NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4168 8.3049 120.3151 55.1210 33.4639 174.8280 2 K 4.3300 8.0999 121.6714 55.1608 35.0858 173.2933 3 R 5.3546 9.4653 123.3234 54.8374 35.3885 173.9534 4 V 4.9418 8.9796 121.3930 61.0824 35.8012 173.6015 5 L 4.6277 8.9686 126.9270 53.0142 44.7812 175.3134 6 V 4.6148 8.1110 125.3421 61.1779 33.9345 173.9233 7 V 4.2988 8.6306 129.8872 61.8883 32.6306 174.2183 8 D 5.0726 8.2108 125.5005 53.3839 44.7071 173.9765 9 D 5.5470 8.2477 121.9319 53.6532 39.8211 176.1729 10 E 4.7264 7.7812 116.5974 54.5878 33.4207 176.1349 11 E 4.2818 8.6195 121.9949 56.5400 31.2775 175.9169 12 S 3.5292 8.8351 114.0056 60.1719 59.6855 171.4181 13 I 3.5034 7.6541 122.1956 59.7985 36.9853 173.8988 14 T 4.1448 7.8436 110.9732 60.0737 69.3010 174.5587 15 S 4.2188 8.2413 121.1565 60.1278 63.4946 174.5170 16 S 4.3785 8.8435 117.9244 59.1326 61.4858 171.3528 17 L 4.1023 7.7674 119.9235 57.2644 41.7607 178.6106 18 S 4.0497 8.0595 112.3785 61.5355 61.9357 176.0844 19 A 3.9893 7.8205 121.1158 55.9096 18.4968 178.7929 20 I 3.6642 7.4866 117.1594 64.1469 36.9989 178.1452 21 L 3.9927 8.6996 120.1611 58.6309 41.5680 179.8827 22 E 4.0321 7.9937 116.9811 58.9435 29.4452 178.3832 23 E 4.1885 8.6694 119.3033 58.8721 29.8899 178.0667 24 E 4.2116 8.1824 117.6942 57.1570 30.2564 177.3554 25 G 3.8294 8.5610 105.6411 46.1001 0.0000 171.7337 26 Y 4.5828 7.8318 117.1264 56.5349 41.3106 176.6770 27 H 4.9910 8.8374 118.4399 54.0902 30.0165 170.2635 28 P 5.6086 0.0000 0.0000 60.8899 32.6852 176.3962 29 D 5.0132 8.1035 120.2535 52.5369 40.3803 174.9838 30 T 4.0100 7.8681 111.1182 62.7419 70.1391 175.0713 31 A 5.0720 8.8406 129.1467 50.7596 21.6546 175.7603 32 K 4.9364 8.6605 109.6851 56.8442 34.9239 175.6996 33 T 4.6730 7.1129 107.1174 59.7481 72.2558 173.9543 34 L 3.3395 7.9720 120.0208 57.5566 41.3468 179.5849 35 R 4.1364 7.5315 119.3650 59.1035 30.2006 178.3216 36 E 3.9737 8.0790 117.4892 59.1374 29.2860 179.0772 37 A 3.9415 8.0431 121.0788 55.2929 18.4318 179.1613 38 E 4.0268 8.3960 117.2849 59.8019 29.2983 179.7965 39 K 4.0127 7.7053 117.7958 59.5313 32.6413 178.7692 40 K 4.2992 7.9685 118.2044 59.6699 32.2529 179.4921 41 I 4.4190 8.9720 122.0826 63.2126 36.8232 178.3376 42 K 4.1864 8.5416 119.3948 58.7154 31.8189 176.5170 43 E 4.4701 7.6826 114.5429 57.6334 31.3964 176.0900 44 L 3.8347 7.8968 120.8820 55.1508 42.0512 177.8673 45 F 4.6520 8.4337 129.8453 56.5642 37.7984 174.9028 46 F 4.1961 7.7078 120.8235 57.2812 40.0428 174.2520 47 P 4.3100 0.0000 0.0000 64.7687 32.8759 176.2695 48 V 4.5152 7.4124 118.6190 60.7027 34.9820 174.8290 49 I 4.7927 9.1280 127.7889 59.7037 40.3967 173.9665 50 V 4.7129 8.8085 128.3865 60.4520 33.1900 175.1369 51 L 4.7660 8.4332 129.5621 54.7736 44.4664 175.1884 52 D 5.4666 8.5266 122.3666 52.9594 42.9835 175.1209 53 V 3.7621 7.7839 129.8828 62.5461 28.3184 174.5627 54 W 4.5912 8.5221 132.4548 59.3247 31.2699 175.1809 55 M 4.6262 7.7905 119.2606 54.1784 33.5904 174.1223 56 P 4.6724 0.0000 0.0000 62.4528 33.6258 175.7512 57 D 4.8235 8.4693 119.2079 54.5255 42.2797 176.2359 58 G 3.4742 7.9372 106.8941 42.4413 0.0000 173.7864 59 D 4.1773 8.2723 119.1126 54.4226 40.1378 175.0424 60 G 3.9180 7.4825 109.0174 44.3084 0.0000 174.1062 61 V 3.6415 8.4327 126.9270 65.6489 32.1099 177.1080 62 N 4.6270 8.1569 116.3411 54.7148 39.4097 176.0920 63 F 4.3823 8.3891 120.2378 62.1538 39.0275 176.5530 64 I 3.6064 7.5147 118.6015 64.6658 36.8316 177.6967 65 D 4.3080 8.0761 118.3495 56.8898 41.1508 