NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.2796 8.1801 120.6343 55.0088 41.7566 175.7627 23 A 4.3683 8.2032 124.2664 50.3461 20.2644 175.0022 24 D 5.3218 8.1774 117.4952 51.1099 44.5655 174.4429 25 S 4.1802 8.7848 115.1760 61.6987 62.6352 177.2995 26 K 3.9735 8.1680 120.4341 59.4541 31.8925 179.1120 27 A 4.0484 8.2079 121.0894 55.0739 18.2325 180.0997 28 V 3.6723 7.7455 117.7554 64.6873 31.5471 178.4652 29 L 4.1382 8.0612 119.7859 57.9179 41.6492 179.0955 30 N 4.2295 8.1850 116.6900 56.5398 38.7863 176.3762 31 Q 4.2084 8.4414 120.8997 59.5136 29.1407 178.5169 32 A 4.2273 8.6012 121.9865 55.1195 18.5564 179.6057 33 V 3.5323 8.1692 116.6122 66.2441 31.4730 178.2198 34 A 4.0667 8.1845 119.8178 55.4038 18.2976 179.4129 35 D 4.3849 8.4654 117.5282 57.5122 40.8608 179.0327 36 L 4.1324 8.6275 119.9804 57.8082 41.4543 179.7158 37 S 3.9279 7.7638 114.7864 61.5237 62.5796 176.9830 38 V 3.6051 7.6044 120.7723 65.8076 31.3067 177.7634 39 A 3.9845 8.1713 120.6602 55.4498 18.1816 178.9264 40 H 3.9887 8.4539 116.7130 59.5668 29.9278 177.3508 41 S 4.0866 7.8768 114.6339 61.3845 62.1666 176.2037 42 I 3.6359 7.9485 122.5219 64.4558 36.8652 178.1342 43 L 3.8908 7.8184 119.7712 58.2948 41.4403 179.2376 44 H 3.6457 8.0464 117.7851 58.9909 29.6149 177.0084 45 Q 4.2188 7.9371 121.3448 59.2694 28.5272 178.3495 46 V 3.6280 7.9189 119.2753 66.3570 31.3115 177.1623 47 H 4.1255 8.0412 116.5254 59.3461 29.6768 176.8000 48 W 4.7311 8.0363 118.9585 59.7639 29.0398 177.6714 49 Y 4.3317 8.6666 114.9016 57.5112 37.5754 175.1973 50 M 4.5379 7.5622 120.9008 55.8719 32.8631 175.5761 51 R 4.6633 8.9932 123.7139 55.1524 34.6644 173.6333 52 G 4.1311 8.7972 105.7703 43.0272 0.0000 173.2256 53 R 4.2264 8.2336 119.5387 57.5588 30.5194 177.6594 54 G 4.1924 9.3026 110.6487 45.1458 0.0000 174.6867 55 F 4.1511 8.4755 122.1286 61.9590 39.0571 176.8188 56 M 4.3314 8.3288 115.3839 58.1007 31.8072 177.0490 57 I 3.8636 7.5940 117.9344 62.7333 38.7054 177.1838 58 W 4.3345 8.1524 119.3141 58.8639 28.8119 178.2137 59 H 3.8831 8.1536 118.5846 58.7075 29.6848 175.3996 60 P 4.2630 0.0000 0.0000 65.2526 31.2367 178.0759 61 K 3.5653 7.5063 119.1822 59.5840 31.9670 178.2563 62 M 3.9874 7.8772 118.8621 58.6345 31.8362 178.4614 63 D 4.1618 7.6363 118.2772 57.4628 41.0908 178.6812 64 E 3.9310 7.9189 118.3684 59.6857 29.4824 178.9184 65 Y 4.5202 7.8811 116.6949 61.4650 37.8566 178.6447 66 M 4.1175 8.3024 119.7224 58.3004 32.0509 178.3739 67 E 3.8666 8.2694 119.5273 59.2198 29.9132 178.5340 68 E 3.6765 8.1320 119.2242 59.2273 29.6976 178.7742 69 I 3.8388 7.8778 119.8577 64.6223 37.1908 178.1815 70 D 4.4553 8.4261 120.0053 57.1428 40.5725 179.0598 71 G 3.4534 7.9280 106.3995 47.8278 0.0000 175.4141 72 Y 4.3178 7.3251 118.6996 60.7343 37.9359 178.0021 73 L 4.0468 7.9356 121.2711 58.5055 42.0801 178.6214 74 D 4.2901 8.0196 117.3868 57.3759 41.2390 177.7732 75 E 3.8822 8.1378 119.8153 59.6749 29.7397 178.7006 76 M 3.9958 8.5126 119.0322 57.9463 32.0013 178.7583 77 S 4.1180 8.1708 113.6403 61.4154 62.6330 176.0644 78 E 4.0212 8.4128 121.4191 59.0314 29.1969 179.1815 79 R 3.8342 7.9532 119.0933 59.1747 30.0301 178.2048 80 L 3.8978 7.7086 119.5609 58.3442 42.1339 178.8760 81 I 3.6637 7.6273 119.5565 64.9687 36.8500 178.6085 82 T 3.9480 7.7978 115.0417 65.9921 68.2762 175.6763 83 L 4.4759 7.4399 118.1792 54.3422 41.8597 177.3138 84 G 3.8370 8.0558 107.4107 45.5437 0.0000 174.3322 85 G 3.8689 7.8480 109.1748 44.1300 0.0000 174.2066 86 A 4.4588 7.9586 120.9773 49.0659 19.5474 173.8663 87 P 4.3897 0.0000 0.0000 62.9023 31.9998 177.0784 88 F 4.6828 8.2952 120.1001 