NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 P 4.3815 0.0000 0.0000 62.4790 34.8474 180.0935 13 K 3.4128 8.9618 118.1587 56.9088 31.2645 175.4462 14 G 3.8353 10.2061 119.9735 48.3411 0.0000 173.3272 15 V 4.3590 7.4267 112.6280 59.8816 34.3950 175.6967 16 S 4.3778 8.6007 115.8874 57.0053 65.2898 172.9118 17 V 4.3784 8.4847 128.3894 61.8788 32.2105 174.6050 18 E 4.7394 9.1142 128.4716 54.5400 32.0620 175.1990 19 V 4.7288 8.4131 123.3182 61.1053 33.6805 174.5366 20 A 4.7419 8.7227 129.1100 50.4210 21.7006 175.0491 21 P 3.6759 0.0000 0.0000 61.2700 32.7074 176.6497 22 G 4.2192 7.9506 102.0418 46.0192 0.0000 171.5205 23 R 5.2339 8.2603 118.7766 54.7031 35.6759 174.2488 24 V 4.7174 8.4676 119.2615 61.4324 34.8938 174.0536 25 K 4.5982 9.2236 128.5845 55.1457 33.7110 175.9157 26 V 4.7149 7.9813 126.2360 60.6387 31.4325 174.6816 27 K 4.3273 8.6633 124.8640 56.8560 34.5415 177.0249 28 G 4.3271 8.0316 107.3464 45.4466 0.0000 172.1499 29 P 4.8419 0.0000 0.0000 63.1549 31.1230 177.3412 30 K 4.4477 8.5066 116.6748 54.6297 34.7068 176.3284 31 G 3.8821 7.1330 105.7998 45.6588 0.0000 169.8869 32 E 4.7563 8.2016 119.7344 54.5999 31.2285 175.8829 33 L 4.6570 8.2472 124.9713 52.5334 44.6529 175.5656 34 E 4.2221 8.8303 123.5354 56.4884 30.6823 177.0220 35 V 4.3393 9.1869 125.0822 60.0440 33.8851 172.8358 36 P 4.5484 0.0000 0.0000 63.3890 31.3296 175.8027 37 V 4.5615 8.3066 123.9675 60.3149 34.9181 175.1829 38 S 4.2883 8.6095 118.7554 57.6179 62.2271 172.6265 39 P 4.2710 0.0000 0.0000 65.4558 31.3195 175.9456 40 E 4.3430 8.1238 118.0611 58.5241 28.7042 176.7055 41 M 4.8705 9.7917 134.0124 56.5490 30.4970 177.6200 42 R 3.5311 6.6115 113.5782 57.0454 29.1857 176.5414 43 V 4.0736 7.7250 110.5987 60.2541 32.2594 175.9903 44 V 4.4046 7.9526 131.1394 62.1385 34.7052 174.9659 45 V 4.2593 8.4552 121.9293 61.9004 31.9076 177.1199 46 E 4.4306 8.0859 127.3063 53.1484 29.0202 174.8426 47 E 4.0888 8.2790 123.4460 55.7863 29.0076 177.6503 48 G 3.6869 8.4868 109.8781 46.7558 0.0000 173.1425 49 V 4.4275 7.8246 112.9532 60.0046 36.0591 173.0579 50 V 4.6160 8.1171 120.3672 61.3379 33.0642 174.6553 51 R 4.7744 8.1088 124.4398 54.5008 33.3413 174.2952 52 V 4.5296 8.3399 122.8648 61.0220 34.5174 174.3680 53 E 4.6976 8.6832 126.8081 54.3582 32.3232 174.9298 54 R 4.7138 8.6057 122.4345 54.0334 33.1574 174.6449 55 P 4.1299 0.0000 0.0000 63.6493 29.6539 178.0892 56 S 4.1313 8.7733 107.5424 58.0051 64.2232 174.4163 57 D 4.9826 8.1728 118.3399 54.0238 41.5152 177.4487 58 E 4.3032 7.7556 118.3248 55.5288 31.6675 176.9845 59 R 3.8711 8.5555 121.4779 60.1518 30.1187 179.0230 60 R 3.9155 8.0924 116.8788 59.3507 30.0617 178.4057 61 H 4.3838 7.9069 115.0673 58.2320 29.1379 177.4672 62 K 3.9585 8.5093 119.1498 59.0201 32.0810 178.8879 63 S 4.4478 7.7593 115.3290 61.0562 63.2700 175.8689 64 L 3.9358 7.5982 120.9220 57.1188 41.4132 176.8131 65 H 4.0764 7.5569 116.4990 58.0812 30.6314 173.7853 66 G 4.3994 9.2105 119.8605 46.4948 0.0000 175.2746 67 L 3.9108 7.9764 121.6583 57.9975 42.0501 179.2625 68 T 3.8154 8.4472 115.7169 67.3315 68.4872 177.1825 69 R 3.7447 7.6706 119.2706 60.1057 30.2688 178.1982 70 T 4.0375 8.4554 115.7423 65.5617 68.2579 178.0449 71 L 3.7222 8.0026 122.4281 57.4312 42.1636 179.6051 72 I 3.8248 7.9123 119.7555 64.3855 37.2868 178.0133 73 A 3.9806 7.7914 121.4774 55.8044 17.8831 179.5461 74 N 4.3276 8.5445 113.4625 56.0380 38.8082 177.0899 75 A 4.1794 8.0276 122.2564 54.7790 18.5543 179.1600 76 V 3.5309 7.7231 116.8309 65.9892 31.1785 177.9398 77 K 4.0780 8.3421 118.1848 59.0816 31.5116 179.1415 78 G 3.6190 7.7603 107.2804 47.5629 0.0000 175.5907 79 V 3.8805 8.0135 114.2466 61.2726 32.9844 177.0010 80 S 4.6399 7.1313 114.0474 57.6921 62.3514 174.5916 81 E 3.8082 7.9786 120.3985 56.8238 26.2365 175.6267 82 G 4.4409 7.2676 113.1688 44.0064 0.0000 172.3785 83 Y 5.2055 8.3500 122.7838 55.8839 37.2647 180.9939 84 S 4.0286 9.0983 125.3794 