NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 R 4.2124 8.2549 117.2809 55.9335 30.6317 174.8567 7 T 3.8628 8.4882 119.8680 62.1747 68.2166 171.7252 8 P 4.3788 0.0000 0.0000 63.5513 32.5425 178.1257 9 S 5.8760 8.5500 122.8183 59.5947 60.7918 176.5415 10 D 4.8216 8.0859 118.5911 54.0854 39.5243 175.6001 11 K 4.1778 7.7857 118.8926 55.0503 32.8172 174.9466 12 P 4.7295 0.0000 0.0000 63.2340 32.4190 175.5455 13 V 5.0646 8.3861 120.7911 61.0867 35.3862 172.7627 14 A 4.6539 8.6844 120.5343 51.5978 23.2276 175.3398 15 H 4.8269 9.3890 121.8909 54.8105 32.1500 172.3942 16 V 4.8555 8.7128 119.3607 59.6032 34.2892 175.3834 17 V 5.3792 8.6693 121.5780 59.6552 35.1214 174.6161 18 A 4.4888 8.6596 123.3150 51.9057 18.9598 176.9346 19 N 4.3954 8.9078 121.6041 52.4601 39.2651 174.3885 20 P 2.9700 0.0000 0.0000 64.4179 31.7161 177.1151 21 Q 4.0643 7.7211 116.6427 56.3888 29.5672 175.5252 22 A 4.7412 7.1466 118.9662 50.3178 18.6800 175.9263 23 E 4.2901 7.9247 119.6483 57.5003 30.3273 179.0758 24 G 3.9660 9.2099 108.1884 45.7326 0.0000 172.7287 25 Q 4.4670 7.7208 115.6300 54.4611 31.8041 174.7437 26 L 4.2475 8.1247 119.9735 52.9736 41.9953 173.6293 27 Q 4.5895 7.8817 125.8213 53.6516 31.3414 173.8997 28 W 5.3813 9.0161 126.9574 56.2263 30.3835 175.7754 29 L 5.1748 9.5609 123.4221 53.0928 45.5158 176.7650 30 N 5.0433 8.9199 115.7814 52.5407 38.6934 174.4631 31 R 4.3844 7.7997 115.9450 56.7348 29.8301 175.2681 32 R 4.6705 7.3071 114.9196 55.2348 34.3990 175.6511 33 A 3.1455 7.4211 115.6098 54.0611 19.7778 178.1936 34 N 4.8468 8.3052 115.5819 51.2680 38.8118 173.1625 35 A 5.1056 7.4505 119.4410 50.3165 23.2171 176.7899 36 L 4.6277 8.6851 117.5378 53.8848 46.6284 176.0019 37 L 4.7914 8.1356 120.3147 54.5249 43.4628 172.8610 38 A 4.7031 8.7349 125.7848 49.0878 23.9165 174.9273 39 N 4.3995 9.9689 112.8843 54.8761 36.1916 174.8810 40 G 4.2067 8.5503 106.6566 45.7010 0.0000 175.5030 41 V 4.2637 7.4720 118.0764 61.2475 32.1805 175.7759 42 E 4.7273 8.7448 121.8652 54.5076 33.4775 174.8253 43 L 4.9950 8.4986 124.2307 53.5839 43.2330 175.2397 44 R 4.5601 8.9367 127.1399 55.6479 32.5073 175.1940 45 D 4.4929 9.7554 124.0615 55.5193 38.5687 173.2127 46 N 4.5446 8.6338 111.7680 54.5574 37.4904 173.0123 47 Q 4.9594 8.2185 113.9739 53.5452 33.5168 174.3724 48 L 4.7354 8.5810 122.1013 54.1401 43.5482 175.9396 49 V 4.7540 8.6023 123.4596 60.7673 34.0571 174.8772 50 V 3.9133 8.3655 129.2516 62.4664 32.0950 174.7302 51 P 4.6389 0.0000 0.0000 63.1927 32.1409 175.3189 52 S 4.6475 7.3969 112.3439 57.1489 65.9307 174.5592 53 E 4.2780 8.8036 121.1478 56.2318 29.9609 177.0403 54 G 4.5869 7.6281 110.2726 44.6461 0.0000 171.1066 55 L 5.0818 7.6975 119.7343 54.0067 43.2133 175.9173 56 Y 5.1896 9.4534 121.0599 56.0871 42.4942 174.1030 57 L 5.0192 9.0404 125.5929 54.1255 43.8945 175.1640 58 I 5.2595 9.0422 127.5646 59.8937 40.3605 174.2496 59 Y 5.2815 8.2791 122.7919 56.5734 41.9100 173.2774 60 S 4.9196 8.3639 112.2458 57.7559 66.7240 173.7758 61 Q 5.4143 8.4395 125.8907 53.6807 32.5668 173.9840 62 V 4.6099 8.2606 117.8536 59.2528 36.2531 174.1520 63 L 4.7529 8.0187 124.4481 53.4530 44.6378 175.1053 64 F 5.2537 9.1735 125.8378 56.4849 41.1168 175.0714 65 K 4.1518 9.0064 123.0135 54.6698 35.3728 175.5957 66 G 3.4076 6.3168 112.5467 44.2440 0.0000 171.3259 67 Q 4.3926 8.6604 122.3355 55.5978 29.6646 177.4328 68 G 3.9632 8.3305 114.3753 45.8940 0.0000 171.0631 69 C 5.2136 8.4667 114.3483 54.4995 43.3154 174.1271 70 P 4.4739 0.0000 0.0000 62.7337 31.4129 174.8940 71 S 4.5781 8.2642 117.6665 58.2603 66.1137 178.1643 72 T 3.1263 8.9383 117.7321 64.1103 68.4258 173.7098 73 H 4.8267 9.0008 123.9788 55.2544 