NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4040 8.3049 120.3478 55.2718 33.4190 174.6303 2 Q 4.1105 8.5113 124.1176 54.6703 29.7494 173.9308 3 I 4.5730 8.8786 124.0796 59.6140 40.8926 174.0210 4 Y 4.7321 8.6193 122.8866 56.1719 40.1773 174.7117 5 E 4.7729 8.5848 120.2384 55.3946 32.4261 174.1808 6 G 4.1382 8.3828 108.6950 43.3447 0.0000 173.9254 7 K 4.3378 8.4399 123.1555 56.6936 33.8128 177.0579 8 L 4.7381 8.2894 115.9888 54.5593 42.1778 176.6830 9 T 4.3867 7.8551 109.4116 61.2040 69.9406 174.2834 10 A 4.7216 8.8988 126.8892 51.6624 19.5164 175.6289 11 E 4.3163 7.5997 118.5450 58.1142 29.8238 177.6651 12 G 3.9475 8.8701 113.1867 45.6534 0.0000 173.4844 13 L 4.2647 7.6918 119.5740 54.1646 42.6682 176.3527 14 R 4.6244 8.5381 120.5490 54.3789 33.3543 174.5682 15 F 5.2150 8.9733 122.3887 55.5333 42.7558 174.4045 16 G 4.4625 8.9041 109.3532 44.6079 0.0000 172.3161 17 I 5.0743 8.9879 125.0018 59.2462 40.4897 174.5440 18 V 4.8658 8.6250 126.8687 61.0582 33.8277 174.0593 19 A 5.3261 9.0607 130.1812 50.0377 21.9509 175.6972 20 S 4.9099 8.8257 117.5666 58.4579 64.4442 175.0805 21 R 4.4772 8.4290 118.8960 57.3224 31.0548 177.3495 22 F 4.1812 8.2310 121.5932 58.6248 40.2869 174.6768 23 N 3.9019 7.5933 120.7935 54.4849 36.0150 176.2693 24 H 4.1367 8.1185 115.5927 58.6394 28.3716 176.0181 25 A 4.0396 7.5422 122.2714 54.2823 18.3617 178.5651 26 L 4.2797 7.9005 117.4631 56.9358 42.3942 179.1573 27 V 3.6017 7.6240 117.6699 66.1850 31.4810 177.6197 28 D 4.3953 8.6478 118.9577 57.3821 40.5751 179.0542 29 R 4.2604 7.8293 119.6043 58.6312 30.0985 178.8445 30 L 4.2300 7.7132 118.6093 57.7191 41.5826 179.6651 31 V 3.5760 8.1542 118.5774 66.0266 31.0400 177.7491 32 E 4.0805 8.2826 118.4576 59.5759 29.3264 179.7632 33 G 3.7904 8.3712 105.3609 47.7308 0.0000 175.6021 34 A 3.9241 8.4595 123.7132 54.9212 18.2962 179.8565 35 I 3.5820 7.8815 118.3149 64.4169 37.1093 178.0018 36 D 4.3487 8.2523 118.9875 57.5773 41.1605 177.8652 37 C 3.6769 7.9582 118.9379 62.3307 31.3545 175.5262 38 I 3.3954 7.3795 121.1196 64.4266 36.7375 178.6743 39 V 4.1650 7.8619 120.4885 65.5255 31.2417 177.6376 40 R 4.2924 8.1495 115.1481 57.4394 30.3850 176.6559 41 H 4.5106 7.9399 115.9099 55.6796 29.1714 176.5455 42 G 4.0513 8.3134 109.0653 44.9593 0.0000 174.3081 43 G 4.0086 8.2525 109.4286 45.1415 0.0000 173.4139 44 R 4.5817 8.3220 120.8865 54.6030 31.5505 177.7878 45 E 4.0502 8.7849 119.7634 59.4207 29.7573 178.9837 46 E 4.0620 8.1973 117.6312 58.6489 29.8584 177.0153 47 D 4.7757 8.2025 118.1593 54.0659 41.0403 175.1735 48 I 5.0139 7.5879 120.8490 60.2056 38.9602 175.2411 49 T 4.5784 8.9652 123.5328 61.6654 71.0478 172.7441 50 L 5.0686 8.6080 128.6879 53.3154 43.9967 175.2731 51 V 4.4146 8.9797 126.8862 61.2434 33.7570 174.3224 52 R 5.1765 8.6147 126.5935 54.9907 32.0062 175.8740 53 V 4.5724 8.3650 114.9372 59.2059 36.3305 175.1299 54 P 4.3014 0.0000 0.0000 65.3115 32.4379 176.8684 55 G 4.5894 8.3318 105.9243 42.7574 0.0000 173.3664 56 S 4.1877 8.7798 114.5964 61.2276 62.3590 176.6365 57 W 4.2669 8.3838 130.0158 60.4960 30.1293 176.8945 58 E 4.2884 8.3109 116.1301 56.9557 29.1409 178.3597 59 I 3.7044 7.5814 121.2772 63.9720 37.1497 176.1673 60 P 4.1908 0.0000 0.0000 65.6597 30.7860 179.0857 61 V 3.5705 7.6160 117.1288 64.7030 31.3757 178.0760 62 A 3.9744 7.7733 120.4047 54.8151 18.2099 179.4432 63 A 4.0602 8.4263 119.8456 55.2157 18.1087 180.0936 64 G 3.6330 8.4647 104.7175 47.8771 0.0000 175.9136 65 E 4.0036 7.6768 119.4879 59.2470 29.8235 179.0739 66 L 4.1130 7.8947 118.7861 57.7533 41.5076 179.3801 67 A 4.1205 8.2857 119.5728 54.4963 18.3986 179.2899 68 R 4.0780 7.5148 115.1937 56.9858 