NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2541 8.3344 116.7626 58.3746 64.2499 171.6252 5 V 3.7582 8.1461 121.5755 61.6193 31.6029 171.1287 6 V 4.0877 8.9824 128.4002 62.0575 33.6773 174.5651 7 K 4.7097 8.1438 123.0668 54.3254 35.1602 177.3237 8 S 4.2105 9.0139 119.2358 61.9559 62.8282 176.4974 9 E 4.2965 8.1643 115.2847 58.2685 29.6565 176.5770 10 D 4.6990 8.2213 120.6099 54.4991 40.8409 177.9547 11 Y 4.0729 7.3114 119.4152 59.8042 37.8377 176.9806 12 A 4.3225 7.0063 120.4143 52.2812 19.1328 176.5957 13 L 4.6983 7.3749 116.0498 51.8275 43.8872 174.8473 14 P 4.4495 0.0000 0.0000 62.8480 31.8666 176.1843 15 S 4.8566 8.2202 114.9195 56.3675 65.9330 173.1146 16 Y 4.3443 8.4850 122.9367 57.4467 39.4173 175.1490 17 V 4.2064 6.6981 123.4033 60.4852 34.0888 173.1164 18 D 4.6771 8.3450 123.0795 52.7632 41.8656 176.0890 19 R 4.4615 8.1027 119.8430 54.6794 32.1929 176.0577 20 R 3.7437 8.6472 121.7667 59.2322 30.1519 176.8097 21 D 4.8333 7.9867 114.1883 53.3371 40.3667 176.7044 22 Y 4.8644 8.3009 121.0179 55.9897 39.5276 173.3008 23 P 4.2348 0.0000 0.0000 65.0506 31.8889 177.2124 24 L 4.6053 6.6571 116.8913 51.4809 40.7000 174.2995 25 P 4.4715 0.0000 0.0000 62.5431 31.9508 177.3532 26 D 4.3593 8.6682 118.6666 56.2711 41.1276 176.9343 27 V 4.4971 7.2298 117.2758 60.6519 34.8106 174.3394 28 A 4.2201 8.3943 128.2468 52.1060 18.9800 177.3142 29 H 3.6568 8.5214 122.0776 58.0714 30.0006 175.8799 30 V 4.1229 7.2438 118.7664 60.9597 32.4757 175.1169 31 K 4.1252 8.4112 126.8887 57.1251 32.7454 176.3547 32 N 4.7673 7.8811 115.6917 51.3244 39.1375 174.0276 33 L 4.5375 8.1972 123.8751 53.8046 43.0773 177.9401 34 S 4.5368 8.7098 118.0090 56.9457 66.0586 175.0551 35 A 3.9548 8.4454 122.6217 55.6494 17.9294 179.7068 36 S 4.0862 8.0587 111.8398 61.9152 62.9406 176.5997 37 Q 3.9775 7.9381 121.5407 58.5563 28.3309 178.7164 38 K 4.1365 8.5820 119.7897 59.1836 31.9940 179.3518 39 A 3.9739 7.8788 121.1813 54.8805 18.3935 179.1996 40 L 3.8852 8.0216 118.9717 58.5419 41.9288 179.4128 41 K 3.9788 8.3199 117.1433 59.3776 32.1123 178.5887 42 E 4.1264 7.9371 119.5607 58.9565 29.5753 178.5431 43 K 3.9239 8.6017 120.1162 59.4212 31.9756 178.2157 44 E 4.2200 8.1858 118.5784 58.5834 29.6257 177.6057 45 K 4.2387 8.1341 116.7333 57.7582 32.9873 177.3537 46 A 4.4748 7.6541 124.3631 51.4774 20.3908 176.3865 47 S 4.2047 8.3588 108.6592 57.9304 63.4878 176.4431 48 W 4.6771 8.2858 126.4000 59.3029 29.1735 178.1352 49 S 4.4321 7.7725 111.2183 59.9356 62.4729 174.9070 50 S 4.5865 7.7747 115.9210 58.7885 63.3921 174.3766 51 L 4.5368 7.6331 121.2483 54.0789 42.3727 177.4118 52 S 4.5605 9.2688 117.7252 57.4884 65.6069 175.4033 53 I 3.6694 8.3253 123.8097 65.1427 36.7966 178.2094 54 D 4.4794 8.1322 118.7135 57.5370 40.5504 178.7129 55 E 4.0071 7.9629 118.9858 59.2183 29.4741 179.5234 56 K 3.9244 8.3322 119.0318 59.2807 32.0111 179.6579 57 V 3.5923 8.3106 118.9083 66.0518 31.3064 177.6158 58 E 3.9287 8.2930 118.1129 59.1277 29.6804 178.2681 59 L 4.0382 8.1781 120.5285 58.2244 42.2534 178.1840 60 Y 4.0591 8.0466 119.3379 60.9481 38.6248 178.2009 61 R 4.4467 8.2356 117.6940 57.4127 30.4903 178.0105 62 L 4.0772 7.8581 121.1159 57.0921 42.0958 178.2999 63 K 3.5731 7.3827 118.9339 57.1895 32.6173 176.1624 64 F 5.2098 6.8537 116.3576 55.3884 42.3056 176.2055 65 K 3.8245 9.2236 124.6812 58.5827 32.2915 177.0424 66 E 5.6492 8.3192 115.3774 53.2421 32.5669 176.6203 67 S 5.3689 8.5650 118.2158 57.0398 65.8734 175.2789 68 F 3.8484 9.1087 120.4582 60.7925 38.3766 177.7541 69 A 4.0972 8.1020 118.8642 55.1894 18.3594 179.1319 70 E 4.1112 8.0312 117.3311 59.7227 29.4079 179.3881 71 M 4.1850 8.1631 115.8368 57.5570 31.3496 177.2561 72 N 4.7442 7.7602 115.8359 51.9712 39.3517 175.0594 73 R 3.9909 7.2046 121.3671 56.5018 30.7542 175.7858 74 S 4.6798 8.4624 118.7672 57.0606 63.8022 173.2204 75 T 4.6149 8.2569 116.0921 60.4629 71.3178 173.6277 76 N 4.7761 8.3131 115.2433 53.1489 39.1858 176.4243 77 E 3.8762 8.0385 122.6817 59.3565 29.5086 178.7865 78 W 4.4565 8.4464 116.0092 59.8568 27.7118 178.1781 79 K 3.1017 6.6484 118.6956 59.3405 31.3124 179.3640 80 T 3.7692 7.5818 115.3539 66.4359 68.3579 176.7807 