NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 Y 4.6533 8.0033 121.6889 57.2544 39.9462 176.0161 27 P 4.5819 0.0000 0.0000 62.8538 31.2819 175.9808 28 D 4.6774 8.5345 121.7558 54.2918 43.3750 175.9467 29 A 4.5671 8.0154 121.7089 49.1037 19.9938 173.9297 30 P 4.2705 0.0000 0.0000 64.0586 31.9852 176.2023 31 V 3.7337 8.3389 122.6213 62.5993 32.6249 174.7244 32 A 4.4562 8.5057 130.5997 51.4169 18.6535 176.2514 33 L 4.3936 7.9169 121.7979 53.3833 44.1735 177.4106 34 K 4.1393 8.1799 120.3411 55.1603 32.9064 176.7220 35 P 4.3052 0.0000 0.0000 65.7141 31.2247 177.3897 36 R 4.2132 7.9432 116.7356 56.6459 30.4855 175.8760 37 F 4.2082 7.9447 119.3959 59.9515 39.6183 175.0435 38 H 4.3078 7.4294 124.3711 54.3444 27.7238 174.6791 39 G 4.4478 7.5507 113.8734 44.3821 0.0000 169.7539 40 R 4.1841 8.5379 121.5075 56.8046 31.0099 177.3107 41 H 4.5053 8.9604 123.4124 56.6753 29.6616 174.8258 42 V 4.7103 8.9186 121.6980 59.8993 34.1922 174.4355 43 L 4.9509 9.9122 123.8552 53.5212 43.1687 176.4568 44 T 4.3235 8.5943 115.0199 61.0033 70.9461 174.0596 45 R 4.7143 8.2274 120.2606 54.4448 33.1624 175.4964 46 H 4.6092 8.6840 117.4687 54.3921 29.6804 174.9374 47 P 4.2449 0.0000 0.0000 66.2496 31.1258 177.9565 48 N 4.1412 8.1242 114.1635 55.4914 38.5258 176.0828 49 G 4.0767 7.8340 104.0739 44.9959 0.0000 173.9431 50 L 4.2202 7.6637 119.7791 54.2183 42.4378 176.5197 51 E 4.4437 8.2643 121.1219 56.3728 29.9560 177.6310 52 K 4.1325 7.9922 120.0340 57.9522 32.6258 177.1121 53 C 4.3835 7.9109 119.8937 58.6277 31.8672 173.1648 54 I 4.9119 7.7504 121.3639 60.0053 37.6848 175.3097 55 G 4.0729 8.2874 106.2504 47.7351 0.0000 174.9924 56 C 4.1953 8.1350 114.1883 58.0795 30.3434 173.7451 57 S 3.8718 7.9997 113.3544 59.2531 60.5328 172.9739 58 L 4.2816 7.3903 122.4633 56.9204 42.0245 177.2043 59 C 4.0668 8.1786 114.0077 61.3914 29.5879 175.4209 60 A 3.9177 8.1526 123.4040 54.4952 17.5817 179.4335 61 A 4.0234 7.4586 118.1794 55.3214 18.6760 179.3835 62 A 4.2603 7.7102 116.5891 52.7646 18.4143 177.1806 63 C 4.1044 7.3382 118.2866 58.2431 31.6535 172.6159 64 P 3.9480 0.0000 0.0000 64.8550 30.9754 176.7965 65 A 4.1357 7.5265 119.2487 51.1900 20.2363 175.6378 66 Y 3.7099 6.6533 111.9307 59.5706 35.8000 170.5033 67 A 4.7537 7.5889 118.0026 51.6202 21.5539 177.1800 68 I 4.8247 7.7154 116.0950 59.3145 40.3719 174.2742 69 Y 4.5101 8.6899 127.6128 55.6175 41.5010 174.2386 70 V 4.7568 7.9793 125.7723 61.2585 34.2954 174.0298 71 E 4.6528 9.0269 128.0276 54.4664 31.3029 174.0619 72 P 5.1173 0.0000 0.0000 61.6130 33.5482 174.6090 73 A 4.5635 8.0414 121.8461 50.3111 23.1834 174.7373 74 E 4.8226 8.6273 120.4771 55.3151 30.4855 176.1418 75 N 4.6317 8.7673 124.5892 53.6922 39.5085 174.0688 76 D 4.6912 8.5295 121.7485 52.3776 42.1851 175.3464 77 P 4.2566 0.0000 0.0000 65.6851 31.6994 177.4411 78 E 4.0784 8.6863 118.4771 58.4875 29.7042 176.3221 79 N 4.8849 7.6948 116.6473 50.7670 38.8144 170.7872 80 P 4.5571 0.0000 0.0000 61.6140 33.2863 177.4984 81 V 3.6232 8.3009 121.0376 64.9873 31.7849 175.6187 82 S 4.8805 7.9369 110.8765 56.3983 66.0841 173.6810 83 A 4.1582 8.5676 122.6686 54.3691 18.8160 179.3409 84 G 3.9578 7.8666 106.0318 45.6924 0.0000 172.9724 85 E 4.5572 8.7915 117.0792 56.2957 31.6352 175.5540 86 R 5.1920 7.9051 121.8852 54.8392 33.4089 173.6149 87 Y 5.3482 8.7627 123.1181 55.2132 42.2733 173.9246 88 A 4.7571 8.6624 121.0290 50.4615 19.1923 177.0367 89 K 4.0668 8.6083 123.6472 59.9305 32.7957 177.2028 90 V 4.6006 7.8057 119.1597 61.0947 34.5648 173.1012 91 Y 5.1493 8.6053 127.4446 56.0043 42.1537 173.5432 92 E 5.0063 8.6295 125.4538 54.8033 34.5260 174.3660 93 I 5.2169 8.2118 124.8075 58.5939 40.3075 174.9657 94 N 4.7376 8.7339 