NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1597 8.1727 122.0517 56.2917 34.1219 174.1185 2 V 4.6136 8.1572 126.9931 60.6028 32.3488 174.4032 3 F 4.2962 10.1022 129.0273 57.6282 40.1453 174.8483 4 E 4.1943 8.9281 120.8867 55.3865 31.1190 176.3683 5 R 3.2572 8.9818 118.7879 61.2754 29.9713 179.1622 6 C 4.3045 8.0249 115.2604 59.8420 35.7739 175.7243 7 E 3.8924 8.1258 120.5917 59.2861 29.1836 178.5749 8 L 3.6789 8.0456 120.0879 57.8386 42.0811 178.5944 9 A 3.9277 7.9194 120.7662 55.4301 18.2810 179.9053 10 R 3.9558 8.0739 116.4087 59.3706 30.1534 179.4075 11 T 3.8716 7.7376 115.6081 66.6207 68.5767 176.6997 12 L 3.8477 8.0677 121.2136 57.4565 41.6040 179.4365 13 K 3.9115 8.0387 119.5864 59.7193 31.9593 179.1399 14 R 4.0067 8.1730 117.3372 58.8324 30.0058 178.0998 15 L 4.3397 7.3754 115.9069 54.5239 41.7142 177.2958 16 G 3.8736 7.8469 107.1138 46.4375 0.0000 174.8039 17 M 3.9672 7.7579 120.5652 56.1924 32.3947 175.6076 18 D 4.3326 8.0074 117.6747 55.8049 40.8676 175.6715 19 G 3.9449 9.4105 115.5799 45.4058 0.0000 171.1862 20 Y 4.2671 8.1999 121.8564 58.7483 38.9120 176.4252 21 R 3.6354 8.9755 126.4953 57.2730 27.7404 177.2941 22 G 3.8128 8.1828 103.6981 45.6643 0.0000 174.1496 23 I 4.0042 7.5719 122.1681 59.5169 37.7034 176.0173 24 S 4.7057 8.3008 120.8528 57.8824 65.0072 174.8697 25 L 4.2394 8.7027 123.4875 58.3638 41.8687 178.7949 26 A 4.1382 8.1778 120.3213 55.3442 18.3153 179.2551 27 N 4.4517 8.0564 115.0626 56.3432 38.5879 177.7533 28 W 4.4054 8.0144 120.3701 59.9351 29.0446 178.5727 29 M 4.1263 8.5191 118.9202 58.6264 31.4586 177.9200 30 C 3.1384 8.0236 118.5983 59.0758 44.4579 175.3479 31 L 3.9658 8.0900 121.6368 58.3063 41.7072 178.8753 32 A 3.9566 8.3076 120.7856 54.7887 18.2608 179.4297 33 K 2.9128 8.1564 118.2369 59.4029 32.0379 179.1828 34 W 4.1084 7.6728 117.5183 59.2409 29.0279 178.1911 35 L 4.3276 8.0927 120.4123 57.5889 42.0632 177.8733 36 S 4.4690 8.1946 108.7398 57.3098 65.3325 174.3240 37 G 3.5928 8.3271 108.6148 47.0289 0.0000 173.8592 38 Y 3.6654 7.6342 113.4525 58.4050 35.2922 168.3381 39 N 5.1948 7.7973 119.9044 52.2398 39.6741 175.9421 40 T 4.1699 9.0572 117.2338 63.7687 69.2020 175.9936 41 R 4.4071 8.3314 119.8636 56.0143 30.9378 176.4014 42 A 4.2806 7.5953 121.8967 52.9043 19.2919 176.8372 43 T 5.0401 8.3039 110.7710 60.1486 72.4065 172.8714 44 N 4.9145 8.7544 121.8803 52.2187 42.3072 172.2206 45 Y 4.7791 8.7092 127.6073 56.8532 41.0644 173.8781 46 N 4.6862 8.4912 124.5791 51.1772 38.9288 175.3268 47 A 3.6667 8.2402 127.7483 54.7429 18.9626 179.1713 48 G 3.7111 8.0713 104.2873 48.0476 0.0000 173.8840 49 D 4.7401 7.6791 116.3287 52.0499 40.0689 176.3283 50 R 4.1256 8.2159 116.6454 57.1738 28.1264 175.6891 51 S 4.9953 7.2336 108.8856 56.9936 66.6366 172.6207 52 T 5.1363 9.1856 115.6924 62.0627 73.0195 172.9688 53 D 5.3740 9.1387 125.8747 53.3766 43.0351 174.9877 54 Y 4.8257 9.3511 121.4417 57.3745 41.1948 177.5396 55 G 4.4494 8.9642 112.3936 45.8596 0.0000 173.3987 56 I 3.9415 8.3771 116.9327 62.9463 37.9021 177.5341 57 F 4.6811 8.0554 115.6119 56.2823 39.6632 175.6864 58 Q 3.4916 7.9994 118.8626 57.0600 26.6665 174.4637 59 I 4.3161 8.2013 119.5112 61.1886 39.1598 176.8957 60 N 5.4492 9.2422 126.1131 53.3339 39.6704 175.9076 61 S 4.5899 9.1906 120.9703 60.7583 63.4223 175.5096 62 R 3.7486 8.7929 122.1571 58.8306 30.2798 177.9867 63 Y 4.5178 7.7445 113.6390 57.5326 40.7530 177.0916 64 W 4.8368 8.2484 119.2778 57.8140 30.2222 173.6033 65 C 5.5709 7.9157 110.7023 53.6448 45.2410 171.7659 66 N 4.9449 8.8590 119.3227 52.0154 39.6778 174.6937 67 D 4.7861 8.5536 123.0410 52.2323 40.4687 176.7460 68 G 3.9538 8.4776 107.4640 46.1348 0.0000 174.2295 69 K 4.5455 8.2979 115.9290 56.2390 33.3826 