NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5610 8.3049 120.5950 55.8377 33.2840 174.3769 2 H 5.1848 8.8478 123.5638 53.6725 32.0731 171.9017 3 A 5.0389 10.1188 125.0387 50.5275 21.5788 175.5662 4 L 5.0955 9.2340 123.0847 52.9171 44.5764 175.7236 5 V 4.8171 8.6861 124.0837 60.8163 34.4872 174.2731 6 Q 4.5776 8.7840 129.8793 56.3351 29.5319 175.9817 7 L 4.8432 8.8556 125.0310 54.3891 43.7835 176.7146 8 R 4.6225 8.0027 117.9140 53.7116 32.8450 175.6411 9 G 3.9212 8.6937 111.7907 45.2632 0.0000 173.1431 10 E 3.9337 8.5637 116.5707 58.3550 30.0438 177.2578 11 V 3.7574 7.5819 119.6731 64.3311 31.6084 175.3625 12 N 4.5167 9.0030 123.6838 53.4268 35.9475 173.8642 13 M 4.2708 7.6360 115.9391 53.8313 32.8440 176.3923 14 H 4.0916 8.4424 117.8588 56.8952 30.6110 176.6566 15 T 3.8434 8.5145 121.4990 66.8102 68.2054 176.7563 16 D 4.4300 8.0413 120.3044 56.2269 39.2628 178.4152 17 I 3.7758 7.4928 121.0937 63.9824 37.4175 177.7671 18 Q 3.8617 8.0178 120.5723 59.0790 28.8053 177.8729 19 D 4.3762 8.5152 120.5275 57.3174 40.8828 178.8454 20 T 3.8266 7.5773 116.2745 66.5151 68.4240 176.6254 21 L 3.9639 7.6038 120.9076 57.9711 41.6767 179.4945 22 E 3.8709 7.9883 117.9682 59.6451 29.1195 179.3754 23 M 4.1853 7.9914 117.9473 57.6243 31.9604 177.5784 24 L 4.5366 7.3850 117.4608 54.0915 41.9318 176.4736 25 N 4.2871 7.8930 114.3878 53.8486 36.6119 173.6203 26 I 4.4610 7.7164 112.0250 59.6678 38.9285 175.0187 27 H 4.8059 8.8542 119.9336 55.4832 30.1219 172.7013 28 H 4.8464 7.5087 115.8727 53.8557 32.7315 172.8336 29 V 3.7389 8.0460 121.0656 64.3637 31.8976 176.1033 30 N 4.5729 9.4253 122.9400 53.6623 37.1992 173.4484 31 H 4.9256 7.8871 116.5272 55.2537 30.4616 173.9424 32 C 5.9523 9.1621 122.2999 57.3087 35.0452 172.4396 33 T 5.0946 8.2593 116.8984 60.6365 71.2196 171.8404 34 L 5.2010 8.4466 125.2764 52.8565 43.8940 176.2506 35 V 4.0321 8.5478 123.5857 58.7780 34.0959 173.6985 36 P 4.3853 0.0000 0.0000 62.5818 32.0410 176.9577 37 E 4.2684 8.7483 123.2244 55.3986 28.1225 176.2177 38 T 4.6746 7.4604 118.9940 61.4310 73.0608 174.4960 39 D 4.3414 8.5064 121.7493 57.4248 40.3526 178.9875 40 A 3.9142 7.9092 120.7650 55.5708 18.5381 179.2528 41 Y 3.9483 7.9084 114.6672 60.8610 37.9318 178.4120 42 R 4.0053 8.3486 120.3266 59.3485 30.1694 178.7901 43 G 3.5752 7.9339 104.9264 48.0009 0.0000 175.3579 44 M 3.9946 7.6184 120.6983 58.4387 31.9185 179.4493 45 V 3.5055 7.8771 112.0156 64.1797 31.3786 178.5403 46 A 3.9881 7.7119 119.8449 54.8209 18.2001 179.2589 47 K 4.1040 7.7667 117.7915 58.9386 32.5686 178.2603 48 V 4.2350 7.4052 115.9795 62.5818 31.2650 176.5129 49 N 4.2699 7.5887 117.4672 57.4041 38.7277 175.1680 50 D 4.5109 8.0915 114.3466 54.8445 41.5333 176.5442 51 F 4.7186 8.6119 117.6825 56.8031 40.0733 174.3619 52 V 5.0685 7.5628 120.0488 60.0956 35.7848 173.6514 53 A 5.2881 8.9673 121.5141 50.1899 21.8072 175.3661 54 F 6.0216 8.6309 116.4072 53.8847 42.4429 173.9381 55 G 4.0833 8.1246 106.8043 46.1250 0.0000 170.5074 56 E 4.9941 7.9619 121.3395 54.4239 30.7308 174.1616 57 P 4.9722 0.0000 0.0000 61.8385 33.0427 176.2361 58 S 4.4823 8.8546 114.5663 57.5806 65.3851 174.8036 59 Q 3.9644 8.7158 124.0620 59.7859 28.5679 179.1946 60 E 3.9595 8.1187 118.5343 59.7322 29.6431 179.1185 61 T 3.8346 7.6155 115.4633 66.6662 68.4815 176.1317 62 L 3.9351 8.1387 122.2540 58.4134 41.6500 178.8121 63 E 3.9579 8.2433 118.2568 59.7221 29.3643 179.5965 64 T 3.8713 8.0684 115.8190 66.7182 68.5894 176.9391 65 V 3.6014 7.8677 120.0957 65.8404 31.5112 178.0922 66 L 3.8916 8.2637 118.8323 57.8158 41.3042 179.3262 67 A 3.9907 7.7908 119.3402 55.2003 18.3494 178.9843 68 T 4.1610 7.7725 110.3510 63.6386 67.7634 175.3983 69 R 4.4901 8.3675 115.6807 54.9851 32.2458 