NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 D 4.5981 8.2233 120.1887 53.2507 41.2059 175.7274 -1 P 4.1123 0.0000 0.0000 64.4691 31.0073 176.6690 0 M 3.9036 8.2293 116.4312 58.9120 33.1033 177.9474 1 V 3.6692 7.9050 117.2126 65.3667 31.5463 177.7522 2 S 4.2511 8.0576 113.2372 60.7100 61.9935 175.6106 3 K 3.9211 7.4234 121.6915 59.7413 32.1571 178.7182 4 G 3.7782 7.9841 105.2778 47.4968 0.0000 174.9473 5 E 4.0385 7.8332 120.4929 59.4545 29.4189 178.8531 6 E 4.0285 8.3099 117.4892 59.3754 29.5618 179.0235 7 L 3.8962 7.5700 117.3326 56.1944 41.5550 177.6615 8 F 4.9315 7.9083 116.8448 57.2571 39.5775 177.2197 9 T 3.9151 8.1328 111.7603 63.3380 68.9274 173.5286 10 G 4.3448 7.2191 110.4046 43.4984 0.0000 171.4820 11 V 4.1393 8.3967 119.3532 62.6826 32.2962 176.1999 12 V 4.5610 8.9416 128.3752 60.4243 33.9203 173.1546 13 P 4.9020 0.0000 0.0000 62.7119 32.8787 175.2144 14 I 5.0852 8.7496 123.4312 59.4247 41.0483 174.2118 15 L 5.1133 8.9503 127.7500 53.1930 45.3728 175.1424 16 V 5.0746 8.9832 125.5571 61.2060 35.0451 173.9363 17 E 5.2598 9.3144 126.0319 54.5445 33.6472 174.3817 18 L 5.2529 9.3350 125.6615 53.4608 45.7507 174.4691 19 D 4.9920 8.9553 126.1225 52.4600 43.3394 175.6455 20 G 3.4620 8.3956 110.2610 44.1326 0.0000 171.0623 21 D 5.1833 8.4620 120.4613 52.5993 45.2425 174.0743 22 V 4.7380 8.8108 125.5376 61.3943 34.3715 175.1932 23 N 4.2678 10.1999 127.5789 54.4605 36.6681 175.7071 24 G 3.8287 8.4700 104.2565 45.8574 0.0000 174.2036 25 H 4.5029 8.1864 118.2986 54.8856 28.0947 174.3968 26 K 4.9873 8.4645 124.7733 55.9200 33.0346 176.5945 27 F 5.0771 8.5953 117.8960 55.9740 41.7332 173.1988 28 S 5.1916 8.9667 114.9102 56.9353 67.1907 173.3205 29 V 5.1258 9.0307 121.7687 61.5267 35.2339 174.2306 30 S 5.4226 9.1776 122.7581 56.8868 66.3389 173.3388 31 G 4.0864 9.1939 109.4131 44.9574 0.0000 171.0831 32 E 4.9630 7.9492 118.7983 54.6904 34.3973 175.5804 33 G 4.0922 7.8714 109.3758 46.1497 0.0000 171.6440 34 E 5.0089 8.0695 119.8365 55.0303 33.6685 174.9803 35 G 3.5294 8.9697 107.4754 44.3793 0.0000 171.3717 36 D 5.0588 9.3399 122.2611 51.6599 41.9317 175.6307 37 A 4.4806 9.0167 127.4557 54.9279 19.0621 180.1635 38 T 3.7154 8.1308 111.7666 66.2992 68.4574 174.4679 39 Y 4.4888 7.8663 115.3634 56.8417 38.7494 175.4528 40 G 4.3154 7.9662 108.2642 46.5581 0.0000 172.9079 41 K 4.6665 8.1626 120.3220 54.1259 34.7704 174.8239 42 L 5.0437 8.3541 125.7243 53.2158 46.4814 175.6523 43 T 4.8409 8.5038 117.9676 61.8918 72.1525 173.0552 44 L 5.0002 8.9920 125.9668 52.7193 46.6596 175.3795 45 K 4.7761 8.4512 122.9784 54.5234 35.4766 174.7142 46 F 5.0160 9.1138 125.5364 55.6042 42.4217 174.3225 47 I 5.0397 8.9317 123.1875 59.5849 40.7785 174.1951 48 C 5.1447 9.6174 128.4218 59.3888 31.6022 173.3656 49 T 4.4339 9.0250 116.5669 62.1329 69.0292 175.2310 50 T 4.5368 7.7285 111.1932 61.3858 70.2054 173.7119 51 G 4.1001 7.9526 106.8309 44.4156 0.0000 175.6426 52 K 4.1764 8.6207 126.8198 55.5451 32.6661 176.1422 53 L 3.7303 9.0770 129.5003 54.3261 42.2149 175.3514 54 P 4.3456 0.0000 0.0000 63.3277 31.6162 175.8214 55 V 4.1086 6.3192 110.9688 58.6260 35.7987 173.3418 56 P 4.3835 0.0000 0.0000 62.1656 32.0958 177.4505 57 W 4.5097 9.1166 123.7944 59.9660 28.9474 176.8719 58 P 4.6147 0.0000 0.0000 65.8119 30.5304 178.4142 59 T 4.2692 7.9272 107.3403 63.6570 69.0530 175.6313 60 L 4.2736 7.8440 120.8530 54.5988 41.9025 178.1667 61 V 3.5754 7.4578 119.3374 66.5004 31.4503 177.7576 62 T 4.0319 7.9196 107.2103 64.8022 68.7864 176.3407 63 T 4.0969 7.5792 117.7420 66.1158 69.5049 177.0123 64 F 4.8352 7.6991 120.1538 56.9141 37.7382 175.9309 *68 L 4.3804 7.6161 114.6401 54.8404 43.3517 179.2168 69 M 3.8933 7.9609 119.3980 57.9939 32.3078 178.9132 70 C 4.0784 7.5723 111.9404 60.1584 30.0198 174.3091 71 F 4.4958 8.3299 118.8022 57.2542 38.8976 175.1964 72 A 4.3548 7.6384 123.6268 52.2725 19.0832 177.6886 73 R 4.2252 8.8646 122.7180 56.2583 31.1967 174.8417 74 Y 4.4304 8.5613 125.0284 55.6661 38.9809 174.2709 75 P 4.3249 0.0000 0.0000 62.4591 32.4926 176.7954 76 D 4.3379 8.8073 120.0564 57.7096 41.2018 178.2728 77 H 4.3783 8.2710 112.8623 57.8140 28.7020 175.5701 