NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 V 4.0121 8.0544 120.3956 62.7163 32.0342 175.4816 10 F 4.2746 8.8533 122.4112 55.4568 39.8715 174.6741 11 S 4.2490 8.2912 123.4340 58.0829 65.7964 174.1317 12 E 3.8675 8.6116 122.9630 59.6891 29.2712 179.0649 13 E 3.9077 7.9104 118.1008 59.0642 29.5235 179.2484 14 K 3.6017 7.6455 118.6900 58.9609 31.8905 178.7233 15 E 3.9392 7.8170 119.3941 59.5216 29.4810 178.6948 16 A 4.0019 7.9958 120.4769 55.2992 18.2710 179.6897 17 L 3.9427 7.8140 117.3108 57.8517 41.6615 179.8609 18 V 3.2803 7.8164 118.3090 65.7784 31.3199 178.0558 19 L 4.1541 8.5622 119.2506 57.8582 41.2900 179.7714 20 K 4.0868 8.4193 119.0423 59.7319 32.4236 179.3815 21 S 4.4523 8.2498 115.4726 61.1303 63.2640 176.2502 22 W 4.6614 9.1720 132.4252 60.2003 30.2115 177.5081 23 A 3.8288 8.2623 120.2676 55.1341 17.8318 179.3996 24 I 3.9136 7.2256 118.0475 64.6724 37.5330 178.5015 25 M 4.1379 8.3119 119.6574 58.1271 31.5651 178.5817 26 K 3.0391 7.7970 119.3674 58.9637 32.0688 178.4880 27 K 4.1538 7.4613 117.5910 57.7701 32.2572 176.8267 28 D 4.9738 8.2435 119.8018 53.4582 41.9729 177.7815 29 S 4.4419 8.3287 115.2278 60.5097 63.2575 175.0798 30 A 3.9790 8.0750 124.3126 55.2877 18.1015 178.9927 31 N 4.2336 7.9982 114.7843 56.8033 39.1493 177.0260 32 L 3.8494 7.9587 120.5736 57.4113 41.7111 179.4990 33 G 3.6584 8.0082 106.1298 47.9280 0.0000 175.4740 34 L 4.0674 7.7658 122.5554 57.7904 42.0101 179.2440 35 R 3.8886 8.1149 118.3021 58.9021 29.9630 178.5979 36 F 4.4967 8.4005 122.3059 61.0064 39.3913 177.3584 37 F 3.0836 8.1468 116.9611 60.0120 38.6749 177.8186 38 L 4.1268 8.2410 119.0384 57.4804 41.3764 179.4854 39 K 3.9121 8.2138 119.8606 59.4058 32.0805 178.6224 40 I 3.4919 7.2672 120.1025 64.7210 36.8866 178.3397 41 F 4.7071 7.5470 117.3972 59.7486 38.4755 177.6430 42 E 4.0020 7.9320 119.0043 59.3043 29.5733 178.4941 43 I 4.0303 7.7050 118.3336 62.9569 38.6010 176.5513 44 A 4.6843 8.1782 123.6963 48.4146 18.9609 174.1973 45 P 4.6739 0.0000 0.0000 64.6639 31.5535 178.0692 46 S 4.1317 8.1989 112.4139 61.2573 62.8560 176.1316 47 A 4.1065 8.2809 124.3476 54.8684 17.9998 179.4391 48 R 3.1616 8.1802 117.7134 59.5423 29.8739 178.5495 49 Q 4.0922 7.5895 116.1662 58.4155 28.7066 178.0990 50 M 4.2993 7.8861 119.1085 56.0116 32.1458 175.9884 51 F 4.1961 7.6217 118.9158 54.9062 39.1692 174.5346 52 P 4.1770 0.0000 0.0000 65.6876 31.2473 178.0470 53 F 4.6690 7.7960 109.3307 57.4281 37.8395 175.4018 54 L 4.5995 7.6460 119.7013 54.8911 42.0627 177.3601 55 R 3.9962 7.5812 117.2240 57.0450 30.6799 176.2840 56 D 4.5957 7.7751 118.8778 52.6697 40.3082 176.6493 57 S 4.2108 8.4677 122.2323 60.7596 63.1907 175.0893 58 D 4.4933 7.9983 118.9234 54.9392 40.9272 176.3365 59 V 4.2183 7.3346 113.5572 58.6502 32.6489 174.2083 60 P 4.3487 0.0000 0.0000 62.4690 30.6275 177.4143 61 L 4.0326 8.7304 122.0454 58.1475 41.7656 179.6156 62 E 4.2074 8.2347 116.8222 58.5496 29.5330 177.4601 63 T 4.3431 7.0526 104.1752 60.8987 69.9962 174.0578 64 N 4.2385 7.8539 121.3423 53.7698 39.1291 173.1110 65 P 4.2241 0.0000 0.0000 65.4942 31.4574 178.6169 66 K 3.7501 8.0951 118.3333 59.0442 32.0415 178.6010 67 L 3.9155 8.0462 120.2715 58.1014 42.1143 178.9335 68 K 3.9548 7.7835 118.1513 59.7379 32.0713 179.5372 69 T 3.8459 7.4562 114.9709 66.6403 68.3459 176.3434 70 H 3.8805 8.1027 120.0533 59.1254 29.7873 176.9863 71 A 3.0668 8.0242 122.6815 54.9954 18.1640 179.7844 72 V 3.7053 7.5770 116.1706 66.1411 31.5903 177.9167 73 S 4.1357 7.9354 112.6531 61.6904 62.1631 176.5139 74 V 3.7526 8.0629 120.8895 65.8925 31.2328 177.7980 75 F 4.3819 9.0240 120.9943 61.3313 39.2476 177.3127 76 V 3.4940 8.4995 118.3795 66.1240 31.3715 