30.8857 177.2797 69 K 4.1091 7.5259 120.1750 56.0294 32.5368 177.8573 70 E 3.9680 8.8408 124.6716 58.6921 29.8257 176.7846 71 D 4.7548 7.9807 116.3216 52.7829 39.7033 175.4322 72 I 4.3563 7.3362 120.3453 60.1869 38.8094 175.3717 73 D 4.6031 8.8794 125.7611 56.5071 41.6845 176.5855 74 A 4.6612 7.4941 117.4084 50.8191 22.9260 175.1827 75 V 4.8999 8.5930 119.6162 61.1335 34.7928 174.4488 76 I 4.8119 9.1880 128.1987 58.7654 39.5102 174.2184 77 A 5.0836 8.6740 129.6876 50.5393 21.0423 175.7066 78 I 4.9281 7.9975 123.2981 58.5217 40.9745 175.0896 79 G 4.2517 7.9843 111.7566 46.5162 0.0000 171.9647 80 V 4.8192 8.3752 118.9679 61.1350 34.1293 174.2645 81 L 5.0415 9.2969 128.6911 53.1510 44.1733 175.7027 82 I 5.1696 8.5036 123.2879 59.1550 40.3571 175.3345 83 R 3.4826 8.4094 128.1395 56.4341 30.1664 176.7751 84 G 4.2519 8.4512 115.7694 45.0319 0.0000 173.4403 85 A 4.1117 8.6828 122.3317 53.9550 19.0252 177.5518 86 T 4.5473 7.5301 105.2896 59.2934 71.2322 172.5987 87 P 4.5307 0.0000 0.0000 63.6401 31.7662 177.2098 88 H 4.1665 8.5415 120.5815 59.9991 29.5519 176.1346 89 F 4.0495 8.5275 121.5747 61.7369 39.0441 176.5554 90 D 4.2768 8.0287 117.6028 57.8574 40.6121 178.7572 91 Y 4.2178 7.3979 116.3478 60.9070 37.8928 178.2314 92 I 3.9304 8.0123 120.6354 64.5104 37.2995 178.2276 93 A 3.8580 8.0043 121.9800 55.2219 17.9703 179.6246 94 S 3.9858 8.1258 111.5088 61.5973 62.4188 176.1489 95 E 4.0129 8.3046 121.0118 58.6624 29.3245 179.3105 96 V 3.4977 8.0600 119.1519 65.7936 31.6436 178.2718 97 S 3.9508 8.0517 114.0553 61.3319 62.7955 176.1767 98 K 3.8967 8.2483 124.1936 58.9575 31.7984 178.9276 99 G 3.4708 8.2491 106.0561 47.8148 0.0000 175.7108 100 L 3.9781 7.8885 121.5719 57.2715 41.7045 179.5585 101 A 3.9369 8.0438 120.6922 55.1781 18.2629 179.3928 102 N 4.2547 8.3278 115.2472 56.5590 38.5634 177.6381 103 L 3.9543 8.1979 120.6439 57.7447 41.7690 179.5183 104 S 4.2588 8.0564 114.3953 60.8061 62.0350 176.3162 105 L 3.9953 7.7664 121.1519 57.7477 41.1694 179.0677 106 E 3.9990 8.2714 118.3594 58.9972 29.7513 178.0977 107 L 4.2959 8.0568 115.8015 53.7282 42.9970 176.4393 108 R 3.9370 7.4363 116.1645 56.4284 27.9432 176.2830 109 K 4.5267 7.9419 117.1172 54.1559 36.7615 174.0607 110 P 4.3117 0.0000 0.0000 62.8537 32.4863 175.1874 111 I 5.1003 8.2084 124.3942 59.8400 39.8350 174.9949 112 T 4.5031 9.1749 117.9511 60.3588 71.6657 173.7262 113 F 4.7608 8.8151 125.8648 56.2053 39.2291 174.7574 114 G 4.0287 8.8144 115.6801 45.9900 0.0000 170.2383 115 V 4.5570 6.5788 120.7067 60.6140 32.9768 175.1958 116 I 4.0826 8.5718 130.1777 61.4578 38.3834 175.3431 117 T 5.1677 8.7154 116.4011 59.7549 69.5889 172.1651 118 A 4.8345 9.4430 131.0911 50.6368 21.3520 177.4771 119 D 4.0389 8.9582 121.5455 56.3942 41.5964 177.5936 120 T 4.6927 7.5401 107.9108 58.8085 73.1376 174.3913 121 L 3.9219 8.3607 123.3592 58.2909 42.0562 178.7114 122 E 3.8908 8.1913 118.7129 59.6816 29.3036 178.7561 123 Q 4.1946 8.1748 117.5311 58.2921 28.8824 178.5182 124 A 4.1385 7.8583 121.4447 55.1145 18.5732 179.6210 125 I 3.6224 8.0799 118.7637 64.7411 36.7069 178.4324 126 E 4.5031 8.3148 120.6925 58.4615 29.2906 178.6766 127 R 4.4918 7.7223 115.3003 55.6654 30.7822 176.6010 128 A 4.9681 8.0552 121.9786 51.8131 19.2443 177.2945 129 G 4.2020 9.0554 106.9932 46.4794 0.0000 174.0895 130 T 4.6370 7.2915 112.6357 61.1425 68.4141 177.7678 131 K 4.1436 8.9449 118.7796 58.7987 32.7882 177.0401 132 H 4.7561 8.6055 116.8112 55.3379 29.6506 175.8061 133 G 3.6872 8.7281 108.5706 44.8117 0.0000 172.7626 134 N 5.3422 8.3282 118.1411 51.1777 41.6315 176.0523 135 K 4.2731 9.0003 129.1051 58.8317 32.1184 179.8072 136 G 3.5445 8.2024 