274 118.6972 65.8646 31.1378 178.1454 24 R 3.8879 7.7502 118.4189 59.4184 29.3895 178.7080 25 T 3.9489 7.9919 115.8159 66.8194 68.3881 177.1115 26 T 3.9512 7.7958 117.3220 66.8567 68.5010 176.6009 27 Y 4.2811 8.2644 118.8117 61.1376 37.9849 178.2290 28 E 4.2356 8.2025 119.4091 59.0485 29.3153 179.1141 29 A 4.1222 7.5750 119.7441 54.3461 18.5780 178.6371 30 Q 4.1275 7.4128 114.0057 55.1868 29.0495 176.5157 31 G 3.8189 7.1491 106.7969 46.0352 0.0000 173.5668 32 Y 4.7462 7.9514 116.5456 57.5122 38.9277 174.7813 33 A 4.7913 9.2859 123.6760 50.6914 21.4474 176.0534 34 I 4.5665 8.4353 122.8285 59.8272 38.4331 174.8371 35 D 5.0319 8.7152 125.8475 52.1848 44.1508 176.1643 36 E 4.1146 8.5713 122.5643 57.7958 29.5397 179.1514 37 S 4.1572 8.0138 115.2389 60.7929 63.1772 176.5686 38 F 4.4395 7.6976 121.5201 60.6257 38.6954 177.3945 39 A 4.1115 8.1926 119.9298 55.6174 17.9493 179.6681 40 T 3.9312 7.6498 112.9678 66.7110 68.7825 176.7039 41 F 4.4685 7.8933 119.4242 60.5323 38.7996 177.6391 42 L 4.2476 8.0194 116.8553 56.7173 41.5781 178.1931 43 E 4.5295 7.6742 115.4884 55.5645 29.9675 176.5158 44 G 3.9557 7.3508 109.0936 44.3364 0.0000 173.2266 45 P 4.4160 0.0000 0.0000 64.5904 31.6730 177.7754 46 S 4.5085 8.1745 111.2773 58.3086 63.6871 173.0758 47 A 5.2703 7.3642 121.5280 51.0129 21.5943 176.3739 48 T 4.4749 8.5791 114.7850 62.2325 73.4643 173.2528 49 T 4.7526 8.1430 121.5645 61.7156 71.6251 173.1320 50 F 5.3403 9.1372 124.7533 55.7554 42.5438 174.7886 51 G 4.3052 9.1243 107.5962 44.3011 0.0000 171.0016 52 L 5.1882 8.3219 122.5159 52.8591 45.0632 175.1469 53 F 5.4929 9.5732 124.6332 56.1055 41.7471 175.4807 54 N 4.3934 9.3810 121.1912 54.6308 40.1898 175.6617 *57 V 3.9747 7.4187 110.7353 60.6314 32.7591 174.2595 58 L 4.1617 8.8292 127.0375 55.2324 42.2334 175.7357 59 Y 4.7655 8.8465 123.0271 56.2841 39.7884 175.1298 60 G 4.0943 6.8700 106.6569 45.0400 0.0000 171.3309 61 T 5.1495 8.6397 114.9836 61.0135 71.5745 172.0577 62 I 5.1218 8.3719 123.3356 61.0962 42.1203 173.2678 63 S 5.1574 9.1404 121.0740 57.1495 67.9987 172.9174 64 I 4.9856 8.7570 121.8718 59.3883 41.3990 173.8663 65 I 4.9074 8.5326 129.6382 59.5367 39.6255 175.1011 66 N 4.9675 9.2105 125.2237 52.8386 39.5167 175.2216 67 D 4.3949 8.7714 121.4433 55.0101 41.5864 177.1133 68 G 3.7630 8.9365 121.2759 46.6868 0.0000 174.3631 *70 Q 4.2939 9.2693 124.4319 54.4076 32.0228 177.0733 71 G 4.1680 8.1208 105.5281 45.4709 0.0000 173.8286 72 L 4.4681 8.4502 121.9820 51.9550 45.6605 175.6018 73 P 4.4744 0.0000 0.0000 65.9542 31.6260 178.8208 74 M 4.1350 8.2196 117.3613 57.8537 31.4334 178.0721 75 D 4.4276 8.0765 119.7065 57.5503 40.7834 178.8112 76 S 4.0224 7.4971 113.5160 61.2469 62.6904 174.5275 77 I 4.0911 7.0207 118.9545 61.9244 38.8986 176.8274 78 Y 4.7732 8.1574 116.1321 58.3025 39.2176 178.3496 79 A 4.0324 7.9642 123.6968 55.4410 18.4734 179.9457 80 V 3.5099 7.6678 115.4018 65.9994 31.7497 176.8281 81 E 4.0232 8.0668 116.9239 57.6975 29.7247 177.5411 82 L 4.3138 7.4171 116.8312 54.9397 42.7193 178.1342 83 A 4.0081 7.5460 121.4209 55.0620 17.9839 179.4986 84 A 4.0284 7.6349 118.1568 55.1028 18.5928 178.9100 85 W 4.6301 7.6123 116.6142 59.9764 29.3553 178.2088 86 R 4.2144 8.2424 116.3112 58.6774 29.7446 176.6977 87 G 3.8932 7.4571 105.0887 45.6851 0.0000 173.3024 *91 K 4.1406 7.9728 120.6197 55.9524 33.7740 174.3219 92 L 5.2086 8.5023 125.6199 53.2533 46.0374 175.0845 93 A 5.0913 8.6428 120.5390 50.7682 23.3750 174.8150 94 E 4.9935 9.0380 122.1219 54.1940 32.1495 175.4440 95 V 4.4288 8.3570 128.0306 63.0922 32.4298 175.4328 96 V 4.3696 9.4195 125.5088 60.6433 34.6903 173.3806 97 Q 3.3195 8.1191 118.3460 57.0010 25.7346 