NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 P 4.4111 0.0000 0.0000 62.5532 33.6986 178.1705 4 L 3.8936 7.7353 119.0321 55.7699 41.7990 177.5229 5 T 3.8555 7.7617 110.1314 65.3077 69.3324 176.2847 6 V 3.6640 7.7824 123.1205 63.9950 31.1963 177.3478 7 Y 4.1136 8.2249 121.3657 61.2677 38.9163 178.4203 8 K 4.3232 8.1200 123.9357 60.2825 31.7439 180.6204 9 N 4.6442 8.1220 117.4351 56.0349 38.3810 177.5484 10 S 4.2711 8.1321 117.2892 60.9367 63.2100 176.3983 11 V 3.5658 8.0809 123.1903 65.4037 31.1969 178.1200 12 K 4.0042 8.1378 119.0371 59.5290 31.7569 178.9455 13 Q 4.0694 8.0694 118.4526 58.8313 28.4733 178.5793 14 Q 4.0089 8.6990 119.6662 58.9486 28.6331 178.6553 15 I 3.8260 7.9893 120.7831 64.1478 37.0356 178.0448 16 D 4.4009 7.9721 119.8514 57.3135 40.7012 178.3605 17 S 4.0841 7.9894 113.3671 61.5607 62.3222 176.2908 18 A 4.0023 7.8211 123.3315 55.3212 18.0805 179.3343 19 D 4.3040 7.8015 117.4529 57.3917 40.8102 178.7699 20 L 3.9481 7.8703 120.9272 57.9906 42.0259 178.7843 21 L 3.9558 8.2696 121.0318 58.0518 42.0520 179.3212 22 V 3.5983 8.0319 119.0153 64.7836 30.8278 178.2291 23 A 4.0117 8.2180 121.5726 54.8643 18.2632 179.1060 24 N 4.2931 8.4286 115.7127 56.8247 38.4825 177.0938 25 L 4.1068 8.0898 120.5689 57.7290 41.6487 179.6118 26 V 3.6007 7.8481 118.2596 65.9352 31.4446 177.4203 27 N 4.4238 7.9669 116.2220 56.8722 38.7363 176.5107 28 E 3.9762 7.8352 118.4113 59.5804 29.5641 178.9654 29 N 4.2973 7.8597 115.9870 56.7529 38.8110 176.9854 30 F 4.3161 8.2288 118.1254 60.1484 39.3435 177.2475 31 V 3.9569 7.8855 117.9943 65.6584 31.3956 177.3585 32 L 4.0624 8.2473 119.1859 57.3254 41.4306 179.3457 33 S 4.0749 8.2733 113.0833 61.3985 62.5390 176.8809 34 E 3.9980 7.9323 119.5261 59.4007 28.1666 179.2287 35 K 4.0298 8.4286 119.9468 58.3771 32.0900 178.8285 36 L 4.5093 7.7730 118.5564 56.7526 42.3330 178.2341 37 D 4.3573 7.9578 117.7738 57.3701 40.7796 178.0766 38 T 4.0384 8.1182 113.2996 64.3426 67.1942 176.3881 39 K 4.0498 7.4742 120.0191 59.2315 30.8315 178.7049 40 A 4.1238 7.9531 120.1371 54.2091 18.1837 179.0928 41 T 4.3114 7.4635 107.1422 63.9796 69.5603 177.0609 42 E 4.7895 7.7700 121.3791 58.3636 29.3531 179.2302 43 I 3.7050 7.9804 119.2864 63.8310 37.9803 177.8053 44 K 4.4449 7.3689 121.4231 59.1348 32.0123 178.8179 45 Q 3.9832 8.0871 118.3473 58.9507 28.6470 178.7517 46 L 4.0026 7.6875 120.0600 57.8901 41.6691 179.6133 47 Q 4.0207 8.1757 117.9992 58.9227 28.6612 179.0240 48 K 4.0131 8.3207 119.7110 59.5380 31.9897 179.5330 49 Q 3.9962 8.4304 118.6674 58.8689 28.5553 178.7435 50 I 3.6856 8.3096 121.1340 64.5568 37.1836 178.1240 51 D 4.3517 8.1070 119.6540 57.3944 40.6649 178.8096 52 S 4.0651 8.0169 113.4536 61.5898 62.4054 176.3585 53 L 4.0405 8.1960 121.7229 57.6587 41.2462 179.2973 54 N 4.2844 8.5700 116.7172 56.1665 38.5212 176.9333 55 A 3.9698 7.9249 122.0674 55.4866 18.4065 179.2766 56 Q 3.8787 7.8945 116.1108 59.3935 28.8767 180.0540 57 V 3.5541 7.7623 118.5221 66.0948 31.6587 177.8294 58 K 3.8210 8.1161 118.1385 59.8213 31.9898 178.8432 59 E 4.0351 8.6743 120.7629 58.7699 29.6025 178.8356 60 L 4.0503 8.2057 119.1103 57.5519 41.6046 179.6314 61 K 4.0760 7.9977 118.9974 59.2054 31.6558 179.5698 62 T 3.9596 8.1445 111.7213 64.3322 68.7791 176.7827 63 Q 4.0551 8.1615 121.1103 59.0942 28.5255 178.5046 64 T 3.8514 7.9641 115.2415 64.8135 67.3519 176.3791 65 S 4.2547 8.1436 116.0571 61.0689 63.0174 176.4651 66 Q 4.1453 8.4535 122.7687 58.5817 28.4706 178.2675 67 Q 3.9850 8.4676 118.9486 59.0526 28.6370 178.2346 68 A 3.9527 8.0250 122.8193 54.8341 18.3463 178.9768 69 E 3.8628 7.8309 117.5394 59.6586 29.6126 178.6476 70 N 4.2862 7.8543 116.3081 56.4362 38.5660 177.0830 71 S 4.0846 8.2631 114.4853 61.4591 62.3783 175.6333 72 E 3.9111 8.3900 122.0406 59.3910 29.2605 178.6965 73 