58.2800 61.9631 165.0000 85 K 3.9507 8.6699 127.1389 56.2970 32.7482 175.4216 86 E 5.2606 8.3968 122.7721 54.8982 32.7022 174.5028 87 L 5.1893 10.5116 121.0565 52.5710 45.7859 175.8472 88 L 5.0877 8.2658 122.8365 54.0077 43.0720 175.8156 89 I 4.6868 7.5998 119.3647 63.4936 40.5058 172.5494 90 K 4.7949 9.0271 119.7991 55.8091 34.7780 171.9780 91 G 3.8706 7.2186 112.4678 44.5708 0.0000 177.0571 92 I 4.3709 7.4037 129.4026 60.5409 37.1784 177.4646 93 G 3.9285 9.0207 117.1750 47.8966 0.0000 172.0997 94 Y 5.1485 9.5271 118.9023 57.4542 38.5942 175.7257 95 R 4.6398 7.8404 118.1874 56.2429 32.4585 172.3299 96 A 4.8916 8.7945 120.0122 50.5005 21.2242 177.0048 97 R 4.5079 8.2162 117.9173 53.2750 31.6044 173.1863 98 L 4.0233 7.9857 121.8631 55.0249 43.2777 177.8670 99 V 4.3773 9.1311 125.5377 60.4936 32.5662 176.1161 100 G 3.9653 8.0475 113.1327 44.9665 0.0000 172.8750 101 R 4.2022 8.6214 119.4999 57.6039 30.5014 176.0754 102 A 4.8813 7.5663 119.9667 50.3333 21.4939 176.1381 103 L 4.5872 7.6720 118.4942 54.0004 44.3262 175.2416 104 E 5.1081 8.2930 117.1941 53.0575 30.2998 173.0821 105 L 4.5045 8.0073 124.1504 55.1989 42.7080 176.2401 106 T 4.7058 8.5120 113.2330 59.3647 70.7528 175.2627 107 V 3.1957 7.4855 122.2648 60.0344 32.3498 176.4247 108 G 3.9027 8.1031 106.3414 45.2869 0.0000 173.4461 109 F 5.0141 7.3543 118.6548 56.7843 40.1605 176.0394 110 S 4.6438 8.5486 115.6802 59.3359 62.8213 173.6918 111 H 5.0317 7.6703 119.3175 53.5783 32.9914 170.4875 112 P 4.5558 0.0000 0.0000 62.1730 32.6147 175.5814 113 V 4.0331 8.4348 123.2321 61.8153 32.7315 175.2149 114 V 4.3452 8.3215 129.6277 61.7480 31.6482 174.9856 115 V 3.9006 8.1467 129.1736 61.8279 32.3123 175.3266 116 E 4.3825 8.9837 129.2648 55.8953 30.7392 173.7883 117 P 5.1192 0.0000 0.0000 60.2671 33.0604 173.0682 118 P 4.5683 0.0000 0.0000 61.0717 32.6325 174.9156 119 E 3.9916 8.6042 121.9816 58.1248 29.6047 176.4871 120 G 4.1137 8.9815 113.1041 45.2184 0.0000 172.5337 121 I 5.0171 7.5661 119.4767 59.7047 41.1484 175.0560 122 T 4.5774 8.7063 121.0273 61.8301 72.6990 172.7735 123 F 5.1025 8.8001 124.0654 56.2033 40.7507 174.8591 124 E 4.5900 9.2481 123.7886 54.6800 31.7939 175.5576 125 V 4.8816 8.2920 125.2127 60.1530 30.7407 173.1590 126 P 4.3425 0.0000 0.0000 64.8218 31.7132 177.2941 127 E 4.7174 7.7956 118.2382 52.9190 32.3407 174.7157 128 P 4.6545 0.0000 0.0000 64.0518 31.6639 176.9564 129 T 4.5647 7.7453 107.5366 61.3587 69.7987 173.4016 130 R 4.9398 7.9279 121.0483 55.3201 33.3828 174.3790 131 V 4.9426 9.3855 124.0508 61.5039 35.7245 173.7378 132 R 5.0475 9.0478 121.5056 54.5627 33.1196 173.7310 133 V 4.7155 9.0314 121.9637 61.3322 33.5208 174.8391 134 S 4.9085 8.7146 124.0449 56.8742 66.0305 174.2998 135 G 4.0871 7.8436 109.9398 46.2478 0.0000 171.8215 136 I 4.4308 7.1141 116.3482 58.7137 35.9702 173.5443 137 D 4.5506 7.2389 120.6783 50.5357 47.3800 175.8810 138 K 4.3748 8.5087 122.5185 54.8462 29.9507 178.4066 139 Q 3.7866 7.7449 125.4548 58.8744 30.4637 178.6369 140 K 4.3089 8.1690 116.8573 58.8034 32.9872 177.4570 141 V 3.5628 7.9871 117.6773 66.1791 31.0318 177.6059 142 G 3.8568 8.1187 107.6735 47.9274 0.0000 174.8595 143 Q 4.1218 7.6842 121.3712 59.2174 29.4160 178.0123 144 V 4.7142 8.1048 118.7414 64.5623 31.4810 176.8984 145 A 4.2272 8.3345 120.2698 55.2562 17.8858 179.8105 146 A 3.5965 8.1972 114.5953 54.1807 20.6224 180.0815 147 N 4.2155 8.1079 110.9787 55.9764 38.8932 176.8798 148 I 4.0308 7.3205 119.9075 62.8830 36.7918 178.0531 149 R 3.8256 9.0143 118.2158 59.7200 28.9470 178.6780 150 A 3.9283 8.7114 121.7916 55.0393 18.3935 178.4519 151 I 3.8515 7.4198 117.1525 64.3100 37.4027 175.6812 152 R 4.9916 7.0131 116.6406 54.3118 34.3923 174.6646 153 K 4.6793 8.1723 120.3225 56.4232 33.8675 174.8503 154 P 5.1084 0.0000 0.0000 63.4141 37.8029 174.4686 155 S 4.0327 9.0720 110.1702 58.3105 64.3239 173.1424 156 A 4.3471 10.0788 122.0260 56.0771 16.6415 180.1188 