177.4981 77 M 3.9711 8.2297 117.9732 59.0097 32.0404 178.3302 78 T 3.8199 8.0001 115.6351 67.0006 68.7170 176.5580 79 C 4.0128 7.6342 118.6967 62.6380 27.8590 176.1138 80 E 3.8089 7.9874 120.3834 58.8890 28.7475 179.1031 81 A 3.9268 7.7240 119.9974 55.0922 18.7039 179.2023 82 A 3.6330 7.7356 118.9241 55.1758 18.2037 179.7951 83 A 3.9664 8.0793 118.0289 54.3112 18.6954 178.7458 84 Q 4.4384 7.6222 114.6586 55.5821 29.3753 177.3696 85 L 3.9977 7.3677 124.2240 57.5949 41.9431 178.7097 86 R 3.9064 7.9077 117.0041 59.5028 30.3976 177.4049 87 K 3.9764 8.3224 115.1519 59.6240 30.9137 178.0631 88 A 4.0878 8.6186 120.5412 52.3761 18.7940 178.6604 89 G 3.7855 8.1102 103.5298 45.3103 0.0000 173.2113 90 K 4.1115 6.7691 115.1273 56.0047 35.3791 173.7716 91 I 4.0834 8.2859 120.8975 60.9879 37.4953 175.8560 92 T 4.6200 8.2446 114.9798 59.6393 71.2409 173.7414 93 V 4.3459 7.9637 116.4371 59.0438 34.0199 175.5206 94 R 3.9214 8.5282 122.0133 57.4666 29.7192 176.6532 95 E 3.8792 9.4504 118.8701 57.1350 27.5896 174.0867 96 T 4.4460 7.3519 112.5541 60.7687 70.0010 172.7617 97 T 4.7264 8.1772 111.5783 59.6675 71.9711 175.3596 98 L 4.0175 8.5142 125.6227 57.7059 41.6451 179.7624 99 K 4.0658 8.0008 119.0742 59.6642 32.2448 178.8309 100 R 3.9659 7.9839 117.7506 59.3146 30.0537 178.9856 101 L 4.2166 7.9299 118.5790 57.6792 41.6833 179.5842 102 G 3.8691 8.6389 106.3256 47.8042 0.0000 175.6656 103 G 3.7788 8.2656 108.3763 47.9026 0.0000 175.6784 104 T 4.0062 7.9866 118.5186 66.8463 68.5055 176.5870 105 H 4.2595 8.4546 117.8704 58.5264 28.6710 177.8292 106 L 3.9996 8.2404 122.3911 58.2429 41.8051 179.1236 107 K 3.8990 7.9012 117.0045 59.3680 32.0464 178.0310 108 Y 4.1930 8.0539 114.3083 57.3743 38.1411 175.8684 109 G 3.8219 7.8586 108.0203 46.1955 0.0000 174.0682 110 V 3.4668 8.1922 120.1462 62.3707 32.1030 175.4138 111 A 4.8598 8.6794 129.2728 50.2965 21.8636 176.9018 112 D 4.8018 9.0141 119.0527 58.0316 40.7863 179.7418 113 G 3.8614 8.2157 105.3089 45.9398 0.0000 175.2431 114 H 4.1742 7.9619 117.7595 58.9907 28.7511 177.8793 115 F 4.4567 8.1760 118.9218 60.5353 38.5670 177.5565 116 E 4.1092 8.3213 118.3059 59.4895 29.2846 179.4241 117 V 3.6510 7.8107 118.2049 66.4060 31.5681 178.1154 118 T 3.8836 8.0949 115.4331 66.5003 68.2556 176.3342 119 R 2.8518 8.2124 120.6483 59.2932 30.0680 178.2634 120 F 3.9690 8.2188 119.8844 61.2153 39.4047 176.8352 121 A 4.0237 8.5892 120.8413 55.0204 18.0814 179.4230 122 L 3.2950 8.2960 119.1783 58.1720 42.0629 179.2486 123 L 3.8789 7.7645 118.9503 57.7301 41.4290 179.3686 124 E 3.5718 7.8494 118.5739 59.4472 29.2484 179.6067 125 T 3.6862 7.5720 115.6951 66.4501 68.4742 176.7757 126 I 3.4194 7.5495 121.8909 64.1908 36.8884 178.2235 127 K 2.4800 7.0898 118.9313 59.1940 31.8219 178.4293 128 E 3.8725 7.7326 117.0524 58.8680 29.3347 178.7505 129 A 4.0906 7.5273 120.3261 53.1741 18.8418 177.6095 130 L 4.5665 6.6917 115.6870 52.4008 43.6383 174.8270 131 P 4.2702 0.0000 0.0000 62.7670 32.2469 177.2555 132 A 4.0858 8.9701 125.4662 55.6781 18.3218 179.3429 133 D 4.5089 8.2697 113.8351 57.4156 40.9523 177.6363 134 M 4.3487 8.2786 117.3369 55.7105 32.8526 176.1152 135 W 4.5107 7.9171 128.8894 56.5010 31.6891 175.9563 136 G 3.7393 6.8298 110.0407 42.5914 0.0000 172.1726 137 P 4.0771 0.0000 0.0000 65.6028 31.0795 178.8166 138 E 3.8173 7.8778 116.6217 59.4683 29.4566 178.7990 139 M 3.9266 7.6713 117.5587 58.7228 32.3542 177.8582 140 R 3.6797 7.3387 119.0220 59.6161 30.0862 178.2291 141 N 4.3750 8.5127 116.3401 55.9138 38.4274 177.2177 142 A 3.9596 8.1884 122.5411 55.1396 18.4188 179.8158 143 W 4.1406 8.2957 117.4937 59.7811 29.0700 179.0762 144 G 3.7552 8.5096 105.7755 47.9675 0.0000 