NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.6341 8.2785 119.2070 53.1594 39.7475 174.6460 2 A 3.8498 8.5015 129.2784 54.6688 18.3925 177.6283 3 K 3.8878 8.6542 117.8705 59.6512 32.6659 177.9125 4 L 4.0243 7.7891 118.6750 57.5086 41.4700 179.0935 5 D 4.3502 7.9793 118.7330 57.5988 40.7146 178.8279 6 Q 4.0256 8.0032 118.1637 58.9654 28.5608 179.0267 7 I 3.7649 7.6907 120.5166 64.3789 37.0998 178.5802 8 R 3.9816 8.0138 118.9753 59.1563 29.8980 178.8598 9 L 3.9352 8.2182 120.2189 58.2347 42.1838 178.1576 10 Y 3.9928 8.2635 119.6859 60.9006 38.6592 178.3208 11 L 3.9473 8.3707 119.9740 57.9969 41.3260 179.3493 12 D 4.4692 8.3841 118.9579 57.3758 40.5331 178.7236 13 Q 4.1809 8.2338 119.9804 58.2152 28.8015 178.1719 14 K 4.3703 7.3010 122.1694 55.3463 32.1493 181.1900 15 G 4.0355 7.5900 104.9369 47.4354 0.0000 173.6829 16 A 4.8362 8.2232 121.3888 50.1513 21.6563 177.1121 17 E 4.4306 8.4153 117.8537 56.7426 31.8420 175.8611 18 L 5.0276 7.7365 120.4606 53.4204 46.0400 173.9438 19 A 5.0131 8.9203 127.1275 50.0843 22.1559 174.9599 20 I 4.5790 8.7652 123.6327 59.5280 39.6785 174.7028 21 F 5.1894 9.2529 127.0602 56.0140 40.5153 176.9944 22 S 4.5218 9.4142 115.7335 57.8157 64.9076 174.4130 23 D 3.9611 8.3170 121.3713 53.0459 41.7801 174.4896 24 P 4.0885 0.0000 0.0000 65.7951 31.3071 178.7982 25 V 3.7404 8.2212 116.9722 66.2944 31.4646 178.3002 26 T 3.9205 7.8599 115.0240 66.7273 68.4061 176.5933 27 I 3.6945 8.0865 122.0189 64.3196 37.0342 177.9300 28 N 4.7378 8.5251 119.5609 56.3961 38.5773 176.2475 29 Y 4.1359 7.8704 119.7987 60.7827 38.9716 177.7044 30 L 3.9808 8.0419 119.0959 56.6141 41.8900 177.8005 31 T 4.4907 8.0972 106.2493 60.3962 70.4466 175.2325 32 G 3.9068 8.5968 110.0321 45.1422 0.0000 172.6830 33 F 4.7822 8.1908 123.1347 56.3255 40.3441 173.9707 34 F 4.4903 8.2089 130.2695 56.4478 40.5950 174.3130 35 C 3.9309 6.6637 126.5923 57.3579 34.1930 172.3293 36 D 4.3645 8.0967 126.8675 51.9549 41.0027 174.0479 37 P 4.4262 0.0000 0.0000 63.2277 33.3100 177.6968 38 H 3.8772 7.3942 115.8272 57.3706 28.0373 176.1736 39 E 4.3412 9.1058 126.7386 57.5705 29.8235 176.2003 40 R 4.4486 7.7844 119.3362 55.6515 31.2347 175.6593 41 Q 4.3130 9.0216 118.8840 55.3224 29.6745 175.8470 42 L 4.9192 7.5325 122.6183 53.8902 45.0670 175.0340 43 F 5.2302 9.5949 124.1218 55.7681 44.1139 173.2605 44 L 5.1445 8.9799 124.2002 53.5435 44.4573 175.1291 45 F 4.9754 9.5785 126.7340 56.3061 40.5848 175.5197 46 V 4.4011 8.7842 126.6477 61.2791 31.8977 174.6665 47 Y 4.8862 8.4064 125.2764 57.9179 38.1708 175.9956 48 H 4.6302 9.3962 118.7259 57.9410 28.8269 175.9035 49 D 4.7288 8.2896 115.0026 52.2120 40.8810 174.9460 50 L 4.6376 7.6508 118.1997 52.0709 44.5245 175.5556 51 A 4.1382 8.2896 122.8275 51.6657 18.7426 175.7948 52 P 4.7603 0.0000 0.0000 62.7865 32.7937 175.7599 53 V 4.7578 8.8406 119.9362 61.2453 34.9402 173.6544 54 L 5.2506 9.1837 130.3620 53.8039 43.9569 174.5179 55 F 5.6518 9.9245 129.3781 56.8520 41.6217 174.6832 56 V 4.8617 8.2460 118.1431 58.7397 36.6391 173.2716 57 P 4.0456 0.0000 0.0000 62.3727 32.0347 177.4832 58 A 3.8933 8.5186 124.6311 55.4158 17.9515 180.1950 59 L 4.0220 7.7419 116.1798 58.0610 40.8380 178.1330 60 E 4.4565 8.2239 118.9501 56.7999 29.8777 178.1387 61 V 3.4453 7.6367 119.2738 65.8313 31.4058 177.5882 62 A 3.9271 7.8509 118.6484 55.1107 18.6482 179.1206 63 R 3.9772 7.9520 116.3615 59.6743 30.3462 178.3801 64 A 3.4782 7.9225 120.4745 55.1161 17.9576 179.7038 65 S 4.0401 8.0012 112.6045 61.1246 62.8615 176.4599 66 Q 4.0883 7.7076 