NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.6766 8.3344 115.5610 58.3506 63.6258 172.3244 5 V 4.2301 8.8883 128.0533 60.1867 33.9036 172.7469 6 K 4.4602 9.3092 129.9343 55.8340 32.6905 175.9178 7 I 3.8218 8.6161 129.6840 63.5872 37.3681 175.4944 8 S 4.5314 7.1647 112.1838 57.6388 65.0606 174.6295 9 D 4.3695 8.7627 119.5233 56.7786 40.7476 177.0386 10 D 4.8942 7.8100 115.2242 52.7802 40.2293 175.2883 11 I 5.2498 7.6607 121.0531 59.9833 41.1993 174.3803 12 S 5.0575 9.0246 120.8785 56.4646 66.9454 172.7570 13 I 5.0461 8.7986 120.6707 59.6337 41.6758 173.8432 14 T 4.9297 9.2279 125.2160 61.7052 71.4386 173.1320 15 Q 4.0275 8.7255 127.6562 55.3679 29.8789 175.1369 16 L 3.8858 8.3148 125.8511 56.0615 42.6174 176.1992 17 S 4.5470 7.0792 110.8123 56.7629 65.9881 174.0415 18 D 4.2744 8.7384 119.4572 57.1325 40.5961 178.0488 19 K 4.4979 7.6412 115.2996 55.9898 33.0265 175.5967 20 V 4.9989 7.3764 119.8552 61.3132 34.8515 173.8653 21 Y 5.1328 9.4059 124.1607 56.4421 42.6640 174.1090 22 T 4.9207 9.2893 116.2166 60.4231 70.3452 172.3788 23 Y 5.2130 8.1897 126.0736 55.1864 41.8348 174.6347 24 V 4.8325 8.9034 120.1985 61.1802 34.7428 174.1798 25 S 5.3741 9.2076 122.7657 56.5648 65.7632 172.8468 26 L 5.0745 9.0147 124.4846 53.4816 42.5489 175.9194 27 A 4.7786 8.8732 124.6628 50.1230 23.2264 174.2582 28 E 4.7355 8.7889 120.8517 55.6013 31.0239 175.7329 29 I 4.3108 8.9452 128.0635 59.1674 38.6575 174.2133 30 E 3.9834 8.8806 126.2224 58.8987 29.2095 176.9685 31 G 3.5589 9.1087 115.1007 44.9095 0.0000 172.7595 32 W 4.8305 8.2697 117.1974 55.4496 31.6015 176.6955 33 G 3.8381 8.0415 106.0589 44.4146 0.0000 171.4241 34 M 4.6999 8.4663 119.3149 55.3674 32.8380 176.2840 35 V 4.5513 9.5654 124.9020 60.3843 34.6853 172.5562 36 P 5.3536 0.0000 0.0000 62.2055 32.7163 175.3674 37 S 4.9747 9.1852 116.6924 56.7953 66.4674 172.6217 38 N 5.3403 8.2375 118.8870 51.4963 41.3348 174.0686 39 G 3.6681 6.4757 105.7863 46.4283 0.0000 171.3761 40 M 5.3103 8.7385 117.8446 53.4435 36.7449 175.0415 41 I 4.9818 8.8109 121.9884 59.6712 40.6160 174.5707 42 V 4.9327 8.6941 127.2878 61.0865 34.0412 174.2883 43 I 5.1103 9.0251 128.2885 59.5974 40.4416 174.7829 44 N 4.7570 9.1093 124.3737 53.3356 42.0655 174.0419 45 N 4.1890 9.6555 123.6612 55.0871 36.3836 173.8251 46 H 4.1786 7.9553 108.1998 56.7290 27.0335 174.3326 47 Q 5.1450 8.1243 117.5284 54.0571 32.0019 174.5529 48 A 5.3578 9.5315 124.3826 50.0583 23.0101 174.5895 49 A 5.1445 8.8794 121.5505 50.0151 22.2186 175.1183 50 L 5.1153 9.1905 124.9534 53.4339 44.5621 175.1066 51 L 4.8718 8.9547 127.2913 54.1759 43.0299 173.8683 52 D 5.5391 9.0427 127.8474 54.4471 41.3410 174.2380 53 T 4.7546 8.4488 112.2821 58.9665 69.9964 172.5478 54 P 4.6861 0.0000 0.0000 62.4762 32.2691 177.2743 55 I 4.0885 7.8282 119.2813 63.9449 37.2268 175.6503 56 N 5.3948 7.5429 116.7195 50.1606 40.7908 175.1360 57 D 4.2464 8.7340 117.4525 57.2273 40.7386 178.7504 58 A 3.8023 7.8807 120.7143 55.4671 18.4716 179.6354 59 Q 3.8754 8.8661 116.7106 59.2700 28.8390 179.1808 60 T 3.7320 7.7346 116.9057 66.4818 68.4173 176.3797 61 E 3.2600 8.0433 121.6225 58.9281 29.3585 178.4491 62 M 3.9186 7.7164 118.2762 58.5854 32.3068 178.0212 63 L 3.8523 7.7328 120.3765 58.1914 42.2724 179.1223 64 V 3.7039 8.0258 118.3583 66.0325 31.4368 177.7906 65 N 4.4428 8.4995 116.5254 55.7741 38.3520 177.2439 66 W 4.0749 8.0113 130.0337 60.1746 30.7462 178.3328 67 V 3.2248 8.0227 118.3908 66.0477 31.1032 178.0278 68 T 3.9600 7.6193 116.6466 66.3955 68.1431 176.3981 69 D 4.1830 8.1348 119.6474 56.9383 40.9855 178.3916 70 S 4.0429 7.5760 114.3481 59.5158 63.3996 175.1446 71 L 4.1127 6.8716 118.5437 53.9903 42.0905 175.9254 72 H 4.4759 7.8920 113.4781 55.6059 26.1565 174.1080 73 A 4.8708 7.5995 118.9924 50.1067 22.1258 175.3108 74 K 4.6901 8.6042 122.2447 54.6239 34.2878 175.6604 75 V 4.3694 8.4892 128.1555 63.2711 31.6722 175.2959 76 T 4.6937 9.2747 117.5153 61.6316 71.3186 173.8453 77 T 5.4907 7.9405 118.2737 61.9111 73.1054 172.5830 78 F 5.5907 9.4841 126.1316 56.9350 43.6895 173.3482 79 I 4.9495 8.1482 125.4284 