126.9163 52.6721 37.2025 174.8991 95 M 4.2537 8.6488 125.0190 57.7576 32.3864 178.7973 96 L 4.0119 7.7448 116.6932 56.2503 42.1433 177.4552 97 R 4.2982 8.1988 118.5702 57.6385 31.0085 176.3492 98 C 4.0088 7.1550 116.6678 59.8376 31.8072 172.8673 99 I 4.4425 7.9256 122.2851 59.7850 40.0033 174.6154 100 F 3.4806 7.8904 116.6150 58.8017 34.6342 174.7243 101 C 4.4083 7.7394 114.6073 57.4637 31.4758 175.9299 102 G 3.8841 8.0969 108.0004 46.0097 0.0000 174.9881 103 L 3.9587 7.4749 120.6294 57.8826 41.5961 179.2678 104 C 4.0703 7.9084 113.6414 61.5165 29.5091 175.5422 105 E 4.3014 8.0222 121.6436 57.6959 29.1712 177.7372 106 E 4.0942 7.7472 118.3008 58.8521 29.8605 177.9747 107 A 4.2129 7.6749 119.8967 53.5791 18.6262 177.5898 108 C 4.0485 7.4247 118.2036 59.2420 31.7099 171.8098 109 P 4.5266 0.0000 0.0000 64.0218 31.4909 176.6104 110 T 4.3339 7.9850 108.1845 61.0523 70.5206 174.7843 111 G 3.7031 8.2912 108.6330 45.8969 0.0000 174.5097 112 A 4.1274 7.0997 120.7461 53.8476 18.8119 177.7486 113 I 4.3243 7.3920 112.4406 60.4304 39.8511 174.8259 114 V 4.5949 8.3169 128.4334 61.2469 35.1411 173.6743 115 L 4.0279 8.8148 128.6008 54.5552 42.1433 177.6876 116 G 3.5590 8.0775 109.5965 46.5994 0.0000 175.0918 117 Y 5.0930 8.3847 117.3538 58.6961 40.7444 176.1836 118 D 5.0513 8.6192 119.7869 55.1139 41.3215 176.9431 119 F 4.8808 8.5630 115.9304 56.7734 39.3573 175.4746 120 E 4.0156 7.0210 121.2552 56.2381 27.0772 177.3121 121 M 4.4820 7.7770 123.3997 54.0953 31.5508 175.8149 122 A 4.1658 7.9458 121.4858 53.4447 19.3116 176.9351 123 D 3.9523 7.8772 117.7706 53.9995 44.2191 173.9799 124 Y 4.5989 8.3061 115.5610 59.5553 39.2355 176.0280 125 E 4.6280 8.1326 119.2023 54.7358 31.3228 175.7114 126 Y 4.0652 9.0947 125.9198 61.1011 38.6902 178.2096 127 S 4.5694 8.3333 109.5863 59.6074 63.0403 174.0294 128 D 4.6474 8.4747 120.6899 55.0904 41.2661 176.8011 129 L 4.5703 8.0028 119.4341 54.3236 42.1736 175.9924 130 V 4.4164 7.5408 119.7103 60.8710 31.8810 175.7783 131 Y 4.3910 9.0424 124.1089 57.7283 39.5866 174.7554 132 G 4.4659 9.1630 107.6280 42.7847 0.0000 173.7458 133 K 4.0933 9.1713 120.4214 59.5891 32.1896 178.1978 134 E 4.2121 8.2564 115.0143 58.2894 29.7639 177.7431 135 D 4.7207 8.6430 119.3599 55.7492 40.8514 176.9112 136 M 4.9089 8.0252 116.6183 54.5300 33.3214 175.3287 137 L 4.3405 7.6736 119.0853 54.0980 42.4685 178.5566 138 V 3.9385 8.2761 113.6931 64.4578 31.6675 177.9492 139 D 4.4411 8.0650 118.3705 55.2605 39.5803 176.6327 140 V 3.8228 7.2978 119.7238 60.8064 32.1081 175.5335 141 V 3.9344 8.3401 124.8322 63.2782 31.9418 175.4407 142 G 4.0462 9.1044 113.1553 45.1677 0.0000 172.2763 143 T 4.7506 7.9697 108.3502 60.1710 72.1327 174.9007 144 K 3.6426 8.8450 119.8012 59.1312 31.7845 177.2678 145 P 4.1968 0.0000 0.0000 66.7332 30.9926 178.1212 146 Q 3.9531 7.7781 117.4769 58.3851 28.4067 179.2748 147 R 4.0763 8.0042 117.7561 58.4977 30.5958 178.6156 148 R 4.0320 8.4130 119.2863 59.2921 29.8591 178.1825 149 E 4.0237 8.3856 118.4855 58.8643 30.1422 177.7924 150 A 4.2664 7.7394 118.6950 53.3449 18.3868 178.5837 151 K 4.2616 7.8763 119.7328 58.3938 32.0486 178.7995 152 R 4.3313 7.5441 112.3774 56.9674 29.1282 177.4723 153 T 4.4029 8.4516 115.5789 63.0415 71.8139 175.4516 154 G 4.0249 7.8300 106.1508 45.8691 0.0000 172.7607 155 K 4.4095 7.3548 120.1720 53.3047 33.2848 174.1079 156 P 4.2780 0.0000 0.0000 62.6593 32.0109 176.3207 157 V 3.7611 8.1739 114.2998 61.0892 32.1082 175.8905 158 K 4.3835 8.3810 124.1885 54.4653 33.3162 176.1730 159 V 3.6457 8.0865 124.4042 62.2468 32.1733 176.0580 160 G 3.8856 8.8933 116.4364 44.1703 0.0000 171.5959 161 Y 5.1029 6.9432 115.5185 56.9585 41.2566 174.2891 162 V 5.5081 8.3822 