NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0997 8.0549 120.3916 62.4593 32.4981 175.1727 2 L 3.9966 8.2916 127.4854 52.4708 42.2889 175.9934 3 S 4.5425 9.6885 119.0406 57.7058 66.2608 175.0708 4 E 4.2744 8.8301 121.5753 59.6714 29.2375 179.8775 5 G 3.6398 8.1137 105.2007 47.8034 0.0000 175.3983 6 E 3.9113 8.1910 120.9657 59.0365 29.3883 179.4894 7 W 4.4052 8.3002 119.1665 59.8653 29.1129 178.3414 8 Q 4.0958 8.5794 119.7171 59.1504 28.4021 178.3107 9 L 4.0854 7.9941 119.9716 57.6881 41.6504 179.6168 10 V 3.7445 7.9734 118.0914 66.2800 31.6434 178.0880 11 L 4.3425 8.5543 118.3566 57.2377 41.2665 178.9819 12 H 4.2381 8.2736 118.4962 59.2325 30.3005 177.3201 13 V 3.7336 7.8575 120.8220 64.5305 31.2924 178.1436 14 W 3.8717 8.6295 128.8364 60.0120 30.2766 177.8030 15 A 4.0210 8.0327 120.1452 54.8914 18.0304 179.4476 16 K 3.9044 7.6396 116.8758 59.3961 31.9335 179.7368 17 V 2.9639 6.9312 118.1161 65.5233 31.1582 177.2756 18 E 3.8979 7.3463 115.7798 57.6923 29.3097 178.1988 19 A 4.2039 7.4470 120.6251 53.4459 19.6906 177.6185 20 D 4.6483 8.0510 116.6405 52.0590 42.8117 175.5092 21 V 3.4353 7.8578 123.9852 66.0732 32.0279 176.8401 22 A 4.0527 7.9866 120.0159 54.9609 18.2605 179.6895 23 G 3.6445 8.3466 105.6842 45.5229 0.0000 175.7407 24 H 4.1775 8.2451 118.8751 58.4629 28.6903 178.2011 25 G 3.5349 8.3370 107.8108 47.7129 0.0000 175.7730 26 Q 3.8788 8.2031 120.5592 58.8934 28.7519 178.7071 27 D 4.2879 7.9673 119.7660 57.3415 40.7513 179.0437 28 I 3.6446 7.9216 120.5027 64.3737 37.0564 178.5563 29 L 3.4184 7.7468 119.7961 57.4903 41.2614 179.6488 30 I 3.5579 7.6052 119.8711 64.2621 36.9477 178.4129 31 R 3.7821 7.9494 119.5741 59.1703 29.8924 178.2443 32 L 3.9375 7.8683 120.1986 58.4036 41.7281 179.1225 33 F 4.6080 8.0731 117.9059 60.4052 38.5373 178.0033 34 K 4.0740 8.1175 117.7032 59.5919 32.0440 179.4083 35 S 4.2809 8.1820 114.5097 60.3899 64.0424 174.5935 36 H 4.6916 8.0670 118.3744 52.2456 29.5579 171.9707 37 P 4.5330 0.0000 0.0000 64.1757 31.5314 177.4275 38 E 4.1017 8.1986 116.5130 59.2384 29.4916 179.0646 39 T 4.0742 8.2758 111.7467 64.6079 68.9393 176.4989 40 L 3.5899 7.8832 123.3456 57.6813 41.7996 178.4642 41 E 4.0378 7.7054 117.5991 58.5980 29.6309 178.3278 42 K 4.4471 8.0201 116.9511 57.1089 32.6802 177.3168 43 F 4.6138 8.2158 119.2640 55.4678 39.5406 175.5255 44 D 4.4083 8.6362 124.5745 57.2305 40.9733 178.7191 45 R 3.8034 7.8756 117.9630 58.3514 30.2086 176.6291 46 F 5.0547 8.0225 113.7548 56.5528 40.8036 176.4760 47 K 4.1103 8.1344 119.3222 58.6723 32.5070 177.4996 48 H 4.3885 8.1036 114.5794 57.1483 28.9237 175.2653 49 L 4.2003 7.6837 121.9476 54.3888 41.7815 176.7101 50 K 4.5460 9.4561 122.4031 55.9975 34.3166 176.5530 51 T 4.7473 7.4788 108.5972 58.8409 73.1933 174.1553 52 E 3.9122 8.6749 121.8043 59.3946 29.7188 178.8182 53 A 3.9933 7.9809 120.3841 55.2822 18.2273 179.3301 54 E 3.9494 8.1364 116.1689 59.6182 29.9293 179.0872 55 M 4.1787 8.1231 118.7643 58.5388 31.8770 179.0860 56 K 4.0022 8.2454 117.1151 58.8584 32.2673 178.4904 57 A 4.4324 7.6258 118.9539 51.7702 19.2311 177.0426 58 S 4.3500 7.4762 113.5623 57.2251 62.7986 174.4398 59 E 4.0014 8.8785 129.2853 59.3382 29.4224 177.9882 60 D 4.4290 8.1896 117.8298 57.1959 41.2764 177.8389 61 L 3.4124 8.1089 121.0730 57.7591 42.1569 178.8492 62 K 3.8694 7.9451 119.2338 59.2909 32.1150 178.9399 63 K 3.9971 8.3217 118.9368 59.8841 31.9695 178.8537 64 H 4.4251 8.7150 118.7096 59.1352 29.7283 177.3959 65 G 3.5853 8.3897 107.9897 47.7181 0.0000 175.8466 66 V 3.5887 7.7380 120.0164 66.0488 31.5736 178.0249 67 T 3.8863 7.9071 115.5373 66.7668 68.2864 176.5319 68 V 3.5838 7.9125 