57.9820 40.8481 172.4982 80 P 4.9785 0.0000 0.0000 61.3954 32.6291 175.6759 81 N 4.4450 9.9943 121.7415 56.8450 39.2374 174.0635 82 H 5.0235 7.3191 110.0776 54.8017 30.4633 172.6639 83 W 4.4692 8.8297 115.1397 58.4409 28.7019 176.0822 84 H 4.0065 7.1915 117.0516 55.2399 29.0045 176.3990 85 G 3.6708 8.5324 110.0809 48.7564 0.0000 174.9064 86 D 4.7346 8.0483 116.3805 54.0745 39.9528 175.8296 87 C 4.8043 8.5587 117.6363 61.2520 30.3987 175.5582 88 I 4.7899 7.7216 109.8082 60.3090 37.7997 176.9408 89 G 4.0656 7.7883 111.6941 47.9669 0.0000 175.0151 90 G 4.5648 8.3904 106.7901 43.9825 0.0000 175.1580 91 L 3.7770 8.1160 124.9592 57.5245 41.8655 179.1874 92 G 3.7039 8.1067 105.4032 48.0672 0.0000 174.7957 93 Y 4.0735 8.1347 121.6597 60.2517 38.8788 177.6773 94 L 3.5886 7.7096 119.5769 58.0029 41.7298 179.6820 95 Q 3.9210 8.2937 118.1333 58.9662 28.3911 179.0392 96 R 3.9560 7.6470 118.1801 58.5463 30.1451 178.2784 97 K 4.1560 7.3966 116.1285 56.1437 32.2717 177.6330 98 G 3.8214 7.6567 107.6587 45.3669 0.0000 173.6376 99 V 3.8482 7.5581 119.8286 62.6014 32.1480 175.7329 100 Q 4.7939 8.9535 127.1966 55.2594 30.4462 174.9908 101 S 5.9617 8.7611 116.6706 55.8575 66.7264 172.4784 102 Y 5.2963 8.4377 117.5969 56.7556 42.2404 174.0015 103 A 4.6263 9.2663 123.1158 50.9319 23.7240 175.2837 104 N 3.4177 8.4240 117.5301 53.3666 39.6167 175.6281 105 Q 3.8998 8.6124 125.9693 59.5323 29.0343 178.7387 106 M 3.9181 7.8993 119.7261 58.6432 31.8634 178.8288 107 T 4.3883 7.4717 116.5700 66.1310 68.6122 176.5911 108 I 3.6928 7.4926 121.3229 64.5648 37.0870 178.2357 109 D 4.2799 8.1358 119.6694 57.2229 40.7133 178.9283 110 L 3.6498 7.8770 119.1609 57.7041 41.5270 179.3791 111 A 4.0276 8.2497 121.0279 54.9967 18.2407 179.9061 112 K 3.8845 8.2547 117.3400 59.5966 32.0586 179.4391 113 E 4.0547 8.1629 115.9087 58.2492 29.5179 178.0076 114 K 4.3652 7.5023 117.2756 55.1772 32.8196 176.5323 115 G 3.8396 7.7533 107.2208 46.4027 0.0000 173.8669 116 L 4.6119 7.7835 119.1253 51.8025 43.4365 174.9493 117 P 4.2676 0.0000 0.0000 63.0257 31.6658 176.1693 118 V 4.3304 8.0818 122.1392 60.1793 33.0165 173.7960 119 P 4.5063 0.0000 0.0000 62.8323 31.6774 175.9973 120 E 4.0190 8.5510 120.7303 58.9270 29.4330 176.4153 121 H 4.8702 8.3465 115.9836 54.2096 30.8748 173.7643 122 G 5.0933 9.0839 110.2774 44.3580 0.0000 172.2849 123 F 5.3360 8.5643 117.9478 55.2300 41.0557 175.6791 124 T 4.2067 8.8942 108.6523 62.0427 70.1410 173.1684 125 D 5.2022 7.8086 118.9939 54.5779 43.1758 175.7210 126 S 4.9899 7.8485 113.0029 57.1117 66.9981 172.5216 127 L 4.2603 7.9346 121.8816 54.0424 45.7233 174.2682 128 T 4.7019 8.2751 122.8558 61.8446 70.1446 173.8182 129 V 3.7091 8.4107 128.0236 61.8413 33.2442 174.7750 130 S 4.7360 8.3627 122.5744 56.8998 63.2373 173.9932 131 L 4.2329 9.1181 132.3041 54.7727 40.4024 175.6116 132 D 4.2247 9.3705 126.1656 54.9773 39.9399 173.6796 133 G 4.0493 8.0500 106.5016 45.4051 0.0000 174.0637 134 M 4.4015 7.9325 121.0392 53.9906 33.3069 173.8528 135 P 4.7533 0.0000 0.0000 62.7419 32.8164 176.0984 136 L 4.5333 8.8924 123.4485 53.0145 43.9671 174.9022 137 Q 4.5184 8.9061 123.8691 55.0217 30.0547 174.6310 138 C 5.1028 8.7654 123.1150 58.3258 30.6217 172.7969 139 Y 5.3412 9.0570 120.2253 56.5149 41.9468 173.4839 140 Y 5.1083 9.2315 125.4016 55.9102 40.0664 175.1623 141 L 4.4505 8.0938 125.1222 54.3527 42.8427 175.7262 142 G 3.7058 6.0515 104.9983 43.4719 0.0000 174.5769 143 G 3.9766 8.4077 108.6613 45.7256 0.0000 173.8354 144 G 3.4507 8.3063 114.8844 44.6259 0.0000 175.2786 145 H 2.5800 6.4210 126.5638 57.7266 29.7685 174.0621 146 A 5.2567 7.4044 118.9887 48.9442 22.4641 176.6846 147 T 3.8752 8.5854 110.0773 64.0786 69.2267 175.4801 148 D 4.7536 8.0057 119.7597 52.4703 40.0810 175.7341 149 N 4.9696 8.2694 117.3372 52.8921 37.7247 173.8111 150 I 5.0755 8.0021 113.2708 59.5887 41.2275 174.2587 151 V 4.6559 8.7757 113.0215 59.9968 36.5693 174.9257 152 V 4.9198 8.7205 122.5899 61.0556 34.2765 173.9265 153 W 5.2964 9.7881 135.0000 56.0580 32.9843 174.9128 154 L 4.9391 7.7535 127.5292 51.4656 40.1497 174.9272 