178.0004 66 F 3.9783 8.3866 121.8273 61.2854 39.4622 177.1400 67 I 3.5556 7.3097 118.8563 64.2943 36.7136 178.2463 68 K 4.1139 7.4093 117.2950 58.5467 32.0112 178.7059 69 E 4.0573 8.1720 119.9328 58.2337 29.5733 176.9084 70 N 4.9209 7.2004 112.1179 52.8743 39.9263 175.6771 71 S 4.5322 7.4712 112.8812 57.5669 65.4764 173.9252 72 P 4.3104 0.0000 0.0000 64.5362 31.9086 177.0502 73 D 5.1018 8.0514 116.8760 54.2189 41.4492 174.8205 74 S 4.6150 6.8433 111.7341 55.8143 65.6851 172.5272 75 V 4.0937 8.3081 120.0495 60.7823 34.6848 174.8061 76 V 4.9694 8.2034 125.8070 60.4049 33.1562 174.0921 77 I 4.9575 7.8709 131.6327 59.5146 36.1652 173.9099 78 V 4.0841 7.8399 123.7415 63.0155 32.9576 174.8240 79 I 3.9968 8.3023 128.3437 59.3437 41.4318 176.8278 80 T 4.5330 8.1253 111.8535 61.4494 69.8748 175.7535 81 G 3.8215 7.7824 115.6977 48.1689 0.0000 176.2545 82 H 4.8351 8.8777 120.3380 54.4622 30.2446 173.9309 83 G 4.0715 9.6002 111.1970 45.5362 0.0000 172.7167 84 S 3.6150 8.4615 119.2612 58.8630 59.5356 171.8620 85 V 3.8189 7.7167 124.0117 65.0887 32.2703 177.9449 86 D 4.3233 7.8992 119.1752 56.9023 40.8010 178.3446 87 T 3.7512 7.7137 113.4432 64.6776 67.3770 175.6213 88 A 2.0000 6.8030 122.1568 54.5849 18.3049 180.0796 89 V 3.5032 7.3201 109.7567 64.1736 31.5113 178.2141 90 K 4.0896 7.8175 117.2080 57.9010 32.1228 177.4937 91 A 4.6114 7.3916 118.9398 53.3974 20.4793 178.1449 92 I 4.0821 7.7733 111.5206 63.5857 37.9675 178.4574 93 K 3.9734 7.9972 119.3748 59.2953 31.8393 178.2936 94 K 4.0368 8.1919 117.9546 57.6003 32.2876 178.0110 95 G 4.1025 7.4713 103.8042 45.5369 0.0000 173.2674 96 A 4.6401 7.7772 125.1935 51.0686 20.8907 176.6966 97 Y 4.6634 9.5698 115.2979 56.8049 40.2483 176.4100 98 E 5.2317 7.0912 114.1182 55.6651 31.1490 176.2225 99 F 4.8912 7.9153 120.3981 54.5430 39.3487 172.4314 100 L 3.8874 8.3429 127.0044 55.1761 41.8398 176.2544 101 E 4.5171 8.4994 125.6709 55.9405 32.1428 174.9053 102 K 3.8020 8.6341 116.5456 56.6262 27.0698 173.4696 103 P 4.5212 0.0000 0.0000 62.7573 32.7748 177.0668 104 F 3.6860 8.5190 113.7680 58.3891 36.0535 177.0557 105 S 4.8191 7.1840 112.3387 57.1699 65.8194 175.9002 106 V 3.4512 7.7747 124.6924 64.1583 31.6830 177.7411 107 E 3.9557 8.3716 119.7901 59.5693 29.2385 178.8184 108 R 3.9361 7.7147 118.2092 59.3305 30.3180 178.1852 109 F 4.1392 8.4082 120.4601 60.9040 39.2534 176.7955 110 L 3.9443 7.7746 120.2316 58.0931 41.7478 178.6433 111 L 4.1122 7.6650 118.2822 58.4103 41.5864 179.3678 112 T 3.7969 8.0092 114.6214 67.5250 68.1577 176.2897 113 I 3.3090 6.7284 119.0487 64.3017 37.2757 177.3711 114 K 4.1586 7.9152 118.6493 60.5675 32.0742 178.4489 115 H 4.0039 8.2402 115.8109 58.9789 28.7511 177.6308 116 A 3.8217 8.5733 122.9744 54.8996 17.9035 179.7200 117 F 4.1052 8.3699 116.0208 60.6373 39.0914 176.9197 118 E 4.2470 8.1906 116.7770 59.1423 29.6471 177.6133 119 E 4.2317 8.4719 116.4637 58.0107 29.7415 176.4524 120 Y 4.6574 7.3313 120.1083 56.3863 39.2228 174.6839 121 S 4.4606 8.3179 118.3693 58.4649 63.4092 173.7339 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 M 8.30 4.42 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.62 0.00 2 K 8.10 4.33 0.00 1.36 1.17 0.00 1.26 0.00 0.00 1.49 0.00 0.00 2.72 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.50 0.21 7.81 3 R 9.47 5.35 0.00 2.00 2.22 0.00 3.21 0.00 0.00 3.46 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 4 V 8.98 4.94 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 1.00 0.00 0.00 1.16 0.00 0.00 5 L 8.97 