59.0454 39.3314 176.6691 89 S 4.7556 8.9019 119.2132 56.3509 63.3590 174.7451 90 T 4.4760 6.7932 109.6550 59.8887 73.0418 173.4537 91 L 3.9067 8.1991 122.1271 57.7357 41.8744 179.2968 92 K 3.7458 8.0086 119.1824 60.0500 31.8342 178.2151 93 E 3.7288 7.7691 117.8067 59.0848 29.1366 179.5273 94 F 4.4817 7.7329 117.9081 60.8507 38.8582 177.7718 95 S 4.1544 8.3997 111.7010 61.1980 62.2084 175.4748 96 E 4.1655 7.8452 120.1212 58.4611 29.5212 177.9105 97 N 4.5037 7.5833 114.9772 53.5439 39.3289 175.4996 98 S 4.5904 7.1896 115.1736 57.8551 63.1003 173.8989 99 Q 4.2165 8.3939 124.3882 56.5303 28.9688 176.3118 100 L 4.0554 7.4957 119.0610 53.8764 42.4599 176.2647 101 K 4.5705 8.2504 121.6274 54.6368 34.1376 175.6053 102 E 4.7473 8.4894 121.3989 54.5875 32.4203 175.6404 103 V 4.5244 7.7872 113.6086 58.8943 35.4156 175.6804 104 L 4.0195 8.2589 121.4333 54.4798 42.0315 177.9009 105 G 2.4346 7.9463 111.1415 45.4063 0.0000 172.8703 106 D 4.3384 7.2026 120.6019 52.8201 43.4968 175.7710 107 Y 4.5747 8.5987 124.3239 60.1528 38.1277 176.6493 108 N 4.6634 8.9894 116.0388 53.6167 39.1514 175.7098 109 V 3.6294 7.1502 119.3089 63.0154 32.1556 176.4876 110 T 4.2142 8.8003 117.9161 61.3000 70.7879 175.6511 111 I 3.6956 8.2733 122.6790 64.8473 37.1928 178.5273 112 E 3.8770 8.1036 118.7011 59.4073 29.3264 179.0771 113 E 3.9320 8.1021 118.4149 59.3680 29.5748 179.4159 114 Q 3.9080 8.1208 118.0009 58.9760 28.8354 178.8680 115 L 3.6690 7.7498 119.6112 57.6351 41.5689 179.3185 116 A 3.8978 7.9311 120.6565 55.2512 18.2428 179.6561 117 R 3.7386 7.8477 117.0289 59.4855 30.0279 178.9485 118 V 3.2052 7.4954 117.8699 65.5847 31.4082 178.1270 119 V 3.4478 7.6014 117.9617 65.9907 31.5022 177.5735 120 E 3.9149 8.0988 118.2723 59.6572 29.2910 179.7320 121 V 3.6347 7.7644 117.8516 66.1258 31.5381 178.0857 122 F 4.4506 8.4360 117.8803 60.5395 38.6715 177.8087 123 R 3.9075 8.7363 118.1311 59.3887 29.8950 178.2041 124 Y 3.9133 7.8736 118.7591 60.7997 38.7172 178.0268 125 L 3.4478 8.1905 119.5625 57.6628 41.7051 179.3918 126 A 3.7526 7.8708 120.2178 55.0652 18.4132 179.4317 127 A 3.7447 7.6595 119.0734 55.1201 18.4391 179.4429 128 L 3.6159 7.5320 119.0615 58.4491 42.0429 179.2706 129 F 4.4149 8.0114 117.8901 60.6274 38.6886 177.4819 130 Q 3.9633 8.0946 119.3243 59.0999 28.7807 178.4192 131 K 3.9964 7.9032 119.2662 59.2883 32.0226 179.6398 132 G 2.4148 7.5839 106.0771 47.0158 0.0000 175.3829 133 F 4.0015 8.1857 123.5279 61.2634 39.4124 176.9640 134 D 4.4089 8.4117 118.3283 57.3739 40.5646 178.7673 135 V 3.5590 7.8409 118.9822 66.2827 31.3537 178.2924 136 S 4.2871 7.9015 115.0498 60.8053 62.6548 175.8428 137 D 4.1134 7.9476 121.7303 57.1205 40.7281 177.8561 138 E 3.9355 8.0493 118.6802 58.6415 30.0556 177.6428 139 E 4.4396 7.9238 116.9234 55.1473 29.7702 176.7056 140 G 3.8972 7.5668 107.0675 47.0560 0.0000 175.0580 141 D 4.6264 7.8846 121.6173 52.8435 39.6217 175.7601 142 S 4.1704 8.0444 120.2933 60.2131 63.6241 176.6273 143 V 3.4870 7.6318 121.7451 66.1718 31.4420 177.6889 144 T 3.6971 7.6961 115.5398 66.7299 68.4015 175.6057 145 N 4.2406 7.9683 120.1097 56.3003 38.7995 176.2632 146 D 4.3904 7.9136 118.5303 57.1327 41.1294 178.0718 147 I 3.5282 7.4461 120.1033 64.5486 37.1265 178.4585 148 F 4.0080 7.8481 118.2408 60.1267 38.6174 177.4586 149 N 4.4023 8.1031 116.5642 56.6179 38.4900 177.0156 150 V 3.5529 7.8964 119.4884 66.0265 31.6769 177.8660 151 A 3.5639 7.3962 121.4359 54.2315 18.0476 179.2291 152 K 3.9451 8.0063 118.0075 59.8889 32.0856 178.5521 153 A 4.0101 8.0073 121.0154 55.2054 18.2785 179.6360 154 S 4.1819 7.7861 111.1476 61.0652 