155 P 3.8004 0.0000 0.0000 65.6088 31.3697 179.3120 156 T 3.9442 7.6027 106.7930 62.9230 69.1158 174.5990 157 E 4.3576 6.9188 120.4017 55.1685 31.7238 175.4004 158 N 3.6550 7.8476 115.9048 54.4668 36.6377 173.6166 159 I 5.0052 6.7808 117.4605 59.4058 40.9512 174.8097 160 L 5.1579 9.1583 129.4584 53.4358 44.5689 174.9682 161 F 5.1301 9.5489 130.3126 57.0735 38.9789 176.0141 162 G 3.3808 8.8455 114.1277 46.8977 0.0000 173.0761 163 G 3.4016 7.3354 108.7106 44.6654 0.0000 173.3929 164 C 4.2083 8.3791 115.7526 61.9979 28.0954 174.6022 165 M 4.1804 7.8037 115.9196 56.2657 31.1646 176.0359 166 L 4.9401 8.0256 120.3129 52.9008 44.6034 175.5499 167 K 4.8418 8.8109 121.7976 54.3393 34.5061 176.1010 168 D 4.7279 8.2944 120.8290 52.7288 40.3601 177.0964 169 N 4.0603 8.5600 116.7425 56.2351 38.5455 176.7357 170 Q 4.1036 8.0911 115.1497 57.2907 29.3403 176.2858 171 A 4.2068 7.5349 121.2283 52.6229 18.7940 177.2619 172 T 4.5906 8.3853 108.4962 60.5894 69.8382 174.0434 173 S 4.8201 7.5989 116.1321 55.9910 65.6254 174.7961 174 I 3.4901 8.1992 121.4222 61.9447 38.2111 177.2635 175 G 3.6373 7.1467 108.7400 44.4454 0.0000 171.7222 176 N 4.1447 8.6826 119.1961 54.4856 38.7666 175.0592 177 I 4.4462 8.0995 118.8882 60.4655 38.0640 177.6869 178 S 4.2197 8.1558 117.9352 61.4857 62.9224 174.6174 179 D 5.1407 7.9839 118.8790 53.8274 42.4474 175.9118 180 A 4.5142 7.8361 120.3282 50.8443 20.0275 178.1424 181 D 4.7683 8.5797 119.1705 51.6507 40.4662 176.3374 182 V 3.9416 8.3935 121.6131 66.1206 32.0115 176.8343 183 T 4.1018 7.9940 107.4463 64.4699 69.1346 175.9072 184 A 4.2325 8.2255 123.3305 53.9623 18.6022 178.9454 185 W 4.5185 8.3579 127.3973 60.7870 30.7950 176.4074 186 P 4.2540 0.0000 0.0000 65.4484 30.7661 178.5171 187 K 3.9949 8.0959 118.0309 59.6907 32.0487 178.9502 188 T 3.8764 7.8982 116.0526 66.6324 68.3857 176.8082 189 L 4.1077 8.2487 120.8318 57.8163 41.5684 179.4364 190 D 4.3195 7.9850 118.9074 57.0517 40.7586 178.6193 191 K 3.8660 7.7873 119.8152 59.4352 32.2369 179.0655 192 V 3.6397 8.1467 118.9694 65.7623 31.2270 177.8750 193 K 3.8928 8.0358 118.1779 59.6183 32.1816 178.4013 194 A 4.0039 7.7297 119.5528 54.8511 18.2931 179.1237 195 K 3.5052 7.4520 117.3481 57.6722 32.9986 177.1069 196 F 4.5149 7.6229 117.0610 55.6445 39.1069 174.6532 197 P 4.3040 0.0000 0.0000 65.0414 31.8509 177.6904 198 S 4.5243 7.8816 111.7783 57.8079 63.4714 173.9842 199 A 4.5572 7.5053 124.2086 53.6117 18.6137 177.4261 200 R 4.3066 9.4153 123.2120 57.7226 31.5349 176.3775 201 Y 5.1823 7.8464 115.3339 56.1016 42.2162 174.7027 202 V 4.8369 9.4184 123.6516 61.2734 34.7828 174.1099 203 V 4.8126 8.9208 129.2217 60.8137 33.1825 173.7758 204 P 5.0613 0.0000 0.0000 61.7635 32.6978 176.3633 205 G 3.7674 8.2243 107.4204 49.0622 0.0000 173.7928 206 H 5.0664 8.1200 115.6162 55.2544 32.6911 173.0910 207 G 3.9097 8.7878 108.5172 44.3881 0.0000 172.6528 208 D 4.3781 8.1007 118.2604 54.2521 41.2520 176.1785 209 Y 4.6025 7.7138 120.5714 56.3862 39.6766 175.4377 210 G 3.8899 9.5119 110.6726 46.3245 0.0000 171.5549 211 G 4.7665 9.8037 113.0802 43.6329 0.0000 173.1327 212 T 4.2252 8.7901 109.6882 63.9293 68.0615 175.5256 213 E 4.0739 8.1753 120.5696 59.2629 29.6355 178.7484 214 L 4.1517 7.9423 119.9792 57.5316 41.5761 179.5187 215 I 3.7487 7.6807 119.6676 64.3557 37.0957 178.0613 216 E 3.8969 8.0891 119.6896 59.3430 29.5978 177.7639 217 H 4.0981 8.3166 118.3858 59.9271 29.7878 177.2820 218 T 3.6957 7.9999 117.2009 66.3899 68.2193 176.6008 219 K 3.7441 7.8666 121.5244 59.5254 32.1356 178.9412 220 Q 3.9342 8.0698 118.4378 58.8030 28.5563 178.6601 221 I 3.5841 7.4636 120.8808 64.3654 37.1226 178.7146 222 V 3.2750 7.6214 119.2468 65.8269 31.2816 177.9051 223 N 4.3134 8.1955 116.3489 56.3733 38.3260 177.3738 224 Q 3.9708 8.4537 119.9168 59.0306 28.8493 178.3597 225 Y 3.8914 8.1634 120.5563 60.8531 38.6630 178.2226 226 I 3.7326 7.5966 119.3198 64.1307 37.3166 177.9374 227 E 4.0137 7.9398 120.3133 59.1668 29.4958 178.7063 228 S 4.2437 7.9540 112.4910 60.0969 62.8631 174.4775 229 T 4.5420 6.9773 111.1163 61.4677 68.7692 174.8207 