173.7088 98 F 5.5101 7.9677 118.2359 56.8738 41.0257 175.5474 99 A 4.3825 8.3510 126.8946 50.6437 22.7299 174.5602 100 M 4.9671 8.2054 119.2593 53.3624 36.1603 174.3297 101 D 4.9978 8.6718 120.9871 52.8038 42.6966 175.9635 102 H 4.4492 9.1849 122.0294 58.4317 29.1340 176.1693 103 T 3.9238 7.2852 107.5648 62.1217 68.2847 174.9122 *114 S 3.5279 7.8464 118.2430 57.9356 62.9307 172.6641 115 P 4.3130 0.0000 0.0000 64.5122 31.2345 178.4116 116 F 4.7549 6.4513 111.3902 57.9553 38.2931 176.0069 117 E 4.2457 7.7720 120.1950 57.7726 29.6373 176.7138 118 A 4.5541 7.3513 122.5680 51.7165 19.7984 179.0890 119 A 4.0399 7.9126 125.1289 56.2308 18.3675 179.7681 120 S 4.1038 7.9572 112.3628 61.5150 62.8867 176.6451 121 L 3.9065 7.6112 122.2020 57.4959 41.5001 179.2144 122 F 4.5406 7.5751 117.6369 60.7302 38.7922 177.8316 123 T 3.7537 8.0394 115.4112 67.0255 68.4169 176.3728 124 M 3.8288 7.4835 119.8975 58.3533 31.8035 179.0956 125 V 3.4657 7.2140 118.2043 65.7282 31.7287 177.9444 126 L 3.7417 7.5797 119.8642 58.5356 41.5181 179.1468 127 T 3.8435 8.1611 116.0027 66.4781 68.2738 176.1830 128 Y 4.0522 7.9413 121.1729 60.6085 38.8601 177.6877 129 A 4.0596 8.0631 121.7952 55.0283 18.5729 179.6114 130 L 3.9283 7.9470 117.6579 57.6186 41.5089 179.1893 131 E 4.0278 7.5279 116.1938 58.5874 29.7418 177.6236 132 T 3.9086 7.4671 113.2505 63.4152 68.7663 174.3752 133 H 4.0573 7.2911 116.2086 56.4822 26.7024 175.0331 134 I 3.7515 7.4898 120.5417 61.7864 37.2362 175.9070 135 D 4.2482 8.4267 126.8991 56.5883 41.4396 175.2483 136 Y 4.9769 7.6517 114.5659 56.0645 41.0250 174.0055 137 L 4.7782 8.8262 126.9936 54.0579 43.3204 175.3159 138 C 5.1898 9.5974 125.4385 59.1330 30.7046 173.0201 139 I 4.7634 8.3348 120.2045 59.9200 41.7148 174.7400 140 S 4.7529 8.5180 119.6182 56.7318 64.9737 172.9205 141 I 4.7192 8.3978 118.0704 58.3208 41.4064 174.5711 142 N 4.7684 8.6959 121.7930 53.0831 38.9491 174.1158 143 P 4.3985 0.0000 0.0000 64.5507 31.7047 178.2769 144 K 4.1153 8.0274 116.9565 59.2704 32.9483 178.0690 145 H 4.9110 8.4841 115.6999 55.7651 28.9272 176.1623 146 D 4.5074 7.7496 120.8085 57.8822 40.8570 178.1227 147 T 3.9580 7.9845 111.7409 64.6200 67.5272 175.7057 148 F 4.3833 8.2612 123.0244 61.6390 39.6282 177.0096 149 Y 3.9803 8.0632 115.7696 60.5493 37.6306 178.1740 150 S 4.5051 8.0321 115.7574 61.2958 63.0145 176.3681 151 L 4.1407 7.7615 122.3337 56.6969 41.1119 178.1429 152 L 4.1468 7.4118 117.1842 54.6847 41.7375 177.4075 153 G 3.7432 7.9195 106.8276 45.3353 0.0000 173.8380 154 F 4.6543 7.8656 118.2194 56.7218 39.1545 175.5009 155 T 4.2667 8.9114 122.2208 63.0288 69.6370 174.3793 156 Q 4.5967 8.7918 127.7804 56.3650 29.2337 175.4841 157 I 4.4493 9.1209 118.4380 60.3056 39.3973 175.5539 158 G 4.1978 7.5916 108.6299 43.9945 0.0000 172.1143 159 A 4.3940 8.6682 123.3862 50.8025 19.9871 176.9278 160 L 4.3678 8.4235 121.0765 55.5132 42.3365 176.1548 161 K 4.7825 8.9766 125.3633 54.5187 36.9994 175.2372 162 H 4.6018 8.7541 122.4391 56.2928 30.8315 173.9536 163 Y 4.4868 8.8269 128.2781 56.5580 38.8052 176.3362 164 G 3.7440 9.1103 117.2319 48.8397 0.0000 174.1941 165 T 3.8166 7.8925 115.8783 65.6828 68.6382 175.1438 166 V 4.2546 7.2201 118.2470 60.9120 33.2195 174.3257 167 N 4.3199 7.9279 116.8247 53.8545 37.6336 172.7113 168 A 4.7415 6.9752 117.0284 50.1931 23.0807 175.5543 169 P 4.8823 0.0000 0.0000 62.9642 32.4718 175.8730 170 A 5.0380 9.0272 122.7316 50.7092 23.2731 175.1792 171 I 4.8788 8.8315 120.7147 59.3523 41.1435 174.5417 172 A 5.1860 7.6372 126.6805 50.0418 20.1199 176.4391 173 R 5.2070 8.2711 120.4914 54.6775 34.6109 174.5928 174 A 5.5609 9.6726 121.9256 50.6204 23.4844 174.8084 175 L 