NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.3269 8.1801 120.7729 54.4874 41.8894 176.0627 23 A 4.2128 7.8354 124.4876 51.3091 19.9825 175.9512 24 D 4.9848 8.3865 116.0441 50.7235 44.9479 174.6716 25 S 4.1835 9.7466 116.1281 61.7129 62.7155 177.2381 26 K 3.9354 8.0859 120.3262 59.4897 31.8489 179.0462 27 A 4.0282 8.1770 121.1650 55.1862 18.2495 180.1195 28 V 3.7750 8.0698 117.7712 64.8145 31.5688 178.5961 29 L 4.1076 8.3095 119.8015 57.7305 41.4697 179.0264 30 N 4.2385 8.3529 117.0374 56.4638 38.7463 176.6006 31 Q 4.2612 8.7480 121.3356 59.3980 29.1432 178.3066 32 A 4.2353 8.9974 122.4049 55.2176 18.4465 179.5780 33 V 3.5451 8.0511 116.4480 66.1964 31.6790 178.0526 34 A 4.1278 8.4487 120.1710 55.5255 18.3622 179.3071 35 D 4.3622 8.5662 117.6419 57.6149 40.8367 179.1617 36 L 4.1879 8.6316 119.8502 57.8219 41.4736 179.6366 37 S 3.8876 7.8807 115.2051 61.5727 62.5566 177.0174 38 V 3.6203 7.7648 120.4775 65.6395 31.2038 177.7859 39 A 3.9764 8.5439 120.9882 55.5689 18.2406 178.8861 40 H 3.9670 8.5586 116.9693 59.6682 29.8412 177.3882 41 S 4.1347 7.8696 114.6314 61.3427 62.2478 176.1503 42 I 3.6822 8.0065 122.8050 64.3927 36.7500 178.4662 43 L 3.9888 8.1601 120.1054 57.8967 41.4005 179.0237 44 H 3.6528 8.0085 118.3267 58.8136 29.6438 177.0562 45 Q 4.1941 7.8838 121.4086 59.2920 28.8246 178.2422 46 V 3.6184 7.7339 119.1624 66.4148 31.2695 177.0584 47 H 4.1133 8.1206 116.4746 59.4660 29.6935 176.8263 48 W 4.6978 8.4475 119.3850 59.6858 29.1544 177.3899 49 Y 4.2918 8.7535 114.8083 57.0903 37.8184 175.2830 50 M 4.5150 7.6066 121.3413 55.8102 32.9809 175.5726 51 R 4.6607 8.8542 123.3168 55.4909 34.6280 173.6040 52 G 4.0899 8.9039 106.0744 43.3920 0.0000 173.4612 53 R 4.2742 8.3238 119.1940 57.6069 30.5491 177.6879 54 G 4.1926 9.4462 110.6862 45.1016 0.0000 174.7067 55 F 4.0875 8.6074 122.3818 62.0583 39.0557 176.9779 56 M 4.2704 8.2567 115.1615 58.0110 31.9315 177.2926 57 I 3.7549 7.5217 118.3360 63.2955 38.5427 177.4868 58 W 4.1604 8.4256 120.0026 59.3318 28.5629 178.0920 59 H 3.8785 8.2641 119.2068 58.7229 29.1299 175.6064 60 P 4.0584 0.0000 0.0000 65.0103 31.2538 178.0872 61 K 3.5314 7.3521 119.6527 59.6531 31.9737 178.2079 62 M 4.0354 7.9342 118.8573 58.8540 31.8537 178.5259 63 D 4.2050 7.4780 118.4846 57.2646 40.9486 178.7174 64 E 3.9013 7.6310 119.1826 59.5748 29.4531 179.0357 65 Y 4.4710 7.8307 116.7299 61.3952 37.9730 178.4235 66 M 4.0473 8.4892 120.0598 58.4173 32.0749 178.4147 67 E 3.8953 8.2552 119.3801 59.0926 29.7871 178.3660 68 E 3.6161 8.1669 119.2238 59.2947 29.6505 178.5129 69 I 3.7803 8.0745 120.1298 64.9380 37.2752 178.0890 70 D 4.4337 8.6774 119.7609 57.1843 40.6413 179.1601 71 G 3.4769 8.0235 106.3083 48.0000 0.0000 175.4445 72 Y 4.3154 7.5472 119.3646 60.5669 37.8767 178.0791 73 L 4.0798 8.3047 121.7101 58.3823 42.0850 178.6970 74 D 4.3102 8.2256 117.8203 57.2288 41.1121 177.7928 75 E 3.8977 8.1030 119.7277 59.5507 29.5792 178.7660 76 M 3.8985 8.2020 118.8899 58.2207 31.9362 178.6995 77 S 4.0748 8.1208 113.3643 61.5102 62.5574 176.1373 78 E 3.9476 8.5535 121.7005 59.0986 29.0794 179.2832 79 R 3.7994 8.2382 119.2360 59.2226 30.0790 178.0525 80 L 3.8869 7.9753 120.1926 58.3890 41.9465 178.8042 81 I 3.8227 7.8510 119.5464 65.0647 36.8889 178.5275 82 T 3.8665 8.0295 115.1755 66.4288 68.3529 175.8750 83 L 4.3359 8.0121 118.5230 55.0286 41.8281 177.6928 84 G 3.8418 8.2760 108.0978 45.3254 0.0000 173.9793 85 G 3.7815 7.9063 109.1779 43.9447 0.0000 173.4295 86 A 4.5142 8.0169 121.3490 49.1344 20.2298 174.2248 87 P 4.4927 0.0000 0.0000 62.9149 32.1428 176.6855 88 F 4.5626 8.5082 