175.6234 145 E 4.0450 8.8290 121.4725 58.9632 29.4399 179.2500 146 A 3.5876 8.2919 120.9480 55.2032 18.3184 178.9039 147 Y 3.9807 8.3459 118.1964 61.0528 38.7800 178.0833 148 D 4.3510 8.6016 119.9599 57.5878 40.8721 178.9078 149 Q 3.8357 8.1322 118.4141 58.6770 28.7011 178.4140 150 L 3.7549 7.8398 121.4848 58.2031 41.9839 179.3562 151 V 3.0624 7.5465 117.8850 65.7639 31.5108 177.6377 152 A 3.8039 8.3132 120.7461 55.2580 17.8962 179.5181 153 A 3.9086 7.8738 118.4189 55.1333 18.6846 179.7422 154 I 3.7805 7.6820 118.3580 64.5502 37.1562 178.7835 155 K 3.9321 8.1104 119.5913 59.5237 31.5335 179.2383 156 Q 3.9842 7.6722 117.1965 58.5837 28.6631 177.2907 157 E 4.4291 7.7809 116.5891 56.6929 29.6002 176.5334 158 M 4.5809 8.0830 118.0523 54.9175 33.3157 175.7636 159 K 4.7307 7.5645 116.9902 53.3672 35.7853 174.2538 160 P 4.4247 0.0000 0.0000 63.0919 31.1880 176.6081 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 9 V 8.05 4.01 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 0.97 0.00 0.00 0.94 0.00 0.00 10 F 8.85 4.27 0.00 2.92 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 11 S 8.29 4.25 0.00 3.96 3.82 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 12 E 8.61 3.87 0.00 2.01 1.94 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 2.33 2.38 0.00 13 E 7.91 3.91 0.00 1.96 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 2.33 2.39 0.00 14 K 7.65 3.60 0.00 0.83 0.74 0.00 1.04 0.00 0.00 1.26 0.00 0.00 2.74 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.07 1.07 7.81 15 E 7.82 3.94 0.00 2.08 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 0.00 2.33 2.39 0.00 16 A 8.00 4.00 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 17 L 7.81 3.94 0.00 1.78 1.71 0.77 0.82 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 18 V 7.82 3.28 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.16 0.00 0.00 19 L 8.56 4.15 0.00 1.77 1.78 0.96 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.42 4.09 0.00 2.04 2.12 0.00 1.35 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.77 1.55 7.81 21 S 8.25 4.45 0.00 4.38 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 0.00 22 W 9.17 4.66 0.00 3.72 3.35 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 23 A 8.26 3.83 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 24 I 7.23 3.91 2.07 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 1.53 0.83 0.93 0.00 0.00 25 M 8.31 4.14 0.00 2.43 2.49 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.63 0.00 26 K 7.80 3.04 0.00 0.79 1.17 0.00 1.48 0.00 0.00 1.54 0.00 0.00 2.92 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.98 0.32 7.81 27 K 7.46 4.15 0.00 1.76 1.80 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.59 7.81 28 D 8.24 4.97 0.00 2.64 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.33 4.44 0.00 4.61 4.45 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 30 A 8.07 3.98 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 31 N 8.00 4.23 0.00 2.82 3.05 0.00 0.00 7.12 6.66 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 32 L 7.96 3.85 0.00 1.29 1.07 0.99 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.01 3.66 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 0.00 0.00 0.00 34 L 7.77 4.07 0.00 1.79 1.80 0.95 0.91 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 35 R 8.11 3.89 0.00 1.95 1.90 0.00 3.11 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 36 F 8.40 4.50 0.00 2.83 3.26 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 37 F 8.15 3.08 0.00 3.11 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.24 4.13 0.00 1.69 1.75 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.21 3.91 0.00 1.92 1.96 0.00 1.62 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.56 7.81 40 I 7.27 3.49 0.90 0.00 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.01 0.53 0.00 0.00 41 F 7.55 4.71 0.00 3.09 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 42 E 7.93 4.00 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 43 I 7.71 4.03 2.