157 Y 4.2000 7.4441 120.2452 60.0669 35.2299 173.8876 158 H 4.2450 7.8430 115.4959 56.3114 28.8643 174.7442 159 E 4.0565 8.6617 123.6196 56.7609 28.6123 174.4576 160 K 4.1109 7.1779 116.7469 56.3792 32.7864 175.9544 161 G 4.1521 8.3121 107.1736 43.2862 0.0000 172.5074 162 I 4.5245 7.6744 113.6705 59.2018 37.9966 175.0585 163 Y 4.1861 8.6344 124.4248 57.4922 38.9874 175.1609 164 Y 4.8219 8.4979 116.8184 57.8135 39.0005 177.5995 165 A 5.5569 7.7174 135.0000 53.4300 18.9567 176.7894 166 G 4.0368 7.9696 104.8422 45.1978 0.0000 172.3525 167 E 4.6969 8.4597 118.2522 53.6033 31.9635 174.5127 168 P 4.7124 0.0000 0.0000 61.6333 31.6059 176.1200 169 V 4.0538 8.2641 123.7387 60.7667 32.6098 176.6288 170 R 3.6001 8.7813 122.1103 59.6838 29.7623 177.1562 *171 L 4.1254 7.7512 121.9908 53.9502 41.6082 177.9610 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 12 P 0.00 4.38 0.00 2.05 2.13 0.00 3.78 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 1.91 2.10 0.00 13 K 8.96 3.41 0.00 1.96 1.55 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.44 7.81 14 G 10.21 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 15 V 7.43 4.36 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 0.65 0.00 0.00 0.92 0.00 0.00 16 S 8.60 4.38 0.00 3.85 3.65 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 17 V 8.48 4.38 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 0.84 0.00 0.00 0.92 0.00 0.00 18 E 9.11 4.74 0.00 1.92 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 2.22 2.21 0.00 19 V 8.41 4.73 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 0.78 0.00 0.00 0.92 0.00 0.00 20 A 8.72 4.74 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 21 P 0.00 3.68 0.00 2.07 1.94 0.00 3.63 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 2.14 0.00 22 G 7.95 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 23 R 8.26 5.23 0.00 1.71 1.87 0.00 3.06 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 24 V 8.47 4.72 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 0.96 0.00 0.00 0.92 0.00 0.00 25 K 9.22 4.60 0.00 1.70 1.87 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.35 7.81 26 V 7.98 4.71 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.91 0.00 0.00 27 K 8.66 4.33 0.00 1.82 1.90 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.47 7.81 28 G 8.03 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 29 P 0.00 4.84 0.00 2.05 2.09 0.00 3.94 0.00 0.00 3.64 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 30 K 8.51 4.45 0.00 1.52 1.66 0.00 1.86 0.00 0.00 1.72 0.00 0.00 2.78 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.36 1.45 7.81 31 G 7.13 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.20 4.76 0.00 1.96 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 2.19 2.38 0.00 33 L 8.25 4.66 0.00 1.51 1.52 0.96 0.83 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 34 E 8.83 4.22 0.00 1.84 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 2.30 2.30 0.00 35 V 9.19 4.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.95 0.00 0.00 36 P 0.00 4.55 0.00 2.10 2.07 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 37 V 8.31 4.56 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 0.76 0.00 0.00 1.00 0.00 0.00 38 S 8.61 4.29 0.00 3.87 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 39 P 0.00 4.27 0.00 2.22 2.08 0.00 3.65 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 2.11 2.11 0.00 40 E 8.12 4.34 0.00 2.01 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 2.37 2.49 0.00 41 M 9.79 4.87 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.31 0.00 42 R 6.61 3.53 0.00 1.84 1.92 0.00 3.25 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 43 V 7.72 4.07 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 0.76 0.00 0.00 0.92 0.00 0.00 44 V 7.95 4.40 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 0.92 0.00 0.00 0.99 0.00 0.00 45 V 8.46 4.26 