NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.8212 8.2827 118.2310 52.9034 39.7366 175.9886 4 I 3.4474 7.9164 118.5021 63.6301 37.7154 174.3412 5 E 4.2472 8.9672 121.7445 58.5864 29.6739 178.8394 6 K 3.9852 8.1246 118.6513 59.3638 32.0828 179.0442 7 L 3.7043 7.5586 119.9702 58.1120 41.5172 178.5762 8 E 4.0990 8.0574 118.5325 59.5237 29.2311 179.2103 9 Q 4.0220 8.2491 119.5634 59.3484 28.9171 178.5124 10 S 4.1677 7.9404 115.1605 61.4967 62.9755 176.2642 11 L 4.1715 8.2923 120.6050 55.1157 41.6641 176.9466 12 T 3.5238 7.5223 108.0259 61.9641 68.1297 171.7048 13 Y 4.4427 8.0275 121.5201 57.2965 41.7331 173.1329 14 E 4.3423 7.6665 128.2668 53.9530 30.6018 175.3379 15 F 4.2094 8.8514 126.1663 57.5774 39.6955 175.9070 16 K 3.9184 9.2245 125.5889 59.0502 32.1239 177.1557 17 D 4.7771 8.2824 122.9188 52.3914 41.0030 176.6937 18 K 3.9906 8.5857 127.7831 59.5166 32.0036 178.9358 19 N 4.4283 8.2971 116.2956 55.9083 38.3673 177.2184 20 L 4.0018 7.8827 122.1891 57.9000 41.9783 178.7235 21 L 3.2916 7.2365 118.6510 57.8516 42.3140 178.2560 22 I 3.7952 7.4894 119.7866 64.8026 37.1004 177.6164 23 H 4.0565 8.6012 118.8743 59.4870 29.4534 177.1196 24 A 4.0110 7.8511 120.7980 54.5799 18.4027 178.5889 25 L 4.5328 7.6806 115.6405 54.5153 42.0730 176.4431 26 T 4.4981 7.4870 117.8886 61.9336 68.3541 173.9592 27 H 4.6239 8.7765 127.5886 55.4043 30.4758 176.5979 28 K 4.0688 8.1180 123.9539 59.4064 32.4184 178.2362 29 S 4.3396 7.9391 113.2395 60.4782 63.6265 175.4104 30 F 4.4714 8.4258 123.5402 60.5473 39.3851 175.2819 31 K 4.4604 7.7797 120.2215 54.2260 35.0612 174.7419 32 K 3.9670 8.6278 127.1584 58.0440 32.5707 176.1294 33 S 3.7740 8.9568 119.5392 59.2119 60.4924 171.5066 34 Y 4.5383 7.8822 121.5693 56.6689 40.2264 173.4915 35 N 4.8785 8.0670 123.7441 51.2285 40.0639 174.2600 36 N 4.6376 8.7516 114.4040 53.3723 37.4284 176.7180 37 E 3.9649 8.5986 123.3587 59.8360 29.5502 179.3619 38 R 3.9497 7.8364 117.6352 59.2848 30.2511 178.9409 39 L 4.0299 7.7945 118.3272 57.6214 41.5356 178.9923 40 E 4.0076 8.5495 119.7156 59.1419 29.4891 178.5469 41 F 4.1239 8.3067 120.6708 61.2626 39.4613 176.8359 42 L 3.8756 8.2394 119.9191 58.2076 41.9229 179.1943 43 G 3.5703 8.5440 106.0502 47.6920 0.0000 175.1055 44 D 4.8813 8.6541 121.7331 56.6984 41.2694 178.2630 45 A 3.8422 7.5743 121.0680 54.9007 18.2903 179.7151 46 V 3.5923 7.7929 116.7462 66.3369 31.5657 178.3488 47 L 4.1017 8.3226 119.0579 57.8935 41.3797 179.2311 48 D 4.3864 8.3998 119.0885 57.1485 40.6392 178.6836 49 L 3.9617 7.8791 120.4541 57.9388 42.1733 178.8584 50 V 3.7623 8.3559 118.7123 66.3753 31.4480 178.2654 51 V 3.8585 8.3262 118.2569 65.8240 31.3244 178.1205 52 G 3.7204 8.4032 105.7238 47.8361 0.0000 175.3067 53 E 4.0033 8.7486 122.3251 59.0716 29.7116 177.9700 54 Y 4.2572 8.3000 119.6370 61.0690 38.7648 178.4152 55 L 4.1849 8.4433 119.7327 57.6429 41.5270 178.9534 56 F 4.0594 8.3499 119.8813 61.9625 39.3228 176.7416 57 H 4.4088 8.3015 114.2400 58.7305 28.6789 177.5274 58 K 3.8523 8.0230 120.3348 57.7255 33.5372 176.9146 59 F 4.6773 8.1198 117.1273 55.3555 38.9030 175.5961 60 A 3.9674 7.8538 124.2966 54.0174 18.8844 178.8737 61 K 4.2903 7.7407 113.0415 57.4488 33.8146 176.8636 62 D 4.3954 7.7741 120.0984 53.8653 41.3890 176.7123 63 A 4.2462 8.2666 124.6788 51.3333 20.6270 178.1251 64 E 3.9442 8.8292 121.5004 59.6931 29.5106 179.4497 65 G 3.6958 8.0905 104.8984 48.0930 0.0000 175.2038 66 D 4.3003 7.9232 120.6837 56.9048 40.8962 178.6062 67 L 3.8858 8.0290 