NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.3680 8.3349 115.2783 57.7239 64.1668 172.8372 7 H 5.2581 7.9120 115.0611 52.7926 32.1992 171.4065 8 I 4.8033 8.4839 113.9768 59.3376 41.5071 173.8897 9 T 5.1222 8.8908 114.3971 60.1500 71.2407 173.0490 10 I 5.5956 8.7009 125.9664 58.6777 40.6302 174.3433 11 L 5.2562 8.4096 126.4098 53.6109 45.8101 174.4946 12 T 5.1826 8.8757 120.2866 60.2611 70.2517 172.4727 13 L 4.7076 8.7228 129.7300 53.3046 45.8903 174.3581 14 N 4.7307 8.7165 125.2964 53.3645 38.8503 174.2020 15 I 3.8399 8.8168 127.0892 59.5566 39.0195 174.6536 16 N 4.2324 8.2491 118.7883 53.5484 37.6618 174.7100 17 G 3.8782 8.4071 103.7939 46.3139 0.0000 173.3914 18 L 4.7447 8.5101 121.5570 54.2547 43.0176 177.4321 19 N 4.4446 8.4203 118.6356 56.2371 38.7015 175.9735 20 S 4.4142 7.8599 111.4142 57.8888 64.4554 174.2704 21 A 4.4048 8.2501 121.7041 53.1522 19.2291 179.5105 22 I 3.6467 7.5943 117.4747 63.7361 38.0852 177.5424 23 K 3.8471 7.8274 120.1662 59.8304 32.1273 179.0514 24 R 3.8830 7.7366 118.2782 59.3949 29.9106 178.6346 25 H 4.2293 8.1559 117.7811 59.2045 29.8027 177.5744 26 R 4.0603 8.1487 120.0492 58.7348 29.8480 178.6133 27 L 3.8944 8.1884 120.3083 58.1952 42.0777 178.8018 28 A 3.9019 7.9723 120.8087 55.3309 18.3191 179.7424 29 S 4.1868 8.2441 112.5672 60.9142 63.2425 176.4570 30 W 4.1173 8.5380 132.3592 60.4283 30.4667 177.9348 31 I 3.3919 8.5712 120.0582 64.0962 36.2110 178.3074 32 K 3.9663 7.9401 118.5219 59.7799 32.0354 178.9413 33 S 4.2002 7.7175 113.4766 62.0970 62.9003 176.8174 34 Q 3.7085 7.5828 119.1009 56.5580 29.5956 176.1858 35 D 4.7038 8.0713 118.3792 54.6368 39.9236 171.0903 36 P 5.2695 0.0000 0.0000 61.9980 33.3857 177.4345 37 S 4.4108 9.2104 116.7234 61.3229 63.9047 174.4993 38 V 4.9956 7.8531 118.5315 61.1294 35.1185 173.5977 39 C 5.1482 9.2297 126.6573 58.0410 34.9154 172.0499 40 C 5.2605 9.4857 124.6994 58.2160 30.1931 172.9503 41 I 5.1008 8.7388 124.3365 59.5736 40.4882 174.7005 42 Q 4.8094 8.3454 124.0970 54.0381 32.8021 174.7364 43 E 3.6030 8.0296 117.2260 57.6909 26.6362 176.6023 44 T 3.6334 7.8420 111.1265 63.3592 69.3679 175.9061 45 H 4.0340 8.3591 116.7541 56.2725 26.8948 173.6996 46 L 4.4850 7.7098 119.2701 53.6474 42.5002 176.9736 47 T 4.4883 8.1050 112.3469 60.7890 69.6089 174.9234 48 C 4.2222 8.4136 121.2848 61.8660 31.6095 175.4137 49 R 4.0860 7.9131 118.8799 58.9751 30.1174 177.2982 50 D 4.7517 7.9205 116.7358 54.3571 41.1667 178.1221 51 T 3.8984 7.5829 112.9323 65.5208 68.2214 175.9091 52 H 4.2825 8.2201 116.9993 58.3886 28.9317 176.7794 53 R 3.9136 7.8276 117.4938 57.9795 29.9143 176.4886 54 L 4.3615 7.5267 119.5544 53.5127 41.0641 175.3568 55 K 4.6414 8.3034 124.4609 54.3534 35.4064 176.3079 56 I 4.4572 8.1074 122.5798 58.9256 39.8999 174.6680 57 K 4.0867 8.8097 127.4409 58.6420 32.2224 176.6687 58 G 4.0273 9.8027 114.9911 45.1905 0.0000 172.4111 59 W 4.9661 8.2232 118.8352 54.9644 29.5916 174.8527 60 R 4.0541 8.8083 117.4107 58.2524 30.1905 177.9442 61 K 4.0800 7.8661 118.5836 55.9663 32.7655 176.2976 62 I 4.8866 7.7415 125.4762 59.5352 40.7151 174.5233 63 Y 4.8418 8.9886 124.9936 56.3246 40.3942 174.9119 64 Q 5.1635 8.8592 121.4481 54.0293 33.0405 174.4743 65 A 4.6859 8.9790 124.2315 50.3978 21.5263 174.9400 66 N 5.2902 8.9245 118.7519 51.7548 42.3659 174.2305 67 G 4.1687 8.2877 106.8491 44.5374 0.0000 174.9143 68 K 4.2786 8.7685 118.6108 57.6341 32.1527 176.7750 69 Q 4.6384 7.6391 117.2085 53.9735 31.9869 175.4255 70 K 4.5948 8.4425 117.6465 54.9758 31.3657 176.3876 71 K 4.5915 6.9990 116.0128 55.7040 37.3240 178.1891 72 A 3.5954 9.4715 120.9780 55.5867 16.6658 177.7777 73 G 4.6128 9.4361 105.5134 48.6243 0.0000 172.3543 74 V 5.0891 8.7230 117.2445 59.5179 35.8795 174.7563 75 A 5.3487 8.9329 124.5070 50.3128 23.2131 174.8658 76 I 4.9343 9.1129 120.9252 59.5721 40.2696 174.6187 77 L 5.2115 9.1725 127.6588 52.9173 44.2528 175.6447 78 V 4.9590 8.7934 123.7840 60.9365 33.9312 175.3860 79 S 3.4063 8.9380 122.6817 57.5511 63.7250 175.1105 80 D 4.2132 8.1727 122.4827 57.3046 40.6808 178.1558 81 K 4.0797 7.1312 115.1906 57.6049 32.4698 176.8497 82 T 4.2160 7.5379 116.9276 62.3727 69.0828 174.2574 83 D 4.6621 8.5866 126.9908 53.4622 41.5155 173.6739 84 F 5.1450 8.7267 127.4775 56.1226 