NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3789 8.3349 115.4117 57.8974 65.1064 173.8868 3 K 3.6037 8.1602 120.1827 56.1794 32.2140 175.3990 4 L 3.8862 7.7925 123.7854 55.1109 43.1173 176.1111 5 D 4.8937 8.8455 122.5022 52.6996 42.7334 176.3484 6 L 4.1844 8.7170 127.9034 56.9548 42.6578 177.5793 7 N 4.4896 8.2322 113.6639 54.4983 38.7378 175.0108 8 A 4.6212 7.7352 120.5450 52.7627 20.9630 178.7123 9 L 4.0881 7.4335 115.3179 57.6931 41.8074 178.6387 10 N 4.5826 8.2525 114.3917 54.6205 38.7202 175.2327 11 E 4.6443 7.6011 117.4380 55.9251 29.8724 175.6867 12 L 4.7973 7.2707 116.3861 51.4562 45.7034 175.4270 13 P 4.4915 0.0000 0.0000 62.1205 33.4573 177.6631 14 K 4.0130 8.5183 119.2305 59.3768 32.0178 178.8948 15 V 3.7906 7.6499 119.0349 64.4818 31.9246 178.0134 16 D 4.4104 7.9975 118.9359 56.6616 40.6287 178.5760 17 R 3.8219 7.8337 119.1082 59.5693 30.1217 178.5180 18 I 3.8698 7.6551 117.6464 63.5109 37.6547 177.8673 19 L 4.0487 7.6757 119.2016 57.4118 42.0300 178.6376 20 A 4.1568 8.3289 121.0169 55.3145 18.3837 179.7743 21 L 4.1468 8.5125 117.4050 57.4042 41.6252 179.3605 22 A 4.0512 7.6550 121.4012 55.3522 18.0052 179.5136 23 E 3.9495 7.6699 114.7251 59.5507 29.8116 179.3338 24 T 4.0840 7.6549 115.4300 66.4486 68.8597 176.6843 25 N 4.1866 8.5636 118.6024 56.0995 38.2743 177.2103 26 A 3.9754 7.8589 121.5089 54.9278 18.6354 178.8525 27 E 4.0130 7.8637 117.6535 59.0441 29.7128 178.6697 28 L 3.8045 7.3723 118.1527 57.1057 41.4243 178.7165 29 E 4.0551 7.9404 119.1133 58.3433 29.7695 177.6744 30 K 4.1965 7.5909 116.6212 57.6281 32.6683 177.1486 31 L 4.3727 7.1324 117.0919 53.7941 42.7277 176.5132 32 D 4.8256 8.2765 120.5682 52.2846 42.3379 177.0112 33 A 4.0150 8.9248 121.0257 55.8044 18.1215 179.7592 34 E 4.0827 8.4599 116.4479 59.4214 29.6398 179.6428 35 G 3.6801 8.1265 105.4542 47.6906 0.0000 175.9742 36 R 4.0571 8.2604 120.4631 59.0470 30.0230 179.2738 37 V 3.8599 7.8648 117.6339 65.9919 31.3243 177.8865 38 A 3.9607 7.9388 119.2651 54.9538 18.3163 179.0496 39 W 4.1528 8.8548 127.0542 60.6387 30.3073 178.0695 40 A 3.9182 8.8218 121.0322 54.9064 17.5953 179.2346 41 L 3.4438 7.8401 117.2746 56.8192 43.0849 178.0384 42 D 4.7055 7.0758 115.9863 51.6139 41.2102 173.4182 43 N 4.5176 7.5227 116.6332 52.7903 45.6112 174.4249 44 L 4.4931 6.8717 117.1956 51.8317 44.5804 174.7337 45 P 4.6432 0.0000 0.0000 61.8921 33.8476 175.2135 46 G 3.6216 8.4148 105.4476 45.7616 0.0000 172.8298 47 E 3.7002 8.5339 116.4133 57.3998 26.9797 173.4760 48 Y 5.2548 8.6589 121.2185 56.5545 39.5774 175.9149 49 V 4.7199 8.8465 117.7774 59.5846 35.6112 175.0471 50 L 5.6524 9.2792 124.9784 52.3392 43.8181 174.6950 51 S 5.1200 9.1034 120.5595 57.6852 64.1340 173.5244 52 S 4.9203 9.0143 118.3810 56.6235 65.0302 173.6474 53 S 4.6437 8.8613 117.0333 57.5522 64.5676 173.7309 54 F 3.8599 7.4707 119.1324 58.7600 36.9833 174.7037 55 G 4.2178 7.5456 113.6220 45.2486 0.0000 174.9976 56 I 3.7980 8.3758 121.3389 63.7099 37.1206 176.7547 57 Q 5.2694 7.7612 117.3010 55.0202 29.4040 177.1379 58 A 3.8773 8.4767 123.0126 56.0376 18.5066 179.4945 59 A 3.9674 8.3816 118.9490 56.0595 18.1392 179.0878 60 V 3.5591 7.6524 117.1244 65.5299 31.4063 178.0688 61 S 3.8039 7.6137 112.9083 61.4565 62.8670 176.4301 62 L 3.8439 7.8276 122.4019 57.7204 41.3488 178.8954 63 H 4.1654 8.0601 117.6188 59.3006 29.9021 176.7537 64 L 3.8669 8.0410 122.1578 58.4035 41.8797 179.1699 65 V 3.3857 7.8876 118.1705 65.8509 31.2190 177.6262 66 N 4.5158 8.2684 117.8927 56.0267 38.8507 176.3996 67 Q 4.0677 8.0434 120.4532 59.0914 29.2100 177.9579 68 I 4.0591 7.4108 119.6846 62.7872 37.5091 176.2671 69 R 4.3429 8.1217 122.8815 53.2516 30.9520 172.5068 70 P 4.4111 0.0000 0.0000 63.8914 32.2454 176.2766 71 D 4.3522 7.7435 120.0392 55.2712 38.9307 174.0964 72 I 4.0796 7.4145 116.9769 59.3929 39.3755 172.7626 73 P 4.5430 0.0000 0.0000 63.3759 31.7902 174.7528 74 V 5.1015 8.5945 125.4768 61.2108 32.8054 174.7664 75 I 4.7386 8.3443 130.0353 60.6514 38.6573 174.7535 76 L 5.1153 9.3898 130.3862 53.4815 44.1546 175.2763 77 T 5.3331 8.5706 117.5336 60.1076 68.4745 172.5710 78 D 4.6105 8.5463 128.6931 54.7348 41.5725 176.5049 