119.6393 57.9365 41.5280 179.8060 68 S 4.0915 8.5329 115.4936 61.3132 62.8572 176.6860 69 K 3.8648 7.9775 122.3836 59.4633 32.1152 178.8996 70 L 3.8842 7.8435 119.2832 57.7069 41.4921 179.4936 71 R 3.9482 8.3142 118.8026 59.3921 29.8192 178.4726 72 A 4.1138 8.0374 119.4610 54.9023 18.3742 179.1754 73 A 3.9474 7.6068 118.0922 54.2618 18.4170 178.2690 74 L 3.7524 6.9505 114.9496 55.7977 43.2015 177.7673 75 V 3.3348 7.5698 120.0977 60.2167 29.8735 174.5635 76 N 4.6200 6.0904 119.9009 49.8335 41.3382 174.9374 77 E 3.9062 8.5527 122.0558 59.4296 29.7461 178.9340 78 K 3.9297 8.0098 118.9815 59.7593 32.2844 178.7513 79 S 4.5259 9.0099 115.6240 61.8670 62.7581 176.7778 80 F 4.6910 8.4005 120.4307 60.5469 38.5123 177.6645 81 A 4.1919 8.6336 121.0746 54.8186 18.1455 179.6170 82 K 3.9149 8.2745 118.2855 59.7158 32.1068 179.0620 83 I 3.7058 8.1324 119.8760 64.3919 37.0683 178.1380 84 A 4.0554 8.5682 121.8467 55.5079 18.2031 179.4920 85 N 4.3653 8.6408 115.4541 56.3530 38.3504 177.7549 86 S 4.2099 7.9890 114.7999 60.5227 63.1440 175.4648 87 L 4.4607 7.3643 120.3297 53.4061 42.1588 175.7690 88 N 4.2840 8.4205 116.1266 53.9294 36.9956 176.4130 89 L 4.3595 8.2794 121.5495 58.3190 42.0309 177.9442 90 G 3.6697 8.2375 105.2774 47.9241 0.0000 175.1057 91 D 4.1290 8.0668 119.9294 56.2449 40.7502 177.6637 92 F 4.7126 7.8935 116.1367 56.5683 40.5427 175.9574 93 I 4.1128 6.8921 119.9346 61.1642 37.7331 175.5399 94 L 4.2997 8.7532 127.8828 53.6557 42.8772 175.7279 95 M 5.3292 8.1089 119.9299 53.8211 34.3869 174.5990 96 S 4.4705 9.0131 114.4326 58.0452 64.0880 175.4937 97 V 3.5733 8.7061 120.6653 66.3760 31.0835 178.1093 98 A 3.9902 7.9862 119.7091 55.2062 18.2775 179.0623 99 E 3.8784 8.2667 117.8386 59.3006 29.7123 178.6141 100 E 3.9071 8.4850 119.6237 59.5036 29.5404 178.5882 101 N 4.4046 8.3377 115.5016 56.0320 38.5766 176.1155 102 N 4.8023 7.8044 115.7906 52.9917 38.8612 175.6273 103 G 3.8991 8.2413 109.2424 45.8308 0.0000 176.1809 104 G 3.6372 8.3031 111.7116 48.3178 0.0000 176.6447 105 K 4.1198 8.0191 117.4540 58.1280 32.1667 177.2274 106 E 4.4999 7.9757 116.7522 55.9748 30.5488 176.7038 107 K 4.2251 7.8475 121.1248 55.2585 33.2691 176.1217 108 P 4.3662 0.0000 0.0000 65.8095 31.2037 178.8539 109 S 4.2599 8.0507 113.7630 61.4655 62.9810 176.4966 110 I 3.7643 7.6964 123.0155 63.8856 36.9730 178.2132 111 L 3.9991 7.9757 119.8303 57.8628 41.4386 179.4601 112 S 4.2173 8.4872 113.3684 61.6282 62.2834 175.8506 113 D 4.3746 8.4006 121.3924 57.4416 40.5205 178.7713 114 A 3.9711 8.1257 121.2010 54.8742 18.3546 179.3719 115 L 3.8094 7.9425 118.8510 58.4749 42.2988 179.1530 116 E 3.7736 8.3306 118.3969 59.2395 29.2574 179.2014 117 A 4.1424 8.3397 121.2193 55.1090 18.3205 179.7369 118 I 3.6686 7.9300 118.4223 64.6963 37.1608 178.7188 119 I 3.6837 7.7622 120.7549 64.1702 36.7782 178.6200 120 G 3.6390 8.3414 106.6012 47.8434 0.0000 175.5607 121 A 4.0743 8.2517 123.5145 54.9008 18.4386 179.7730 122 I 3.1403 7.9623 118.5172 64.5104 36.9897 178.0210 123 H 4.1941 8.2670 119.1236 59.2233 29.4622 176.8589 124 L 3.9303 7.9960 121.2176 58.1490 42.0061 178.2857 125 E 4.2373 8.1062 115.5435 57.8407 30.1529 177.3549 126 A 4.6140 8.5603 118.7964 50.1790 20.8962 176.9144 127 G 3.9427 7.8091 103.0075 44.9767 0.0000 174.6026 128 F 4.2470 8.8091 119.8342 61.4728 39.3304 177.0170 129 E 3.8323 8.2499 117.6876 59.1349 29.2918 179.0292 130 F 3.8381 8.1106 120.0842 61.1401 39.5828 176.8397 131 A 3.8225 8.0515 120.4757 54.9391 18.0334 179.4573 132 K 