NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4120 8.2893 120.3486 55.3610 33.0679 174.7188 2 N 4.6525 8.5866 124.0791 51.4618 38.9075 172.9920 3 I 4.5951 8.8056 121.1775 59.5721 41.8847 176.3511 4 I 4.3670 8.3149 123.7032 59.6374 38.5267 175.1514 5 K 4.4400 8.6130 124.8813 54.3988 33.9717 176.2605 6 A 4.5736 8.3909 126.4645 50.7792 20.9212 175.0426 7 N 5.0503 8.2128 117.0862 51.9364 41.3261 175.0623 8 V 3.8334 8.1966 114.7836 62.8371 32.2709 176.8041 9 A 4.2627 7.9927 123.5940 52.1274 18.6853 178.0044 10 A 4.6300 8.3217 122.4630 51.2523 21.4442 174.0845 11 P 4.7990 0.0000 0.0000 64.8530 32.1819 178.8704 12 D 4.7398 8.0593 115.4673 54.3118 40.5824 175.8577 13 A 4.5521 7.6182 124.9231 52.0126 19.9755 178.2515 14 R 4.8300 9.5491 120.8408 55.1293 32.5687 175.8961 15 V 4.9396 8.8124 124.3386 59.9946 34.8643 173.9632 16 A 4.9054 8.4599 128.3042 50.0500 21.5908 175.1599 17 I 4.8081 8.6029 123.6976 59.5467 39.8932 174.6691 18 T 4.8637 8.5720 117.6795 59.9563 70.8551 173.4011 19 I 5.2305 8.2979 126.3761 58.2287 40.5505 174.4674 20 A 5.0227 8.4293 127.9091 51.2785 19.1259 177.9710 21 R 4.4427 9.3139 119.6300 58.4513 30.2443 176.9613 22 F 4.5979 8.1890 121.4347 59.8934 39.6760 174.3128 23 N 4.6588 9.8366 123.9766 54.5698 35.5687 176.1852 24 Q 4.1559 8.3259 120.3908 59.3979 28.1012 177.7787 25 F 3.9154 8.4864 121.5470 61.1104 39.4025 176.3672 26 I 4.2373 8.2743 118.5995 63.6167 37.7572 177.7256 27 N 4.3728 8.2853 116.6180 56.2914 38.2669 176.9483 28 D 4.4662 8.7423 120.8251 57.6332 40.9827 178.8098 29 S 4.0787 7.9625 112.9886 61.0415 62.4255 175.4523 30 L 4.0436 7.8403 123.2582 58.5458 41.6552 178.4049 31 L 3.8596 8.4707 120.5443 57.8020 42.0169 178.5919 32 D 4.5065 8.4121 118.6728 57.3497 40.9071 179.7459 33 G 3.6017 8.0732 105.7561 47.8133 0.0000 175.2915 34 A 3.9210 7.8916 123.3597 54.7206 18.4821 179.2073 35 V 3.4425 7.9341 116.6123 66.3994 31.4984 177.3411 36 D 4.3201 8.1933 116.9953 57.7903 40.9524 177.8571 37 A 3.9247 8.3054 120.9026 55.8192 18.2909 179.0365 38 L 3.8648 8.5159 116.4833 59.2223 41.9169 179.8540 39 T 4.1909 8.2699 110.8431 64.2094 68.5913 176.3239 40 R 3.8681 8.3123 123.4130 58.1168 30.3661 178.3904 41 I 4.2378 7.8028 118.2570 63.4819 38.1084 177.7060 42 G 3.8568 7.8128 103.6516 44.2631 0.0000 174.0379 43 Q 3.8116 7.9806 118.5459 56.4135 26.9127 173.2887 44 V 3.9362 7.5357 118.9892 62.3469 32.2268 175.2874 45 K 4.2395 8.5580 128.7698 56.2680 32.5843 176.6228 46 D 4.6807 8.8023 124.3503 53.9962 39.1273 176.1893 47 D 4.8062 7.9883 117.1363 53.7416 40.2171 176.3026 48 N 4.7205 8.4897 117.8169 53.6922 39.4270 174.1414 49 I 4.9710 7.5976 120.1625 60.3294 38.3762 175.2194 50 T 4.7135 8.8344 117.2618 59.7083 71.9054 172.9795 51 V 