V 3.6011 7.9925 118.2362 66.2506 31.4561 177.6811 74 I 3.7000 7.9880 119.4775 64.4621 36.9618 177.8496 75 K 3.9023 8.3276 120.3653 59.9640 31.8657 177.5745 76 D 4.3551 8.4100 118.0591 57.6084 41.0802 177.7711 77 L 3.9712 8.2607 120.4929 59.3018 41.7978 178.1293 78 Y 4.0233 8.1877 114.9474 61.3196 37.9047 178.2510 79 E 4.2953 8.5264 122.0718 60.4077 30.3468 178.5357 80 Y 4.0747 8.6475 115.8580 61.8439 38.2887 177.5468 81 L 4.6350 8.4262 125.5179 55.4495 40.2131 177.4507 82 C 4.7444 8.2511 113.0715 60.6580 34.5554 174.8339 83 N 4.3978 8.3616 115.7143 53.3164 36.5743 174.2689 84 V 4.5966 7.7520 117.4235 60.2690 34.1033 173.5054 85 R 4.5676 8.7783 125.5201 54.2232 32.8405 174.8416 86 V 4.3626 8.1963 126.2016 62.2034 31.3009 175.2675 87 H 4.4766 8.4488 124.8590 58.7586 28.8649 175.6092 88 K 4.6268 7.6126 113.5848 56.3577 36.1165 174.7538 89 S 4.3541 8.1412 113.8274 59.0973 64.9901 174.4813 90 Y 4.8648 6.7536 123.8886 56.0676 41.7059 174.7141 91 E 5.4443 8.1829 118.5159 53.9804 29.5812 175.2258 92 D 4.5258 8.3430 118.5020 54.1366 41.7630 177.8906 93 D 4.1021 8.2858 127.4168 55.2069 41.2264 176.8536 94 S 4.2445 9.0059 114.5078 59.9099 61.8181 173.3189 95 G 4.5904 9.1782 115.8553 45.6076 0.0000 171.4484 96 L 5.6832 8.1994 122.0923 53.3729 43.7120 175.1664 97 W 5.4133 8.0256 118.4191 55.0621 33.7730 174.2265 98 F 5.1773 9.1774 120.7356 55.7602 42.2823 174.0403 99 D 5.1529 8.9104 122.1783 54.3722 43.0037 174.8234 100 I 4.8528 8.6936 123.0073 59.8755 42.0091 174.3480 101 S 5.3125 8.5401 119.3685 55.6310 67.6574 173.3051 *115 I 4.1040 8.1475 120.9277 61.4522 37.9389 175.0833 116 M 4.7313 8.6165 123.9740 53.7057 34.1925 174.3350 117 D 5.1151 8.7089 126.7586 54.3468 42.8338 175.2823 118 Y 4.9114 8.0874 119.4678 56.4241 42.1352 173.1151 119 K 5.3920 9.0394 117.2979 54.7929 36.7916 175.7666 120 L 5.2192 9.1008 121.8535 53.0305 45.4137 175.9297 121 G 3.2402 8.1142 109.8199 43.9130 0.0000 171.9641 122 F 4.9686 8.6436 119.7367 55.7005 40.8277 175.4608 123 V 4.0926 8.3415 123.4909 64.0774 34.0454 175.4799 *130 T 4.3571 7.7412 108.0259 61.9635 69.8501 172.7162 131 E 4.6244 7.8913 119.3423 55.6202 33.7784 173.7818 132 V 4.0492 8.0206 122.4062 60.9842 35.9081 174.3432 133 I 4.4169 7.3484 123.1592 59.8758 41.5935 173.4427 134 Y 5.2436 8.5539 128.2584 55.6821 41.3210 174.0811 135 A 4.8918 8.0974 127.3231 49.2202 22.3155 173.5309 136 P 4.4541 0.0000 0.0000 62.6013 32.4659 176.6723 137 V 4.2761 8.5541 123.2177 60.8088 32.9181 174.6141 138 L 4.8704 7.9988 127.4288 54.8640 43.0986 178.6571 139 K 4.3291 8.0447 122.3073 58.7818 32.5623 176.2947 140 Q 4.5309 7.6599 114.9665 54.2846 30.9362 174.0165 141 R 4.4889 8.2682 120.3662 55.5587 33.1194 173.5534 142 S 4.7055 10.7700 118.1009 57.0131 64.1672 175.4787 143 T 3.9945 8.8194 117.2031 65.2983 68.0573 175.6053 144 E 4.0268 8.3340 119.5367 59.4185 29.2327 179.1192 145 E 3.9590 8.5986 119.6264 59.3093 29.1940 179.0744 146 L 3.3359 8.0975 118.2942 57.6869 41.3983 178.5671 147 Y 4.1667 7.9588 115.7146 59.4824 38.7475 177.5497 148 S 4.1753 8.0747 114.3246 61.7332 62.3820 176.4721 149 L 4.2113 8.8953 122.5263 57.8195 41.2393 179.3088 150 Q 4.3881 7.6793 116.0380 58.2077 28.6205 178.1808 151 S 4.4126 7.7110 115.0603 60.6739 63.5066 176.0359 152 K 4.2285 7.6314 119.8119 56.6962 32.3784 176.8412 153 L 4.7258 7.2819 117.0787 51.7670 45.4068 174.6309 154 P 4.4769 0.0000 0.0000 62.0501 32.1488 177.4485 155 E 4.5654 8.8655 121.5251 59.5330 29.9459 178.6916 156 Y 5.0675 7.9758 115.4093 59.4816 38.4393 177.4106 157 L 3.8598 6.0701 119.2920 57.5640 41.6243 179.1723 158 F 4.6715 7.2238 112.7730 58.1727 38.7235 174.6408 159 E 4.9229 8.3314 119.0636 54.2373 32.3895 175.2465 160 T 5.2109 8.4198 116.8978 64.1135 69.6237 173.1261 161 L 4.9614 8.4223 122.9080 54.0731 47.2294 175.1557 162 S 4.6666 