NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5238 8.3049 120.2844 55.4925 34.2659 174.6625 2 D 4.6843 8.5907 119.8337 52.6739 42.2239 174.0058 3 I 5.0523 8.4579 124.2044 59.5046 40.4566 175.0685 4 S 4.6947 9.1857 119.7106 56.5948 65.5806 172.9201 5 I 4.3101 8.5645 128.0872 61.7365 37.3286 175.3596 6 I 4.2584 8.8540 128.5065 63.1264 37.6102 176.0745 7 S 4.8519 7.8945 115.8096 57.0383 67.9906 172.5311 8 D 4.9427 8.6455 120.2111 51.8867 40.2640 174.4663 9 R 4.6751 9.6311 125.5674 54.9587 32.8315 174.6314 10 N 5.1814 8.7044 120.4492 52.0416 41.4952 173.7317 11 N 4.9372 8.8926 124.4126 50.9108 39.4333 173.4564 12 P 4.0279 0.0000 0.0000 65.1876 32.0088 178.7800 13 L 3.8828 7.8176 117.5647 57.9540 41.6067 178.2075 14 L 4.4812 7.7394 115.8846 54.8277 42.1483 176.7211 15 Q 3.1118 8.0567 116.1607 57.0337 27.0487 173.8096 16 R 5.1454 8.3261 115.6211 54.3622 34.4560 175.2571 17 R 4.8024 9.1430 120.2069 54.8317 33.2010 173.8530 18 E 5.1307 9.0452 126.4863 54.3310 31.0824 174.8234 19 I 4.8703 8.1615 125.1589 59.3206 40.4336 174.7598 20 K 5.0147 8.6672 129.2350 55.3947 34.6349 175.2305 21 F 5.4687 8.1149 119.4495 56.8208 41.7923 172.4215 22 T 5.1018 9.6600 114.9894 61.7610 72.5424 173.9334 23 V 4.9132 9.7433 123.9311 60.1857 34.8043 174.3550 24 S 4.8893 8.9561 118.7381 56.5445 65.8987 172.3970 25 F 5.0507 7.5134 118.2443 56.0169 40.9548 174.6211 26 D 4.5430 8.8482 120.9989 53.3891 39.3132 175.4305 27 A 4.1776 8.4285 129.1321 52.4612 17.3905 178.2601 28 A 3.6759 7.7056 119.1406 52.8396 18.0392 177.2628 29 T 3.2750 7.9132 120.1596 61.1079 69.5972 173.1410 30 P 4.4799 0.0000 0.0000 62.1281 33.4006 173.8266 31 S 4.9624 8.0768 113.7385 57.2951 66.1907 174.1384 32 I 3.7478 8.2873 120.3740 65.2250 36.9094 178.4878 33 K 3.9366 7.9529 118.7240 59.3702 31.6632 178.6484 34 D 4.2682 8.0492 117.7863 57.6089 41.1685 178.5277 35 V 3.6476 8.0247 118.8223 65.6394 31.3657 177.9880 36 K 3.9885 8.2928 119.1571 60.1896 32.1132 178.5634 37 M 4.0673 7.8954 119.7158 58.6003 31.9064 178.9054 38 K 3.9225 7.6636 117.6804 59.6329 32.1223 179.3750 39 L 3.7703 8.1669 119.6338 57.9373 41.3574 179.9487 40 V 3.5967 8.3668 118.4525 65.9506 31.2717 178.0037 41 A 3.7688 7.4697 119.2608 54.5276 18.2416 179.6930 42 V 3.6302 7.9415 116.7485 66.2775 31.8085 178.0558 43 L 3.9696 8.6511 118.2666 55.2778 42.7904 176.3655 44 N 4.0720 8.8333 115.4258 53.8138 36.8567 171.0968 45 A 4.5563 7.1533 120.4016 50.4506 23.0154 174.9580 46 N 4.3899 8.6204 117.3525 53.7528 38.9084 175.1103 47 K 4.1355 8.6344 125.9573 59.7122 33.3150 178.2272 48 Q 4.0736 8.3911 117.8891 58.9690 28.3112 178.7823 49 V 4.2526 7.4799 110.8995 60.6822 31.2987 175.5399 50 L 4.9975 7.3639 120.0706 53.5579 45.2138 175.9576 51 V 4.4664 8.1838 123.5976 62.2931 35.7771 172.4174 52 V 4.2788 8.2711 121.7332 61.7229 33.3656 174.8413 53 D 4.7040 8.2852 124.4451 55.5545 41.8867 176.8737 54 T 4.4552 7.3742 112.3158 63.3819 73.0689 171.1044 55 L 4.8892 8.3206 123.8465 54.7385 45.8639 174.2225 56 D 4.7372 9.1817 120.5687 53.0438 45.4458 175.1697 57 Q 4.4688 8.8108 124.8889 55.9319 30.1745 174.8731 58 I 4.3078 9.1420 126.7198 60.3988 38.0580 175.8578 59 F 4.3602 9.0218 128.1312 60.5590 39.6352 176.7216 60 G 3.9198 8.1092 108.1926 48.0035 0.0000 173.6701 61 K 4.6920 7.4562 121.9778 55.1997 34.6380 175.9967 62 L 4.5072 8.1292 112.6038 54.9243 40.3363 175.2594 63 E 4.6248 7.6852 119.3683 54.4063 33.8579 175.0633 64 A 4.8720 8.8772 124.9310 50.5504 22.9126 174.6957 65 E 4.4525 9.1454 124.4123 54.7965 32.4047 174.9690 66 G 4.2274 7.9507 111.1364 45.7402 0.0000 170.8294 67 Y 5.0430 8.6575 120.2758 55.5573 41.4593 174.4404 68 A 4.6407 8.4167 127.3995 50.3613 22.3423 175.4411 69 K 5.1791 8.0327 118.3071 54.2463 36.4426 175.1976 