3.5668 7.9528 118.3835 59.7750 32.1701 179.0373 133 T 3.7558 7.6470 115.8554 66.6931 68.3699 176.6220 134 I 3.6442 7.7394 121.2101 64.3418 37.0821 178.2949 135 A 3.9052 8.2003 121.9269 55.3081 18.2103 179.7365 136 L 3.7919 8.1621 117.7165 57.7196 41.5815 179.9038 137 R 3.8993 7.9222 118.1307 59.3475 29.6718 179.1099 138 L 4.0078 7.8734 118.6555 57.7232 41.4964 179.7485 139 I 3.8381 8.0537 119.9911 64.6768 36.6161 178.4794 140 E 3.6581 8.6549 119.7246 59.2552 29.0164 179.5708 141 K 4.1320 8.2154 117.8139 58.3652 32.1668 177.3411 142 N 4.7050 7.4400 113.0477 52.6614 41.0757 174.2352 143 F 5.4589 9.0699 117.3879 54.6569 39.3094 174.6067 144 P 4.7709 0.0000 0.0000 64.7886 31.9436 178.3217 145 Q 4.1821 8.2458 116.9132 58.1212 29.0735 176.1860 146 I 4.1682 7.7020 123.9188 61.4780 37.2627 175.2753 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 3 N 8.28 4.82 0.00 3.02 3.20 0.00 0.00 5.74 6.96 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 4 I 7.92 3.45 1.90 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.08 0.96 0.00 0.00 5 E 8.97 4.25 0.00 2.04 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 2.41 2.22 0.00 6 K 8.12 3.99 0.00 2.22 2.00 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.53 7.81 7 L 7.56 3.70 0.00 0.27 1.24 0.71 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.06 4.10 0.00 2.20 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 2.63 2.34 0.00 9 Q 8.25 4.02 0.00 2.32 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 10 S 7.94 4.17 0.00 4.04 3.92 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 11 L 8.29 4.17 0.00 1.85 1.82 1.06 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.52 3.52 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 1.27 0.00 0.00 13 Y 8.03 4.44 0.00 2.88 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 14 E 7.67 4.34 0.00 1.76 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 2.11 2.26 0.00 15 F 8.85 4.21 0.00 3.20 3.15 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 16 K 9.22 3.92 0.00 1.95 1.85 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.22 7.81 17 D 8.28 4.78 0.00 2.75 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 18 K 8.59 3.99 0.00 1.81 1.83 0.00 1.76 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.49 7.81 19 N 8.30 4.43 0.00 2.97 2.94 0.00 0.00 6.58 6.28 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 20 L 7.88 4.00 0.00 1.80 1.95 0.97 0.92 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 21 L 7.24 3.29 0.00 0.27 1.33 0.60 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.49 3.80 2.13 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 1.58 1.02 1.01 0.00 0.00 23 H 8.60 4.06 0.00 3.41 3.39 0.00 5.61 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 24 A 7.85 4.01 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 25 L 7.68 4.53 0.00 1.86 1.80 0.87 0.66 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 26 T 7.49 4.50 4.40 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 1.56 0.00 0.00 27 H 8.78 4.62 0.00 3.15 3.35 0.00 5.59 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.12 4.07 0.00 1.86 1.86 0.00 1.60 0.00 0.00 1.96 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.12 1.33 7.81 29 S 7.94 4.34 0.00 4.11 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 0.00 30 F 8.43 4.47 0.00 3.04 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 31 K 7.78 4.46 0.00 1.65 1.70 0.00 1.48 0.00 0.00 1.53 0.00 0.00 2.80 