NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4891 8.5004 122.9741 52.3456 19.8051 176.9683 2 A 4.5544 8.0117 127.9043 50.1759 19.5075 173.9193 3 N 5.0347 7.8282 116.7348 52.5067 41.2489 170.1241 4 C 4.7782 8.2120 111.5400 52.3659 43.2493 173.7127 5 A 4.0651 8.4659 121.0995 52.5362 19.6438 177.8947 6 D 4.2398 8.7691 121.1350 57.5460 41.2627 179.0415 7 A 3.9582 7.8703 120.2374 55.0108 18.5688 179.1415 8 A 3.8840 8.0335 118.5450 55.1343 18.2464 179.7184 9 A 3.7715 8.3614 119.4584 55.3945 18.5909 179.4783 10 A 3.9059 7.8842 119.2591 55.5252 18.2803 179.9102 11 I 3.5745 7.8070 118.0442 64.5363 37.1455 178.4464 12 V 3.0119 7.1346 118.8588 66.5144 31.0482 177.3759 13 Q 4.2094 8.1118 116.6755 59.3727 28.5237 178.9390 14 A 4.1323 8.3141 120.8808 55.7172 18.5705 179.7712 15 Q 4.1327 8.3455 116.0492 58.9531 28.8429 178.8263 16 W 4.6421 9.4350 130.4845 60.9228 30.6306 177.6450 17 E 3.9418 9.0906 117.9606 59.6668 28.9334 178.5263 18 D 4.4751 8.1481 117.2432 56.6463 41.3094 177.2762 19 V 4.2276 7.0143 109.1992 60.9817 33.6510 176.0507 20 W 4.6616 7.7057 129.1871 55.0115 30.2350 173.5926 21 S 4.7414 7.3795 116.2851 55.3352 65.3621 175.9858 22 A 3.6476 8.4873 123.7505 54.4043 18.6138 178.1342 23 A 4.6553 7.2031 118.1396 50.7412 19.8948 175.2415 24 A 4.2033 7.4794 125.3982 50.7271 19.9642 179.9265 25 A 4.3043 8.6326 117.6156 49.8728 23.3947 177.2486 26 A 3.9107 8.5604 125.5784 55.4079 18.3621 180.1425 27 A 3.9604 7.8748 118.7670 55.0898 18.4946 179.7326 28 S 3.9807 7.8094 111.2486 61.6267 62.7117 176.2090 29 R 4.1653 7.8316 120.7067 59.3964 29.7392 179.0965 30 V 3.6175 7.5971 117.8618 66.3006 31.5225 178.1170 31 S 4.0663 8.0980 114.5364 61.5418 62.6011 176.5424 32 A 4.0948 8.3284 123.5336 55.1705 18.0679 179.9255 33 G 3.5575 8.0911 103.8695 47.9997 0.0000 174.9910 34 E 4.0752 8.9573 123.2411 59.3200 29.5204 178.7814 35 E 3.9348 8.5435 118.3617 59.4138 29.5833 179.4094 36 V 3.4002 7.8810 118.2427 66.1451 31.4716 178.1711 37 F 3.4375 8.2696 117.0193 60.2650 38.7115 177.2674 38 A 4.0753 8.3681 120.6701 55.5823 18.1213 179.6483 39 A 3.9013 8.1244 118.9612 55.1270 18.2540 179.6263 40 L 3.8898 7.5738 117.7123 57.5306 42.4052 178.7724 41 F 4.9912 8.2643 118.2347 60.1418 39.1790 177.7836 42 K 3.9788 8.2079 118.0046 59.7475 31.8904 178.1537 43 M 4.3921 7.7879 117.4364 57.3676 33.4869 176.8067 44 V 4.4790 7.7143 119.4465 60.1966 32.3239 173.1109 45 P 4.2798 0.0000 0.0000 64.5948 31.5468 178.7780 46 A 4.1314 8.0789 120.2448 53.6397 18.2938 177.4187 47 A 4.5845 7.8863 118.0257 52.7029 20.3974 178.7362 48 K 3.4576 7.9013 116.5711 59.6229 32.0196 178.8498 49 N 4.5111 8.0955 110.2597 53.9700 36.7580 174.8801 50 L 4.2504 8.0393 121.2536 55.8502 43.0199 176.8615 51 F 4.8621 7.8496 116.8961 57.3025 39.6651 177.3915 52 T 3.8476 8.1687 117.9291 65.2152 67.2456 175.1336 53 R 4.0523 8.0856 120.1477 58.6516 30.3598 176.8393 54 V 4.4378 7.4932 111.2216 61.9041 32.0641 175.0055 55 N 4.2499 8.3491 111.5030 54.0162 36.3591 177.1742 56 V 3.0049 8.0123 117.2537 63.7308 31.8572 176.7925 57 A 3.9567 8.0505 123.2961 54.5919 18.2555 176.7102 58 D 4.6967 7.9412 116.2834 51.3942 41.2924 175.5303 59 I 2.8574 8.0770 125.7384 63.8211 37.3445 176.6352 60 N 4.8145 7.9998 115.0112 52.8180 37.5812 175.9932 61 S 4.4330 8.6780 116.1958 57.5431 65.1173 173.2314 62 P 4.2277 0.0000 0.0000 66.3237 31.1895 178.1736 63 E 3.9779 8.3542 118.5271 59.1177 29.3990 179.3114 64 F 4.1430 8.4469 120.1164 61.4376 39.5389 176.9561 65 Q 4.0812 8.6860 118.3456 59.2133 28.5380 179.5889 66 G 3.6315 