230 S 4.5174 8.3882 119.3974 59.5363 65.4409 175.1155 *231 K 4.6836 7.7039 125.8888 54.1270 31.3222 181.1600 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 S 8.33 4.68 0.00 3.93 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.89 4.23 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 0.87 0.00 0.00 1.04 0.00 0.00 6 K 9.31 4.46 0.00 1.79 1.69 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.55 7.81 7 I 8.62 3.82 1.73 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.15 0.71 0.00 0.00 8 S 7.16 4.53 0.00 3.92 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 9 D 8.76 4.37 0.00 2.67 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 10 D 7.81 4.89 0.00 3.01 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 11 I 7.66 5.25 1.74 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 1.24 0.66 0.77 0.00 0.00 12 S 9.02 5.06 0.00 3.92 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.80 5.05 1.45 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.26 0.22 0.00 0.00 14 T 9.23 4.93 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 15 Q 8.73 4.03 0.00 1.66 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.93 0.00 0.00 0.00 0.00 0.00 1.95 1.58 0.00 16 L 8.31 3.89 0.00 1.27 1.07 0.35 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.08 4.55 0.00 3.89 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 18 D 8.74 4.27 0.00 2.65 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 19 K 7.64 4.50 0.00 1.87 1.91 0.00 1.57 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.32 7.81 20 V 7.38 5.00 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 0.90 0.00 0.00 0.87 0.00 0.00 21 Y 9.41 5.13 0.00 2.93 2.83 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 22 T 9.29 4.92 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 1.09 0.00 0.00 23 Y 8.19 5.21 0.00 3.13 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 24 V 8.90 4.83 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 1.00 0.00 0.00 0.96 0.00 0.00 25 S 9.21 5.37 0.00 3.94 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 9.01 5.07 0.00 1.51 1.66 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.87 4.78 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 28 E 8.79 4.74 0.00 2.01 1.88 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 2.29 2.34 0.00 29 I 8.95 4.31 2.10 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 1.26 0.78 1.14 0.00 0.00 30 E 8.88 3.98 0.00 1.95 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 2.30 2.29 0.00 31 G 9.11 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 W 8.27 4.83 0.00 3.24 3.20 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 33 G 8.04 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 34 M 8.47 4.70 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.50 0.00 35 V 9.57 4.55 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 0.97 0.00 0.00 1.05 0.00 0.00 36 P 0.00 5.35 0.00 2.14 2.05 0.00 3.78 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 2.00 1.98 0.00 37 S 9.19 4.97 0.00 3.87 4.06 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 38 N 8.24 5.34 0.00 2.80 2.57 0.00 0.00 6.70 7.48 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 39 G 6.48 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 0.00 0.00 0.00 40 M 8.74 5.31 0.00 1.70 1.70 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.07 0.00 41 I 8.81 4.98 2.02 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.12 0.96 0.00 0.00 42 V 8.69 4.