NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3175 8.3044 120.3489 55.6712 33.2646 174.7866 2 H 4.4811 8.4815 124.6786 53.7985 31.1300 170.4298 3 L 4.3594 8.0067 127.4688 53.7031 43.4679 177.7141 4 T 4.0297 8.3838 113.9878 60.8214 70.8474 173.4687 5 P 4.1873 0.0000 0.0000 65.9044 31.2809 178.7834 6 E 4.0063 8.0629 115.6880 59.1710 29.6249 178.9106 7 E 3.9014 8.0837 119.8646 59.0803 29.4962 179.2587 8 K 3.8247 8.1681 118.7366 59.4213 32.0232 179.1744 9 S 4.0529 8.1927 113.1664 61.4879 62.3063 176.1954 10 A 3.9912 8.1867 123.4741 54.9123 18.0992 179.7922 11 V 3.3721 7.8921 116.8914 66.5153 31.6401 178.4529 12 T 3.9602 8.0253 115.2182 66.5393 68.0493 176.5867 13 A 4.0172 8.1314 121.9472 55.1495 18.6704 179.1639 14 L 3.8997 8.1596 118.9294 57.9936 42.1492 178.9790 15 W 4.2883 8.7585 128.5364 60.2496 30.4599 177.9171 16 G 3.7988 8.1603 104.6152 46.6985 0.0000 174.6501 17 K 4.3754 7.9114 119.0296 55.7597 32.9720 176.6752 18 V 3.7426 7.0088 120.2153 61.9328 32.1732 175.6574 19 N 4.5383 8.3521 125.2989 52.4015 39.0841 175.6370 20 V 3.5199 8.1165 128.4956 66.0749 31.7951 177.3019 21 D 4.3735 8.1100 118.1447 57.2496 40.7231 178.2619 22 E 3.8601 8.3627 119.6916 59.4328 29.7372 179.0755 23 V 3.6217 8.1014 118.7667 65.7091 31.4418 178.1698 24 G 3.7566 8.6389 106.1807 47.8439 0.0000 175.9277 25 G 3.6097 8.2256 108.6098 47.2555 0.0000 175.4645 26 E 3.8707 8.2726 121.4379 59.0235 29.6661 178.8224 27 A 3.9072 8.3537 121.2667 55.3802 18.5988 179.0438 28 Y 3.8008 8.4302 118.4542 60.4036 38.8370 178.1456 29 G 3.6096 8.3498 106.8920 47.9942 0.0000 175.9761 30 R 3.8892 8.2089 121.1162 58.4089 29.9630 178.7889 31 L 3.8872 7.9501 120.4617 58.4156 42.1852 179.2924 32 L 4.0399 7.5650 119.4143 56.7090 41.2123 179.8235 33 V 3.4997 7.3184 117.8196 65.9806 31.6931 178.0423 34 V 3.4947 7.7949 116.7954 64.2791 32.8018 175.5984 35 Y 3.7852 7.2556 115.9535 54.5725 37.7795 174.3060 36 P 4.8165 0.0000 0.0000 64.0512 32.0671 178.2844 37 W 4.3690 8.1215 116.7806 59.1583 27.8751 177.6213 38 T 4.1971 7.7238 110.7579 63.8851 68.1730 175.8715 39 Q 4.4467 8.2003 121.4143 57.7783 28.4606 178.1146 40 R 3.7022 7.5016 116.1928 58.6297 29.4283 177.6855 41 F 4.1533 7.2268 114.8345 58.0331 39.4365 175.6804 42 F 4.5544 7.7163 120.6870 56.8029 39.5099 177.3095 43 E 4.0477 8.3469 122.6628 59.1321 29.3669 178.2377 44 S 4.5848 8.0567 110.8460 58.9081 63.6276 174.4093 45 F 4.7748 8.4862 119.5756 57.7034 39.9461 176.8858 46 G 3.9938 8.0987 106.9970 44.8720 0.0000 174.4098 47 D 4.5445 8.6084 125.5150 54.1833 41.2200 175.8274 48 L 4.8966 8.3957 127.0074 54.5647 42.8040 177.8957 49 S 4.3813 8.5840 115.9345 60.3508 63.5993 174.3778 50 T 4.7337 7.3982 110.4514 58.3915 72.9305 172.6332 51 P 4.1944 0.0000 0.0000 66.0115 31.3722 178.7346 52 D 4.3127 8.0818 116.8827 57.2388 40.5416 178.5562 53 A 4.0027 8.0169 120.6268 54.9657 18.7641 179.5795 54 V 3.7031 8.0228 116.9158 66.6232 31.4684 178.2649 55 M 4.2047 8.2154 117.3392 57.8227 31.8759 178.1089 56 G 3.9737 7.8502 103.0648 43.7004 0.0000 173.2715 57 N 4.4714 7.5195 121.2193 52.6557 39.4820 173.8210 58 P 4.2125 0.0000 0.0000 65.6390 31.3672 178.8426 59 K 3.5643 8.0895 117.4315 58.9915 31.7203 179.5657 60 V 3.6595 7.8480 118.0593 66.1069 31.4955 178.1621 61 K 3.9392 8.2027 118.0206 59.2510 31.8406 179.2543 62 A 3.8950 8.1329 121.4193 55.0176 18.1766 179.4238 63 Q 3.8601 8.1397 118.2677 59.2758 29.0536 178.7268 64 G 3.4900 8.0357 106.9154 47.6861 0.0000 175.7441 65 K 3.9953 8.1937 120.9118 59.1254 32.1303 179.4133 66 K 3.9612 7.9674 119.8888 59.3302 32.1008 179.1068 67 V 3.6068 7.9273 118.7299 66.1486 31.6069 177.8671 68 L 4.3471 8.5128 120.2550 57.5443 41.9111 179.0085 69 G 3.7480 8.4698 106.1262 47.8387 0.0000 175.5934 70 A 4.1234 8.1546 123.3996 54.6624 18.1985 179.3329 71 F 4.1730 8.4032 118.3272 61.6287 39.8950 176.8233 72 S 4.1405 8.9586 112.9694 61.7955 62.3325 175.9732 73 D 4.5026 8.3751 121.5077 57.2860 40.4693 179.0226 74 G 3.4836 8.0150 106.0218 47.1869 0.0000 175.3119 75 L 3.8421 7.1695 119.3055 56.3625 41.6165 178.1422 76 A 4.2290 7.5233 119.4244 52.8733 19.0084 176.7460 77 H 4.9720 8.1310 115.5985 55.0235 29.9516 175.7960 78 