NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9784 8.3549 109.7493 44.7797 0.0000 174.0278 2 L 4.6046 7.5701 117.6866 49.9976 44.8873 175.3479 3 S 4.4973 8.3561 117.1005 58.2359 66.2033 174.6353 4 D 4.8979 8.6659 121.7170 55.1526 39.6705 178.7972 5 G 3.6317 8.0018 107.7873 47.8768 0.0000 175.5117 6 E 3.8817 7.9028 121.1601 58.9293 29.4344 179.2729 7 W 4.3369 8.1007 119.1284 59.8455 29.1322 177.9652 8 Q 4.0618 8.6606 119.8394 59.6869 28.2866 178.9643 9 Q 4.0465 7.9768 118.6019 58.9349 28.7725 178.9802 10 V 3.6807 7.8387 119.1946 66.1916 31.4298 178.0681 11 L 4.2841 8.3598 117.3756 57.0221 41.8796 178.6138 12 N 4.4580 8.2214 117.6845 56.9012 38.8427 176.9853 13 V 3.5970 7.9198 119.5221 65.7037 31.6461 177.6077 14 W 4.4013 8.4820 127.7304 59.6050 30.3053 178.1596 15 G 3.6453 7.7482 104.7648 47.5652 0.0000 175.7134 16 K 4.0049 7.5489 120.7248 59.3587 32.0923 179.6089 17 V 2.7804 7.0105 117.9425 65.6202 31.1440 177.5418 18 E 3.9048 7.5254 116.2327 58.2318 29.3528 178.4223 19 A 4.2105 7.2833 118.7414 53.5567 20.1785 177.5245 20 D 4.6279 7.5066 114.5699 52.4258 43.4118 175.4458 21 I 3.5834 7.6562 123.4160 63.8098 38.5967 176.7059 22 A 4.1556 7.3399 122.6727 54.4945 18.3412 179.7536 23 G 3.4456 8.1806 104.0656 48.1365 0.0000 175.7192 24 H 4.1256 8.3347 118.9459 58.5688 28.7325 178.1975 25 G 3.5363 8.0779 107.5090 47.6345 0.0000 175.5774 26 Q 3.8330 7.9336 121.6738 59.1497 29.0485 178.2661 27 E 3.9291 8.0938 119.6487 59.0990 29.4157 179.2789 28 V 3.5983 7.9002 118.5487 66.1914 31.6407 178.0785 29 L 3.4842 7.7137 118.4364 57.5753 41.2419 179.8560 30 I 3.7068 7.4721 119.8657 64.1986 37.1653 178.3904 31 R 3.8002 8.5494 120.2766 59.1411 29.8963 178.1212 32 L 3.9122 8.3108 120.4502 58.3501 41.7594 178.8670 33 F 4.5631 8.2844 118.2165 60.9183 38.6570 177.7587 34 T 4.2258 8.0872 108.5123 64.2313 69.0019 177.1089 35 G 3.5571 7.7836 107.4829 46.5081 0.0000 173.7575 36 H 4.7785 7.8578 118.4726 51.7120 28.7829 172.2252 37 P 4.4113 0.0000 0.0000 65.1208 30.5815 178.2655 38 E 4.1087 8.2400 116.8053 59.2712 29.4088 179.0557 39 T 3.8172 8.1472 111.5335 64.5643 68.7754 176.0350 40 L 3.5814 7.8383 123.0637 58.1439 41.7339 178.8673 41 E 4.0970 7.7931 116.1447 58.8678 29.4279 178.8376 42 K 4.3850 8.2705 117.3996 56.6492 32.1281 176.5782 43 F 4.6641 7.9961 119.2367 55.5724 39.9304 176.3610 44 D 4.4218 8.7287 126.8233 56.5586 40.8966 177.5399 45 K 4.2315 7.7977 115.7215 57.2911 33.1687 176.8805 46 F 5.1509 7.7646 116.9572 57.0880 40.4323 176.8394 47 K 3.9766 8.4015 121.6743 59.7325 32.0549 177.9569 48 H 4.3275 8.3497 113.1090 58.1224 28.6973 176.1643 49 L 3.8704 7.1222 119.7218 55.1838 41.9060 176.5744 50 K 4.3438 8.7589 121.5031 57.0608 34.2446 176.6263 51 T 4.5836 7.5951 107.6464 59.6635 72.6226 174.5209 52 E 4.1166 8.4864 119.7026 58.1792 29.6299 178.2134 53 A 3.9720 7.8400 120.8097 55.4022 18.4527 179.1045 54 E 3.9310 7.7903 115.9318 59.9063 29.2896 179.6546 55 M 4.0271 7.4702 116.3856 58.2715 32.1044 178.6320 56 K 4.0506 7.9348 117.4488 59.2459 32.3384 178.7310 57 A 4.3168 8.1122 119.3418 52.3297 18.8587 177.2613 58 S 4.3453 7.2719 113.9863 57.7219 63.0588 174.8049 59 E 4.1794 8.8049 127.7943 59.1171 29.3044 178.5160 60 D 4.4977 8.1382 117.8255 56.8588 41.3420 177.7743 61 L 3.7537 7.6382 120.2662 57.6823 42.0954 178.8465 62 K 3.9247 7.6755 117.1862 59.1372 31.9411 179.0236 63 K 3.8947 8.0190 119.7309 60.1261 32.1740 179.0137 64 T 4.1473 8.4447 116.3564 66.5108 68.3608 176.8866 65 G 3.6058 8.5530 108.2313 48.1148 0.0000 175.9329 66 T 3.9216 7.9104 118.0482 66.2290 68.4647 176.9408 67 V 3.7150 7.8201 120.2032 66.0023 31.5615 178.0900 68 V 3.6624 7.9755 117.8117 66.3260 31.6091 178.1148 69 L 4.3538 