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.79 0.86 0.00 0.00 44 A 8.18 4.68 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 45 P 0.00 4.67 0.00 2.19 2.15 0.00 3.92 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 46 S 8.20 4.13 0.00 4.07 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 47 A 8.28 4.11 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 0.00 0.00 0.00 0.00 0.00 48 R 8.18 3.16 0.00 1.41 1.88 0.00 2.86 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.98 0.00 49 Q 7.59 4.09 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 50 M 7.89 4.30 0.00 1.70 1.81 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 2.64 2.47 0.00 51 F 7.62 4.20 0.00 2.65 1.65 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 52 P 0.00 4.18 0.00 2.30 2.20 0.00 3.56 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 2.36 2.24 0.00 53 F 7.80 4.67 0.00 3.10 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.65 4.60 0.00 1.47 1.36 0.19 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.58 4.00 0.00 1.79 1.94 0.00 3.12 0.00 0.00 3.31 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 56 D 7.78 4.60 0.00 2.67 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 57 S 8.47 4.21 0.00 3.99 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 8.00 4.49 0.00 2.83 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 59 V 7.33 4.22 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 0.69 0.00 0.00 0.94 0.00 0.00 60 P 0.00 4.35 0.00 2.17 1.98 0.00 3.61 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 2.11 2.11 0.00 61 L 8.73 4.03 0.00 1.74 1.80 0.98 0.79 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 62 E 8.23 4.21 0.00 1.94 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 2.32 2.37 0.00 63 T 7.05 4.34 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 64 N 7.85 4.24 0.00 2.97 2.81 0.00 0.00 7.10 7.79 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 65 P 0.00 4.22 0.00 2.15 2.05 0.00 3.63 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 2.09 2.12 0.00 66 K 8.10 3.75 0.00 1.69 1.72 0.00 1.19 0.00 0.00 1.30 0.00 0.00 2.53 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.61 0.21 7.81 67 L 8.05 3.92 0.00 1.93 1.83 0.90 0.90 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 68 K 7.78 3.95 0.00 1.85 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.68 7.81 69 T 7.46 3.85 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 1.14 0.00 0.00 70 H 8.10 3.88 0.00 2.94 3.18 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 71 A 8.02 3.07 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 72 V 7.58 3.71 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 1.21 0.00 0.00 1.07 0.00 0.00 73 S 7.94 4.14 0.00 4.01 4.02 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 74 V 8.06 3.75 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 1.35 0.00 0.00 0.96 0.00 0.00 75 F 9.02 4.38 0.00 3.56 3.35 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 76 V 8.50 3.49 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 1.33 0.00 0.00 77 M 8.23 3.97 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 78 T 8.00 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 1.31 0.00 0.00 79 C 7.63 4.01 0.00 1.38 1.18 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 80 