L 3.9333 8.0693 120.8896 57.4704 41.7205 178.3645 79 D 4.5668 7.9152 115.9574 54.5833 40.3411 176.2654 80 N 4.9530 8.2143 120.5793 51.2077 39.5936 175.8703 81 L 4.0423 8.1028 120.7960 57.8667 41.9000 179.1402 82 K 4.1273 8.0320 117.1149 59.4182 32.2002 179.1979 83 G 3.6797 8.0753 105.5255 48.0615 0.0000 175.5798 84 T 3.6558 7.9157 114.7173 63.9362 67.5241 175.2369 85 F 4.7257 7.9192 117.3533 57.1388 39.2833 177.3889 86 A 4.0961 7.7434 123.0510 55.7227 18.2313 180.3456 87 T 4.0628 7.8533 113.7364 66.7147 68.5231 176.9732 88 L 4.1565 7.9736 120.6101 57.5069 41.6712 179.1503 89 S 4.4578 8.5474 115.0581 61.0640 62.3600 176.1181 90 E 3.9020 8.3416 121.1401 59.2849 29.1903 179.2141 91 L 3.9338 8.0545 120.3085 58.5895 42.1891 178.8401 92 H 4.2287 8.6345 116.3833 58.7098 28.3421 177.4415 93 C 3.4649 7.8796 120.6776 62.4573 31.1625 175.3961 94 D 4.4516 8.1957 119.6414 56.2145 40.5557 177.9051 95 K 4.3146 7.7410 116.4946 57.3776 34.1165 177.7091 96 L 4.1977 7.7799 116.9580 54.2792 42.4259 176.2184 97 H 4.0708 7.2404 114.9022 56.6573 26.6477 175.1691 98 V 4.0532 7.8888 118.9156 61.0778 32.2380 174.8585 99 D 4.3748 8.7925 127.4514 53.7700 41.6662 175.1927 100 P 3.2253 0.0000 0.0000 64.5988 31.8113 177.9617 101 E 3.9109 8.3919 119.0668 59.1215 29.2575 178.3482 102 N 4.2522 8.0717 116.8307 56.3198 38.4477 177.2314 103 F 4.4417 7.3757 119.1097 60.6605 38.9644 177.9846 104 R 3.9595 7.8695 117.3334 59.0794 29.9188 178.8506 105 L 3.7189 7.9153 118.8706 57.5739 41.5601 179.2757 106 L 3.9829 8.1323 120.4748 58.0271 41.9943 179.1578 107 G 3.6897 8.3211 105.8208 48.0961 0.0000 175.4431 108 N 4.4412 8.2623 119.0497 55.8088 38.4772 177.7495 109 V 3.6113 8.0258 119.8831 65.8448 31.5819 177.7780 110 L 3.8637 8.3504 120.4716 58.1093 41.9036 178.9850 111 V 3.6040 7.9406 118.1215 66.4158 31.4098 177.7403 112 C 4.0844 8.1230 116.2796 62.8432 27.8639 176.3763 113 V 3.4591 8.0963 120.2307 65.8215 31.0757 178.1121 114 L 3.8408 8.0601 119.0122 57.4360 41.3286 179.3386 115 A 3.6193 7.2072 120.6404 55.2224 18.1146 178.9960 116 H 3.9805 8.0983 115.7906 59.9837 29.9865 176.8463 117 H 4.1733 8.3675 116.8100 57.6737 28.8715 176.7562 118 F 4.7615 8.3412 117.8966 55.7354 40.1912 177.1162 119 G 3.7709 8.7642 108.0084 45.9026 0.0000 175.9507 120 K 3.8324 9.2080 123.3988 59.5429 31.7459 177.3676 121 E 4.1333 8.2138 116.7164 58.5240 30.0608 177.3794 122 F 4.5381 8.1427 123.9780 57.0620 37.9907 174.9782 123 T 4.1987 7.2165 115.3538 60.5426 71.4314 173.4921 124 P 4.1823 0.0000 0.0000 65.4899 31.2931 177.2930 125 P 4.2440 0.0000 0.0000 65.2627 31.2591 178.8849 126 V 3.5308 7.5002 116.9177 65.8284 31.4292 177.7487 127 Q 3.5168 7.8425 119.4582 59.1129 28.8408 178.2788 128 A 4.0593 8.0629 121.4213 54.9905 18.3821 179.4402 129 A 3.8572 8.0070 119.2722 55.7094 18.4459 179.6010 130 Y 3.9165 8.2878 115.1360 61.0297 37.8918 178.7047 131 Q 4.1280 8.8329 119.7234 58.8965 28.7564 178.8736 132 K 3.9643 8.0613 119.5118 59.4165 32.0556 179.6113 133 V 3.5000 7.7965 118.3780 66.1972 31.4211 178.6072 134 V 3.8975 8.3997 112.3694 64.1902 31.2421 178.4611 135 A 4.0981 8.2370 120.9288 55.1568 18.1965 179.9495 136 G 3.5023 8.3159 104.4245 47.7757 0.0000 176.1892 137 V 3.3347 8.2409 120.8206 65.6199 31.5649 177.9289 138 A 3.8437 8.1420 120.7549 55.1882 17.9919 179.0796 139 N 4.2296 8.2600 114.4974 56.7549 39.4402 176.6272 140 A 4.1656 8.1424 122.2613 55.2618 18.0110 179.6684 141 L 3.8996 8.1010 117.2948 57.0807 41.5913 178.7507 142 A 4.2899 7.8944 119.6841 53.4079 18.6817 178.6850 143 H 4.2863 8.0138 116.4555 58.6293 30.0306 175.8589 144 K 4.3816 8.1608 117.5488 56.3537 32.2796 176.5669 145 Y 4.1361 7.9970 117.6900 58.5817 38.4200 175.7944 146 H 4.4104 8.3222 116.9507 56.3129 28.0860 173.4922 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 4.32 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 2 H 8.48 4.48 0.00 3.12 3.17 0.00 5.97 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.01 4.36 0.00 1.56 1.48 0.80 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.38 4.03 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 1.22 0.00 0.00 5 P 0.00 4.19 0.00 2.15 2.13 0.00 3.57 