8.6263 118.5593 57.7124 41.3076 179.7240 70 T 4.0460 8.5295 116.5459 66.3516 68.3528 176.5685 71 A 3.9515 8.2116 122.7283 55.0911 18.4637 179.3035 72 L 3.6231 7.8850 119.0016 58.2478 42.0930 179.3221 73 G 3.0636 7.9424 105.2997 47.5131 0.0000 175.7947 74 G 3.5762 7.5434 106.7650 47.5653 0.0000 175.7057 75 I 3.8268 7.4466 122.2639 64.1554 37.2095 178.4434 76 L 3.9352 8.0843 120.0763 57.7725 41.1759 179.5677 77 K 3.9870 7.5774 116.5932 58.2406 32.2680 178.7614 78 K 3.9147 8.1948 119.1423 56.0551 33.0384 176.2785 79 K 2.0000 7.8916 117.9999 56.3922 29.3033 176.1468 80 G 3.9269 7.3933 104.5859 46.1879 0.0000 172.9579 81 H 4.6692 7.1427 119.3327 55.0881 27.4000 174.7875 82 H 5.8457 7.3194 111.6680 53.6187 29.9540 176.7737 83 E 3.9676 8.6554 120.3798 60.7489 29.0546 177.6201 84 A 3.9745 7.9642 120.1573 54.9742 18.7935 178.9746 85 E 4.1280 8.1597 116.2036 58.7209 29.7529 178.7168 86 L 4.1556 8.0448 120.3407 57.1698 42.3988 178.0904 87 K 3.7802 7.9780 120.0070 59.3116 32.0598 176.3814 88 P 4.2624 0.0000 0.0000 66.2059 30.7692 177.5698 89 L 3.9602 7.9939 119.0708 57.9704 42.1067 178.5901 90 A 4.1398 8.6396 120.8441 55.2600 18.2694 179.6529 91 Q 3.8884 8.6969 117.0926 59.1142 28.7580 179.1807 92 S 4.0100 8.1699 115.2373 61.9130 63.0620 176.2768 93 H 4.1650 8.7005 119.9256 58.1389 28.5162 177.7275 94 A 2.5800 7.7971 122.9265 54.6344 17.9764 179.7971 95 T 3.6938 7.4131 106.9064 64.2015 69.2683 175.9157 96 K 3.9958 7.4227 121.0318 58.6511 32.6716 177.3569 97 H 4.2520 7.8363 114.2342 56.2177 29.4229 175.4641 98 K 3.5850 7.4378 116.6285 56.3579 28.7302 176.9576 99 I 4.3358 8.0946 119.3179 58.9100 37.5178 174.7509 100 P 4.1707 0.0000 0.0000 62.7947 31.9071 177.7617 101 I 3.5475 8.5942 121.7734 63.9170 37.6731 177.9146 102 K 3.6600 7.8006 120.1828 59.6547 31.9677 178.1474 103 Y 4.1908 7.9388 116.9616 60.9187 37.6491 178.2251 104 L 4.2473 7.8010 119.2911 57.0444 41.7243 178.9920 105 E 3.9231 7.8186 119.5696 59.2016 29.5634 178.3775 106 F 4.4626 8.0199 117.9304 61.0857 38.9827 177.7370 107 I 3.8045 8.1407 117.6666 63.9255 37.5550 178.1374 108 S 4.2489 7.9709 116.4296 61.5966 62.6080 176.2955 109 D 4.4434 8.5192 121.5241 57.3886 40.5879 178.5864 110 A 4.0492 8.4272 121.5206 55.2393 18.2781 179.8730 111 I 3.7216 7.7269 118.1312 64.5950 36.8370 178.6680 112 I 3.9421 7.6379 120.7321 64.8080 36.9279 177.5193 113 H 4.1825 8.5831 119.1341 59.3039 29.6429 176.9537 114 V 3.5330 8.1470 119.6485 66.3715 31.5056 178.0279 115 L 3.8486 7.8029 118.2107 58.3758 40.8398 179.4499 116 H 4.4731 8.0540 115.4521 58.8223 28.4462 177.8418 117 S 4.1418 7.8747 114.3597 60.8313 62.2652 175.6618 118 K 4.1639 7.9709 119.8803 57.2370 33.2677 176.4833 119 H 4.9568 7.9403 115.9005 53.4031 29.3959 172.1767 120 P 4.5423 0.0000 0.0000 63.9939 31.3979 177.0894 121 G 4.0881 9.4005 111.6136 45.3949 0.0000 172.7389 122 D 4.9871 8.4740 118.9246 53.1724 39.9965 176.1897 123 F 5.0463 8.1302 122.1017 55.8962 39.3269 174.8215 124 G 3.9166 8.2806 111.1104 44.4533 0.0000 170.6825 125 A 3.9627 8.4489 123.2900 54.7232 18.3910 180.1132 126 D 4.2122 7.9454 117.1396 56.6083 39.5967 178.5603 127 A 4.3031 7.7109 123.4335 54.2653 18.4320 179.1145 128 Q 3.7244 8.1547 118.6485 59.5312 29.0371 178.1583 129 G 3.5812 7.8673 105.9899 47.5798 0.0000 175.0835 130 A 3.8505 8.3844 122.6113 54.7646 18.6486 179.3922 131 M 4.0167 8.3178 116.6163 59.2037 32.2391 178.5685 132 T 3.9381 8.2410 116.0461 66.5998 68.5721 176.8798 133 K 4.1859 8.1569 121.0625 58.8131 32.1499 179.3256 134 A 3.8785 7.9439 121.0880 55.1510 18.3065 179.7512 135 L 4.1198 8.1488 117.5285 57.8216 41.5979 179.5949 136 E 4.0196 8.3684 118.9102 59.2634 29.4375 179.0348 137 L 4.1056 8.2171 120.5736 