4.8017 8.8260 122.5117 53.1743 44.8644 175.0782 176 Y 4.5481 8.2637 126.8844 57.3333 38.3051 175.8163 177 V 3.5265 8.1982 127.8415 65.5240 31.5185 175.4095 178 P 4.1895 0.0000 0.0000 64.9382 31.3859 176.2567 179 E 4.5160 6.8783 115.1491 54.0845 29.7424 175.2845 180 W 4.3657 7.8241 119.5455 58.3715 29.3529 179.5025 181 R 3.6044 6.4771 113.8675 57.1950 29.3004 177.4653 182 S 4.1574 7.6381 112.5240 60.0527 63.4721 174.6791 183 Q 4.4069 7.3702 117.3004 55.9805 30.1259 175.4670 184 T 4.4420 7.4557 115.6335 61.8791 69.6349 175.5200 185 L 4.1660 7.9516 125.6935 56.5455 41.7564 177.5437 186 L 4.6473 7.8144 117.7361 54.6136 41.6207 176.7788 187 A 4.5046 7.1262 119.7808 52.3212 19.8338 178.6974 188 Q 4.0198 7.4162 113.4558 57.2783 29.1097 176.3237 189 F 5.0568 7.4898 116.3441 57.2733 39.1180 175.4980 190 M 4.3748 7.7114 124.2183 55.7632 30.8329 174.4025 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 4 R 8.25 4.29 0.00 1.80 1.96 0.00 3.16 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 5 K 8.34 4.81 0.00 1.81 1.83 0.00 1.92 0.00 0.00 1.83 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.51 7.81 6 V 9.41 4.56 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 0.94 0.00 0.00 0.98 0.00 0.00 7 A 9.05 5.71 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 8 R 8.56 4.84 0.00 1.95 2.12 0.00 2.96 0.00 0.00 3.32 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 9 I 8.49 4.45 1.89 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 1.59 0.65 0.72 0.00 0.00 10 L 8.68 4.74 0.00 1.52 1.60 0.88 1.07 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 *12 A 8.29 4.11 1.38 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 0.00 0.00 13 P 0.00 4.28 0.00 2.17 2.11 0.00 3.60 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 2.11 2.14 0.00 14 N 8.12 4.45 0.00 3.01 3.08 0.00 0.00 6.27 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 15 E 8.11 4.07 0.00 2.26 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 2.63 2.51 0.00 16 R 8.03 3.99 0.00 1.88 1.96 0.00 3.10 0.00 0.00 3.13 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 17 D 8.04 4.39 0.00 2.63 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 18 A 7.98 4.01 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 19 A 8.07 3.89 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 20 R 7.86 3.84 0.00 2.11 1.96 0.00 3.08 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 21 R 7.69 3.95 0.00 2.00 1.92 0.00 3.16 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 22 I 7.48 3.67 1.91 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.16 0.87 0.00 0.00 23 V 7.43 3.24 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 0.10 0.00 0.00 0.69 0.00 0.00 24 R 7.75 3.89 0.00 2.09 1.87 0.00 3.12 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 25 T 7.99 3.95 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 1.20 0.00 0.00 26 T 7.80 3.95 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 27 Y 8.26 4.28 0.00 3.11 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 28 E 8.20 4.24 0.00 2.14 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 2.35 2.38 0.00 29 A 7.57 4.12 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 30 Q 7.41 4.13 0.00 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.14 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 31 G 7.15 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 0.00 0.00 0.00 32 Y 7.95 4.75 0.00 2.82 2.59 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 33 A 9.29 4.79 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 34 I 8.44 4.57 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.75 0.96 0.00 0.00 35 D 8.72 