NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4062 8.1927 115.2889 58.5695 64.7975 175.6540 3 Q 3.8043 7.9291 120.1894 58.6957 29.0980 176.1999 4 A 3.9699 8.8870 122.6006 55.5282 18.6298 178.7114 5 N 4.2899 8.0742 114.1944 56.3790 38.6789 177.2722 6 L 3.6911 7.4105 120.5780 58.1508 42.0437 178.8336 7 M 4.0150 8.0807 116.7748 57.7664 31.0694 178.6761 8 R 3.8108 7.8740 120.3617 59.0971 30.2351 177.8013 9 L 3.0962 7.6707 120.1894 57.9679 41.8604 179.1796 10 K 2.9088 7.2521 118.1973 59.1294 31.9351 179.5994 11 S 4.1657 7.5073 114.3272 61.3586 62.5878 176.3730 12 D 4.2687 7.8842 122.0814 57.2945 40.7004 178.4568 13 L 4.0294 7.5610 118.3972 57.0654 41.5713 178.7210 14 F 5.0364 7.6276 116.4854 57.8466 40.9282 176.0547 15 N 4.8312 7.8025 115.0012 51.3610 38.1020 172.9032 *20 Y 4.4581 7.5559 117.6077 56.9233 39.7156 172.2176 21 P 4.4052 0.0000 0.0000 62.8562 31.9581 177.0791 22 G 2.8851 5.9224 105.9716 44.4986 0.0000 172.0389 23 P 4.3462 0.0000 0.0000 62.4270 31.8802 175.2765 24 T 4.7725 7.7628 109.0170 59.3611 71.9079 174.1292 25 K 4.4665 8.5705 119.5729 59.2023 32.0463 178.6667 26 D 4.5082 7.9942 117.1927 56.4769 41.7727 176.0575 27 D 4.7492 7.6387 118.3848 51.7517 40.9150 172.0972 28 P 5.0979 0.0000 0.0000 62.2842 33.3906 176.6121 29 L 4.8283 8.8845 121.3965 53.6201 45.6718 174.8490 30 T 5.0671 8.6447 121.7079 61.9035 70.7067 173.7079 31 V 4.7733 8.8356 126.8044 61.5383 34.1668 174.3515 32 T 5.0708 9.0290 125.1320 62.5625 70.1141 173.7589 33 L 5.5641 8.5293 126.0295 52.1075 44.8966 176.3595 34 G 4.1976 8.0690 108.3849 44.7965 0.0000 171.1524 35 F 5.3143 9.5535 122.6890 55.7654 42.1465 174.8862 36 T 4.8850 8.4241 119.1916 61.6699 70.9365 173.0547 37 L 4.5540 8.4285 129.8947 54.7776 42.1766 176.2417 38 Q 4.3271 9.0897 126.2103 57.8734 30.7699 175.5509 39 D 4.2432 7.7278 114.5107 53.3001 44.7529 174.8831 40 I 4.6790 8.7072 127.4151 60.4668 37.0700 175.9138 41 V 3.9582 8.7838 128.6903 65.3600 32.0816 176.4218 42 K 4.9245 7.9890 119.9048 54.8769 35.9247 174.3607 43 A 4.7362 8.8952 127.9093 50.2928 21.4726 174.9974 44 D 4.8333 9.2115 124.3872 53.1521 42.2065 176.9389 45 S 4.6622 8.7729 120.5212 58.8566 63.8232 175.2816 46 S 4.3856 8.0916 115.8695 60.0606 63.2579 174.8697 47 T 4.3752 7.6129 107.5716 60.1277 70.5598 173.0105 48 N 4.2772 7.9693 119.2041 53.6485 36.5981 173.0771 49 E 5.0818 7.4524 116.4811 54.4031 34.3200 176.8995 50 V 4.7454 7.9862 122.3622 61.1038 35.3517 173.6885 51 D 5.6316 8.9899 126.7180 52.6826 43.2255 175.1869 52 L 5.2989 9.2523 123.7089 52.9431 45.2225 175.4626 53 V 4.9664 8.8303 123.0274 61.4737 33.8808 174.1008 54 Y 5.1771 8.2458 124.1428 56.6448 41.8251 172.7637 55 Y 5.1529 8.6577 117.5645 56.6651 40.8038 174.9580 56 E 4.2792 8.4461 123.9344 53.9041 30.5850 174.3372 57 Q 4.2071 8.7487 125.1969 55.7863 30.1698 175.1527 58 Q 5.2371 9.4164 123.6018 54.0665 32.4239 174.5237 59 R 5.2214 9.0682 124.0412 54.3600 33.5813 174.0924 60 W 5.5832 8.1889 121.2932 55.6177 32.3959 173.0220 61 K 4.9846 8.6865 120.3350 54.7677 34.9233 175.0311 62 L 4.6509 8.7919 126.7417 52.7997 44.8098 177.5868 63 N 4.3339 8.9440 121.3017 56.2905 38.7749 177.2886 64 S 4.2827 7.9572 111.2248 60.3983 63.1601 174.4718 65 L 4.7871 7.7745 120.5957 54.9038 42.5332 176.0364 66 M 4.7302 7.9237 119.0089 54.8773 32.9287 175.4807 67 W 5.2523 8.3348 118.0385 55.6432 32.3279 173.5219 68 D 4.7422 9.0395 120.0272 52.3883 41.2198 174.9075 69 P 4.8469 0.0000 0.0000 65.3125 31.1213 178.0486 70 N 4.3796 8.3908 114.1991 56.2956 38.9393 175.5889 71 E 4.2912 7.9679 117.3200 56.5279 30.2898 175.8815 72 Y 4.7118 7.2424 117.6760 57.5940 39.1768 175.2784 73 G 4.1232 8.8037 102.9650 46.9431 0.0000 173.4163 