E 7.99 3.81 0.00 1.95 1.94 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 2.42 2.56 0.00 81 A 7.72 3.93 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 82 A 7.74 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.08 3.97 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 84 Q 7.62 4.44 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.76 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 85 L 7.37 4.00 0.00 1.60 1.33 0.71 0.19 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 86 R 7.91 3.91 0.00 2.00 2.17 0.00 3.47 0.00 0.00 3.38 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 87 K 8.32 3.98 0.00 1.78 1.87 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.15 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 88 A 8.62 4.09 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 89 G 8.11 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 90 K 6.77 4.11 0.00 1.81 1.85 0.00 1.29 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.29 1.22 7.81 91 I 8.29 4.08 1.78 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 1.34 0.84 0.82 0.00 0.00 92 T 8.24 4.62 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 1.17 0.00 0.00 93 V 7.96 4.35 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 0.83 0.00 0.00 0.95 0.00 0.00 94 R 8.53 3.92 0.00 1.94 1.96 0.00 3.16 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 95 E 9.45 3.88 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 96 T 7.35 4.45 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 1.30 0.00 0.00 97 T 8.18 4.73 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 1.27 0.00 0.00 98 L 8.51 4.02 0.00 1.72 1.69 0.88 0.75 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 99 K 8.00 4.07 0.00 1.83 1.82 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.68 7.81 100 R 7.98 3.97 0.00 2.13 2.01 0.00 3.20 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 101 L 7.93 4.22 0.00 1.95 1.83 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 102 G 8.64 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.27 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 T 7.99 4.01 4.43 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 1.22 0.00 0.00 105 H 8.45 4.26 0.00 3.42 3.53 0.00 5.81 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 0.00 106 L 8.24 4.00 0.00 2.00 1.86 0.99 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 107 K 7.90 3.90 0.00 1.91 1.60 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.54 7.81 108 Y 8.05 4.19 0.00 2.97 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 0.00 109 G 7.86 3.82 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 0.00 0.00 0.00 110 V 8.19 3.47 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 0.26 0.00 0.00 0.88 0.00 0.00 111 A 8.68 4.86 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 0.00 112 D 9.01 4.80 0.00 2.86 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 0.00 113 G 8.22 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 0.00 114 H 7.96 4.17 0.00 3.22 3.19 0.00 5.83 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 0.00 115 F 8.18 4.46 0.00 3.34 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 0.00 116 E 8.32 4.11 0.00 2.33 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 2.44 2.61 0.00 117 V 7.81 3.65 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 1.11 0.00 0.00 0.97 0.00 0.00 118 T 8.09 3.88 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 119 R 8.21 2.85 0.00 1.93 2.17 0.00 3.31 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.34 0.00 120 F 8.22 3.97 0.00 3.25 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 0.00 121 A 8.59 4.02 1.47 