8.5568 114.8166 58.0377 66.6017 174.2354 163 F 5.0975 7.0576 118.8755 54.1813 41.8904 172.4220 164 P 4.6937 0.0000 0.0000 62.1071 32.3019 176.9196 165 L 3.9736 8.6982 121.0938 58.8689 41.5938 179.2800 166 S 4.1138 8.1964 113.2450 61.8430 63.0297 176.1770 167 S 4.4388 8.1838 115.9137 59.3907 62.8513 175.6390 168 L 3.8959 8.4467 124.5435 58.3014 41.7903 177.9568 169 N 4.2695 8.3026 116.0239 57.1720 38.5302 176.7016 170 Q 3.9697 8.0014 117.6733 59.3237 29.2230 177.7246 171 F 3.8733 8.2816 121.2751 61.4502 39.2013 176.4615 172 Y 4.1761 8.5758 118.5806 60.9797 38.8074 178.6266 173 N 4.1060 8.2691 117.2639 56.0351 38.1495 177.2231 174 K 3.7110 7.8564 120.9560 59.6664 31.9918 178.9399 175 I 3.4445 7.0843 118.0892 63.8688 37.3063 177.8754 176 A 3.9153 7.4604 121.6965 55.1203 18.0002 179.7772 177 K 3.8331 7.7474 115.6776 59.6786 32.1478 179.2513 178 S 4.2781 7.5064 113.3432 59.8666 62.9823 174.5780 179 L 4.3383 7.5102 127.2941 55.0599 42.0178 175.5998 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 3 P 0.00 4.41 0.00 2.21 2.16 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 4 L 7.74 3.89 0.00 1.77 1.62 0.56 0.28 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 5 T 7.76 3.86 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 1.24 0.00 0.00 6 V 7.78 3.66 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 0.90 0.00 0.00 0.95 0.00 0.00 7 Y 8.22 4.11 0.00 3.00 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 8 K 8.12 4.32 0.00 1.80 1.82 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.37 7.81 9 N 8.12 4.64 0.00 2.94 2.91 0.00 0.00 6.79 8.51 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 10 S 8.13 4.27 0.00 3.98 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 11 V 8.08 3.57 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.87 0.00 0.00 12 K 8.14 4.00 0.00 2.11 1.91 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.50 7.81 13 Q 8.07 4.07 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 14 Q 8.70 4.01 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.66 2.48 0.00 15 I 7.99 3.83 1.90 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 1.53 0.97 0.92 0.00 0.00 16 D 7.97 4.40 0.00 2.85 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 7.99 4.08 0.00 3.97 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 18 A 7.82 4.00 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 19 D 7.80 4.30 0.00 2.86 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 20 L 7.87 3.95 0.00 1.78 1.84 0.93 0.59 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 21 L 8.27 3.96 0.00 1.77 1.90 0.92 0.78 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 22 V 8.03 3.60 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 0.85 0.00 0.00 0.93 0.00 0.00 23 A 8.22 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 24 N 8.43 4.29 0.00 2.85 3.08 0.00 0.00 7.24 6.51 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 25 L 8.09 4.11 0.00 1.85 1.70 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 26 V 7.85 3.60 2.32 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 1.14 0.00 0.00 0.98 0.00 0.00 27 N 7.97 4.42 0.00 2.87 3.00 0.00 0.00 7.23 7.53 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 28 E 7.84 3.98 0.00 2.22 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 2.35 2.56 0.00 29 N 7.86 4.30 0.00 2.80 2.87 0.00 0.00 7.28 7.59 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 30 F 8.23 4.32 0.00 3.33 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 V 7.89 3.96 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 1.05 0.00 0.00 32 L 8.25 4.06 0.00 1.89 1.64 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.27 4.07 0.00 3.86 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 34 E 7.93 4.00 0.00 2.37 