81 V 3.6079 7.8526 120.1261 66.0552 31.6181 178.2924 82 V 3.8128 8.6267 118.4435 65.8945 31.3805 178.0997 83 G 3.6277 8.4138 105.4123 47.9848 0.0000 175.4476 84 A 4.1244 8.4365 124.1449 54.5002 18.2815 179.5245 85 A 4.1312 8.2707 119.2334 55.9507 18.5337 179.9171 86 M 4.0794 8.4504 117.1552 58.1964 31.8333 178.9821 87 F 3.9844 8.4207 121.1970 61.4063 39.7928 177.3616 88 F 4.0102 8.5702 117.4132 60.3633 38.4193 177.8625 89 I 3.9595 8.0575 119.4812 64.1973 37.1863 178.3249 90 G 3.6320 8.2700 106.8683 47.6777 0.0000 175.4448 91 F 3.9668 8.0808 123.3238 61.3463 39.2610 177.3403 92 T 3.6643 7.8141 114.7640 66.4253 68.1581 176.3068 93 A 4.0414 7.8209 122.3997 54.8266 18.2655 179.7095 94 L 3.8951 7.5230 117.6160 57.7460 41.6084 179.3952 95 L 3.9264 7.4803 118.9678 57.5711 41.4299 179.5605 96 L 3.9979 7.7630 118.3450 57.9202 41.7028 179.2499 97 I 3.7087 7.9938 119.9572 64.2546 36.9938 178.1416 98 W 4.2749 8.7644 129.3379 60.5852 30.5215 177.4824 99 E 3.9874 8.9408 119.6019 59.3043 28.8574 178.6942 100 K 4.0761 8.0473 118.5330 59.6483 32.2941 178.0939 101 H 4.0119 7.8818 117.5102 59.2621 29.9759 176.2547 102 Y 4.1647 7.4466 116.0378 58.3492 38.2240 176.6687 103 V 3.9868 7.2041 118.1736 64.3245 32.7968 175.8524 104 Y 4.6279 7.6333 116.9573 57.7469 38.4188 176.2328 105 G 3.9746 8.4662 114.9943 44.1238 0.0000 170.8751 106 P 4.5111 0.0000 0.0000 61.7030 32.4929 175.9244 107 I 3.9373 7.8168 113.6446 59.4421 38.7368 173.8565 108 P 4.2989 0.0000 0.0000 63.0981 31.8128 177.3356 109 H 4.3044 8.5814 116.1991 57.8654 28.4837 176.6502 110 T 2.9028 7.0173 108.9655 61.9811 68.6567 174.9126 111 F 4.4923 7.5371 120.3464 58.1250 39.9683 176.7577 112 E 4.2583 7.7888 119.0986 55.7978 31.4314 177.3040 113 E 3.9594 8.9044 121.3418 59.9537 29.5934 179.3824 114 E 3.9036 8.3009 118.2508 59.1131 29.6716 178.1289 115 W 3.9686 8.3791 127.6510 60.9263 30.6672 178.2629 116 V 3.4946 8.1347 111.6256 64.1114 30.7525 178.5935 117 A 4.0289 7.9395 120.8303 55.0563 18.2760 179.8898 118 K 3.8146 8.1068 117.0983 59.5067 32.0808 179.3594 119 Q 3.9162 8.6605 120.5325 59.6029 28.8445 178.6375 120 T 4.0475 8.2270 116.9134 66.2579 68.3878 176.7379 121 K 3.6442 7.6627 121.5755 59.3775 32.1998 178.7942 122 R 3.8212 8.3172 119.3470 59.6659 29.9194 178.2664 123 M 3.9887 8.3310 118.7014 58.5939 31.8772 178.8637 124 L 4.1161 8.1845 119.0567 57.6642 41.3433 179.4779 125 D 4.4355 8.1729 119.2262 57.1349 40.8596 177.5915 126 M 4.3377 8.0599 114.8683 54.1068 32.1310 176.1875 127 K 3.9612 7.6710 116.7757 56.3369 30.5101 176.3795 128 V 3.4293 7.9349 118.2379 64.0724 32.4699 174.6437 129 A 4.2886 8.6544 131.0220 52.8397 15.2285 175.2848 130 P 4.6612 0.0000 0.0000 63.6374 32.7894 178.6620 131 I 4.1548 7.8086 119.4506 63.7885 37.6588 176.0877 132 Q 4.6557 7.9418 114.1931 57.2275 35.0548 176.3656 133 G 3.7542 8.4140 105.8132 48.0961 0.0000 172.7269 134 F 4.7743 7.8533 120.3292 58.9555 41.9327 176.9039 135 S 4.4537 9.1213 117.2852 61.3579 63.1584 176.3162 136 A 4.3513 8.2040 121.0046 53.6193 18.4884 177.5594 137 K 4.6433 8.6998 115.4314 55.6264 33.5232 175.3501 138 W 4.7681 8.0026 130.8575 55.5009 32.4698 175.1317 139 D 4.3786 7.6859 127.5931 52.8911 40.2156 176.4334 140 Y 4.3202 8.4020 124.3314 60.7073 38.1927 178.0170 141 D 4.4658 7.5815 118.3847 57.1379 41.1562 177.4386 142 K 4.1272 7.9110 115.4332 55.7770 32.5010 176.7274 143 N 3.8935 7.2911 115.0016 53.4302 36.7504 173.2778 144 E 4.1661 5.9000 113.0120 54.0560 33.8232 175.4551 145 W 4.5345 8.3043 121.0454 56.4407 29.6050 176.5225 146 K 3.9583 8.7073 124.5383 56.8036 32.5819 177.0837 147 K 3.9512 8.2382 121.9759 57.4722 32.2741 174.4875 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 4 S 8.33 4.25 0.00 3.83 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 5 V 8.15 3.76 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 0.74 0.00 0.00 0.92 0.00 0.00 6 V 8.98 4.09 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 0.90 0.00 0.00 0.98 0.00 0.00 7 K 8.14 4.71 0.00 1.81 1.64 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.42 7.81 8 S 9.01 4.21 0.00 3.