NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4352 8.3044 120.3658 54.8769 33.4844 174.9653 2 T 3.6768 7.7575 116.5729 63.4935 71.5284 170.2288 3 H 4.4489 8.8303 115.3666 55.5177 31.7189 171.6804 4 D 4.4960 8.5134 123.8659 54.1840 42.0540 175.6249 5 N 4.8138 8.4578 124.9751 55.2622 38.4032 174.8463 6 K 4.4186 9.8602 118.5254 55.9340 31.5577 175.2439 7 L 4.6081 7.1858 115.6459 53.4394 45.2381 174.1904 8 Q 4.2627 8.5325 118.3825 55.3683 28.8918 175.0740 9 V 4.5536 8.0872 124.4938 60.8358 34.2350 173.8163 10 E 4.7688 8.3122 116.7884 54.1592 32.7585 175.6192 11 A 4.3145 8.4046 124.1718 52.2135 18.9081 177.4257 12 I 4.5033 8.0131 114.1534 59.4918 40.6834 175.3616 13 K 2.0000 7.8360 123.4363 57.5391 32.6037 176.1507 14 R 4.7447 7.9676 117.8660 54.3806 33.5431 173.1651 15 G 3.8002 7.8902 108.5634 43.0334 0.0000 172.7848 16 T 4.5700 7.9250 119.3225 63.2334 70.0224 174.2487 17 V 4.2121 9.1301 125.8544 61.0109 33.9324 174.1218 18 I 4.5296 8.1492 128.9864 60.8305 38.1287 174.8416 19 D 4.7970 9.3766 127.1397 53.2985 44.8106 175.5157 20 H 4.5156 9.0492 118.3199 56.2807 25.8439 175.2701 21 I 3.9266 7.4511 120.0047 60.4668 37.5607 174.6681 22 P 4.6151 0.0000 0.0000 61.6377 31.9902 175.4179 23 A 4.0643 8.4988 121.9061 54.3953 18.8008 177.8651 24 Q 3.5315 9.1130 118.9923 56.8717 27.2202 174.8982 25 I 4.1483 7.7079 118.4130 62.0805 36.9901 177.9706 26 G 3.5427 8.8249 108.9030 47.7802 0.0000 175.7856 27 F 3.9566 8.2741 122.8793 60.8755 39.4508 176.5726 28 K 4.0599 7.6404 116.9892 58.4121 32.0418 178.7325 29 L 3.2653 8.0862 119.5290 57.9584 41.7337 179.6743 30 L 3.8896 8.1074 120.6559 57.4275 41.8914 178.5086 31 S 4.3661 8.2190 113.4795 59.6818 63.9178 176.3435 32 L 4.0421 7.6282 120.9857 56.4526 41.2605 177.5298 33 F 5.1243 7.4336 115.6222 57.4524 40.2048 175.7462 34 K 4.0586 8.1054 118.9067 57.4792 29.9300 176.6379 35 L 4.0689 7.8807 122.1170 57.6943 41.9912 179.2926 36 T 4.1375 7.7149 110.9508 62.5397 67.2203 174.7500 37 E 4.1063 7.8967 121.2007 59.5223 29.7611 177.7568 38 T 3.8148 7.2371 115.0730 64.2798 68.5493 173.0702 39 D 4.6888 8.6949 125.7803 54.2711 41.2300 175.2055 40 Q 4.5702 7.5827 117.4030 53.1891 30.7637 174.7885 41 R 3.8834 8.3649 122.2224 57.4463 31.1217 175.1411 42 I 4.8722 8.1824 125.2068 59.9890 40.1145 174.9904 43 T 4.4423 8.8781 124.8056 63.1831 70.3340 174.7129 44 I 4.8302 8.1661 124.4973 60.3164 41.4138 174.3129 45 G 4.0841 9.6379 115.6189 44.5375 0.0000 172.8351 46 L 4.5896 8.4621 125.8251 53.3774 44.0088 176.6602 47 N 4.0727 8.0674 114.5717 53.7199 36.4399 175.1821 48 L 4.4315 7.5996 121.5101 53.8540 43.1428 175.7047 49 P 4.7549 0.0000 0.0000 63.2219 32.8279 176.6273 50 S 4.5328 9.1261 109.4219 57.8918 64.7199 178.5641 51 G 3.8952 8.3787 122.8755 47.3296 0.0000 172.9602 52 E 4.2622 8.9693 122.5074 57.1239 29.6858 176.5497 53 M 4.4358 8.6248 119.1922 54.5720 34.0263 178.1905 54 G 3.8275 7.3093 109.1000 46.0116 0.0000 175.9787 55 R 4.6855 8.5671 123.9606 55.9747 30.4991 174.9822 56 K 4.7048 9.3783 122.0430 55.5500 36.0682 175.5845 57 D 5.1253 9.1341 122.9158 53.9477 43.4226 175.2032 58 L 4.6421 8.4324 119.3139 54.5407 45.6578 173.6288 59 I 4.9178 8.2434 126.5560 59.6457 41.0074 175.1038 60 K 4.6797 8.9456 124.2971 55.2743 36.1125 175.3142 61 I 4.8247 8.3873 119.4514 58.2711 38.8540 174.7317 62 E 3.7946 8.2100 126.7793 57.3761 30.2300 176.7354 63 N 4.1845 9.0550 117.9580 54.1548 36.9978 174.3056 64 T 4.5037 6.8354 113.9250 61.5853 72.1312 173.0484 65 F 5.6164 8.3719 122.6374 54.0082 42.2240 174.9954 66 L 3.9806 8.7292 124.9102 55.1106 42.0726 177.5872 67 S 4.2833 8.8433 118.9590 58.7907 62.9476 174.5056 68 E 3.2212 7.7408 114.9848 59.5700 30.3161 178.1844 69 D 4.8334 8.2698 118.0593 55.7157 41.3403 