106.2996 47.4485 0.0000 175.3951 137 W 4.0883 8.6210 131.1518 60.1706 30.7093 177.9162 138 E 4.1191 8.4982 118.2601 59.5331 28.9685 179.2339 139 A 3.9903 8.3180 120.7294 55.0190 18.2891 179.5993 140 A 3.6644 8.0391 119.4768 54.9703 18.3764 179.5584 141 L 3.5069 7.8154 119.1691 58.2709 42.0225 179.4210 142 S 4.1011 8.1811 114.9189 61.4840 62.6508 176.5583 143 A 3.9984 7.9732 123.5135 55.0153 18.0610 179.6722 144 I 3.8657 7.8881 118.7112 64.5419 37.1271 178.0745 145 E 4.2045 7.9608 121.2508 59.1425 29.4111 178.8482 146 M 4.0702 8.2600 118.4049 58.2753 31.8867 178.5448 147 A 3.9616 8.3273 121.2501 55.3743 18.5295 179.4823 148 N 4.3442 8.4410 115.0093 56.2515 38.5119 177.3481 149 L 4.0631 8.3637 122.0938 58.4429 42.2805 179.1625 150 F 4.0899 8.9333 117.5708 59.9748 38.5393 177.6629 151 K 4.0424 7.9217 117.9750 58.8064 31.8380 178.2717 152 S 4.6426 7.4184 110.2229 59.5422 64.1435 175.8213 153 L 3.6816 8.0322 123.5936 57.0711 41.8653 176.3681 154 R 3.7362 7.6019 122.8251 56.2356 30.0110 175.5764 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 4.40 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 2 Q 8.51 4.11 0.00 2.22 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.55 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 3 I 8.88 4.57 1.83 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 1.43 0.60 0.93 0.00 0.00 4 Y 8.62 4.73 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.58 4.77 0.00 2.08 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 2.21 2.34 0.00 6 G 8.38 4.14 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 0.00 0.00 0.00 7 K 8.44 4.34 0.00 1.98 2.01 0.00 1.48 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.49 7.81 8 L 8.29 4.74 0.00 1.67 1.68 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 9 T 7.86 4.39 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 10 A 8.90 4.72 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 7.60 4.32 0.00 1.96 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 2.30 2.29 0.00 12 G 8.87 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 0.00 0.00 0.00 13 L 7.69 4.26 0.00 1.74 0.95 1.09 0.56 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 14 R 8.54 4.62 0.00 1.66 1.70 0.00 3.08 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.44 0.00 15 F 8.97 5.22 0.00 3.03 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 16 G 8.90 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.99 5.07 1.88 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 1.08 0.66 0.94 0.00 0.00 18 V 8.63 4.87 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 1.10 0.00 0.00 0.96 0.00 0.00 19 A 9.06 5.33 1.20 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 0.00 0.00 20 S 8.83 4.91 0.00 4.03 4.15 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 21 R 8.43 4.48 0.00 1.95 2.07 0.00 3.21 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 22 F 8.23 4.18 0.00 3.09 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 N 7.59 3.90 0.00 2.89 2.76 0.00 0.00 6.85 8.16 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 24 H 8.12 4.14 0.00 3.34 3.83 0.00 5.46 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 A 7.54 4.04 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 26 L 7.90 4.28 0.00 1.76 1.68 0.88 0.92 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 27 V 7.62 3.60 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 1.19 0.00 0.00 1.06 0.00 0.00 28 D 8.65 4.40 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 29 R 7.83 4.26 0.00 1.94 1.98 0.00 3.56 0.00 0.00 3.29 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.51 0.00 30 L 7.71 4.23 0.00 1.80 