110.1730 61.5167 36.5746 173.9534 163 V 4.7187 8.0755 114.6914 59.1231 35.8049 174.7863 164 P 4.1464 0.0000 0.0000 65.7281 31.3715 176.1968 165 Y 4.8547 6.8145 113.1688 55.5587 40.2368 173.8222 166 V 4.4371 8.5600 115.2348 60.3557 33.0057 176.3399 167 R 4.1052 8.3798 123.1012 55.5474 30.9695 175.5698 168 P 4.2743 0.0000 0.0000 65.9794 31.4804 177.9604 169 E 4.0998 8.1757 115.9319 59.0245 29.7457 176.9361 170 L 4.4477 7.5297 118.3330 53.9730 42.2118 176.2116 171 E 4.0681 8.2151 118.6566 58.3727 30.0054 174.6316 172 G 4.1466 9.3266 113.9725 45.8387 0.0000 172.5335 173 F 3.8803 7.8087 122.2711 58.2422 39.0385 175.0556 174 K 4.2308 8.1486 128.5826 55.3920 31.5758 176.4093 175 A 4.7828 8.1982 126.1368 49.1803 22.3812 174.3007 176 P 4.5590 0.0000 0.0000 63.1358 29.9452 176.7552 177 T 5.3699 7.8386 120.1858 59.7086 69.0751 176.0322 178 E 3.8409 8.5100 122.3922 58.7911 30.0561 177.9704 179 G 4.0999 7.6202 111.4888 45.8308 0.0000 173.2652 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 26 Y 8.00 4.65 0.00 3.00 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 27 P 0.00 4.58 0.00 2.21 2.10 0.00 3.75 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 2.06 2.23 0.00 28 D 8.53 4.68 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.02 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.27 0.00 2.08 2.11 0.00 3.74 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 31 V 8.34 3.73 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 0.58 0.00 0.00 0.90 0.00 0.00 32 A 8.51 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.92 4.39 0.00 1.07 0.93 0.37 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.18 4.14 0.00 1.78 1.66 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.32 7.81 35 P 0.00 4.31 0.00 2.39 1.89 0.00 3.64 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.77 0.00 36 R 7.94 4.21 0.00 1.84 2.05 0.00 3.39 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 37 F 7.94 4.21 0.00 3.02 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 38 H 7.43 4.31 0.00 2.74 3.08 0.00 5.73 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 39 G 7.55 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 40 R 8.54 4.18 0.00 1.96 1.93 0.00 3.27 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.47 0.00 41 H 8.96 4.51 0.00 2.99 3.22 0.00 5.89 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 42 V 8.92 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 0.46 0.00 0.00 1.01 0.00 0.00 43 L 9.91 4.95 0.00 1.56 1.50 0.65 0.04 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 44 T 8.59 4.32 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 1.26 0.00 0.00 45 R 8.23 4.71 0.00 1.79 2.00 0.00 3.21 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 46 H 8.68 4.61 0.00 3.18 3.22 0.00 5.64 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.24 0.00 2.05 2.15 0.00 3.79 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 2.06 2.15 0.00 48 N 8.12 4.14 0.00 2.69 2.92 0.00 0.00 7.14 7.65 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 49 G 7.83 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 0.00 0.00 0.00 0.00 50 L 7.66 4.22 0.00 1.75 1.62 0.90 0.96 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 51 E 8.26 4.44 0.00 1.99 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 2.33 2.41 0.00 52 K 7.99 4.13 0.00 1.60 1.77 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.69 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.83 1.30 7.81 53 C 7.91 4.38 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 54 I 7.75 4.91 1.95 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 1.32 1.97 0.98 0.00 0.00 55 G 8.29 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 