178.0578 70 Q 3.5812 8.1715 121.8627 58.9081 28.4798 178.6652 71 V 3.6308 6.9688 117.7450 66.0001 31.8071 177.5187 72 D 4.4387 7.8939 118.3064 57.3504 39.8051 178.3459 73 Q 3.9119 8.2450 120.5418 58.6543 28.7975 177.0332 74 L 4.5843 7.8972 118.7024 55.6019 42.0670 177.8674 75 A 4.2038 7.7748 120.9180 55.6302 18.6142 179.8524 76 L 3.8931 7.7165 115.3858 58.0463 41.7894 178.2742 77 Y 4.6328 7.0726 110.8320 59.6105 38.6049 176.1769 78 A 4.7087 7.8048 119.8608 50.2514 21.3148 174.3972 79 P 4.2577 0.0000 0.0000 65.3810 31.4004 178.5918 80 Q 4.2077 7.9957 113.2085 56.1456 29.2720 175.4961 81 A 4.4860 7.7453 120.9667 52.9226 19.5296 177.0870 82 T 4.6185 9.1335 115.2736 61.8482 73.0732 173.2792 83 V 4.5249 8.6512 126.0325 61.4047 33.7830 174.0550 84 N 5.2523 8.6861 124.8668 51.5901 41.2057 173.6895 85 R 4.7886 9.0862 124.4814 55.3054 31.2418 176.4149 86 I 5.3814 8.0983 124.6707 59.5011 40.5290 174.3049 87 D 4.5900 8.7049 118.7928 54.3231 44.4429 175.3469 88 N 4.3860 9.5082 123.6269 55.5656 37.3177 172.9435 89 Y 3.8359 7.9377 108.0488 57.7732 36.6947 170.5672 90 E 4.8253 8.2261 117.4920 54.6099 33.3579 176.4030 91 V 4.1904 8.0603 120.1489 62.5175 31.4951 178.1061 92 V 3.7014 7.8201 113.4919 64.0574 32.0961 177.7324 93 G 4.1728 7.9141 106.8468 45.3093 0.0000 171.2808 94 K 4.8281 8.3321 125.4508 56.1309 33.5209 176.5194 95 S 4.6439 9.3063 120.5071 56.9580 67.1777 172.9774 96 R 4.9508 8.6928 124.8114 54.0506 31.8188 173.5901 97 P 4.7491 0.0000 0.0000 61.7017 32.9815 175.1828 98 S 4.7804 8.1380 115.8368 56.2662 65.5136 174.1498 99 L 4.0063 8.3938 124.7789 54.2209 41.7748 175.8143 100 P 4.6367 0.0000 0.0000 62.0196 33.1977 175.5100 101 E 4.3665 8.6511 116.5111 59.1747 30.5195 177.4063 102 R 5.6481 7.6450 113.0600 55.9068 32.5434 174.7610 103 I 4.3693 8.5198 122.8914 60.1822 38.8935 174.3286 104 D 5.2388 8.7803 127.5477 54.1034 42.6283 175.8733 105 N 4.3074 9.7356 116.1602 53.0074 37.9681 175.3812 106 V 4.0230 8.0532 118.4530 64.0427 32.3373 176.9148 107 L 4.2533 7.7677 118.6171 53.9702 42.1505 176.4398 108 V 4.4495 7.8963 118.8176 60.8977 33.5569 174.7463 109 C 4.4340 9.2249 127.5177 59.6399 31.7576 172.0413 110 P 4.1337 0.0000 0.0000 64.7055 31.4070 175.9892 111 N 4.5913 8.1392 117.6861 52.9773 38.7789 175.2729 112 S 4.0778 8.8180 121.8060 61.5074 63.1421 174.7224 113 N 4.6632 8.3430 116.7138 53.4615 38.6410 173.8505 114 C 4.3487 8.1994 118.9725 58.8848 32.2560 174.2761 115 I 3.7397 8.4591 126.8670 63.5671 37.1904 177.8989 116 S 3.8186 7.7001 114.1346 61.7263 62.9282 175.3884 117 H 4.2977 7.4090 118.4854 58.7775 28.5986 177.2781 118 A 4.0933 7.7838 120.0199 54.4775 18.7947 177.7709 119 E 4.1615 7.2205 115.9303 55.4268 30.3448 176.5477 120 P 4.6320 0.0000 0.0000 62.0457 29.5740 175.6958 121 V 4.5077 7.2097 116.9411 60.2431 36.0319 175.3681 122 S 4.4274 8.6552 119.1791 57.8207 62.8762 174.5437 123 S 4.4467 8.8019 120.9484 58.8644 64.1382 173.1944 124 S 5.0640 8.4559 116.8044 56.5674 65.8555 172.1633 125 F 5.4648 9.1989 124.9777 55.4901 42.2644 174.2897 126 A 4.6097 9.1406 126.2427 51.7676 19.7561 176.3204 127 V 4.5723 8.8472 123.2219 61.3753 32.9250 175.1642 128 R 4.3923 8.8454 129.8420 54.0146 32.0678 175.5845 129 K 4.4960 8.4357 130.5765 55.9068 29.9097 175.6558 130 R 3.9140 8.0916 121.0956 55.9032 31.1947 179.0948 131 A 3.5942 8.9314 129.3484 52.9843 18.1542 176.3574 132 N 4.8082 9.2027 117.3570 51.5188 41.3941 174.0563 133 D 4.7493 7.8250 118.1980 51.8818 41.3291 175.1980 134 I 3.7162 8.3103 126.8508 62.0781 38.2213 174.9626 135 A 4.8104 9.6794 130.4448 51.2849 20.3810 175.9043 136 L 5.2276 9.2010 122.2751 52.8161 45.0675 175.3691 137 K 5.0269 9.2366 125.8196 54.6935 34.9089 174.4232 138 C 3.8288 8.8578 128.3308 58.4104 31.9526 