NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6199 8.2227 120.4780 54.2927 43.2313 173.0881 2 V 4.3447 7.8507 119.1637 61.8084 32.6421 173.7253 3 Q 4.6911 9.9995 126.7338 54.1729 33.3738 173.6208 4 L 5.2753 8.4736 121.5399 53.1957 46.1258 175.3856 5 Q 4.6403 8.4711 122.5204 55.0355 32.6279 173.6018 6 E 5.0421 8.9266 126.2554 56.3517 30.9027 175.8762 7 S 4.6094 9.1981 115.9592 57.1393 67.0067 173.5983 8 G 4.5939 8.7210 107.7369 42.2186 0.0000 171.1032 9 P 4.3403 0.0000 0.0000 62.9846 31.7370 176.3961 10 S 4.7304 8.5119 113.8626 58.6168 64.8634 173.0406 11 L 5.2266 7.6779 122.2256 53.6037 44.7338 175.5694 12 V 4.6193 8.7520 118.1064 59.6696 36.7133 174.6000 13 K 5.0822 8.9893 121.4231 53.4862 34.2369 175.0226 14 P 4.4772 0.0000 0.0000 64.2779 31.4585 177.0751 15 S 4.1585 9.5898 116.3271 58.1410 62.8151 169.0525 16 Q 4.3560 7.5659 117.5980 56.1420 31.0543 174.3496 17 T 4.8307 8.1361 115.7353 62.0859 69.9165 174.4890 18 L 4.3062 8.7108 129.7077 54.2819 43.5677 175.4456 19 S 5.0904 8.4291 121.4190 56.7325 66.1629 173.2927 20 L 4.9689 8.7113 123.8028 53.1231 45.7860 175.5314 21 T 5.2786 8.9464 117.1830 61.9927 72.5811 172.3636 22 C 5.0890 8.7306 125.1619 54.8957 40.5511 172.6539 23 S 4.7939 8.7659 123.5814 57.3665 64.2180 173.3921 24 V 4.6693 7.9729 124.9331 61.4001 33.0751 174.9674 25 T 4.5322 9.0484 124.4467 62.7966 71.3901 174.6413 26 G 4.5191 9.3322 112.5556 46.7380 0.0000 172.8269 27 D 4.4139 7.3252 115.9077 53.4025 44.0608 174.7808 28 S 4.4028 8.2091 117.4447 57.6629 63.0045 175.1646 29 I 4.0972 8.3050 120.1445 63.7653 37.4696 176.9824 30 T 4.2400 7.9857 110.0046 63.1617 68.6953 174.9407 31 S 4.7367 7.8278 118.1253 58.0154 63.1305 172.6860 32 D 4.2049 7.7061 118.4827 54.0602 43.6968 173.5939 33 Y 4.8186 7.4077 118.1002 56.1261 40.3054 175.1315 34 W 5.0729 9.0433 122.7780 54.8510 32.9294 174.6913 35 S 5.5083 9.1012 117.2850 56.5757 67.0833 172.4669 36 W 5.5044 9.1501 118.6934 55.1087 32.7682 175.0026 37 I 5.2801 9.3043 124.3686 59.5672 41.1843 174.5267 38 R 5.0379 8.9034 120.6564 54.2549 33.3397 173.7129 39 K 4.8214 8.7776 122.2045 54.7230 34.6816 175.9157 40 F 4.8459 9.0236 126.7514 56.0821 39.9101 174.7207 41 P 4.2627 0.0000 0.0000 66.0189 31.6934 177.5958 42 G 3.9541 8.2647 105.2806 45.4091 0.0000 173.3145 43 N 4.7078 8.2115 114.8512 54.0595 36.5490 173.7829 44 R 4.6701 7.4829 116.8856 54.8051 32.0423 174.6744 45 L 5.1179 8.6005 126.2036 53.4817 43.7842 175.5490 46 E 4.7506 9.0471 123.4690 54.5551 32.9919 173.7049 47 Y 4.4978 8.9221 128.6177 57.6027 38.9729 174.7784 48 M 4.4366 9.3818 128.0749 56.6151 33.5999 177.0158 49 G 5.0381 7.8883 104.2386 47.1952 0.0000 170.2922 50 Y 5.8704 8.3024 116.8594 55.8723 41.9502 174.0855 51 V 4.8945 9.3067 120.7773 60.1447 34.4000 175.6210 52 S 4.2715 8.6046 119.7890 56.1722 65.3411 174.6076 53 A 3.9909 7.9024 122.0190 55.4720 17.9467 178.8670 54 S 4.2041 7.7237 107.6818 59.2705 63.5049 175.0902 55 G 3.9650 7.9753 110.4018 44.7943 0.0000 174.0645 56 S 4.2680 7.5806 115.7652 58.4415 64.0965 173.5233 57 T 4.7297 7.8557 111.5231 59.9929 71.8295 172.7656 58 Y 4.2193 7.9799 119.7432 56.3862 41.3659 174.0032 59 Y 5.6274 8.3546 121.5168 55.8548 41.3076 175.1472 60 N 4.6168 9.3583 122.9390 53.1232 39.6458 174.2098 61 P 4.3720 0.0000 0.0000 65.5100 31.2003 178.6271 62 S 4.2347 8.6671 112.7805 60.9907 63.1174 175.6350 63 L 4.2877 8.3646 121.1553 54.0484 41.7032 176.6907 64 K 3.6572 8.9170 117.8340 57.7705 30.2354 174.7371 65 S 3.7713 8.0860 107.3133 59.9750 60.5943 173.5662 66 R 4.3136 7.8461 118.1814 56.2671 30.6940 175.8914 67 I 4.7541 7.1063 118.1576 59.4915 40.0423 174.6182 68 S 4.4914 8.6356 121.4662 56.7060 66.0426 172.4734 69 I 5.6948 9.3421 127.6941 59.0278 39.5271 174.9096 70 T 5.0349 8.9461 115.8198 60.0668 72.7796 172.6176 71 R 5.1912 8.6943 119.2721 54.6179 34.7051 175.1865 72 D 4.6667 9.1976 120.7059 52.8975 43.3321 176.1338 73 T 3.9256 8.7774 123.9895 66.5522 68.8793 177.1064 74 S 4.1384 8.2844 114.4507 60.9625 62.8699 175.0928 75 K 4.1949 8.5369 117.5305 55.3241 32.9825 175.5520 76 