70 I 4.8488 8.2472 124.3027 60.1708 41.9078 173.4717 71 Y 5.1137 7.9152 123.3304 55.6776 41.4458 173.8345 72 N 4.9568 8.5734 114.8208 54.3469 40.3989 175.4857 73 D 4.9504 8.0371 116.8830 50.6845 42.2487 176.3140 74 E 3.9799 8.9087 122.3357 58.6698 29.1739 179.4927 75 K 4.1280 8.1230 118.5672 59.4108 32.0068 178.8415 76 A 3.9811 8.0253 120.2069 55.4488 18.4599 178.8472 77 M 4.0913 7.9096 117.4537 58.0581 31.8066 178.1759 78 A 3.9293 8.4980 120.3131 55.2716 18.4192 179.0350 79 T 4.1861 7.0128 112.8197 66.7191 69.1887 176.7521 80 I 3.4989 8.8762 121.2509 63.6665 37.5135 177.4018 81 E 3.9890 7.5370 119.0352 57.3030 30.6877 176.2354 82 T 4.8364 7.9517 109.4089 59.2452 72.9548 174.7991 83 K 3.8222 8.5952 120.4048 60.1505 31.6118 179.2532 84 S 4.0746 7.9369 116.1579 61.6279 62.6285 176.5119 85 V 3.6688 7.5667 120.4135 66.0046 31.2260 177.8606 86 L 4.0366 7.9839 117.3832 57.0004 41.4588 179.0090 87 E 4.1000 8.1076 118.8982 59.5345 29.5222 178.1291 88 K 3.7595 7.4404 115.3018 59.5171 32.4171 176.3135 89 N 4.1018 7.5746 121.2061 53.1790 38.3408 175.3692 90 K 4.1767 8.3903 122.3995 55.8548 32.4492 176.5301 91 I 3.5443 7.7605 120.4423 62.6754 37.1299 176.5423 92 E 4.6708 8.0376 123.3691 54.4902 33.1644 174.3497 93 E 4.7110 8.3158 119.5377 54.1588 32.5359 174.5026 94 E 4.3843 8.3426 116.7384 57.8057 31.4762 176.1528 95 A 5.3589 8.4210 129.4837 52.5293 19.2042 176.2646 96 E 3.8221 7.8562 119.0394 58.5076 30.1237 177.5540 97 A 4.4163 7.4388 118.3966 51.1652 22.1029 175.6602 98 E 4.0556 9.1412 120.8612 59.4649 29.5441 178.3618 99 V 3.8119 7.6001 110.0925 61.1568 32.2704 175.0660 100 A 4.2521 8.4731 124.7806 51.8195 21.6832 174.5078 101 E 3.6652 8.7015 123.8736 55.0175 29.9983 174.1627 102 E 4.1275 8.8111 119.0864 57.0575 29.5121 177.4788 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.52 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.76 0.00 2 D 8.59 4.68 0.00 2.60 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 3 I 8.46 5.05 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.69 0.85 0.00 0.00 4 S 9.19 4.69 0.00 3.87 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 5 I 8.56 4.31 1.90 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 1.34 0.91 1.03 0.00 0.00 6 I 8.85 4.26 1.93 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 0.82 0.94 0.00 0.00 7 S 7.89 4.85 0.00 3.77 3.73 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 8 D 8.65 4.94 0.00 2.64 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 9 R 9.63 4.68 0.00 1.94 1.93 0.00 3.25 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 10 N 8.70 5.18 0.00 2.67 2.67 0.00 0.00 6.85 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 11 N 8.89 4.94 0.00 2.77 2.73 0.00 0.00 6.45 8.08 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 12 P 0.00 4.03 0.00 2.19 2.27 0.00 3.72 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.97 0.00 13 L 7.82 3.88 0.00 1.63 1.78 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.74 4.48 0.00 1.67 1.76 0.96 1.04 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 15 Q 8.06 3.11 0.00 1.79 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 6.52 0.00 0.00 0.00 0.00 0.00 2.14 2.29 0.00 16 R 8.33 5.15 0.00 1.75 1.94 0.00 3.45 0.00 0.00 3.63 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 17 R 9.14 4.80 0.00 1.96 1.74 0.00 3.10 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 18 E 9.05 5.13 0.00 2.10 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 2.50 2.22 0.00 19 I 8.16 4.87 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 1.16 0.76 1.02 0.00 0.00 20 K 8.67 5.01 0.00 1.93 1.75 0.00 1.76 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.60 7.81 21 F 8.11 5.47 0.00 3.33 