NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 P 4.4290 0.0000 0.0000 65.2397 32.8449 178.7390 13 K 4.2388 7.5782 118.8020 57.2045 32.9782 176.3742 14 G 3.8698 8.9179 105.4760 47.3897 0.0000 173.7158 15 V 4.6830 8.7821 115.0811 60.8618 33.1537 176.7690 16 S 4.4904 9.2610 119.8985 56.6369 64.5213 171.8667 17 V 4.1239 8.1741 122.1119 62.2289 31.5045 174.4002 18 E 4.5809 9.0767 128.6858 55.1779 31.3295 175.7394 19 V 4.5703 8.3563 122.3395 61.3036 34.4488 174.3640 20 A 4.7625 8.1131 129.1974 49.7499 21.4475 172.7014 21 P 3.9112 0.0000 0.0000 65.9261 31.6087 176.5076 22 G 4.2705 8.0798 101.9376 46.1371 0.0000 171.7018 23 R 5.0410 7.9603 117.8590 54.0911 35.3703 174.3002 24 V 4.5345 7.9930 119.8575 61.4142 35.0180 174.2805 25 K 4.8243 8.6500 128.2564 55.2187 33.3463 175.5862 26 V 4.5328 8.3578 126.7588 61.3818 32.9915 175.0100 27 K 4.7948 8.6279 128.0602 55.1412 35.2890 175.7872 28 G 4.5513 7.8863 107.3132 45.2969 0.0000 172.1289 29 P 4.3686 0.0000 0.0000 65.2881 31.1803 177.7586 30 K 4.3261 8.1747 116.8384 56.1153 33.8865 177.0637 31 G 4.0418 7.3395 106.5645 46.2075 0.0000 170.4925 32 E 5.5039 8.4027 120.8050 54.5152 31.0483 175.1417 33 L 4.8793 8.2056 123.8231 53.1765 46.8451 174.8888 34 E 4.6666 8.7462 120.8948 54.6509 30.3338 177.2773 35 V 4.4555 8.1036 128.1326 60.2069 30.2238 173.2887 36 P 4.5682 0.0000 0.0000 63.9634 32.0123 177.2491 37 V 4.5452 9.2337 122.6389 60.9770 35.6314 174.4596 38 S 4.2530 8.5271 115.8711 57.6852 62.6393 172.8149 39 P 4.4943 0.0000 0.0000 63.5407 30.8369 175.8763 40 E 4.5915 8.0239 118.4390 56.3488 31.2105 174.1334 41 M 3.5715 8.6650 120.8735 54.3906 29.8530 177.3009 42 R 3.7739 7.7837 114.6578 57.0373 28.6707 175.7875 43 V 3.7872 7.9384 109.2668 60.2892 31.6106 175.7981 44 V 4.3384 8.2148 127.6228 63.2300 34.4628 177.4612 45 V 4.4866 8.6334 122.6989 60.8535 32.7430 174.3770 46 E 4.4113 8.4031 125.0005 57.5321 30.4602 175.4908 47 E 4.0239 8.7192 123.4105 55.0919 27.8904 176.7358 48 G 3.8537 8.4145 112.0932 46.5976 0.0000 173.6687 49 V 4.3410 7.5923 113.2691 60.2164 35.3501 172.7861 50 V 4.6546 8.2198 119.3752 61.9092 33.7607 175.6718 51 R 4.8608 8.2076 124.8702 54.6309 34.2447 174.9129 52 V 4.3849 8.1237 118.7550 62.1252 34.4382 173.1942 53 E 4.9891 8.3593 129.3089 55.5617 32.1678 174.0092 54 R 4.5370 8.3777 113.3561 55.2924 32.0345 171.4894 55 P 4.3403 0.0000 0.0000 64.2884 32.1306 180.9527 56 S 4.4513 7.5469 119.7104 57.4923 64.6375 175.0028 57 D 4.7944 8.4349 122.2597 54.2032 42.9674 175.1773 58 E 4.0443 8.1384 120.7705 56.2969 29.7730 178.0703 59 R 3.8546 8.8697 123.2875 59.4546 29.8204 178.8797 60 R 3.9357 7.8607 117.3350 59.7382 30.0005 178.2890 61 H 4.1278 8.4811 116.0688 58.7645 28.6058 177.8287 62 K 4.0009 8.0137 118.8514 59.8623 31.8505 178.6783 63 S 4.2983 7.7899 114.7800 61.8192 62.5683 176.9806 64 L 4.0998 7.9564 121.2590 56.4863 41.2224 176.9925 65 H 4.6720 9.1901 117.9037 56.0002 31.3015 174.7849 66 G 4.3041 8.2657 115.6482 46.6920 0.0000 175.7113 67 L 3.9307 7.1655 118.1168 58.5002 41.9668 179.3279 68 T 3.9574 7.4095 112.3683 66.0593 68.1881 176.6411 69 R 3.8517 7.9020 119.7352 60.0976 29.9991 178.1434 70 T 4.0713 8.3909 114.9731 67.8334 68.6453 177.2457 71 L 3.5057 8.1478 117.6040 57.2222 41.5812 179.3566 72 I 3.6354 8.4106 119.5140 64.9985 37.4254 178.5156 73 A 3.8424 7.6096 121.2021 55.2227 18.0040 179.0812 74 N 4.3959 8.2576 114.4873 55.6346 38.9016 177.3845 75 A 3.9337 8.6202 122.7225 55.2947 18.4025 178.7715 76 V 3.7170 8.1084 117.1239 64.0559 31.1106 177.4295 77 K 3.9996 7.1885 122.7074 59.6907 32.9783 178.7708 78 G 3.7642 8.6929 106.2596 48.1276 0.0000 176.2970 79 V 3.7024 7.3627 114.1112 63.3714 32.3982 177.6887 80 S 4.4224 7.9471 115.5844 58.5033 61.8620 174.6333 81 E 3.9168 8.0686 120.2091 56.5853 26.0541 172.8784 82 G 4.2794 8.6820 107.4274 43.8044 0.0000 169.1391 83 Y 4.7183 9.2739 120.9328 56.2174 38.1230 