57.9815 42.1098 178.8051 138 F 4.1298 8.2164 120.1419 61.4328 39.3652 177.0303 139 R 3.5563 8.1262 118.2673 59.2288 29.8991 178.0211 140 N 4.1993 8.6561 117.0564 56.9359 39.1230 176.7214 141 D 4.3865 7.9569 120.1032 57.2344 40.7145 179.0245 142 I 3.5227 7.3055 119.8696 64.1091 37.0774 177.9473 143 A 3.7872 7.8662 121.6454 55.2050 18.0890 179.6015 144 A 3.9423 7.8702 118.6940 55.4199 18.4165 180.0697 145 K 4.0046 7.9232 116.5048 59.8653 32.0694 179.2726 146 Y 4.2098 8.4972 117.5269 60.7516 37.7520 178.3567 147 K 3.9843 8.2670 120.7175 59.6288 32.1525 178.5903 148 E 4.0041 8.1050 117.5744 59.4031 29.5232 178.6929 149 L 4.3604 7.6996 116.0733 54.1772 41.9503 177.2988 150 G 3.9273 7.9265 106.7284 46.4282 0.0000 175.2826 151 F 4.6712 7.9782 120.6588 56.9917 37.5382 174.9461 152 Q 3.9773 7.9928 123.2569 59.0754 28.7510 177.9566 153 G 3.4418 7.4848 110.6240 44.7238 0.0000 173.1813 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 3.98 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 2 L 7.57 4.60 0.00 0.62 0.89 0.42 -0.92 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 8.36 4.50 0.00 4.07 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 4 D 8.67 4.90 0.00 3.11 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.00 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 6 E 7.90 3.88 0.00 1.95 1.67 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 2.19 2.25 0.00 7 W 8.10 4.34 0.00 3.37 3.20 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 8 Q 8.66 4.06 0.00 2.37 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 9 Q 7.98 4.05 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 10 V 7.84 3.68 2.44 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 1.17 0.00 0.00 0.80 0.00 0.00 11 L 8.36 4.28 0.00 1.73 1.80 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.22 4.46 0.00 3.05 2.92 0.00 0.00 6.66 7.10 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 13 V 7.92 3.60 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 0.82 0.00 0.00 1.16 0.00 0.00 14 W 8.48 4.40 0.00 3.56 3.07 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 0.00 15 G 7.75 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 16 K 7.55 4.00 0.00 1.63 1.51 0.00 1.30 0.00 0.00 0.91 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.29 7.81 17 V 7.01 2.78 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 -0.09 0.00 0.00 0.27 0.00 0.00 18 E 7.53 3.90 0.00 1.92 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 2.27 1.98 0.00 19 A 7.28 4.21 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 20 D 7.51 4.63 0.00 2.69 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 0.00 0.00 0.00 0.00 21 I 7.66 3.58 1.78 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 1.54 1.09 0.89 0.00 0.00 22 A 7.34 4.16 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 23 G 8.18 3.45 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 0.00 24 H 8.33 4.13 0.00 3.14 3.20 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 8.08 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 26 Q 7.93 3.83 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 27 E 8.09 3.93 0.00 1.99 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 2.26 2.38 0.00 28 V 7.90 3.60 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 1.01 0.00 0.00 0.99 0.00 0.00 29 L 7.71 3.48 0.00 1.30 0.62 0.67 0.58 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 30 I 7.47 3.71 1.90 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.78 0.88 0.00 0.00 31 R 8.55 3.80 0.00 1.91 2.08 0.00 3.00 0.00 0.00 2.95 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 32 L 8.31 3.91 0.00 1.65 1.44 1.06 1.01 