41.8139 174.3324 85 K 4.4347 8.2002 126.2018 53.7998 33.7680 173.9450 86 P 4.4974 0.0000 0.0000 62.7730 31.6666 176.1943 87 T 4.5128 8.7429 111.9608 62.0571 71.2438 174.2198 88 K 4.6283 7.6402 121.8730 55.1164 35.9566 174.6587 89 I 5.0271 8.3047 126.5296 59.6426 40.7092 174.6041 90 K 4.5831 9.2047 127.2688 54.7590 34.5242 175.3649 91 R 4.7279 8.4769 124.3447 54.2381 32.1549 175.8587 92 D 3.9455 8.0946 123.7866 53.6524 41.6109 176.8133 93 K 3.7816 8.9034 127.2775 59.5623 32.1572 176.9370 94 E 4.2694 8.4224 114.6742 56.1381 30.0759 176.6168 95 G 3.8372 8.0023 107.5588 46.4477 0.0000 174.4055 96 H 5.1157 8.3275 115.8566 55.6276 30.6176 173.7153 97 Y 5.4554 7.3739 115.3371 56.3150 41.2542 173.3019 98 I 5.1750 8.9398 120.3802 59.9657 42.1123 172.9960 99 M 5.3665 9.4064 129.4819 53.6928 35.0401 174.5339 100 V 4.8668 8.7646 124.9313 59.9333 34.7014 174.4991 101 K 5.0056 8.8512 124.8808 55.1233 34.9727 176.2234 102 G 3.7317 8.2883 108.6121 46.0401 0.0000 171.9081 103 S 5.2555 7.9457 113.4724 56.5193 66.8577 173.4157 104 I 4.8453 8.2730 122.0040 60.0094 39.0596 176.1287 105 Q 3.1444 9.7816 126.4312 57.1420 25.9877 174.7409 106 Q 3.9131 8.0785 113.8502 55.6216 27.9176 173.6297 107 E 4.5028 7.8002 119.6720 54.0779 30.7430 174.8774 108 E 4.5248 8.5055 126.1878 56.2883 30.5170 175.9438 109 L 4.9399 8.9102 124.2511 53.9284 46.2651 174.6195 110 T 5.1112 9.0669 122.5746 61.9274 71.5688 172.9373 111 I 4.8834 8.8600 127.9734 59.4239 40.0523 174.3822 112 L 5.0247 9.2091 130.5472 53.4893 43.9790 174.3588 113 N 5.3639 9.1702 126.5648 52.2405 40.9621 173.4284 114 I 5.1863 8.9671 126.1304 59.4964 41.7146 173.3074 115 Y 5.0213 9.3159 130.5268 55.7317 39.6587 174.7505 116 A 3.9913 8.7586 128.1293 50.1920 19.4197 175.3911 117 P 3.9615 0.0000 0.0000 62.3266 32.4134 177.4850 118 N 3.9831 8.2131 118.6429 56.3357 38.6568 175.1984 119 T 4.4962 6.9590 112.8961 62.6709 71.0490 174.3169 120 G 3.8691 8.8187 112.0743 46.7991 0.0000 175.3849 121 A 3.9900 8.1510 122.1520 54.7807 18.3651 178.6717 122 P 4.2723 0.0000 0.0000 65.9158 31.3617 178.5571 123 R 3.8791 7.9634 118.1045 59.0448 30.1107 178.0228 124 F 3.9969 8.3861 120.5422 61.3976 39.3333 177.1922 125 I 3.4499 7.9047 119.3846 64.1232 36.9865 178.3461 126 K 3.8094 7.8262 120.1105 59.4764 31.9131 178.6749 127 Q 3.8375 7.8521 119.8696 59.0704 28.8095 178.3609 128 V 3.1623 7.2242 119.3246 65.7262 31.2253 178.0733 129 L 3.8638 7.7298 118.1769 57.3148 41.5698 179.1832 130 S 4.1652 7.6917 113.0785 61.4597 62.1945 175.9008 131 D 4.4129 8.0743 120.4482 56.3630 40.6890 177.8070 132 L 4.5602 7.2391 117.5459 54.1965 41.5462 177.6302 133 Q 3.8664 7.6676 122.5443 59.5427 28.6149 179.2408 134 R 3.9125 7.9008 117.8972 59.2862 30.2637 176.9007 135 D 4.5711 8.0380 116.0757 55.6365 41.3342 176.9541 136 L 4.2970 7.2358 118.7010 54.6826 42.5248 176.5670 137 D 4.4337 8.2597 120.6618 53.0665 41.1804 175.7714 138 S 4.7174 8.5393 116.5886 58.8140 63.7238 173.3646 139 H 5.0911 7.9922 117.2699 55.9248 28.8769 173.0418 140 T 5.0474 8.1303 115.7930 63.5057 70.6642 174.3519 141 L 5.1877 9.3183 126.1955 52.9755 44.8762 175.3836 142 I 5.0368 9.1940 125.0085 59.9935 39.5663 174.6219 143 M 5.3965 10.4396 126.7867 53.3537 36.4172 177.0414 144 G 4.4167 7.7831 106.6704 45.3784 0.0000 171.6661 145 D 5.2582 8.3035 121.7943 53.0933 40.2554 177.7730 146 F 4.5400 9.4488 126.2107 57.8453 39.3720 176.3830 147 N 4.4607 8.4636 116.8476 53.5541 36.9261 173.7610 148 T 4.5494 7.3085 109.1867 60.2396 70.7828 171.1791 149 P 4.8588 0.0000 0.0000 63.0501 32.0938 175.7663 150 L 4.5117 9.1507 119.0723 55.2573 43.4620 176.8476 151 S 4.8944 7.8261 112.7149 56.1052 66.8252 174.8046 152 T 4.0686 8.4548 111.1885 65.0254 68.3867 176.3051 153 L 4.2264 7.8129 119.9095 56.6204 41.6915 177.5707 154 D 4.5790 8.1371 118.2541 55.7106 41.3182 175.9405 155 R 4.8566 7.8405 119.4628 53.8101 32.1915 177.3680 156 S 4.1940 8.7892 116.8497 61.2891 63.0078 175.3440 157 T 4.1283 7.8632 108.6301 61.3212 69.2272 174.9916 158 R 4.0896 7.9428 119.7409 57.0166 28.3424 176.1313 159 Q 4.1463 7.6718 118.0515 55.4430 29.5664 176.3707 160 K 4.1033 8.4033 122.3037 56.7374 33.1341 177.2242 161 V 3.7362 8.1902 114.9446 61.1349 32.1802 176.5008 162 N 4.5900 8.5557 121.5646 52.8494 39.1144 176.4023 163 K 3.9778 