78 M 4.7702 8.0222 119.3081 54.9351 32.9157 177.6322 79 K 3.9371 8.0168 121.0963 59.5588 32.2312 178.6920 80 Q 4.1499 7.9809 115.1411 57.4596 28.6962 175.9754 81 H 4.6682 8.0937 114.7215 55.5221 29.0570 175.2476 82 D 3.6328 6.9415 121.1668 52.0725 39.8036 176.3703 83 F 3.8379 8.0112 126.6067 60.5319 39.3362 176.1650 84 F 3.9452 7.4326 115.9116 60.6337 39.1025 177.4024 85 K 4.1743 8.1831 118.0370 59.0366 31.6065 179.5476 86 S 4.0239 7.4454 113.8778 61.1529 62.9709 175.9274 87 A 4.0512 7.5622 122.9316 52.9221 18.2896 177.2540 88 M 4.6704 7.2998 117.1850 54.1985 33.1346 174.8516 89 P 4.8441 0.0000 0.0000 64.0607 32.3029 178.0894 90 E 3.8632 8.1376 118.7796 57.9589 29.7783 176.6735 91 G 3.8099 9.2852 104.4582 44.3292 0.0000 171.1360 92 Y 5.4142 7.9247 114.8519 55.4690 42.1586 174.2349 93 V 4.7257 9.1368 121.2419 61.8349 33.6249 174.2333 94 Q 5.3111 9.2904 129.2162 54.5211 31.4791 173.8477 95 E 5.3109 9.3657 125.8473 54.7788 33.2886 175.3162 96 R 5.8572 8.8637 120.6697 53.8750 35.2873 174.0516 97 T 4.8960 8.4893 116.8833 61.8115 72.0414 173.0656 98 I 4.5146 8.5825 126.6023 59.4665 40.4902 174.3990 99 F 4.6844 8.7417 126.9298 55.8541 40.9201 175.1941 100 F 4.7346 8.8280 123.9332 55.9071 40.0260 175.5614 101 K 3.9672 8.5240 125.5497 58.3318 32.2235 175.7498 102 D 4.5011 8.9389 124.5532 54.9453 38.6342 172.7264 103 D 4.3739 7.8778 118.7241 53.9345 44.4272 173.6806 104 G 2.8080 7.5620 104.6747 45.3444 0.0000 172.1428 105 N 5.6218 8.0882 115.5535 51.3480 41.0830 173.1474 106 Y 5.5692 8.8038 118.1270 56.7981 40.8089 174.8237 107 K 5.1506 9.4132 122.2501 54.8637 35.6325 175.3922 108 T 5.1945 8.9970 115.0946 59.8551 72.5320 173.0923 109 R 5.0917 8.8755 122.7339 54.8651 33.3440 173.6397 110 A 5.3123 9.3449 127.7183 50.1903 23.1380 174.0964 111 E 4.9958 9.0568 119.5042 54.4636 32.7730 175.3208 112 V 4.7569 8.3760 124.7648 61.1858 33.9541 174.3451 113 K 4.6625 8.4575 125.8126 55.8178 36.3340 174.6742 114 F 4.6047 8.5166 119.8643 57.3527 40.0284 175.9379 115 E 4.5138 9.3423 123.3762 54.9999 30.8859 176.8282 116 G 3.8083 8.2584 116.8060 47.0278 0.0000 173.8933 117 D 4.5318 8.8360 123.2604 55.6921 41.3616 175.9503 118 T 4.6934 7.7985 117.0961 62.2198 70.5278 173.5858 119 L 4.0656 8.8513 128.8383 54.0274 43.6233 175.2227 120 V 4.7538 8.5697 126.8540 61.1046 34.3228 173.8397 121 N 5.3401 9.1111 125.9835 52.1462 41.4384 172.7925 122 R 5.1032 8.9307 126.4597 54.5534 32.6247 175.6706 123 I 5.1132 9.1884 124.5216 59.4700 41.5809 174.2554 124 E 5.1691 9.0766 124.2945 54.4646 32.9444 174.7706 125 L 5.1950 8.7895 125.3842 53.1294 45.8666 175.0954 126 K 5.0117 9.3038 124.9973 54.4957 35.8189 175.2421 127 G 4.9759 9.3862 112.1445 44.4917 0.0000 171.9191 128 I 5.0373 8.5575 116.8989 59.6627 41.5586 175.2076 129 D 4.3134 8.8494 120.6108 55.3851 37.9145 174.1211 130 F 4.4895 8.3332 117.4758 56.5334 39.9106 175.8323 131 K 4.2539 9.4269 124.9661 55.9263 32.2902 177.9205 132 E 3.9248 9.0995 124.6190 59.1087 29.4926 177.7208 133 D 4.7664 7.9796 114.8938 52.8204 39.8797 176.5576 134 G 3.9489 7.9355 110.7900 45.2041 0.0000 174.5321 135 N 4.3104 8.6102 115.1239 55.7367 38.7018 177.2276 136 I 3.7533 6.8890 117.6889 63.4848 37.7388 178.0564 137 L 3.9776 7.5793 120.3826 56.9676 41.8008 178.2682 138 G 3.7528 8.1304 106.2615 45.0964 0.0000 173.1720 139 H 3.9344 7.3948 115.8134 57.0984 26.2163 175.0322 140 K 4.7286 8.1943 115.6030 55.5607 33.6689 177.7329 141 L 4.8206 7.6558 120.2871 53.1292 43.1942 176.4756 142 E 4.1103 8.7067 122.3730 56.7621 30.0567 177.3652 143 Y 4.5569 8.5751 125.0324 55.3232 37.4503 173.8120 144 N 4.7000 7.4252 118.9158 53.1602 40.0640 173.6281 145 Y 4.1639 8.0978 114.8595 57.2947 41.5441 173.7316 146 N 4.7831 8.1976 124.4928 52.3851 40.0794 174.8268 147 S 4.7736 8.2542 116.5606 59.0396 64.1781 173.5768 148 H 4.9520 8.8577 119.0471 54.5134 33.2600 172.8146 149 N 5.0920 8.7535 119.8063 52.8613 39.8926 174.6020 150 V 3.9419 8.1416 121.1371 61.2110 34.5475 173.7917 151 Y 4.8717 8.2022 124.8126 56.8958 39.5631 174.5675 152 I 4.7596 8.9305 126.7915 59.9442 39.3890 174.9302 153 M 5.1795 8.9610 123.6042 52.9119 34.6347 174.9585 154 A 4.1871 8.6580 122.0716 