N 4.0972 7.9822 117.8999 54.5065 37.8195 172.5800 77 Q 4.8893 7.9089 115.4177 54.4281 34.2543 175.2384 78 Y 4.9036 7.9552 118.1680 55.5318 42.3084 173.4807 79 Y 5.6398 9.6783 116.9083 56.3419 43.1801 174.1553 80 L 4.9835 8.6859 121.7263 53.3961 45.2374 174.7113 81 D 5.2329 8.9809 125.7984 52.3056 44.4148 174.7241 82 L 4.9952 8.8637 124.9967 53.2709 44.7463 175.5959 83 N 4.6791 9.2691 124.5935 52.5009 39.5721 175.6173 84 S 3.7636 8.1503 113.8787 58.7802 60.4317 172.7867 85 V 4.0971 7.7518 115.3081 61.5841 32.6862 176.0529 86 T 4.9003 8.7382 111.5130 59.7044 71.9986 174.9327 87 T 4.1695 8.4043 110.5143 64.3288 68.5989 175.7852 88 E 4.1318 8.0411 120.8677 58.3737 29.5426 177.0519 89 D 4.9938 8.2951 117.9600 54.3203 41.2905 176.6804 90 T 4.1782 7.8676 117.4950 63.8675 68.7873 173.4377 91 A 4.3871 8.4632 126.7144 52.1469 23.9196 174.4818 92 T 4.7314 8.1548 116.0213 62.6441 70.1974 174.0954 93 Y 4.9917 9.0981 125.1973 56.7459 40.1552 174.5376 94 Y 5.5991 9.8222 121.1281 56.4073 42.4106 172.0510 95 C 4.9609 9.2770 116.7863 53.9068 45.9829 172.5076 96 A 4.9094 7.9544 120.0649 50.9302 22.6378 175.6604 97 N 4.6144 8.6874 117.6455 52.0126 38.5321 175.7861 98 W 4.0710 8.4017 130.5469 60.9434 30.5083 177.3121 99 D 4.0912 8.0917 118.0579 55.5226 40.4217 177.4414 100 G 3.8924 7.8471 106.0714 45.5769 0.0000 174.0326 101 D 4.3567 7.5578 119.9923 55.7125 41.4147 176.1900 102 Y 5.1005 7.5123 116.6916 55.9090 40.4221 174.5275 103 W 5.2542 8.9810 123.8717 54.6409 32.7011 175.7178 104 G 4.1351 9.0224 111.0814 44.6274 0.0000 173.5607 105 Q 4.2214 8.7596 115.8766 56.5932 29.2776 176.8252 106 G 3.7713 9.8227 105.4384 46.1234 0.0000 172.7949 107 T 4.5623 8.2371 115.3806 60.1110 71.0856 172.4482 108 L 4.6834 8.6236 131.3945 54.8596 43.2862 175.7880 109 V 4.5655 9.0972 126.2915 61.5075 34.4579 173.9594 110 T 4.8525 9.0593 125.3546 61.8927 70.8504 173.6668 111 V 4.7414 8.5491 127.1030 61.5795 32.6227 174.9245 112 S 4.7732 8.9423 121.7955 56.6213 65.7648 174.8137 113 A 4.1345 9.0137 127.9309 53.9381 18.5208 177.5365 114 A 4.3376 7.6082 123.1751 52.1245 19.2121 176.1662 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 D 8.22 4.62 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 2 V 7.85 4.34 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 0.00 0.00 0.56 0.00 0.00 0.69 0.00 0.00 3 Q 10.00 4.69 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.52 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 4 L 8.47 5.28 0.00 1.67 1.51 1.09 0.94 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 5 Q 8.47 4.64 0.00 2.12 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.94 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 6 E 8.93 5.04 0.00 1.95 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 2.59 2.46 0.00 7 S 9.20 4.61 0.00 3.85 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 8 G 8.72 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.34 0.00 2.13 2.02 0.00 3.83 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.88 0.00 10 S 8.51 4.73 0.00 3.99 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 11 L 7.68 5.23 0.00 1.58 1.51 0.97 0.87 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 12 V 8.75 4.62 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 0.67 0.00 0.00 0.95 0.00 0.00 13 K 8.99 5.08 0.00 1.64 1.70 0.00 1.69 0.00 0.00 1.98 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.38 7.81 14 P 0.00 4.48 0.00 2.03 1.99 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 15 S 9.59 4.16 0.00 3.98 4.03 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 16 Q 7.57 4.36 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.54 2.29 0.00 17 T 8.14 4.83 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 1.22 0.00 0.00 18 L 8.71 4.31 0.00 1.58 1.36 0.53 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.43 5.09 0.00 3.63 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 20 L 8.71 4.97 0.00 0.81 1.35 0.48 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.95 5.28 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 