119.8824 66.2504 31.5596 178.1909 69 L 4.2323 8.1998 118.5992 57.8777 41.3884 179.7080 70 T 3.9722 8.3776 116.1991 66.5247 68.5041 176.5759 71 A 4.0058 8.0810 122.7920 55.0334 18.3669 179.4498 72 L 3.7707 8.2264 119.1648 58.1287 42.1465 179.4404 73 G 3.2497 8.4750 105.8214 47.5992 0.0000 175.5493 74 A 4.0176 7.7752 122.2527 54.8039 18.6279 179.6368 75 I 3.7985 7.5696 118.0531 64.6058 37.2500 178.6133 76 L 3.9953 7.9148 120.1822 57.6944 41.1963 179.4308 77 K 4.0469 7.7494 116.3296 57.9894 32.2825 178.5982 78 K 3.9793 7.8707 118.6061 55.8587 32.6498 176.5040 79 K 2.0000 8.3073 118.2193 56.4206 29.7636 175.6867 80 G 3.9280 7.9841 106.2038 45.6880 0.0000 173.9650 81 H 4.5758 7.4213 119.2095 55.2020 27.4536 174.7836 82 H 5.2370 7.2574 110.7777 54.2398 29.9119 176.3143 83 E 3.9401 8.5736 122.8000 60.2821 29.0678 178.4869 84 A 4.0588 7.9170 118.9672 55.1302 17.2593 178.9778 85 E 4.1159 8.1139 116.7815 59.3685 29.7265 179.1290 86 L 4.3014 8.2120 118.9746 56.8735 41.6953 178.9698 87 K 3.8098 7.9264 120.0194 59.3012 32.0238 176.9839 88 P 4.2969 0.0000 0.0000 65.5407 31.2751 178.1259 89 L 3.9780 7.5115 119.5226 57.9844 42.0432 178.7554 90 A 4.1330 8.5102 121.1174 55.2703 18.2946 179.6152 91 Q 3.7934 8.1544 116.7472 59.1223 28.7661 179.2866 92 S 3.9797 8.2726 115.4503 61.7427 63.0131 176.2403 93 H 4.1921 8.6137 119.8110 58.1669 28.2379 177.7503 94 A 2.9926 7.8237 122.5606 54.6177 18.1684 179.0352 95 T 3.7829 7.2067 105.7214 61.9313 69.7164 175.4456 96 K 4.1953 7.4372 120.5532 58.3080 33.3170 176.8940 97 H 4.3253 8.0599 114.0708 56.1001 29.3993 175.3609 98 K 3.7534 7.6724 117.1885 57.4198 28.8165 176.2561 99 I 4.2175 7.7928 118.9713 58.7794 38.3990 175.0602 100 P 4.4312 0.0000 0.0000 62.2066 32.0824 177.5211 101 I 3.3765 8.4338 122.2152 64.6833 36.8840 178.4068 102 K 3.6446 7.9411 119.5958 59.7890 31.9017 178.1200 103 Y 4.0402 8.0561 116.6383 60.4422 37.7486 178.0542 104 L 4.1924 7.8626 120.4729 57.4244 41.6529 178.9279 105 E 3.9644 7.8767 119.0873 59.2512 29.6633 178.6778 106 F 4.4795 7.7470 117.8766 60.7947 38.8988 177.5372 107 I 3.9133 8.1652 118.0562 63.8378 37.7677 178.0790 108 S 4.1786 8.2702 116.4844 61.5833 62.6098 176.3959 109 E 4.0618 8.5476 121.0984 59.4134 29.2418 179.2943 110 A 4.0302 8.2109 120.8303 55.0727 18.3843 179.7338 111 I 3.6935 8.1525 118.6697 64.6841 37.2465 178.7331 112 I 3.8677 7.9501 120.5791 64.5773 36.9556 177.9276 113 H 4.1205 8.4837 119.1480 59.4787 29.6855 177.5651 114 V 3.6182 7.9802 119.9386 65.8832 31.2814 177.9954 115 L 3.7730 8.0056 118.9987 57.7490 41.0396 178.9533 116 H 4.4409 8.0440 117.5800 59.3606 29.9183 177.2645 117 S 4.1986 7.9707 116.0934 61.4967 62.7743 176.3364 118 R 4.1124 7.8528 118.9666 57.2731 31.3468 176.4070 119 H 5.0179 8.1228 115.7246 53.9516 29.7950 172.9312 120 P 4.3023 0.0000 0.0000 65.7850 31.7805 179.3735 121 G 3.7043 8.1548 106.5021 47.4837 0.0000 173.5888 122 D 5.0388 8.1300 117.9135 54.0322 41.6075 176.2182 123 F 5.0089 8.0367 121.0162 56.4284 39.6166 174.5784 124 G 3.8606 7.9434 107.6281 44.0877 0.0000 172.9676 125 A 3.9063 8.3846 121.0208 54.8333 18.2248 179.4095 126 D 4.1978 8.0029 117.1076 56.8311 39.3976 178.7527 127 A 3.9797 7.7656 121.9792 54.3995 18.3513 179.4164 128 Q 3.2060 7.8401 117.2750 58.7780 28.6916 179.2877 129 G 3.4828 8.2451 106.8364 47.6636 0.0000 175.6408 130 A 3.8585 8.0020 123.3187 55.0674 18.3262 179.4385 131 M 4.0033 8.4938 117.2187 58.6957 32.2371 177.9202 132 N 4.3135 8.5190 117.6572 56.6186 39.0739 177.0053 133 K 3.8770 8.1282 119.7344 59.3365 32.1106 179.1915 134 A 3.8528 8.1102 121.2990 55.1547 18.2826 179.7091 135 L 4.1269 8.2798 117.5991 57.6135 41.6986 179.5094 