175.4941 70 A 4.1113 7.8347 121.4660 52.2844 19.0927 176.5868 71 E 4.6031 8.0046 118.4820 53.8005 34.3889 173.4575 72 P 4.5848 0.0000 0.0000 62.0483 31.8660 176.4730 73 L 4.1733 8.4357 123.6895 58.2342 42.3914 177.0865 74 E 4.5769 8.1483 115.3406 55.9432 33.3846 175.3106 75 G 3.9696 8.8369 106.6695 45.9222 0.0000 172.6808 76 D 4.5511 8.1952 115.1164 53.2894 41.3737 175.4662 77 A 3.9575 7.9841 120.7399 52.7537 18.3623 177.3814 78 D 4.2310 8.6506 122.2381 54.8698 41.8151 175.8195 79 V 3.9779 7.9816 124.7340 61.0690 32.4079 174.2466 80 D 4.9449 8.4094 125.7489 50.7637 42.9887 175.5211 81 D 4.4531 8.9894 117.8167 57.9283 40.5583 178.8447 82 E 3.9150 8.2897 118.9625 58.8826 29.5580 178.4790 83 W 3.9046 9.5736 129.4548 60.4147 30.7828 177.8119 84 V 3.9840 8.8648 118.3315 66.3343 30.7402 177.7922 85 A 4.4115 8.4080 120.4059 54.6025 18.3478 178.5995 86 E 4.2158 8.1137 114.0418 56.9368 29.6855 176.9921 87 H 4.5287 7.4501 113.4964 55.1770 32.0049 172.6943 88 T 4.7855 8.0534 115.8984 61.6159 72.2339 173.8813 89 D 4.5411 8.7000 118.6564 54.9678 40.3454 175.5694 90 Y 4.7324 7.6944 116.9247 56.2300 41.4133 176.0757 91 D 4.5269 8.7610 119.9278 56.3949 41.7018 175.9977 92 D 4.7035 7.5993 116.1922 51.4371 42.0562 175.4884 93 I 3.7341 9.0168 119.5028 64.9118 36.8964 178.4511 94 S 4.4988 7.7450 116.9138 60.9829 62.6926 176.9100 95 G 3.8463 7.9819 106.7767 47.7695 0.0000 175.3843 96 L 2.9613 7.6422 122.6215 57.4931 42.1355 178.5493 97 A 3.9219 8.6282 121.5007 55.3717 18.2728 179.3815 98 F 3.9682 8.7078 118.9291 61.4604 39.4335 177.2451 99 A 4.1330 7.9074 121.6584 54.3571 18.0271 179.6395 100 L 3.8584 8.0505 117.9611 58.0788 41.5790 179.5466 101 L 3.9187 7.6720 117.8522 57.4388 41.6674 178.8687 102 S 4.3002 7.6815 112.0753 56.9601 63.4157 173.8897 103 E 3.9026 8.2697 120.6675 57.8329 27.2350 174.9176 104 E 4.3008 8.7066 118.9770 57.3630 30.6326 174.4372 105 T 5.2729 7.4580 110.0740 62.4946 70.3317 171.4693 106 T 4.7683 8.1180 110.7475 59.3696 72.2128 174.6299 107 L 4.0154 8.5999 122.1127 58.2274 42.2064 180.1330 108 R 4.2697 8.0674 116.4197 58.8309 30.4617 178.6177 109 E 4.0444 8.1463 117.3265 59.2693 29.5374 178.2332 110 Q 4.3812 7.8722 115.7888 55.7779 29.2025 175.9556 111 G 4.1108 8.3364 104.6451 46.4773 0.0000 173.8781 112 L 5.0910 8.2159 119.0457 51.9898 44.2221 176.2473 113 S 4.2311 8.5769 117.0685 57.7996 62.7016 173.0680 114 P 4.4178 0.0000 0.0000 64.5756 31.3851 176.1905 115 T 4.8842 7.3950 114.8702 61.5386 71.3690 173.8543 116 L 4.4367 9.0029 125.5885 53.2857 43.8165 176.1748 117 R 4.1709 8.4475 124.5707 54.9417 29.0867 176.5221 118 L 4.3307 8.2758 124.2641 54.7233 43.1176 175.4651 119 H 4.8980 8.7827 119.8222 53.8392 32.1501 172.6322 120 P 4.3919 0.0000 0.0000 61.7748 31.9265 174.6358 121 P 4.3580 0.0000 0.0000 62.6789 31.2991 176.0896 122 R 4.0722 8.7912 124.1166 57.7145 30.2093 177.4267 123 G 3.7759 8.9818 110.7866 44.7806 0.0000 173.7148 124 G 3.9631 8.2004 107.2865 45.3463 0.0000 172.9474 125 H 4.9009 7.9606 114.7107 53.9405 30.9825 174.5154 126 D 4.6002 9.6129 118.6737 54.6684 40.6928 177.1235 127 G 4.1512 8.6015 107.2219 46.4119 0.0000 174.6236 128 V 4.4921 8.0626 114.5220 61.1804 32.1151 176.6890 129 K 4.4651 8.0422 116.9667 56.4115 33.6651 175.8165 130 H 4.8717 7.5425 115.6276 53.3339 32.9583 171.2706 131 P 4.9200 0.0000 0.0000 61.7690 32.8362 177.4537 132 V 3.8613 8.0257 117.0200 65.4438 31.2347 178.3043 133 K 4.1378 8.0299 116.8017 58.8361 31.9219 177.3447 134 E 4.3851 8.1727 115.9865 55.9142 29.6292 176.7181 135 G 3.8835 8.6346 108.6444 44.8708 0.0000 174.3276 136 G 4.4937 8.2601 107.5539 44.8254 0.0000 173.6010 137 Q 4.7468 8.5238 119.2562 55.7834 30.2640 176.5780 138 L 4.3837 7.8055 118.5386 56.2611 43.7968 