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.16 4.30 0.00 2.05 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 0.00 2.30 2.33 0.00 10 D 8.22 4.70 0.00 2.95 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 11 Y 7.31 4.07 0.00 3.08 3.29 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 12 A 7.01 4.32 1.03 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 13 L 7.37 4.70 0.00 1.74 1.57 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.45 0.00 2.07 2.03 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 15 S 8.22 4.86 0.00 3.97 3.83 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 16 Y 8.48 4.34 0.00 3.01 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 17 V 6.70 4.21 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 0.65 0.00 0.00 0.85 0.00 0.00 18 D 8.35 4.68 0.00 2.66 2.57 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 19 R 8.10 4.46 0.00 1.89 1.92 0.00 2.92 0.00 0.00 3.50 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.69 0.00 20 R 8.65 3.74 0.00 1.82 2.17 0.00 3.32 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 21 D 7.99 4.83 0.00 2.84 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 22 Y 8.30 4.86 0.00 2.92 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 23 P 0.00 4.23 0.00 2.26 2.43 0.00 3.74 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.03 0.00 24 L 6.66 4.61 0.00 1.58 1.67 0.93 1.14 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 25 P 0.00 4.47 0.00 2.39 1.69 0.00 3.93 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 26 D 8.67 4.36 0.00 2.76 2.80 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 27 V 7.23 4.50 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 0.84 0.00 0.00 0.97 0.00 0.00 28 A 8.39 4.22 1.14 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 29 H 8.52 3.66 0.00 2.16 3.11 0.00 5.73 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.24 4.12 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 0.78 0.00 0.00 0.70 0.00 0.00 31 K 8.41 4.13 0.00 1.75 1.81 0.00 1.60 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.40 7.81 32 N 7.88 4.77 0.00 2.65 2.73 0.00 0.00 6.91 7.85 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 33 L 8.20 4.54 0.00 1.61 1.56 0.89 0.90 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 34 S 8.71 4.54 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.45 3.95 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.06 4.09 0.00 4.05 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 37 Q 7.94 3.98 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 38 K 8.58 4.14 0.00 1.99 1.86 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.45 1.65 7.81 39 A 7.88 3.97 1.38 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 0.00 0.00 40 L 8.02 3.89 0.00 1.92 1.73 1.03 0.47 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 41 K 8.32 3.98 0.00 1.89 1.87 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.73 1.58 7.81 42 E 7.94 4.13 0.00 2.22 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 2.31 2.37 0.00 43 K 8.60 3.92 0.00 1.97 1.97 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.49 7.81 44 E 8.19 4.22 0.00 2.19 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 2.62 2.45 0.00 45 K 8.13 4.24 0.00 1.86 1.87 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.70 7.81 46 A 7.65 4.47 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 47 S 8.36 4.20 0.00 3.80 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.29 4.68 0.00 3.52 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 49 S 7.77 4.43 0.00 4.03 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 50 S 7.77 4.59 0.00 4.08 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 51 L 7.63 4.54 0.00 1.84 1.63 1.03 0.93 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 52 S 9.27 4.56 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.33 3.67 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 1.64 0.76 0.90 0.00 0.00 54 D 8.13 4.48 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 7.96 4.01 0.00 2.18 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 2.34 2.36 0.00 56 K 8.33 3.92 0.00 1.94 1.82 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.44 7.81 57 V 8.31 3.59 