79 T 3.9024 8.7355 117.9647 63.7876 69.1195 175.1272 80 G 4.0414 8.5867 108.8504 45.5512 0.0000 173.2426 81 Y 4.8530 7.8931 116.9119 57.4989 38.8007 175.7731 82 L 4.1253 8.0531 118.3653 53.9186 42.8581 177.3236 83 F 4.1043 7.9461 118.7557 56.9363 39.6593 174.9509 84 P 4.5626 0.0000 0.0000 65.9991 31.1014 178.7390 85 E 4.2062 8.3051 115.1292 59.1115 29.5726 179.1726 86 T 4.1070 8.1215 117.7176 66.7431 68.5973 176.2834 87 Y 4.2238 7.7698 118.1107 61.4016 38.1062 178.9082 88 R 4.2823 8.1018 118.2457 59.0365 30.0662 178.9241 89 F 4.3985 8.1178 120.6912 60.9902 39.3232 177.4806 90 I 3.4989 7.8555 119.5882 64.5145 36.7766 178.2117 91 D 4.7279 8.5145 121.0439 56.3420 40.5127 178.5433 92 E 4.0683 8.0756 120.1987 58.8661 29.4241 178.6447 93 L 3.8519 7.6269 119.2267 58.0945 41.6846 179.3620 94 T 3.6575 8.4323 109.9893 64.8959 68.0551 175.3544 95 D 4.3738 7.3599 119.6596 56.3134 41.5565 177.9838 96 K 4.0760 7.7867 119.4347 59.2337 32.4393 177.7429 97 L 4.2130 8.8741 117.1902 54.3620 42.3795 176.4709 98 K 3.9033 7.7820 117.4678 56.8994 28.6337 173.7238 99 L 4.6606 8.1415 119.2458 52.9082 44.5814 177.2978 100 N 4.6852 8.5165 121.8192 52.3437 37.9309 172.0963 101 L 4.6347 8.0481 123.8321 54.4254 43.5915 175.7256 102 K 4.4627 9.4849 126.3512 54.7440 34.3771 175.0645 103 V 4.5487 8.1187 125.6556 62.0260 32.9141 175.0234 104 Y 4.6032 9.2269 125.5827 56.4000 40.6064 175.0474 105 R 5.2183 8.5574 120.9560 53.2597 32.5017 175.1725 106 A 4.2196 8.3926 122.2532 52.5905 18.7478 177.4383 107 T 4.0970 8.2421 114.7273 65.2121 68.8345 175.1294 108 E 4.3335 7.5756 117.2331 53.5155 32.7054 175.9234 109 S 4.6165 8.5987 115.0549 57.0879 66.3093 174.7011 110 A 4.1521 8.6499 123.3668 54.9606 18.0187 179.6208 111 A 4.0779 8.0313 118.7088 54.8505 18.4413 179.5154 112 W 4.0804 7.9544 126.4679 60.9297 30.8351 178.3141 113 Q 4.2731 8.9894 118.3900 59.1749 28.2265 178.6207 114 E 4.3463 9.0899 120.3605 58.0093 29.2482 178.6659 115 A 4.2842 7.6064 119.4996 53.9315 19.6224 179.0727 116 R 3.8789 8.3139 116.8880 59.0175 30.2583 176.9533 117 Y 4.7005 7.5968 112.8407 61.8596 40.8021 173.9963 118 G 4.3293 8.6542 104.8765 44.2485 0.0000 173.3215 119 K 2.8225 8.1096 115.2361 54.3450 30.2675 176.7925 120 L 3.8821 7.5098 124.3290 57.3739 41.6381 178.6767 121 W 4.2402 7.6524 114.9832 58.9958 28.2504 177.3821 122 E 4.2520 7.6118 118.9238 57.5801 28.9120 176.7858 123 Q 4.4127 7.7365 118.5164 56.0571 29.3766 177.5395 124 G 3.9915 7.7783 109.5466 45.1810 0.0000 175.1636 125 V 3.6248 8.3374 110.7020 64.6581 31.4557 178.1825 126 E 4.1961 8.2685 118.5659 59.1565 29.4533 178.9741 127 G 3.5774 7.7284 105.6078 47.8029 0.0000 175.9235 128 I 3.9398 7.9314 122.2134 63.9334 36.9670 178.5013 129 E 3.9954 8.6751 120.1272 59.3859 29.4302 179.2701 130 K 3.8831 8.2518 119.7039 59.3694 32.1308 178.3366 131 Y 4.0408 8.1656 119.9936 60.9369 38.8005 177.6935 132 N 4.2533 8.9420 117.6617 55.9678 38.5687 177.0996 133 D 4.2463 8.3504 120.0958 57.2260 41.1804 177.8719 134 I 4.0755 7.4902 117.2609 62.8772 38.1231 176.5220 135 N 4.6329 7.9420 115.8876 53.4710 39.4535 175.1121 136 K 4.3481 7.4832 116.4284 57.8305 34.4065 177.9540 137 V 3.5185 7.8119 118.3223 65.9540 31.3234 177.3407 138 E 3.8474 8.9002 118.7527 59.1123 29.6209 177.4478 139 P 4.2416 0.0000 0.0000 65.6917 31.3603 178.3414 140 M 3.7074 7.8729 116.8999 58.6485 32.2515 178.0788 141 N 4.1789 8.2283 116.7841 56.1176 38.5362 177.2728 142 R 3.8934 7.9639 119.9384 58.7323 30.1704 178.3766 143 A 2.9621 7.2888 120.7393 54.7103 18.2250 179.5033 144 L 3.7242 7.5236 117.4619 57.7658 41.6071 180.1091 145 K 3.9082 7.4446 117.5477 59.5851 31.8767 179.3983 146 E 4.0388 8.1071 117.5589 58.8736 29.4650 178.4920 147 L 4.3561 7.8737 116.1866 53.6446 42.5553 176.0093 148 N 4.0771 7.8407 115.4310 53.9812 36.7523 174.2954 149 A 4.9156 7.7677 118.5800 51.3403 19.8953 178.0412 150 Q 4.6738 8.7419 117.7446 55.5758 31.9399 175.4523 151 T 5.1545 7.7024 115.4987 61.3800 72.8946 172.7749 152 W 5.6954 9.2540 135.0000 56.0632 34.2134 173.4768 153 F 5.1899 10.2405 126.5152 56.2645 40.3895 174.8813 154 A 4.7104 8.7748 123.8949 49.4335 22.6019 176.7005 155 G 3.6822 8.3140 111.1163 