8.4717 119.9733 59.3811 32.1172 179.1139 164 D 4.3836 8.1713 118.9245 58.0376 40.7363 178.9778 165 T 3.9478 9.1932 113.8151 65.0590 67.3195 176.1387 166 Q 3.9898 8.4136 120.5069 59.0827 28.7748 178.9067 167 E 3.9748 8.3657 119.7260 59.1700 29.4083 179.0883 168 L 3.9302 7.9227 120.4370 58.2200 42.1995 178.7297 169 N 4.1932 8.3682 116.6017 56.3062 38.4680 177.4506 170 S 4.0789 8.0814 116.2192 61.6215 62.8448 176.6083 171 A 3.9865 7.8156 123.0018 55.2341 18.0945 179.6514 172 L 3.9535 8.1511 117.6778 58.3696 41.8003 179.5512 173 H 4.3413 8.1820 116.0886 58.8931 28.3448 177.8789 174 Q 4.0639 8.0609 119.1144 58.6587 28.5893 177.7399 175 A 4.2924 7.5234 118.6839 51.0550 19.4496 176.8166 176 D 4.3483 7.7574 117.5552 56.1635 39.1823 173.1568 177 L 5.4311 7.9985 116.9246 53.0322 44.4153 177.5084 178 I 4.7443 8.8645 115.5230 58.7800 41.9951 174.1460 179 D 4.6892 8.6822 122.5680 54.4692 41.2025 176.7263 180 I 3.7822 8.7125 129.1949 64.3426 37.1019 177.9855 181 Y 3.8888 8.0673 120.0077 60.7698 38.8359 177.7074 182 R 4.0259 8.2940 119.1231 59.4932 29.9044 178.6183 183 T 3.8488 7.7560 115.1716 66.5013 68.5753 176.2538 184 L 4.1773 7.6804 118.8233 55.9934 43.3037 177.2656 185 H 4.8201 7.6443 115.7968 53.2249 29.4963 171.9900 186 P 4.9425 0.0000 0.0000 64.7675 31.7865 177.8427 187 K 4.3659 7.8548 114.3899 56.0773 32.2296 176.7111 188 S 4.2872 7.8991 115.1363 59.0243 62.6413 174.2107 189 T 4.7385 8.1855 117.5191 61.3616 69.0683 173.9477 190 E 4.2436 7.8441 121.1598 57.1100 30.4644 175.5676 191 Y 4.9597 7.5370 117.8335 55.5380 41.1458 175.2136 192 T 4.6900 9.0042 108.1825 61.4416 70.9513 172.8520 193 Y 5.3320 8.0787 123.5168 56.0839 42.5958 173.4563 194 V 4.5220 7.6171 125.6308 60.9195 34.1437 174.5349 195 R 4.5138 8.3670 123.0769 54.4888 33.8185 173.6489 196 V 4.5533 8.1460 118.9800 61.5222 32.7870 175.0722 197 R 4.3195 8.7903 128.0049 55.4085 32.5034 174.6473 198 D 4.1892 9.4453 126.6448 55.6434 38.0116 174.5983 199 G 3.9130 8.2714 103.4711 46.0822 0.0000 172.7923 200 H 5.0289 7.5742 114.2905 53.0143 31.6108 173.0452 201 V 4.3690 8.2045 113.9823 61.3872 32.3677 175.9282 202 S 4.6478 9.2008 119.1915 56.6097 66.1218 172.6900 203 Q 4.8162 8.5260 122.0772 54.1014 30.8356 174.7892 204 S 4.6716 9.0547 117.0340 57.0254 67.4820 172.8866 205 K 4.9304 8.4003 121.9496 54.6172 32.5331 175.3437 206 I 4.6643 8.2737 117.5392 59.2074 39.2131 174.7726 207 D 5.3665 7.8009 122.2354 53.2431 42.9999 175.2485 208 H 4.7836 8.7262 118.6648 54.0401 33.9675 172.7065 209 I 4.4554 8.3166 121.0114 59.9719 39.1879 174.6241 210 V 4.7371 8.8086 128.1971 61.7282 33.9702 174.7986 211 G 4.3707 8.9317 112.3625 45.2378 0.0000 172.4545 212 S 4.7357 9.0203 117.1523 58.3631 63.0040 176.3214 213 K 3.8485 9.1060 125.4249 59.4506 31.7127 178.6768 214 A 4.0927 8.0009 119.3977 54.2319 18.6173 178.5001 215 L 4.2643 8.1176 117.3158 56.3109 41.8331 178.6257 216 L 4.0565 7.6191 119.7140 57.9800 41.3364 179.5981 217 S 4.1683 8.1395 111.7231 60.5523 63.1710 175.0025 218 K 4.2832 8.4318 119.5922 56.7103 32.6941 175.7734 219 C 4.8812 7.6745 117.6903 59.3847 28.8834 172.9271 220 K 4.8916 8.1756 134.1474 55.5497 32.9190 179.7756 221 R 4.1088 8.7971 126.5407 57.8452 30.0777 174.9787 222 T 5.8562 8.5794 118.1094 61.2878 72.1513 172.9465 223 E 4.9784 8.6283 119.4983 55.6773 32.8083 173.7268 224 I 4.6973 8.3353 122.3965 60.1151 39.2881 175.3407 225 I 4.5891 8.9516 127.1578 59.3933 39.8940 175.3132 226 T 4.4714 8.5177 117.7652 62.0021 69.6095 173.0634 227 N 4.5982 8.2154 118.7186 52.9568 39.7552 173.6380 228 Y 4.8777 8.1878 113.5134 57.9720 38.3197 176.9985 229 L 4.1272 7.5525 120.8533 56.7169 42.1888 176.2586 230 S 4.4900 7.2333 110.0198 57.6018 65.0053 174.1841 231 D 4.7033 8.5163 121.5482 55.3742 41.5862 175.6742 232 H 5.4625 8.2366 116.4682 54.4674 30.4757 174.9969 233 S 4.8086 9.0579 118.3456 57.7044 64.2933 173.9775 234 A 4.5841 8.6951 124.5219 51.6887 20.4208 176.2971 235 I 4.7935 8.3911 121.0465 59.4140 39.8652 174.6817 236 K 5.1100 9.0954 128.3395 54.5050 35.0321 174.4105 237 L 5.2430 9.2083 128.4912 53.2870 45.5824 174.2909 238 E 5.1554 9.5268 127.8240 54.4239 31.7180 174.3849 239 L 5.2731 8.6519 126.7832 53.4796 44.0574 176.5624 240 R 4.2836 8.9223 121.1890 56.8534 29.6452 176.0765 