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 6 E 8.06 4.01 0.00 2.14 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 2.33 2.32 0.00 7 E 8.08 3.90 0.00 2.20 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 2.28 2.30 0.00 8 K 8.17 3.82 0.00 1.87 1.79 0.00 1.62 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.57 7.81 9 S 8.19 4.05 0.00 3.87 4.05 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 10 A 8.19 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 11 V 7.89 3.37 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 0.65 0.00 0.00 0.43 0.00 0.00 12 T 8.03 3.96 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 1.25 0.00 0.00 13 A 8.13 4.02 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 14 L 8.16 3.90 0.00 1.85 1.95 0.29 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.76 4.29 0.00 3.86 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 16 G 8.16 3.80 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 0.00 0.00 0.00 17 K 7.91 4.38 0.00 1.92 2.09 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.60 7.81 18 V 7.01 3.74 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 0.00 0.00 -0.01 0.00 0.00 0.66 0.00 0.00 19 N 8.35 4.54 0.00 2.73 2.63 0.00 0.00 6.84 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.12 3.52 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 1.25 0.00 0.00 0.99 0.00 0.00 21 D 8.11 4.37 0.00 2.87 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 22 E 8.36 3.86 0.00 2.01 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 0.00 2.29 2.28 0.00 23 V 8.10 3.62 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 0.89 0.00 0.00 0.81 0.00 0.00 24 G 8.64 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 0.00 0.00 0.00 25 G 8.23 3.61 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 0.00 0.00 0.00 26 E 8.27 3.87 0.00 2.02 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 2.21 2.25 0.00 27 A 8.35 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 28 Y 8.43 3.80 0.00 3.25 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 29 G 8.35 3.61 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 0.00 0.00 0.00 30 R 8.21 3.89 0.00 1.83 1.90 0.00 3.05 0.00 0.00 3.00 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 31 L 7.95 3.89 0.00 1.63 1.53 0.84 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.57 4.04 0.00 1.89 1.68 0.78 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.32 3.50 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 0.70 0.00 0.00 0.93 0.00 0.00 34 V 7.79 3.49 1.56 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 -0.11 0.00 0.00 0.75 0.00 0.00 35 Y 7.26 3.79 0.00 2.58 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 36 P 0.00 4.82 0.00 2.32 2.28 0.00 3.77 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 2.21 1.89 0.00 37 W 8.12 4.37 0.00 3.53 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 38 T 7.72 4.20 4.29 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 0.99 0.00 0.00 39 Q 8.20 4.45 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 40 R 7.50 3.70 0.00 1.58 1.93 0.00 3.02 0.00 0.00 2.76 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.50 0.00 41 F 7.23 4.15 0.00 1.51 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 0.00 0.00 0.00 0.00 42 F 7.72 4.55 0.00 3.00 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 0.00 0.00 0.00 0.00 43 E 8.35 4.05 0.00 1.95 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 2.26 2.21 0.00 44 S 8.06 4.58 0.00 4.13 4.09 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 45 F 8.49 4.77 0.00 3.26 3.18 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 46 G 8.10 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.61 4.54 0.00 2.66 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 48 L 8.40 4.90 0.00 1.68 1.65 1.04 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.58 4.38 0.00 4.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.40 4.73 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 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.15 2.11 0.00 3.58 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 2.09 2.15 0.00 52 D 8.08 4.31 0.00 2.67 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 53 A 8.02 4.