NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3016 8.3044 120.3258 55.6432 32.8703 176.2344 2 H 4.2236 7.9128 117.7677 55.0085 29.3707 171.9075 3 L 4.7644 7.7938 126.4397 52.9057 44.5857 177.1666 4 T 4.2014 8.4535 113.9260 60.4753 71.2338 174.1092 5 P 4.1790 0.0000 0.0000 66.1846 31.3987 178.8853 6 E 4.0308 8.0715 116.5848 59.0865 29.3247 179.1319 7 E 3.8974 7.9703 118.6998 59.2979 29.5827 179.1937 8 K 3.8064 8.2878 120.0068 59.4146 32.0663 178.8164 9 S 4.0731 8.1384 113.3815 61.0565 62.2076 175.8452 10 A 3.9823 8.0209 123.5355 55.1311 18.2280 179.7708 11 V 3.3806 7.9815 116.9435 66.4670 31.7217 178.3681 12 T 3.9509 7.9438 115.1863 66.6831 68.0554 175.9720 13 A 4.0085 8.1309 121.7320 55.6356 18.5711 179.0360 14 L 3.8923 7.9692 117.7981 58.0052 42.2308 179.2314 15 W 4.2634 8.5882 128.1389 60.2281 30.4397 177.9474 16 G 3.8404 8.1257 104.1788 46.5707 0.0000 174.6626 17 K 4.4214 7.9345 119.0280 55.4452 32.9709 176.5120 18 V 3.6725 6.9023 120.4419 61.9618 32.1635 175.7669 19 N 4.5256 8.3025 125.3881 52.5152 38.8963 175.7342 20 V 3.5104 8.0882 122.5819 64.3081 31.7801 177.8974 21 D 4.3486 8.1416 118.0949 57.6001 40.7914 178.5392 22 E 3.8872 8.1911 119.0334 59.2918 29.5887 179.0134 23 V 3.5750 8.0324 118.6715 65.5186 31.4934 178.2488 24 G 3.6966 8.5407 106.2676 47.7878 0.0000 175.7797 25 G 3.6783 7.9746 108.6913 47.5026 0.0000 175.5910 26 E 3.9557 8.1358 120.6739 58.9877 29.5105 179.3885 27 A 3.9289 8.1458 120.9388 55.0348 18.6150 179.4617 28 L 4.0089 7.9761 119.0824 58.1259 42.1999 179.2980 29 G 3.6343 8.1053 105.6176 48.0932 0.0000 175.8063 30 R 3.9528 8.2208 121.2385 58.5874 30.0234 178.8621 31 L 4.1221 8.0358 120.1560 58.4416 41.6188 179.2065 32 L 4.2389 7.8641 119.4838 56.6869 41.2587 179.6819 33 V 3.6404 7.5290 117.7970 65.8823 31.7372 178.0589 34 V 3.5897 8.1238 116.7806 64.4285 32.8143 175.5842 35 Y 4.7914 7.7897 115.5771 54.6078 38.1241 174.1422 36 P 4.5817 0.0000 0.0000 64.4755 31.8266 177.7465 37 A 4.0449 8.2254 119.7540 55.2781 18.3938 179.0552 38 T 4.2471 8.5134 107.6116 63.9736 68.7399 176.2146 39 Q 4.4599 8.3214 121.7000 58.1163 28.5122 177.9668 40 R 3.6959 7.5848 116.9619 58.7036 29.1952 177.8139 41 F 4.3931 7.0751 114.6834 57.3239 39.6973 175.6249 42 F 4.5797 7.9413 119.0325 56.6865 39.5905 177.2025 43 E 4.0506 8.2743 121.0713 59.2174 29.7239 178.4151 44 S 4.4788 8.0178 111.9261 59.7305 63.2054 174.5368 45 F 4.6929 8.3246 119.6113 58.2121 39.8711 176.9856 46 G 3.9782 7.6811 106.1530 44.6350 0.0000 173.9606 47 D 4.5031 8.5997 124.4826 54.4699 41.3546 176.0361 48 L 4.9411 8.3296 126.9268 54.5578 43.1997 177.9862 49 S 4.3200 8.4991 116.8912 60.3766 63.5716 174.3942 50 T 4.7355 7.4382 109.8068 58.1618 73.0134 172.8125 51 P 4.1968 0.0000 0.0000 66.0920 31.3718 178.6992 52 D 4.3951 8.1216 116.7372 57.3306 40.5146 178.5866 53 A 4.0273 7.6788 120.0421 54.8763 18.5177 179.7199 54 V 3.7156 7.8076 116.7741 66.4977 31.5591 178.3006 55 M 4.0329 8.3474 117.4653 57.9426 31.8627 177.6271 56 G 3.8259 7.8800 104.8511 45.3876 0.0000 173.7466 57 N 4.2992 7.7682 119.8108 53.2601 39.7705 173.5490 58 P 4.2306 0.0000 0.0000 65.5527 31.5036 178.8072 59 K 3.7268 8.1301 117.5485 58.9368 31.7243 179.6303 60 V 3.6420 7.7039 118.2365 65.8657 31.6677 178.0703 61 K 3.9184 8.1353 118.0507 59.5130 31.7816 179.2752 62 A 4.0260 8.0717 121.0293 55.2601 18.1784 179.2136 63 H 4.3961 8.4994 117.1626 59.1684 29.9622 177.6374 64 G 3.6492 8.4709 108.1339 47.7276 0.0000 175.5272 65 K 3.9879 7.9828 121.8366 59.0411 32.3189 178.8829 66 K 3.9830 7.9105 119.8385 59.4321 32.2296 178.9574 67 V 3.6562 8.0765 118.9054 66.2140 31.4111 178.0511 68 L 4.3864 8.3015 118.6837 57.2533 41.4711 179.6226 69 G 3.7447 8.4518 105.9268 47.9596 0.0000 175.6047 70 A 4.1281 7.8071 121.9134 54.6369 18.7569 179.1362 71 F 4.4248 8.3866 119.1124 61.6623 39.4684 177.5204 72 S 3.9929 8.7535 115.0384 61.8431 62.8468 176.4684 73 D 4.5054 8.2761 121.5760 57.2538 40.4809 179.1471 74 G 3.4583 7.8439 106.1960 47.5406 0.0000 175.4616 75 L 3.8639 7.3030 119.2251 56.1092 41.6392 178.1639 76 A 4.3477 7.3136 119.0804 52.3714 19.8804 176.5975 77 H 4.8583 8.0562 115.2239 54.6261 29.8293 175.4345 