63.4260 176.4467 155 I 3.4327 7.5489 122.9926 64.3578 36.8864 177.9759 156 E 3.9879 8.2346 118.9846 59.3033 29.2855 179.2221 157 K 4.1445 7.8919 119.3369 60.1414 32.1679 178.3913 158 H 4.3737 8.2789 116.1989 59.0652 28.6530 177.6894 159 I 3.8075 8.2700 121.9348 64.1582 36.9180 177.9886 160 W 4.4341 8.3297 129.0561 61.0709 30.4377 177.9734 161 M 3.3121 7.6703 117.8152 57.9972 31.3900 178.7223 162 L 4.0315 8.2076 119.3081 58.1433 41.7864 179.7507 163 Q 4.0216 8.2521 117.6174 58.7866 28.7072 178.6424 164 A 4.0259 8.2287 122.0486 55.0999 18.1778 179.1528 165 E 4.0301 8.3203 117.2242 59.2580 29.7412 178.1408 166 L 4.4484 7.4638 115.8159 53.9487 41.8154 176.7767 167 G 3.9475 7.9342 106.3893 46.8099 0.0000 173.9675 168 Q 4.6203 8.1881 116.4259 53.0631 32.3797 175.6037 169 A 4.3127 8.3200 122.5768 51.5328 19.2006 177.0400 170 P 4.3322 0.0000 0.0000 64.2403 31.6404 177.2981 171 K 3.8527 7.2929 112.2669 57.2094 30.2681 175.0354 172 L 4.1898 7.9566 122.0415 55.1603 41.6027 177.4073 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 22 L 8.18 4.28 0.00 1.66 1.74 0.95 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.20 4.37 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 24 D 8.18 5.32 0.00 2.97 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 25 S 8.78 4.18 0.00 3.93 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 26 K 8.17 3.97 0.00 1.79 1.84 0.00 1.65 0.00 0.00 1.95 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.50 7.81 27 A 8.21 4.05 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 28 V 7.75 3.67 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 1.11 0.00 0.00 0.78 0.00 0.00 29 L 8.06 4.14 0.00 1.93 1.79 0.97 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.19 4.23 0.00 2.80 2.59 0.00 0.00 6.91 6.78 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 31 Q 8.44 4.21 0.00 2.45 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.76 0.00 32 A 8.60 4.23 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 0.00 0.00 0.00 0.00 0.00 33 V 8.17 3.53 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 1.21 0.00 0.00 0.98 0.00 0.00 34 A 8.18 4.07 1.62 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 0.00 0.00 35 D 8.47 4.38 0.00 2.92 2.97 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 36 L 8.63 4.13 0.00 1.76 1.80 1.17 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.76 3.93 0.00 3.49 3.43 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 0.00 38 V 7.60 3.61 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.97 0.00 0.00 39 A 8.17 3.98 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 40 H 8.45 3.99 0.00 3.33 3.53 0.00 5.79 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 41 S 7.88 4.09 0.00 3.94 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 42 I 7.95 3.64 1.83 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 1.48 0.56 0.85 0.00 0.00 43 L 7.82 3.89 0.00 1.77 1.68 1.11 0.83 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 44 H 8.05 3.65 0.00 2.96 2.59 0.00 5.59 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 7.94 4.22 0.00 2.