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 1.11 0.00 0.00 0.91 0.00 0.00 58 E 8.29 3.93 0.00 2.10 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 2.32 2.33 0.00 59 L 8.18 4.04 0.00 2.09 1.67 0.89 0.99 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 60 Y 8.05 4.06 0.00 3.08 3.15 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 61 R 8.24 4.45 0.00 1.86 2.03 0.00 3.46 0.00 0.00 3.31 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.73 0.00 62 L 7.86 4.08 0.00 2.02 1.52 0.87 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.38 3.57 0.00 1.40 0.75 0.00 1.29 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.31 0.44 7.81 64 F 6.85 5.21 0.00 2.72 2.89 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 65 K 9.22 3.82 0.00 1.10 2.10 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.11 7.81 66 E 8.32 5.65 0.00 2.14 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 2.37 2.21 0.00 67 S 8.57 5.37 0.00 4.10 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 68 F 9.11 3.85 0.00 3.08 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 69 A 8.10 4.10 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.03 4.11 0.00 2.16 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 0.00 2.36 2.36 0.00 71 M 8.16 4.18 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 72 N 7.76 4.74 0.00 2.81 2.89 0.00 0.00 6.93 7.06 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 73 R 7.20 3.99 0.00 1.82 1.93 0.00 3.26 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 74 S 8.46 4.68 0.00 3.90 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 75 T 8.26 4.61 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 1.24 0.00 0.00 76 N 8.31 4.78 0.00 2.66 2.60 0.00 0.00 6.43 7.66 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 77 E 8.04 3.88 0.00 2.02 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 0.00 2.36 2.36 0.00 78 W 8.45 4.46 0.00 3.65 3.39 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 79 K 6.65 3.10 0.00 1.42 1.38 0.00 1.25 0.00 0.00 1.24 0.00 0.00 2.69 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.58 3.77 4.33 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 1.18 0.00 0.00 81 V 7.85 3.61 2.34 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 1.08 0.00 0.00 1.04 0.00 0.00 82 V 8.63 3.81 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 1.18 0.00 0.00 1.24 0.00 0.00 83 G 8.41 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 84 A 8.44 4.12 1.55 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 0.00 0.00 85 A 8.27 4.13 1.53 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 86 M 8.45 4.08 0.00 2.13 2.33 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 2.94 2.62 0.00 87 F 8.42 3.98 0.00 3.14 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 88 F 8.57 4.01 0.00 3.33 3.13 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 89 I 8.06 3.96 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.70 0.94 0.00 0.00 90 G 8.27 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 91 F 8.08 3.97 0.00 2.60 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 92 T 7.81 3.66 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 1.19 0.00 0.00 93 A 7.82 4.04 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 94 L 7.52 3.90 0.00 1.47 1.56 0.88 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.48 3.93 0.00 1.71 1.59 0.83 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.76 4.00 0.00 1.87 1.74 0.92 0.88 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 I 7.99 3.71 2.06 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 1.42 0.85 0.96 0.00 0.00 98 W 8.76 4.27 0.00 3.41 3.36 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 99 E 8.94 3.99 0.00 2.32 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 1.71 2.20 0.00 100 K 8.05 4.08 0.00 1.85 1.99 0.00 1.92 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.48 7.81 101 H 7.88 4.01 0.00 3.12 2.89 0.00 5.81 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.45 4.16 0.00 1.45 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 0.00 0.00 0.00 0.00 103 V 7.20 3.99 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 