56 C 8.13 4.20 0.00 3.12 3.20 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 57 S 8.00 3.87 0.00 3.94 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 58 L 7.39 4.28 0.00 2.00 1.64 0.92 0.88 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 59 C 8.18 4.07 0.00 3.23 3.20 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 60 A 8.15 3.92 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 61 A 7.46 4.02 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 62 A 7.71 4.26 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 63 C 7.34 4.10 0.00 2.97 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 64 P 0.00 3.95 0.00 2.07 2.06 0.00 3.68 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 1.86 1.88 0.00 65 A 7.53 4.14 1.19 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 66 Y 6.65 3.71 0.00 3.19 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 67 A 7.59 4.75 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 68 I 7.72 4.82 1.76 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 1.08 0.63 0.49 0.00 0.00 69 Y 8.69 4.51 0.00 2.92 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 70 V 7.98 4.76 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 1.06 0.00 0.00 0.83 0.00 0.00 71 E 9.03 4.65 0.00 2.12 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 2.38 2.61 0.00 72 P 0.00 5.12 0.00 1.85 1.89 0.00 3.59 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.02 0.00 73 A 8.04 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.63 4.82 0.00 2.02 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 2.31 2.49 0.00 75 N 8.77 4.63 0.00 2.77 2.78 0.00 0.00 6.95 7.63 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 76 D 8.53 4.69 0.00 2.68 2.69 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 77 P 0.00 4.26 0.00 2.08 2.11 0.00 3.74 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 2.04 2.09 0.00 78 E 8.69 4.08 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 79 N 7.69 4.88 0.00 2.61 2.62 0.00 0.00 7.29 7.39 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 80 P 0.00 4.56 0.00 2.18 2.00 0.00 3.77 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 1.93 1.92 0.00 81 V 8.30 3.62 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 0.84 0.00 0.00 -0.23 0.00 0.00 82 S 7.94 4.88 0.00 4.03 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 83 A 8.57 4.16 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 84 G 7.87 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 0.00 0.00 0.00 85 E 8.79 4.56 0.00 2.07 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 2.30 2.30 0.00 86 R 7.91 5.19 0.00 1.88 1.80 0.00 3.11 0.00 0.00 3.52 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 87 Y 8.76 5.35 0.00 3.11 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 88 A 8.66 4.76 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 89 K 8.61 4.07 0.00 1.50 1.93 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.42 7.81 90 V 7.81 4.60 2.17 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 1.00 0.00 0.00 0.97 0.00 0.00 91 Y 8.61 5.15 0.00 3.15 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.63 5.01 0.00 1.90 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 2.40 2.30 0.00 93 I 8.21 5.22 1.78 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.60 0.67 0.00 0.00 94 N 8.73 4.74 0.00 2.78 2.73 0.00 0.00 7.15 7.65 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 95 M 8.65 4.25 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.67 0.00 96 L 7.74 4.01 0.00 1.24 1.53 0.35 0.78 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 97 R 8.20 4.30 0.00 1.81 1.93 0.00 3.41 0.00 0.00 3.40 