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 2.64 2.28 0.00 35 K 8.43 4.03 0.00 1.91 1.92 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.50 7.81 36 L 7.77 4.51 0.00 1.73 1.70 0.99 1.00 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 37 D 7.96 4.36 0.00 2.91 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.12 4.04 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 1.27 0.00 0.00 39 K 7.47 4.05 0.00 1.99 1.83 0.00 1.75 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.74 1.60 7.81 40 A 7.95 4.12 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 41 T 7.46 4.31 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 1.27 0.00 0.00 42 E 7.77 4.79 0.00 2.21 2.05 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 2.33 2.18 0.00 43 I 7.98 3.70 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 1.57 1.35 0.94 0.00 0.00 44 K 7.37 4.44 0.00 2.15 1.86 0.00 1.69 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.39 7.81 45 Q 8.09 3.98 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 46 L 7.69 4.00 0.00 1.82 1.72 0.92 0.95 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 47 Q 8.18 4.02 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 48 K 8.32 4.01 0.00 1.95 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.70 7.81 49 Q 8.43 4.00 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 50 I 8.31 3.69 2.08 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 1.52 0.94 0.91 0.00 0.00 51 D 8.11 4.35 0.00 2.84 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 52 S 8.02 4.07 0.00 4.04 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 53 L 8.20 4.04 0.00 1.98 1.70 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 54 N 8.57 4.28 0.00 2.87 2.86 0.00 0.00 6.83 7.07 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 55 A 7.92 3.97 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 56 Q 7.89 3.88 0.00 2.35 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.65 0.00 57 V 7.76 3.55 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 58 K 8.12 3.82 0.00 2.06 1.87 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.48 7.81 59 E 8.67 4.04 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.21 0.00 60 L 8.21 4.05 0.00 1.87 1.70 0.92 0.64 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 61 K 8.00 4.08 0.00 2.01 1.85 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.73 7.81 62 T 8.14 3.96 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 63 Q 8.16 4.06 0.00 2.31 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 64 T 7.96 3.85 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 1.26 0.00 0.00 65 S 8.14 4.25 0.00 4.12 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 0.00 66 Q 8.45 4.15 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 67 Q 8.47 3.98 0.00 2.27 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.49 2.39 0.00 68 A 8.03 3.95 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 69 E 7.83 3.86 0.00 2.08 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 0.00 2.32 2.42 0.00 70 N 7.85 4.29 0.00 2.97 2.88 0.00 0.00 6.73 7.70 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 71 S 8.26 4.08 0.00 4.12 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 E 8.39 3.91 0.00 2.26 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 2.33 2.35 0.00 73 V 7.99 3.60 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 1.08 0.00 0.00 0.95 0.00 0.00 74 I 7.99 3.70 2.11 0.00 0.00 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 1.69 0.86 1.16 0.00 0.00 75 K 8.33 3.90 0.00 1.84 2.07 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.49 7.81 76 D 8.41 4.36 0.00 3.02 2.76 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 77 L 8.26 3.97 0.00 1.76 1.94 0.84 1.08 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 78 Y 