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.93 0.00 0.00 43 I 9.03 5.11 1.96 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 1.16 0.90 0.96 0.00 0.00 44 N 9.11 4.76 0.00 2.71 2.70 0.00 0.00 7.10 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 45 N 9.66 4.19 0.00 2.93 2.83 0.00 0.00 7.13 8.16 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 46 H 7.96 4.18 0.00 3.36 3.45 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 8.12 5.15 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 48 A 9.53 5.36 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 49 A 8.88 5.14 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 50 L 9.19 5.12 0.00 1.90 1.85 1.12 0.47 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 51 L 8.95 4.87 0.00 1.52 1.80 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 52 D 9.04 5.54 0.00 3.12 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 53 T 8.45 4.75 4.23 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 0.90 0.00 0.00 54 P 0.00 4.69 0.00 2.16 2.17 0.00 3.51 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.94 0.00 55 I 7.83 4.09 1.91 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 1.39 0.86 0.93 0.00 0.00 56 N 7.54 5.39 0.00 2.99 2.88 0.00 0.00 6.81 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 57 D 8.73 4.25 0.00 2.67 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 58 A 7.88 3.80 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 59 Q 8.87 3.88 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 60 T 7.73 3.73 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 1.26 0.00 0.00 61 E 8.04 3.26 0.00 1.16 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 2.12 2.09 0.00 62 M 7.72 3.92 0.00 2.28 1.95 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 63 L 7.73 3.85 0.00 1.53 1.62 0.61 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 64 V 8.03 3.70 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.12 0.00 0.00 65 N 8.50 4.44 0.00 2.98 2.87 0.00 0.00 6.59 7.20 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 66 W 8.01 4.07 0.00 3.30 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 V 8.02 3.22 2.24 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 0.99 0.00 0.00 1.19 0.00 0.00 68 T 7.62 3.96 4.38 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 1.17 0.00 0.00 69 D 8.13 4.18 0.00 2.44 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 70 S 7.58 4.04 0.00 2.72 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 71 L 6.87 4.11 0.00 1.49 1.46 0.39 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 72 H 7.89 4.48 0.00 3.24 3.27 0.00 5.69 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.60 4.87 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 74 K 8.60 4.69 0.00 1.83 1.68 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.36 7.81 75 V 8.49 4.37 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 0.93 0.00 0.00 0.98 0.00 0.00 76 T 9.27 4.69 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 1.24 0.00 0.00 77 T 7.94 5.49 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 1.34 0.00 0.00 78 F 9.48 5.59 0.00 3.14 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 I 8.15 4.95 1.80 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 1.00 1.61 0.95 0.00 0.00 80 P 0.00 4.98 0.00 2.33 2.26 0.00 3.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.07 0.00 81 N 9.99 4.45 0.00 2.68 2.83 0.00 0.00 6.78 8.54 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 82 H 7.32 5.02 0.00 3.52 3.21 0.00 5.58 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 W 8.83 4.47 0.00 3.60 3.25 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 84 H 7.19 4.01 0.00 2.89 3.15 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.53 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 0.00 0.00 0.00 86 D 8.05 4.73 0.00 2.86 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 87 C 8.56 4.80 0.00 3.18 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 88 I 7.72 4.79 2.01 0.00 0.00 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 1.73 0.84 1.24 0.00 0.00 89 G 7.79 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 0.00 0.00 0.00 90 G 8.39 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.12 3.78 0.00 1.74 1.72 0.79 1.28 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 92 G 8.11 3.70 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 0.00 0.00 0.00 93 Y 8.13 4.07 0.00 3.04 3.15 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 94 L 7.71 3.59 0.00 1.71 1.52 0.25 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 95 Q 8.29 3.92 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 