52.4413 19.6636 177.1817 155 D 4.6470 8.8515 119.7617 51.9601 40.9975 176.1594 156 K 4.0264 8.3095 122.4491 58.9752 32.7809 179.5829 157 Q 4.0581 8.0958 116.5933 58.0525 28.7310 177.0086 158 K 4.3742 7.8286 114.4525 55.1222 32.6921 175.1836 159 N 4.2854 8.0086 116.4647 53.8226 38.6221 173.8697 160 G 3.6239 7.7147 105.8856 45.2739 0.0000 172.8763 161 I 5.0879 7.9078 115.8414 59.1032 41.6981 174.9367 162 K 5.1658 9.1033 121.6707 54.7929 36.2348 175.5997 163 V 5.1136 8.8334 121.6569 60.6129 35.2183 173.4203 164 N 5.4198 8.6535 125.1755 51.8422 42.5009 172.6566 165 F 4.8348 7.8179 118.2324 56.5009 41.7386 172.4748 166 K 4.9465 8.9869 118.8165 54.7188 34.7062 175.5720 167 I 4.1258 8.5844 125.1478 59.5014 39.8663 174.7353 168 R 4.7234 8.5161 125.0251 54.8829 31.9813 175.0983 169 H 4.7402 9.0010 122.7018 54.0966 30.5295 174.7627 170 N 4.8314 8.7935 121.3363 53.3710 39.9670 174.1131 171 I 4.8674 7.7460 122.4097 60.1373 40.1464 178.2948 172 E 3.6601 7.9529 123.8183 58.4430 30.7152 178.1392 173 D 4.9198 8.1254 114.5350 52.3173 40.2145 176.1920 174 G 3.9962 8.3886 108.6693 45.4953 0.0000 174.1733 175 S 4.4842 8.7725 115.2580 58.3085 63.8585 173.0147 176 V 4.8833 8.1451 114.8004 59.4872 35.3222 175.1521 177 Q 4.5457 8.9584 125.3543 54.6241 30.5531 174.6365 178 L 4.7760 8.5595 126.8316 54.3931 43.6351 176.0479 179 A 4.3242 8.9877 124.4935 50.1115 21.8202 174.4125 180 D 4.7168 9.0770 123.2037 54.2902 42.7756 174.8490 181 H 4.9360 8.6293 124.0020 54.1104 31.3615 173.4113 182 Y 4.7657 8.8067 120.1789 56.1442 41.1299 174.5040 183 Q 5.2452 9.3277 124.5714 54.6605 33.2148 173.6728 184 Q 5.0402 9.0871 122.4989 54.4024 33.8372 173.6769 185 N 6.2600 9.4485 119.2417 50.7829 42.6664 173.6325 186 T 5.1387 8.4678 111.2098 59.3064 72.6318 171.5218 187 P 4.9995 0.0000 0.0000 63.0497 31.7560 176.8171 188 I 3.8971 8.8666 124.5973 64.1097 37.2974 177.2576 189 G 3.9452 7.8289 107.5508 44.9306 0.0000 172.4329 190 D 4.6675 8.5292 116.5700 53.8890 41.7505 176.1056 191 G 4.0724 7.5165 106.9200 44.1931 0.0000 171.3097 192 P 4.3526 0.0000 0.0000 62.7402 31.6860 176.2496 193 V 4.5138 7.9487 114.4855 59.1427 35.5460 174.9725 194 L 4.1803 8.3212 121.6253 54.3458 42.0454 177.1376 195 L 4.5427 8.3144 123.5202 52.3744 42.1046 174.5729 196 P 4.6952 0.0000 0.0000 61.8880 32.4798 175.9488 197 D 4.6815 8.5559 119.4170 53.7381 41.6157 176.0107 198 N 4.8862 8.4864 118.6176 54.4428 39.3537 174.1321 199 H 4.9774 8.8218 117.5647 55.2507 32.6262 171.3589 200 Y 5.2629 8.5227 115.9062 55.3196 41.8533 174.1734 201 L 4.9965 8.8336 119.7150 53.1374 44.8990 175.7345 202 S 5.1096 9.1258 119.5777 57.2672 65.1765 172.6821 203 Y 5.0894 8.8249 122.5063 56.3224 40.7406 174.9107 204 Q 5.0356 9.1278 121.3075 54.4157 33.1555 174.4364 205 S 5.2313 8.9678 117.9547 56.7632 66.9849 173.1957 206 A 4.8039 9.2622 125.3953 50.1167 21.9733 174.7057 207 L 5.1818 8.5189 122.0617 53.2222 44.5537 175.9207 208 S 4.8571 8.9328 116.3204 57.7722 66.7332 172.6186 209 K 4.9650 8.5746 117.5826 54.8058 36.1258 175.6483 210 D 4.7672 8.7475 121.6464 51.8305 41.9892 175.6044 211 P 4.3254 0.0000 0.0000 65.3353 31.4596 176.7987 212 N 4.5176 8.2851 114.7334 53.4189 38.9050 174.2960 213 E 4.3001 7.8025 120.6124 54.8338 30.0320 175.8781 214 K 4.2612 8.4627 125.3216 57.4518 32.9372 177.4536 215 R 4.2530 8.0950 117.9885 55.3739 30.8512 175.5428 216 D 4.8163 8.6170 120.1040 54.9373 42.2815 174.7086 217 H 4.7660 8.4474 119.6947 55.2002 31.8488 172.3944 218 M 4.3963 8.1164 117.9149 53.5361 35.7346 173.3257 219 V 4.6418 8.6406 126.3273 61.3087 33.7562 174.0523 220 L 5.1469 9.1917 129.9160 53.1012 45.2015 174.4811 221 L 5.0354 8.8899 128.0669 53.3092 44.7821 174.8438 222 E 5.2675 8.8628 124.8279 54.5921 34.1696 174.6712 223 F 5.3199 9.2186 120.8357 55.8012 43.0689 174.2731 224 V 5.2429 8.8806 122.6558 60.7075 34.9298 174.0339 225 T 4.9628 8.1650 122.5804 61.6715 72.8848 172.8874 226 A 4.5015 8.4483 126.9949 51.7027 19.8581 176.3212 227 A 4.0397 8.3662 121.3965 51.1271 23.2279 177.1933 228 G 3.9117 8.9660 105.7370 45.3601 0.0000 173.5893 229 I 4.2850 7.1964 120.7130 59.4977 37.8695 175.7012 230 T 4.1150 8.4333 114.9374 61.8349 68.8474 