174.1034 139 K 3.5554 8.1727 128.5042 59.4995 31.8184 177.1709 140 Y 4.3630 7.8083 116.7930 60.1636 38.6579 176.0833 141 C 4.3166 8.0054 112.2194 58.1834 30.3439 174.1629 142 E 3.8755 8.0937 118.2833 57.1024 27.7909 174.6493 143 K 4.1875 7.5253 118.6214 56.1990 33.4591 175.4705 144 E 4.9726 7.9501 121.7615 54.5849 32.5797 174.7977 145 F 5.1723 9.2852 122.8574 55.5881 44.3815 174.0469 146 S 4.5491 8.8953 116.0718 58.1934 63.1140 174.3913 147 H 4.1185 9.8511 124.7686 59.0782 28.2134 177.1430 148 N 4.1738 7.7479 116.6364 55.4131 37.1336 176.7000 149 V 3.6552 7.6578 119.7885 65.9746 31.6619 177.9778 150 V 3.6082 7.6314 116.0764 64.3509 32.7827 176.1558 151 L 4.2524 7.5923 122.2614 53.4206 40.1349 175.4669 152 A 4.2592 7.5402 122.1905 52.3626 18.2778 177.5324 153 N 4.4872 8.5383 117.3816 53.9802 37.9942 174.9729 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 4.44 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 2 T 7.76 3.68 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 3 H 8.83 4.45 0.00 3.08 3.17 0.00 5.99 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.51 4.50 0.00 2.71 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 5 N 8.46 4.81 0.00 2.70 2.52 0.00 0.00 7.25 6.68 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 6 K 9.86 4.42 0.00 1.94 2.00 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.48 7.81 7 L 7.19 4.61 0.00 1.59 1.51 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.53 4.26 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.50 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 9 V 8.09 4.55 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.03 0.00 0.00 10 E 8.31 4.77 0.00 1.93 1.80 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 2.20 2.33 0.00 11 A 8.40 4.31 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 12 I 8.01 4.50 1.76 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 1.23 0.96 0.87 0.00 0.00 13 K 7.84 2.00 0.00 1.47 1.53 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.16 0.78 7.81 14 R 7.97 4.74 0.00 2.09 1.64 0.00 3.30 0.00 0.00 3.53 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.99 0.00 15 G 7.89 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 16 T 7.92 4.57 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 1.22 0.00 0.00 17 V 9.13 4.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.90 0.00 0.00 18 I 8.15 4.53 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.64 0.96 0.00 0.00 19 D 9.38 4.80 0.00 2.69 2.36 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 20 H 9.05 4.52 0.00 3.29 3.62 0.00 5.77 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.45 3.93 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.53 0.94 0.00 0.00 22 P 0.00 4.62 0.00 2.20 2.00 0.00 3.67 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.17 0.00 23 A 8.50 4.06 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 24 Q 9.11 3.53 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.97 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 25 I 7.71 4.15 1.94 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.21 0.96 0.00 0.00 26 G 8.82 3.54 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 0.00 0.00 0.00 27 F 8.27 3.96 0.00 3.02 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 28 K 7.64 4.06 0.00 1.90 1.53 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.62 1.57 7.81 29 L 8.09 3.27 0.00 1.60 1.63 1.01 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.11 3.89 0.00 1.80 1.46 0.86 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.22 4.37 0.00 3.88 3.81 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 32 L 7.63 4.04 0.00 1.28 1.31 0.89 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.43 