8.19 4.02 0.00 3.28 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 79 E 8.53 4.30 0.00 1.96 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 0.00 2.29 2.22 0.00 80 Y 8.65 4.07 0.00 3.36 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 81 L 8.43 4.64 0.00 1.80 1.76 0.92 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 82 C 8.25 4.74 0.00 3.56 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 83 N 8.36 4.40 0.00 2.94 2.92 0.00 0.00 6.71 7.45 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 84 V 7.75 4.60 2.40 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 0.88 0.00 0.00 1.06 0.00 0.00 85 R 8.78 4.57 0.00 1.85 1.65 0.00 3.09 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 86 V 8.20 4.36 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 0.88 0.00 0.00 0.79 0.00 0.00 87 H 8.45 4.48 0.00 3.32 3.38 0.00 5.67 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 88 K 7.61 4.63 0.00 1.82 1.93 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.59 7.81 89 S 8.14 4.35 0.00 3.18 3.52 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 90 Y 6.75 4.86 0.00 2.97 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 91 E 8.18 5.44 0.00 1.79 1.85 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 2.14 2.07 0.00 92 D 8.34 4.53 0.00 2.59 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.29 4.10 0.00 2.79 1.76 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 94 S 9.01 4.24 0.00 3.92 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 95 G 9.18 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 96 L 8.20 5.68 0.00 1.28 1.67 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 97 W 8.03 5.41 0.00 3.41 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 9.18 5.18 0.00 2.81 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 99 D 8.91 5.15 0.00 3.05 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 0.00 100 I 8.69 4.85 0.77 0.00 0.00 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 1.07 0.94 0.76 0.00 0.00 101 S 8.54 5.31 0.00 3.81 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *115 I 8.15 4.10 1.92 0.00 0.00 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 1.34 0.51 0.97 0.00 0.00 116 M 8.62 4.73 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.72 0.00 117 D 8.71 5.12 0.00 2.89 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.09 4.91 0.00 3.06 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 0.00 119 K 9.04 5.39 0.00 2.02 2.13 0.00 1.82 0.00 0.00 2.08 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.56 7.81 120 L 9.10 5.22 0.00 1.96 1.56 1.23 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 121 G 8.11 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 F 8.64 4.97 0.00 2.88 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 0.00 123 V 8.34 4.09 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 1.02 0.00 0.00 0.92 0.00 0.00 *130 T 7.74 4.36 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 131 E 7.89 4.62 0.00 1.92 1.69 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 1.95 2.06 0.00 132 V 8.02 4.05 1.46 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 0.24 0.00 0.00 0.48 0.00 0.00 133 I 7.35 4.42 1.42 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.33 0.87 0.00 0.00 134 Y 8.55 5.24 0.00 3.16 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 0.00 135 A 8.10 4.89 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 0.00 136 P 0.00 4.45 0.00 2.05 2.18 0.00 3.65 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 137 V 8.55 4.28 2.30 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 0.83 0.00 0.00 1.00 0.00 0.00 138 L 8.00 4.87 0.00 1.64 1.62 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 139 K 8.04 4.33 0.00 1.70 1.84 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.55 