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 0.86 0.00 0.00 0.96 0.00 0.00 46 E 8.09 4.43 0.00 2.11 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 2.20 2.38 0.00 47 E 8.28 4.09 0.00 2.10 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 2.23 2.19 0.00 48 G 8.49 3.69 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 0.00 0.00 0.00 49 V 7.82 4.43 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 0.71 0.00 0.00 0.93 0.00 0.00 50 V 8.12 4.62 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 0.76 0.00 0.00 0.92 0.00 0.00 51 R 8.11 4.77 0.00 1.87 1.72 0.00 3.26 0.00 0.00 3.16 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 52 V 8.34 4.53 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 0.77 0.00 0.00 0.89 0.00 0.00 53 E 8.68 4.70 0.00 1.92 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 0.00 2.20 2.22 0.00 54 R 8.61 4.71 0.00 1.98 2.00 0.00 3.34 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.55 0.00 55 P 0.00 4.13 0.00 2.12 1.83 0.00 3.70 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 1.80 1.90 0.00 56 S 8.77 4.13 0.00 3.96 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 57 D 8.17 4.98 0.00 2.65 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 58 E 7.76 4.30 0.00 2.08 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 2.35 2.33 0.00 59 R 8.56 3.87 0.00 1.87 1.94 0.00 3.20 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 60 R 8.09 3.92 0.00 1.78 1.92 0.00 3.15 0.00 0.00 3.32 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 61 H 7.91 4.38 0.00 3.39 3.34 0.00 5.83 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 62 K 8.51 3.96 0.00 1.82 1.91 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.50 7.81 63 S 7.76 4.45 0.00 3.97 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 64 L 7.60 3.94 0.00 1.69 1.72 0.89 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 65 H 7.56 4.08 0.00 3.20 3.34 0.00 5.72 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 66 G 9.21 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 0.00 0.00 0.00 0.00 67 L 7.98 3.91 0.00 1.84 1.92 0.92 1.14 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 68 T 8.45 3.82 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 69 R 7.67 3.74 0.00 1.95 1.94 0.00 3.16 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 1.69 1.66 0.00 70 T 8.46 4.04 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 1.20 0.00 0.00 71 L 8.00 3.72 0.00 1.77 1.66 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.91 3.82 1.85 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 1.44 1.01 0.89 0.00 0.00 73 A 7.79 3.98 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 0.00 0.00 0.00 0.00 0.00 74 N 8.54 4.33 0.00 2.80 2.87 0.00 0.00 7.05 7.38 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 75 A 8.03 4.18 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 76 V 7.72 3.53 2.25 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 1.05 0.00 0.00 0.95 0.00 0.00 77 K 8.34 4.08 0.00 1.85 1.84 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.72 7.81 78 G 7.76 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 79 V 8.01 3.88 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 0.88 0.00 0.00 1.00 0.00 0.00 80 S 7.13 4.64 0.00 4.00 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 81 E 7.98 3.81 0.00 2.15 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 2.28 2.31 0.00 82 G 7.27 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.35 5.21 0.00 2.86 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 0.00 0.00 0.00 0.00 84 S 9.10 4.03 0.00 4.12 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.67 3.95 0.00 2.00 1.90 0.00 1.57 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.29 1.26 7.81 86 E 8.40 5.26 0.00 1.99 1.87 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 2.21 2.31 0.00 87 L 10.51 5.19 0.00 1.68 1.79 1.06 0.90 