45.0970 0.0000 173.9747 156 L 4.3609 7.3517 118.5995 53.7865 43.0387 176.8705 157 R 5.0122 7.9779 119.1376 54.3638 33.4773 176.9988 158 R 4.3977 8.7717 118.3639 57.7539 30.4880 178.1572 159 E 4.2486 7.7865 117.4847 58.6776 29.9778 177.4881 160 Q 3.2923 7.4633 109.2181 59.1758 28.8080 177.7432 161 S 4.4741 8.1781 112.1521 57.2993 64.4337 174.4356 162 G 3.9822 7.6424 102.8470 45.3303 0.0000 174.3488 163 S 4.5546 7.7788 118.6904 57.0705 63.3545 173.6171 164 R 4.1035 7.6156 121.8412 56.7044 30.9838 176.7336 165 A 4.4587 8.3864 122.1041 52.3215 17.3485 177.7715 166 N 4.9529 9.7605 116.2809 53.7544 40.7532 175.7843 167 L 4.5340 7.5262 118.4190 52.0801 41.3245 174.1991 168 P 4.4536 0.0000 0.0000 61.6505 32.5333 176.7140 169 V 3.6977 8.4099 120.5922 65.5045 32.1848 175.3925 170 L 5.2666 7.9455 120.0889 53.5097 45.1259 175.3063 171 A 4.4295 8.3143 123.6875 51.8541 23.7477 175.1001 172 I 4.5524 8.1909 117.9744 59.2572 39.1903 175.4549 173 Q 4.1327 9.0980 129.5960 55.7979 28.8885 176.2439 174 R 4.4650 7.6620 113.6388 55.1949 29.1908 176.2181 175 G 4.1275 8.1029 110.1061 46.7711 0.0000 171.0699 176 V 4.4287 7.0661 117.9970 60.5743 35.6722 173.9323 177 F 4.4690 9.4861 126.7974 57.6852 39.6427 174.2779 178 K 4.3774 9.5854 128.1932 55.7847 33.1264 175.6208 179 V 4.6921 8.7170 128.1396 61.2056 34.2568 174.4901 180 L 5.2793 9.2706 127.2513 50.9503 42.2690 174.8082 181 P 4.3172 0.0000 0.0000 65.6074 31.7691 179.4685 182 I 3.2480 6.9005 112.0539 59.8837 38.0169 177.1284 183 I 4.1252 7.9830 122.5006 64.7997 38.2362 176.5523 184 D 4.6907 8.0812 115.8260 53.6520 39.8178 176.4402 185 W 4.3027 8.2504 120.4839 56.8408 29.8882 175.2501 186 D 5.2363 8.3074 120.4035 51.1750 43.0907 176.5823 187 N 4.3500 8.6154 117.3312 56.9273 38.4812 177.8378 188 R 4.0274 8.0916 118.5030 59.7951 30.3587 178.8303 189 T 4.0760 8.1556 116.6324 66.1190 68.2959 176.7600 190 I 4.0967 8.0658 121.5599 64.6215 37.2125 177.7852 191 Y 4.0318 8.4176 120.5669 60.8615 38.1774 178.2369 192 Q 3.8466 8.8087 119.3795 58.9534 28.9028 177.9951 193 Y 4.0153 8.2336 120.5761 60.7222 38.8467 178.1123 194 L 4.0248 8.2638 120.0711 57.8246 41.7164 179.6764 195 Q 3.7437 7.6543 117.8507 58.8847 28.5053 178.5777 196 K 3.8296 8.0971 119.4427 59.0073 32.1461 177.4285 197 H 4.7112 7.5775 113.4631 54.4904 28.9587 175.1172 198 G 3.8918 7.4782 107.9232 46.2475 0.0000 173.9916 199 L 4.3960 7.8334 118.9780 53.5078 42.6360 176.6312 200 K 4.5973 8.2381 121.0505 54.7413 34.2506 175.8409 201 Y 4.5111 8.2776 119.0041 57.4965 38.9705 175.1495 202 H 3.4655 8.3059 120.8872 55.2826 30.2248 174.2596 203 P 4.3143 0.0000 0.0000 65.6851 31.5166 177.3826 204 L 4.2542 8.0466 117.3051 56.6074 42.1375 178.4145 205 W 4.4812 8.0501 128.0594 60.3792 30.7492 175.7655 206 D 4.7580 7.8800 117.4085 53.6537 40.6368 176.2504 207 E 4.7130 7.8253 117.1955 56.1107 36.5892 177.7858 208 G 4.5936 7.6731 117.1826 46.9491 0.0000 171.3782 209 Y 3.8900 7.5928 117.1254 57.9251 37.4197 175.6659 210 L 4.0893 8.5061 127.9656 57.6576 42.3240 177.7515 211 S 4.5827 7.6192 113.8587 56.9193 63.3368 173.6363 212 V 3.6899 8.0136 120.9504 63.6774 30.9592 175.3355 213 G 4.2513 9.2023 115.0539 46.7931 0.0000 174.7596 214 D 5.0412 9.4564 121.4721 53.1983 44.3619 177.4818 215 T 3.2718 8.2684 110.0080 63.2950 69.5485 172.6740 216 H 3.6122 7.6848 126.9205 55.2896 28.0098 174.6682 217 T 3.5109 7.6123 122.7998 64.0671 67.9219 173.7827 218 T 4.2231 7.5568 117.4174 64.7928 71.1570 174.9608 219 R 4.5619 7.7255 119.5916 55.5114 32.4078 175.6529 220 K 5.0148 8.3141 130.5709 56.7373 33.7747 175.7866 *235 L 4.0975 7.4111 117.8375 53.6650 42.3972 175.8173 236 K 3.9177 8.6389 123.4544 57.4039 32.7195 179.2442 237 R 3.7866 7.5917 122.3388 58.1833 30.8163 175.3236 238 E 4.7595 8.3327 117.0182 54.6238 33.2762 173.5962 239 C 4.9934 8.4083 116.7926 57.8966 31.9127 173.6672 240 G 4.0737 8.2237 108.0459 44.2624 0.0000 172.6650 241 L 4.1137 8.5394 122.7656 54.9981 42.5010 175.4225 242 H 4.1222 8.0230 117.3760 56.8786 25.2941 176.4246 243 E 3.5373 7.6388 125.1643 58.8078 31.4090 177.1349 244 G 3.9528 7.6301 110.7762 45.7033 0.0000 173.3728 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 