136 E 3.9962 8.5076 119.1865 59.2615 29.3925 179.0278 137 L 4.0175 8.1769 120.5025 57.9464 42.0869 178.6150 138 F 4.1244 8.3612 120.6260 61.6383 39.2569 177.4422 139 R 3.5676 8.2603 117.5390 58.8001 29.8716 178.8758 140 K 3.8219 8.4701 119.8821 59.7741 32.0440 178.6371 141 D 4.3506 8.1486 119.0196 57.2677 40.7002 178.8467 142 I 3.5421 7.6492 120.3358 64.1703 36.9039 178.3219 143 A 3.7446 8.1468 121.8244 54.9263 18.1323 179.5652 144 A 3.9408 7.9105 119.3106 55.1976 18.4271 180.0890 145 K 4.0034 7.8821 117.1542 59.6701 32.0567 179.0392 146 Y 4.0919 8.5854 117.5643 61.1299 37.8217 178.8398 147 K 3.9831 8.5075 120.6424 59.3718 32.0861 178.1162 148 E 3.9289 7.9916 118.5372 59.5375 29.6635 178.4379 149 L 4.4064 7.7914 115.2631 55.1446 41.8941 177.6387 150 G 3.7945 8.1446 107.2907 46.0898 0.0000 173.5991 151 Y 4.6090 8.1977 113.9577 57.2714 38.9821 176.7265 152 Q 4.1477 8.2858 123.1867 58.1590 29.5501 176.0620 153 G 4.0611 8.2846 110.2088 45.7291 0.0000 173.0995 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 V 8.05 4.10 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 1.05 0.00 0.00 0.95 0.00 0.00 2 L 8.29 4.00 0.00 0.68 0.60 0.55 -0.56 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 3 S 9.69 4.54 0.00 4.04 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 4 E 8.83 4.27 0.00 2.07 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 2.51 2.39 0.00 5 G 8.11 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 6 E 8.19 3.91 0.00 2.02 1.72 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 2.22 2.27 0.00 7 W 8.30 4.41 0.00 3.57 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 8 Q 8.58 4.10 0.00 2.30 2.25 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 2.42 2.48 0.00 9 L 7.99 4.09 0.00 1.97 1.75 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.97 3.74 2.48 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 1.21 0.00 0.00 0.90 0.00 0.00 11 L 8.55 4.34 0.00 1.86 1.82 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.27 4.24 0.00 3.33 3.57 0.00 5.95 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.86 3.73 2.47 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 0.98 0.00 0.00 0.79 0.00 0.00 14 W 8.63 3.87 0.00 3.67 3.21 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 0.00 15 A 8.03 4.02 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 16 K 7.64 3.90 0.00 1.43 1.51 0.00 1.60 0.00 0.00 1.45 0.00 0.00 2.70 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.46 1.42 7.81 17 V 6.93 2.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.26 0.00 0.00 18 E 7.35 3.90 0.00 1.98 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 2.20 1.98 0.00 19 A 7.45 4.20 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 20 D 8.05 4.65 0.00 2.64 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.86 3.44 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 1.05 0.00 0.00 0.84 0.00 0.00 22 A 7.99 4.05 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 8.35 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 24 H 8.25 4.18 0.00 3.26 3.23 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 8.34 3.53 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 0.00 0.00 0.00 26 Q 8.20 3.88 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 27 D 7.97 4.29 0.00 2.74 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 28 I 7.92 3.64 1.86 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 1.51 0.63 0.88 0.00 0.00 29 L 7.75 3.42 0.00 1.27 0.76 0.73 0.45 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 30 I 7.61 3.56 1.83 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.54 0.87 0.00 0.00 