174.5604 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 D 8.22 4.60 0.00 2.67 2.64 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 -1 P 0.00 4.11 0.00 2.26 2.07 0.00 3.65 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 2.10 2.19 0.00 0 M 8.23 3.90 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.63 0.00 1 V 7.90 3.67 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 0.90 0.00 0.00 0.86 0.00 0.00 2 S 8.06 4.25 0.00 3.98 3.81 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 0.00 0.00 0.00 0.00 3 K 7.42 3.92 0.00 1.80 1.81 0.00 1.83 0.00 0.00 1.79 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.44 7.81 4 G 7.98 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 0.00 0.00 0.00 5 E 7.83 4.04 0.00 2.26 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 0.00 2.34 2.39 0.00 6 E 8.31 4.03 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 7 L 7.57 3.90 0.00 1.47 0.83 0.66 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 8 F 7.91 4.93 0.00 3.16 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.13 3.92 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 1.28 0.00 0.00 10 G 7.22 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 0.00 0.00 0.00 0.00 11 V 8.40 4.14 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 0.81 0.00 0.00 0.99 0.00 0.00 12 V 8.94 4.56 2.64 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 1.33 0.00 0.00 1.15 0.00 0.00 13 P 0.00 4.90 0.00 2.13 1.95 0.00 3.88 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 14 I 8.75 5.09 1.74 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.87 0.92 0.00 0.00 15 L 8.95 5.11 0.00 1.69 1.45 0.97 0.94 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 16 V 8.98 5.07 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 1.28 0.00 0.00 1.09 0.00 0.00 17 E 9.31 5.26 0.00 1.91 1.81 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 0.00 2.24 2.39 0.00 18 L 9.34 5.25 0.00 1.93 1.76 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.96 4.99 0.00 2.55 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 20 G 8.40 3.46 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 0.00 21 D 8.46 5.18 0.00 2.62 2.42 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 22 V 8.81 4.74 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 0.60 0.00 0.00 0.94 0.00 0.00 23 N 10.20 4.27 0.00 2.96 2.93 0.00 0.00 7.12 8.37 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 24 G 8.47 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 H 8.19 4.50 0.00 3.31 3.29 0.00 5.61 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.46 4.99 0.00 1.66 1.74 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.37 1.60 7.81 27 F 8.60 5.08 0.00 3.01 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 28 S 8.97 5.19 0.00 3.83 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 29 V 9.03 5.13 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 1.37 0.00 0.00 1.31 0.00 0.00 30 S 9.18 5.42 0.00 3.82 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 31 G 9.19 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.95 4.96 0.00 1.72 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 2.15 2.15 0.00 33 G 7.87 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.07 5.01 0.00 1.95 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 2.09 2.17 0.00 35 G 8.97 3.53 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 36 D 9.34 5.06 0.00 2.72 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 37 A 9.02 4.48 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 38 T 8.13 3.72 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 0.51 0.00 0.00 39 Y 7.87 4.49 0.00 3.13 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 40 G 7.97 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 0.00 0.00 0.00 0.00 41 K 8.16 4.67 0.00 1.96 1.69 0.00 1.44 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.17 0.86 7.81 42 L 8.35 5.04 0.00 1.47 1.26 0.88 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.50 4.84 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 44 L 8.99 5.00 0.00 1.49 0.80 1.02 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.45 