NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8515 8.3549 109.7318 45.4697 0.0000 172.8180 2 L 4.2780 7.8922 125.5208 51.1483 43.3482 176.0659 3 S 4.5040 9.5242 118.7354 57.8692 66.1594 174.9662 4 D 4.6427 8.7500 121.9660 57.6394 40.5606 179.3351 5 G 3.6644 8.1126 105.6206 47.8527 0.0000 175.4465 6 E 3.9309 8.2549 120.9754 58.9626 29.4759 179.4168 7 W 4.3867 8.2858 119.1951 59.8945 29.0822 178.2939 8 Q 4.0709 8.5027 119.5819 59.2272 28.3977 178.1830 9 Q 3.9917 8.2520 120.6034 59.0983 29.0762 178.1831 10 V 3.6907 8.0989 119.4954 66.3549 31.3814 177.9992 11 L 4.2572 8.0966 116.7163 57.0892 41.6578 178.7265 12 N 4.4929 8.4575 117.6871 56.6872 38.9781 176.8994 13 V 3.5929 8.1399 119.9460 65.9594 31.5547 177.7543 14 W 4.1919 8.6882 128.1282 60.2725 30.2367 177.9036 15 G 3.7030 7.7636 105.3454 47.7045 0.0000 175.4173 16 K 3.9517 7.8611 120.4405 59.3119 32.0669 179.5135 17 V 2.6747 6.9036 117.7805 65.7270 31.0902 177.7463 18 E 3.8520 7.5385 116.5640 58.7581 29.2754 178.7778 19 A 4.1939 7.3110 119.7272 53.8813 19.8679 177.6668 20 D 4.6668 7.6969 116.4707 52.2367 42.6903 175.2257 21 I 3.6124 7.8012 123.3842 63.7115 38.4930 176.6904 22 A 4.1552 7.3975 122.6810 54.4074 18.3215 179.6975 23 G 3.5967 8.1763 105.5762 47.7698 0.0000 175.6505 24 H 4.1359 8.3138 119.3309 58.2979 28.6899 178.1433 25 G 3.5572 8.3575 107.8577 47.7543 0.0000 175.3529 26 Q 3.8430 8.3160 122.6634 59.0705 29.0142 178.4580 27 E 3.8665 8.1334 119.4417 59.1332 29.3459 179.5260 28 V 3.5093 7.9226 118.5472 66.0544 31.5922 178.1826 29 L 3.3974 7.6558 118.6612 57.5189 41.2502 179.5791 30 I 3.6192 7.6851 119.9565 64.1638 37.0278 178.3598 31 R 3.7804 8.0410 119.7411 59.2544 29.8847 178.2755 32 L 3.9488 7.8475 120.0829 58.3998 41.7641 179.0760 33 F 4.6169 8.2484 118.3748 60.6418 38.5887 177.8704 34 T 4.0985 8.1345 109.1955 64.5638 68.9176 176.9784 35 G 3.6168 7.9763 107.6032 46.3328 0.0000 173.7016 36 H 4.7763 7.9578 117.6244 52.1062 29.6942 171.9353 37 P 4.4667 0.0000 0.0000 64.4425 31.3511 177.5047 38 E 4.0859 8.2928 116.4684 59.5828 29.3618 179.2009 39 T 3.8756 8.2424 111.2423 64.4968 68.8521 176.2492 40 L 3.5179 7.8227 123.1660 57.9579 41.7847 178.6745 41 E 4.1694 7.8934 117.1410 58.4673 29.4697 178.6883 42 K 4.4668 8.1302 117.4612 56.9504 32.7739 177.3383 43 F 4.5954 8.1218 118.9832 55.4004 39.2685 175.4324 44 D 4.4160 8.6042 125.2202 57.1506 40.8825 179.1733 45 K 3.8438 7.8418 115.4623 58.0232 33.1271 177.0982 46 F 5.0306 7.9170 117.4369 57.0172 40.2850 176.9273 47 K 3.9363 7.6225 122.1159 59.1604 32.0356 177.3691 48 H 4.3882 8.1222 112.6804 57.2953 28.8573 175.8067 49 L 4.1665 7.3829 120.6645 54.3356 39.6669 176.5850 50 K 4.2648 8.9982 123.0490 57.3198 32.9870 177.8701 51 T 4.7353 7.4853 108.7048 58.8465 73.2429 174.1360 52 E 3.9118 8.7084 121.8529 59.2670 29.6422 178.8418 53 A 3.9800 7.9797 120.4473 55.3412 18.2461 179.2947 54 E 3.9351 8.0038 115.6578 59.6859 29.9270 179.1546 55 M 4.1336 7.9602 118.7341 58.4378 31.8639 178.8263 56 K 3.9426 8.3225 118.4027 58.9448 32.4534 177.8015 57 A 4.5071 7.7363 118.5290 51.4409 19.0708 176.9764 58 S 4.3550 7.5245 113.5857 57.4386 62.5372 174.7009 59 E 4.0436 8.8011 128.7421 59.2785 29.2120 178.6698 60 D 4.4506 8.1709 117.9899 57.0210 41.2889 177.8094 61 L 3.7490 8.1422 121.2319 57.8192 42.0431 178.8582 62 K 3.8762 7.8416 119.7844 59.2080 32.1239 178.5179 63 K 3.9130 8.2614 120.0056 60.0572 32.0620 178.2238 64 H 4.3834 8.7917 118.6806 59.1281 29.8025 177.2667 65 G 3.6631 8.4849 107.9847 48.1717 0.0000 175.7459 66 T 3.8985 8.0445 118.0228 66.3102 68.4728 176.8729 67 V 3.7044 7.7860 120.1439 65.9823 31.5317 178.2709 68 V 