177.9610 139 G 4.1441 9.0759 109.5225 44.0717 0.0000 172.2756 140 K 3.0366 8.0147 119.5355 56.4013 32.6278 176.5234 141 H 4.9395 8.3920 123.3123 53.5514 32.5603 172.9793 142 D 4.5656 8.3583 119.1495 54.3693 41.8984 178.1778 143 T 4.3018 8.4341 117.6718 66.2665 68.2989 176.8093 144 E 4.0606 8.1583 121.1747 58.9585 29.7688 178.9078 145 G 3.5768 7.8717 105.3817 48.6641 0.0000 175.3379 146 I 3.6538 8.0935 121.9647 63.8018 37.9704 177.7006 147 D 4.3691 8.2455 119.7692 57.3437 40.2295 178.4464 148 D 4.3530 8.2397 119.5852 57.2098 40.7100 178.6077 149 L 3.9793 7.9152 120.6478 58.3238 41.9949 178.8194 150 L 4.0019 8.0171 117.9421 58.0816 41.8200 179.2686 151 E 4.1142 8.4242 118.1983 59.1757 29.4886 178.9536 152 A 4.2082 8.1949 120.1610 54.0447 18.4090 178.3538 153 M 4.7053 7.7512 117.5729 53.7951 32.3813 176.2715 154 R 4.0854 7.6787 122.0013 56.7992 29.3655 176.1828 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 4.56 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 2 H 8.85 5.18 0.00 3.16 3.30 0.00 5.67 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 3 A 10.12 5.04 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 4 L 9.23 5.10 0.00 1.71 1.60 0.90 0.61 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 5 V 8.69 4.82 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 0.98 0.00 0.00 0.94 0.00 0.00 6 Q 8.78 4.58 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.39 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 7 L 8.86 4.84 0.00 1.56 1.64 0.88 0.96 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 8 R 8.00 4.62 0.00 2.04 2.04 0.00 3.19 0.00 0.00 3.09 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 9 G 8.69 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 10 E 8.56 3.93 0.00 2.32 2.17 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 2.34 2.27 0.00 11 V 7.58 3.76 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 0.82 0.00 0.00 0.93 0.00 0.00 12 N 9.00 4.52 0.00 2.97 3.02 0.00 0.00 7.13 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 13 M 7.64 4.27 0.00 1.73 0.97 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.42 0.00 14 H 8.44 4.09 0.00 3.14 3.40 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.51 3.84 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 1.23 0.00 0.00 16 D 8.04 4.43 0.00 2.83 2.90 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 17 I 7.49 3.78 1.84 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.06 0.68 0.00 0.00 18 Q 8.02 3.86 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.29 0.00 19 D 8.52 4.38 0.00 2.66 2.66 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 0.00 0.00 0.00 0.00 20 T 7.58 3.83 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 1.18 0.00 0.00 21 L 7.60 3.96 0.00 1.74 1.66 0.88 1.02 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 22 E 7.99 3.87 0.00 2.16 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 0.00 2.23 2.40 0.00 23 M 7.99 4.19 0.00 1.95 2.24 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 24 L 7.38 4.54 0.00 1.85 1.72 0.94 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 25 N 7.89 4.29 0.00 2.91 2.96 0.00 0.00 6.73 7.01 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 26 I 7.72 4.46 1.90 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 1.42 0.67 0.98 0.00 0.00 27 H 8.85 4.81 0.00 2.99 3.17 0.00 5.88 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 28 H 7.51 4.85 0.00 2.45 2.92 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.05 3.74 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 0.83 0.00 0.00 0.96 0.00 0.00 30 N 9.43 4.57 0.00 2.99 3.03 0.00 0.00 6.87 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 31 H 7.89 4.93 0.00 3.25 3.22 