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 33 F 8.28 4.56 0.00 3.00 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 34 T 8.09 4.23 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 1.25 0.00 0.00 35 G 7.78 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 36 H 7.86 4.78 0.00 2.90 3.06 0.00 5.65 0.00 0.00 0.00 0.00 6.84 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 4.41 0.00 2.25 2.33 0.00 3.87 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.89 0.00 38 E 8.24 4.11 0.00 2.32 2.35 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 2.42 2.61 0.00 39 T 8.15 3.82 4.34 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 0.71 0.00 0.00 40 L 7.84 3.58 0.00 1.47 1.70 -0.10 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.79 4.10 0.00 2.31 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 0.00 2.39 2.56 0.00 42 K 8.27 4.38 0.00 1.90 1.78 0.00 1.91 0.00 0.00 1.81 0.00 0.00 3.21 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.77 2.02 7.81 43 F 8.00 4.66 0.00 3.26 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 44 D 8.73 4.42 0.00 2.65 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 7.80 4.23 0.00 1.64 1.73 0.00 1.28 0.00 0.00 1.50 0.00 0.00 2.51 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.65 0.21 7.81 46 F 7.76 5.15 0.00 2.83 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 47 K 8.40 3.98 0.00 1.79 1.91 0.00 1.78 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.61 1.56 7.81 48 H 8.35 4.33 0.00 3.28 3.43 0.00 5.55 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.12 3.87 0.00 1.67 1.56 0.68 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.76 4.34 0.00 1.80 1.79 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.36 7.81 51 T 7.60 4.58 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 1.27 0.00 0.00 52 E 8.49 4.12 0.00 2.04 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 2.35 2.35 0.00 53 A 7.84 3.97 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 54 E 7.79 3.93 0.00 2.03 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 2.32 2.48 0.00 55 M 7.47 4.03 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.52 0.00 56 K 7.93 4.05 0.00 1.90 1.85 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.57 7.81 57 A 8.11 4.32 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 58 S 7.27 4.35 0.00 3.94 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 59 E 8.80 4.18 0.00 2.05 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 2.32 0.00 60 D 8.14 4.50 0.00 2.91 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.64 3.75 0.00 1.44 1.61 0.78 0.45 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 7.68 3.92 0.00 2.04 1.83 0.00 1.69 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.42 7.81 63 K 8.02 3.89 0.00 2.02 2.08 0.00 1.69 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.54 7.81 64 T 8.44 4.15 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 1.51 0.00 0.00 65 G 8.55 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 T 7.91 3.92 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 1.24 0.00 0.00 67 V 7.82 3.71 2.29 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 1.08 0.00 0.00 1.02 0.00 0.00 68 V 7.98 3.66 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 1.06 0.00 0.00 1.15 0.00 0.00 69 L 8.63 4.35 0.00 1.81 1.81 0.83 0.90 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 8.53 4.05 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 71 A 8.21 3.95 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 72 L 7.89 3.62 0.00 1.57 1.57 -0.10 1.12 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 7.94 3.06 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 