120.8634 58.8436 39.2743 176.4815 89 S 4.8277 8.8384 120.0033 56.6022 63.4585 174.5355 90 T 4.4924 6.7710 109.6183 59.9472 72.9159 173.4570 91 L 4.0311 8.2501 122.2011 57.7961 41.8080 179.7635 92 K 3.8562 7.7884 119.1130 59.5563 32.2480 178.5752 93 E 3.7200 7.8853 118.8085 59.1634 29.2622 179.4123 94 F 4.4300 7.6339 117.7739 60.8673 38.8484 177.7804 95 S 4.1499 8.1699 111.5343 61.3214 62.2377 175.6120 96 E 4.1057 7.8782 120.3129 58.9511 29.3669 178.2868 97 N 4.4675 7.7425 115.2912 54.1997 39.2098 175.9861 98 S 4.5699 7.5713 114.3784 58.5699 62.9651 173.5921 99 Q 4.4371 9.0790 124.3146 55.5839 28.9082 175.6151 100 L 4.1905 7.4531 118.9412 53.3847 42.7770 176.1811 101 K 4.5185 8.2442 121.8636 54.7550 33.9455 175.6366 102 E 4.7101 8.4580 121.6983 54.6777 31.8278 175.6995 103 V 4.5307 7.7571 113.8320 58.8788 35.5942 175.6086 104 L 3.9670 8.3525 121.5907 54.5269 41.9833 177.8242 105 G 2.4510 8.1562 111.5266 45.6235 0.0000 172.4633 106 D 4.4726 7.3102 121.2688 52.6233 43.6820 174.9204 107 Y 4.9663 8.7882 123.8548 59.7602 38.7050 175.8368 108 N 4.9097 8.5817 119.2381 52.7807 38.3709 175.2163 109 V 4.3735 7.4003 117.1454 60.9721 34.1616 175.7202 110 T 4.2057 8.6523 117.6653 61.2932 70.7718 175.7532 111 I 3.6232 8.2453 122.7759 64.7980 37.2120 178.2788 112 E 3.8662 8.1901 118.6947 59.6568 29.2720 179.3584 113 E 3.9100 8.1094 118.2822 59.3057 29.5253 179.1312 114 Q 3.9386 8.5470 118.4076 59.2900 28.8816 179.4043 115 L 3.7205 8.1993 119.7122 57.4265 41.5048 179.4505 116 A 3.8991 7.9685 120.9857 54.9534 18.1848 179.6602 117 R 3.7343 7.9790 117.3291 59.4755 30.0634 178.8841 118 V 3.2055 7.5346 118.0995 65.6975 31.3251 178.0688 119 V 3.4300 7.5475 117.8823 66.0097 31.3380 177.7876 120 E 3.9256 8.0341 118.1621 59.4570 29.2591 179.5405 121 V 3.6104 7.9992 118.5075 66.1763 31.5860 178.1082 122 F 4.5093 8.4642 117.8611 60.7192 38.7073 177.9328 123 R 4.0046 8.4398 118.0620 59.1523 29.7361 178.4028 124 Y 3.8965 8.0467 119.3723 60.7507 38.8283 178.2171 125 L 3.4524 8.2414 119.7541 57.4996 41.6124 179.3563 126 A 3.8581 8.2108 120.8689 55.0238 18.3058 179.5635 127 A 3.7752 7.8302 119.2352 55.1039 18.3328 179.6469 128 L 3.6566 7.5296 119.1065 58.2188 42.0376 179.2707 129 F 4.4849 8.1739 118.2587 60.4337 38.7152 177.4061 130 Q 3.9498 8.2548 119.4526 59.0603 28.7747 178.5620 131 K 3.9717 8.0306 119.5240 59.4151 32.0847 179.4842 132 G 2.3373 7.6786 106.0668 47.2438 0.0000 175.0364 133 F 4.0200 8.1730 123.4412 61.3426 39.3947 176.7939 134 D 4.4511 8.6212 118.4440 57.5701 40.7484 179.3052 135 V 3.5750 8.0833 119.1480 65.9640 31.5096 178.2601 136 S 4.2956 8.1055 115.5291 60.8605 62.9932 175.8833 137 D 4.1157 8.1109 121.9675 57.1161 40.6949 178.1033 138 E 3.9715 7.9359 117.9516 59.3979 29.5604 178.7549 139 E 4.2029 8.1166 116.8005 56.6539 29.6269 177.6958 140 G 3.8277 7.4699 106.3052 46.8139 0.0000 175.0378 141 D 4.6141 7.9628 122.0337 52.5359 38.7714 176.4792 142 S 4.0470 7.9656 119.4383 60.6814 63.5198 176.6863 143 V 3.5155 7.6457 121.3683 66.2690 31.3926 178.0137 144 T 3.7592 7.9575 115.0427 66.3464 68.1840 175.9842 145 N 4.5051 8.1817 120.4357 56.3046 38.8817 176.4116 146 D 4.3720 8.2088 119.1343 57.2456 41.3603 178.2215 147 I 3.5183 7.3992 119.9542 64.3745 37.0253 178.4162 148 F 3.9528 7.8454 118.5599 60.2441 38.6140 177.2708 149 N 4.3176 8.5898 116.8486 56.7358 38.7317 176.9286 150 V 3.5395 7.9222 119.4732 66.0513 31.5890 177.8500 151 A 3.3797 7.3866 121.1464 54.0926 17.9015 179.3736 152 K 3.9700 8.1061 118.0465 59.6571 32.3493 178.3779 153 A 3.9729 8.1900 121.3937 55.6481 18.2547 179.6865 154 S 4.0571 7.8969 