175.9283 70 T 4.5836 7.7399 116.7316 61.3399 69.6304 171.8812 71 P 4.1653 0.0000 0.0000 64.4364 31.6227 176.3059 72 G 3.9774 8.7767 110.5195 46.2324 0.0000 172.8868 73 A 4.3408 7.4307 119.4847 51.3054 19.7424 178.0364 74 V 4.2233 8.3792 113.0938 59.3664 34.9403 176.1860 75 N 4.9726 7.9366 116.9023 52.1750 37.5940 174.6230 76 A 3.9872 9.1258 124.7921 54.7965 19.1363 178.3946 77 C 4.5800 8.5089 111.1839 57.1246 41.1723 173.0362 78 H 4.0726 7.8763 116.5248 56.6837 26.4014 174.2269 79 L 4.8450 8.2890 117.5770 52.8086 46.4222 176.8387 80 S 4.6137 8.3554 115.4521 58.0661 63.2718 176.0362 81 C 4.1458 8.7412 124.0076 59.5923 40.6601 176.3583 82 S 3.9019 7.7504 114.7464 61.2771 61.6577 175.9367 83 A 4.0655 7.7941 122.4301 54.3079 18.1426 177.9077 84 L 4.5247 7.8139 116.4995 54.8964 41.8197 177.4799 85 L 5.0485 7.9479 117.3569 54.5873 42.3061 176.6029 86 Q 4.4516 7.8291 117.4999 55.0556 29.7859 175.9070 87 D 4.4399 8.5747 120.2292 57.1842 41.1434 176.8908 88 N 4.5901 8.0609 118.1169 53.3184 39.4229 174.6330 89 I 4.3217 8.4660 118.5919 60.9504 38.0340 177.1026 90 A 3.9344 8.3676 124.8137 56.1005 18.1910 180.2831 91 D 4.2844 8.0873 116.4666 57.3465 40.9521 178.7343 92 A 4.0803 7.9674 120.9829 55.1014 18.3839 179.7311 93 V 3.2729 8.1760 116.9480 65.8642 31.5686 178.0798 94 A 3.8028 8.0181 120.6385 55.2914 18.1461 178.8638 95 C 4.1886 8.3524 116.7493 59.7150 38.3670 175.5507 96 A 3.8764 8.2989 122.7995 55.0546 17.5629 179.8086 97 K 3.7991 7.7194 116.4225 59.4833 32.1231 179.1483 98 R 4.0667 7.8056 119.0410 59.3501 30.0338 178.7384 99 V 2.6029 7.5885 118.0315 65.7530 31.3499 178.1718 100 V 3.8500 7.7111 110.3382 63.1186 31.2431 178.2974 101 R 4.1235 7.5149 117.4946 57.6205 30.3400 176.5057 102 D 4.6966 7.5114 118.5678 52.8655 41.7802 175.3099 103 P 4.2157 0.0000 0.0000 66.2175 31.3511 178.3767 104 Q 3.9958 8.1384 116.2586 56.6487 29.7805 177.3613 105 G 3.9261 7.9528 106.9527 46.2582 0.0000 174.6349 106 I 3.4818 7.7956 118.3822 63.5700 37.9073 178.3837 107 R 4.2712 7.2178 117.4863 57.6778 29.9378 177.4500 108 A 4.0644 7.7838 121.3639 54.1634 18.7934 177.7258 109 W 4.6554 8.0085 117.0845 55.4272 29.9068 177.5310 110 V 3.7388 8.7446 123.5917 65.9984 30.9223 177.6133 111 A 4.0231 8.3278 120.2101 54.8681 18.1456 179.2274 112 W 4.0098 8.3305 126.5405 60.6615 30.5862 178.4737 113 R 3.7090 8.1714 116.4491 59.2585 29.6667 178.3937 114 N 4.4250 8.2324 115.5880 55.3896 38.6685 176.2556 115 R 4.2415 7.8063 112.8187 55.6713 30.2765 175.1850 116 C 4.5044 7.3025 115.0408 58.2704 43.0171 174.2898 117 Q 3.1468 6.6963 120.1107 57.2828 28.6517 175.6572 118 N 4.1710 8.5718 121.6092 54.5335 36.3228 173.8860 119 R 4.5228 7.3389 114.1690 54.1261 33.3793 175.8907 120 D 4.5800 8.4583 119.2381 53.9439 40.2796 175.9221 121 V 4.5868 8.1618 118.6795 61.0644 32.5292 178.2338 122 R 4.0323 8.1582 122.2737 59.4191 30.0628 178.7742 123 Q 3.9949 8.1726 114.2600 59.3599 28.3255 177.7544 124 Y 4.2957 8.0086 115.5165 60.0426 38.3258 176.7457 125 V 4.3684 7.7563 110.3707 60.7566 32.8458 175.4029 126 Q 4.2227 7.9740 120.4581 57.2646 28.7372 176.6812 127 G 3.9597 9.0061 111.1024 45.8098 0.0000 174.3188 128 C 4.4348 8.0080 115.6725 56.7058 40.5897 173.9855 129 G 3.8633 8.1313 107.2639 46.7511 0.0000 174.1886 130 V 4.0074 7.8914 118.0787 61.0786 32.0486 175.8506 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 1 K 8.17 4.16 0.00 2.08 1.64 0.00 1.24 0.00 0.00 1.14 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 1.13 7.81 2 V 8.16 4.61 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 10.10 4.30 0.00 2.81 2.80 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 0.00 4 E 8.93 4.19 0.00 1.96 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 2.31 2.25 0.00 