33.7046 171.2734 74 V 4.3284 7.8914 125.1928 60.8265 33.6037 174.2873 75 L 4.6543 8.3125 126.2009 52.8370 44.1140 175.5186 76 L 4.6917 8.5110 123.5445 52.9696 44.2971 175.6146 77 T 5.1779 9.6193 113.8028 60.1261 72.4508 172.3394 78 H 5.5096 8.9784 122.9453 54.9381 33.5479 171.9183 79 T 4.9584 8.8803 118.6998 60.9836 71.4924 171.9689 80 I 4.7753 8.8166 129.6243 59.9912 39.2118 175.0276 81 S 5.1613 8.8882 123.3886 56.6983 66.3343 173.0272 82 R 4.9562 8.7128 122.2784 54.4614 33.1270 174.4189 83 I 4.9263 8.7973 119.3158 57.8878 39.5293 174.9873 84 A 4.6926 8.4355 130.7555 51.6987 19.1492 178.5239 85 V 3.6156 8.6284 120.7573 65.7698 31.6869 177.3696 86 S 4.6597 7.8216 113.6336 58.4352 63.0529 174.3739 87 Y 4.9077 7.5076 117.8993 56.8100 40.8696 173.7468 88 Q 4.2681 7.7987 124.8784 55.5088 27.8933 176.2596 89 T 4.5109 6.9913 114.6673 61.6225 73.7835 174.0676 90 K 4.2402 8.6883 125.7251 56.8974 32.8213 176.7130 91 V 4.5087 8.5432 118.1353 59.2716 35.2431 174.9160 92 N 4.5723 8.9416 123.2266 53.7195 38.5333 174.5941 93 L 4.4564 8.8227 123.8660 55.9861 43.3795 177.2023 94 L 4.9390 7.3865 116.8658 53.2847 46.1062 175.5233 95 S 5.1131 8.5107 114.5676 57.6349 65.4137 173.3491 96 A 4.8831 8.9827 126.2455 50.7191 22.9620 174.9963 97 I 5.0853 8.2478 118.6870 59.5794 41.3303 175.1170 98 K 4.5693 9.0857 125.9546 55.0038 36.0019 175.1506 99 S 4.4697 8.5242 122.6282 56.0577 62.8472 172.0146 100 P 3.6042 0.0000 0.0000 65.1745 31.4051 177.3506 101 C 4.3535 6.9018 124.2325 55.4391 38.8079 174.4391 102 Q 4.1512 8.4983 128.8032 56.1185 28.0512 178.1669 103 R 4.3992 8.1673 115.5014 56.4416 29.5235 175.9330 104 E 3.8988 7.7804 114.0878 59.8738 29.2800 176.6673 105 T 3.0976 8.0676 108.8016 60.5745 68.6073 169.0590 106 P 4.1298 0.0000 0.0000 62.4918 31.3821 175.2253 107 E 4.0100 9.0273 125.2006 57.8223 29.3994 178.1579 108 G 4.5108 7.1378 116.3526 45.9479 0.0000 171.9630 109 A 4.5876 7.2214 123.5464 52.4528 22.3634 174.3713 110 E 4.1439 8.4702 120.8269 54.3865 25.8910 177.0846 111 A 3.6358 8.7083 125.2503 53.1517 14.6962 178.0030 112 K 4.4807 7.8744 121.5553 55.2098 34.0833 174.2743 113 P 5.0699 0.0000 0.0000 62.1787 32.8740 175.4197 114 W 5.3017 8.4378 117.6236 54.9870 31.5696 173.6030 115 Y 5.3058 9.1103 118.8703 56.4040 40.7618 174.9722 116 E 4.7829 9.8101 124.8694 54.4678 32.6160 172.3753 117 P 5.4149 0.0000 0.0000 61.9635 34.0238 175.2274 118 I 4.8052 8.5572 120.9402 60.1339 41.4389 173.5133 119 Y 5.1910 8.9220 127.5856 55.8836 41.5049 174.6165 120 L 4.8353 7.5909 124.1660 53.1055 46.2949 175.6987 121 G 4.4174 8.4586 106.0032 45.9359 0.0000 172.5085 122 G 4.2609 8.7290 109.4426 45.7957 0.0000 171.9368 123 V 5.0296 8.1030 119.9065 61.3674 33.1521 174.9279 124 F 4.9410 9.3071 125.0399 55.8371 43.9477 173.2931 125 Q 4.8941 8.9087 123.0959 55.6442 29.7695 174.8556 126 L 5.0720 9.4087 126.4246 53.0656 45.7995 175.5511 127 E 5.6481 9.6390 121.2302 53.8986 32.0209 175.8198 128 K 4.1499 8.7277 123.8679 58.0311 32.5609 176.9565 129 G 4.0701 8.9592 115.2075 45.1811 0.0000 173.6293 130 D 4.6507 8.0684 119.9935 54.7270 42.3403 175.5686 131 R 5.0549 8.6590 120.5824 54.4864 32.9687 174.8414 132 L 5.2101 9.0149 124.3316 53.1284 44.4226 175.7005 133 S 5.0068 9.0075 118.5155 56.6541 66.6805 173.1913 134 A 4.5560 8.4090 124.7742 50.0970 20.0663 174.8396 135 E 4.9580 8.9742 120.2429 55.2462 33.5723 175.1506 136 I 5.6217 8.3776 113.4237 58.4026 40.5795 174.6511 137 N 4.6053 8.3637 121.4988 53.3968 38.5195 175.8732 138 R 4.6975 7.6272 118.1563 53.5224 30.1665 174.3601 139 P 4.3038 0.0000 0.0000 64.7842 31.8302 178.5975 140 D 4.3596 7.9041 117.3942 55.1480 39.9170 176.0866 141 Y 4.8127 8.1515 117.5167 57.6860 