111.0293 61.4513 62.5059 176.2939 155 I 3.5057 7.8139 122.5527 64.4696 36.8467 178.2347 156 E 4.0428 8.4567 119.5678 59.1927 29.2909 179.3251 157 K 4.2348 8.1008 119.5416 60.0586 32.2899 178.5222 158 H 4.4176 8.3289 116.4045 58.9725 28.5059 177.8208 159 I 3.8250 8.0690 121.6260 64.0938 36.9121 177.9800 160 W 4.4333 8.3360 129.1708 61.0818 30.4678 177.9125 161 M 3.2747 7.7666 118.1044 58.0146 31.3361 178.7915 162 L 4.0141 8.3909 119.4942 57.9684 41.7864 179.5211 163 Q 3.9676 8.4331 118.0348 58.9510 28.5923 178.8582 164 A 4.1385 8.2147 121.8389 55.2479 18.2086 179.0846 165 E 3.9624 8.1432 116.6901 59.4579 29.7440 178.2741 166 L 4.3552 7.6057 115.7906 54.2142 41.8304 176.9382 167 G 3.9112 8.2309 107.0859 46.7032 0.0000 173.6925 168 Q 4.6089 8.2303 116.6214 53.1475 32.7510 175.3485 169 A 4.3704 8.3389 122.1174 51.4567 19.1296 176.3591 170 P 4.3668 0.0000 0.0000 63.9618 32.0765 177.2772 171 K 3.8152 8.0944 115.7954 57.3615 29.5273 174.6806 172 L 4.1883 7.6804 120.9132 55.1655 41.5365 177.7990 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 4.33 0.00 1.68 1.57 0.92 0.44 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 23 A 7.84 4.21 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 24 D 8.39 4.98 0.00 3.15 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 25 S 9.75 4.18 0.00 3.87 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 26 K 8.09 3.94 0.00 1.94 1.84 0.00 1.66 0.00 0.00 1.80 0.00 0.00 3.17 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.51 7.81 27 A 8.18 4.03 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 28 V 8.07 3.77 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 0.91 0.00 0.00 0.76 0.00 0.00 29 L 8.31 4.11 0.00 2.00 1.79 0.94 0.19 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 30 N 8.35 4.24 0.00 2.79 2.44 0.00 0.00 6.83 6.31 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 31 Q 8.75 4.26 0.00 2.40 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.49 2.78 0.00 32 A 9.00 4.24 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.05 3.55 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 1.27 0.00 0.00 1.07 0.00 0.00 34 A 8.45 4.13 1.59 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 35 D 8.57 4.36 0.00 2.89 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.63 4.19 0.00 1.79 1.80 1.16 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.88 3.89 0.00 3.48 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 38 V 7.76 3.62 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 1.05 0.00 0.00 0.96 0.00 0.00 39 A 8.54 3.98 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.56 3.97 0.00 3.31 3.53 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.87 4.13 0.00 3.95 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 8.01 3.68 1.98 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.80 0.85 0.00 0.00 43 L 8.16 3.99 0.00 1.76 1.67 1.11 1.31 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 44 H 8.01 3.65 0.00 2.97 2.53 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 7.88 4.19 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.52 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 46 V 7.73 3.62 2.22 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 0.95 0.00 0.00 0.96 0.00 0.00 47 H 8.12 4.11 0.00 3.09 3.25 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 8.45 4.70 0.00 3.62 2.90 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 49 Y 8.75 4.29 0.00 3.16 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 50 M 7.61 4.52 0.00 2.28 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 