96 R 7.65 3.96 0.00 1.85 1.93 0.00 3.16 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 97 K 7.40 4.16 0.00 1.48 1.61 0.00 1.61 0.00 0.00 1.51 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.50 1.01 7.81 98 G 7.66 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 99 V 7.56 3.85 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.89 0.00 0.00 100 Q 8.95 4.79 0.00 2.27 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.51 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 101 S 8.76 5.96 0.00 4.11 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 0.00 102 Y 8.44 5.30 0.00 2.99 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 9.27 4.63 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 0.00 104 N 8.42 3.42 0.00 2.39 2.46 0.00 0.00 6.49 6.69 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 0.00 105 Q 8.61 3.90 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.56 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 106 M 7.90 3.92 0.00 1.95 1.79 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 107 T 7.47 4.39 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 1.32 0.00 0.00 108 I 7.49 3.69 2.00 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 1.62 0.72 0.88 0.00 0.00 109 D 8.14 4.28 0.00 2.73 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 0.00 110 L 7.88 3.65 0.00 1.69 0.93 0.87 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.25 4.03 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.25 3.88 0.00 1.92 1.82 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.57 7.81 113 E 8.16 4.05 0.00 2.01 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 2.31 2.14 0.00 114 K 7.50 4.37 0.00 1.69 1.80 0.00 0.97 0.00 0.00 1.00 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 1.22 7.81 115 G 7.75 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 0.00 116 L 7.78 4.61 0.00 1.82 1.70 1.23 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.27 0.00 2.07 2.01 0.00 3.71 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 2.06 2.11 0.00 118 V 8.08 4.33 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 0.87 0.00 0.00 1.01 0.00 0.00 119 P 0.00 4.51 0.00 2.12 2.07 0.00 3.77 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 2.13 2.28 0.00 120 E 8.55 4.02 0.00 1.63 1.41 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 2.21 2.17 0.00 121 H 8.35 4.87 0.00 3.11 3.29 0.00 5.57 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 9.08 5.09 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 0.00 123 F 8.56 5.34 0.00 3.07 3.15 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 0.00 124 T 8.89 4.21 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 1.19 0.00 0.00 125 D 7.81 5.20 0.00 2.93 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 0.00 126 S 7.85 4.99 0.00 3.47 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 0.00 127 L 7.93 4.26 0.00 1.16 0.32 0.87 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 128 T 8.28 4.70 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 129 V 8.41 3.71 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 0.48 0.00 0.00 0.16 0.00 0.00 130 S 8.36 4.74 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 0.00 131 L 9.12 4.23 0.00 1.67 1.64 0.91 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 0.00 132 D 9.37 4.22 0.00 2.99 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 0.00 133 G 8.05 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 M 7.93 4.40 0.00 2.19 1.92 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 135 P 0.00 4.75 0.00 2.08 2.00 0.00 3.70 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 1.92 1.97 0.00 136 L 8.89 4.53 0.00 1.65 1.52 0.91 0.83 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 0.00 137 Q 8.91 4.52 0.00 2.45 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 138 C 8.77 5.10 0.00 2.04 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 0.00 139 Y 9.06 5.34 0.00 3.06 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 0.00 140 Y 9.23 5.11 0.00 2.94 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 