4.78 0.00 1.60 1.37 0.00 1.46 0.00 0.00 1.52 0.00 0.00 2.72 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.15 1.25 7.81 46 F 9.11 5.02 0.00 2.61 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 47 I 8.93 5.04 1.92 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 1.10 0.96 1.00 0.00 0.00 48 C 9.62 5.14 0.00 3.18 3.19 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 49 T 9.02 4.43 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 1.32 0.00 0.00 50 T 7.73 4.54 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 1.29 0.00 0.00 51 G 7.95 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.62 4.18 0.00 1.71 1.69 0.00 1.72 0.00 0.00 1.49 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.37 7.81 53 L 9.08 3.73 0.00 1.17 0.91 0.19 -1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.35 0.00 1.88 1.94 0.00 2.65 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.74 0.00 55 V 6.32 4.11 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.40 0.00 0.00 56 P 0.00 4.38 0.00 2.14 2.00 0.00 3.39 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 57 W 9.12 4.51 0.00 3.79 3.53 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 58 P 0.00 4.61 0.00 2.26 2.39 0.00 3.73 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.28 0.00 59 T 7.93 4.27 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 1.03 0.00 0.00 60 L 7.84 4.27 0.00 1.39 0.51 0.68 0.18 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 61 V 7.46 3.58 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 0.26 0.00 0.00 0.94 0.00 0.00 62 T 7.92 4.03 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 63 T 7.58 4.10 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 1.13 0.00 0.00 64 F 7.70 4.84 0.00 2.85 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 *68 L 7.62 4.38 0.00 1.96 2.14 1.05 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 69 M 7.96 3.89 0.00 0.61 0.83 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 70 C 7.57 4.08 0.00 2.34 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.33 4.50 0.00 3.27 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 72 A 7.64 4.35 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 R 8.86 4.23 0.00 2.10 1.79 0.00 3.03 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 74 Y 8.56 4.43 0.00 2.85 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 75 P 0.00 4.32 0.00 1.85 1.95 0.00 3.40 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 2.08 2.00 0.00 76 D 8.81 4.34 0.00 2.76 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.27 4.38 0.00 3.31 3.43 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 8.02 4.77 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.42 0.00 79 K 8.02 3.94 0.00 1.78 1.83 0.00 1.68 0.00 0.00 2.00 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.69 1.56 7.81 80 Q 7.98 4.15 0.00 1.86 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.12 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 81 H 8.09 4.67 0.00 3.28 3.26 0.00 5.64 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 6.94 3.63 0.00 1.58 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 0.00 0.00 0.00 0.00 83 F 8.01 3.84 0.00 3.06 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 7.43 3.95 0.00 3.12 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.18 4.17 0.00 1.68 1.84 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.42 1.20 7.81 86 S 7.45 4.02 0.00 3.84 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 87 A 7.56 4.05 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 88 M 7.30 4.67 0.00 2.41 2.45 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.14 3.02 0.00 89 P 0.00 4.84 0.00 2.28 2.19 0.00 3.70 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 2.06 1.92 0.00 90 E 8.14 3.86 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 91 G 9.29 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 7.92 5.41 0.00 3.42 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 93 V 9.14 4.73 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.02 0.00 0.00 94 Q 9.29 5.31 0.00 2.57 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.52 