31 R 7.95 3.78 0.00 1.89 2.03 0.00 3.05 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 32 L 7.87 3.94 0.00 1.77 1.47 1.07 1.18 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 33 F 8.07 4.61 0.00 3.12 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.12 4.07 0.00 1.75 1.83 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.66 7.81 35 S 8.18 4.28 0.00 3.74 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 36 H 8.07 4.69 0.00 3.06 2.82 0.00 5.62 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 37 P 0.00 4.53 0.00 2.14 2.09 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 38 E 8.20 4.10 0.00 2.30 2.28 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 2.00 2.36 0.00 39 T 8.28 4.07 4.56 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 1.01 0.00 0.00 40 L 7.88 3.59 0.00 1.24 1.72 0.02 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.71 4.04 0.00 2.17 2.26 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 2.39 2.45 0.00 42 K 8.02 4.45 0.00 1.98 1.73 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.74 1.93 7.81 43 F 8.22 4.61 0.00 3.19 2.99 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 44 D 8.64 4.41 0.00 2.63 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 R 7.88 3.80 0.00 1.45 1.01 0.00 3.01 0.00 0.00 2.92 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.29 0.00 46 F 8.02 5.05 0.00 2.90 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 47 K 8.13 4.11 0.00 1.86 2.22 0.00 1.59 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.66 1.45 7.81 48 H 8.10 4.39 0.00 3.31 3.48 0.00 5.52 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 49 L 7.68 4.20 0.00 1.63 1.59 0.95 0.85 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 50 K 9.46 4.55 0.00 1.77 1.80 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.47 7.81 51 T 7.48 4.75 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 52 E 8.67 3.91 0.00 2.04 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 2.36 2.36 0.00 53 A 7.98 3.99 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 54 E 8.14 3.95 0.00 2.13 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 2.36 2.35 0.00 55 M 8.12 4.18 0.00 2.06 2.26 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 2.80 2.61 0.00 56 K 8.25 4.00 0.00 1.81 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.53 7.81 57 A 7.63 4.43 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 58 S 7.48 4.35 0.00 3.96 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 59 E 8.88 4.00 0.00 2.14 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 2.40 2.46 0.00 60 D 8.19 4.43 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 8.11 3.41 0.00 1.43 1.62 -0.19 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.95 3.87 0.00 1.87 1.97 0.00 1.67 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.45 7.81 63 K 8.32 4.00 0.00 2.21 1.94 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.50 7.81 64 H 8.72 4.43 0.00 3.62 3.47 0.00 5.79 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 65 G 8.39 3.59 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 66 V 7.74 3.59 2.26 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 1.13 0.00 0.00 0.98 0.00 0.00 67 T 7.91 3.89 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 1.28 0.00 0.00 68 V 7.91 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 1.16 0.00 0.00 0.96 0.00 0.00 69 L 8.20 4.23 0.00 1.80 1.91 0.86 0.81 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 70 T 8.38 3.97 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 1.26 0.00 0.00 71 A 8.08 4.01 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 