1.71 0.90 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.15 3.58 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 1.03 0.00 0.00 0.97 0.00 0.00 32 E 8.28 4.08 0.00 2.28 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 2.35 2.48 0.00 33 G 8.37 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.46 3.92 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 35 I 7.88 3.58 1.87 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 1.39 0.78 0.91 0.00 0.00 36 D 8.25 4.35 0.00 2.93 3.02 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 0.00 0.00 0.00 37 C 7.96 3.68 0.00 1.41 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.38 3.40 1.84 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.27 0.93 0.00 0.00 39 V 7.86 4.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.94 0.00 0.00 40 R 8.15 4.29 0.00 1.98 1.98 0.00 3.25 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.81 0.00 41 H 7.94 4.51 0.00 3.44 3.39 0.00 5.77 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.31 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.25 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 0.00 0.00 0.00 44 R 8.32 4.58 0.00 2.04 2.09 0.00 3.15 0.00 0.00 3.40 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 45 E 8.78 4.05 0.00 2.20 2.23 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 2.37 2.41 0.00 46 E 8.20 4.06 0.00 1.97 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 2.32 2.40 0.00 47 D 8.20 4.78 0.00 2.91 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 48 I 7.59 5.01 2.02 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 1.36 0.77 0.95 0.00 0.00 49 T 8.97 4.58 4.25 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 1.22 0.00 0.00 50 L 8.61 5.07 0.00 1.62 1.56 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.98 4.41 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 0.99 0.00 0.00 0.94 0.00 0.00 52 R 8.61 5.18 0.00 1.74 1.84 0.00 3.21 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 53 V 8.37 4.57 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 0.83 0.00 0.00 1.02 0.00 0.00 54 P 0.00 4.30 0.00 2.05 2.14 0.00 3.85 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.02 0.00 55 G 8.33 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.78 4.19 0.00 3.95 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 57 W 8.38 4.27 0.00 3.38 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 58 E 8.31 4.29 0.00 2.35 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 59 I 7.58 3.70 1.97 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 1.52 0.88 0.90 0.00 0.00 60 P 0.00 4.19 0.00 1.95 1.98 0.00 3.55 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.05 0.00 61 V 7.62 3.57 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 0.91 0.00 0.00 0.91 0.00 0.00 62 A 7.77 3.97 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 A 8.43 4.06 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 64 G 8.46 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 65 E 7.68 4.00 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 66 L 7.89 4.11 0.00 1.85 1.71 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 67 A 8.29 4.12 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 68 R 7.51 4.08 0.00 1.95 1.99 0.00 3.16 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 69 K 7.53 4.11 0.00 1.97 1.94 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.37 7.81 70 E 8.84 3.97 0.00 1.91 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 2.28 2.23 0.00 71 D 7.98 4.75 0.00 2.78 2.70 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 72 I 7.34 4.36 1.93 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 