39.5445 175.1679 142 L 3.9439 7.4554 121.0828 54.8602 42.0420 176.9904 143 L 4.2585 8.6156 128.7673 52.7798 41.9325 176.3314 144 F 5.0454 7.8028 125.1727 56.1649 38.6252 177.3435 145 A 4.2399 8.3889 125.8332 56.1907 18.3943 178.7958 146 E 3.9961 7.8400 116.1270 56.0670 29.2303 176.9339 147 S 4.5969 7.1228 123.8810 58.7288 66.5079 177.1400 148 G 4.2065 8.9689 111.8511 46.2587 0.0000 174.4621 149 Q 4.4420 8.3219 119.9412 56.4038 30.1376 176.2898 150 V 4.8187 7.8990 117.5243 61.4095 34.5689 173.7734 151 Y 5.6933 8.6913 125.2820 56.2129 42.4105 173.6766 152 F 5.0442 8.9353 121.5901 57.0997 43.1319 173.2133 153 G 3.9524 8.2543 112.3245 45.4483 0.0000 171.4332 154 I 5.7676 8.3840 112.4778 59.6691 41.3959 173.7605 155 I 5.0377 8.3868 122.9998 59.2947 41.6812 173.5855 156 A 3.7739 8.5610 131.6714 51.3325 18.8228 177.3849 157 L 4.1918 8.1654 122.1917 55.0776 41.4731 177.0474 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 6 R 8.25 4.21 0.00 1.93 2.02 0.00 3.16 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 7 T 8.49 3.86 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 1.22 0.00 0.00 8 P 0.00 4.38 0.00 2.03 2.14 0.00 3.84 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 9 S 8.55 5.88 0.00 4.08 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 10 D 8.09 4.82 0.00 2.71 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 11 K 7.79 4.18 0.00 1.79 1.69 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.97 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.42 1.35 7.81 12 P 0.00 4.73 0.00 2.27 2.39 0.00 3.66 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 2.05 2.04 0.00 13 V 8.39 5.06 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 0.70 0.00 0.00 1.03 0.00 0.00 14 A 8.68 4.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 H 9.39 4.83 0.00 3.23 3.18 0.00 5.77 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.71 4.86 2.31 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 0.57 0.00 0.00 0.52 0.00 0.00 17 V 8.67 5.38 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 0.97 0.00 0.00 1.27 0.00 0.00 18 A 8.66 4.49 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 19 N 8.91 4.40 0.00 2.73 2.57 0.00 0.00 7.06 8.02 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 20 P 0.00 2.97 0.00 1.82 1.88 0.00 3.52 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.84 0.00 21 Q 7.72 4.06 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.38 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 22 A 7.15 4.74 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 E 7.92 4.29 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 2.30 2.36 0.00 24 G 9.21 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 25 Q 7.72 4.47 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.88 0.00 0.00 0.00 0.00 0.00 2.51 2.29 0.00 26 L 8.12 4.25 0.00 1.34 1.36 -0.01 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.88 4.59 0.00 2.06 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 28 W 9.02 5.38 0.00 3.29 3.11 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 29 L 9.56 5.17 0.00 1.60 1.55 1.06 0.42 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 30 N 8.92 5.04 0.00 2.77 2.89 0.00 0.00 6.07 7.66 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 31 R 7.80 4.38 0.00 1.95 2.06 0.00 2.98 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 32 R 7.31 4.67 0.00 1.81 1.88 0.00 3.41 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 33 A 7.42 3.15 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 34 N 8.31 4.85 0.00 2.71 2.76 0.00 0.00 6.61 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.45 5.11 