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 88 L 8.27 5.09 0.00 1.66 1.30 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.60 4.69 2.00 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 1.48 1.38 1.00 0.00 0.00 90 K 9.03 4.79 0.00 2.00 1.82 0.00 1.58 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.17 0.90 7.81 91 G 7.22 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 7.40 4.37 1.84 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 1.24 0.70 0.89 0.00 0.00 93 G 9.02 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 9.53 5.15 0.00 2.56 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 95 R 7.84 4.64 0.00 1.92 2.05 0.00 2.91 0.00 0.00 3.36 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.46 0.00 96 A 8.79 4.89 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 8.22 4.51 0.00 1.74 1.79 0.00 3.15 0.00 0.00 3.08 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 98 L 7.99 4.02 0.00 1.59 1.60 1.04 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 99 V 9.13 4.38 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 0.83 0.00 0.00 0.95 0.00 0.00 100 G 8.05 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 R 8.62 4.20 0.00 1.88 2.10 0.00 3.23 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 102 A 7.57 4.88 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 0.00 103 L 7.67 4.59 0.00 1.59 1.41 0.75 -0.09 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 0.00 104 E 8.29 5.11 0.00 1.94 1.86 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 2.12 2.01 0.00 105 L 8.01 4.50 0.00 1.60 1.81 0.81 0.29 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 0.00 106 T 8.51 4.71 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 0.00 107 V 7.49 3.20 1.06 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 0.28 0.00 0.00 0.30 0.00 0.00 108 G 8.10 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 0.00 0.00 0.00 109 F 7.35 5.01 0.00 3.18 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 0.00 110 S 8.55 4.64 0.00 3.88 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 H 7.67 5.03 0.00 2.82 3.15 0.00 5.94 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 0.00 112 P 0.00 4.56 0.00 2.02 1.94 0.00 3.16 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 113 V 8.43 4.03 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 0.93 0.00 0.00 1.11 0.00 0.00 114 V 8.32 4.35 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 0.78 0.00 0.00 0.90 0.00 0.00 115 V 8.15 3.90 1.78 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 0.85 0.00 0.00 0.87 0.00 0.00 116 E 8.98 4.38 0.00 2.06 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 2.38 2.38 0.00 117 P 0.00 5.12 0.00 2.27 2.44 0.00 3.89 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 1.96 2.01 0.00 118 P 0.00 4.57 0.00 2.24 2.23 0.00 3.64 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 119 E 8.60 3.99 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 2.28 2.31 0.00 120 G 8.98 4.11 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 0.00 0.00 0.00 121 I 7.57 5.02 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.64 0.60 0.00 0.00 122 T 8.71 4.58 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 1.22 0.00 0.00 123 F 8.80 5.10 0.00 2.95 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 0.00 124 E 9.25 4.59 0.00 1.94 1.84 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 2.22 2.32 0.00 125 V 8.29 4.88 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 0.95 0.00 0.00 0.98 0.00 0.00 126 P 0.00 4.34 0.00 2.22 2.17 0.00 3.88 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 2.00 2.01 0.00 127 E 7.80 4.72 0.00 2.00 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 2.30 2.20 0.00 128 P 0.00 4.65 0.00 2.22 2.28 0.00 3.64 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 129 T 7.75 4.56 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 130 R 7.93 4.94 0.00 1.75 1.79 