4.63 0.00 0.57 1.22 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.11 4.61 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 0.85 0.00 0.00 0.86 0.00 0.00 7 V 8.63 4.30 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 0.86 0.00 0.00 0.89 0.00 0.00 8 D 8.21 5.07 0.00 2.71 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 D 8.25 5.55 0.00 2.74 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 10 E 7.78 4.73 0.00 2.00 1.65 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 2.03 1.94 0.00 11 E 8.62 4.28 0.00 1.92 1.85 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 2.27 2.37 0.00 12 S 8.84 3.53 0.00 3.98 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 13 I 7.65 3.50 1.82 0.00 0.00 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 1.07 1.28 0.85 0.00 0.00 14 T 7.84 4.14 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 15 S 8.24 4.22 0.00 3.87 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 16 S 8.84 4.38 0.00 3.92 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 0.00 17 L 7.77 4.10 0.00 1.81 1.61 0.80 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.06 4.05 0.00 3.85 3.85 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 19 A 7.82 3.99 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 20 I 7.49 3.66 2.03 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 1.56 0.96 0.99 0.00 0.00 21 L 8.70 3.99 0.00 1.73 1.89 0.92 1.27 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 22 E 7.99 4.03 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 23 E 8.67 4.19 0.00 1.95 2.23 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 2.34 2.36 0.00 24 E 8.18 4.21 0.00 2.35 2.29 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 2.45 2.54 0.00 25 G 8.56 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 7.83 4.58 0.00 2.91 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 27 H 8.84 4.99 0.00 3.46 3.30 0.00 5.77 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 5.61 0.00 2.14 2.09 0.00 3.40 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.86 0.00 29 D 8.10 5.01 0.00 3.02 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 30 T 7.87 4.01 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 1.15 0.00 0.00 31 A 8.84 5.07 1.16 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 0.00 0.00 32 K 8.66 4.94 0.00 1.75 1.78 0.00 2.20 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.31 7.81 33 T 7.11 4.67 4.12 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 1.16 0.00 0.00 34 L 7.97 3.34 0.00 1.22 0.54 0.67 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 35 R 7.53 4.14 0.00 1.73 1.84 0.00 3.35 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.45 0.00 36 E 8.08 3.97 0.00 2.16 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 2.37 2.29 0.00 37 A 8.04 3.94 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 38 E 8.40 4.03 0.00 1.97 1.90 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 1.47 2.11 0.00 39 K 7.71 4.01 0.00 1.78 2.10 0.00 1.87 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.67 7.81 40 K 7.97 4.30 0.00 2.16 2.17 0.00 1.97 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.60 1.57 7.81 41 I 8.97 4.42 2.33 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.98 0.00 0.00 42 K 8.54 4.19 0.00 2.03 1.99 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.78 1.77 7.81 43 E 7.68 4.47 0.00 2.07 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 2.27 2.30 0.00 44 L 7.90 3.83 0.00 1.91 0.95 0.45 0.91 