2.78 2.89 0.00 51 R 8.85 4.66 0.00 2.02 1.79 0.00 3.52 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.77 0.00 52 G 8.90 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 0.00 0.00 0.00 53 R 8.32 4.27 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 9.45 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 8.61 4.09 0.00 3.38 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 56 M 8.26 4.27 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.71 0.00 57 I 7.52 3.75 1.66 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.05 0.75 0.00 0.00 58 W 8.43 4.16 0.00 3.47 3.19 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 59 H 8.26 3.88 0.00 1.92 2.48 0.00 5.78 0.00 0.00 0.00 0.00 6.79 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 4.06 0.00 2.17 2.22 0.00 3.60 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 61 K 7.35 3.53 0.00 1.49 1.86 0.00 0.87 0.00 0.00 1.07 0.00 0.00 2.53 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.14 0.49 7.81 62 M 7.93 4.04 0.00 2.05 2.28 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 3.05 0.00 63 D 7.48 4.20 0.00 2.68 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 7.63 3.90 0.00 1.86 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 2.23 2.34 0.00 65 Y 7.83 4.47 0.00 3.25 3.14 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 66 M 8.49 4.05 0.00 1.87 2.11 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.15 0.00 67 E 8.26 3.90 0.00 2.13 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 2.26 2.30 0.00 68 E 8.17 3.62 0.00 2.06 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 1.83 1.96 0.00 69 I 8.07 3.78 2.09 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.99 1.02 0.00 0.00 70 D 8.68 4.43 0.00 2.77 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 71 G 8.02 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 7.55 4.32 0.00 3.20 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.30 4.08 0.00 1.76 1.85 0.89 1.09 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 74 D 8.23 4.31 0.00 2.91 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 8.10 3.90 0.00 2.09 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 2.20 2.29 0.00 76 M 8.20 3.90 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.02 0.00 77 S 8.12 4.07 0.00 3.99 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 78 E 8.55 3.95 0.00 2.10 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 2.39 0.00 79 R 8.24 3.80 0.00 1.91 2.00 0.00 3.11 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 80 L 7.98 3.89 0.00 1.76 1.84 0.93 0.92 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 81 I 7.85 3.82 2.02 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.71 0.91 0.00 0.00 82 T 8.03 3.87 4.39 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 1.19 0.00 0.00 83 L 8.01 4.34 0.00 1.69 1.69 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.28 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 7.91 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.02 4.51 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 87 P 0.00 4.49 0.00 2.26 2.07 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 2.00 0.00 88 F 8.51 4.56 0.00 3.40 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 89 S 8.84 4.83 0.00 4.01 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 6.77 4.49 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 1.13 0.00 0.00 91 L 8.25 4.03 0.00 1.70 1.81 1.00 1.19 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 7.79 3.86 0.00 1.76 1.70 0.00 1.69 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.48 