74 N 4.2675 8.5654 114.1829 54.0205 38.4139 173.8183 75 I 4.1501 7.7539 117.3980 61.0903 37.8254 176.7333 76 T 4.7750 8.7081 114.9698 62.5538 71.1790 173.4438 77 D 5.6914 8.1936 119.5832 52.9875 42.6240 174.2224 78 F 4.9794 8.6925 111.8110 55.9290 41.3522 173.6003 79 R 4.6853 8.7457 120.0212 56.5508 30.8993 175.7419 80 T 4.8293 9.0165 117.0150 60.2771 71.7514 172.9939 81 S 4.4383 8.8001 120.4238 58.2356 63.3157 175.2454 82 A 3.7220 8.7318 129.9125 54.9643 18.2461 179.7082 83 A 4.0253 7.7891 117.5792 54.9735 18.5508 178.1915 84 D 4.2797 7.8302 114.8252 55.6468 41.1063 176.0524 85 I 4.7845 7.2004 111.0836 58.0489 40.8083 174.7772 86 W 4.2952 8.9905 131.4044 57.5412 31.1643 175.3365 87 T 3.8202 7.0088 114.4219 58.3222 71.2370 171.8434 88 P 3.5478 0.0000 0.0000 62.5529 32.5716 176.1219 89 D 4.7322 8.2410 120.5702 53.0792 38.5363 176.5974 90 I 4.3686 7.5253 118.9754 62.6392 38.2488 177.5155 91 T 4.9687 9.4253 123.4650 61.4799 72.8940 173.1908 92 A 4.0203 8.7626 127.0918 51.9246 18.5352 177.0322 93 Y 4.4464 8.9254 125.2694 59.2699 39.8827 177.1048 94 S 4.7981 7.8042 114.0228 57.5253 63.7652 173.9460 95 S 4.8697 8.1308 114.8927 59.7304 63.6249 173.7492 96 T 4.4995 8.4065 111.0630 61.6725 69.9108 174.4063 97 R 4.7029 7.5237 119.5410 53.5785 34.2675 172.9429 98 P 4.3009 0.0000 0.0000 62.5420 31.9183 176.7056 99 V 3.9489 8.2838 122.0760 63.4365 32.4718 174.8991 100 Q 4.6274 8.7320 126.2186 54.1766 30.8929 174.7845 101 V 4.2973 8.4158 124.7040 62.4148 32.1708 175.4485 102 L 4.7978 8.9711 127.1975 54.5532 42.5427 176.0710 103 S 4.7602 7.7075 112.4866 55.4090 66.4881 172.1260 104 P 4.3001 0.0000 0.0000 63.6801 31.6808 177.1243 105 Q 4.8822 8.4596 121.3665 54.5077 28.3024 173.0466 106 I 4.9986 8.1750 121.0818 59.2306 41.1290 174.2754 107 A 4.9662 9.3755 128.1469 50.1593 22.8416 175.0137 108 V 4.5558 8.3623 118.5036 61.1635 34.3002 174.3468 109 V 4.5225 7.9236 128.0974 61.6215 33.4498 174.8766 110 T 5.0919 8.5416 124.5544 61.7355 71.1228 175.5210 111 H 2.0000 8.4369 119.3751 57.4422 28.3761 176.6832 112 D 4.2990 7.1890 117.5288 53.2876 39.3589 177.1018 113 G 3.9083 8.0966 109.1788 45.7111 0.0000 173.6020 114 S 4.6901 7.6412 115.1615 57.8623 64.8354 173.4640 115 V 4.5339 8.4642 121.9425 61.0996 34.6511 173.7544 116 M 5.0155 8.5002 126.0723 53.6605 35.6360 173.8958 117 F 5.2687 9.0634 127.0155 56.7563 43.1027 173.7105 118 I 4.4404 7.8572 125.9932 58.7523 37.1350 172.4138 119 P 4.1890 0.0000 0.0000 62.1806 33.3192 176.1802 120 A 4.9983 8.9643 125.1975 51.3599 20.6911 176.2558 121 Q 4.7874 8.5153 119.3395 54.1763 34.0826 173.7684 122 R 5.1143 8.9421 122.5936 54.6021 32.4957 174.4359 123 L 5.2140 9.1489 128.1676 53.4672 45.4497 174.9602 124 S 5.4911 8.8248 122.3844 57.5000 64.8407 173.1771 125 F 5.3731 8.9276 118.6667 55.0309 42.1179 173.6213 126 M 4.5396 8.7313 119.7059 55.6894 32.3423 175.8500 127 C 4.5323 8.6724 123.0889 55.7511 47.8478 172.4005 128 D 4.8079 8.7655 127.1790 52.6012 40.6249 173.6183 129 P 4.4926 0.0000 0.0000 63.2040 31.3941 176.1489 130 T 3.9841 7.8506 116.3093 66.0055 68.8768 174.5312 131 G 3.9579 8.9414 114.2382 44.9940 0.0000 175.4247 132 V 3.5679 7.7832 120.1082 64.1448 31.4622 176.5305 133 D 5.0157 7.9079 119.1284 53.4272 39.8652 175.6111 134 S 4.7742 7.7293 113.1400 56.8558 66.3555 174.1601 135 E 3.9097 8.9125 121.2353 59.1232 29.1887 177.5354 136 E 4.0522 7.5422 111.7200 56.0297 30.3242 177.3314 137 G 3.6399 7.5786 108.3280 44.6726 0.0000 172.2684 138 A 4.4827 7.9506 120.0562 50.7871 21.4077 176.6390 139 T 5.0808 8.0238 114.6284 62.2494 72.0993 174.3896 140 C 5.3402 9.6789 122.4694 55.4224 45.2940 172.8329 141 A 5.4430 8.6677 121.0552 50.6168 22.2232 176.0414 