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 45 F 8.43 4.65 0.00 2.93 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 46 F 7.71 4.20 0.00 3.01 2.88 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 47 P 0.00 4.31 0.00 1.83 2.34 0.00 3.73 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 2.62 2.29 0.00 48 V 7.41 4.52 1.89 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 0.74 0.00 0.00 -0.12 0.00 0.00 49 I 9.13 4.79 1.83 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 1.11 1.27 0.89 0.00 0.00 50 V 8.81 4.71 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 1.18 0.00 0.00 51 L 8.43 4.77 0.00 1.90 1.54 0.93 1.15 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 52 D 8.53 5.47 0.00 2.80 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 53 V 7.78 3.76 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 0.97 0.00 0.00 1.04 0.00 0.00 54 W 8.52 4.59 0.00 3.41 2.92 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 55 M 7.79 4.63 0.00 1.68 1.78 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.81 0.00 56 P 0.00 4.67 0.00 2.13 2.08 0.00 3.65 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 1.95 1.97 0.00 57 D 8.47 4.82 0.00 2.58 2.60 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 58 G 7.94 3.47 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 59 D 8.27 4.18 0.00 2.77 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 60 G 7.48 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 0.00 0.00 0.00 61 V 8.43 3.64 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 0.99 0.00 0.00 0.95 0.00 0.00 62 N 8.16 4.63 0.00 2.82 2.86 0.00 0.00 6.88 7.74 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 63 F 8.39 4.38 0.00 3.13 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 64 I 7.51 3.61 1.89 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 1.59 0.79 0.95 0.00 0.00 65 D 8.08 4.31 0.00 2.87 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 66 F 8.39 3.98 0.00 3.09 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 67 I 7.31 3.56 1.78 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.49 0.73 0.00 0.00 68 K 7.41 4.11 0.00 1.78 1.83 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.55 7.81 69 E 8.17 4.06 0.00 2.00 1.81 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 2.22 2.29 0.00 70 N 7.20 4.92 0.00 2.47 2.65 0.00 0.00 6.18 5.73 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 71 S 7.47 4.53 0.00 3.70 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.31 0.00 2.12 2.15 0.00 3.84 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.27 0.00 73 D 8.05 5.10 0.00 2.82 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 S 6.84 4.61 0.00 3.52 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 75 V 8.31 4.09 1.80 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 0.69 0.00 0.00 0.73 0.00 0.00 76 V 8.20 4.97 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 1.46 0.00 0.00 0.83 0.00 0.00 77 I 7.87 4.96 1.98 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.10 1.02 0.00 0.00 78 V 7.84 4.08 2.41 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 1.13 0.00 0.00 1.08 0.00 0.00 79 I 8.30 4.00 1.70 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.10 0.80 0.00 0.00 80 T 8.13 4.53 4.35 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 1.34 0.00 0.00 81 G 7.78 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 8.88 4.84 0.00 3.22 3.31 0.00 5.70 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 83 