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 46 V 7.92 3.63 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 0.94 0.00 0.00 1.01 0.00 0.00 47 H 8.04 4.13 0.00 3.08 3.33 0.00 6.00 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 48 W 8.04 4.73 0.00 3.51 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.67 4.33 0.00 3.19 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 50 M 7.56 4.54 0.00 2.31 2.38 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 2.77 2.87 0.00 51 R 8.99 4.66 0.00 1.86 1.77 0.00 3.29 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.81 0.00 52 G 8.80 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 0.00 0.00 0.00 53 R 8.23 4.23 0.00 1.87 1.95 0.00 3.37 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.30 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 0.00 0.00 0.00 0.00 55 F 8.48 4.15 0.00 3.37 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 56 M 8.33 4.33 0.00 2.09 2.23 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.72 0.00 57 I 7.59 3.86 1.69 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 1.26 0.55 0.34 0.00 0.00 58 W 8.15 4.33 0.00 3.52 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 8.15 3.88 0.00 1.68 2.56 0.00 5.95 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 60 P 0.00 4.26 0.00 2.19 2.23 0.00 3.63 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 1.94 1.95 0.00 61 K 7.51 3.57 0.00 1.58 1.83 0.00 1.15 0.00 0.00 1.07 0.00 0.00 2.61 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.15 0.52 7.81 62 M 7.88 3.99 0.00 2.02 2.27 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 3.00 0.00 63 D 7.64 4.16 0.00 2.86 2.60 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 64 E 7.92 3.93 0.00 1.88 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 2.29 2.36 0.00 65 Y 7.88 4.52 0.00 3.21 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 66 M 8.30 4.12 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.33 0.00 67 E 8.27 3.87 0.00 2.00 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 2.26 2.26 0.00 68 E 8.13 3.68 0.00 2.08 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 1.90 2.01 0.00 69 I 7.88 3.84 2.08 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.83 1.03 0.00 0.00 70 D 8.43 4.46 0.00 2.88 2.66 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 71 G 7.93 3.45 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 0.00 72 Y 7.33 4.32 0.00 3.23 2.86 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 73 L 7.94 4.05 0.00 1.78 1.88 0.85 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.02 4.29 0.00 2.87 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 75 E 8.14 3.88 0.00 2.13 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 2.22 2.30 0.00 76 M 8.51 4.00 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.02 0.00 77 S 8.17 4.12 0.00 4.01 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 78 E 8.41 4.02 0.00 2.08 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 2.32 2.44 0.00 79 R 7.95 3.83 0.00 1.95 1.99 0.00 3.10 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 80 L 7.71 3.90 0.00 1.93 1.86 0.94 0.76 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 81 I 7.63 3.66 1.86 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 0.92 0.91 0.00 0.00 82 T 7.80 3.95 4.36 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 1.19 0.00 0.00 83 L 7.44 4.48 0.00 1.78 1.68 0.95 1.08 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 84 G 8.06 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.85 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 86 A 7.96 4.46 1.19 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 0.00 0.00 0.00 87 P 0.00 4.39 0.00 2.26 2.08 0.00 3.79 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 88 F 8.30 4.68 0.00 3.43 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 89 S 8.90 4.76 0.00 4.00 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 90 T 6.79 4.48 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 1.13 0.00 0.00 91 L 8.20 3.91 0.00 1.69 1.80 0.99 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.01 