120.3392 58.1037 28.5083 176.9537 67 A 4.5461 7.6755 119.7845 52.3767 21.3366 176.4719 68 I 3.6429 7.3677 117.6223 61.0757 37.3601 176.1812 69 S 4.3818 8.2542 119.2141 58.3450 63.8453 173.6320 70 F 4.9161 6.7949 115.9659 54.3184 40.4761 173.6457 71 P 4.1620 0.0000 0.0000 62.8688 32.1932 175.7220 72 V 4.6349 8.0529 123.3723 61.1173 33.7737 174.3316 73 F 5.3185 9.4239 127.4763 55.8854 41.4173 175.3572 74 G 4.9935 8.9336 110.4948 44.6626 0.0000 172.0853 75 Y 5.2269 7.8891 116.9771 55.2927 41.7124 174.9014 76 V 4.1891 8.8425 114.8838 59.9998 33.5662 176.9369 77 D 4.3790 8.6971 122.4763 57.6547 40.7619 178.6985 78 S 4.2863 8.0360 111.9942 60.2431 63.3045 173.9400 79 E 4.4480 8.1122 121.5828 54.9764 30.5040 176.0065 80 N 4.4992 8.6701 121.6813 52.9794 40.0280 174.2139 81 P 3.9581 0.0000 0.0000 65.4180 31.4727 178.6405 82 W 4.2498 7.5169 118.3831 59.5309 29.0021 178.1980 83 E 3.9483 8.7035 118.6237 59.1497 28.9182 179.0706 84 K 3.8607 8.3384 120.0670 59.7436 32.2544 178.6175 85 I 3.2749 7.9022 120.1115 64.2349 36.7463 178.2626 86 K 3.7109 7.6137 118.7082 59.4761 32.0489 178.3931 87 A 4.0606 7.9771 120.1891 54.3823 18.3743 179.1016 88 V 3.7437 7.3823 109.1362 61.2834 32.8802 176.9151 89 L 4.3672 7.0554 118.4427 53.7905 42.0160 175.6341 90 P 4.3729 0.0000 0.0000 65.3159 31.7874 176.3748 91 N 4.7249 7.7077 115.4379 52.9951 41.5390 173.7971 92 T 4.7271 8.5838 116.2779 61.6726 69.2620 174.0744 93 A 4.5738 7.9680 122.0286 52.3864 19.3676 177.8297 94 A 4.0617 8.2776 122.4542 53.8888 19.0817 179.4392 95 K 4.2184 8.9743 124.9539 57.1893 33.6672 175.9003 96 T 4.8436 8.0675 117.8775 61.4935 71.4894 173.5150 97 I 4.6856 8.8686 127.5631 59.5063 40.4616 174.1256 98 Y 4.8959 8.7633 123.6400 56.3360 40.6661 174.7155 99 A 5.1356 8.3687 123.4259 50.0744 23.9713 175.3275 100 E 4.3898 8.6714 118.9064 55.2404 28.8957 177.5558 101 F 4.6002 8.6285 123.4748 59.8411 39.4058 176.6666 102 D 4.6095 8.1878 118.7718 55.7777 41.2463 175.9603 103 H 4.6301 8.0561 116.7979 57.1793 31.7547 173.9652 104 L 4.0630 8.2914 121.6837 55.2820 42.2124 176.9474 105 N 4.7055 8.5864 123.9801 52.0068 39.9930 176.1879 106 V 3.5199 8.0941 119.8535 66.1146 31.5120 177.6876 107 N 4.2747 8.0902 115.7696 56.3101 38.3946 177.3974 108 K 4.2437 8.0956 119.3587 59.3062 32.3086 178.8150 109 F 4.1745 8.4084 121.1087 61.9165 39.0457 176.8980 110 H 3.8775 8.1383 114.6191 58.5271 28.6335 177.6492 111 G 2.0613 7.5817 107.5369 47.3011 0.0000 175.7535 112 L 4.2195 7.7190 122.0440 57.4808 41.4050 179.5422 113 Q 4.2682 7.6357 118.3800 57.7301 28.6619 177.9532 114 T 4.0051 7.2249 109.2630 63.1156 68.9828 174.9554 115 I 4.0121 7.3941 121.0340 62.1580 38.6775 175.6237 116 F 4.8492 8.3322 119.8590 55.9006 40.2191 176.8027 117 S 4.4090 8.8507 121.6225 60.0606 63.2581 174.3742 118 G 3.9733 7.9138 106.9119 45.5150 0.0000 172.2989 119 Q 4.6572 8.8324 121.3943 55.2250 30.3026 174.4870 120 F 5.0664 9.1941 125.1629 56.5849 40.6079 174.8534 121 N 4.9677 8.9012 119.7680 50.9541 42.8558 173.1931 122 N 3.9456 8.0818 119.5925 52.7637 39.9723 174.8150 123 L 4.3735 7.9991 124.5252 55.2221 41.3004 177.0179 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 N 8.28 4.63 0.00 2.81 2.81 0.00 0.00 6.96 7.86 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 2 A 8.50 3.85 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 3 K 8.65 3.89 0.00 1.65 1.71 0.00 1.29 0.00 0.00 1.11 0.00 0.00 2.23 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.34 1.36 7.81 4 L 7.79 4.02 0.00 1.64 1.64 0.82 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 