142 V 4.4579 8.5945 119.6808 60.1035 35.0493 173.7932 143 K 4.9994 8.5486 123.2089 55.2699 35.5551 174.9127 144 F 5.3073 8.6279 120.1134 56.0282 42.8748 174.4454 145 G 4.5253 8.9560 108.3334 45.5523 0.0000 172.3488 146 S 4.9257 8.9603 115.5106 58.2033 62.3697 173.9963 147 W 4.2221 9.1316 135.0000 60.0298 30.5923 177.1253 148 V 4.3307 8.1321 107.9157 61.0456 32.5430 174.9445 149 Y 4.6526 8.1616 118.8740 55.9746 39.2512 176.1021 150 S 2.9876 8.5404 120.0860 56.5339 64.2878 175.2204 151 G 3.5501 8.2463 109.5787 49.1602 0.0000 175.0049 152 F 4.4492 7.8384 118.2569 59.3623 39.5521 176.3678 153 E 4.6230 8.2779 118.5760 57.2469 32.2265 175.8892 154 I 4.8975 8.1057 120.7912 59.5223 40.1146 174.4578 155 D 4.9445 9.1151 127.1315 52.6949 43.7011 174.9182 156 L 5.5611 8.3385 122.0717 53.2064 45.3081 175.3455 157 K 4.7934 8.8730 119.0203 56.3413 36.3990 174.5204 158 T 5.0905 8.3980 110.0691 60.2851 71.1022 173.7074 159 D 4.6565 8.7654 121.2475 55.8191 41.8543 176.8993 160 T 4.6698 7.4309 111.5801 60.5500 70.4242 172.6810 161 D 5.3782 8.6650 125.4047 53.5704 40.9098 174.9066 162 Q 4.7344 7.8722 122.0892 54.8229 30.1090 175.3182 163 V 3.8891 8.1580 127.0579 62.6334 32.8353 174.9983 164 D 4.4820 9.1040 128.0762 54.3154 42.1293 176.1903 165 L 4.7321 8.5317 124.9648 54.5066 42.4063 178.4105 166 S 4.3105 8.6575 115.2731 60.2341 63.0951 175.1139 167 S 4.6961 7.8712 113.7517 57.7409 63.2265 173.3354 168 Y 4.2094 7.6915 122.2229 58.0571 39.1687 175.2964 169 Y 4.1652 8.0502 128.3472 57.6333 38.9099 176.7373 170 A 4.0945 8.4988 130.7232 54.3435 18.7338 177.6927 171 S 4.4445 5.8100 110.9796 57.8784 62.6856 174.4010 172 S 4.4601 7.0892 114.3985 58.0585 62.8410 175.2883 173 K 3.9993 8.5995 123.1231 58.3695 32.0410 176.6576 174 Y 5.3372 7.2693 113.4710 55.9112 40.1147 174.6804 175 E 4.6880 9.1229 123.1712 55.3060 32.0901 175.1886 176 I 4.5000 7.9201 123.0763 60.9080 37.5343 175.6859 177 L 4.3870 9.1198 128.6774 57.3735 42.3563 177.3379 178 S 4.7308 7.8341 110.4344 57.5471 66.7301 173.5969 179 A 5.1690 8.3304 122.4703 51.2308 22.1464 175.3142 180 T 5.2074 9.0624 112.9746 59.8393 73.0323 173.0241 181 Q 5.0120 9.2079 120.6073 54.9043 31.6673 174.2651 182 T 4.9100 8.9133 120.2583 61.2928 72.5930 173.3981 183 R 4.5718 8.8212 127.2745 56.6860 30.9851 175.3590 184 Q 4.7879 9.7707 124.4065 54.1291 33.7175 174.0621 185 V 4.9270 8.2454 119.4894 61.3885 34.2768 174.3298 186 Q 4.5413 8.8880 126.9548 55.0689 32.9273 172.8425 187 H 5.1972 8.4131 119.8165 54.3494 31.6379 173.6717 188 Y 4.7128 8.1718 116.7498 56.0160 41.7814 176.7848 189 S 4.2153 8.9799 118.9671 61.8550 63.1837 174.9945 190 C 4.4430 8.2539 113.7994 58.0151 41.5005 174.7108 191 C 5.1846 8.1018 115.9935 54.3292 43.7821 172.5526 192 P 4.2771 0.0000 0.0000 65.1766 31.4901 176.7096 193 E 4.4464 8.1572 118.8819 55.1253 30.3921 174.5891 194 P 4.5958 0.0000 0.0000 63.0570 33.2541 174.5249 195 Y 4.8935 9.3162 118.9029 56.4114 41.1256 174.8057 196 I 4.9691 8.3895 123.3634 60.2108 39.0921 174.6775 197 D 5.1595 9.0196 124.0868 51.8808 43.7632 174.2405 198 V 4.6688 8.8368 120.1195 61.4046 33.6112 173.9065 199 N 4.9840 9.5020 128.6031 52.5699 40.4924 173.3031 200 L 4.7905 8.7819 129.4749 53.7248 43.8372 175.0181 201 V 4.7746 8.6286 127.4308 61.1116 33.8737 174.3048 202 V 4.8836 9.1713 128.2018 61.0346 34.5448 174.0273 203 K 5.2356 9.3222 127.7843 54.7098 34.5677 175.3209 204 F 5.4975 8.7957 118.9788 56.1200 41.9075 172.9929 205 R 5.0107 8.9135 115.2399 54.8855 33.2405 173.9635 206 E 4.6384 9.0136 120.0029 56.3253 30.2229 177.4476 207 R 4.2171 9.1167 123.6121 57.4765 30.7316 177.1913 208 R 3.9244 8.1727 122.1985 56.0900 29.7604 175.8376 