3.75 0.00 1.75 1.74 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.53 7.81 93 E 7.77 3.73 0.00 1.93 1.60 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 2.24 2.25 0.00 94 F 7.73 4.48 0.00 3.25 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 95 S 8.40 4.15 0.00 3.98 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 96 E 7.85 4.17 0.00 1.95 1.90 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 2.28 2.39 0.00 97 N 7.58 4.50 0.00 2.39 2.83 0.00 0.00 6.97 7.88 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 98 S 7.19 4.59 0.00 4.00 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 99 Q 8.39 4.22 0.00 1.73 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.48 2.77 0.00 100 L 7.50 4.06 0.00 1.51 1.44 0.91 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.25 4.57 0.00 1.63 1.65 0.00 1.50 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 1.45 7.81 102 E 8.49 4.75 0.00 1.89 1.80 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 2.17 2.26 0.00 103 V 7.79 4.52 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.26 4.02 0.00 1.53 1.50 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 105 G 7.95 2.43 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 0.00 0.00 0.00 0.00 106 D 7.20 4.34 0.00 2.47 2.35 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 0.00 107 Y 8.60 4.57 0.00 3.13 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 0.00 108 N 8.99 4.66 0.00 2.82 2.90 0.00 0.00 6.91 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.15 3.63 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 0.76 0.00 0.00 0.94 0.00 0.00 110 T 8.80 4.21 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 0.00 111 I 8.27 3.70 1.91 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.24 0.88 0.00 0.00 112 E 8.10 3.88 0.00 1.97 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 2.36 0.00 113 E 8.10 3.93 0.00 2.19 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 2.30 2.33 0.00 114 Q 8.12 3.91 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 115 L 7.75 3.67 0.00 1.53 1.30 -0.29 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.93 3.90 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 0.00 117 R 7.85 3.74 0.00 1.88 2.02 0.00 3.15 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 118 V 7.50 3.21 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 0.04 0.00 0.00 0.82 0.00 0.00 119 V 7.60 3.45 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 0.97 0.00 0.00 0.87 0.00 0.00 120 E 8.10 3.91 0.00 2.27 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 2.32 2.31 0.00 121 V 7.76 3.63 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 1.21 0.00 0.00 0.91 0.00 0.00 122 F 8.44 4.45 0.00 3.19 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 0.00 123 R 8.74 3.91 0.00 1.99 2.00 0.00 3.15 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 124 Y 7.87 3.91 0.00 3.13 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.19 3.45 0.00 1.48 0.95 1.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 126 A 7.87 3.75 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 0.00 127 A 7.66 3.74 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 7.53 3.62 0.00 1.14 1.36 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.01 4.41 0.00 3.13 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 0.00 130 Q 8.09 3.96 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 131 K 7.90 4.00 0.00 1.90 1.75 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.47 7.81 132 G 7.58 2.41 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 