7.81 93 E 7.89 3.72 0.00 1.88 1.61 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 2.23 2.24 0.00 94 F 7.63 4.43 0.00 3.26 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 95 S 8.17 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 7.88 4.11 0.00 1.98 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 2.30 2.39 0.00 97 N 7.74 4.47 0.00 2.38 2.72 0.00 0.00 6.98 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 7.57 4.57 0.00 3.96 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 9.08 4.44 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.50 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 100 L 7.45 4.19 0.00 1.48 1.42 0.89 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.24 4.52 0.00 1.67 1.66 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.37 7.81 102 E 8.46 4.71 0.00 1.91 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 103 V 7.76 4.53 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 8.35 3.97 0.00 1.54 1.50 0.90 0.86 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 0.00 105 G 8.16 2.45 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 0.00 106 D 7.31 4.47 0.00 2.44 2.38 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 0.00 107 Y 8.79 4.97 0.00 3.13 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 0.00 108 N 8.58 4.91 0.00 2.72 2.85 0.00 0.00 6.75 8.17 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 0.00 109 V 7.40 4.37 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 0.87 0.00 0.00 0.93 0.00 0.00 110 T 8.65 4.21 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 1.22 0.00 0.00 111 I 8.25 3.62 1.86 0.00 0.00 1.00 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 1.06 0.77 0.00 0.00 112 E 8.19 3.87 0.00 2.00 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 2.37 2.42 0.00 113 E 8.11 3.91 0.00 2.25 1.95 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 2.29 2.32 0.00 114 Q 8.55 3.94 0.00 2.10 2.09 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 2.65 2.60 0.00 115 L 8.20 3.72 0.00 1.30 1.26 -0.38 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.97 3.90 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 0.00 117 R 7.98 3.73 0.00 1.86 2.00 0.00 3.08 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 1.54 1.57 0.00 118 V 7.53 3.21 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 0.06 0.00 0.00 0.80 0.00 0.00 119 V 7.55 3.43 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.90 0.00 0.00 120 E 8.03 3.93 0.00 2.14 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 2.55 0.00 121 V 8.00 3.61 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 1.21 0.00 0.00 0.88 0.00 0.00 122 F 8.46 4.51 0.00 3.12 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 0.00 123 R 8.44 4.00 0.00 2.02 1.99 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.89 0.00 124 Y 8.05 3.90 0.00 3.14 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 0.00 125 L 8.24 3.45 0.00 1.62 0.89 1.05 1.09 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 0.00 126 A 8.21 3.86 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 7.83 3.78 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 0.00 128 L 7.53 3.66 0.00 1.14 1.35 0.89 1.52 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 0.00 129 F 8.17 4.48 0.00 3.17 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 0.00 130 Q 8.25 3.95 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 131 K 8.03 3.97 0.00 1.87 1.73 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.50 7.81 132 G 7.