NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2971 8.2393 120.8598 56.4441 30.4994 174.4633 3 L 3.9492 8.4863 122.9065 57.8934 41.1972 179.9698 4 N 3.3367 6.4337 112.5030 54.7713 43.2354 175.9805 5 T 4.2283 7.4618 110.6054 61.2464 67.3531 174.8455 6 L 4.6065 7.7538 122.3621 53.9479 44.8063 175.2050 7 S 4.7540 8.3748 119.6401 55.5164 66.1392 171.6400 8 P 4.4905 0.0000 0.0000 61.3165 32.3003 175.3487 9 A 4.0770 8.2894 121.5360 52.2618 18.9595 176.4652 10 E 4.1378 8.6788 120.1469 56.6148 30.3357 176.7851 11 G 3.9773 8.7934 113.2666 46.5418 0.0000 174.2856 12 S 4.3561 7.6249 113.0833 58.8525 63.6153 174.1477 13 K 4.7786 7.7316 119.5017 54.8974 34.6933 175.5049 14 K 4.4675 7.9736 118.2313 56.2648 33.2555 177.5646 15 A 3.6149 8.3320 122.5303 52.0911 17.8437 176.7937 16 G 4.0520 8.1951 104.6895 43.1915 0.0000 172.5828 17 K 3.7373 8.9146 123.2743 57.5884 32.1256 176.4261 18 R 3.8515 8.3601 124.0165 57.0286 30.6284 172.2393 19 L 3.5235 8.3129 127.3633 55.4990 43.6813 174.2071 20 G 3.5538 9.5948 114.2781 44.4637 0.0000 174.1862 21 R 4.0223 7.7589 107.9159 56.9611 31.5162 176.3517 22 G 3.9845 8.5295 109.4826 45.3873 0.0000 173.3381 23 I 3.9427 8.1315 117.8445 63.3059 37.8889 179.1310 24 G 3.6797 8.0288 107.4433 48.0867 0.0000 174.6078 25 S 4.0406 8.0976 114.0328 59.8750 62.6673 175.6822 26 G 4.0068 9.0493 107.4717 45.4759 0.0000 173.6930 27 L 4.6338 7.6104 115.6097 54.2346 46.0379 176.5490 28 G 4.0061 7.2575 106.5921 45.1738 0.0000 172.1387 29 K 3.4016 9.3681 121.2310 56.9593 29.7087 169.6447 30 T 3.3565 8.4339 121.7534 60.5934 69.1068 173.9354 31 G 3.7723 8.5938 117.3173 45.8599 0.0000 172.7734 32 G 4.0477 7.8761 114.5571 47.5988 0.0000 171.7046 33 R 4.4428 7.9256 115.3934 54.7491 33.7575 178.6788 34 G 3.8954 8.1610 104.5079 45.8727 0.0000 172.1217 35 H 4.9121 8.3744 119.1777 54.2597 32.6457 175.2044 36 K 3.4579 9.5202 119.3917 58.1239 31.0392 174.5870 37 G 3.8341 8.5666 108.2688 45.9751 0.0000 172.0903 38 Q 4.3299 8.3587 117.0470 57.5210 29.9337 176.9242 39 K 4.6181 7.8257 117.1731 56.3535 32.8569 177.6141 40 S 4.2362 8.5061 110.3332 57.8370 64.2765 176.3964 41 R 3.1488 8.8166 115.5048 55.9251 27.6115 175.2287 42 S 3.8283 8.5730 121.8324 58.9533 62.0899 172.9689 43 G 3.7690 8.9128 118.9601 45.5242 0.0000 170.8104 44 G 4.0121 8.2287 108.6979 43.9958 0.0000 169.7074 45 G 4.3640 8.2879 119.0778 44.7000 0.0000 172.2698 46 V 4.0234 7.8175 116.5997 60.3915 32.9858 175.7762 47 R 4.3483 8.2170 116.9588 54.6564 30.6130 175.0239 48 R 4.1530 8.5120 116.7408 60.6400 28.4550 175.4074 49 G 3.8238 8.6129 110.7993 45.2479 0.0000 171.8325 50 F 5.0314 8.2910 123.0850 57.2130 40.4392 175.0142 51 E 4.2853 8.0112 124.8852 56.0794 30.4316 176.7467 52 G 3.6008 5.3800 106.1470 44.3938 0.0000 174.1389 53 G 4.1963 7.5838 108.0892 45.9313 0.0000 174.6539 54 Q 3.7959 7.9738 121.1049 56.2051 29.1853 174.7073 55 M 3.6661 8.6049 124.7981 54.9267 32.2605 174.6502 56 P 4.5080 0.0000 0.0000 62.3541 33.3321 176.6668 57 L 3.8796 9.1382 122.3745 58.9049 41.7609 179.3394 58 Y 4.1529 8.0530 115.2509 60.2143 37.8851 178.0166 59 R 4.0153 6.9038 118.4147 58.5184 30.3489 178.5923 60 R 3.9765 8.0920 117.8783 57.9501 30.5281 177.1252 61 L 4.4606 7.4581 117.9436 52.7504 42.8221 175.3878 62 P 4.5960 0.0000 0.0000 61.8042 32.8992 174.8820 63 K 4.2826 8.2507 116.9127 55.2537 34.1772 175.4545 64 F 4.7237 8.0413 119.4668 56.6526 38.2239 175.6949 65 G 4.0254 7.6150 109.3795 45.8499 0.0000 173.2545 66 F 5.1442 7.5881 125.4962 58.0611 41.4198 172.9144 67 T 4.4225 5.8761 112.9655 59.4051 71.1884 174.1196 68 S 3.8668 8.1849 119.6745 61.6584 63.0554 176.5869 69 R 4.1288 8.5846 115.3741 56.4761 27.4596 176.9886 70 K 4.6082 7.3908 118.8411 54.5344 31.9964 176.1400 71 A 4.6142 7.9180 118.4025 52.6084 23.4167 178.4497 72 A 4.2465 8.1318 117.2579 53.8364 18.7515 177.5248 73 I 4.5474 7.5959 107.4764 60.5652 40.4489 175.2303 74 T 4.9365 7.6059 119.1473 62.8146 69.0641 174.7024 75 A 4.7594 8.9640 129.5840 50.4163 22.1099 175.0900 76 E 4.7829 8.4055 115.9527 54.9048 