0.00 0.00 0.00 0.00 0.00 2.41 2.62 0.00 95 E 9.37 5.31 0.00 1.97 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 96 R 8.86 5.86 0.00 1.75 1.74 0.00 3.13 0.00 0.00 3.25 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.52 0.00 97 T 8.49 4.90 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 0.43 0.00 0.00 98 I 8.58 4.51 1.62 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 0.73 0.65 -0.01 0.00 0.00 99 F 8.74 4.68 0.00 2.96 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 0.00 100 F 8.83 4.73 0.00 3.18 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 0.00 101 K 8.52 3.97 0.00 1.73 1.79 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.49 7.81 102 D 8.94 4.50 0.00 2.88 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 0.00 103 D 7.88 4.37 0.00 2.68 2.56 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 0.00 104 G 7.56 2.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 8.09 5.62 0.00 2.50 2.67 0.00 0.00 7.35 7.58 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 0.00 106 Y 8.80 5.57 0.00 2.90 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 0.00 107 K 9.41 5.15 0.00 1.63 1.67 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.46 7.81 108 T 9.00 5.19 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 0.00 109 R 8.88 5.09 0.00 1.90 1.78 0.00 3.06 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 110 A 9.34 5.31 1.35 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 0.00 0.00 111 E 9.06 5.00 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 112 V 8.38 4.76 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 0.75 0.00 0.00 0.95 0.00 0.00 113 K 8.46 4.66 0.00 2.07 1.78 0.00 1.37 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.27 1.38 7.81 114 F 8.52 4.60 0.00 2.94 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 0.00 115 E 9.34 4.51 0.00 1.95 1.89 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 2.22 2.36 0.00 116 G 8.26 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 8.84 4.53 0.00 2.71 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 0.00 118 T 7.80 4.69 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 1.26 0.00 0.00 119 L 8.85 4.07 0.00 1.24 1.61 0.99 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.57 4.75 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 0.88 0.00 0.00 0.92 0.00 0.00 121 N 9.11 5.34 0.00 2.93 2.76 0.00 0.00 6.81 7.27 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 0.00 122 R 8.93 5.10 0.00 1.80 1.83 0.00 3.12 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 123 I 9.19 5.11 1.94 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 1.32 1.16 0.93 0.00 0.00 124 E 9.08 5.17 0.00 1.85 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 2.19 2.21 0.00 125 L 8.79 5.19 0.00 1.50 1.20 0.39 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.30 5.01 0.00 1.66 1.67 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.49 7.81 127 G 9.39 4.98 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 0.00 128 I 8.56 5.04 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 1.28 0.74 0.99 0.00 0.00 129 D 8.85 4.31 0.00 2.77 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.33 4.49 0.00 3.24 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 0.00 131 K 9.43 4.25 0.00 1.82 1.77 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.51 7.81 132 E 9.10 3.92 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 133 D 7.98 4.77 0.00 2.77 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 0.00 134 G 7.94 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 0.00 0.00 0.00 135 N 8.61 4.31 0.00 2.88 2.87 0.00 0.00 6.82 7.29 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 0.00 136 I 6.89 3.75 1.73 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 -0.03 0.30 0.00 0.00 137 L 7.58 3.98 0.00 1.74 1.61 0.97 0.62 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 0.00 138 G 8.13 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 0.00 0.00 0.00 139 H 7.39 3.93 0.00 3.28 3.31 0.00 5.64 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 0.00 140 K 8.19 4.73 0.00 1.78 1.81 0.00 1.88 