3.6022 8.0284 118.1559 66.2137 31.3976 178.0906 69 L 4.2691 8.1485 118.5362 57.7997 41.4379 179.6267 70 T 4.0010 8.2684 115.9645 66.4374 68.3657 176.4784 71 A 3.9825 8.0631 122.7093 55.1657 18.4036 179.4189 72 L 3.7250 8.1496 119.0533 58.1162 42.0912 179.3859 73 G 3.0510 8.4829 106.1726 47.4503 0.0000 175.8752 74 G 3.5954 7.8148 107.1617 47.5226 0.0000 175.5779 75 I 3.8466 7.5819 122.1918 64.1831 37.1618 178.5494 76 L 3.9775 7.8534 120.1147 57.6333 41.1750 179.4320 77 K 4.0127 7.6032 116.5767 58.0734 32.3240 178.6507 78 K 3.9520 7.8026 118.5555 55.9764 32.5800 176.5614 79 K 2.0000 8.2492 118.1596 56.3523 29.7325 175.9012 80 G 3.9102 7.8682 106.2478 45.7487 0.0000 173.9308 81 H 4.5687 7.2992 119.1941 55.2383 27.3651 174.8202 82 H 5.3936 7.3732 110.8169 53.8876 29.9443 175.7951 83 E 3.9284 8.6208 122.5001 60.2404 29.0301 178.7299 84 A 4.0163 7.8974 118.6850 55.0678 18.7378 178.9873 85 E 4.0918 8.1110 116.8574 59.2678 29.6425 178.9000 86 L 4.0682 8.3506 120.7244 57.3576 42.1709 178.3305 87 K 3.8126 8.2173 120.2534 59.3632 32.0159 176.8554 88 P 4.2741 0.0000 0.0000 65.7730 31.0858 178.3425 89 L 4.0670 7.9059 118.1689 57.4929 41.6360 178.9227 90 A 4.1218 8.1974 120.8716 55.4302 18.2602 179.7897 91 Q 3.8662 8.3072 116.8408 59.0055 28.7021 179.0990 92 S 3.9817 8.4916 115.8259 61.7835 63.1212 176.3178 93 H 4.1155 8.7359 119.9613 58.1288 28.2069 177.7374 94 A 2.5800 7.7028 122.0598 54.5809 18.2567 179.1730 95 T 3.8862 7.4409 112.5374 65.0173 69.1026 176.2243 96 K 4.0801 7.4102 119.8186 58.7802 32.8238 177.2065 97 H 4.3417 7.8717 113.8740 55.9756 29.4116 175.3572 98 K 3.5317 7.4904 117.1143 57.2567 28.8237 176.4321 99 I 4.2826 7.9516 119.4493 58.9949 38.0550 175.0767 100 P 4.5906 0.0000 0.0000 62.2421 31.9979 177.6304 101 I 3.5124 8.5662 120.8082 63.9584 37.7185 177.9498 102 K 3.5858 8.0221 120.2055 59.9364 31.8325 178.0681 103 Y 4.1272 7.9756 116.5763 60.7990 37.7301 178.2926 104 L 4.1922 7.8278 119.8400 57.3795 41.7647 178.7884 105 E 3.9444 8.0466 119.5234 59.3041 29.5895 178.7380 106 F 4.5209 7.9348 117.8132 60.9891 39.0534 177.6441 107 I 3.8647 8.1919 117.9442 63.8672 37.7399 178.1546 108 S 4.2127 8.2732 116.3909 61.7900 62.7103 176.3167 109 D 4.4747 8.4506 121.3512 57.3233 40.4454 178.7157 110 A 4.0598 8.2579 121.3853 55.1195 18.3209 179.7001 111 I 3.6619 7.9486 118.2917 64.6547 37.3491 178.6673 112 I 3.8543 7.6898 120.1089 64.6568 36.8745 177.9474 113 H 4.1913 8.4745 119.0529 59.4266 29.6555 177.5188 114 V 3.5132 8.1584 120.3096 65.7883 31.3378 177.9218 115 L 3.8085 7.9713 118.8653 58.1640 41.4719 179.3005 116 H 4.3936 8.1371 115.7554 58.8760 28.3991 177.8841 117 S 4.1486 8.0673 114.5859 61.0152 62.3043 175.7803 118 K 4.1272 8.1259 119.8893 57.4735 33.2352 176.6022 119 H 4.9589 8.0067 116.2479 53.8362 29.4378 171.9045 120 P 4.5930 0.0000 0.0000 63.5617 31.9985 177.4932 121 G 3.9848 9.1643 110.5418 45.6731 0.0000 172.9737 122 D 4.9503 8.4228 117.7985 53.6655 41.6504 175.9191 123 F 4.9863 8.0280 120.2204 55.0664 39.3850 174.9487 124 G 3.8247 8.0891 112.7466 43.3668 0.0000 170.8952 125 A 3.8878 8.3393 121.8869 54.9427 18.2767 179.6220 126 D 4.2283 7.9981 116.9855 56.5667 39.3887 178.5304 127 A 3.9722 7.8105 121.8585 54.8131 18.3917 179.1878 128 Q 3.5759 7.8803 118.5358 58.9203 29.0408 178.5792 129 G 3.5714 7.9944 106.4939 47.8102 0.0000 175.4920 130 A 3.8671 8.0586 123.7802 54.9327 18.4056 179.4065 131 M 4.0386 8.3933 117.0702 59.0248 32.2343 178.4792 132 T 3.9016 8.2437 116.1734 66.6690 68.6196 176.6271 133 K 4.0175 8.0994 120.0427 59.4563 32.0571 179.2772 134 A 3.8393 7.9604 120.9435 55.1251 18.2232 179.7534 135 L 4.0861 8.1897 