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 6 S 8.33 4.37 0.00 3.77 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 7 H 7.91 5.26 0.00 3.14 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.48 4.80 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.01 0.96 0.00 0.00 9 T 8.89 5.12 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 1.23 0.00 0.00 10 I 8.70 5.60 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.29 0.96 0.00 0.00 11 L 8.41 5.26 0.00 1.70 1.50 0.88 0.89 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 12 T 8.88 5.18 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 1.23 0.00 0.00 13 L 8.72 4.71 0.00 1.68 1.32 0.73 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.72 4.73 0.00 2.55 2.26 0.00 0.00 7.02 7.94 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 15 I 8.82 3.84 1.71 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.71 0.82 0.00 0.00 16 N 8.25 4.23 0.00 2.74 2.76 0.00 0.00 7.45 8.75 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 17 G 8.41 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 0.00 0.00 0.00 18 L 8.51 4.74 0.00 1.63 1.60 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.42 4.44 0.00 2.72 2.89 0.00 0.00 7.09 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 20 S 7.86 4.41 0.00 4.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.25 4.40 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 22 I 7.59 3.65 1.86 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 1.52 1.31 0.90 0.00 0.00 23 K 7.83 3.85 0.00 1.86 1.96 0.00 1.54 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.64 1.48 7.81 24 R 7.74 3.88 0.00 1.86 1.97 0.00 3.18 0.00 0.00 3.12 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.93 0.00 25 H 8.16 4.23 0.00 3.42 3.42 0.00 5.78 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 26 R 8.15 4.06 0.00 2.02 1.98 0.00 3.20 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 27 L 8.19 3.89 0.00 1.68 1.79 0.82 1.24 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 28 A 7.97 3.90 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 29 S 8.24 4.19 0.00 4.10 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 30 W 8.54 4.12 0.00 3.40 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 31 I 8.57 3.39 1.70 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.58 -0.52 0.00 0.00 32 K 7.94 3.97 0.00 1.92 1.92 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.66 1.74 7.81 33 S 7.72 4.20 0.00 3.68 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 34 Q 7.58 3.71 0.00 1.39 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.55 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 35 D 8.07 4.70 0.00 2.98 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 36 P 0.00 5.27 0.00 2.51 2.04 0.00 3.47 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.84 0.00 37 S 9.21 4.41 0.00 3.92 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 38 V 7.85 5.00 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 0.97 0.00 0.00 0.86 0.00 0.00 39 C 9.23 5.15 0.00 2.97 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 40 C 9.49 5.26 0.00 2.90 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 41 I 8.74 5.10 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.28 0.82 0.00 0.00 42 Q 8.35 4.81 0.00 1.74 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.29 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 43 E 8.03 3.60 0.00 1.92 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.47 0.00 44 T 7.84 3.63 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 45 H 8.36 4.03 0.00 3.37 3.39 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.71 4.49 0.00 1.63 1.59 0.97 0.96 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 47 T 8.10 4.49 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 1.21 0.00 0.00 48 C 8.41 4.22 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 49 R 7.91 4.09 0.00 1.79 1.96 0.00 3.29 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 50 D 7.92 4.75 0.00 2.91 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 51 T 7.58 3.90 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 1.35 0.00 0.00 52 H 8.22 4.28 0.00 3.13 3.41 0.00 5.72 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 R 7.83 