8.33 4.38 0.00 3.99 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 3 K 8.16 3.60 0.00 1.71 1.78 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.49 7.81 4 L 7.79 3.89 0.00 1.39 1.76 0.85 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 5 D 8.85 4.89 0.00 2.82 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 6 L 8.72 4.18 0.00 1.64 1.57 0.41 0.21 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 7 N 8.23 4.49 0.00 2.73 2.84 0.00 0.00 6.70 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 8 A 7.74 4.62 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 L 7.43 4.09 0.00 1.99 1.66 1.08 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.25 4.58 0.00 2.65 2.82 0.00 0.00 6.97 8.50 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 11 E 7.60 4.64 0.00 2.09 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 0.00 2.43 2.40 0.00 12 L 7.27 4.80 0.00 1.82 1.51 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.49 0.00 2.15 1.99 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 14 K 8.52 4.01 0.00 1.85 1.80 0.00 1.59 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.55 7.81 15 V 7.65 3.79 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 0.81 0.00 0.00 0.93 0.00 0.00 16 D 8.00 4.41 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 17 R 7.83 3.82 0.00 2.12 2.12 0.00 3.08 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 18 I 7.66 3.87 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.18 0.96 0.00 0.00 19 L 7.68 4.05 0.00 1.89 1.71 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.33 4.16 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 21 L 8.51 4.15 0.00 1.87 1.76 1.06 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 22 A 7.66 4.05 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 E 7.67 3.95 0.00 2.02 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 2.35 2.35 0.00 24 T 7.65 4.08 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 25 N 8.56 4.19 0.00 2.72 2.80 0.00 0.00 6.92 7.06 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 26 A 7.86 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 7.86 4.01 0.00 2.03 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 28 L 7.37 3.80 0.00 1.62 1.46 0.50 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 29 E 7.94 4.06 0.00 2.06 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 2.29 2.30 0.00 30 K 7.59 4.20 0.00 1.74 1.82 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.51 7.81 31 L 7.13 4.37 0.00 1.63 1.60 0.85 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.28 4.83 0.00 3.01 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 33 A 8.92 4.02 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.46 4.08 0.00 2.34 2.05 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 2.47 2.49 0.00 35 G 8.13 3.68 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 0.00 0.00 0.00 36 R 8.26 4.06 0.00 2.08 2.04 0.00 3.25 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 37 V 7.86 3.86 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 0.72 0.00 0.00 0.91 0.00 0.00 38 A 7.94 3.96 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 W 8.85 4.15 0.00 3.48 3.41 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 A 8.82 3.92 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 7.84 3.44 0.00 1.75 1.59 0.40 0.98 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 42 D 7.08 4.71 0.00 2.55 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 0.00 0.00 0.00 0.00 43 N 7.52 4.52 0.00 1.51 1.48 0.00 0.00 6.81 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 44 L 6.87 4.49 0.00 1.59 1.39 0.39 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.64 0.00 2.17 2.11 0.00 3.81 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 2.07 2.13 0.00 46 G 8.41 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 47 E 8.53 3.70 0.00 2.26 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 2.67 2.40 0.00 48 Y 8.66 5.25 0.00 3.05 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 49 V 8.85 4.72 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 0.79 0.00 0.00 0.91 0.00 0.00 50 L 9.28 5.65 0.00 