117.6258 57.8587 41.6339 179.5555 136 E 3.9928 8.6039 119.1078 59.1953 29.3545 179.1020 137 L 3.9735 8.1732 120.4981 58.0131 42.1413 178.5064 138 F 4.1671 8.3817 120.5828 61.6747 39.2929 177.2476 139 R 3.6136 8.3096 117.4803 59.2514 29.8678 178.6367 140 N 4.2742 8.5276 117.1358 56.8156 38.8320 176.7343 141 D 4.3613 8.2523 120.3757 57.1568 40.8352 178.7567 142 I 3.4842 7.6202 120.2868 64.2346 36.9468 178.1924 143 A 3.7702 8.1782 121.7074 55.0649 18.1243 179.4741 144 A 3.9370 7.9572 119.1932 55.3491 18.4660 180.0958 145 K 4.0046 7.8867 117.1161 59.7151 32.0376 179.1374 146 Y 4.1748 8.5778 117.5454 61.0258 37.8092 178.7074 147 K 3.9518 8.5051 120.7157 59.4465 32.1003 178.1008 148 E 3.9435 7.9083 118.4226 59.5180 29.6211 178.3599 149 L 4.3330 7.8373 115.3137 54.3312 41.9539 177.2231 150 G 3.8666 7.8547 106.9261 46.3326 0.0000 173.0901 151 F 4.4383 8.4805 122.2051 57.2495 40.4071 175.7005 152 Q 3.3508 7.8238 125.6143 56.3924 28.6752 173.4898 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 G 8.35 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 2 L 7.89 4.28 0.00 0.51 0.72 0.50 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.52 4.50 0.00 4.05 3.98 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 4 D 8.75 4.64 0.00 2.77 2.84 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 5 G 8.11 3.66 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 0.00 0.00 0.00 6 E 8.25 3.93 0.00 2.05 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 7 W 8.29 4.39 0.00 3.51 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 8 Q 8.50 4.07 0.00 2.30 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 9 Q 8.25 3.99 0.00 2.36 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.54 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 10 V 8.10 3.69 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 1.14 0.00 0.00 0.88 0.00 0.00 11 L 8.10 4.26 0.00 1.77 1.81 0.92 0.98 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 12 N 8.46 4.49 0.00 2.94 3.01 0.00 0.00 6.65 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 13 V 8.14 3.59 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 0.84 0.00 0.00 1.18 0.00 0.00 14 W 8.69 4.19 0.00 3.61 3.25 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 15 G 7.76 3.70 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 0.00 0.00 0.00 16 K 7.86 3.95 0.00 1.64 1.46 0.00 1.44 0.00 0.00 0.98 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.25 1.29 7.81 17 V 6.90 2.67 0.67 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 0.10 0.00 0.00 0.16 0.00 0.00 18 E 7.54 3.85 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.14 0.00 19 A 7.31 4.19 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 20 D 7.70 4.67 0.00 2.71 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 21 I 7.80 3.61 1.79 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.26 0.89 0.00 0.00 22 A 7.40 4.16 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 23 G 8.18 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 24 H 8.31 4.14 0.00 3.08 3.22 0.00 5.82 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 25 G 8.36 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 26 Q 8.32 3.84 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 E 8.13 3.87 0.00 1.97 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 2.25 2.39 0.00 28 V 7.92 3.51 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 1.08 0.00 0.00 0.95 0.00 0.00 29 L 7.66 3.40 0.00 1.48 0.76 0.82 0.67 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 30 I 7.69 3.62 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.62 