3.91 0.00 2.14 2.00 0.00 3.16 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 54 L 7.53 4.36 0.00 1.61 1.61 0.90 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.30 4.64 0.00 1.74 1.67 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.35 7.81 56 I 8.11 4.46 1.99 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 1.30 1.06 0.94 0.00 0.00 57 K 8.81 4.09 0.00 1.77 1.83 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.48 7.81 58 G 9.80 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 59 W 8.22 4.97 0.00 3.45 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 60 R 8.81 4.05 0.00 1.93 2.05 0.00 3.05 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.57 0.00 61 K 7.87 4.08 0.00 1.74 1.76 0.00 1.78 0.00 0.00 2.15 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.48 7.81 62 I 7.74 4.89 1.78 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 1.36 0.62 0.89 0.00 0.00 63 Y 8.99 4.84 0.00 2.92 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 8.86 5.16 0.00 1.91 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 65 A 8.98 4.69 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 66 N 8.92 5.29 0.00 2.57 2.89 0.00 0.00 7.04 7.65 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 67 G 8.29 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 68 K 8.77 4.28 0.00 1.76 1.87 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 69 Q 7.64 4.64 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.61 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 70 K 8.44 4.59 0.00 1.69 1.83 0.00 1.62 0.00 0.00 0.61 0.00 0.00 3.13 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.43 7.81 71 K 7.00 4.59 0.00 1.81 1.70 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.29 1.42 7.81 72 A 9.47 3.60 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 73 G 9.44 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.72 5.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.99 0.00 0.00 75 A 8.93 5.35 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 9.11 4.93 2.07 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.88 0.96 0.00 0.00 77 L 9.17 5.21 0.00 1.67 1.74 0.94 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.79 4.96 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 0.74 0.00 0.00 0.66 0.00 0.00 79 S 8.94 3.41 0.00 2.72 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 80 D 8.17 4.21 0.00 2.43 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 81 K 7.13 4.08 0.00 1.65 1.77 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.17 7.81 82 T 7.54 4.22 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 83 D 8.59 4.66 0.00 2.82 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 8.73 5.14 0.00 3.06 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 85 K 8.20 4.43 0.00 1.53 1.55 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.29 7.81 86 P 0.00 4.50 0.00 2.01 2.11 0.00 3.62 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 2.00 2.15 0.00 87 T 8.74 4.51 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 1.11 0.00 0.00 88 K 7.64 4.63 0.00 1.80 1.62 0.00 1.66 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.47 7.81 89 I 8.30 5.03 1.87 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.40 0.93 0.00 0.00 90 K 9.20 4.58 0.00 1.80 1.80 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.42 7.81 91 R 8.48 4.73 0.00 1.66 1.79 0.00 3.23 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 92 D 8.09 3.95 0.00 1.58 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 0.00 0.00 0.00 0.00 93 K 8.90 3.78 0.00 1.74 1.85 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 94 E 8.42 4.27 0.00 2.33 2.06 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 2.31 2.32 0.00 95 G 8.00 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 0.00 0.00 0.00 96 H 8.33 5.12 0.00 3.60 3.59 0.00 5.86 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 7.37 5.46 0.00 3.18 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 98 I 8.94 5.18 1.91 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.77 1.00 0.00 0.00 99 M 9.41 5.37 0.00 2.17 1.96 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 2.52 2.49 0.00 100 V 8.76 4.87 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 0.70 