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 22 T 9.66 5.10 4.30 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 1.38 0.00 0.00 23 V 9.74 4.91 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.17 0.00 0.00 24 S 8.96 4.89 0.00 3.83 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 25 F 7.51 5.05 0.00 3.04 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 26 D 8.85 4.54 0.00 2.76 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 27 A 8.43 4.18 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 28 A 7.71 3.68 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 29 T 7.91 3.28 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 1.10 0.00 0.00 30 P 0.00 4.48 0.00 2.12 2.02 0.00 3.23 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.89 0.00 31 S 8.08 4.96 0.00 3.85 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 32 I 8.29 3.75 1.88 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 1.66 0.70 0.94 0.00 0.00 33 K 7.95 3.94 0.00 1.83 1.85 0.00 1.56 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.55 7.81 34 D 8.05 4.27 0.00 2.80 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 35 V 8.02 3.65 2.31 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 1.11 0.00 0.00 0.99 0.00 0.00 36 K 8.29 3.99 0.00 1.99 2.29 0.00 1.38 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.54 1.47 7.81 37 M 7.90 4.07 0.00 2.08 2.32 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 2.76 2.64 0.00 38 K 7.66 3.92 0.00 1.71 1.82 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.50 7.81 39 L 8.17 3.77 0.00 1.76 1.53 0.92 -0.70 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 40 V 8.37 3.60 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 1.00 0.00 0.00 0.91 0.00 0.00 41 A 7.47 3.77 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 42 V 7.94 3.63 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 0.70 0.00 0.00 0.91 0.00 0.00 43 L 8.65 3.97 0.00 1.46 1.66 0.83 0.91 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 44 N 8.83 4.07 0.00 2.76 2.83 0.00 0.00 6.93 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 7.15 4.56 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 46 N 8.62 4.39 0.00 2.68 2.77 0.00 0.00 6.93 6.70 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 47 K 8.63 4.14 0.00 1.89 1.91 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.45 7.81 48 Q 8.39 4.07 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.59 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 49 V 7.48 4.25 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 0.79 0.00 0.00 1.01 0.00 0.00 50 L 7.36 5.00 0.00 1.78 1.58 0.88 0.91 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 51 V 8.18 4.47 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 0.91 0.00 0.00 0.96 0.00 0.00 52 V 8.27 4.28 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 0.89 0.00 0.00 1.04 0.00 0.00 53 D 8.29 4.70 0.00 3.03 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 54 T 7.37 4.46 4.31 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 1.23 0.00 0.00 55 L 8.32 4.89 0.00 1.62 1.53 0.88 1.18 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 56 D 9.18 4.74 0.00 2.72 2.49 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 57 Q 8.81 4.47 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.71 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 58 I 9.14 4.31 1.84 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 1.11 1.00 0.93 0.00 0.00 59 F 9.02 4.36 0.00 2.91 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 60 G 8.11 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 0.00 0.00 0.00 61 K 7.46 4.69 0.00 1.76 1.70 0.00 1.50 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.23 