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.25 7.81 141 L 7.66 4.82 0.00 1.55 1.62 0.82 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 142 E 8.71 4.11 0.00 2.12 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 143 Y 8.58 4.56 0.00 3.05 2.95 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 0.00 144 N 7.43 4.70 0.00 2.84 2.82 0.00 0.00 6.12 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 0.00 145 Y 8.10 4.16 0.00 2.92 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 0.00 146 N 8.20 4.78 0.00 2.51 2.52 0.00 0.00 7.12 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 0.00 147 S 8.25 4.77 0.00 3.77 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 0.00 148 H 8.86 4.95 0.00 3.10 3.09 0.00 5.80 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 N 8.75 5.09 0.00 2.21 2.04 0.00 0.00 6.72 7.68 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 0.00 150 V 8.14 3.94 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 0.86 0.00 0.00 0.01 0.00 0.00 151 Y 8.20 4.87 0.00 3.21 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 I 8.93 4.76 1.64 0.00 0.00 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 1.42 0.67 0.93 0.00 0.00 153 M 8.96 5.18 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.63 0.00 154 A 8.66 4.19 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 0.00 155 D 8.85 4.65 0.00 2.66 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.31 4.03 0.00 1.85 1.84 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.46 7.81 157 Q 8.10 4.06 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 158 K 7.83 4.37 0.00 1.78 1.80 0.00 1.93 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 159 N 8.01 4.29 0.00 2.84 2.89 0.00 0.00 6.84 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 G 7.71 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 I 7.91 5.09 1.71 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.92 0.31 0.00 0.00 162 K 9.10 5.17 0.00 1.66 1.85 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.34 7.81 163 V 8.83 5.11 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 1.61 0.00 0.00 1.07 0.00 0.00 164 N 8.65 5.42 0.00 2.81 2.67 0.00 0.00 6.81 7.71 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 0.00 165 F 7.82 4.83 0.00 3.06 3.05 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 0.00 166 K 8.99 4.95 0.00 1.64 1.70 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.37 7.81 167 I 8.58 4.13 1.73 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.10 0.46 0.00 0.00 168 R 8.52 4.72 0.00 1.69 1.84 0.00 3.24 0.00 0.00 3.23 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 169 H 9.00 4.74 0.00 3.17 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.79 4.83 0.00 2.83 2.75 0.00 0.00 6.91 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 I 7.75 4.87 2.06 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.91 1.03 0.00 0.00 172 E 7.95 3.66 0.00 2.03 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.32 0.00 173 D 8.13 4.92 0.00 2.75 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 0.00 174 G 8.39 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 0.00 0.00 0.00 175 S 8.77 4.48 0.00 4.03 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 0.00 176 V 8.15 4.88 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.94 0.00 0.00 177 Q 8.96 4.55 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.99 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 178 L 8.56 4.78 0.00 1.65 1.54 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 179 A 8.99 4.32 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 D 9.08 4.72 0.00 2.72 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 0.00 181 H 8.63 4.94 0.00 1.75 2.17 0.00 5.80 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.81 4.77 0.00 3.01 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 0.00 183 Q 9.33 5.25 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.75 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 184 Q 9.09 5.04 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 185 N 9.45 6.26 0.00 2.32 2.65 0.00 0.00 6.38 6.72 