8.8486 106.9334 47.9601 0.0000 175.1244 67 H 3.9780 7.8234 120.2370 58.9101 29.9110 177.0931 68 V 3.2631 7.4089 120.3304 66.1752 31.1578 177.9338 69 V 3.6876 7.7681 117.4641 66.3272 31.3222 177.9317 70 R 3.9639 7.8158 117.5721 59.3628 29.7872 179.2018 71 V 3.5183 7.5754 117.7245 66.1912 31.5922 177.7777 72 M 3.7631 7.9768 118.4907 58.3410 31.8244 178.6700 73 G 4.0591 8.3841 106.1670 48.0461 0.0000 175.5609 74 G 3.5598 7.8882 108.1044 47.4554 0.0000 175.1947 75 L 3.6627 7.8856 123.9137 57.6971 41.9066 178.3554 76 D 4.1899 8.2186 117.9519 57.3567 40.9872 178.0689 77 I 3.7053 8.0344 119.9271 65.2047 37.5452 177.6540 78 L 3.9750 8.2318 119.8824 56.8920 41.2823 179.3274 79 I 3.4420 8.0964 119.7180 64.9696 37.0836 178.2538 80 N 4.4631 8.4325 115.6184 55.6605 38.4283 176.2416 81 A 4.5482 7.7981 121.0431 52.2903 18.9099 179.1353 82 L 3.9336 7.4881 122.3648 58.7916 41.6146 178.0000 83 D 4.4111 8.0133 117.2102 55.9238 41.9796 175.9917 84 D 4.6807 7.5646 120.6918 51.7574 39.8927 175.7984 85 I 3.6277 8.0105 124.1358 63.4859 38.0336 174.7817 86 P 4.2551 0.0000 0.0000 65.8912 31.0502 178.3484 87 T 4.0520 7.8298 115.6379 66.0257 68.5699 176.6751 88 L 3.9140 7.9898 122.2019 58.1263 41.5571 178.4444 89 E 3.9138 7.8301 118.9177 59.5563 29.3166 179.0813 90 S 4.1430 7.7275 114.5324 62.2398 63.0382 176.5260 91 M 3.9732 8.2200 121.1116 59.0479 31.6755 178.5132 92 L 3.9215 8.5598 118.7693 58.0538 41.7863 179.3958 93 D 4.4891 8.5819 118.8544 58.2450 40.8159 178.5804 94 H 4.0623 8.6265 118.6447 59.3435 29.7555 176.7029 95 L 4.1450 8.2936 119.9422 58.2843 41.5950 179.3000 96 A 4.3825 8.3307 122.2949 54.5121 18.4112 179.5061 97 G 3.9216 8.4038 103.4674 48.4119 0.0000 175.6068 98 Q 4.0520 8.2124 119.4199 58.3526 28.8348 178.1018 99 H 4.5863 8.1382 116.4211 57.7104 29.3653 177.1057 100 A 3.9879 8.7192 123.0422 55.2022 18.1774 179.6794 101 V 4.0017 7.5487 116.0146 63.2270 32.0110 176.7291 102 R 4.0990 7.9519 119.4706 54.8728 28.9915 175.2815 103 D 4.4805 8.4909 123.7442 55.8045 40.9824 175.4901 104 G 3.6014 9.0547 116.6063 45.8418 0.0000 174.4040 105 V 3.7150 7.4480 114.7752 61.6474 31.9211 175.5473 106 T 4.5342 8.4367 119.5221 60.1985 68.8057 175.3354 107 G 3.6876 8.7136 114.3208 47.0273 0.0000 173.6753 108 A 4.8744 7.9875 121.8268 51.7849 20.8549 178.8644 109 G 3.7794 8.6818 103.9955 47.6959 0.0000 176.1184 110 F 3.8522 8.5296 119.6194 60.3709 39.0445 177.2375 111 Q 4.0696 8.3273 117.2691 59.2248 28.4894 179.3083 112 L 3.9229 7.9191 119.4227 58.0173 41.6909 178.8527 113 M 3.7267 7.7728 117.8447 59.1385 31.9376 177.5025 114 A 3.9125 8.2987 120.4889 55.9267 18.4013 179.3457 115 T 3.8006 8.1091 112.7679 66.8969 68.7796 176.8550 116 V 3.7248 7.6552 120.9592 65.4955 31.6542 177.8691 117 L 3.8226 7.8515 118.6912 58.1882 41.2660 179.5408 118 M 4.0088 8.0386 117.7165 58.3319 31.8927 178.3391 119 E 4.1170 8.4462 117.0524 57.8461 30.1520 177.9013 120 S 4.4779 7.4853 113.1715 57.7431 64.3310 175.7961 121 L 3.5721 7.8298 125.4624 57.4714 41.5647 176.8144 122 P 3.8765 0.0000 0.0000 65.2478 30.9400 177.9225 123 Q 4.0094 7.2996 117.3926 58.6469 28.7064 177.8997 124 V 3.9664 7.2030 111.1370 62.1810 32.7689 177.1386 125 V 4.0778 7.4714 117.1305 62.4306 33.3854 175.5843 126 E 3.9683 8.9606 125.2963 58.1406 28.0622 178.6911 127 G 4.0143 9.1456 113.3059 46.4519 0.0000 174.2298 128 F 3.9774 7.7758 118.9761 57.9709 40.3705 174.6431 129 N 4.6384 7.7010 125.9739 50.6555 39.8880 172.8620 130 P 4.0691 0.0000 0.0000 65.8345 31.3742 177.8570 131 D 4.3840 8.0695 117.8012 57.1112 