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.35 1.45 7.81 32 K 8.63 3.97 0.00 1.73 1.70 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.54 7.81 33 S 8.96 3.77 0.00 4.10 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 34 Y 7.88 4.54 0.00 2.77 2.80 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 35 N 8.07 4.88 0.00 2.91 2.80 0.00 0.00 6.28 8.04 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 36 N 8.75 4.64 0.00 3.00 3.22 0.00 0.00 7.45 7.26 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 37 E 8.60 3.96 0.00 2.11 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 2.33 2.43 0.00 38 R 7.84 3.95 0.00 1.80 1.96 0.00 3.09 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 39 L 7.79 4.03 0.00 1.74 1.85 0.70 0.82 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 40 E 8.55 4.01 0.00 2.16 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 2.49 2.50 0.00 41 F 8.31 4.12 0.00 3.16 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 42 L 8.24 3.88 0.00 1.92 1.85 0.92 0.94 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 43 G 8.54 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 44 D 8.65 4.88 0.00 2.92 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 45 A 7.57 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 7.79 3.59 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 1.11 0.00 0.00 0.88 0.00 0.00 47 L 8.32 4.10 0.00 1.82 1.85 0.61 0.86 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 48 D 8.40 4.39 0.00 2.88 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 49 L 7.88 3.96 0.00 1.71 1.87 0.84 0.31 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 50 V 8.36 3.76 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 0.91 0.00 0.00 0.89 0.00 0.00 51 V 8.33 3.86 2.24 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 1.03 0.00 0.00 1.03 0.00 0.00 52 G 8.40 3.72 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 0.00 0.00 0.00 53 E 8.75 4.00 0.00 2.13 2.37 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 2.50 2.44 0.00 54 Y 8.30 4.26 0.00 3.24 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 55 L 8.44 4.18 0.00 1.89 1.82 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.35 4.06 0.00 3.14 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 57 H 8.30 4.41 0.00 3.22 3.35 0.00 5.71 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 58 K 8.02 3.85 0.00 1.21 1.52 0.00 1.21 0.00 0.00 1.44 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.96 7.81 59 F 8.12 4.68 0.00 3.12 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 60 A 7.85 3.97 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 61 K 7.74 4.29 0.00 1.85 1.91 0.00 1.58 0.00 0.00 1.64 0.00 0.00 3.15 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.40 7.81 62 D 7.77 4.40 0.00 2.88 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.27 4.25 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 64 E 8.83 3.94 0.00 2.02 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 2.39 2.35 0.00 65 G 8.09 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 66 D 7.92 4.30 0.00 2.80 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 67 L 8.03 3.89 0.00 1.83 1.73 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.53 4.09 0.00 3.96 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 69 K 7.98 3.86 0.00 1.78 1.85 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 70 L 7.84 3.88 0.00 1.68 1.53 -0.29 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.31 3.95 