7.81 140 Q 7.66 4.53 0.00 2.14 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.52 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 141 R 8.27 4.49 0.00 1.74 1.80 0.00 3.30 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.83 0.00 142 S 10.77 4.71 0.00 4.50 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 0.00 143 T 8.82 3.99 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 144 E 8.33 4.03 0.00 2.24 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 0.00 2.39 2.45 0.00 145 E 8.60 3.96 0.00 2.10 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 2.36 2.38 0.00 146 L 8.10 3.34 0.00 1.85 1.54 0.87 0.82 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 0.00 147 Y 7.96 4.17 0.00 2.99 2.96 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 0.00 148 S 8.07 4.18 0.00 4.05 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 0.00 149 L 8.90 4.21 0.00 1.81 1.87 1.04 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 7.68 4.39 0.00 1.91 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.98 0.00 0.00 0.00 0.00 0.00 1.64 1.97 0.00 151 S 7.71 4.41 0.00 4.03 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 0.00 152 K 7.63 4.23 0.00 1.84 2.07 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.70 7.81 153 L 7.28 4.73 0.00 1.18 1.13 0.84 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 154 P 0.00 4.48 0.00 1.32 2.13 0.00 3.22 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.10 0.00 155 E 8.87 4.57 0.00 2.14 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 2.44 0.00 156 Y 7.98 5.07 0.00 3.13 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 0.00 157 L 6.07 3.86 0.00 0.87 1.25 0.23 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 158 F 7.22 4.67 0.00 3.27 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.33 4.92 0.00 2.24 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 2.40 2.67 0.00 160 T 8.42 5.21 4.32 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 1.31 0.00 0.00 161 L 8.42 4.96 0.00 1.75 1.69 1.23 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 162 S 8.56 4.67 0.00 3.58 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 F 7.06 5.10 0.00 3.02 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 P 0.00 4.69 0.00 2.26 2.23 0.00 3.87 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 2.12 1.98 0.00 165 L 8.70 3.97 0.00 1.83 1.76 1.04 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.20 4.11 0.00 3.89 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 0.00 167 S 8.18 4.44 0.00 3.93 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 L 8.45 3.90 0.00 1.93 1.72 1.15 0.85 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 0.00 169 N 8.30 4.27 0.00 2.85 2.87 0.00 0.00 7.02 6.88 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 0.00 170 Q 8.00 3.97 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 171 F 8.28 3.87 0.00 2.63 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 8.58 4.18 0.00 3.20 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 N 8.27 4.11 0.00 2.92 2.81 0.00 0.00 6.73 8.07 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 0.00 174 K 7.86 3.71 0.00 1.69 1.59 0.00 1.36 0.00 0.00 1.53 0.00 0.00 3.03 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.25 7.81 175 I 7.08 3.44 1.65 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.13 0.75 0.00 0.00 176 A 7.46 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 K 7.75 3.83 0.00 1.77 1.82 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.57 7.81 178 S 7.51 4.28 0.00 3.72 4.04 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 0.00 179 L 7.51 4.34 0.00 1.70 1.48 0.92 0.88 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 * Residues marked with a * may have inaccurate shift predictions.