5 D 7.98 4.35 0.00 2.93 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 6 Q 8.00 4.03 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.61 0.00 7 I 7.69 3.76 1.91 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 1.07 0.00 0.00 8 R 8.01 3.98 0.00 2.10 2.02 0.00 3.14 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.84 0.00 9 L 8.22 3.94 0.00 1.94 1.82 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 10 Y 8.26 3.99 0.00 3.16 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 11 L 8.37 3.95 0.00 1.94 1.97 1.02 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.38 4.47 0.00 2.70 2.73 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 13 Q 8.23 4.18 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.88 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 14 K 7.30 4.37 0.00 1.86 1.68 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.30 7.81 15 G 7.59 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.22 4.84 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 17 E 8.42 4.43 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.08 0.00 18 L 7.74 5.03 0.00 1.57 1.20 0.38 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.92 5.01 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 20 I 8.77 4.58 1.77 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.77 0.54 0.00 0.00 21 F 9.25 5.19 0.00 2.95 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 9.41 4.52 0.00 4.08 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 23 D 8.32 3.96 0.00 2.62 2.59 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 24 P 0.00 4.09 0.00 2.12 1.95 0.00 3.59 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 2.04 2.01 0.00 25 V 8.22 3.74 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.04 0.00 0.00 26 T 7.86 3.92 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 27 I 8.09 3.69 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.97 1.06 0.00 0.00 28 N 8.53 4.74 0.00 3.18 3.13 0.00 0.00 6.43 8.22 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 29 Y 7.87 4.14 0.00 3.02 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 30 L 8.04 3.98 0.00 1.51 1.52 -0.10 0.54 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 31 T 8.10 4.49 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 1.40 0.00 0.00 32 G 8.60 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.19 4.78 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 34 F 8.21 4.49 0.00 2.88 2.77 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 35 C 6.66 3.93 0.00 2.28 2.35 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 36 D 8.10 4.36 0.00 2.63 2.44 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 37 P 0.00 4.43 0.00 2.45 2.20 0.00 3.76 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 2.00 1.89 0.00 38 H 7.39 3.88 0.00 3.33 2.38 0.00 5.64 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 E 9.11 4.34 0.00 2.11 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 0.00 2.27 2.42 0.00 40 R 7.78 4.45 0.00 1.98 2.01 0.00 3.06 0.00 0.00 3.01 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 41 Q 9.02 4.31 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.59 0.00 0.00 0.00 0.00 0.00 2.21 1.81 0.00 42 L 7.53 4.92 0.00 1.52 1.35 1.09 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 43 F 9.59 5.23 0.00 2.87 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 0.00 0.00 0.00 44 L 8.98 5.14 0.00 1.88 1.69 1.08 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 45 F 9.58 4.98 0.00 2.96 