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.02 3.70 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 1.08 0.00 0.00 0.97 0.00 0.00 55 M 8.22 4.20 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.86 0.00 56 G 7.85 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 57 N 7.52 4.47 0.00 3.02 2.86 0.00 0.00 7.12 7.49 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 58 P 0.00 4.21 0.00 2.12 2.03 0.00 3.61 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 2.08 2.14 0.00 59 K 8.09 3.56 0.00 1.49 0.74 0.00 1.57 0.00 0.00 1.42 0.00 0.00 2.57 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.10 1.22 7.81 60 V 7.85 3.66 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 1.28 0.00 0.00 1.13 0.00 0.00 61 K 8.20 3.94 0.00 1.79 1.80 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.55 7.81 62 A 8.13 3.90 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 63 Q 8.14 3.86 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 1.84 1.23 0.00 64 G 8.04 3.49 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 65 K 8.19 4.00 0.00 1.96 1.87 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.65 7.81 66 K 7.97 3.96 0.00 1.84 2.03 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.47 7.81 67 V 7.93 3.61 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 1.12 0.00 0.00 0.94 0.00 0.00 68 L 8.51 4.35 0.00 1.97 1.80 0.87 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.47 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 0.00 0.00 0.00 70 A 8.15 4.12 1.56 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 71 F 8.40 4.17 0.00 3.08 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 72 S 8.96 4.14 0.00 4.58 4.31 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 73 D 8.38 4.50 0.00 2.88 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 74 G 8.02 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.17 3.84 0.00 1.44 1.40 -0.51 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.52 4.23 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 77 H 8.13 4.97 0.00 3.20 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.07 3.93 0.00 1.54 1.64 0.77 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.92 4.57 0.00 2.76 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 80 N 8.21 4.95 0.00 2.73 2.68 0.00 0.00 7.09 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.10 4.04 0.00 1.76 1.84 0.91 0.87 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 82 K 8.03 4.13 0.00 1.66 1.76 0.00 1.66 0.00 0.00 1.42 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.47 7.81 83 G 8.08 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 0.00 0.00 0.00 84 T 7.92 3.66 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 85 F 7.92 4.73 0.00 3.24 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 86 A 7.74 4.10 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 87 T 7.85 4.06 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 88 L 7.97 4.16 0.00 2.02 1.84 1.15 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.55 4.46 0.00 4.17 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 90 E 8.34 3.90 0.00 2.21 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 2.33 2.52 0.00 91 L 8.05 3.93 0.00 1.79 1.89 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.63 4.23 0.00 3.63 3.79 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.88 3.46 0.00 1.23 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 0.00 0.00 0.00 0.00 94 D 8.20 4.45 0.00 2.71 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 95 K 7.74 4.31 0.00 1.73 1.77 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.40 7.81 96 L 7.78 4.20 0.00 1.65 1.56 0.66 0.87 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 97 H 7.24 4.07 0.00 3.41 3.46 0.00 5.84 0.00 0.00 0.00 0.00 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.89 4.05 2.13 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 0.34 0.00 0.00 0.38 0.00 0.00 99 D 8.79 4.37 0.00 2.77 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 0.00 100 P 0.00 3.23 0.00 1.96 1.95 