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 98 C 7.15 4.01 0.00 2.76 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 99 I 7.93 4.44 1.88 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 1.43 1.00 0.96 0.00 0.00 100 F 7.89 3.48 0.00 3.13 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 C 7.74 4.41 0.00 3.09 3.17 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 0.00 102 G 8.10 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 0.00 103 L 7.47 3.96 0.00 1.69 1.71 0.94 0.80 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 0.00 104 C 7.91 4.07 0.00 3.15 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 0.00 105 E 8.02 4.30 0.00 2.02 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 2.23 2.17 0.00 106 E 7.75 4.09 0.00 2.13 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 0.00 2.30 2.30 0.00 107 A 7.67 4.21 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 0.00 108 C 7.42 4.05 0.00 2.97 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 0.00 109 P 0.00 4.53 0.00 2.22 2.15 0.00 3.77 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 110 T 7.99 4.33 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 1.26 0.00 0.00 111 G 8.29 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 0.00 0.00 0.00 112 A 7.10 4.13 1.19 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 0.00 113 I 7.39 4.32 1.82 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.22 0.91 0.00 0.00 114 V 8.32 4.59 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 0.72 0.00 0.00 0.90 0.00 0.00 115 L 8.81 4.03 0.00 1.29 1.39 0.63 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 116 G 8.08 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 0.00 0.00 0.00 117 Y 8.38 5.09 0.00 2.99 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.62 5.05 0.00 3.01 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 0.00 119 F 8.56 4.88 0.00 3.22 3.37 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 0.00 120 E 7.02 4.02 0.00 1.70 1.72 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 2.01 1.47 0.00 121 M 7.78 4.48 0.00 2.15 2.18 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 2.50 2.67 0.00 122 A 7.95 4.17 1.20 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 0.00 123 D 7.88 3.95 0.00 2.50 2.45 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 0.00 124 Y 8.31 4.60 0.00 3.06 2.96 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 0.00 125 E 8.13 4.63 0.00 2.11 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 2.42 2.39 0.00 126 Y 9.09 4.07 0.00 3.01 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 S 8.33 4.57 0.00 4.10 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 0.00 128 D 8.47 4.65 0.00 2.95 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 0.00 129 L 8.00 4.57 0.00 1.77 1.63 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.54 4.42 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 0.78 0.00 0.00 0.96 0.00 0.00 131 Y 9.04 4.39 0.00 2.98 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 0.00 132 G 9.16 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 9.17 4.09 0.00 1.93 1.94 0.00 1.80 0.00 0.00 2.00 0.00 0.00 3.28 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.57 1.50 7.81 134 E 8.26 4.21 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 135 D 8.64 4.72 0.00 3.06 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 M 8.03 4.91 0.00 2.40 2.08 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.73 0.00 137 L 7.67 4.34 0.00 1.79 1.84 1.