G 9.60 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 84 S 8.46 3.62 0.00 4.09 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 85 V 7.72 3.82 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 0.96 0.00 0.00 0.91 0.00 0.00 86 D 7.90 4.32 0.00 2.67 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 87 T 7.71 3.75 4.19 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 1.21 0.00 0.00 88 A 6.80 2.00 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 89 V 7.32 3.50 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 0.73 0.00 0.00 0.85 0.00 0.00 90 K 7.82 4.09 0.00 1.79 1.91 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.43 7.81 91 A 7.39 4.61 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 0.00 0.00 0.00 0.00 0.00 92 I 7.77 4.08 1.90 0.00 0.00 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 1.66 1.10 1.20 0.00 0.00 93 K 8.00 3.97 0.00 1.95 1.92 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.12 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.52 7.81 94 K 8.19 4.04 0.00 1.93 1.85 0.00 1.84 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.59 7.81 95 G 7.47 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 96 A 7.78 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.57 4.66 0.00 2.93 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 98 E 7.09 5.23 0.00 2.16 1.80 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 1.83 2.03 0.00 99 F 7.92 4.89 0.00 2.87 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 8.34 3.89 0.00 1.69 1.65 0.99 1.26 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 0.00 101 E 8.50 4.52 0.00 2.19 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 2.28 2.38 0.00 102 K 8.63 3.80 0.00 1.99 1.95 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.11 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.47 7.81 103 P 0.00 4.52 0.00 2.34 2.30 0.00 3.96 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.13 0.00 104 F 8.52 3.69 0.00 3.22 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 0.00 105 S 7.18 4.82 0.00 3.88 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 0.00 106 V 7.77 3.45 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 0.82 0.00 0.00 0.76 0.00 0.00 107 E 8.37 3.96 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 108 R 7.71 3.94 0.00 1.97 1.98 0.00 3.24 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 109 F 8.41 4.14 0.00 3.12 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 0.00 110 L 7.77 3.94 0.00 1.93 1.73 1.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.67 4.11 0.00 1.95 1.71 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 112 T 8.01 3.80 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 113 I 6.73 3.31 1.80 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.48 0.68 0.00 0.00 114 K 7.92 4.16 0.00 1.94 1.87 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.70 7.81 115 H 8.24 4.00 0.00 3.35 3.59 0.00 5.86 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 0.00 116 A 8.57 3.82 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 F 8.37 4.11 0.00 3.24 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 0.00 118 E 8.19 4.25 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.28 0.00 119 E 8.47 4.23 0.00 1.92 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 2.36 2.34 0.00 120 Y 7.33 4.66 0.00 3.03 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 0.00 121 S 8.32 4.46 0.00 4.10 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