78 L 3.9205 7.9263 119.7703 57.5783 41.8811 178.5653 79 D 4.5627 7.8865 116.0803 55.3135 41.9503 176.2873 80 N 5.0063 8.0229 117.9635 51.4791 39.7434 174.6241 81 L 4.0278 7.8341 123.0127 57.5820 42.1650 179.2058 82 K 4.0144 8.0037 117.1586 59.4937 32.2943 179.1803 83 G 3.6899 8.0513 105.6983 48.0195 0.0000 175.7536 84 T 3.6809 7.5124 117.1798 65.7986 68.6371 175.6865 85 F 4.7698 7.9043 116.7810 57.0675 39.2518 177.4331 86 A 4.1139 7.7947 123.0048 55.7830 18.2461 180.6192 87 T 3.9012 7.8867 107.5787 64.8883 68.8069 176.5160 88 L 4.1009 7.9782 121.4400 57.4470 41.7203 179.0360 89 S 4.3750 8.4850 114.8835 60.9914 62.3217 176.0160 90 E 3.8532 8.1596 121.1054 59.2736 29.2311 179.1140 91 L 3.8877 7.9375 120.1272 58.7144 42.1882 178.8472 92 H 4.1570 8.6395 116.3663 59.0199 28.7053 177.1272 93 C 3.5243 7.7203 120.7555 62.2417 31.1219 175.3299 94 D 4.4145 8.2818 120.8507 56.1697 40.6066 177.5726 95 K 4.2336 7.7253 117.2699 57.7173 33.3024 177.5536 96 L 4.1794 7.6565 115.6757 54.7035 42.5259 175.9963 97 H 4.1162 7.1478 113.5713 56.6150 26.5783 175.4535 98 V 3.7639 7.8418 118.4427 61.0132 32.2524 174.6549 99 D 4.2761 8.7961 127.3084 54.0424 41.4047 175.0546 100 P 3.1689 0.0000 0.0000 64.9644 31.2805 177.8444 101 E 3.8358 8.1671 118.3616 59.3361 29.3477 178.5556 102 N 4.2707 7.8538 116.4246 56.0796 38.4714 177.3160 103 F 4.4722 7.4517 119.3500 60.4730 39.0057 177.9455 104 R 3.9931 7.8007 117.5144 59.0297 29.9642 178.7856 105 L 3.8174 7.6984 118.5065 57.6758 41.5951 179.2706 106 L 4.0950 8.1649 120.4237 58.0151 41.9765 179.1926 107 G 3.6726 8.1009 105.6653 48.0637 0.0000 175.4734 108 N 4.4650 8.1364 118.9841 55.8269 38.4973 177.7899 109 V 3.6276 8.0481 119.7976 65.9154 31.6642 177.6322 110 L 3.8657 8.5074 120.4346 58.3337 41.8211 179.2341 111 V 3.6173 7.8277 118.0127 66.2195 31.4226 177.8151 112 C 4.1565 8.1606 116.5640 62.7509 27.9372 176.2791 113 V 3.5507 7.9493 119.9795 65.9210 31.0792 178.1454 114 L 3.8224 7.8447 118.5595 57.5182 41.3538 179.3442 115 A 3.6790 7.3838 120.7019 55.1960 18.0835 179.1405 116 H 4.0980 8.1849 116.0563 59.8142 30.0163 176.9764 117 H 3.9704 8.0477 116.7989 58.0991 28.7514 176.9507 118 F 4.7158 8.3858 117.7032 56.3148 39.8167 177.4299 119 G 3.9302 8.6601 109.0589 46.0024 0.0000 175.7606 120 K 3.9588 9.1203 120.9041 59.9095 32.0415 177.6166 121 E 4.0379 7.8705 119.1756 57.8825 29.7795 177.1151 122 F 4.6692 8.1030 122.7094 57.2100 37.8153 175.4533 123 T 4.2427 7.4648 116.0367 59.8622 71.3994 173.5312 124 P 4.1601 0.0000 0.0000 65.6652 31.1526 177.1448 125 P 4.2366 0.0000 0.0000 65.5170 31.1856 178.8941 126 V 3.5499 7.4922 117.2836 65.6989 31.4237 177.8647 127 Q 3.3934 7.8367 119.4067 59.0060 28.7550 177.9956 128 A 4.0769 7.9775 121.4871 55.2597 18.4157 179.5637 129 A 3.9001 7.7418 119.0733 55.5051 18.5259 179.4848 130 Y 3.8646 8.0297 115.3034 61.1694 37.9279 178.7872 131 Q 4.1496 8.8376 119.4215 59.0025 28.8619 179.0869 132 K 3.9709 7.8442 119.5583 59.3650 31.9963 179.6188 133 V 3.5065 7.6566 118.0948 66.1820 31.4376 178.4641 134 V 3.8064 8.4894 112.3374 64.5017 31.2880 178.4994 135 A 4.1094 8.2518 120.7328 55.0349 18.1873 179.9641 136 G 3.4867 8.2329 104.3690 47.8743 0.0000 176.2194 137 V 3.4266 8.1086 120.6980 65.5704 31.4017 178.0067 138 A 3.9169 8.2300 120.7954 55.2334 17.9795 179.4242 139 N 4.3038 8.2404 114.1620 56.2876 39.0300 177.2212 140 A 4.1526 8.1243 122.3246 55.1936 18.6323 179.6752 141 L 3.9057 7.9369 116.8575 56.8778 41.6609 178.5309 142 A 4.5298 7.6617 119.8698 52.9576 18.8564 178.6464 143 H 4.3908 8.0627 113.3585 57.8110 28.7370 176.3013 144 K 4.3522 7.8870 118.9770 56.1877 32.1249 176.3530 145 Y 4.1549 7.9567 117.7514 58.3867 38.4212 175.6510 146 H 4.4525 8.2577 117.5786 56.1814 28.2700 173.2960 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 4.30 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 2 H 7.91 4.22 0.00 3.17 3.25 0.00 5.70 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.79 4.76 0.00 1.54 1.46 0.84 0.82 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 4 T 8.45 4.20 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 1.22 0.00 0.00 5 P 0.00 4.18 0.00 2.15 2.12 