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.17 4.02 0.00 3.28 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 D 8.62 4.45 0.00 2.87 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 0.00 135 V 8.08 3.58 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 1.06 0.00 0.00 0.93 0.00 0.00 136 S 8.11 4.30 0.00 4.26 4.20 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 0.00 137 D 8.11 4.12 0.00 2.42 2.54 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 0.00 0.00 0.00 0.00 138 E 7.94 3.97 0.00 2.24 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 0.00 2.33 2.48 0.00 139 E 8.12 4.20 0.00 2.07 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 0.00 2.33 2.30 0.00 140 G 7.47 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 0.00 0.00 0.00 141 D 7.96 4.61 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 7.97 4.05 0.00 4.04 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 0.00 143 V 7.65 3.52 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 7.96 3.76 4.44 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 1.32 0.00 0.00 145 N 8.18 4.51 0.00 2.69 2.84 0.00 0.00 6.46 8.04 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 0.00 146 D 8.21 4.37 0.00 2.83 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.40 3.52 1.62 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.83 0.49 0.00 0.00 148 F 7.85 3.95 0.00 3.39 3.28 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 0.00 149 N 8.59 4.32 0.00 3.25 3.00 0.00 0.00 6.83 7.27 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 0.00 150 V 7.92 3.54 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 0.99 0.00 0.00 0.94 0.00 0.00 151 A 7.39 3.38 -0.16 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 0.00 0.00 152 K 8.11 3.97 0.00 2.10 2.05 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.51 7.81 153 A 8.19 3.97 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 7.90 4.06 0.00 3.95 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 0.00 155 I 7.81 3.51 1.87 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.85 0.77 0.00 0.00 156 E 8.46 4.04 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 2.34 2.47 0.00 157 K 8.10 4.23 0.00 2.08 2.03 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.72 1.93 7.81 158 H 8.33 4.42 0.00 3.39 3.45 0.00 5.68 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 0.00 159 I 8.07 3.83 2.16 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.11 1.00 0.00 0.00 160 W 8.34 4.43 0.00 3.42 3.51 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 0.00 0.00 0.00 0.00 161 M 7.77 3.27 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.06 0.00 162 L 8.39 4.01 0.00 1.70 1.60 0.86 0.67 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 0.00 163 Q 8.43 3.97 0.00 2.35 2.46 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 2.52 2.74 0.00 164 A 8.21 4.14 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 8.14 3.96 0.00 2.22 2.24 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 2.32 2.44 0.00 166 L 7.61 4.36 0.00 1.80 1.64 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.23 3.91 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 0.00 0.00 0.00 168 Q 8.23 4.61 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 169 A 8.34 4.37 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 0.00 170 P 0.00 4.37 0.00 2.13 2.30 0.00 3.89 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.43 0.00 171 K 8.09 3.82 0.00 1.87 1.83 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.46 7.81 172 L 7.68 4.19 0.00 1.63 1.58 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00