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 2 S 8.19 4.41 0.00 3.87 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 3 Q 7.93 3.80 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 4 A 8.89 3.97 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 5 N 8.07 4.29 0.00 2.94 3.07 0.00 0.00 6.78 6.74 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 6 L 7.41 3.69 0.00 1.72 1.71 0.56 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 7 M 8.08 4.01 0.00 2.23 2.25 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 2.57 2.60 0.00 8 R 7.87 3.81 0.00 2.11 2.13 0.00 3.17 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 9 L 7.67 3.10 0.00 1.04 1.20 -0.93 -0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.25 2.91 0.00 1.55 1.61 0.00 1.41 0.00 0.00 1.52 0.00 0.00 3.19 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.41 0.71 7.81 11 S 7.51 4.17 0.00 4.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 7.88 4.27 0.00 2.69 2.76 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 13 L 7.56 4.03 0.00 0.78 1.44 0.69 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.63 5.04 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 N 7.80 4.83 0.00 2.82 2.78 0.00 0.00 6.93 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 *20 Y 7.56 4.46 0.00 2.93 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 21 P 0.00 4.41 0.00 2.09 2.03 0.00 3.48 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 22 G 5.92 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 0.00 0.00 0.00 23 P 0.00 4.35 0.00 2.06 1.77 0.00 2.87 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.42 0.00 24 T 7.76 4.77 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 1.17 0.00 0.00 25 K 8.57 4.47 0.00 1.74 1.87 0.00 1.75 0.00 0.00 0.61 0.00 0.00 2.52 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.56 7.81 26 D 7.99 4.51 0.00 2.64 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 27 D 7.64 4.75 0.00 2.64 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 5.10 0.00 2.12 2.30 0.00 3.77 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 2.00 2.00 0.00 29 L 8.88 4.83 0.00 1.60 1.39 0.97 0.93 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 30 T 8.64 5.07 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 31 V 8.84 4.77 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.03 0.00 0.00 32 T 9.03 5.07 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 1.30 0.00 0.00 33 L 8.53 5.56 0.00 1.47 1.37 1.09 0.81 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 34 G 8.07 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 35 F 9.55 5.31 0.00 2.87 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 36 T 8.42 4.89 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 0.93 0.00 0.00 37 L 8.43 4.55 0.00 1.72 1.68 1.11 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 9.09 4.33 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.56 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 39 D 7.73 4.24 0.00 2.61 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 40 I 8.71 4.68 2.03 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.84 0.45 0.00 0.00 41 V 8.78 3.96 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 0.74 0.00 0.00 1.04 0.00 0.00 42 K 7.99 4.92 0.00 1.90 1.62 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.52 7.81 43 A 8.90 4.74 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 44 D 9.21 4.83 0.00 2.68 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.77 4.66 0.00 4.02 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 46 S 8.09 4.39 0.00 4.04 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 47 T 7.61 4.38 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 1.20 0.00 0.00 48 N 7.97 4.28 0.00 2.87 2.89 0.00 0.00 7.00 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.45 5.08 0.00 1.81 1.70 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 2.21 2.37 0.00 50 V 7.99 4.75 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 0.86 0.00 0.00 0.81 0.00 0.00 51 D 8.99 5.63 0.00 2.66 2.61 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 52 L 9.25 5.30 0.00 1.82 1.72 0.59 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 53 V 8.83 4.