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 0.00 122 L 8.30 3.30 0.00 1.25 1.45 0.16 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.76 3.88 0.00 1.56 1.76 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 124 E 7.85 3.57 0.00 1.74 1.75 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 1.58 1.99 0.00 125 T 7.57 3.69 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 126 I 7.55 3.42 1.58 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.96 0.58 0.00 0.00 127 K 7.09 2.48 0.00 0.79 1.16 0.00 1.30 0.00 0.00 1.25 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.70 0.21 7.81 128 E 7.73 3.87 0.00 1.87 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.09 0.00 129 A 7.53 4.09 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 0.00 130 L 6.69 4.57 0.00 1.70 1.72 1.23 1.50 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 0.00 131 P 0.00 4.27 0.00 2.23 2.02 0.00 3.70 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 2.16 2.12 0.00 132 A 8.97 4.09 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 0.00 133 D 8.27 4.51 0.00 2.72 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 0.00 134 M 8.28 4.35 0.00 2.14 2.41 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.55 0.00 135 W 7.92 4.51 0.00 3.39 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 0.00 136 G 6.83 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 P 0.00 4.08 0.00 2.07 2.05 0.00 3.49 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 138 E 7.88 3.82 0.00 1.90 1.89 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 2.31 2.28 0.00 139 M 7.67 3.93 0.00 1.78 2.08 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.90 0.00 140 R 7.34 3.68 0.00 0.93 1.73 0.00 3.17 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 1.63 1.81 0.00 141 N 8.51 4.37 0.00 2.81 3.03 0.00 0.00 6.92 7.42 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 0.00 142 A 8.19 3.96 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 0.00 143 W 8.30 4.14 0.00 3.56 3.33 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 0.00 144 G 8.51 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.83 4.05 0.00 2.29 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 2.40 2.45 0.00 146 A 8.29 3.59 0.97 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 0.00 0.00 147 Y 8.35 3.98 0.00 3.14 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 0.00 148 D 8.60 4.35 0.00 2.90 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 0.00 149 Q 8.13 3.84 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 150 L 7.84 3.75 0.00 1.58 1.61 0.84 0.94 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 0.00 151 V 7.55 3.06 1.66 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 0.15 0.00 0.00 0.11 0.00 0.00 152 A 8.31 3.80 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 0.00 153 A 7.87 3.91 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 0.00 154 I 7.68 3.78 1.69 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 1.51 0.61 0.97 0.00 0.00 155 K 8.11 3.93 0.00 1.61 1.78 0.00 1.47 0.00 0.00 1.55 0.00 0.00 3.06 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.25 1.08 7.81 156 Q 7.67 3.98 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.04 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 157 E 7.78 4.43 0.00 2.12 1.99 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 2.29 2.45 0.00 158 M 8.08 4.58 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.76 0.00 159 K 7.56 4.73 0.00 1.80 1.67 0.00 1.76 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.43 7.81 160 P 0.00 4.42 0.00 2.04 1.97 0.00 3.71 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 2.03 2.09 0.00