31.6770 175.8340 77 I 4.3334 8.0885 125.7581 60.5171 38.7284 175.4575 78 R 4.8417 8.2028 121.3602 53.9554 33.7953 176.8620 79 L 4.3725 8.6677 118.3049 55.9961 41.1823 177.7949 80 S 4.8075 7.9266 111.8417 58.0249 65.1730 173.4635 81 D 4.3848 8.5071 121.6803 54.5403 39.5837 181.7564 82 L 3.1782 8.8332 122.2183 56.4587 43.9811 175.2882 83 A 4.0006 8.1506 126.3019 55.3934 18.7329 178.1022 84 K 4.0398 8.4682 119.5168 57.7846 31.6478 176.3452 85 V 4.7209 8.3924 130.9187 62.1415 32.7843 172.7346 86 E 4.1312 8.8635 125.9780 56.5582 27.1496 176.8452 87 G 4.4455 7.3216 112.7104 46.0438 0.0000 171.2382 88 G 3.6884 7.8912 121.6642 45.2064 0.0000 170.4276 89 V 3.1741 8.0574 130.2390 60.7391 33.0723 173.9086 90 V 4.0559 7.9316 121.8280 60.9145 29.8489 174.3950 91 D 4.7247 7.7530 121.6758 53.9321 41.6221 175.4515 92 L 4.0500 7.6320 120.3689 58.4942 43.3301 179.3069 93 N 4.8836 7.6028 119.0480 51.8118 36.3088 175.8860 94 T 3.7119 8.3086 119.2859 64.7861 67.7186 173.6237 95 L 3.9284 7.8330 120.0231 57.9607 41.3506 179.1606 96 K 4.0648 7.9356 115.7542 58.8137 32.2847 177.8985 97 A 3.9961 7.9343 123.0594 54.2790 19.1386 177.6325 98 A 4.4541 7.8118 119.8935 55.0999 18.4504 178.9651 99 N 3.9341 7.0684 116.4362 51.4242 36.3378 174.0679 100 I 3.9624 7.8633 127.1197 63.0588 41.9337 173.1175 101 I 3.7834 8.2464 135.0000 60.3991 34.6375 172.8148 102 G 4.0937 8.4393 106.6864 44.5466 0.0000 174.6274 103 I 3.6823 8.6086 125.8788 64.5304 37.4474 177.4378 104 Q 4.1213 8.1221 118.2975 58.7460 28.7509 177.2642 105 I 4.6301 7.4338 116.6012 61.7381 37.5233 175.5511 106 E 4.6616 8.5692 118.4643 55.7189 32.2588 175.4373 107 F 4.9849 8.1697 117.6260 55.6010 44.0362 173.4262 108 A 5.0532 8.5418 122.6812 50.6048 22.5766 176.1193 109 K 4.9972 8.4825 121.9121 55.0559 34.8355 176.6413 110 V 4.1467 8.3834 115.7450 64.3227 35.8904 176.0368 111 I 3.4557 7.8371 109.2419 60.6834 38.7273 171.9691 112 L 4.6653 8.2715 119.1593 54.6777 42.8457 174.9431 113 A 4.5280 9.2237 125.2438 51.6502 21.0467 177.6920 114 G 4.2478 7.9662 109.5375 45.7384 0.0000 172.7193 115 E 3.9800 8.2978 118.7788 55.7016 31.4258 176.7032 116 V 4.1986 8.1983 118.0305 63.7243 33.9488 177.1906 117 T 3.0811 7.9402 118.3667 63.3479 67.5523 172.5288 118 T 3.7982 8.6206 121.9581 63.2515 67.7602 174.4565 119 P 4.6286 0.0000 0.0000 61.7000 30.2476 176.2641 120 V 3.8636 6.8616 114.6475 63.6948 32.8415 174.9480 121 T 4.7847 8.2282 117.6846 59.7945 69.6745 173.8610 122 V 4.4714 8.3898 122.2280 60.4527 31.2063 174.9908 123 R 4.2978 8.6388 124.7212 55.5790 31.7707 177.5999 124 G 4.0556 8.9537 110.6503 46.0736 0.0000 172.8722 125 L 4.8816 7.3755 119.5495 52.6981 44.9808 175.4928 126 R 4.7005 8.4934 117.6781 54.9307 33.0884 175.2677 127 V 4.4789 8.3318 123.7846 59.7311 33.7305 176.0245 128 T 4.1578 8.5764 120.0389 63.7816 68.8647 175.3124 129 K 4.1463 8.8791 122.9487 59.6383 32.6364 179.2407 130 G 3.4431 8.0206 106.0722 46.6762 0.0000 175.3597 131 A 4.0850 7.7748 121.9179 54.0890 18.5839 179.4945 132 R 3.7840 8.1739 117.7402 59.2334 30.0095 177.6924 133 A 4.3925 7.2543 116.4511 52.3271 18.3321 177.4720 134 A 4.6051 7.3934 118.5200 52.5529 21.0096 177.5759 135 I 4.1931 7.2879 115.1329 62.4792 39.2448 177.4138 136 E 4.1881 8.7187 119.3136 58.2757 30.0857 177.8543 137 A 4.0733 8.1290 121.3534 55.2577 18.5910 179.0254 138 A 4.0190 7.8251 116.4263 52.4431 18.6826 175.1218 139 G 3.6866 8.3583 114.0940 48.0009 0.0000 174.0191 140 G 4.2891 7.2961 112.3545 45.3334 0.0000 170.1179 141 K 4.8760 7.9199 120.1070 54.4136 36.2009 174.5705 142 I 4.7327 8.0836 124.9929 59.1690 40.2829 176.1536 143 E 4.2524 8.9527 122.6118 57.0560 29.7437 176.4326 144 E 4.0881 7.7883 126.2401 56.7976 29.5842 176.1578 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 R 8.24 4.30 0.00 1.79 1.94 0.00 3.19 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 3 L 8.49 3.95 0.00 1.99 1.89 0.92 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 4 N 6.43 3.34 0.00 2.74 2.79 0.00 0.00 6.98 7.70 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 