1.82 1.61 1.02 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 51 S 9.10 5.12 0.00 4.02 3.85 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 52 S 9.01 4.92 0.00 3.64 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 53 S 8.86 4.64 0.00 4.11 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 54 F 7.47 3.86 0.00 3.31 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 55 G 7.55 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 0.00 0.00 0.00 0.00 56 I 8.38 3.80 1.60 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 1.40 1.05 -0.10 0.00 0.00 57 Q 7.76 5.27 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 58 A 8.48 3.88 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 A 8.38 3.97 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 60 V 7.65 3.56 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 0.30 0.00 0.00 0.92 0.00 0.00 61 S 7.61 3.80 0.00 3.92 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 62 L 7.83 3.84 0.00 1.68 1.69 0.48 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.06 4.17 0.00 3.32 3.50 0.00 5.61 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.04 3.87 0.00 1.63 1.60 0.63 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 65 V 7.89 3.39 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 0.58 0.00 0.00 0.74 0.00 0.00 66 N 8.27 4.52 0.00 2.75 2.85 0.00 0.00 7.10 6.82 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 67 Q 8.04 4.07 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 68 I 7.41 4.06 1.88 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 1.35 0.79 0.79 0.00 0.00 69 R 8.12 4.34 0.00 1.59 1.64 0.00 2.96 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 70 P 0.00 4.41 0.00 2.07 1.96 0.00 3.85 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 2.01 2.09 0.00 71 D 7.74 4.35 0.00 2.75 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.41 4.08 2.00 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 1.49 0.93 0.94 0.00 0.00 73 P 0.00 4.54 0.00 2.20 2.10 0.00 3.91 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.16 0.00 74 V 8.59 5.10 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 1.23 0.00 0.00 1.07 0.00 0.00 75 I 8.34 4.74 1.87 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.72 0.87 0.00 0.00 76 L 9.39 5.12 0.00 1.92 1.60 1.07 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.57 5.33 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 1.22 0.00 0.00 78 D 8.55 4.61 0.00 2.93 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 79 T 8.74 3.90 4.40 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 1.26 0.00 0.00 80 G 8.59 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 Y 7.89 4.85 0.00 3.21 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 82 L 8.05 4.13 0.00 0.98 0.88 1.02 0.73 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 83 F 7.95 4.10 0.00 3.00 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 84 P 0.00 4.56 0.00 2.27 2.24 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 85 E 8.31 4.21 0.00 2.17 2.26 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 2.39 2.29 0.00 86 T 8.12 4.11 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 1.35 0.00 0.00 87 Y 7.77 4.22 0.00 3.22 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 88 R 8.10 4.28 0.00 1.96 2.07 0.00 3.18 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 89 F 8.12 4.40 0.00 3.10 3.27 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 90 I 7.86 3.50 1.89 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 0.73 0.81 0.19 0.00 0.00 91 D 8.51 4.73 0.00 2.68 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 92 E 8.08 4.07 0.00 2.32 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 2.31 2.37 0.00 93 L 7.63 3.85 0.00 1.82 1.63 0.34 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 94 T 8.43 3.66 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 1.25 0.00 0.00 95 D 7.36 4.37 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.79 4.08 0.00 1.92 1.90 0.00 1.84 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.46 7.81 97 L 8.87 4.21 0.00 1.56 1.70 0.90 0.86 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 