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 36 L 8.69 4.63 0.00 1.67 1.51 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.14 4.79 0.00 1.57 1.61 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 38 A 8.73 4.70 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 39 N 9.97 4.40 0.00 2.97 2.90 0.00 0.00 7.13 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 40 G 8.55 4.21 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 0.00 41 V 7.47 4.26 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 1.19 0.00 0.00 0.85 0.00 0.00 42 E 8.74 4.73 0.00 1.89 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 2.27 2.43 0.00 43 L 8.50 4.99 0.00 1.60 1.60 1.03 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.94 4.56 0.00 1.80 1.72 0.00 3.29 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 45 D 9.76 4.49 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.63 4.54 0.00 2.91 3.02 0.00 0.00 6.99 7.08 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 47 Q 8.22 4.96 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.95 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 48 L 8.58 4.74 0.00 1.40 1.33 -0.51 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.60 4.75 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 0.95 0.00 0.00 0.91 0.00 0.00 50 V 8.37 3.91 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 0.80 0.00 0.00 0.26 0.00 0.00 51 P 0.00 4.64 0.00 2.24 2.26 0.00 3.96 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 52 S 7.40 4.65 0.00 4.15 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 53 E 8.80 4.28 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.30 0.00 54 G 7.63 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 7.70 5.08 0.00 1.64 1.58 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 9.45 5.19 0.00 2.91 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 L 9.04 5.02 0.00 1.86 1.68 1.13 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 58 I 9.04 5.26 2.04 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.98 0.96 0.00 0.00 59 Y 8.28 5.28 0.00 3.06 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 60 S 8.36 4.92 0.00 3.75 3.49 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 0.00 61 Q 8.44 5.41 0.00 1.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.49 0.00 0.00 0.00 0.00 0.00 2.20 2.44 0.00 62 V 8.26 4.61 1.47 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 0.30 0.00 0.00 0.52 0.00 0.00 63 L 8.02 4.75 0.00 1.88 1.62 1.07 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.17 5.25 0.00 3.44 3.07 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 65 K 9.01 4.15 0.00 1.14 1.22 0.00 1.31 0.00 0.00 1.41 0.00 0.00 2.68 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.67 0.21 7.81 66 G 6.32 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Q 8.66 4.39 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.99 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 68 G 8.33 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 69 C 8.47 5.21 0.00 2.97 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 70 P 0.00 4.47 0.00 2.10 2.05 0.00 3.68 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 2.23 2.32 0.00 71 S 8.26 4.58 0.00 3.83 3.79 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 72 T 8.94 3.13 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 1.22 0.00 0.00 73 H 9.00 4.83 0.00 2.96 3.09 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 7.89 4.33 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 0.88 0.00 0.00 0.95 0.00 0.00 75 L 8.31 4.65 0.00 1.48 1.47 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 76 L 8.51 4.69 0.00 1.26 0.43 