0.87 0.00 0.00 31 R 8.04 3.78 0.00 1.93 2.10 0.00 3.03 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 32 L 7.85 3.95 0.00 1.77 1.45 1.08 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.25 4.62 0.00 2.97 2.85 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 34 T 8.13 4.10 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 1.23 0.00 0.00 35 G 7.98 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 0.00 0.00 0.00 36 H 7.96 4.78 0.00 3.08 2.95 0.00 5.64 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 37 P 0.00 4.47 0.00 2.15 2.10 0.00 3.84 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 2.09 1.98 0.00 38 E 8.29 4.09 0.00 2.30 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 2.18 2.54 0.00 39 T 8.24 3.88 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 40 L 7.82 3.52 0.00 1.42 1.72 -0.15 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.89 4.17 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 42 K 8.13 4.47 0.00 1.96 1.77 0.00 1.93 0.00 0.00 1.80 0.00 0.00 3.22 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.77 2.00 7.81 43 F 8.12 4.60 0.00 3.28 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 44 D 8.60 4.42 0.00 2.67 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 45 K 7.84 3.84 0.00 1.58 1.73 0.00 1.35 0.00 0.00 1.49 0.00 0.00 2.82 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.86 0.21 7.81 46 F 7.92 5.03 0.00 2.80 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 47 K 7.62 3.94 0.00 1.74 1.87 0.00 1.82 0.00 0.00 1.80 0.00 0.00 3.04 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.46 1.60 7.81 48 H 8.12 4.39 0.00 3.30 3.44 0.00 5.77 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.38 4.17 0.00 1.62 1.60 0.81 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.00 4.26 0.00 1.86 1.85 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.51 7.81 51 T 7.49 4.74 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 1.20 0.00 0.00 52 E 8.71 3.91 0.00 2.04 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 2.35 2.36 0.00 53 A 7.98 3.98 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 54 E 8.00 3.94 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 55 M 7.96 4.13 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.52 0.00 56 K 8.32 3.94 0.00 1.77 1.93 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.47 7.81 57 A 7.74 4.51 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 58 S 7.52 4.35 0.00 4.06 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 59 E 8.80 4.04 0.00 2.06 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 2.42 2.32 0.00 60 D 8.17 4.45 0.00 2.90 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.14 3.75 0.00 1.44 1.67 0.68 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.84 3.88 0.00 1.81 2.00 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.57 7.81 63 K 8.26 3.91 0.00 2.03 2.13 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.51 7.81 64 H 8.79 4.38 0.00 3.65 3.58 0.00 5.85 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 65 G 8.48 3.66 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 0.00 0.00 0.00 66 T 8.04 3.90 4.45 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 1.23 0.00 0.00 67 V 7.79 3.70 2.21 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 1.05 0.00 0.00 1.02 0.00 0.00 68 V 8.03 3.60 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.98 0.00 0.00 69 L 8.15 4.27 0.00 1.87 1.85 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.27 4.00 4.46 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 1.26 0.00 0.00 71 A 8.06 3.98 