0.00 3.55 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 2.09 2.15 0.00 6 E 8.07 4.03 0.00 1.95 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 2.38 2.32 0.00 7 E 7.97 3.90 0.00 2.23 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 2.28 2.27 0.00 8 K 8.29 3.81 0.00 1.71 1.91 0.00 1.57 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.37 7.81 9 S 8.14 4.07 0.00 4.03 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 10 A 8.02 3.98 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 11 V 7.98 3.38 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 0.65 0.00 0.00 0.37 0.00 0.00 12 T 7.94 3.95 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 1.26 0.00 0.00 13 A 8.13 4.01 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 14 L 7.97 3.89 0.00 1.75 1.92 -0.13 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.59 4.26 0.00 3.91 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 8.13 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 0.00 0.00 0.00 17 K 7.93 4.42 0.00 2.03 2.07 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.46 7.81 18 V 6.90 3.67 1.27 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 0.04 0.00 0.00 0.71 0.00 0.00 19 N 8.30 4.53 0.00 2.72 2.61 0.00 0.00 7.22 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 8.09 3.51 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 0.81 0.00 0.00 1.00 0.00 0.00 21 D 8.14 4.35 0.00 2.91 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.19 3.89 0.00 2.02 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 2.22 2.28 0.00 23 V 8.03 3.58 1.96 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 0.86 0.00 0.00 0.64 0.00 0.00 24 G 8.54 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 25 G 7.97 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 26 E 8.14 3.96 0.00 2.22 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 2.32 2.49 0.00 27 A 8.15 3.93 1.27 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 0.00 0.00 28 L 7.98 4.01 0.00 1.79 1.66 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.11 3.63 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 0.00 0.00 0.00 30 R 8.22 3.95 0.00 1.94 1.99 0.00 3.11 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 31 L 8.04 4.12 0.00 1.93 1.94 1.05 0.59 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 32 L 7.86 4.24 0.00 1.92 1.74 0.76 0.62 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 33 V 7.53 3.64 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 0.75 0.00 0.00 0.94 0.00 0.00 34 V 8.12 3.59 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 -0.03 0.00 0.00 0.86 0.00 0.00 35 Y 7.79 4.79 0.00 3.24 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 36 P 0.00 4.58 0.00 2.17 2.13 0.00 3.91 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 2.11 2.14 0.00 37 A 8.23 4.04 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 38 T 8.51 4.25 4.53 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 39 Q 8.32 4.46 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 40 R 7.58 3.70 0.00 1.57 1.80 0.00 2.74 0.00 0.00 2.54 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.50 0.00 41 F 7.08 4.39 0.00 2.09 2.33 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 42 F 7.94 4.58 0.00 2.84 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.27 4.05 0.00 2.15 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 0.00 2.33 2.30 0.00 44 S 8.02 4.48 0.00 4.15 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 45 F 8.32 4.69 0.00 3.15 3.13 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 0.00 0.00 0.00 0.00 46 G 7.68 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 47 D 8.60 4.50 0.00 2.65 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 8.33 4.94 0.00 1.66 1.63 1.02 1.05 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 49 S 8.50 4.32 0.00 4.01 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 0.00 50 T 7.44 4.74 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 4.20 0.00 2.16 2.13 0.00 3.59 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 2.10 2.17 0.00 52 D 8.12 4.40 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.68 