178.9934 84 S 3.2654 9.8370 113.1852 59.6448 63.8763 171.1055 85 K 4.1709 7.1000 130.0464 56.2924 33.8077 173.2009 86 E 4.8802 7.6444 123.2668 54.7636 32.5539 174.9739 87 L 5.7996 9.4136 120.8356 52.9399 46.8118 174.6796 88 L 5.2765 8.0439 119.6539 54.3054 44.9910 175.2728 89 I 4.1654 8.4271 118.7676 62.5557 41.6356 174.5715 90 K 4.2713 9.6277 117.6219 55.8970 32.4446 173.2522 91 G 4.0269 8.4462 106.6614 44.7323 0.0000 172.2584 92 I 4.6219 7.4510 130.7771 60.5904 35.5928 179.3071 93 G 4.1413 8.9656 116.2097 46.5017 0.0000 173.6770 94 Y 5.0794 9.3792 120.7006 55.9313 37.6533 175.4930 95 R 5.2017 8.1634 119.5736 56.5242 33.0033 173.1678 96 A 4.9391 8.4503 119.4114 50.5339 22.3705 176.4853 97 R 4.2554 8.4774 120.0166 53.6440 30.9619 174.9785 98 L 3.7844 8.4761 124.7632 55.7517 42.0236 177.6536 99 V 4.1099 8.5585 128.2588 61.5490 31.2261 177.1207 100 G 4.0479 7.8313 118.8601 46.4651 0.0000 173.8277 101 R 4.2422 8.8390 123.8614 56.1196 30.5287 175.0579 102 A 4.5557 7.6264 120.9316 49.7795 22.2450 174.1481 103 L 5.0314 7.3240 117.7585 54.0556 44.3646 175.7737 104 E 5.5689 8.5457 119.1196 53.4935 29.6802 173.2384 105 L 4.6419 7.9318 123.8806 54.7237 43.0104 176.1803 106 T 4.5811 8.3543 112.2403 60.5056 71.5467 174.6627 107 V 3.3383 8.0159 116.1320 60.8159 33.6424 173.2740 108 G 4.5350 8.6466 117.2004 45.9786 0.0000 172.4317 109 F 4.1437 8.4313 118.3223 57.7900 39.1956 176.2296 110 S 4.4064 8.7318 118.1157 59.7654 62.8581 173.5811 111 H 4.7014 8.1904 121.1697 53.8905 31.7867 170.8978 112 P 4.1505 0.0000 0.0000 63.3385 31.5904 175.3188 113 V 4.0961 8.0137 119.5408 61.5013 33.1889 174.7386 114 V 4.4814 8.2766 128.6912 61.3929 32.4362 175.2238 115 V 3.8462 8.6982 130.4171 61.4882 32.1718 175.1113 116 E 3.8849 8.8572 129.1126 56.0644 29.8517 174.5816 117 P 4.5419 0.0000 0.0000 60.8215 31.6092 174.0959 118 P 4.4521 0.0000 0.0000 62.0867 32.0673 175.5613 119 E 4.1170 8.5745 121.2791 57.0480 29.7091 177.5546 120 G 4.0491 9.0511 113.8471 44.9392 0.0000 172.4387 121 I 4.6567 6.9953 118.6722 59.7062 39.5431 175.2109 122 T 4.6891 9.4832 124.0421 61.8216 71.2654 173.1242 123 F 4.5800 8.9157 124.6944 55.9710 40.6126 174.9151 124 E 4.5752 8.6550 123.1970 54.6925 32.1295 175.5198 125 V 4.4482 8.4915 126.0625 60.7090 30.7450 173.4393 126 P 4.4019 0.0000 0.0000 65.3274 31.7193 176.1095 127 E 4.6654 7.3243 115.5603 54.7979 33.7858 172.7292 128 P 4.4853 0.0000 0.0000 65.9337 32.8285 178.0091 129 T 3.8625 8.1378 108.1633 62.8438 67.3741 175.6013 130 R 4.2822 8.7954 118.3729 57.0368 32.0708 175.2948 131 V 4.8224 8.4962 123.1224 61.8033 35.7208 172.7220 132 R 4.9234 8.5380 122.4553 54.5839 33.1886 173.8136 133 V 4.0328 8.8910 122.3858 61.3085 32.8407 175.0219 134 S 4.8684 9.2960 124.2594 56.1623 65.8344 173.7137 135 G 4.0856 7.6640 110.8717 46.4610 0.0000 171.3830 136 I 4.5969 8.3312 118.3131 59.8537 38.2258 175.7491 137 D 5.0749 8.7987 130.0435 53.6069 40.1926 178.6985 138 K 5.0219 6.6951 126.2807 57.4155 31.9277 175.8647 139 Q 4.2336 7.5459 120.8184 59.0079 29.4700 179.4598 140 K 4.2001 8.1840 115.7618 58.9592 33.0367 178.5396 141 V 3.7286 7.5890 118.1815 65.7412 31.6130 177.8510 142 G 3.6925 8.5759 105.5847 48.1030 0.0000 175.1331 143 Q 4.3016 7.6344 121.7196 58.0516 28.6843 177.0473 144 V 4.3013 8.2253 119.6790 62.5844 33.1906 176.6527 145 A 4.5005 8.3478 121.0771 52.4800 20.3747 179.2718 146 A 3.9432 7.6718 118.3436 55.6070 18.2698 179.4664 147 N 4.3121 8.2853 114.2976 55.7927 38.5122 175.3407 148 I 4.3792 7.8155 119.2372 60.6804 39.3766 177.5706 149 R 3.3342 7.0381 121.6913 59.7499 30.0268 178.8883 150 A 4.1814 7.9631 119.4436 53.9424 18.6672 178.3706 151 I 3.9115 8.5930 118.0813 63.3551 37.4543 176.7372 152 R 4.8312 7.3248 116.7963 53.8868 33.8348 176.8858 153 K 4.4249 8.3610 125.2244 56.4334 32.4794 174.0070 154 P 4.5728 0.0000 0.0000 64.2910 33.5165 176.9802 155 S 4.3331 7.7816 115.5913 