5.12 0.00 3.13 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 34 K 8.11 4.06 0.00 1.90 2.01 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.55 7.81 35 L 7.88 4.07 0.00 1.71 1.72 0.96 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.71 4.14 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 1.15 0.00 0.00 37 E 7.90 4.11 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.43 0.00 38 T 7.24 3.81 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 1.20 0.00 0.00 39 D 8.69 4.69 0.00 2.61 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 40 Q 7.58 4.57 0.00 1.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.56 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 41 R 8.36 3.88 0.00 1.91 1.93 0.00 3.16 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 42 I 8.18 4.87 1.85 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 1.31 0.90 0.95 0.00 0.00 43 T 8.88 4.44 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 1.21 0.00 0.00 44 I 8.17 4.83 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.23 1.00 0.00 0.00 45 G 9.64 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 46 L 8.46 4.59 0.00 1.55 1.63 1.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.07 4.07 0.00 2.87 3.17 0.00 0.00 7.04 7.73 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 48 L 7.60 4.43 0.00 1.64 1.59 0.98 1.03 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 49 P 0.00 4.75 0.00 2.07 2.07 0.00 3.81 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 1.99 1.97 0.00 50 S 9.13 4.53 0.00 3.87 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 51 G 8.38 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.97 4.26 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 53 M 8.62 4.44 0.00 1.93 2.16 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 54 G 7.31 3.83 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 0.00 0.00 0.00 55 R 8.57 4.69 0.00 1.71 1.88 0.00 3.18 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.63 0.00 56 K 9.38 4.70 0.00 1.74 1.84 0.00 1.34 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.43 7.81 57 D 9.13 5.13 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 58 L 8.43 4.64 0.00 1.77 1.63 1.07 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.24 4.92 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.12 0.91 0.00 0.00 60 K 8.95 4.68 0.00 1.63 1.63 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.38 7.81 61 I 8.39 4.82 1.77 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.17 0.87 0.00 0.00 62 E 8.21 3.79 0.00 1.88 1.90 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 2.25 2.22 0.00 63 N 9.05 4.18 0.00 2.76 2.93 0.00 0.00 6.72 6.24 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 64 T 6.84 4.50 4.19 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 1.15 0.00 0.00 65 F 8.37 5.62 0.00 2.93 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 66 L 8.73 3.98 0.00 1.63 1.57 0.87 0.89 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 67 S 8.84 4.28 0.00 3.82 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 68 E 7.74 3.22 0.00 2.06 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 2.38 2.43 0.00 69 D 8.27 4.83 0.00 2.71 2.64 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 0.00 0.00 0.00 0.00 70 Q 8.17 3.58 0.00 2.04 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 71 V 6.97 3.63 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 0.82 0.00 0.00 0.90 0.00 0.00 72 D 7.89 4.44 0.00 2.92 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 73 Q 8.25 3.91 0.00 2.15 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 74 L 7.90 4.58 0.00 1.85 1.86 1.23 1.15 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 