5 T 7.46 4.23 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 1.21 0.00 0.00 6 L 7.75 4.61 0.00 1.69 1.55 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.37 4.75 0.00 3.95 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.49 0.00 2.20 2.11 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 9 A 8.29 4.08 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 10 E 8.68 4.14 0.00 2.01 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 2.35 2.30 0.00 11 G 8.79 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 12 S 7.62 4.36 0.00 4.10 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.73 4.78 0.00 1.73 1.73 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.36 7.81 14 K 7.97 4.47 0.00 1.67 1.73 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.36 7.81 15 A 8.33 3.61 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.20 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 17 K 8.91 3.74 0.00 1.87 1.90 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.51 7.81 18 R 8.36 3.85 0.00 1.82 1.97 0.00 3.47 0.00 0.00 3.15 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 19 L 8.31 3.52 0.00 1.75 1.69 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 20 G 9.59 3.55 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 21 R 7.76 4.02 0.00 1.86 1.89 0.00 3.07 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.52 0.00 22 G 8.53 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 23 I 8.13 3.94 1.87 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 1.35 1.05 0.91 0.00 0.00 24 G 8.03 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 25 S 8.10 4.04 0.00 3.98 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 26 G 9.05 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 0.00 0.00 0.00 27 L 7.61 4.63 0.00 1.58 1.65 0.92 0.90 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 28 G 7.26 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 0.00 0.00 0.00 29 K 9.37 3.40 0.00 1.85 1.81 0.00 1.88 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.40 7.81 30 T 8.43 3.36 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 1.17 0.00 0.00 31 G 8.59 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.88 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 33 R 7.93 4.44 0.00 1.75 1.93 0.00 3.24 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 1.51 1.78 0.00 34 G 8.16 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 35 H 8.37 4.91 0.00 3.07 3.21 0.00 6.05 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 36 K 9.52 3.46 0.00 1.89 1.83 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.44 7.81 37 G 8.57 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Q 8.36 4.33 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.25 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 39 K 7.83 4.62 0.00 1.80 1.82 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.44 7.81 40 S 8.51 4.24 0.00 3.90 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 41 R 8.82 3.15 0.00 1.91 2.30 0.00 3.42 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 42 S 8.57 3.83 0.00 3.82 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 43 G 8.91 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.23 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 0.00 0.00 0.00 45 G 8.29 4.36 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 0.00 46 V 7.82 4.02 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.13 0.00 0.00 47 R 8.22 4.35 0.00 2.06 2.06 0.00 3.15 0.00 0.00 3.43 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 48 R 8.51 4.15 0.00 1.94 2.09 0.00 2.99 0.00 0.00 3.21 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 49 G 8.61 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.29 5.03 0.00 2.97 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.01 4.29 0.00 1.75 1.71 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 2.14 2.22 0.00 52 G 5.38 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 7.58 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 