57.0662 62.4068 175.3217 156 A 4.3256 8.0271 119.6562 53.3398 16.9467 178.3276 157 Y 3.5502 8.5496 116.1773 60.4119 36.0569 171.5478 158 H 3.7345 8.8937 114.0711 57.0242 27.9673 173.5583 159 E 4.3679 7.9947 126.3184 55.9558 29.5774 176.4922 160 K 4.0711 7.0382 117.7900 56.3347 32.8980 175.8662 161 G 4.1885 9.3059 108.8398 45.3366 0.0000 173.0435 162 I 4.7251 7.9390 112.8686 60.0165 40.0388 174.0686 163 Y 4.6852 8.4705 119.2820 58.8013 42.6175 174.3783 164 Y 4.5192 9.7241 120.2019 58.8465 36.9389 176.6503 165 A 4.6165 9.3882 128.7855 53.1279 24.6920 178.0078 166 G 3.9785 8.1199 104.4121 44.9436 0.0000 172.2301 167 E 4.6861 8.3112 117.9772 53.4983 31.9340 174.6181 168 P 4.6541 0.0000 0.0000 62.4387 32.3087 176.0125 169 V 4.3580 7.9683 117.6833 60.7297 33.5191 176.2089 170 R 3.6464 8.4949 124.6095 59.2874 30.1655 176.6764 *171 L 4.1254 7.7396 122.7450 53.6686 41.6082 178.2584 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 4.43 0.00 2.20 2.11 0.00 3.60 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 2.01 2.11 0.00 13 K 7.58 4.24 0.00 1.84 1.84 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.44 7.81 14 G 8.92 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 15 V 8.78 4.68 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 0.70 0.00 0.00 0.98 0.00 0.00 16 S 9.26 4.49 0.00 3.67 3.74 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 17 V 8.17 4.12 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 0.77 0.00 0.00 0.93 0.00 0.00 18 E 9.08 4.58 0.00 2.08 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 2.44 2.39 0.00 19 V 8.36 4.57 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 0.80 0.00 0.00 0.93 0.00 0.00 20 A 8.11 4.76 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 3.91 0.00 2.05 1.99 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 2.04 2.12 0.00 22 G 8.08 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 0.00 0.00 0.00 23 R 7.96 5.04 0.00 1.71 1.77 0.00 3.07 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 24 V 7.99 4.53 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 1.11 0.00 0.00 0.93 0.00 0.00 25 K 8.65 4.82 0.00 1.69 1.94 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.56 1.36 7.81 26 V 8.36 4.53 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 1.05 0.00 0.00 0.93 0.00 0.00 27 K 8.63 4.79 0.00 1.71 1.68 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.47 7.81 28 G 7.89 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 P 0.00 4.37 0.00 1.96 2.18 0.00 3.66 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 30 K 8.17 4.33 0.00 1.68 1.78 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.55 1.45 7.81 31 G 7.34 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 32 E 8.40 5.50 0.00 1.98 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 2.23 2.27 0.00 33 L 8.21 4.88 0.00 1.56 1.45 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.75 4.67 0.00 1.84 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 2.23 2.23 0.00 35 V 8.10 4.46 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 0.98 0.00 0.00 0.92 0.00 0.00 36 P 0.00 4.57 0.00 2.11 2.07 0.00 3.85 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 37 V 9.23 4.55 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 0.76 0.00 0.00 0.97 0.00 0.00 38 S 8.53 4.25 0.00 3.89 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.49 0.00 2.09 2.07 0.00 3.72 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 2.03 2.11 0.00 40 E 8.02 4.59 0.00 1.99 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 2.30 2.47 0.00 41 M 8.67 3.57 0.00 2.08 2.53 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.66 0.00 42 R 7.78 3.77 0.00 1.92 1.97 0.00 3.24 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 43 V 7.94 3.79 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 0.75 0.00 0.00 0.93 0.00 0.00 44 V 8.21 4.34 