0.00 3.25 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 131 V 9.39 4.94 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 1.06 0.00 0.00 0.96 0.00 0.00 132 R 9.05 5.05 0.00 2.01 1.97 0.00 2.73 0.00 0.00 3.07 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 133 V 9.03 4.72 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 0.57 0.00 0.00 1.13 0.00 0.00 134 S 8.71 4.91 0.00 3.87 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 0.00 135 G 7.84 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 0.00 136 I 7.11 4.43 1.77 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.57 0.80 0.00 0.00 137 D 7.24 4.55 0.00 2.54 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 8.51 4.37 0.00 1.88 2.04 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.29 7.81 139 Q 7.74 3.79 0.00 1.98 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 140 K 8.17 4.31 0.00 2.08 1.72 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.45 7.81 141 V 7.99 3.56 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 0.98 0.00 0.00 0.91 0.00 0.00 142 G 8.12 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 0.00 0.00 0.00 143 Q 7.68 4.12 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.82 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 144 V 8.10 4.71 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 1.28 0.00 0.00 1.00 0.00 0.00 145 A 8.33 4.23 1.51 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 0.00 0.00 146 A 8.20 3.60 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 0.00 147 N 8.11 4.22 0.00 3.04 2.94 0.00 0.00 6.91 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 0.00 148 I 7.32 4.03 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.11 0.94 0.00 0.00 149 R 9.01 3.83 0.00 1.90 2.11 0.00 2.43 0.00 0.00 2.47 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 150 A 8.71 3.93 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 0.00 151 I 7.42 3.85 1.79 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 1.63 0.82 0.95 0.00 0.00 152 R 7.01 4.99 0.00 1.46 1.81 0.00 3.00 0.00 0.00 2.76 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.49 0.00 153 K 8.17 4.68 0.00 1.71 0.98 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.26 1.35 7.81 154 P 0.00 5.11 0.00 2.10 1.64 0.00 3.82 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 155 S 9.07 4.03 0.00 3.87 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 A 10.08 4.35 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 0.00 157 Y 7.44 4.20 0.00 3.00 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 0.00 158 H 7.84 4.24 0.00 3.25 3.76 0.00 5.73 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.66 4.06 0.00 2.09 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 2.10 2.29 0.00 160 K 7.18 4.11 0.00 1.88 1.85 0.00 1.96 0.00 0.00 1.25 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.47 1.38 7.81 161 G 8.31 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 I 7.67 4.52 1.90 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 1.34 0.70 0.92 0.00 0.00 163 Y 8.63 4.19 0.00 3.10 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 0.00 164 Y 8.50 4.82 0.00 2.98 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 0.00 165 A 7.72 5.56 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 0.00 166 G 7.97 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 0.00 167 E 8.46 4.70 0.00 1.98 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 2.24 2.30 0.00 168 P 0.00 4.71 0.00 2.42 2.34 0.00 3.81 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 2.02 1.93 0.00 169 V 8.26 4.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.98 0.00 0.00 170 R 8.78 3.60 0.00 1.77 1.95 0.00 3.23 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 *171 L 7.75 4.13 0.00 1.43 1.52 0.92 0.72 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 * Residues marked with a * may have inaccurate shift predictions.