0.00 0.00 0.84 0.00 0.00 101 K 8.85 5.01 0.00 1.70 1.75 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.40 7.81 102 G 8.29 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 0.00 0.00 0.00 103 S 7.95 5.26 0.00 3.87 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 0.00 104 I 8.27 4.85 1.96 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 1.62 1.99 0.98 0.00 0.00 105 Q 9.78 3.14 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 5.72 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 106 Q 8.08 3.91 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 107 E 7.80 4.50 0.00 2.07 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 0.00 2.24 2.30 0.00 108 E 8.51 4.52 0.00 1.70 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 2.24 2.22 0.00 109 L 8.91 4.94 0.00 1.78 1.59 1.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 110 T 9.07 5.11 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 111 I 8.86 4.88 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 1.17 1.00 0.97 0.00 0.00 112 L 9.21 5.02 0.00 1.72 1.56 0.95 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 113 N 9.17 5.36 0.00 2.96 2.87 0.00 0.00 6.16 8.77 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 0.00 114 I 8.97 5.19 1.85 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.44 0.72 0.00 0.00 115 Y 9.32 5.02 0.00 2.85 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 0.00 116 A 8.76 3.99 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 0.00 117 P 0.00 3.96 0.00 2.10 1.76 0.00 3.13 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.12 0.00 118 N 8.21 3.98 0.00 2.69 2.91 0.00 0.00 6.79 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 0.00 119 T 6.96 4.50 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 0.00 120 G 8.82 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 0.00 0.00 0.00 121 A 8.15 3.99 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.27 0.00 2.30 2.37 0.00 3.65 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 2.10 2.06 0.00 123 R 7.96 3.88 0.00 1.91 2.18 0.00 3.20 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 124 F 8.39 4.00 0.00 3.21 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 0.00 125 I 7.90 3.45 1.79 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.77 0.64 0.00 0.00 126 K 7.83 3.81 0.00 1.92 1.88 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.40 7.81 127 Q 7.85 3.84 0.00 2.20 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 128 V 7.22 3.16 1.72 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 0.21 0.00 0.00 0.06 0.00 0.00 129 L 7.73 3.86 0.00 1.71 1.62 0.88 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 130 S 7.69 4.17 0.00 3.85 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 0.00 131 D 8.07 4.41 0.00 2.52 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 0.00 132 L 7.24 4.56 0.00 1.53 1.55 0.60 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 133 Q 7.67 3.87 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 134 R 7.90 3.91 0.00 1.79 1.94 0.00 3.27 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 135 D 8.04 4.57 0.00 2.83 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 0.00 136 L 7.24 4.30 0.00 1.64 1.57 0.93 0.89 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 0.00 137 D 8.26 4.43 0.00 2.56 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 0.00 138 S 8.54 4.72 0.00 3.97 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 0.00 139 H 7.99 5.09 0.00 3.37 3.53 0.00 5.44 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 T 8.13 5.05 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 141 L 9.32 5.19 0.00 1.58 1.61 0.98 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 142 I 9.19 5.04 2.05 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 0.90 0.96 0.00 0.00 143 M 10.44 5.40 0.00 2.01 2.01 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 2.60 2.55 0.00 144 G 7.78 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 D 8.30 5.26 0.00 2.73 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 0.00 146 F 9.45 4.54 0.00 3.30 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 0.00 147 N 8.46 4.46 0.00 2.85 2.87 0.00 0.00 6.69 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 T 