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 0.00 186 T 8.47 5.14 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 1.29 0.00 0.00 187 P 0.00 5.00 0.00 2.25 2.11 0.00 3.83 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 2.16 2.35 0.00 188 I 8.87 3.90 2.15 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 1.29 0.56 0.95 0.00 0.00 189 G 7.83 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 0.00 0.00 0.00 190 D 8.53 4.67 0.00 2.63 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 0.00 191 G 7.52 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 0.00 192 P 0.00 4.35 0.00 2.04 2.00 0.00 3.62 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 2.02 2.10 0.00 193 V 7.95 4.51 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 0.75 0.00 0.00 1.13 0.00 0.00 194 L 8.32 4.18 0.00 1.57 1.65 0.84 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 195 L 8.31 4.54 0.00 1.63 1.63 0.93 1.04 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 0.00 196 P 0.00 4.70 0.00 2.35 2.30 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 197 D 8.56 4.68 0.00 2.61 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 0.00 198 N 8.49 4.89 0.00 2.65 2.85 0.00 0.00 6.73 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 0.00 199 H 8.82 4.98 0.00 3.33 3.36 0.00 5.20 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.52 5.26 0.00 2.79 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 0.00 201 L 8.83 5.00 0.00 1.69 1.46 1.01 1.08 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 0.00 202 S 9.13 5.11 0.00 3.85 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 0.00 203 Y 8.82 5.09 0.00 3.13 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Q 9.13 5.04 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 205 S 8.97 5.23 0.00 3.63 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 A 9.26 4.80 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 0.00 207 L 8.52 5.18 0.00 0.91 0.91 0.68 0.72 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 0.00 208 S 8.93 4.86 0.00 3.90 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 0.00 209 K 8.57 4.97 0.00 1.60 1.70 0.00 1.38 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.23 1.15 7.81 210 D 8.75 4.77 0.00 2.60 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 P 0.00 4.33 0.00 2.20 2.17 0.00 3.79 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 212 N 8.29 4.52 0.00 2.81 2.86 0.00 0.00 6.87 7.18 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 0.00 213 E 7.80 4.30 0.00 1.84 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 1.85 2.27 0.00 214 K 8.46 4.26 0.00 1.78 1.84 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.38 7.81 215 R 8.10 4.25 0.00 1.93 1.93 0.00 3.20 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 216 D 8.62 4.82 0.00 2.95 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 0.00 217 H 8.45 4.77 0.00 3.16 3.17 0.00 5.56 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 8.12 4.40 0.00 1.44 0.98 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.37 0.00 219 V 8.64 4.64 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 0.91 0.00 0.00 0.91 0.00 0.00 220 L 9.19 5.15 0.00 1.86 1.69 0.85 0.51 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 0.00 221 L 8.89 5.04 0.00 1.71 1.46 0.52 0.99 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 0.00 222 E 8.86 5.27 0.00 1.83 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 223 F 9.22 5.32 0.00 2.91 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 0.00 224 V 8.88 5.24 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 0.52 0.00 0.00 0.17 0.00 0.00 225 T 8.17 4.96 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 1.11 0.00 0.00 226 A 8.45 4.50 0.12 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 0.00 227 A 8.37 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 8.97 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 0.00 229 I 7.20 4.29 1.83 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 1.44 0.72 0.89 0.00 0.00 230 T 8.43 4.11 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 1.25 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.