5.03 0.00 2.74 2.41 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 36 E 8.57 4.11 0.00 2.04 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 2.40 2.37 0.00 37 S 8.01 4.16 0.00 3.87 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 38 F 7.70 4.44 0.00 3.24 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 39 A 8.19 4.11 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 40 T 7.65 3.93 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 1.09 0.00 0.00 41 F 7.89 4.47 0.00 3.51 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 42 L 8.02 4.25 0.00 1.71 1.75 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 43 E 7.67 4.53 0.00 1.99 1.99 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 2.30 2.49 0.00 44 G 7.35 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 45 P 0.00 4.42 0.00 2.09 2.16 0.00 3.72 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 46 S 8.17 4.51 0.00 4.21 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.36 5.27 1.31 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 48 T 8.58 4.47 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 0.59 0.00 0.00 49 T 8.14 4.75 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 1.15 0.00 0.00 50 F 9.14 5.34 0.00 3.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 9.12 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 52 L 8.32 5.19 0.00 1.37 0.73 0.95 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 53 F 9.57 5.49 0.00 3.08 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 N 9.38 4.39 0.00 2.23 2.64 0.00 0.00 7.20 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 *57 V 7.42 3.97 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 0.70 0.00 0.00 1.02 0.00 0.00 58 L 8.83 4.16 0.00 1.55 1.58 0.23 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.85 4.77 0.00 3.15 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 60 G 6.87 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 61 T 8.64 5.15 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 1.26 0.00 0.00 62 I 8.37 5.12 2.08 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 2.05 1.07 0.00 0.00 63 S 9.14 5.16 0.00 3.85 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 64 I 8.76 4.99 1.89 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.51 0.80 0.00 0.00 65 I 8.53 4.91 1.73 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.53 0.82 0.00 0.00 66 N 9.21 4.97 0.00 2.84 2.82 0.00 0.00 7.02 7.95 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 67 D 8.77 4.39 0.00 3.02 2.66 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 0.00 0.00 0.00 0.00 68 G 8.94 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 0.00 0.00 0.00 *70 Q 9.27 4.29 0.00 2.31 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.61 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 71 G 8.12 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.45 4.47 0.00 1.96 1.62 0.97 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.47 0.00 2.39 2.15 0.00 3.52 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.78 0.00 74 M 8.22 4.14 0.00 2.19 2.33 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.76 0.00 75 D 8.08 4.43 0.00 3.02 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 76 S 7.50 4.02 0.00 4.00 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 77 I 7.02 4.09 0.92 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.42 -0.23 0.00 0.00 78 Y 8.16 4.77 0.00 2.99 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 A 7.96 4.03 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.67 3.51 2.04 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 0.79 0.00 0.00 0.90 0.00 0.00 81 E 