1.27 1.06 0.94 0.00 0.00 73 D 8.88 4.60 0.00 2.24 2.53 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 0.00 74 A 7.49 4.66 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 75 V 8.59 4.90 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 0.85 0.00 0.00 0.94 0.00 0.00 76 I 9.19 4.81 1.84 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.23 0.84 0.00 0.00 77 A 8.67 5.08 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 78 I 8.00 4.93 1.84 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 1.05 1.66 0.88 0.00 0.00 79 G 7.98 4.25 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 0.00 80 V 8.38 4.82 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 0.88 0.00 0.00 0.92 0.00 0.00 81 L 9.30 5.04 0.00 1.77 1.69 0.79 0.72 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 82 I 8.50 5.17 1.98 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 1.28 0.70 0.88 0.00 0.00 83 R 8.41 3.48 0.00 0.67 1.57 0.00 3.02 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.24 0.00 84 G 8.45 4.25 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 0.00 85 A 8.68 4.11 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 86 T 7.53 4.55 4.30 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 1.23 0.00 0.00 87 P 0.00 4.53 0.00 2.46 2.36 0.00 3.81 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 2.24 2.05 0.00 88 H 8.54 4.17 0.00 3.35 3.47 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.53 4.05 0.00 3.22 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 90 D 8.03 4.28 0.00 2.38 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 91 Y 7.40 4.22 0.00 3.07 3.04 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 0.00 0.00 0.00 92 I 8.01 3.93 1.82 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 1.39 0.81 1.06 0.00 0.00 93 A 8.00 3.86 0.89 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 0.00 0.00 94 S 8.13 3.99 0.00 3.90 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 0.00 95 E 8.30 4.01 0.00 2.11 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.69 0.00 96 V 8.06 3.50 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 1.11 0.00 0.00 1.02 0.00 0.00 97 S 8.05 3.95 0.00 3.65 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 98 K 8.25 3.90 0.00 1.81 1.86 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.39 1.58 7.81 99 G 8.25 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.89 3.98 0.00 1.78 1.79 1.15 0.78 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 0.00 101 A 8.04 3.94 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 0.00 102 N 8.33 4.25 0.00 2.84 2.85 0.00 0.00 7.08 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 0.00 103 L 8.20 3.95 0.00 1.78 1.69 0.93 0.78 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 0.00 104 S 8.06 4.26 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 0.00 105 L 7.77 4.00 0.00 1.86 1.70 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.27 4.00 0.00 1.93 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 2.34 0.00 107 L 8.06 4.30 0.00 1.72 1.68 0.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 108 R 7.44 3.94 0.00 2.02 2.06 0.00 3.16 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 109 K 7.94 4.53 0.00 1.82 1.55 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.24 1.32 7.81 110 P 0.00 4.31 0.00 1.90 1.67 0.00 3.41 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.75 0.00 111 I 8.21 5.10 1.86 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 1.37 0.75 0.93 0.00 0.00 112 T 9.17 4.50 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 1.19 0.00 0.00 113 F 8.82 4.76 0.00 2.92 3.01 