40.9045 178.1144 132 A 3.9576 9.0108 121.3348 55.1885 18.3293 179.7513 133 W 3.8273 8.2447 116.8935 59.7590 29.1986 178.6042 134 A 4.0731 8.7899 121.2596 55.3790 16.3960 179.6988 135 S 4.0624 8.5726 113.9820 62.0536 62.4824 176.3580 136 C 4.5027 8.2155 118.7594 59.3284 38.3927 175.8018 137 L 3.9247 8.5834 122.0370 58.2945 41.9409 178.8662 138 A 4.1580 8.1204 120.6822 55.0126 17.9253 179.7420 139 G 3.5990 7.6089 104.4129 47.8295 0.0000 175.4731 140 I 4.0204 7.4519 114.0691 62.1384 38.1278 177.7834 141 A 4.0464 8.6950 123.0477 55.0846 17.9177 179.4096 142 A 3.9298 7.7691 117.9832 54.9394 18.4867 179.4017 143 A 4.0734 7.1957 118.7445 55.0821 18.9046 179.5592 144 I 3.7899 7.9483 118.8207 63.6328 38.2891 176.7386 145 S 4.2092 7.0044 115.3954 56.6565 61.8604 174.4144 146 S 4.5422 7.4777 124.4373 55.9847 62.0314 173.8286 147 A 4.5358 7.6703 126.2164 53.2129 21.6218 176.5734 148 L 4.0168 8.6435 123.9572 55.3066 42.7727 173.8248 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 A 8.50 4.49 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 2 A 8.01 4.55 1.27 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 0.00 0.00 3 N 7.83 5.03 0.00 2.77 2.77 0.00 0.00 6.06 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 4 C 8.21 4.78 0.00 2.98 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 5 A 8.47 4.07 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 6 D 8.77 4.24 0.00 2.73 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 7 A 7.87 3.96 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 8 A 8.03 3.88 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 9 A 8.36 3.77 1.34 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 0.00 0.00 10 A 7.88 3.91 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 11 I 7.81 3.57 1.94 0.00 0.00 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 1.62 1.01 0.90 0.00 0.00 12 V 7.13 3.01 1.76 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 -0.30 0.00 0.00 0.32 0.00 0.00 13 Q 8.11 4.21 0.00 2.33 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.48 0.00 0.00 0.00 0.00 0.00 2.53 2.53 0.00 14 A 8.31 4.13 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 15 Q 8.35 4.13 0.00 2.81 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.75 0.00 0.00 0.00 0.00 0.00 2.59 2.80 0.00 16 W 9.43 4.64 0.00 3.56 3.35 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 17 E 9.09 3.94 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 2.69 2.58 0.00 18 D 8.15 4.48 0.00 2.85 3.05 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 19 V 7.01 4.23 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 0.69 0.00 0.00 0.63 0.00 0.00 20 W 7.71 4.66 0.00 1.84 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 0.00 0.00 0.00 21 S 7.38 4.74 0.00 3.95 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 22 A 8.49 3.65 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 23 A 7.20 4.66 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 24 A 7.48 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.63 4.30 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 26 A 8.56 3.91 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 27 A 7.87 3.96 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 28 S 7.81 3.98 0.00 3.86 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 29 R 7.83 4.17 0.00 2.00 2.33 0.00 2.81 0.00 0.00 2.95 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.53 0.00 30 V 7.60 3.62 2.28 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 1.08 0.00 0.00 