0.00 5.57 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 9.16 5.95 0.00 2.93 2.86 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 33 T 8.26 5.09 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 1.26 0.00 0.00 34 L 8.45 5.20 0.00 1.47 1.49 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.55 4.03 1.72 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 0.80 0.00 0.00 0.50 0.00 0.00 36 P 0.00 4.39 0.00 1.83 1.92 0.00 2.20 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.92 0.00 37 E 8.75 4.27 0.00 1.88 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 2.01 2.19 0.00 38 T 7.46 4.67 4.47 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 1.29 0.00 0.00 39 D 8.51 4.34 0.00 2.69 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 40 A 7.91 3.91 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 41 Y 7.91 3.95 0.00 3.14 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 42 R 8.35 4.01 0.00 2.09 2.13 0.00 3.13 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 43 G 7.93 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.62 3.99 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.52 0.00 45 V 7.88 3.51 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 0.78 0.00 0.00 0.76 0.00 0.00 46 A 7.71 3.99 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 47 K 7.77 4.10 0.00 1.87 2.02 0.00 1.78 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 48 V 7.41 4.24 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 1.05 0.00 0.00 0.98 0.00 0.00 49 N 7.59 4.27 0.00 2.92 2.98 0.00 0.00 7.09 8.64 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 50 D 8.09 4.51 0.00 2.23 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 0.00 0.00 0.00 0.00 51 F 8.61 4.72 0.00 3.15 3.06 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 52 V 7.56 5.07 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 1.14 0.00 0.00 1.15 0.00 0.00 53 A 8.97 5.29 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 54 F 8.63 6.02 0.00 3.23 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 55 G 8.12 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 0.00 0.00 0.00 56 E 7.96 4.99 0.00 2.18 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 0.00 2.35 2.41 0.00 57 P 0.00 4.97 0.00 2.21 2.03 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 58 S 8.85 4.48 0.00 4.09 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 0.00 59 Q 8.72 3.96 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.95 0.00 0.00 0.00 0.00 0.00 2.49 2.71 0.00 60 E 8.12 3.96 0.00 2.06 1.99 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 2.41 2.41 0.00 61 T 7.62 3.83 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 1.24 0.00 0.00 62 L 8.14 3.94 0.00 1.72 1.82 0.90 1.19 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 63 E 8.24 3.96 0.00 2.35 2.00 0.00 0.00 0.00 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 2.45 0.00 64 T 8.07 3.87 4.38 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 1.20 0.00 0.00 65 V 7.87 3.60 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 0.81 0.00 0.00 0.92 0.00 0.00 66 L 8.26 3.89 0.00 1.86 1.67 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.79 3.99 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 68 T 7.77 4.16 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 1.33 0.00 0.00 69 R 8.37 4.49 0.00 1.78 1.83 0.00 3.59 0.00 0.00 3.20 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 70 A 7.83 4.11 1.19 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 0.00 0.00 71 E 8.00 4.60 0.00 1.76 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 2.17 2.40 0.00 72 P 0.00 4.58 0.00 2.12 2.03 0.00 3.65 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.47 