75 A 7.77 4.20 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 76 L 7.72 3.89 0.00 1.26 1.64 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 7.07 4.63 0.00 3.00 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 78 A 7.80 4.71 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 79 P 0.00 4.26 0.00 2.20 2.23 0.00 3.81 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 80 Q 8.00 4.21 0.00 2.21 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 81 A 7.75 4.49 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 9.13 4.62 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 1.19 0.00 0.00 83 V 8.65 4.52 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 1.04 0.00 0.00 0.95 0.00 0.00 84 N 8.69 5.25 0.00 2.82 2.70 0.00 0.00 6.56 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 85 R 9.09 4.79 0.00 1.74 2.01 0.00 3.14 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 86 I 8.10 5.38 2.17 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 1.09 1.36 0.85 0.00 0.00 87 D 8.70 4.59 0.00 2.78 2.46 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 88 N 9.51 4.39 0.00 2.92 2.90 0.00 0.00 7.20 7.54 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 89 Y 7.94 3.84 0.00 3.11 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 90 E 8.23 4.83 0.00 2.17 1.83 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 2.48 2.39 0.00 91 V 8.06 4.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.95 0.00 0.00 92 V 7.82 3.70 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 0.75 0.00 0.00 1.04 0.00 0.00 93 G 7.91 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 0.00 0.00 0.00 94 K 8.33 4.83 0.00 1.66 1.76 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.71 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.59 1.47 7.81 95 S 9.31 4.64 0.00 3.68 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 96 R 8.69 4.95 0.00 1.79 1.80 0.00 3.45 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 97 P 0.00 4.75 0.00 2.21 2.02 0.00 3.80 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 1.95 1.99 0.00 98 S 8.14 4.78 0.00 3.83 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 99 L 8.39 4.01 0.00 1.62 1.60 0.88 1.02 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 0.00 100 P 0.00 4.64 0.00 2.16 2.22 0.00 3.73 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 1.97 1.95 0.00 101 E 8.65 4.37 0.00 1.99 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 2.36 0.00 102 R 7.64 5.65 0.00 1.90 1.86 0.00 2.60 0.00 0.00 4.01 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 103 I 8.52 4.37 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.88 0.91 0.00 0.00 104 D 8.78 5.24 0.00 2.66 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 0.00 105 N 9.74 4.31 0.00 2.90 2.99 0.00 0.00 6.90 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 0.00 106 V 8.05 4.02 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 0.80 0.00 0.00 1.18 0.00 0.00 107 L 7.77 4.25 0.00 1.68 1.33 0.73 0.78 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 0.00 108 V 7.90 4.45 2.12 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 0.89 0.00 0.00 1.00 0.00 0.00 109 C 9.22 4.43 0.00 3.23 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 0.00 110 P 0.00 4.13 0.00 0.90 1.67 0.00 3.10 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.72 0.00 111 N 8.14 4.59 0.00 3.07 2.93 0.00 0.00 6.98 7.63 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 0.00 112 S 8.82 4.08 0.00 4.02 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 0.00 113 N 8.34 4.66 0.00 2.74 3.01 0.00 0.00 7.21 6.93 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 0.00 114 C 8.20 4.35 0.00 3.13 