1.00 0.00 0.00 31 S 8.10 4.07 0.00 4.06 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 32 A 8.33 4.09 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 33 G 8.09 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 34 E 8.96 4.08 0.00 2.24 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 2.44 2.60 0.00 35 E 8.54 3.93 0.00 2.17 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 2.51 2.45 0.00 36 V 7.88 3.40 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 0.54 0.00 0.00 0.90 0.00 0.00 37 F 8.27 3.44 0.00 3.10 2.54 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 0.00 0.00 0.00 0.00 38 A 8.37 4.08 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.12 3.90 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 40 L 7.57 3.89 0.00 1.46 1.34 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.26 4.99 0.00 3.28 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 42 K 8.21 3.98 0.00 1.79 1.89 0.00 1.82 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.49 7.81 43 M 7.79 4.39 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.57 0.00 44 V 7.71 4.48 2.20 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 1.12 0.00 0.00 0.99 0.00 0.00 45 P 0.00 4.28 0.00 2.24 2.31 0.00 3.80 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 2.09 1.99 0.00 46 A 8.08 4.13 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 47 A 7.89 4.58 1.60 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 48 K 7.90 3.46 0.00 1.74 1.60 0.00 1.40 0.00 0.00 1.32 0.00 0.00 2.49 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.30 0.64 7.81 49 N 8.10 4.51 0.00 2.77 2.89 0.00 0.00 5.87 7.79 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 50 L 8.04 4.25 0.00 1.67 1.20 0.84 0.92 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 51 F 7.85 4.86 0.00 3.29 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 52 T 8.17 3.85 4.23 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 1.19 0.00 0.00 53 R 8.09 4.05 0.00 1.82 1.98 0.00 3.27 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 54 V 7.49 4.44 2.19 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 0.81 0.00 0.00 1.27 0.00 0.00 55 N 8.35 4.25 0.00 3.02 2.89 0.00 0.00 6.74 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 56 V 8.01 3.00 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 0.70 0.00 0.00 0.61 0.00 0.00 57 A 8.05 3.96 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 58 D 7.94 4.70 0.00 2.63 2.50 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 0.00 59 I 8.08 2.86 1.81 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 0.66 0.37 1.18 0.00 0.00 60 N 8.00 4.81 0.00 2.81 2.94 0.00 0.00 7.03 8.96 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 61 S 8.68 4.43 0.00 4.07 4.18 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 62 P 0.00 4.23 0.00 2.31 2.38 0.00 3.76 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 2.11 2.09 0.00 63 E 8.35 3.98 0.00 2.15 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 0.00 2.56 2.49 0.00 64 F 8.45 4.14 0.00 3.37 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 65 Q 8.69 4.08 0.00 2.38 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 66 G 8.85 3.63 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 0.00 0.00 0.00 67 H 7.82 3.98 0.00 3.19 3.04 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 7.41 3.26 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 1.03 0.00 0.00 0.16 0.00 0.00 69 V 7.77 3.69 2.27 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 