0.49 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 77 T 9.62 5.18 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 1.19 0.00 0.00 78 H 8.98 5.51 0.00 3.37 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.88 4.96 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 80 I 8.82 4.78 1.71 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 0.86 0.34 0.85 0.00 0.00 81 S 8.89 5.16 0.00 3.68 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 82 R 8.71 4.96 0.00 1.70 1.64 0.00 3.16 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 83 I 8.80 4.93 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.95 0.95 0.00 0.00 84 A 8.44 4.69 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 85 V 8.63 3.62 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.07 0.00 0.00 86 S 7.82 4.66 0.00 3.91 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 87 Y 7.51 4.91 0.00 2.84 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 88 Q 7.80 4.27 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.41 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 89 T 6.99 4.51 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 90 K 8.69 4.24 0.00 1.60 1.74 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.45 7.81 91 V 8.54 4.51 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 0.94 0.00 0.00 1.03 0.00 0.00 92 N 8.94 4.57 0.00 2.61 2.74 0.00 0.00 7.03 7.85 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 93 L 8.82 4.46 0.00 1.16 0.66 0.21 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 94 L 7.39 4.94 0.00 1.49 1.51 1.09 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.51 5.11 0.00 3.82 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 96 A 8.98 4.88 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 97 I 8.25 5.09 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 1.23 0.72 0.90 0.00 0.00 98 K 9.09 4.57 0.00 1.77 1.50 0.00 1.67 0.00 0.00 1.79 0.00 0.00 3.17 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.28 1.37 7.81 99 S 8.52 4.47 0.00 3.79 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 0.00 100 P 0.00 3.60 0.00 0.49 0.74 0.00 3.57 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.11 0.00 101 C 6.90 4.35 0.00 2.71 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 0.00 102 Q 8.50 4.15 0.00 2.28 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 5.76 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 103 R 8.17 4.40 0.00 1.99 2.05 0.00 3.19 0.00 0.00 2.25 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.61 0.00 104 E 7.78 3.90 0.00 2.16 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 2.26 2.39 0.00 105 T 8.07 3.10 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 0.00 106 P 0.00 4.13 0.00 2.08 2.14 0.00 3.79 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 2.10 2.18 0.00 107 E 9.03 4.01 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 108 G 7.14 4.51 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 0.00 109 A 7.22 4.59 1.22 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 0.00 110 E 8.47 4.14 0.00 2.04 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 2.17 2.19 0.00 111 A 8.71 3.64 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 K 7.87 4.48 0.00 1.84 1.84 0.00 1.58 0.00 0.00 1.91 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.58 1.54 7.81 113 P 0.00 5.07 0.00 1.90 2.14 0.00 3.77 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 114 W 8.44 5.30 0.00 3.36 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 0.00 115 Y 9.11 5.31 0.00 2.85 2.97 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 0.00 116 E 9.81 4.78 0.00 2.37 