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 0.00 115 I 8.46 3.74 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.91 0.70 0.00 0.00 116 S 7.70 3.82 0.00 3.97 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 0.00 117 H 7.41 4.30 0.00 3.13 3.42 0.00 5.66 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.78 4.09 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 0.00 119 E 7.22 4.16 0.00 1.96 1.80 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 2.27 2.31 0.00 120 P 0.00 4.63 0.00 2.17 2.08 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 121 V 7.21 4.51 2.16 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 0.76 0.00 0.00 0.55 0.00 0.00 122 S 8.66 4.43 0.00 3.92 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 0.00 123 S 8.80 4.45 0.00 4.15 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 0.00 124 S 8.46 5.06 0.00 3.82 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 0.00 125 F 9.20 5.46 0.00 3.09 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 0.00 126 A 9.14 4.61 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 0.00 127 V 8.85 4.57 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 0.76 0.00 0.00 1.01 0.00 0.00 128 R 8.85 4.39 0.00 1.89 1.77 0.00 3.14 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 129 K 8.44 4.50 0.00 1.80 1.73 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.43 7.81 130 R 8.09 3.91 0.00 1.89 2.01 0.00 3.39 0.00 0.00 3.35 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 131 A 8.93 3.59 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 0.00 132 N 9.20 4.81 0.00 2.67 2.83 0.00 0.00 6.61 8.06 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 0.00 133 D 7.82 4.75 0.00 2.68 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 0.00 134 I 8.31 3.72 1.78 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.41 0.91 0.00 0.00 135 A 9.68 4.81 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 0.00 136 L 9.20 5.23 0.00 1.78 1.68 0.77 0.56 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 0.00 137 K 9.24 5.03 0.00 1.85 1.67 0.00 1.60 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.43 7.81 138 C 8.86 3.83 0.00 3.22 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 0.00 139 K 8.17 3.56 0.00 1.53 1.43 0.00 1.55 0.00 0.00 1.17 0.00 0.00 2.47 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.46 1.04 7.81 140 Y 7.81 4.36 0.00 2.98 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 0.00 141 C 8.01 4.32 0.00 3.17 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 E 8.09 3.88 0.00 2.14 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 2.20 2.21 0.00 143 K 7.53 4.19 0.00 1.62 1.09 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.32 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.41 1.44 7.81 144 E 7.95 4.97 0.00 1.79 1.63 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 2.22 2.25 0.00 145 F 9.29 5.17 0.00 3.06 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 0.00 146 S 8.90 4.55 0.00 3.96 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 0.00 147 H 9.85 4.12 0.00 3.37 3.69 0.00 5.52 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 7.75 4.17 0.00 2.80 2.81 0.00 0.00 5.94 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 V 7.66 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 0.71 0.00 0.00 0.96 0.00 0.00 150 V 7.63 3.61 2.12 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 0.48 0.00 0.00 0.82 0.00 0.00 151 L 7.59 4.25 0.00 1.86 1.60 1.14 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.54 4.26 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 0.00 0.00 153 N 8.54 4.49 0.00 2.65 2.94 0.00 0.00 7.02 7.56 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