0.00 73 L 8.44 4.17 0.00 1.88 1.75 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.15 4.58 0.00 1.97 1.79 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 2.23 2.33 0.00 75 G 8.84 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 76 D 8.20 4.55 0.00 2.62 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 77 A 7.98 3.96 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 78 D 8.65 4.23 0.00 2.64 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 79 V 7.98 3.98 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 0.73 0.00 0.00 -0.08 0.00 0.00 80 D 8.41 4.94 0.00 2.94 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 81 D 8.99 4.45 0.00 2.76 2.83 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 82 E 8.29 3.91 0.00 2.08 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 0.00 2.53 2.36 0.00 83 W 9.57 3.90 0.00 3.62 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 84 V 8.86 3.98 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 1.25 0.00 0.00 1.19 0.00 0.00 85 A 8.41 4.41 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 86 E 8.11 4.22 0.00 1.66 1.71 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 2.23 2.44 0.00 87 H 7.45 4.53 0.00 1.51 2.14 0.00 5.60 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 8.05 4.79 4.56 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 1.66 0.00 0.00 89 D 8.70 4.54 0.00 2.05 2.30 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 90 Y 7.69 4.73 0.00 3.16 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 91 D 8.76 4.53 0.00 2.72 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 92 D 7.60 4.70 0.00 3.20 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 93 I 9.02 3.73 1.90 0.00 0.00 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 1.58 1.06 0.92 0.00 0.00 94 S 7.75 4.50 0.00 4.04 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 95 G 7.98 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 0.00 0.00 0.00 96 L 7.64 2.96 0.00 1.60 1.83 0.73 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.63 3.92 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 98 F 8.71 3.97 0.00 3.18 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 99 A 7.91 4.13 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 0.00 100 L 8.05 3.86 0.00 1.73 1.63 0.85 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.67 3.92 0.00 1.64 1.61 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 102 S 7.68 4.30 0.00 3.80 3.44 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 0.00 103 E 8.27 3.90 0.00 2.00 1.99 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 2.16 2.12 0.00 104 E 8.71 4.30 0.00 1.86 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 2.35 2.34 0.00 105 T 7.46 5.27 4.39 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 1.21 0.00 0.00 106 T 8.12 4.77 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 1.20 0.00 0.00 107 L 8.60 4.02 0.00 1.72 1.77 0.96 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 108 R 8.07 4.27 0.00 1.90 2.01 0.00 3.45 0.00 0.00 3.33 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.64 0.00 109 E 8.15 4.04 0.00 2.26 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 2.37 2.34 0.00 110 Q 7.87 4.38 0.00 2.17 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.62 0.00 0.00 0.00 0.00 0.00 2.67 2.59 0.00 111 G 8.34 4.11 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 0.00 0.00 0.00 112 L 8.22 5.09 0.00 1.73 1.55 0.92 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.58 4.23 0.00 3.76 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 0.00 114 P 0.00 4.42 0.00 2.10 2.11 0.00 3.69 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 2.05 2.13 0.00 115 T 