0.00 141 L 8.09 4.45 0.00 1.55 1.52 1.04 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 142 G 6.05 3.71 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 0.00 0.00 0.00 143 G 8.41 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 G 8.31 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 0.00 0.00 0.00 145 H 6.42 2.58 0.00 2.51 2.89 0.00 5.73 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.40 5.26 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 T 8.59 3.88 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 148 D 8.01 4.75 0.00 2.77 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 0.00 149 N 8.27 4.97 0.00 2.86 2.67 0.00 0.00 6.17 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 0.00 150 I 8.00 5.08 2.29 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.81 1.13 0.00 0.00 151 V 8.78 4.66 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 0.79 0.00 0.00 1.09 0.00 0.00 152 V 8.72 4.92 2.27 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 0.90 0.00 0.00 1.04 0.00 0.00 153 W 9.79 5.30 0.00 3.31 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 7.75 4.94 0.00 1.31 1.32 0.83 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 155 P 0.00 3.80 0.00 2.25 2.65 0.00 3.50 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.15 0.00 156 T 7.60 3.94 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 157 E 6.92 4.36 0.00 1.93 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 2.08 2.26 0.00 158 N 7.85 3.65 0.00 2.88 3.16 0.00 0.00 6.59 6.90 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 0.00 159 I 6.78 5.01 1.75 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.94 0.90 0.00 0.00 160 L 9.16 5.16 0.00 2.06 1.66 0.25 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 161 F 9.55 5.13 0.00 3.04 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 0.00 162 G 8.85 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 G 7.34 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 C 8.38 4.21 0.00 2.72 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 0.00 165 M 7.80 4.18 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.73 0.00 166 L 8.03 4.94 0.00 1.85 1.63 0.96 0.74 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 0.00 167 K 8.81 4.84 0.00 1.67 1.73 0.00 1.80 0.00 0.00 1.83 0.00 0.00 3.19 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.41 7.81 168 D 8.29 4.73 0.00 2.90 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 0.00 169 N 8.56 4.06 0.00 2.67 2.82 0.00 0.00 6.95 7.69 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 0.00 170 Q 8.09 4.10 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 171 A 7.53 4.21 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 0.00 172 T 8.39 4.59 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 1.27 0.00 0.00 173 S 7.60 4.82 0.00 3.95 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 0.00 174 I 8.20 3.49 1.61 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.23 0.40 0.00 0.00 175 G 7.15 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 0.00 176 N 8.68 4.14 0.00 2.55 2.76 0.00 0.00 6.67 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 0.00 177 I 8.10 4.45 1.85 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.66 0.91 0.00 0.00 178 S 8.16 4.22 0.00 4.10 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 0.00 179 D 7.98 5.14 0.00 2.62 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 0.00 180 A 7.84 4.51 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 0.00 181 D 8.58 4.77 0.00 2.68 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 0.00 182 V 8.39 3.94 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.03 0.00 0.00 183 T 7.99 4.10 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 1.27 0.00 0.00 184 A 8.23 4.23 1.56 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 0.00 0.00 0.00 0.00 0.00 0.00 185 W 8.36 4.52 0.00 3.61 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 0.00 186 P 0.00 4.25 0.00 2.21 2.05 0.00 3.91 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 