5 R 8.98 3.26 0.00 1.97 1.88 0.00 3.40 0.00 0.00 3.45 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.86 0.00 6 C 8.02 4.30 0.00 3.00 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 7 E 8.13 3.89 0.00 2.05 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 2.54 2.41 0.00 8 L 8.05 3.68 0.00 1.43 1.34 -0.27 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.92 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 10 R 8.07 3.96 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 11 T 7.74 3.87 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 1.25 0.00 0.00 12 L 8.07 3.85 0.00 1.73 1.56 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.04 3.91 0.00 1.95 1.91 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.17 4.01 0.00 1.90 1.97 0.00 3.21 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 15 L 7.38 4.34 0.00 1.64 1.56 0.87 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.85 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 17 M 7.76 3.97 0.00 1.36 1.95 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.20 0.00 18 D 8.01 4.33 0.00 2.69 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.41 3.94 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 0.00 0.00 0.00 20 Y 8.20 4.27 0.00 3.38 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 21 R 8.98 3.64 0.00 1.86 1.82 0.00 3.17 0.00 0.00 2.92 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.32 0.00 22 G 8.18 3.81 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 0.00 0.00 0.00 23 I 7.57 4.00 1.78 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.53 -0.31 0.00 0.00 24 S 8.30 4.71 0.00 4.11 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 25 L 8.70 4.24 0.00 2.06 1.81 0.99 1.02 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 26 A 8.18 4.14 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.06 4.45 0.00 2.78 2.75 0.00 0.00 6.99 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 W 8.01 4.41 0.00 3.50 3.14 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 29 M 8.52 4.13 0.00 2.15 2.34 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.94 0.00 30 C 8.02 3.14 0.00 2.50 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 31 L 8.09 3.97 0.00 2.00 1.96 0.78 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.31 3.96 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 33 K 8.16 2.91 0.00 1.63 1.70 0.00 0.69 0.00 0.00 0.87 0.00 0.00 2.61 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.26 0.55 7.81 34 W 7.67 4.11 0.00 3.44 3.27 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 35 L 8.09 4.33 0.00 1.94 1.69 1.11 0.73 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 36 S 8.19 4.47 0.00 4.08 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 37 G 8.33 3.59 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 38 Y 7.63 3.67 0.00 3.33 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 39 N 7.80 5.19 0.00 2.84 2.86 0.00 0.00 6.99 7.15 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 40 T 9.06 4.17 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 1.50 0.00 0.00 41 R 8.33 4.41 0.00 2.00 2.04 0.00 3.20 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 42 A 7.60 4.28 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.30 5.04 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 1.23 0.00 0.00 44 N 8.75 4.91 0.00 2.87 2.76 0.00 0.00 6.73 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 45 Y 8.71 4.78 0.00 2.98 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 46 N 8.49 4.69 0.00 2.61 2.60 0.00 0.00 6.63 7.21 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 47 A 8.24 3.67 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 48 G 8.07 