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 0.97 0.00 0.00 45 V 8.63 4.49 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 0.95 0.00 0.00 0.96 0.00 0.00 46 E 8.40 4.41 0.00 2.16 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 2.21 2.39 0.00 47 E 8.72 4.02 0.00 2.11 2.39 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 2.24 2.24 0.00 48 G 8.41 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 0.00 0.00 0.00 49 V 7.59 4.34 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 8.22 4.65 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.93 0.00 0.00 51 R 8.21 4.86 0.00 1.81 1.79 0.00 3.21 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 52 V 8.12 4.38 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 0.64 0.00 0.00 0.91 0.00 0.00 53 E 8.36 4.99 0.00 1.94 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 2.19 2.20 0.00 54 R 8.38 4.54 0.00 1.89 1.96 0.00 3.04 0.00 0.00 2.98 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.47 0.00 55 P 0.00 4.34 0.00 2.08 1.94 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.64 0.00 56 S 7.55 4.45 0.00 3.99 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 57 D 8.43 4.79 0.00 2.61 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.14 4.04 0.00 2.15 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 2.35 2.28 0.00 59 R 8.87 3.85 0.00 1.87 1.96 0.00 3.18 0.00 0.00 3.34 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 60 R 7.86 3.94 0.00 1.87 1.88 0.00 3.17 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 61 H 8.48 4.13 0.00 3.33 3.36 0.00 5.85 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 8.01 4.00 0.00 1.73 1.92 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.58 7.81 63 S 7.79 4.30 0.00 4.05 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 64 L 7.96 4.10 0.00 1.83 1.72 0.87 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 65 H 9.19 4.67 0.00 3.15 3.37 0.00 5.84 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 8.27 4.30 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 0.00 67 L 7.17 3.93 0.00 1.99 1.90 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 68 T 7.41 3.96 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 1.20 0.00 0.00 69 R 7.90 3.85 0.00 1.68 2.12 0.00 3.24 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 70 T 8.39 4.07 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 71 L 8.15 3.51 0.00 1.80 1.56 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 72 I 8.41 3.64 1.86 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 1.45 0.83 0.91 0.00 0.00 73 A 7.61 3.84 1.40 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 74 N 8.26 4.40 0.00 2.89 2.86 0.00 0.00 6.71 7.09 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 75 A 8.62 3.93 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 76 V 8.11 3.72 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.93 0.00 0.00 77 K 7.19 4.00 0.00 1.74 1.92 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.73 7.81 78 G 8.69 3.76 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 0.00 0.00 0.00 79 V 7.36 3.70 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.05 0.00 0.00 80 S 7.95 4.42 0.00 4.02 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 81 E 8.07 3.92 0.00 2.20 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 2.37 2.36 0.00 82 G 8.68 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 0.00 0.00 0.00 0.00 83 Y 9.27 4.72 0.00 2.74 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 84 S 9.84 3.27 0.00 4.03 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 85 K 7.10 4.17 0.00 1.81 1.99 0.00 1.48 0.00 0.00 1.50 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.98 0.87 7.81 86 E 7.64 4.88 0.00 2.03 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 2.28 2.27 0.00 87 L 9.41 5.80 0.00 1.51 1.68 0.94 0.33 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 