8.07 4.02 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.31 0.00 82 L 7.42 4.31 0.00 1.75 1.79 1.01 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.55 4.01 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 84 A 7.63 4.03 1.12 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 85 W 7.61 4.63 0.00 3.50 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 86 R 8.24 4.21 0.00 1.88 2.07 0.00 3.27 0.00 0.00 3.49 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.97 0.00 87 G 7.46 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 *91 K 7.97 4.14 0.00 1.90 1.88 0.00 1.67 0.00 0.00 1.92 0.00 0.00 2.80 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.52 7.81 92 L 8.50 5.21 0.00 1.69 1.62 1.16 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.64 5.09 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 94 E 9.04 4.99 0.00 2.04 1.77 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 2.20 2.35 0.00 95 V 8.36 4.43 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.96 0.00 0.00 96 V 9.42 4.37 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 0.64 0.00 0.00 0.99 0.00 0.00 97 Q 8.12 3.32 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.92 0.00 0.00 0.00 0.00 0.00 1.83 2.09 0.00 98 F 7.97 5.51 0.00 3.01 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 99 A 8.35 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 M 8.21 4.97 0.00 1.75 1.73 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.91 4.04 1.43 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 0.00 0.00 120 S 7.96 4.10 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 0.00 121 L 7.61 3.91 0.00 1.59 1.66 0.89 1.12 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 0.00 122 F 7.58 4.54 0.00 3.20 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 0.00 123 T 8.04 3.75 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 1.14 0.00 0.00 124 M 7.48 3.83 0.00 0.98 1.69 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.41 0.00 125 V 7.21 3.47 2.22 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 1.01 0.00 0.00 0.98 0.00 0.00 126 L 7.58 3.74 0.00 1.55 1.54 0.11 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 127 T 8.16 3.84 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 1.16 0.00 0.00 128 Y 7.94 4.05 0.00 3.30 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.06 4.06 1.38 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 0.00 0.00 130 L 7.95 3.93 0.00 1.63 1.66 0.76 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 131 E 7.53 4.03 0.00 1.89 1.85 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 2.25 2.40 0.00 132 T 7.47 3.91 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 1.01 0.00 0.00 133 H 7.29 4.06 0.00 3.34 3.30 0.00 5.66 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 I 7.49 3.75 1.98 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 1.35 0.46 0.92 0.00 0.00 135 D 8.43 4.25 0.00 2.65 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 144 K 8.03 4.12 0.00 1.82 1.93 0.00 1.57 0.00 0.00 1.86 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.05 7.81 145 H 8.48 4.91 0.00 3.55 3.64 0.00 5.63 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 7.75 4.51 0.00 2.91 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 0.00 147 T 7.98 3.96 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 148 F 8.26 4.38 0.00 3.17 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 0.00 149 Y 8.06 3.98 0.00 3.15 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 0.00 150 S 8.03 4.51 0.00 4.07 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 0.00 151 L 7.76 4.14 0.00 1.73 1.71 0.98 0.56 