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.68 4.74 0.00 2.75 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 50 R 8.22 4.13 0.00 2.03 2.19 0.00 3.11 0.00 0.00 3.15 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 51 S 7.23 5.00 0.00 3.93 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 52 T 9.19 5.14 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 0.68 0.00 0.00 53 D 9.14 5.37 0.00 2.73 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 54 Y 9.35 4.83 0.00 2.93 2.93 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 55 G 8.96 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 56 I 8.38 3.94 1.74 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.82 0.44 0.00 0.00 57 F 8.06 4.68 0.00 3.18 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 58 Q 8.00 3.49 0.00 2.40 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 59 I 8.20 4.32 2.13 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.09 1.15 0.00 0.00 60 N 9.24 5.45 0.00 3.14 3.09 0.00 0.00 6.97 7.82 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 61 S 9.19 4.59 0.00 4.05 4.37 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 62 R 8.79 3.75 0.00 1.58 1.12 0.00 2.70 0.00 0.00 2.87 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.03 0.00 63 Y 7.74 4.52 0.00 1.51 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 0.00 0.00 0.00 64 W 8.25 4.84 0.00 3.64 3.27 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 65 C 7.92 5.57 0.00 3.16 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 66 N 8.86 4.94 0.00 2.79 2.69 0.00 0.00 7.09 8.09 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 67 D 8.55 4.79 0.00 2.81 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.48 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 69 K 8.30 4.55 0.00 1.87 1.86 0.00 1.57 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.46 7.81 70 T 7.74 4.58 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 71 P 0.00 4.17 0.00 2.01 2.02 0.00 3.82 0.00 0.00 3.89 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 72 G 8.78 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 73 A 7.43 4.34 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 74 V 8.38 4.22 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 0.61 0.00 0.00 0.87 0.00 0.00 75 N 7.94 4.97 0.00 2.75 2.56 0.00 0.00 6.77 8.05 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 76 A 9.13 3.99 1.24 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 0.00 0.00 0.00 77 C 8.51 4.58 0.00 3.30 3.23 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 78 H 7.88 4.07 0.00 3.30 3.36 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.29 4.84 0.00 1.68 1.50 0.99 0.70 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 80 S 8.36 4.61 0.00 3.83 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 81 C 8.74 4.15 0.00 2.23 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 82 S 7.75 3.90 0.00 3.82 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 83 A 7.79 4.07 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 84 L 7.81 4.52 0.00 1.95 1.83 1.06 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.95 5.05 0.00 1.79 1.71 1.11 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.83 4.45 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.36 7.09 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 87 D 8.57 4.44 0.00 2.63 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.06 4.59 0.00 2.70 2.75 0.00 0.00 6.93 7.94 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 89 I 8.47 4.32 1.83 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.83 0.98 0.00 0.00 90 A 8.37 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 91 D 8.09 4.28 0.00 2.75 2.74 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 92 A 7.97 4.08 1.44 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 93 V 8.18 3.