98 K 7.78 3.90 0.00 1.89 1.84 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.44 7.81 99 L 8.14 4.66 0.00 1.60 1.63 1.02 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 100 N 8.52 4.69 0.00 3.05 2.92 0.00 0.00 6.74 6.66 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 0.00 101 L 8.05 4.63 0.00 1.71 1.57 1.05 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 102 K 9.48 4.46 0.00 1.92 1.95 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.59 1.61 7.81 103 V 8.12 4.55 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 0.77 0.00 0.00 0.88 0.00 0.00 104 Y 9.23 4.60 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 0.00 105 R 8.56 5.22 0.00 1.81 2.18 0.00 2.64 0.00 0.00 3.90 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.44 0.00 106 A 8.39 4.22 1.39 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 0.00 0.00 107 T 8.24 4.10 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 1.12 0.00 0.00 108 E 7.58 4.33 0.00 1.64 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 2.07 2.08 0.00 109 S 8.60 4.62 0.00 4.13 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 0.00 110 A 8.65 4.15 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 0.00 111 A 8.03 4.08 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 7.95 4.08 0.00 3.63 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 0.00 113 Q 8.99 4.27 0.00 2.61 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.67 2.72 0.00 114 E 9.09 4.35 0.00 2.39 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.73 0.00 115 A 7.61 4.28 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 R 8.31 3.88 0.00 1.92 1.60 0.00 3.17 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.34 0.00 117 Y 7.60 4.70 0.00 3.11 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.65 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 0.00 0.00 0.00 0.00 119 K 8.11 2.82 0.00 1.28 0.74 0.00 1.70 0.00 0.00 1.91 0.00 0.00 3.29 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.20 1.29 7.81 120 L 7.51 3.88 0.00 1.87 2.01 1.02 0.84 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 0.00 121 W 7.65 4.24 0.00 3.27 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 0.00 122 E 7.61 4.25 0.00 1.89 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 2.23 1.87 0.00 123 Q 7.74 4.41 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.64 0.00 0.00 0.00 0.00 0.00 2.29 2.17 0.00 124 G 7.78 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 0.00 0.00 0.00 125 V 8.34 3.62 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.94 0.00 0.00 126 E 8.27 4.20 0.00 2.08 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 0.00 2.38 2.44 0.00 127 G 7.73 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 128 I 7.93 3.94 2.07 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 1.56 0.81 1.00 0.00 0.00 129 E 8.68 4.00 0.00 2.19 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 0.00 2.36 2.54 0.00 130 K 8.25 3.88 0.00 1.91 1.85 0.00 1.10 0.00 0.00 1.33 0.00 0.00 2.40 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.31 1.40 7.81 131 Y 8.17 4.04 0.00 3.22 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 0.00 132 N 8.94 4.25 0.00 3.05 2.90 0.00 0.00 6.74 8.08 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 0.00 133 D 8.35 4.25 0.00 2.85 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 0.00 134 I 7.49 4.08 1.80 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 1.50 0.91 0.96 0.00 0.00 135 N 7.94 4.63 0.00 2.24 2.58 0.00 0.00 6.78 7.16 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 0.00 136 K 7.48 4.35 0.00 1.91 1.79 0.00 1.92 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.31 7.81 137 V 7.81 3.52 2.21 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 1.06 0.00 0.00 0.97 0.00 0.00 138 E 8.90 3.85 0.00 2.07 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 2.27 2.48 0.00 139 P 0.00 4.24 0.00 2.18 2.25 0.00 3.66 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 2.17 2.13 0.00 140 M 7.87 3.71 0.00 2.12 2.01 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 2.07 2.32 0.00 141 N 8.23 4.18 0.00 2.82 2.77 0.00 