4.03 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 54 V 7.81 3.72 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 55 M 8.35 4.03 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.76 0.00 56 G 7.88 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 57 N 7.77 4.30 0.00 3.05 2.83 0.00 0.00 7.13 9.05 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 58 P 0.00 4.23 0.00 2.13 2.04 0.00 3.60 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 2.07 2.14 0.00 59 K 8.13 3.73 0.00 1.48 0.74 0.00 1.52 0.00 0.00 1.30 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.18 1.25 7.81 60 V 7.70 3.64 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 1.14 0.00 0.00 1.03 0.00 0.00 61 K 8.14 3.92 0.00 1.96 1.81 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.57 7.81 62 A 8.07 4.03 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 63 H 8.50 4.40 0.00 3.52 3.49 0.00 5.80 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 64 G 8.47 3.65 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 0.00 0.00 0.00 65 K 7.98 3.99 0.00 1.88 1.99 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.47 1.63 7.81 66 K 7.91 3.98 0.00 1.98 2.02 0.00 1.87 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.51 7.81 67 V 8.08 3.66 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 1.02 0.00 0.00 0.90 0.00 0.00 68 L 8.30 4.39 0.00 2.03 1.87 1.04 0.75 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 69 G 8.45 3.74 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 0.00 0.00 0.00 70 A 7.81 4.13 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.39 4.42 0.00 3.14 3.29 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 72 S 8.75 3.99 0.00 4.20 4.28 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 73 D 8.28 4.51 0.00 2.91 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 74 G 7.84 3.46 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 0.00 75 L 7.30 3.86 0.00 1.40 1.40 -0.36 0.17 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 76 A 7.31 4.35 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.06 4.86 0.00 3.07 3.12 0.00 5.82 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.93 3.92 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 1.57 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.89 4.56 0.00 2.63 2.68 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 80 N 8.02 5.01 0.00 2.71 2.59 0.00 0.00 7.10 6.18 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 81 L 7.83 4.03 0.00 1.74 1.80 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.00 4.01 0.00 1.64 1.63 0.00 1.68 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.26 1.45 7.81 83 G 8.05 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 84 T 7.51 3.68 4.07 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 0.00 0.00 0.55 0.00 0.00 85 F 7.90 4.77 0.00 3.19 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.79 4.11 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 87 T 7.89 3.90 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 1.21 0.00 0.00 88 L 7.98 4.10 0.00 2.04 1.89 1.03 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.48 4.38 0.00 4.05 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.16 3.85 0.00 2.23 1.96 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 2.31 2.46 0.00 91 L 7.94 3.89 0.00 1.87 1.87 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.64 4.16 0.00 3.48 3.73 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 7.72 3.52 0.00 1.23 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 94 D 8.28 4.41 0.00 2.60 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 95 K 7.73 4.23 0.00 1.82 1.77 0.00 1.53 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 L 7.66 4.18 0.00 1.68 1.60 0.69 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.15 4.12 0.00 3.45 3.39 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.84 3.76 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 0.10 0.00 0.00 0.43 0.00 0.00 99 D 8.80 4.28 0.00 2.75 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 0.00 100 P 0.00 3.17 0.00 1.88 1.82 0.00 3.34 