187 K 8.10 3.99 0.00 1.88 2.07 0.00 1.60 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.59 7.81 188 T 7.90 3.88 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 189 L 8.25 4.11 0.00 1.90 1.76 0.80 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 190 D 7.99 4.32 0.00 2.94 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 0.00 191 K 7.79 3.87 0.00 1.76 1.90 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.35 7.81 192 V 8.15 3.64 2.27 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 1.07 0.00 0.00 1.02 0.00 0.00 193 K 8.04 3.89 0.00 2.03 1.92 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.46 7.81 194 A 7.73 4.00 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 0.00 195 K 7.45 3.51 0.00 1.34 0.94 0.00 1.18 0.00 0.00 0.81 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.52 7.81 196 F 7.62 4.51 0.00 2.86 2.38 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 0.00 197 P 0.00 4.30 0.00 2.14 2.12 0.00 3.60 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.85 0.00 198 S 7.88 4.52 0.00 4.12 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 0.00 199 A 7.51 4.56 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 R 9.42 4.31 0.00 1.73 2.16 0.00 3.13 0.00 0.00 3.19 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.30 0.00 201 Y 7.85 5.18 0.00 2.89 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 0.00 202 V 9.42 4.84 2.36 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 1.12 0.00 0.00 1.07 0.00 0.00 203 V 8.92 4.81 2.40 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 1.01 0.00 0.00 0.91 0.00 0.00 204 P 0.00 5.06 0.00 2.33 2.12 0.00 3.98 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 205 G 8.22 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 H 8.12 5.07 0.00 3.11 3.16 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 G 8.79 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 0.00 208 D 8.10 4.38 0.00 2.57 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 0.00 0.00 0.00 0.00 209 Y 7.71 4.60 0.00 3.14 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 G 9.51 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 0.00 211 G 9.80 4.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 T 8.79 4.23 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 1.31 0.00 0.00 213 E 8.18 4.07 0.00 2.19 2.27 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 2.52 2.34 0.00 214 L 7.94 4.15 0.00 1.86 1.83 1.04 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 215 I 7.68 3.75 2.02 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 1.46 0.89 0.94 0.00 0.00 216 E 8.09 3.90 0.00 2.08 1.95 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 2.37 2.42 0.00 217 H 8.32 4.10 0.00 3.33 3.53 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 T 8.00 3.70 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 1.17 0.00 0.00 219 K 7.87 3.74 0.00 1.94 1.93 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.43 7.81 220 Q 8.07 3.93 0.00 2.28 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 221 I 7.46 3.58 1.77 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.46 0.73 0.00 0.00 222 V 7.62 3.27 1.64 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 0.76 0.00 0.00 -0.54 0.00 0.00 223 N 8.20 4.31 0.00 2.84 2.80 0.00 0.00 7.01 6.92 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 0.00 224 Q 8.45 3.97 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 225 Y 8.16 3.89 0.00 3.09 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 I 7.60 3.73 2.04 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.02 0.91 0.00 0.00 227 E 7.94 4.01 0.00 2.20 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 228 S 7.95 4.24 0.00 3.96 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 6.98 4.54 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 230 S 8.39 4.52 0.00 3.82 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 *231 K 7.70 4.68 0.00 1.78 1.56 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.36 1.07 7.81 * Residues marked with a * may have inaccurate shift predictions.