0.00 3.36 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.68 0.00 101 E 8.39 3.91 0.00 2.03 1.91 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 2.32 2.40 0.00 102 N 8.07 4.25 0.00 2.56 2.76 0.00 0.00 6.89 7.67 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 0.00 103 F 7.38 4.44 0.00 3.13 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.87 3.96 0.00 1.95 1.96 0.00 3.31 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 105 L 7.92 3.72 0.00 1.61 1.15 0.72 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.13 3.98 0.00 1.72 1.85 0.87 1.04 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 0.00 107 G 8.32 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 N 8.26 4.44 0.00 2.92 2.93 0.00 0.00 6.69 7.39 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 0.00 109 V 8.03 3.61 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 1.05 0.00 0.00 1.13 0.00 0.00 110 L 8.35 3.86 0.00 1.70 1.76 0.93 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.94 3.60 2.32 0.00 0.00 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 1.19 0.00 0.00 112 C 8.12 4.08 0.00 3.17 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 0.00 113 V 8.10 3.46 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 0.86 0.00 0.00 0.83 0.00 0.00 114 L 8.06 3.84 0.00 1.02 1.13 0.65 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.21 3.62 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.10 3.98 0.00 3.06 3.48 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.37 4.17 0.00 2.77 2.57 0.00 5.88 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.34 4.76 0.00 3.28 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.76 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 0.00 120 K 9.21 3.83 0.00 1.74 1.94 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.60 7.81 121 E 8.21 4.13 0.00 2.39 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 0.00 2.40 2.33 0.00 122 F 8.14 4.54 0.00 3.03 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.22 4.20 4.21 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 1.28 0.00 0.00 124 P 0.00 4.18 0.00 2.16 2.14 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 125 P 0.00 4.24 0.00 2.11 2.06 0.00 3.55 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 2.08 2.11 0.00 126 V 7.50 3.53 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 0.96 0.00 0.00 0.90 0.00 0.00 127 Q 7.84 3.52 0.00 1.70 2.10 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 2.42 2.59 0.00 128 A 8.06 4.06 1.35 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 0.00 0.00 129 A 8.01 3.86 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 0.00 130 Y 8.29 3.92 0.00 3.26 3.31 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 0.00 131 Q 8.83 4.13 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.76 2.62 0.00 132 K 8.06 3.96 0.00 1.98 1.83 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.60 7.81 133 V 7.80 3.50 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 0.93 0.00 0.00 0.75 0.00 0.00 134 V 8.40 3.90 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 0.99 0.00 0.00 1.17 0.00 0.00 135 A 8.24 4.10 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 0.00 136 G 8.32 3.50 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 0.00 0.00 0.00 137 V 8.24 3.33 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 0.58 0.00 0.00 0.79 0.00 0.00 138 A 8.14 3.84 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 0.00 0.00 139 N 8.26 4.23 0.00 2.77 3.01 0.00 0.00 7.24 8.31 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 0.00 140 A 8.14 4.17 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 8.10 3.90 0.00 1.04 0.65 -0.09 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.89 4.29 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 0.00 143 H 8.01 4.29 0.00 3.40 3.57 0.00 5.75 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.16 4.38 0.00 1.86 1.85 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.74 7.81 145 Y 8.00 4.14 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 0.00 146 H 8.32 4.41 0.00 3.22 3.25 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00