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.83 0.00 0.00 94 A 8.02 3.80 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 95 C 8.35 4.19 0.00 3.13 3.26 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 96 A 8.30 3.88 0.68 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 97 K 7.72 3.80 0.00 1.61 1.40 0.00 1.29 0.00 0.00 0.90 0.00 0.00 2.28 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 0.91 7.81 98 R 7.81 4.07 0.00 1.97 2.13 0.00 3.28 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.94 0.00 99 V 7.59 2.60 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 -0.53 0.00 0.00 100 V 7.71 3.85 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.42 0.00 0.00 101 R 7.51 4.12 0.00 2.02 2.05 0.00 3.24 0.00 0.00 3.35 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.12 0.00 102 D 7.51 4.70 0.00 3.05 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 0.00 103 P 0.00 4.22 0.00 2.01 2.13 0.00 3.68 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 2.14 0.00 104 Q 8.14 4.00 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.77 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.95 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.80 3.48 0.99 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.19 -0.27 -0.67 0.00 0.00 107 R 7.22 4.27 0.00 2.02 2.03 0.00 3.24 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.58 0.00 108 A 7.78 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.01 4.66 0.00 3.58 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 0.00 110 V 8.74 3.74 2.18 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 1.18 0.00 0.00 0.99 0.00 0.00 111 A 8.33 4.02 1.49 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 0.00 0.00 112 W 8.33 4.01 0.00 3.54 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.17 3.71 0.00 2.07 1.99 0.00 3.62 0.00 0.00 3.58 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.12 0.00 114 N 8.23 4.42 0.00 2.69 2.71 0.00 0.00 6.87 8.36 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 0.00 115 R 7.81 4.24 0.00 0.87 1.03 0.00 2.77 0.00 0.00 2.90 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.00 0.00 116 C 7.30 4.50 0.00 1.81 2.74 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 0.00 117 Q 6.70 3.15 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.77 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 118 N 8.57 4.17 0.00 2.77 2.80 0.00 0.00 6.88 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 0.00 119 R 7.34 4.52 0.00 1.77 1.79 0.00 3.24 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 120 D 8.46 4.58 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.16 4.59 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 0.94 0.00 0.00 1.05 0.00 0.00 122 R 8.16 4.03 0.00 1.93 2.03 0.00 3.28 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.17 3.99 0.00 1.91 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.12 0.00 0.00 0.00 0.00 0.00 2.18 1.63 0.00 124 Y 8.01 4.30 0.00 3.25 3.15 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 0.00 125 V 7.76 4.37 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.06 0.00 0.00 126 Q 7.97 4.22 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.75 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 127 G 9.01 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 0.00 128 C 8.01 4.43 0.00 3.10 3.14 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 0.00 129 G 8.13 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.89 4.01 2.11 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 0.80 0.00 0.00 0.96 0.00 0.00