1.20 0.00 0.00 1.07 0.00 0.00 70 R 7.82 3.96 0.00 2.06 1.97 0.00 3.21 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 71 V 7.58 3.52 2.28 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 1.07 0.00 0.00 0.99 0.00 0.00 72 M 7.98 3.76 0.00 1.21 2.18 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.96 0.00 73 G 8.38 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 0.00 0.00 0.00 0.00 74 G 7.89 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 75 L 7.89 3.66 0.00 1.44 1.31 0.67 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.22 4.19 0.00 2.72 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 77 I 8.03 3.71 2.06 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 1.58 0.96 0.92 0.00 0.00 78 L 8.23 3.97 0.00 1.74 1.51 0.87 1.06 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 79 I 8.10 3.44 1.56 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.86 0.77 0.00 0.00 80 N 8.43 4.46 0.00 2.84 2.93 0.00 0.00 7.05 7.27 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 81 A 7.80 4.55 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 82 L 7.49 3.93 0.00 1.81 1.67 0.75 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.01 4.41 0.00 2.59 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 84 D 7.56 4.68 0.00 2.65 2.52 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 85 I 8.01 3.63 1.85 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 1.68 1.16 0.89 0.00 0.00 86 P 0.00 4.26 0.00 2.29 2.28 0.00 3.79 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.04 0.00 87 T 7.83 4.05 4.33 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 1.21 0.00 0.00 88 L 7.99 3.91 0.00 1.94 1.76 0.94 0.88 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 89 E 7.83 3.91 0.00 2.13 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 2.57 2.49 0.00 90 S 7.73 4.14 0.00 3.92 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 91 M 8.22 3.97 0.00 2.07 2.26 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.65 0.00 92 L 8.56 3.92 0.00 1.72 1.67 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 93 D 8.58 4.49 0.00 2.87 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 94 H 8.63 4.06 0.00 3.37 3.45 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.29 4.15 0.00 1.94 1.81 0.95 1.17 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 96 A 8.33 4.38 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 97 G 8.40 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 98 Q 8.21 4.05 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 99 H 8.14 4.59 0.00 3.39 3.43 0.00 5.83 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 0.00 100 A 8.72 3.99 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 0.00 101 V 7.55 4.00 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 0.84 0.00 0.00 0.92 0.00 0.00 102 R 7.95 4.10 0.00 1.96 1.89 0.00 3.27 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.68 0.00 103 D 8.49 4.48 0.00 2.65 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 0.00 104 G 9.05 3.60 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 0.00 105 V 7.45 3.71 2.28 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 0.72 0.00 0.00 1.08 0.00 0.00 106 T 8.44 4.53 4.28 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 1.34 0.00 0.00 107 G 8.71 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 0.00 0.00 0.00 108 A 7.99 4.87 1.34 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 0.00 0.00 109 G 8.68 3.78 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 0.00 