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.94 0.00 0.00 54 Y 8.25 5.18 0.00 3.31 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 55 Y 8.66 5.15 0.00 2.89 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 56 E 8.45 4.28 0.00 1.99 1.70 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 1.78 1.75 0.00 57 Q 8.75 4.21 0.00 2.14 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.53 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 58 Q 9.42 5.24 0.00 2.38 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 59 R 9.07 5.22 0.00 1.86 1.77 0.00 3.21 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.64 0.00 60 W 8.19 5.58 0.00 3.50 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 8.69 4.98 0.00 1.70 1.65 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.66 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.48 7.81 62 L 8.79 4.65 0.00 1.49 1.27 0.55 -0.32 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 63 N 8.94 4.33 0.00 2.80 2.86 0.00 0.00 6.90 7.07 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 64 S 7.96 4.28 0.00 4.04 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 65 L 7.77 4.79 0.00 1.84 1.85 1.03 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 66 M 7.92 4.73 0.00 1.90 2.11 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.50 0.00 67 W 8.33 5.25 0.00 3.25 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 68 D 9.04 4.74 0.00 2.84 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 69 P 0.00 4.85 0.00 2.21 2.29 0.00 3.87 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.73 0.00 70 N 8.39 4.38 0.00 2.70 3.01 0.00 0.00 6.97 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 71 E 7.97 4.29 0.00 2.13 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 72 Y 7.24 4.71 0.00 3.02 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 73 G 8.80 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 N 8.57 4.27 0.00 2.83 2.90 0.00 0.00 7.07 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.75 4.15 2.05 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.81 1.07 0.00 0.00 76 T 8.71 4.78 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 1.22 0.00 0.00 77 D 8.19 5.69 0.00 2.79 2.72 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 78 F 8.69 4.98 0.00 3.12 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 79 R 8.75 4.69 0.00 1.77 1.95 0.00 3.26 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 80 T 9.02 4.83 4.68 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 1.28 0.00 0.00 81 S 8.80 4.44 0.00 3.88 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 82 A 8.73 3.72 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.79 4.03 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 84 D 7.83 4.28 0.00 2.67 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 0.00 0.00 0.00 0.00 85 I 7.20 4.78 2.11 0.00 0.00 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 1.17 0.81 1.06 0.00 0.00 86 W 8.99 4.30 0.00 3.50 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.01 3.82 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 1.08 0.00 0.00 88 P 0.00 3.55 0.00 