0.71 0.00 0.00 0.88 0.00 0.00 104 Y 7.63 4.63 0.00 3.11 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 0.00 105 G 8.47 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 0.00 0.00 0.00 106 P 0.00 4.51 0.00 2.15 2.01 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.92 0.00 107 I 7.82 3.94 1.51 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.46 0.59 0.00 0.00 108 P 0.00 4.30 0.00 2.30 1.94 0.00 3.69 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.09 0.00 109 H 8.58 4.30 0.00 3.26 3.47 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.02 2.90 3.40 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 -0.18 0.00 0.00 111 F 7.54 4.49 0.00 3.11 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 0.00 112 E 7.79 4.26 0.00 2.33 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 2.63 2.52 0.00 113 E 8.90 3.96 0.00 2.08 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 0.00 2.47 2.47 0.00 114 E 8.30 3.90 0.00 2.09 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 2.38 2.38 0.00 115 W 8.38 3.97 0.00 3.60 3.17 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 0.00 116 V 8.13 3.49 2.17 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 0.89 0.00 0.00 1.07 0.00 0.00 117 A 7.94 4.03 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 0.00 118 K 8.11 3.81 0.00 1.61 1.59 0.00 1.37 0.00 0.00 1.32 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.45 7.81 119 Q 8.66 3.92 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 120 T 8.23 4.05 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 121 K 7.66 3.64 0.00 1.84 1.76 0.00 1.67 0.00 0.00 1.43 0.00 0.00 2.80 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.26 1.49 7.81 122 R 8.32 3.82 0.00 1.76 1.96 0.00 3.08 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 123 M 8.33 3.99 0.00 1.89 2.26 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.45 0.00 124 L 8.18 4.12 0.00 1.38 1.13 -1.09 0.73 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 0.00 125 D 8.17 4.44 0.00 2.74 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 0.00 126 M 8.06 4.34 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.89 0.00 127 K 7.67 3.96 0.00 1.86 1.95 0.00 1.22 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.42 7.81 128 V 7.93 3.43 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 0.79 0.00 0.00 0.87 0.00 0.00 129 A 8.65 4.29 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 P 0.00 4.66 0.00 2.28 2.40 0.00 3.83 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 131 I 7.81 4.15 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 1.46 0.61 0.95 0.00 0.00 132 Q 7.94 4.66 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.07 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 133 G 8.41 3.75 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 0.00 0.00 0.00 134 F 7.85 4.77 0.00 3.11 3.27 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 0.00 135 S 9.12 4.45 0.00 4.20 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 0.00 136 A 8.20 4.35 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.70 4.64 0.00 1.97 1.90 0.00 1.73 0.00 0.00 1.48 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.41 7.81 138 W 8.00 4.77 0.00 2.88 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 0.00 139 D 7.69 4.38 0.00 2.38 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 0.00 0.00 0.00 0.00 140 Y 8.40 4.32 0.00 3.12 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 0.00 141 D 7.58 4.47 0.00 2.81 2.65 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 0.00 142 K 7.91 4.13 0.00 1.53 1.69 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.36 7.81 143 N 7.29 3.89 0.00 2.79 2.82 0.00 0.00 6.67 7.54 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 0.00 144 E 5.90 4.17 0.00 1.78 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 1.93 2.02 0.00 145 W 8.30 4.53 0.00 3.18 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 K 8.71 3.96 0.00 1.81 1.77 0.00 1.95 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.44 7.81 147 K 8.24 3.95 0.00 1.64 1.60 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.17 1.31 7.81