0.00 0.00 110 F 8.53 3.85 0.00 3.11 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 0.00 111 Q 8.33 4.07 0.00 2.33 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 112 L 7.92 3.92 0.00 1.98 1.72 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 113 M 7.77 3.73 0.00 2.05 1.77 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 114 A 8.30 3.91 1.41 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 0.00 115 T 8.11 3.80 4.36 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 1.20 0.00 0.00 116 V 7.66 3.72 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 1.15 0.00 0.00 0.93 0.00 0.00 117 L 7.85 3.82 0.00 1.79 1.58 0.83 0.70 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 0.00 118 M 8.04 4.01 0.00 1.99 2.26 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.86 0.00 119 E 8.45 4.12 0.00 2.12 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 0.00 2.46 2.20 0.00 120 S 7.49 4.48 0.00 3.93 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 0.00 121 L 7.83 3.57 0.00 1.26 0.20 0.81 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 3.88 0.00 2.09 1.81 0.00 3.17 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 123 Q 7.30 4.01 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.86 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 124 V 7.20 3.97 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 0.70 0.00 0.00 0.88 0.00 0.00 125 V 7.47 4.08 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 1.04 0.00 0.00 1.02 0.00 0.00 126 E 8.96 3.97 0.00 2.12 1.76 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 2.46 2.44 0.00 127 G 9.15 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 0.00 0.00 0.00 0.00 128 F 7.78 3.98 0.00 2.90 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 0.00 129 N 7.70 4.64 0.00 2.75 2.63 0.00 0.00 6.61 7.59 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 0.00 130 P 0.00 4.07 0.00 2.35 2.44 0.00 3.64 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 2.05 2.10 0.00 131 D 8.07 4.38 0.00 2.91 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 0.00 132 A 9.01 3.96 1.27 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 0.00 0.00 133 W 8.24 3.83 0.00 3.51 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 8.79 4.07 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 0.00 135 S 8.57 4.06 0.00 3.94 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 0.00 136 C 8.22 4.50 0.00 2.75 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 0.00 137 L 8.58 3.92 0.00 2.14 1.76 1.24 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 138 A 8.12 4.16 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 0.00 139 G 7.61 3.60 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 0.00 140 I 7.45 4.02 1.84 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 1.68 0.73 0.86 0.00 0.00 141 A 8.69 4.05 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 0.00 142 A 7.77 3.93 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 0.00 143 A 7.20 4.07 1.25 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 0.00 0.00 0.00 144 I 7.95 3.79 1.82 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 1.58 1.20 0.77 0.00 0.00 145 S 7.00 4.21 0.00 3.52 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 0.00 146 S 7.48 4.54 0.00 3.96 3.75 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 0.00 147 A 7.67 4.54 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 0.00 148 L 8.64 4.02 0.00 1.76 1.78 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00