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.28 3.94 2.17 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 0.88 0.00 0.00 0.96 0.00 0.00 139 D 8.06 4.44 0.00 2.78 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 7.30 3.82 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 0.87 0.00 0.00 0.98 0.00 0.00 141 V 8.34 3.93 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 0.77 0.00 0.00 0.85 0.00 0.00 142 G 9.10 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 0.00 143 T 7.97 4.75 4.50 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 0.00 0.00 0.00 1.46 0.00 0.00 144 K 8.84 3.64 0.00 1.68 1.72 0.00 1.34 0.00 0.00 1.46 0.00 0.00 2.72 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.08 0.23 7.81 145 P 0.00 4.20 0.00 2.23 2.38 0.00 3.78 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 2.12 2.24 0.00 146 Q 7.78 3.95 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 147 R 8.00 4.08 0.00 1.77 1.98 0.00 3.17 0.00 0.00 3.33 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 148 R 8.41 4.03 0.00 1.84 2.13 0.00 3.12 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 149 E 8.39 4.02 0.00 2.02 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 2.33 2.34 0.00 150 A 7.74 4.27 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 K 7.88 4.26 0.00 2.05 1.72 0.00 1.53 0.00 0.00 1.84 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.48 7.81 152 R 7.54 4.33 0.00 1.96 2.01 0.00 3.04 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 153 T 8.45 4.40 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 154 G 7.83 4.02 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 0.00 0.00 0.00 155 K 7.35 4.41 0.00 1.78 1.70 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.40 7.81 156 P 0.00 4.28 0.00 2.06 2.00 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 157 V 8.17 3.76 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 0.71 0.00 0.00 0.91 0.00 0.00 158 K 8.38 4.38 0.00 1.68 1.67 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.36 7.81 159 V 8.09 3.65 1.20 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 0.30 0.00 0.00 0.74 0.00 0.00 160 G 8.89 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 0.00 161 Y 6.94 5.10 0.00 2.99 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 0.00 162 V 8.38 5.51 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 0.95 0.00 0.00 163 V 8.08 4.72 1.63 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 0.31 0.00 0.00 0.82 0.00 0.00 164 P 0.00 4.15 0.00 1.68 1.95 0.00 3.60 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.57 0.00 165 Y 6.81 4.85 0.00 2.99 2.96 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 0.00 166 V 8.56 4.44 2.36 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 1.16 0.00 0.00 1.11 0.00 0.00 167 R 8.38 4.11 0.00 1.93 2.10 0.00 3.46 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.94 0.00 168 P 0.00 4.27 0.00 2.02 2.11 0.00 3.70 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 169 E 8.18 4.10 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 170 L 7.53 4.45 0.00 1.71 1.66 0.04 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 171 E 8.22 4.07 0.00 1.91 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 2.32 2.43 0.00 172 G 9.33 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 0.00 173 F 7.81 3.88 0.00 3.04 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 K 8.15 4.23 0.00 1.65 1.71 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.44 7.81 175 A 8.20 4.78 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 P 0.00 4.56 0.00 2.26 2.24 0.00 3.89 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 2.27 1.79 0.00 177 T 7.84 5.37 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 178 E 8.51 3.84 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 179 G 7.62 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00