72 L 8.23 3.77 0.00 1.59 1.59 0.30 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.48 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 0.00 0.00 0.00 74 A 7.78 4.02 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.57 3.80 1.93 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.59 0.96 0.00 0.00 76 L 7.91 4.00 0.00 1.30 1.57 -0.24 0.78 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 77 K 7.75 4.05 0.00 1.66 1.80 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.17 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.51 7.81 78 K 7.87 3.98 0.00 1.82 1.80 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.64 1.76 7.81 79 K 8.31 2.00 0.00 1.23 0.74 0.00 1.45 0.00 0.00 1.40 0.00 0.00 2.62 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.30 0.71 7.81 80 G 7.98 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 7.42 4.58 0.00 3.15 3.24 0.00 5.80 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 7.26 5.24 0.00 3.27 3.45 0.00 5.66 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.57 3.94 0.00 2.12 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 2.47 0.00 84 A 7.92 4.06 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 85 E 8.11 4.12 0.00 2.26 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 2.41 2.47 0.00 86 L 8.21 4.30 0.00 1.73 1.67 0.96 0.43 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 87 K 7.93 3.81 0.00 1.87 1.82 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.61 7.81 88 P 0.00 4.30 0.00 2.33 2.30 0.00 3.97 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 89 L 7.51 3.98 0.00 1.92 1.88 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.51 4.13 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 91 Q 8.15 3.79 0.00 2.29 2.09 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 2.33 2.51 0.00 92 S 8.27 3.98 0.00 3.85 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.61 4.19 0.00 3.48 3.57 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 7.82 2.99 -0.13 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 0.00 0.00 95 T 7.21 3.78 4.13 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 0.82 0.00 0.00 96 K 7.44 4.20 0.00 1.55 1.70 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.19 1.34 7.81 97 H 8.06 4.33 0.00 3.01 3.13 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 7.67 3.75 0.00 1.87 1.85 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.38 7.81 99 I 7.79 4.22 2.04 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 1.33 0.94 1.08 0.00 0.00 100 P 0.00 4.43 0.00 1.70 1.77 0.00 2.32 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.79 0.00 101 I 8.43 3.38 1.71 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.61 0.71 0.00 0.00 102 K 7.94 3.64 0.00 1.74 1.71 0.00 1.57 0.00 0.00 1.75 0.00 0.00 3.18 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 0.64 7.81 103 Y 8.06 4.04 0.00 3.10 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.86 4.19 0.00 1.83 1.83 0.67 0.92 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 0.00 105 E 7.88 3.96 0.00 1.95 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 2.42 0.00 106 F 7.75 4.48 0.00 3.23 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 8.17 3.91 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 1.09 0.00 0.00 108 S 8.27 4.18 0.00 4.18 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 0.00 109 E 8.55 4.06 0.00 2.28 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 2.66 2.60 0.00 110 A 8.21 4.03 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 0.00 111 I 8.15 3.69 2.09 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 1.60 0.74 1.04 0.00 0.00 