1.28 0.00 0.00 22 C 8.73 5.09 0.00 2.02 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.77 4.79 0.00 3.74 3.68 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 24 V 7.97 4.67 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 0.60 0.00 0.00 0.16 0.00 0.00 25 T 9.05 4.53 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 26 G 9.33 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 7.33 4.41 0.00 2.59 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.21 4.40 0.00 3.93 3.76 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 29 I 8.31 4.10 1.69 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.76 0.51 0.00 0.00 30 T 7.99 4.24 4.30 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 1.27 0.00 0.00 31 S 7.83 4.74 0.00 4.11 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 32 D 7.71 4.20 0.00 2.34 1.54 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 33 Y 7.41 4.82 0.00 2.59 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 34 W 9.04 5.07 0.00 2.42 1.74 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 35 S 9.10 5.51 0.00 4.09 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 36 W 9.15 5.50 0.00 3.47 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 37 I 9.30 5.28 2.04 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 -0.09 1.08 0.00 0.00 38 R 8.90 5.04 0.00 0.93 1.19 0.00 2.21 0.00 0.00 2.65 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.75 0.00 39 K 8.78 4.82 0.00 1.94 1.82 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.41 7.81 40 F 9.02 4.85 0.00 3.15 2.91 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 41 P 0.00 4.26 0.00 2.10 2.20 0.00 3.89 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 2.13 2.20 0.00 42 G 8.26 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 N 8.21 4.71 0.00 2.93 2.96 0.00 0.00 6.68 7.28 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 44 R 7.48 4.67 0.00 2.04 2.02 0.00 3.14 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.70 0.00 45 L 8.60 5.12 0.00 1.62 1.62 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.05 4.75 0.00 2.26 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 2.36 2.42 0.00 47 Y 8.92 4.50 0.00 3.17 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 48 M 9.38 4.44 0.00 2.24 2.52 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 2.61 0.00 49 G 7.89 5.04 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 50 Y 8.30 5.87 0.00 3.33 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 51 V 9.31 4.89 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.97 0.00 0.00 52 S 8.60 4.27 0.00 2.72 3.33 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 53 A 7.90 3.99 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 54 S 7.72 4.20 0.00 3.94 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 55 G 7.98 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 56 S 7.58 4.27 0.00 3.55 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 7.86 4.73 3.30 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 1.16 0.00 0.00 58 Y 7.98 4.22 0.00 1.94 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.35 5.63 0.00 2.90 2.79 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 60 N 9.36 4.62 0.00 3.25 2.88 0.00 0.00 7.07 8.13 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 61 P 0.00 4.37 0.00 2.26 2.16 0.00 3.76 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 62 S 8.67 4.23 0.00 4.09 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 63 L 8.36 4.29 0.00 1.87 1.76 1.08 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.92 3.66 0.00 1.86 1.86 0.00 1.90 0.00 0.00 1.89 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.62 1.55 7.81 65 S 8.09 3.77 0.00 4.03 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 7.85 4.31 0.00 1.92 2.03 0.00 3.34 0.00 0.00 3.10 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 67 I 7.11 4.75 1.74 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.79 0.43 0.00 0.00 68 S 8.64 4.49 0.00 3.83 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 