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 72 L 8.15 3.72 0.00 1.60 1.77 0.06 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.48 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 0.00 0.00 0.00 74 G 7.81 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 75 I 7.58 3.85 1.90 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.78 0.96 0.00 0.00 76 L 7.85 3.98 0.00 1.24 1.53 0.04 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.60 4.01 0.00 1.63 1.77 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.43 7.81 78 K 7.80 3.95 0.00 1.83 1.81 0.00 1.77 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.60 1.74 7.81 79 K 8.25 2.00 0.00 1.19 0.74 0.00 1.37 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.42 0.98 7.81 80 G 7.87 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 0.00 0.00 0.00 81 H 7.30 4.57 0.00 3.16 3.22 0.00 5.79 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 82 H 7.37 5.39 0.00 3.26 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.62 3.93 0.00 2.12 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 0.00 2.39 2.47 0.00 84 A 7.90 4.02 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 85 E 8.11 4.09 0.00 2.24 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 86 L 8.35 4.07 0.00 1.76 1.68 0.70 0.56 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 87 K 8.22 3.81 0.00 2.04 1.82 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.48 7.81 88 P 0.00 4.27 0.00 2.33 2.31 0.00 3.71 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 2.22 2.08 0.00 89 L 7.91 4.07 0.00 1.90 1.77 1.03 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.20 4.12 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 91 Q 8.31 3.87 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.55 0.00 92 S 8.49 3.98 0.00 3.90 4.17 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 93 H 8.74 4.12 0.00 3.48 3.55 0.00 5.81 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 94 A 7.70 2.58 0.22 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 0.00 0.00 95 T 7.44 3.89 4.16 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 1.10 0.00 0.00 96 K 7.41 4.08 0.00 1.52 1.59 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.24 1.35 7.81 97 H 7.87 4.34 0.00 3.02 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.49 3.53 0.00 1.95 2.02 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.39 7.81 99 I 7.95 4.28 2.07 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.94 1.16 0.00 0.00 100 P 0.00 4.59 0.00 1.71 1.73 0.00 2.37 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.80 0.00 101 I 8.57 3.51 1.65 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.07 0.87 0.00 0.00 102 K 8.02 3.59 0.00 1.76 1.65 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 0.64 7.81 103 Y 7.98 4.13 0.00 3.20 3.09 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 0.00 104 L 7.83 4.19 0.00 1.80 1.75 0.64 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.05 3.94 0.00 1.98 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 2.39 2.39 0.00 106 F 7.93 4.52 0.00 3.27 2.85 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 0.00 107 I 8.19 3.86 2.03 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 1.59 1.40 1.12 0.00 0.00 108 S 8.27 4.21 0.00 4.20 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 0.00 109 D 8.45 4.47 0.00 2.99 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 A 8.26 4.06 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 0.00 111 I 7.95 3.66 2.11 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.75 0.99 0.00 0.00 112 I 7.69 3.85 2.14 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.54 