0.00 6.72 8.51 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 0.00 142 R 7.96 3.89 0.00 2.07 1.97 0.00 3.13 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 143 A 7.29 2.96 0.38 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 0.00 144 L 7.52 3.72 0.00 1.50 1.56 0.62 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.44 3.91 0.00 2.05 1.79 0.00 1.50 0.00 0.00 1.57 0.00 0.00 3.21 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.47 7.81 146 E 8.11 4.04 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 147 L 7.87 4.36 0.00 1.66 1.71 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 148 N 7.84 4.08 0.00 2.84 2.84 0.00 0.00 6.88 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 0.00 149 A 7.77 4.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 8.74 4.67 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 151 T 7.70 5.15 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 1.08 0.00 0.00 152 W 9.25 5.70 0.00 3.24 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 0.00 153 F 10.24 5.19 0.00 3.10 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 0.00 154 A 8.77 4.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 G 8.31 3.68 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 0.00 0.00 0.00 156 L 7.35 4.36 0.00 1.62 1.52 0.79 0.82 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 0.00 157 R 7.98 5.01 0.00 1.82 1.86 0.00 3.18 0.00 0.00 3.62 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.59 0.00 158 R 8.77 4.40 0.00 1.78 1.99 0.00 3.12 0.00 0.00 3.23 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 159 E 7.79 4.25 0.00 1.81 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 2.33 2.27 0.00 160 Q 7.46 3.29 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 161 S 8.18 4.47 0.00 3.85 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 0.00 162 G 7.64 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 0.00 163 S 7.78 4.55 0.00 3.94 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 0.00 164 R 7.62 4.10 0.00 1.86 1.89 0.00 3.19 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 165 A 8.39 4.46 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 0.00 166 N 9.76 4.95 0.00 2.67 2.80 0.00 0.00 6.68 7.73 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 0.00 167 L 7.53 4.53 0.00 1.88 1.56 0.86 1.02 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 0.00 168 P 0.00 4.45 0.00 2.31 1.94 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 169 V 8.41 3.70 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 0.95 0.00 0.00 0.92 0.00 0.00 170 L 7.95 5.27 0.00 1.59 1.63 1.12 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 171 A 8.31 4.43 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 I 8.19 4.55 1.79 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.78 0.77 0.00 0.00 173 Q 9.10 4.13 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.29 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 174 R 7.66 4.47 0.00 1.94 2.04 0.00 3.37 0.00 0.00 3.48 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.50 0.00 175 G 8.10 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 V 7.07 4.43 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 1.07 0.00 0.00 1.00 0.00 0.00 177 F 9.49 4.47 0.00 3.12 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 0.00 178 K 9.59 4.38 0.00 1.67 1.58 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.12 1.09 7.81 179 V 8.72 4.69 1.55 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 0.97 0.00 0.00 0.70 0.00 0.00 180 L 9.27 5.28 0.00 1.37 1.43 0.80 0.86 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 0.00 181 P 0.00 4.32 0.00 2.01 2.20 0.00 3.93 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.94 0.00 182 I 6.90 3.25 0.85 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.44 -0.74 0.00 0.00 183 I 7.98 4.13 2.02 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 1.07 2.08 0.94 0.00 0.00 184 D 8.08 4.69 0.00 2.87 2.82 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 0.00 185 W 8.25 4.30 0.00 3.36 3.21 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 0.00 186 D 8.31 5.24 0.00 3.01 