1.43 7.81 62 L 8.13 4.51 0.00 1.49 1.65 0.88 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 63 E 7.69 4.62 0.00 1.89 1.68 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 2.19 2.18 0.00 64 A 8.88 4.87 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 65 E 9.15 4.45 0.00 1.99 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 2.22 2.19 0.00 66 G 7.95 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 8.66 5.04 0.00 3.01 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 68 A 8.42 4.64 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 69 K 8.03 5.18 0.00 1.79 1.67 0.00 1.72 0.00 0.00 1.90 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.56 7.81 70 I 8.25 4.85 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.41 0.99 0.00 0.00 71 Y 7.92 5.11 0.00 2.91 2.87 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 72 N 8.57 4.96 0.00 2.42 2.78 0.00 0.00 6.47 8.09 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 73 D 8.04 4.95 0.00 2.93 2.78 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 74 E 8.91 3.98 0.00 2.03 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 2.39 2.42 0.00 75 K 8.12 4.13 0.00 1.81 1.89 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.48 7.81 76 A 8.03 3.98 1.67 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 0.00 0.00 77 M 7.91 4.09 0.00 1.37 0.57 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 78 A 8.50 3.93 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 79 T 7.01 4.19 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 1.22 0.00 0.00 80 I 8.88 3.50 2.05 0.00 0.00 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 1.59 0.55 1.01 0.00 0.00 81 E 7.54 3.99 0.00 2.09 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 2.30 2.34 0.00 82 T 7.95 4.84 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 83 K 8.60 3.82 0.00 1.96 2.13 0.00 1.52 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.49 7.81 84 S 7.94 4.07 0.00 3.89 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 85 V 7.57 3.67 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 1.06 0.00 0.00 0.95 0.00 0.00 86 L 7.98 4.04 0.00 1.60 1.69 0.88 0.98 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 87 E 8.11 4.10 0.00 2.07 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 2.33 2.52 0.00 88 K 7.44 3.76 0.00 1.78 1.88 0.00 1.67 0.00 0.00 1.92 0.00 0.00 3.20 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.51 1.50 7.81 89 N 7.57 4.10 0.00 2.78 2.84 0.00 0.00 7.18 7.46 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 90 K 8.39 4.18 0.00 1.74 1.75 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 91 I 7.76 3.54 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 1.29 0.73 0.91 0.00 0.00 92 E 8.04 4.67 0.00 1.85 1.79 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 2.16 2.30 0.00 93 E 8.32 4.71 0.00 2.08 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 2.17 2.25 0.00 94 E 8.34 4.38 0.00 2.09 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 2.23 2.29 0.00 95 A 8.42 5.36 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 96 E 7.86 3.82 0.00 1.96 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 2.35 0.00 97 A 7.44 4.42 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 0.00 0.00 98 E 9.14 4.06 0.00 1.93 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 2.30 2.36 0.00 99 V 7.60 3.81 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 0.69 0.00 0.00 0.93 0.00 0.00 100 A 8.47 4.25 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 0.00 101 E 8.70 3.67 0.00 2.08 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 2.19 2.30 0.00 102 E 8.81 4.13 0.00 1.99 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 2.32 2.34 0.00