88 L 8.04 5.28 0.00 1.67 1.58 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.43 4.17 2.16 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.62 1.04 0.00 0.00 90 K 9.63 4.27 0.00 2.16 2.05 0.00 1.62 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.13 7.81 91 G 8.45 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 7.45 4.62 1.96 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.70 0.98 0.00 0.00 93 G 8.97 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 0.00 0.00 0.00 0.00 94 Y 9.38 5.08 0.00 2.62 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 95 R 8.16 5.20 0.00 1.92 2.06 0.00 3.12 0.00 0.00 3.35 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.45 0.00 96 A 8.45 4.94 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 97 R 8.48 4.26 0.00 1.75 1.87 0.00 3.24 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 98 L 8.48 3.78 0.00 1.61 1.66 1.09 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.56 4.11 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 0.95 0.00 0.00 100 G 7.83 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 R 8.84 4.24 0.00 1.82 2.01 0.00 3.16 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 102 A 7.63 4.56 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 0.00 103 L 7.32 5.03 0.00 1.71 1.62 1.06 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.55 5.57 0.00 1.86 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 2.10 2.11 0.00 105 L 7.93 4.64 0.00 1.77 1.75 0.84 0.18 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 0.00 106 T 8.35 4.58 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 8.02 3.34 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.27 0.00 0.00 108 G 8.65 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 F 8.43 4.14 0.00 2.95 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 0.00 110 S 8.73 4.41 0.00 4.01 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 0.00 111 H 8.19 4.70 0.00 3.08 3.28 0.00 5.98 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 0.00 112 P 0.00 4.15 0.00 2.25 2.01 0.00 3.62 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.90 0.00 113 V 8.01 4.10 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 0.68 0.00 0.00 0.64 0.00 0.00 114 V 8.28 4.48 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 0.75 0.00 0.00 0.87 0.00 0.00 115 V 8.70 3.85 1.69 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 0.63 0.00 0.00 0.81 0.00 0.00 116 E 8.86 3.88 0.00 1.92 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 2.28 2.30 0.00 117 P 0.00 4.54 0.00 2.21 2.10 0.00 3.77 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.91 0.00 118 P 0.00 4.45 0.00 2.24 2.14 0.00 3.92 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 119 E 8.57 4.12 0.00 2.02 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 2.36 2.30 0.00 120 G 9.05 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 7.00 4.66 1.92 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 1.20 0.86 0.90 0.00 0.00 122 T 9.48 4.69 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 1.25 0.00 0.00 123 F 8.92 4.58 0.00 3.13 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 0.00 124 E 8.66 4.58 0.00 1.98 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 2.24 2.38 0.00 125 V 8.49 4.45 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 0.96 0.00 0.00 1.04 0.00 0.00 126 P 0.00 4.40 0.00 2.22 2.16 0.00 3.92 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 127 E 7.32 4.67 0.00 1.80 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 2.26 2.39 0.00 128 P 0.00 4.49 0.00 2.24 2.32 0.00 3.70 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 2.09 1.97 0.00 129 T 8.14 3.86 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 130 R 8.80 4.28 0.00 1.92 1.88 0.00 3.20 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 131 V 8.50 4.82 