7.97 3.80 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 55 M 8.60 3.67 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 56 P 0.00 4.51 0.00 0.91 1.87 0.00 3.46 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.16 0.00 57 L 9.14 3.88 0.00 1.73 1.79 0.94 1.03 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 58 Y 8.05 4.15 0.00 3.15 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 59 R 6.90 4.02 0.00 1.63 1.87 0.00 3.17 0.00 0.00 3.10 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.05 0.00 60 R 8.09 3.98 0.00 1.76 1.96 0.00 3.13 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 61 L 7.46 4.46 0.00 1.74 1.61 0.93 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.60 0.00 2.20 2.11 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 63 K 8.25 4.28 0.00 1.68 1.68 0.00 1.54 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.26 1.36 7.81 64 F 8.04 4.72 0.00 3.11 3.22 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 65 G 7.62 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 66 F 7.59 5.14 0.00 3.04 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 5.88 4.42 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 68 S 8.18 3.87 0.00 3.81 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 69 R 8.58 4.13 0.00 1.87 2.06 0.00 3.36 0.00 0.00 3.13 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.52 0.00 70 K 7.39 4.61 0.00 1.54 1.63 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.34 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.15 1.27 7.81 71 A 7.92 4.61 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 72 A 8.13 4.25 1.28 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 73 I 7.60 4.55 1.95 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.09 0.94 0.00 0.00 74 T 7.61 4.94 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 75 A 8.96 4.76 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 E 8.41 4.78 0.00 1.93 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 2.16 2.31 0.00 77 I 8.09 4.33 1.97 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 1.24 0.66 1.00 0.00 0.00 78 R 8.20 4.84 0.00 1.77 1.78 0.00 3.13 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 79 L 8.67 4.37 0.00 1.78 1.78 0.92 0.89 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 80 S 7.93 4.81 0.00 3.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.51 4.38 0.00 2.79 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 0.00 0.00 0.00 82 L 8.83 3.18 0.00 1.69 1.71 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.15 4.00 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 84 K 8.47 4.04 0.00 1.67 1.77 0.00 1.89 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.38 7.81 85 V 8.39 4.72 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 0.84 0.00 0.00 0.93 0.00 0.00 86 E 8.86 4.13 0.00 2.15 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 0.00 2.19 2.23 0.00 87 G 7.32 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 7.89 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 89 V 8.06 3.17 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 0.97 0.00 0.00 90 V 7.93 4.06 2.20 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 0.93 0.00 0.00 0.96 0.00 0.00 91 D 7.75 4.72 0.00 2.66 2.58 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 92 L 7.63 4.05 0.00 1.67 1.64 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 93 N 7.60 4.88 0.00 2.81 1.96 0.00 0.00 6.05 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 8.31 3.71 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 1.21 0.00 0.00 95 L 7.83 3.93 0.00 1.70 1.74 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.94 4.06 0.00 1.73 1.80 0.00 1.80 0.00 0.00 2.35 0.00 0.00 3.25 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.40 7.81 97 A 7.93 4.00 1.28 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 98 A 7.81 4.45 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 99 N 7.07 3.93 0.00 2.90 3.27 0.00 0.00 6.16 