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 46 V 8.78 4.40 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.04 0.00 0.00 47 Y 8.41 4.89 0.00 3.10 2.89 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 48 H 9.40 4.63 0.00 3.33 3.57 0.00 5.52 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 49 D 8.29 4.73 0.00 2.64 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 0.00 0.00 0.00 0.00 50 L 7.65 4.64 0.00 1.43 1.49 0.32 0.69 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 51 A 8.29 4.14 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 52 P 0.00 4.76 0.00 1.16 1.75 0.00 3.56 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.42 0.00 53 V 8.84 4.76 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 1.08 0.00 0.00 1.27 0.00 0.00 54 L 9.18 5.25 0.00 2.14 1.58 1.18 0.23 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 55 F 9.92 5.65 0.00 3.68 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 56 V 8.25 4.86 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 0.84 0.00 0.00 57 P 0.00 4.05 0.00 2.03 1.67 0.00 3.60 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 58 A 8.52 3.89 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 59 L 7.74 4.02 0.00 1.75 1.76 0.91 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.22 4.46 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 61 V 7.64 3.45 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 1.06 0.00 0.00 0.88 0.00 0.00 62 A 7.85 3.93 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 R 7.95 3.98 0.00 1.96 2.10 0.00 3.27 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.79 0.00 64 A 7.92 3.48 0.40 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 65 S 8.00 4.04 0.00 3.94 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 66 Q 7.71 4.09 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 67 A 7.68 4.55 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 68 I 7.37 3.64 1.47 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.37 -0.46 0.00 0.00 69 S 8.25 4.38 0.00 3.95 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 70 F 6.79 4.92 0.00 3.14 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 71 P 0.00 4.16 0.00 1.64 1.45 0.00 3.98 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 72 V 8.05 4.63 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 0.65 0.00 0.00 0.66 0.00 0.00 73 F 9.42 5.32 0.00 3.32 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.93 4.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 7.89 5.23 0.00 3.21 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 76 V 8.84 4.19 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 0.68 0.00 0.00 1.00 0.00 0.00 77 D 8.70 4.38 0.00 2.64 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.04 4.29 0.00 4.00 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 79 E 8.11 4.45 0.00 2.32 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 0.00 2.37 2.30 0.00 80 N 8.67 4.50 0.00 2.82 2.88 0.00 0.00 6.95 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 81 P 0.00 3.96 0.00 1.35 1.04 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.55 0.00 82 W 7.52 4.25 0.00 3.52 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 83 E 8.70 3.95 0.00 2.20 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 2.35 2.38 0.00 84 K 8.34 3.86 0.00 2.06 2.09 0.00 1.59 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.74 1.84 7.81 85 I 7.90 3.27 1.77 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 -0.36 0.60 0.00 0.00 86 K 7.61 3.71 0.00 1.73 