7.39 4.88 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 1.18 0.00 0.00 116 L 9.00 4.44 0.00 1.50 1.54 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.45 4.17 0.00 1.62 1.83 0.00 3.18 0.00 0.00 3.17 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.48 0.00 118 L 8.28 4.33 0.00 1.63 1.83 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.78 4.90 0.00 3.27 3.28 0.00 5.80 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.39 0.00 2.00 1.94 0.00 3.04 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.01 0.00 121 P 0.00 4.36 0.00 2.24 2.26 0.00 3.71 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 2.05 2.05 0.00 122 R 8.79 4.07 0.00 1.77 1.94 0.00 3.18 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 123 G 8.98 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 0.00 124 G 8.20 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 0.00 125 H 7.96 4.90 0.00 3.45 3.37 0.00 5.54 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.61 4.60 0.00 2.77 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 0.00 127 G 8.60 4.15 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 0.00 0.00 0.00 128 V 8.06 4.49 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 0.78 0.00 0.00 0.95 0.00 0.00 129 K 8.04 4.47 0.00 1.61 1.61 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.38 7.81 130 H 7.54 4.87 0.00 3.11 3.08 0.00 5.61 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 0.00 131 P 0.00 4.92 0.00 2.19 2.17 0.00 3.75 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 2.06 1.94 0.00 132 V 8.03 3.86 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 1.08 0.00 0.00 0.63 0.00 0.00 133 K 8.03 4.14 0.00 1.75 1.85 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.43 7.81 134 E 8.17 4.39 0.00 2.04 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 0.00 2.20 2.26 0.00 135 G 8.63 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 0.00 0.00 0.00 136 G 8.26 4.49 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 0.00 137 Q 8.52 4.75 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.85 0.00 0.00 0.00 0.00 0.00 2.21 2.37 0.00 138 L 7.81 4.38 0.00 1.61 1.52 0.86 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 139 G 9.08 4.14 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 0.00 0.00 0.00 140 K 8.01 3.04 0.00 1.17 1.44 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.65 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.09 0.79 7.81 141 H 8.39 4.94 0.00 2.80 3.08 0.00 5.73 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.36 4.57 0.00 2.60 2.66 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 0.00 0.00 0.00 0.00 143 T 8.43 4.30 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 1.32 0.00 0.00 144 E 8.16 4.06 0.00 2.02 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 0.00 2.53 2.37 0.00 145 G 7.87 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.09 3.65 2.04 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 1.38 1.84 0.93 0.00 0.00 147 D 8.25 4.37 0.00 2.90 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 0.00 148 D 8.24 4.35 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 0.00 149 L 7.92 3.98 0.00 1.78 1.78 0.96 0.67 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 0.00 150 L 8.02 4.00 0.00 1.66 1.73 0.91 0.83 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 0.00 151 E 8.42 4.11 0.00 2.15 1.99 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 2.32 2.32 0.00 152 A 8.19 4.21 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 0.00 0.00 153 M 7.75 4.71 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.56 0.00 154 R 7.68 4.09 0.00 1.92 2.17 0.00 3.07 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00