7.31 4.55 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 149 P 0.00 4.86 0.00 2.27 2.10 0.00 3.84 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 150 L 9.15 4.51 0.00 1.49 1.69 0.66 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 151 S 7.83 4.89 0.00 3.87 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 0.00 152 T 8.45 4.07 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 153 L 7.81 4.23 0.00 1.70 1.96 1.00 1.06 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 0.00 154 D 8.14 4.58 0.00 2.92 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 0.00 155 R 7.84 4.86 0.00 1.89 1.83 0.00 3.16 0.00 0.00 3.40 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.83 0.00 156 S 8.79 4.19 0.00 3.97 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 0.00 157 T 7.86 4.13 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 158 R 7.94 4.09 0.00 2.01 2.06 0.00 3.18 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 159 Q 7.67 4.15 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 160 K 8.40 4.10 0.00 1.91 1.82 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.48 7.81 161 V 8.19 3.74 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.95 0.00 0.00 162 N 8.56 4.59 0.00 3.00 2.98 0.00 0.00 6.25 7.77 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 0.00 163 K 8.47 3.98 0.00 1.83 1.90 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.53 7.81 164 D 8.17 4.38 0.00 2.95 2.75 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 0.00 165 T 9.19 3.95 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 1.33 0.00 0.00 166 Q 8.41 3.99 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 167 E 8.37 3.97 0.00 2.25 1.98 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 2.32 2.48 0.00 168 L 7.92 3.93 0.00 1.77 1.84 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 169 N 8.37 4.19 0.00 2.93 2.75 0.00 0.00 7.06 8.12 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 0.00 170 S 8.08 4.08 0.00 4.01 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 7.82 3.99 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 0.00 172 L 8.15 3.95 0.00 1.78 1.76 0.98 1.41 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 0.00 173 H 8.18 4.34 0.00 3.33 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 Q 8.06 4.06 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.22 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 175 A 7.52 4.29 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 0.00 176 D 7.76 4.35 0.00 2.85 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 L 8.00 5.43 0.00 1.63 1.60 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 178 I 8.86 4.74 1.89 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 1.12 1.40 0.90 0.00 0.00 179 D 8.68 4.69 0.00 2.77 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 0.00 180 I 8.71 3.78 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.80 0.95 0.00 0.00 181 Y 8.07 3.89 0.00 3.13 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 0.00 182 R 8.29 4.03 0.00 2.10 2.16 0.00 3.24 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 183 T 7.76 3.85 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 1.18 0.00 0.00 184 L 7.68 4.18 0.00 1.25 1.40 0.88 0.72 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 0.00 185 H 7.64 4.82 0.00 2.83 3.01 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 P 0.00 4.94 0.00 2.03 2.10 0.00 3.69 0.00 0.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.03 0.00 187 K 7.85 4.37 0.00 1.75 1.84 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.42 7.81 188 S 7.90 4.29 0.00 3.99 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 0.00 189 T 8.19 4.74 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 190 E 7.84 4.24 0.00 1.90 1.76 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 2.28 2.26 0.00 191 Y 7.54 4.96 0.00 3.08 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 T 9.00 4.69 4.26 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 1.08 0.00 0.00 193 Y 8.08 5.33 0.00 2.95 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 0.00 194 V 7.62 4.52 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 0.71 0.00 0.00 0.68 0.00 0.00 195 R 8.37 4.51 0.00 1.76 1.60 0.00 2.94 