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 7.86 3.96 1.87 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 1.30 0.96 1.05 0.00 0.00 101 I 8.25 3.78 1.87 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 1.35 0.77 0.91 0.00 0.00 102 G 8.44 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 0.00 103 I 8.61 3.68 1.87 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 1.41 0.44 0.90 0.00 0.00 104 Q 8.12 4.12 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 105 I 7.43 4.63 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.16 1.03 0.00 0.00 106 E 8.57 4.66 0.00 1.79 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.45 0.00 107 F 8.17 4.98 0.00 2.89 2.86 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 0.00 108 A 8.54 5.05 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 0.00 109 K 8.48 5.00 0.00 1.74 1.79 0.00 1.67 0.00 0.00 1.89 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.37 7.81 110 V 8.38 4.15 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 0.83 0.00 0.00 0.99 0.00 0.00 111 I 7.84 3.46 1.87 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 1.22 1.31 0.91 0.00 0.00 112 L 8.27 4.67 0.00 1.71 1.64 0.92 0.35 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 0.00 113 A 9.22 4.53 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 0.00 114 G 7.97 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 0.00 115 E 8.30 3.98 0.00 2.08 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 2.33 2.41 0.00 116 V 8.20 4.20 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 0.00 117 T 7.94 3.08 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 1.21 0.00 0.00 118 T 8.62 3.80 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 1.21 0.00 0.00 119 P 0.00 4.63 0.00 2.22 2.17 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 120 V 6.86 3.86 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 0.72 0.00 0.00 1.01 0.00 0.00 121 T 8.23 4.78 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 1.21 0.00 0.00 122 V 8.39 4.47 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 0.76 0.00 0.00 0.99 0.00 0.00 123 R 8.64 4.30 0.00 1.78 1.82 0.00 3.23 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 124 G 8.95 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 0.00 0.00 0.00 125 L 7.38 4.88 0.00 1.38 1.64 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.49 4.70 0.00 1.92 1.83 0.00 3.25 0.00 0.00 3.35 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 127 V 8.33 4.48 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 0.74 0.00 0.00 0.97 0.00 0.00 128 T 8.58 4.16 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 129 K 8.88 4.15 0.00 1.98 2.07 0.00 1.49 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.50 7.81 130 G 8.02 3.44 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 0.00 131 A 7.77 4.09 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 0.00 132 R 8.17 3.78 0.00 2.00 1.94 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 133 A 7.25 4.39 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.39 4.61 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 0.00 135 I 7.29 4.19 1.87 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 1.18 1.42 1.03 0.00 0.00 136 E 8.72 4.19 0.00 1.94 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 2.32 2.45 0.00 137 A 8.13 4.07 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 0.00 138 A 7.83 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.36 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 0.00 140 G 7.30 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 0.00 0.00 0.00 0.00 141 K 7.92 4.88 0.00 1.76 1.60 0.00 1.68 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.37 7.81 142 I 8.08 4.73 1.87 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 1.41 1.16 0.95 0.00 0.00 143 E 8.95 4.25 0.00 2.07 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 0.00 2.28 2.33 0.00 144 E 7.79 4.09 0.00 1.89 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 2.33 2.31 0.00