0.00 1.86 2.02 0.00 3.25 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 72 A 8.04 4.11 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 73 A 7.61 3.95 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 74 L 6.95 3.75 0.00 1.70 1.55 0.98 0.48 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 V 7.57 3.33 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 0.90 0.00 0.00 0.99 0.00 0.00 76 N 6.09 4.62 0.00 2.83 2.76 0.00 0.00 5.74 7.66 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 77 E 8.55 3.91 0.00 2.06 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 2.41 2.42 0.00 78 K 8.01 3.93 0.00 1.86 1.94 0.00 1.79 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.58 7.81 79 S 9.01 4.53 0.00 3.61 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 80 F 8.40 4.69 0.00 3.09 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.63 4.19 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 82 K 8.27 3.91 0.00 2.03 2.14 0.00 1.58 0.00 0.00 1.30 0.00 0.00 2.81 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.38 1.46 7.81 83 I 8.13 3.71 2.16 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.01 0.94 0.00 0.00 84 A 8.57 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 85 N 8.64 4.37 0.00 2.95 2.90 0.00 0.00 6.82 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 7.99 4.21 0.00 4.03 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 87 L 7.36 4.46 0.00 1.82 1.75 0.91 1.00 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 88 N 8.42 4.28 0.00 3.10 3.11 0.00 0.00 6.60 6.27 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 89 L 8.28 4.36 0.00 2.02 1.73 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.24 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 91 D 8.07 4.13 0.00 1.98 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 0.00 0.00 0.00 0.00 92 F 7.89 4.71 0.00 3.07 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 6.89 4.11 1.86 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 1.25 0.71 0.89 0.00 0.00 94 L 8.75 4.30 0.00 0.89 0.13 0.74 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 95 M 8.11 5.33 0.00 1.95 2.03 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 2.49 2.52 0.00 96 S 9.01 4.47 0.00 4.10 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 97 V 8.71 3.57 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 1.13 0.00 0.00 0.96 0.00 0.00 98 A 7.99 3.99 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 99 E 8.27 3.88 0.00 2.16 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 0.00 2.21 2.30 0.00 100 E 8.48 3.91 0.00 2.14 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 0.00 2.30 2.34 0.00 101 N 8.34 4.40 0.00 2.86 2.88 0.00 0.00 7.12 7.61 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 0.00 102 N 7.80 4.80 0.00 2.86 2.84 0.00 0.00 7.13 7.77 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 0.00 103 G 8.24 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 0.00 104 G 8.30 3.64 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 0.00 0.00 0.00 105 K 8.02 4.12 0.00 1.74 1.86 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.43 7.81 106 E 7.98 4.50 0.00 2.09 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 2.25 2.24 0.00 107 K 7.85 4.23 0.00 1.95 1.75 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.65 7.81 108 P 0.00 4.37 0.00 2.43 2.34 0.00 3.72 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 2.21 2.04 0.00 109 S 8.05 4.26 0.00 4.11 