1.15 0.00 0.00 113 H 8.47 4.19 0.00 3.31 3.52 0.00 5.78 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.16 3.51 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.02 0.00 0.00 115 L 7.97 3.81 0.00 1.25 0.48 0.47 0.58 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 0.00 116 H 8.14 4.39 0.00 3.42 3.38 0.00 5.62 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 0.00 117 S 8.07 4.15 0.00 3.70 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 0.00 118 K 8.13 4.13 0.00 1.60 1.46 0.00 1.64 0.00 0.00 1.27 0.00 0.00 2.51 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.26 1.45 7.81 119 H 8.01 4.96 0.00 3.24 3.19 0.00 5.62 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 4.59 0.00 2.19 2.15 0.00 3.47 0.00 0.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.91 0.00 121 G 9.16 3.98 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 0.00 0.00 0.00 122 D 8.42 4.95 0.00 2.62 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 0.00 123 F 8.03 4.99 0.00 2.78 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 0.00 124 G 8.09 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.34 3.89 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 0.00 126 D 8.00 4.23 0.00 2.93 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 0.00 127 A 7.81 3.97 1.50 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 0.00 128 Q 7.88 3.58 0.00 1.22 1.79 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 2.26 2.27 0.00 129 G 7.99 3.57 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 0.00 0.00 0.00 130 A 8.06 3.87 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 0.00 131 M 8.39 4.04 0.00 2.41 2.31 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.80 0.00 132 T 8.24 3.90 4.41 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 1.25 0.00 0.00 133 K 8.10 4.02 0.00 1.81 1.67 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.53 7.81 134 A 7.96 3.84 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 0.00 135 L 8.19 4.09 0.00 1.89 1.81 1.00 0.70 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 0.00 136 E 8.60 3.99 0.00 2.20 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 2.44 0.00 137 L 8.17 3.97 0.00 1.88 1.97 0.99 0.98 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 0.00 138 F 8.38 4.17 0.00 3.13 3.26 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 0.00 139 R 8.31 3.61 0.00 2.07 1.90 0.00 3.14 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 1.90 0.00 140 N 8.53 4.27 0.00 2.90 2.93 0.00 0.00 7.27 8.10 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 0.00 141 D 8.25 4.36 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 I 7.62 3.48 1.47 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.13 0.30 0.00 0.00 143 A 8.18 3.77 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.96 3.94 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 0.00 145 K 7.89 4.00 0.00 1.95 1.92 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.62 7.81 146 Y 8.58 4.17 0.00 3.11 3.26 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 0.00 147 K 8.51 3.95 0.00 1.85 1.99 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.91 3.94 0.00 2.04 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 2.34 2.38 0.00 149 L 7.84 4.33 0.00 1.77 1.64 0.85 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.85 3.87 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 0.00 0.00 0.00 151 F 8.48 4.44 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 7.82 3.35 0.00 1.91 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.42 0.00 0.00 0.00 0.00 0.00 1.16 1.72 0.00