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 2.17 2.39 0.00 117 P 0.00 5.41 0.00 2.23 2.14 0.00 3.92 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 2.04 2.09 0.00 118 I 8.56 4.81 2.05 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.41 1.07 0.00 0.00 119 Y 8.92 5.19 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 L 7.59 4.84 0.00 1.56 1.32 0.94 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.46 4.42 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 0.00 0.00 0.00 122 G 8.73 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 0.00 0.00 0.00 0.00 123 V 8.10 5.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.95 0.00 0.00 124 F 9.31 4.94 0.00 3.07 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 0.00 125 Q 8.91 4.89 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 126 L 9.41 5.07 0.00 1.57 1.35 0.97 0.39 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 0.00 127 E 9.64 5.65 0.00 2.18 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 2.29 2.11 0.00 128 K 8.73 4.15 0.00 1.74 1.75 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.51 7.81 129 G 8.96 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 0.00 130 D 8.07 4.65 0.00 2.53 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.66 5.05 0.00 1.73 1.80 0.00 3.07 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 132 L 9.01 5.21 0.00 1.59 1.68 0.76 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 133 S 9.01 5.01 0.00 3.68 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 0.00 134 A 8.41 4.56 -0.06 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 0.00 135 E 8.97 4.96 0.00 1.92 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 2.23 2.22 0.00 136 I 8.38 5.62 2.18 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 1.02 1.86 0.92 0.00 0.00 137 N 8.36 4.61 0.00 2.81 3.00 0.00 0.00 6.73 7.54 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 0.00 138 R 7.63 4.70 0.00 2.00 2.11 0.00 3.33 0.00 0.00 3.43 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 139 P 0.00 4.30 0.00 2.37 2.27 0.00 3.80 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 2.04 1.94 0.00 140 D 7.90 4.36 0.00 2.47 2.65 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 0.00 141 Y 8.15 4.81 0.00 3.35 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 0.00 142 L 7.46 3.94 0.00 1.40 0.85 0.73 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 143 L 8.62 4.26 0.00 1.43 1.68 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 144 F 7.80 5.05 0.00 3.00 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 0.00 145 A 8.39 4.24 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 0.00 146 E 7.84 4.00 0.00 2.04 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 2.44 0.00 147 S 7.12 4.60 0.00 3.89 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.97 4.21 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 0.00 149 Q 8.32 4.44 0.00 2.18 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.42 2.68 0.00 150 V 7.90 4.82 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 1.09 0.00 0.00 0.94 0.00 0.00 151 Y 8.69 5.69 0.00 3.03 3.13 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 0.00 152 F 8.94 5.04 0.00 1.58 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 0.00 153 G 8.25 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 I 8.38 5.77 1.94 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.89 0.60 0.00 0.00 155 I 8.39 5.04 1.98 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 1.30 1.59 1.03 0.00 0.00 156 A 8.56 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 8.17 4.19 0.00 1.50 1.55 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00