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 0.00 110 I 7.70 3.76 2.10 0.00 0.00 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 1.69 0.86 0.93 0.00 0.00 111 L 7.98 4.00 0.00 1.90 1.76 0.99 0.74 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 0.00 112 S 8.49 4.22 0.00 4.04 4.01 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 0.00 0.00 0.00 113 D 8.40 4.37 0.00 2.97 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 0.00 114 A 8.13 3.97 1.39 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 0.00 0.00 115 L 7.94 3.81 0.00 1.75 1.73 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.33 3.77 0.00 2.02 1.93 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 1.99 2.58 0.00 117 A 8.34 4.14 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 0.00 118 I 7.93 3.67 1.99 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 1.47 0.70 0.99 0.00 0.00 119 I 7.76 3.68 1.86 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.66 0.81 0.00 0.00 120 G 8.34 3.64 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 0.00 0.00 0.00 121 A 8.25 4.07 1.57 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 0.00 122 I 7.96 3.14 1.64 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 0.01 0.43 -0.05 0.00 0.00 123 H 8.27 4.19 0.00 3.25 3.51 0.00 5.79 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 0.00 124 L 8.00 3.93 0.00 1.82 1.93 0.96 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.11 4.24 0.00 2.19 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 0.00 2.31 2.22 0.00 126 A 8.56 4.61 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 7.81 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 0.00 0.00 0.00 128 F 8.81 4.25 0.00 3.28 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 0.00 129 E 8.25 3.83 0.00 2.10 1.92 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 2.44 2.52 0.00 130 F 8.11 3.84 0.00 3.23 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 0.00 131 A 8.05 3.82 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 0.00 132 K 7.95 3.57 0.00 0.87 1.57 0.00 1.73 0.00 0.00 1.47 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.28 1.34 7.81 133 T 7.65 3.76 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 1.10 0.00 0.00 134 I 7.74 3.64 1.75 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.69 0.92 0.00 0.00 135 A 8.20 3.91 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 0.00 136 L 8.16 3.79 0.00 1.67 1.61 0.93 0.58 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 0.00 137 R 7.92 3.90 0.00 2.04 1.97 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 138 L 7.87 4.01 0.00 1.84 1.73 0.88 0.89 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 0.00 139 I 8.05 3.84 1.81 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 1.69 1.10 0.96 0.00 0.00 140 E 8.65 3.66 0.00 1.99 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 2.38 2.50 0.00 141 K 8.22 4.13 0.00 1.92 1.85 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.63 7.81 142 N 7.44 4.71 0.00 2.48 2.24 0.00 0.00 6.78 7.33 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 0.00 143 F 9.07 5.46 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.77 0.00 2.23 2.23 0.00 3.37 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 2.02 1.93 0.00 145 Q 8.25 4.18 0.00 2.30 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.95 0.00 0.00 0.00 0.00 0.00 2.54 2.42 0.00 146 I 7.70 4.17 2.00 0.00 0.00 0.78 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 0.77 0.96 0.00 0.00