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 0.00 152 L 7.41 4.15 0.00 1.99 1.65 0.73 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 153 G 7.92 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 0.00 0.00 0.00 154 F 7.87 4.65 0.00 3.24 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 0.00 155 T 8.91 4.27 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 156 Q 8.79 4.60 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.85 0.00 0.00 0.00 0.00 0.00 2.49 2.33 0.00 157 I 9.12 4.45 1.59 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.75 1.04 0.00 0.00 158 G 7.59 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 0.00 159 A 8.67 4.39 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 L 8.42 4.37 0.00 1.69 1.66 0.96 0.54 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 0.00 161 K 8.98 4.78 0.00 1.57 1.48 0.00 1.42 0.00 0.00 1.46 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.36 7.81 162 H 8.75 4.60 0.00 3.18 3.22 0.00 5.72 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 Y 8.83 4.49 0.00 3.00 2.68 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 0.00 164 G 9.11 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 0.00 0.00 0.00 165 T 7.89 3.82 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 0.74 0.00 0.00 166 V 7.22 4.25 1.82 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 0.78 0.00 0.00 0.52 0.00 0.00 167 N 7.93 4.32 0.00 2.90 2.87 0.00 0.00 6.91 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 A 6.98 4.74 1.14 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 0.00 169 P 0.00 4.88 0.00 1.99 2.04 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 170 A 9.03 5.04 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 0.00 171 I 8.83 4.88 1.86 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 1.19 1.06 0.87 0.00 0.00 172 A 7.64 5.19 0.05 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 0.00 173 R 8.27 5.21 0.00 1.52 1.89 0.00 3.36 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 174 A 9.67 5.56 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 175 L 8.83 4.80 0.00 0.90 1.00 0.80 0.55 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 0.00 176 Y 8.26 4.55 0.00 3.09 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 V 8.20 3.53 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 0.66 0.00 0.00 0.89 0.00 0.00 178 P 0.00 4.19 0.00 1.19 1.78 0.00 2.20 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.73 0.00 179 E 6.88 4.52 0.00 1.92 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 180 W 7.82 4.37 0.00 3.46 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 0.00 181 R 6.48 3.60 0.00 1.34 0.88 0.00 2.37 0.00 0.00 2.51 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.91 0.00 182 S 7.64 4.16 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 0.00 183 Q 7.37 4.41 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.70 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 184 T 7.46 4.44 4.36 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 1.29 0.00 0.00 185 L 7.95 4.17 0.00 1.75 1.71 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 186 L 7.81 4.65 0.00 1.77 1.92 1.01 0.90 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 0.00 187 A 7.13 4.50 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 Q 7.42 4.02 0.00 1.51 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.49 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 189 F 7.49 5.06 0.00 3.08 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 0.00 190 M 7.71 4.37 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 * Residues marked with a * may have inaccurate shift predictions.