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.48 0.00 196 V 8.15 4.55 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 0.73 0.00 0.00 0.88 0.00 0.00 197 R 8.79 4.32 0.00 1.72 1.65 0.00 3.30 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 198 D 9.45 4.19 0.00 2.64 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 G 8.27 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 0.00 200 H 7.57 5.03 0.00 3.30 3.36 0.00 5.46 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 0.00 201 V 8.20 4.37 1.98 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 0.68 0.00 0.00 0.86 0.00 0.00 202 S 9.20 4.65 0.00 3.76 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 0.00 203 Q 8.53 4.82 0.00 1.61 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.83 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 204 S 9.05 4.67 0.00 3.91 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 0.00 205 K 8.40 4.93 0.00 1.92 1.95 0.00 1.52 0.00 0.00 1.91 0.00 0.00 2.64 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.28 7.81 206 I 8.27 4.66 1.97 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.19 0.97 0.00 0.00 207 D 7.80 5.37 0.00 2.58 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 0.00 208 H 8.73 4.78 0.00 1.58 2.67 0.00 5.56 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 0.00 209 I 8.32 4.46 1.96 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.75 0.99 0.00 0.00 210 V 8.81 4.74 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 1.08 0.00 0.00 0.99 0.00 0.00 211 G 8.93 4.37 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 S 9.02 4.74 0.00 3.81 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 0.00 213 K 9.11 3.85 0.00 1.84 1.98 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 214 A 8.00 4.09 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 0.00 215 L 8.12 4.26 0.00 1.91 1.75 1.02 0.85 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 0.00 216 L 7.62 4.06 0.00 1.83 1.75 0.91 0.64 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 0.00 217 S 8.14 4.17 0.00 3.98 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 0.00 218 K 8.43 4.28 0.00 1.88 1.91 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.53 7.81 219 C 7.67 4.88 0.00 2.90 2.89 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 0.00 220 K 8.18 4.89 0.00 1.67 1.12 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.28 7.81 221 R 8.80 4.11 0.00 2.07 2.07 0.00 2.89 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.67 0.00 222 T 8.58 5.86 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 223 E 8.63 4.98 0.00 2.01 2.06 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 2.30 2.28 0.00 224 I 8.34 4.70 1.73 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.00 0.77 0.00 0.00 225 I 8.95 4.59 2.08 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 1.31 0.99 1.07 0.00 0.00 226 T 8.52 4.47 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 1.12 0.00 0.00 227 N 8.22 4.60 0.00 2.49 2.74 0.00 0.00 5.96 7.55 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 0.00 228 Y 8.19 4.88 0.00 2.96 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 0.00 229 L 7.55 4.13 0.00 1.25 1.46 0.89 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 230 S 7.23 4.49 0.00 3.65 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 0.00 231 D 8.52 4.70 0.00 2.76 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 0.00 232 H 8.24 5.46 0.00 3.15 3.22 0.00 5.84 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 0.00 233 S 9.06 4.81 0.00 3.68 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 0.00 234 A 8.70 4.58 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 0.00 235 I 8.39 4.79 1.86 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.69 0.83 0.00 0.00 236 K 9.10 5.11 0.00 1.82 1.82 0.00 1.54 0.00 0.00 1.51 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.53 7.81 237 L 9.21 5.24 0.00 1.78 1.50 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 238 E 9.53 5.16 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 239 L 8.65 5.27 0.00 1.76 1.83 0.97 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 240 R 8.92 4.28 0.00 1.96 2.05 0.00 3.31 0.00 0.00 3.31 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00