1.95 0.00 1.51 0.00 0.00 1.51 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.41 7.81 87 A 7.98 4.06 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 88 V 7.38 3.74 0.94 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 0.65 0.00 0.00 1.00 0.00 0.00 89 L 7.06 4.37 0.00 1.59 1.64 0.29 0.95 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 90 P 0.00 4.37 0.00 2.03 2.17 0.00 4.03 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.90 0.00 91 N 7.71 4.72 0.00 2.53 2.50 0.00 0.00 6.76 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 92 T 8.58 4.73 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 0.84 0.00 0.00 93 A 7.97 4.57 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 94 A 8.28 4.06 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 K 8.97 4.22 0.00 1.41 1.81 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.34 1.29 7.81 96 T 8.07 4.84 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 1.11 0.00 0.00 97 I 8.87 4.69 0.65 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.49 0.14 0.00 0.00 98 Y 8.76 4.90 0.00 2.74 2.71 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 99 A 8.37 5.14 1.42 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 0.00 100 E 8.67 4.39 0.00 2.05 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 2.42 2.30 0.00 101 F 8.63 4.60 0.00 2.87 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 0.00 102 D 8.19 4.61 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 0.00 103 H 8.06 4.63 0.00 3.11 3.37 0.00 5.93 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 0.00 104 L 8.29 4.06 0.00 1.91 1.69 1.30 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 105 N 8.59 4.71 0.00 2.98 2.92 0.00 0.00 5.88 7.68 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 0.00 106 V 8.09 3.52 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 0.93 0.00 0.00 0.82 0.00 0.00 107 N 8.09 4.27 0.00 2.82 2.93 0.00 0.00 7.15 8.06 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 0.00 108 K 8.10 4.24 0.00 2.18 2.39 0.00 1.83 0.00 0.00 1.94 0.00 0.00 3.19 0.00 0.00 3.10 0.00 0.00 0.00 0.00 2.19 1.75 7.81 109 F 8.41 4.17 0.00 2.93 3.08 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 0.00 110 H 8.14 3.88 0.00 3.03 3.08 0.00 5.74 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 G 7.58 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 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.72 4.22 0.00 1.76 2.06 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 7.64 4.27 0.00 1.71 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.96 0.00 0.00 0.00 0.00 0.00 1.91 1.19 0.00 114 T 7.22 4.01 4.13 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 1.04 0.00 0.00 115 I 7.39 4.01 1.73 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 1.31 0.62 0.04 0.00 0.00 116 F 8.33 4.85 0.00 3.33 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 0.00 117 S 8.85 4.41 0.00 3.90 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 0.00 118 G 7.91 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 0.00 119 Q 8.83 4.66 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 120 F 9.19 5.07 0.00 3.30 3.42 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 0.00 121 N 8.90 4.97 0.00 1.44 2.25 0.00 0.00 6.40 7.04 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 0.00 122 N 8.08 3.95 0.00 2.38 2.57 0.00 0.00 7.04 7.78 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 0.00 123 L 8.00 4.37 0.00 1.53 1.46 0.64 0.54 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