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 0.91 0.00 0.00 1.03 0.00 0.00 132 R 8.54 4.92 0.00 1.80 1.89 0.00 2.76 0.00 0.00 3.06 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 133 V 8.89 4.03 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 0.46 0.00 0.00 0.32 0.00 0.00 134 S 9.30 4.87 0.00 3.86 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 0.00 135 G 7.66 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 8.33 4.60 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.27 0.87 0.00 0.00 137 D 8.80 5.07 0.00 2.70 1.82 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 0.00 138 K 6.70 5.02 0.00 1.98 1.79 0.00 1.74 0.00 0.00 1.58 0.00 0.00 3.11 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.22 1.09 7.81 139 Q 7.55 4.23 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.25 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 140 K 8.18 4.20 0.00 1.73 1.81 0.00 1.78 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.46 7.81 141 V 7.59 3.73 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 0.86 0.00 0.00 0.90 0.00 0.00 142 G 8.58 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 0.00 143 Q 7.63 4.30 0.00 2.47 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 144 V 8.23 4.30 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 1.11 0.00 0.00 1.19 0.00 0.00 145 A 8.35 4.50 1.40 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 0.00 146 A 7.67 3.94 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 0.00 147 N 8.29 4.31 0.00 2.87 2.98 0.00 0.00 6.86 7.32 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 0.00 148 I 7.82 4.38 1.92 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.48 0.97 0.00 0.00 149 R 7.04 3.33 0.00 2.16 2.41 0.00 2.83 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.74 0.00 150 A 7.96 4.18 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 0.00 151 I 8.59 3.91 1.72 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.73 0.45 0.00 0.00 152 R 7.32 4.83 0.00 1.65 1.86 0.00 3.24 0.00 0.00 2.97 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 153 K 8.36 4.42 0.00 1.89 1.86 0.00 1.54 0.00 0.00 1.92 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.50 1.40 7.81 154 P 0.00 4.57 0.00 2.11 1.90 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.84 0.00 155 S 7.78 4.33 0.00 3.84 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 0.00 156 A 8.03 4.33 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 0.00 157 Y 8.55 3.55 0.00 2.98 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 H 8.89 3.73 0.00 3.23 3.30 0.00 5.68 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 7.99 4.37 0.00 2.16 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 2.15 2.24 0.00 160 K 7.04 4.07 0.00 1.92 2.05 0.00 1.75 0.00 0.00 2.02 0.00 0.00 2.81 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.47 1.43 7.81 161 G 9.31 4.19 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 0.00 0.00 0.00 162 I 7.94 4.73 1.97 0.00 0.00 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 1.34 0.74 1.03 0.00 0.00 163 Y 8.47 4.69 0.00 2.93 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 0.00 164 Y 9.72 4.52 0.00 2.80 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 0.00 165 A 9.39 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 0.00 166 G 8.12 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 0.00 167 E 8.31 4.69 0.00 1.93 1.82 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 2.17 2.25 0.00 168 P 0.00 4.65 0.00 2.07 2.24 0.00 3.65 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 1.86 1.76 0.00 169 V 7.97 4.36 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 0.86 0.00 0.00 0.95 0.00 0.00 170 R 8.49 3.65 0.00 1.80 1.97 0.00 3.20 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 1.59 1.61 0.00 *171 L 7.74 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.