0.00 133 F 8.19 4.00 0.00 3.26 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 0.00 134 D 8.41 4.41 0.00 2.86 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 0.00 135 V 7.84 3.56 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.91 0.00 0.00 136 S 7.90 4.29 0.00 4.29 4.16 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 0.00 137 D 7.95 4.11 0.00 2.53 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 0.00 138 E 8.05 3.94 0.00 2.12 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 2.31 2.34 0.00 139 E 7.92 4.44 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.49 0.00 140 G 7.57 3.90 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 0.00 141 D 7.88 4.63 0.00 2.69 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 0.00 142 S 8.04 4.17 0.00 4.04 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 0.00 143 V 7.63 3.49 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.70 3.70 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 1.31 0.00 0.00 145 N 7.97 4.24 0.00 2.68 2.89 0.00 0.00 6.39 8.11 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 0.00 146 D 7.91 4.39 0.00 2.75 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.45 3.53 1.68 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 1.38 1.26 0.44 0.00 0.00 148 F 7.85 4.01 0.00 3.35 3.23 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 0.00 149 N 8.10 4.40 0.00 3.28 2.92 0.00 0.00 6.72 7.94 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 0.00 150 V 7.90 3.55 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 1.00 0.00 0.00 1.00 0.00 0.00 151 A 7.40 3.56 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.01 3.95 0.00 2.05 2.08 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.71 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.49 7.81 153 A 8.01 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 0.00 154 S 7.79 4.18 0.00 4.12 4.18 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 0.00 155 I 7.55 3.43 1.85 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.91 0.70 0.00 0.00 156 E 8.23 3.99 0.00 2.24 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 2.34 2.49 0.00 157 K 7.89 4.14 0.00 1.98 2.04 0.00 1.72 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.72 1.90 7.81 158 H 8.28 4.37 0.00 3.33 3.36 0.00 5.69 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 0.00 159 I 8.27 3.81 2.15 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.28 1.00 0.00 0.00 160 W 8.33 4.43 0.00 3.41 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 0.00 161 M 7.67 3.31 0.00 1.91 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 1.18 0.00 162 L 8.21 4.03 0.00 1.80 1.65 0.87 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.25 4.02 0.00 2.38 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.48 2.58 0.00 164 A 8.23 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 0.00 165 E 8.32 4.03 0.00 2.25 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 2.38 2.46 0.00 166 L 7.46 4.45 0.00 1.76 1.64 0.81 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.93 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Q 8.19 4.62 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 169 A 8.32 4.31 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 0.00 170 P 0.00 4.33 0.00 2.12 2.28 0.00 3.90 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 2.11 2.43 0.00 171 K 7.29 3.85 0.00 1.94 1.87 0.00 1.89 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.41 7.81 172 L 7.96 4.19 0.00 1.63 1.57 0.93 0.93 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