2.00 1.83 0.00 2.93 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 1.74 1.14 0.00 89 D 8.24 4.73 0.00 2.81 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 90 I 7.53 4.37 2.10 0.00 0.00 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 1.36 0.87 1.19 0.00 0.00 91 T 9.43 4.97 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 1.17 0.00 0.00 92 A 8.76 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.93 4.45 0.00 2.93 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 94 S 7.80 4.80 0.00 4.09 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 95 S 8.13 4.87 0.00 4.04 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.41 4.50 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 1.20 0.00 0.00 97 R 7.52 4.70 0.00 1.75 1.82 0.00 3.26 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 98 P 0.00 4.30 0.00 2.02 1.96 0.00 3.67 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 99 V 8.28 3.95 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 0.85 0.00 0.00 1.07 0.00 0.00 100 Q 8.73 4.63 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.73 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 101 V 8.42 4.30 2.08 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 0.82 0.00 0.00 0.94 0.00 0.00 102 L 8.97 4.80 0.00 1.44 1.62 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 103 S 7.71 4.76 0.00 3.71 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 P 0.00 4.30 0.00 2.07 2.05 0.00 3.62 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 2.02 2.11 0.00 105 Q 8.46 4.88 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.87 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 106 I 8.17 5.00 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 1.30 0.64 0.97 0.00 0.00 107 A 9.38 4.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.36 4.56 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 0.90 0.00 0.00 0.89 0.00 0.00 109 V 7.92 4.52 1.16 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 1.00 0.00 0.00 0.68 0.00 0.00 110 T 8.54 5.09 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 1.09 0.00 0.00 111 H 8.44 2.00 0.00 2.07 2.51 0.00 5.45 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 7.19 4.30 0.00 2.61 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.10 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 0.00 114 S 7.64 4.69 0.00 3.71 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 0.00 115 V 8.46 4.53 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 0.30 0.00 0.00 0.63 0.00 0.00 116 M 8.50 5.02 0.00 1.98 1.70 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 117 F 9.06 5.27 0.00 3.06 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 7.86 4.44 1.63 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 1.30 0.69 0.65 0.00 0.00 119 P 0.00 4.19 0.00 1.86 1.60 0.00 3.47 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 1.75 1.41 0.00 120 A 8.96 5.00 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 0.00 121 Q 8.52 4.79 0.00 1.15 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.72 0.00 0.00 0.00 0.00 0.00 2.17 2.08 0.00 122 R 8.94 5.11 0.00 1.85 1.78 0.00 3.05 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 123 L 9.15 5.21 0.00 2.18 1.86 1.06 0.79 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 0.00 124 S 8.82 5.49 0.00 3.86 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 0.00 125 F 8.93 5.37 0.00 3.23 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 0.00 126 M 8.73 4.54 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.47 0.00 127 C 8.67 4.53 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.77 4.81 0.00 2.63 2.57 