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 0.00 187 N 8.62 4.35 0.00 2.77 3.03 0.00 0.00 7.43 8.85 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 0.00 188 R 8.09 4.03 0.00 2.13 2.03 0.00 3.17 0.00 0.00 3.39 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 189 T 8.16 4.08 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 190 I 8.07 4.10 2.04 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.77 0.98 0.00 0.00 191 Y 8.42 4.03 0.00 3.26 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.81 3.85 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.44 2.72 0.00 193 Y 8.23 4.02 0.00 3.46 3.33 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 0.00 194 L 8.26 4.02 0.00 1.78 1.51 1.01 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 195 Q 7.65 3.74 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.78 0.00 0.00 0.00 0.00 0.00 2.09 1.66 0.00 196 K 8.10 3.83 0.00 1.63 1.60 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.17 1.34 7.81 197 H 7.58 4.71 0.00 3.04 3.14 0.00 5.83 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 G 7.48 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 0.00 199 L 7.83 4.40 0.00 1.66 1.63 1.14 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 200 K 8.24 4.60 0.00 1.83 1.85 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.57 7.81 201 Y 8.28 4.51 0.00 3.14 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 0.00 202 H 8.31 3.47 0.00 2.87 3.02 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 P 0.00 4.31 0.00 2.01 2.16 0.00 2.95 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.18 0.00 204 L 8.05 4.25 0.00 1.52 1.56 -0.29 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 205 W 8.05 4.48 0.00 3.17 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 0.00 206 D 7.88 4.76 0.00 2.77 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 0.00 207 E 7.83 4.71 0.00 2.18 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 2.26 2.29 0.00 208 G 7.67 4.59 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 0.00 0.00 0.00 209 Y 7.59 3.89 0.00 2.81 2.82 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 0.00 210 L 8.51 4.09 0.00 1.53 1.73 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 211 S 7.62 4.58 0.00 4.02 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 0.00 212 V 8.01 3.69 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.66 0.00 0.00 213 G 9.20 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 0.00 0.00 0.00 0.00 214 D 9.46 5.04 0.00 2.55 2.32 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 0.00 215 T 8.27 3.27 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 -0.08 0.00 0.00 216 H 7.68 3.61 0.00 2.16 2.83 0.00 5.85 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 0.00 217 T 7.61 3.51 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 0.00 218 T 7.56 4.22 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 1.13 0.00 0.00 219 R 7.73 4.56 0.00 2.33 2.18 0.00 3.38 0.00 0.00 3.30 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.80 0.00 220 K 8.31 5.01 0.00 1.85 1.80 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.34 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.36 1.23 7.81 *235 L 7.41 4.10 0.00 1.68 1.71 0.99 1.05 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 0.00 236 K 8.64 3.92 0.00 1.83 1.71 0.00 1.64 0.00 0.00 1.87 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.51 7.81 237 R 7.59 3.79 0.00 1.97 1.98 0.00 3.02 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 238 E 8.33 4.76 0.00 1.88 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 239 C 8.41 4.99 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 0.00 240 G 8.22 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 0.00 241 L 8.54 4.11 0.00 1.65 1.74 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 242 H 8.02 4.12 0.00 3.35 3.64 0.00 5.84 0.00 0.00 0.00 0.00 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 E 7.64 3.54 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 244 G 7.63 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 * Residues marked with a * may have inaccurate shift predictions.