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 0.00 114 G 8.81 4.03 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 0.00 115 V 6.58 4.56 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.57 0.00 0.00 116 I 8.57 4.08 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 1.29 0.32 0.95 0.00 0.00 117 T 8.72 5.17 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 1.27 0.00 0.00 118 A 9.44 4.83 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 0.00 119 D 8.96 4.04 0.00 2.79 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 0.00 120 T 7.54 4.69 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 1.17 0.00 0.00 121 L 8.36 3.92 0.00 1.76 1.69 0.89 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.19 3.89 0.00 2.05 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 2.36 2.40 0.00 123 Q 8.17 4.19 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.21 0.00 124 A 7.86 4.14 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 0.00 125 I 8.08 3.62 1.98 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 1.49 1.24 0.89 0.00 0.00 126 E 8.31 4.50 0.00 2.12 1.87 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 2.31 2.37 0.00 127 R 7.72 4.49 0.00 1.81 1.95 0.00 3.24 0.00 0.00 3.19 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 128 A 8.06 4.97 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 0.00 129 G 9.06 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 0.00 0.00 0.00 130 T 7.29 4.64 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 131 K 8.94 4.14 0.00 1.89 1.99 0.00 1.55 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.61 7.81 132 H 8.61 4.76 0.00 3.23 3.35 0.00 5.86 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.73 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 0.00 134 N 8.33 5.34 0.00 2.69 2.70 0.00 0.00 6.95 6.04 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 0.00 135 K 9.00 4.27 0.00 1.82 1.85 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.66 1.61 7.81 136 G 8.20 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 0.00 137 W 8.62 4.09 0.00 3.41 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 0.00 138 E 8.50 4.12 0.00 2.30 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 2.52 2.67 0.00 139 A 8.32 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.04 3.66 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.82 3.51 0.00 1.35 1.70 0.50 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.18 4.10 0.00 4.04 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 7.97 4.00 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 0.00 144 I 7.89 3.87 1.88 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.27 0.97 0.00 0.00 145 E 7.96 4.20 0.00 2.05 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 2.35 2.43 0.00 146 M 8.26 4.07 0.00 1.84 2.06 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.85 0.00 147 A 8.33 3.96 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 0.00 148 N 8.44 4.34 0.00 3.06 2.93 0.00 0.00 6.68 6.26 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 0.00 149 L 8.36 4.06 0.00 1.92 2.12 1.04 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 150 F 8.93 4.09 0.00 3.13 3.12 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 0.00 151 K 7.92 4.04 0.00 1.92 1.92 0.00 1.70 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.72 7.81 152 S 7.42 4.64 0.00 4.29 4.06 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 0.00 153 L 8.03 3.68 0.00 1.35 1.28 0.17 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 154 R 7.60 3.74 0.00 1.47 1.94 0.00 3.32 0.00 0.00 3.49 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.61 0.00