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 0.00 129 P 0.00 4.49 0.00 2.26 2.29 0.00 3.91 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.98 0.00 130 T 7.85 3.98 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 1.19 0.00 0.00 131 G 8.94 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 0.00 132 V 7.78 3.57 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 0.96 0.00 0.00 0.96 0.00 0.00 133 D 7.91 5.02 0.00 2.82 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 0.00 134 S 7.73 4.77 0.00 4.12 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 0.00 135 E 8.91 3.91 0.00 1.92 2.02 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 2.29 2.37 0.00 136 E 7.54 4.05 0.00 2.15 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 0.00 2.24 2.37 0.00 137 G 7.58 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.95 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 T 8.02 5.08 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 1.23 0.00 0.00 140 C 9.68 5.34 0.00 3.17 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 0.00 141 A 8.67 5.44 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 0.00 142 V 8.59 4.46 1.59 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 -0.05 0.00 0.00 0.30 0.00 0.00 143 K 8.55 5.00 0.00 1.94 2.08 0.00 1.34 0.00 0.00 1.73 0.00 0.00 2.60 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.36 1.42 7.81 144 F 8.63 5.31 0.00 3.16 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 0.00 145 G 8.96 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 S 8.96 4.93 0.00 4.12 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 W 9.13 4.22 0.00 3.38 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 0.00 148 V 8.13 4.33 1.94 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 0.93 0.00 0.00 0.65 0.00 0.00 149 Y 8.16 4.65 0.00 3.06 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 0.00 150 S 8.54 2.99 0.00 3.79 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 G 8.25 3.55 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 0.00 0.00 0.00 152 F 7.84 4.45 0.00 3.05 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 0.00 153 E 8.28 4.62 0.00 2.12 1.91 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 2.51 2.44 0.00 154 I 8.11 4.90 1.96 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 1.07 0.62 0.99 0.00 0.00 155 D 9.12 4.94 0.00 2.75 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 L 8.34 5.56 0.00 1.60 1.61 1.09 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 157 K 8.87 4.79 0.00 1.82 1.89 0.00 1.27 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.43 7.81 158 T 8.40 5.09 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 159 D 8.77 4.66 0.00 2.69 2.77 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 0.00 160 T 7.43 4.67 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 1.26 0.00 0.00 161 D 8.66 5.38 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 0.00 162 Q 7.87 4.73 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 163 V 8.16 3.89 2.20 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 0.83 0.00 0.00 0.91 0.00 0.00 164 D 9.10 4.48 0.00 2.81 2.57 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 0.00 165 L 8.53 4.73 0.00 1.73 1.63 0.86 0.62 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 0.00 166 S 8.66 4.31 0.00 4.01 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 0.00 167 S 7.87 4.70 0.00 4.11 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 0.00 168 Y 7.69 4.21 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 0.00 169 Y 8.05 4.17 0.00 2.79 2.46 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 0.00 170 A 8.50 4.09 