112 I 7.95 3.87 2.13 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.07 1.18 0.00 0.00 113 H 8.48 4.12 0.00 3.34 3.47 0.00 5.59 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 0.00 114 V 7.98 3.62 2.06 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 0.96 0.00 0.00 0.94 0.00 0.00 115 L 8.01 3.77 0.00 1.11 0.37 0.76 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.04 4.44 0.00 3.53 3.63 0.00 5.95 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 0.00 117 S 7.97 4.20 0.00 3.98 3.85 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 0.00 118 R 7.85 4.11 0.00 1.39 1.56 0.00 2.71 0.00 0.00 2.69 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.57 0.00 119 H 8.12 5.02 0.00 3.17 3.19 0.00 5.62 0.00 0.00 0.00 0.00 6.76 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 4.30 0.00 2.19 2.22 0.00 3.76 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 121 G 8.15 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 0.00 122 D 8.13 5.04 0.00 2.76 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 0.00 123 F 8.04 5.01 0.00 3.01 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 0.00 124 G 7.94 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.38 3.91 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 8.00 4.20 0.00 2.87 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.77 3.98 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 0.00 128 Q 7.84 3.21 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 129 G 8.25 3.48 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 0.00 0.00 0.00 0.00 130 A 8.00 3.86 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 0.00 131 M 8.49 4.00 0.00 2.41 2.45 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.88 0.00 132 N 8.52 4.31 0.00 2.86 2.95 0.00 0.00 7.19 7.87 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 0.00 133 K 8.13 3.88 0.00 1.86 1.66 0.00 1.57 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.50 7.81 134 A 8.11 3.85 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.28 4.13 0.00 1.74 1.78 0.97 0.98 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 0.00 136 E 8.51 4.00 0.00 2.21 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 2.53 0.00 137 L 8.18 4.02 0.00 1.87 1.96 1.04 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.36 4.12 0.00 3.05 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 8.26 3.57 0.00 2.04 1.86 0.00 3.15 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.98 0.00 140 K 8.47 3.82 0.00 1.79 1.96 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.47 7.81 141 D 8.15 4.35 0.00 2.76 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 0.00 142 I 7.65 3.54 1.32 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 0.87 -0.26 0.46 0.00 0.00 143 A 8.15 3.74 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.91 3.94 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 0.00 145 K 7.88 4.00 0.00 2.01 1.91 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.64 7.81 146 Y 8.59 4.09 0.00 3.03 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 8.51 3.98 0.00 2.09 2.00 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.99 3.93 0.00 2.04 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 0.00 2.35 2.39 0.00 149 L 7.79 4.41 0.00 1.98 1.95 0.79 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.14 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 0.00 151 Y 8.20 4.61 0.00 2.64 2.79 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 0.00 152 Q 8.29 4.15 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 153 G 8.28 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 0.00 0.00 0.00