69 I 9.34 5.69 2.31 0.00 0.00 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 1.37 2.32 1.43 0.00 0.00 70 T 8.95 5.03 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 1.33 0.00 0.00 71 R 8.69 5.19 0.00 1.75 1.88 0.00 3.25 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 72 D 9.20 4.67 0.00 2.99 2.70 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 0.00 0.00 0.00 0.00 73 T 8.78 3.93 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 1.24 0.00 0.00 74 S 8.28 4.14 0.00 3.99 4.03 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 75 K 8.54 4.19 0.00 1.83 1.93 0.00 1.99 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.54 7.81 76 N 7.98 4.10 0.00 2.82 2.70 0.00 0.00 6.86 6.65 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 77 Q 7.91 4.89 0.00 1.80 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.43 0.00 0.00 0.00 0.00 0.00 2.14 2.40 0.00 78 Y 7.96 4.90 0.00 3.11 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 79 Y 9.68 5.64 0.00 2.93 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 80 L 8.69 4.98 0.00 0.27 0.13 0.69 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.98 5.23 0.00 2.52 2.42 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 82 L 8.86 5.00 0.00 1.57 1.38 0.92 0.59 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 83 N 9.27 4.68 0.00 2.57 2.69 0.00 0.00 7.33 7.31 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 84 S 8.15 3.76 0.00 3.92 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 85 V 7.75 4.10 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 0.84 0.00 0.00 0.94 0.00 0.00 86 T 8.74 4.90 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 1.22 0.00 0.00 87 T 8.40 4.17 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 1.28 0.00 0.00 88 E 8.04 4.13 0.00 2.02 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 2.34 2.40 0.00 89 D 8.30 4.99 0.00 2.85 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 90 T 7.87 4.18 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 1.29 0.00 0.00 91 A 8.46 4.39 0.77 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 0.00 0.00 92 T 8.15 4.73 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 0.74 0.00 0.00 93 Y 9.10 4.99 0.00 2.89 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 94 Y 9.82 5.60 0.00 3.15 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 95 C 9.28 4.96 0.00 2.13 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.95 4.91 -0.29 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 97 N 8.69 4.61 0.00 2.15 2.79 0.00 0.00 6.85 8.19 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 98 W 8.40 4.07 0.00 3.19 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 99 D 8.09 4.09 0.00 2.68 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 0.00 100 G 7.85 3.89 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 0.00 101 D 7.56 4.36 0.00 1.69 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 0.00 0.00 0.00 102 Y 7.51 5.10 0.00 3.11 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 0.00 103 W 8.98 5.25 0.00 3.23 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 G 9.02 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 0.00 105 Q 8.76 4.22 0.00 2.25 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.50 2.40 0.00 106 G 9.82 3.77 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 0.00 0.00 0.00 107 T 8.24 4.56 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 1.29 0.00 0.00 108 L 8.62 4.68 0.00 1.68 1.56 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 109 V 9.10 4.57 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 0.81 0.00 0.00 0.75 0.00 0.00 110 T 9.06 4.85 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 1.23 0.00 0.00 111 V 8.55 4.74 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.00 0.00 0.00 112 S 8.94 4.77 0.00 3.91 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 9.01 4.13 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 0.00 114 A 7.61 4.34 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