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 S 5.81 4.44 0.00 3.25 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 S 7.09 4.46 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 0.00 173 K 8.60 4.00 0.00 1.12 1.15 0.00 1.56 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.45 1.28 7.81 174 Y 7.27 5.34 0.00 3.13 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 0.00 175 E 9.12 4.69 0.00 2.07 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 2.43 2.34 0.00 176 I 7.92 4.50 1.54 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 -0.02 -0.11 0.87 0.00 0.00 177 L 9.12 4.39 0.00 1.58 1.71 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 178 S 7.83 4.73 0.00 3.85 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 0.00 179 A 8.33 5.17 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 0.00 180 T 9.06 5.21 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 1.21 0.00 0.00 181 Q 9.21 5.01 0.00 2.17 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 182 T 8.91 4.91 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 1.22 0.00 0.00 183 R 8.82 4.57 0.00 1.87 1.86 0.00 3.30 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 184 Q 9.77 4.79 0.00 2.32 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.53 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 185 V 8.25 4.93 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 0.74 0.00 0.00 0.91 0.00 0.00 186 Q 8.89 4.54 0.00 2.07 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.50 0.00 0.00 0.00 0.00 0.00 2.07 2.32 0.00 187 H 8.41 5.20 0.00 2.91 3.13 0.00 5.89 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 Y 8.17 4.71 0.00 2.80 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 S 8.98 4.22 0.00 3.88 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 0.00 190 C 8.25 4.44 0.00 3.05 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 0.00 191 C 8.10 5.18 0.00 3.14 3.39 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 0.00 192 P 0.00 4.28 0.00 2.27 2.25 0.00 3.85 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 2.05 2.03 0.00 193 E 8.16 4.45 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.59 0.00 194 P 0.00 4.60 0.00 2.01 1.95 0.00 3.57 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.87 0.00 195 Y 9.32 4.89 0.00 3.02 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 I 8.39 4.97 1.92 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.89 1.06 0.00 0.00 197 D 9.02 5.16 0.00 2.86 2.78 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 0.00 198 V 8.84 4.67 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 1.12 0.00 0.00 1.06 0.00 0.00 199 N 9.50 4.98 0.00 3.00 2.67 0.00 0.00 6.32 6.97 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 0.00 200 L 8.78 4.79 0.00 1.36 1.56 0.77 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 201 V 8.63 4.77 2.08 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 0.90 0.00 0.00 0.92 0.00 0.00 202 V 9.17 4.88 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.86 0.00 0.00 203 K 9.32 5.24 0.00 1.78 1.68 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.37 7.81 204 F 8.80 5.50 0.00 3.28 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 R 8.91 5.01 0.00 2.06 2.00 0.00 2.86 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 0.00 206 E 9.01 4.64 0.00 1.92 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 2.51 2.67 0.00 207 R 9.12 4.22 0.00 1.77 1.86 0.00 3.14 0.00 0.00 3.40 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.50 0.00 208 R 8.17 3.92 0.00 1.86 2.13 0.00 3.40 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 * Residues marked with a * may have inaccurate shift predictions.