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.54 3.58 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 0.00 0.00 0.00 75 I 7.45 3.83 1.81 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.59 0.91 0.00 0.00 76 L 8.08 3.94 0.00 1.10 1.53 0.21 1.07 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 77 K 7.58 3.99 0.00 1.63 1.78 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.30 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.60 7.81 78 K 8.19 3.91 0.00 1.72 1.82 0.00 1.78 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.63 1.58 7.81 79 K 7.89 2.00 0.00 1.11 0.74 0.00 1.58 0.00 0.00 1.43 0.00 0.00 2.72 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.77 1.06 7.81 80 G 7.39 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 81 H 7.14 4.67 0.00 3.20 3.20 0.00 5.62 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 7.32 5.85 0.00 3.28 3.43 0.00 5.65 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 83 E 8.66 3.97 0.00 2.28 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 2.37 2.45 0.00 84 A 7.96 3.97 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 85 E 8.16 4.13 0.00 2.10 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 2.42 0.00 86 L 8.04 4.16 0.00 1.82 1.81 0.80 0.30 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 87 K 7.98 3.78 0.00 1.97 1.89 0.00 1.72 0.00 0.00 1.79 0.00 0.00 3.17 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.49 7.81 88 P 0.00 4.26 0.00 2.33 2.34 0.00 3.69 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 2.32 2.16 0.00 89 L 7.99 3.96 0.00 2.01 1.91 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 90 A 8.64 4.14 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 91 Q 8.70 3.89 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 92 S 8.17 4.01 0.00 4.05 4.37 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 93 H 8.70 4.16 0.00 3.52 3.62 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 7.80 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.41 3.69 4.10 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 0.00 0.00 0.00 1.05 0.00 0.00 96 K 7.42 4.00 0.00 1.55 1.53 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.23 1.34 7.81 97 H 7.84 4.25 0.00 3.04 3.16 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 7.44 3.58 0.00 1.92 1.98 0.00 1.76 0.00 0.00 2.36 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.26 1.30 7.81 99 I 8.09 4.34 2.15 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.96 1.18 0.00 0.00 100 P 0.00 4.17 0.00 1.59 1.65 0.00 3.29 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 0.54 1.67 0.00 101 I 8.59 3.55 1.78 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.11 0.82 0.00 0.00 102 K 7.80 3.66 0.00 1.69 1.49 0.00 1.29 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 0.88 7.81 103 Y 7.94 4.19 0.00 3.24 3.10 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 0.00 0.00 0.00 0.00 104 L 7.80 4.25 0.00 1.77 1.70 0.79 1.02 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 0.00 105 E 7.82 3.92 0.00 2.11 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 2.35 2.34 0.00 106 F 8.02 4.46 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 8.14 3.80 2.02 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.40 1.15 0.00 0.00 108 S 7.97 4.25 0.00 4.08 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 8.52 4.44 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 8.43 4.05 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 0.00 111 I 7.73 3.72 2.09 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.74 1.00 0.00 0.00 112 I 7.64 3.94 2.16 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.29 1.12 0.00 