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.47 0.00 101 E 8.17 3.84 0.00 2.04 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 2.23 2.30 0.00 102 N 7.85 4.27 0.00 2.54 2.72 0.00 0.00 6.92 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 0.00 103 F 7.45 4.47 0.00 3.07 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 0.00 104 R 7.80 3.99 0.00 1.91 1.96 0.00 3.10 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 105 L 7.70 3.82 0.00 1.71 1.35 0.49 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.16 4.10 0.00 1.83 1.86 0.96 1.08 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 0.00 107 G 8.10 3.67 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 0.00 0.00 0.00 108 N 8.14 4.47 0.00 2.82 2.94 0.00 0.00 6.71 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 0.00 109 V 8.05 3.63 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 1.09 0.00 0.00 1.18 0.00 0.00 110 L 8.51 3.87 0.00 1.72 1.82 0.86 0.38 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 0.00 111 V 7.83 3.62 2.34 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 1.35 0.00 0.00 1.19 0.00 0.00 112 C 8.16 4.16 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 0.00 113 V 7.95 3.55 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 0.87 0.00 0.00 0.94 0.00 0.00 114 L 7.84 3.82 0.00 1.08 1.11 0.58 0.56 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 0.00 115 A 7.38 3.68 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 0.00 116 H 8.18 4.10 0.00 3.20 3.50 0.00 5.78 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 8.05 3.97 0.00 2.78 2.56 0.00 5.71 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 0.00 118 F 8.39 4.72 0.00 3.23 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.66 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 0.00 0.00 0.00 120 K 9.12 3.96 0.00 1.92 2.04 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.47 7.81 121 E 7.87 4.04 0.00 2.08 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 0.00 2.32 2.30 0.00 122 F 8.10 4.67 0.00 3.00 3.14 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 0.00 123 T 7.46 4.24 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.15 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.24 0.00 2.11 2.07 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 2.09 2.12 0.00 126 V 7.49 3.55 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 1.01 0.00 0.00 0.91 0.00 0.00 127 Q 7.84 3.39 0.00 1.59 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 128 A 7.98 4.08 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 0.00 129 A 7.74 3.90 1.24 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 0.00 0.00 130 Y 8.03 3.86 0.00 3.36 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 8.84 4.15 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.72 2.62 0.00 132 K 7.84 3.97 0.00 1.92 1.83 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.55 7.81 133 V 7.66 3.51 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 0.98 0.00 0.00 0.72 0.00 0.00 134 V 8.49 3.81 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 1.08 0.00 0.00 1.15 0.00 0.00 135 A 8.25 4.11 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 8.23 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 0.00 137 V 8.11 3.43 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 0.70 0.00 0.00 0.74 0.00 0.00 138 A 8.23 3.92 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 8.24 4.30 0.00 2.87 2.89 0.00 0.00 7.02 7.97 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 0.00 140 A 8.12 4.15 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 0.00 141 L 7.94 3.91 0.00 0.89 0.66 0.03 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.66 4.53 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 8.06 4.39 0.00 3.38 3.74 0.00 5.75 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 0.00 144 K 7.89 4.35 0.00 1.75 1.84 0.00 1.66 0.00 0.00 1.49 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.03 1.60 7.81 145 Y 7.96 4.15 0.00 3.07 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 0.00 146 H 8.26 4.45 0.00 3.20 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