0.00 113 H 8.58 4.18 0.00 3.30 3.53 0.00 5.81 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 0.00 114 V 8.15 3.53 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 0.93 0.00 0.00 0.96 0.00 0.00 115 L 7.80 3.85 0.00 1.59 0.59 0.34 0.78 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 0.00 116 H 8.05 4.47 0.00 3.39 3.40 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 7.87 4.14 0.00 3.79 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.97 4.16 0.00 1.54 1.43 0.00 1.41 0.00 0.00 1.24 0.00 0.00 2.56 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.25 1.31 7.81 119 H 7.94 4.96 0.00 3.25 3.61 0.00 5.64 0.00 0.00 0.00 0.00 6.75 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 4.54 0.00 2.19 2.12 0.00 3.46 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 121 G 9.40 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.47 4.99 0.00 2.73 2.73 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 0.00 0.00 0.00 123 F 8.13 5.05 0.00 2.78 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 0.00 124 G 8.28 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 0.00 0.00 0.00 125 A 8.45 3.96 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 7.95 4.21 0.00 2.86 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 7.71 4.30 1.51 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 0.00 0.00 0.00 128 Q 8.15 3.72 0.00 1.28 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 129 G 7.87 3.58 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 0.00 0.00 0.00 130 A 8.38 3.85 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 0.00 131 M 8.32 4.02 0.00 2.36 2.32 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.80 0.00 132 T 8.24 3.94 4.39 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 1.27 0.00 0.00 133 K 8.16 4.19 0.00 1.80 1.70 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.25 7.81 134 A 7.94 3.88 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 8.15 4.12 0.00 1.92 1.83 1.05 0.76 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 0.00 136 E 8.37 4.02 0.00 2.15 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 2.34 2.42 0.00 137 L 8.22 4.11 0.00 1.82 1.96 1.01 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.22 4.13 0.00 3.15 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 0.00 139 R 8.13 3.56 0.00 2.16 2.00 0.00 3.11 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 140 N 8.66 4.20 0.00 2.89 2.78 0.00 0.00 7.22 8.42 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 0.00 141 D 7.96 4.39 0.00 3.01 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 0.00 142 I 7.31 3.52 1.33 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.18 0.11 0.00 0.00 143 A 7.87 3.79 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 0.00 144 A 7.87 3.94 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 0.00 145 K 7.92 4.00 0.00 2.06 1.96 0.00 1.83 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.55 7.81 146 Y 8.50 4.21 0.00 3.20 3.06 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 0.00 0.00 0.00 147 K 8.27 3.98 0.00 1.87 1.99 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.49 7.81 148 E 8.10 4.00 0.00 2.20 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 2.37 2.39 0.00 149 L 7.70 4.36 0.00 1.56 1.66 0.86 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.93 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 0.00 151 F 7.98 4.67 0.00 2.68 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 0.00 152 Q 7.99 3.98 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.68 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 153 G 7.48 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00