4.6171 8.4174 123.7116 61.0492 34.1453 174.5236 52 V 4.3055 8.9807 129.1070 60.7989 33.7091 174.5276 53 W 4.9277 8.9857 129.1162 56.5702 29.5254 176.5239 54 V 4.3849 8.6605 119.0991 59.1122 33.7679 174.9399 55 P 4.3337 0.0000 0.0000 65.1192 31.4633 176.9958 56 G 4.4718 7.9710 108.5972 42.7640 0.0000 174.1179 57 A 4.0322 8.4980 120.7022 54.9155 18.0588 179.3155 58 Y 4.1637 8.1384 117.1599 60.7689 39.2365 177.4969 59 E 4.0995 8.2047 119.1444 58.0337 29.5651 178.6061 60 L 3.8948 7.5332 119.5197 58.1756 41.6170 177.0609 61 P 4.1763 0.0000 0.0000 64.8469 31.1474 177.9684 62 L 3.8832 7.7118 117.9397 58.4687 42.2337 179.2876 63 A 3.9870 7.8428 120.2392 55.6029 18.3065 179.8213 64 T 3.8243 8.1877 108.5038 64.5416 68.7033 176.2083 65 E 3.8463 8.9640 122.7547 59.1962 29.6937 178.3682 66 A 4.0106 8.0275 120.5928 55.5556 18.1698 179.6396 67 L 4.1162 7.5800 115.0819 57.8296 41.8612 179.4536 68 A 4.2124 8.3358 120.9026 55.1987 18.2292 179.6781 69 K 3.8168 8.1444 116.0929 59.8313 32.1692 178.9172 70 S 4.2022 8.0473 112.6130 59.4217 60.9238 175.7849 71 G 3.9236 8.6327 110.4531 46.3242 0.0000 176.0573 72 K 3.9356 7.7066 120.3522 56.2777 31.8794 182.0630 73 Y 5.1137 6.9185 112.7783 56.8224 40.6221 175.4454 74 D 4.7347 9.2214 121.8462 56.1760 41.8767 176.5003 75 A 4.5694 7.4441 117.1650 51.1410 22.5683 175.0925 76 V 4.7288 8.3105 120.0252 61.0323 34.5711 174.5049 77 V 4.3444 8.7595 128.3015 61.5688 33.4327 174.1702 78 A 4.9233 8.6590 130.1833 49.6920 20.8483 175.2337 79 L 5.3173 7.9681 123.1817 52.6563 44.4305 176.3303 80 G 4.2033 7.7570 108.1642 46.1508 0.0000 171.9335 81 T 5.1170 8.1612 116.4936 61.4914 71.9706 174.4437 82 V 4.2230 9.1415 125.0126 61.3725 34.1901 173.8626 83 I 4.7881 8.2004 128.7504 59.5756 38.6689 175.9853 84 R 3.6510 8.4339 127.8415 56.5375 30.3095 176.3098 85 G 4.4391 8.3185 116.0110 44.2428 0.0000 172.8919 86 G 3.6346 8.7932 107.6351 47.5219 0.0000 173.3392 87 T 4.5232 7.5869 108.3603 59.6907 71.6038 173.5031 88 A 4.4633 8.3650 121.2328 52.7783 18.7389 178.7110 89 H 4.2882 8.3443 120.2698 60.3669 29.8649 176.9030 90 F 4.0253 8.4873 121.9664 61.5875 38.9759 176.6293 91 E 3.6060 7.9437 118.1421 59.4958 29.3737 178.3536 92 Y 4.3390 7.3880 115.8600 60.6844 38.2875 177.5408 93 V 3.6977 7.6985 119.3579 65.8559 31.6079 177.7858 94 A 4.0764 7.8273 120.1277 55.2427 18.0767 179.6407 95 G 3.6216 8.0945 104.6679 47.7508 0.0000 176.0746 96 G 3.8526 8.6380 108.2973 45.8580 0.0000 174.8594 97 A 4.2392 7.8440 122.6660 54.4078 19.5823 179.1702 98 S 4.1280 8.2299 111.7788 61.8441 62.3666 176.2665 99 N 4.4286 8.4618 119.3289 55.9873 38.3308 177.3841 100 G 3.7344 7.7220 106.8589 48.0540 0.0000 175.4225 101 L 3.9835 8.0049 121.6574 57.2912 41.7729 179.5791 102 A 3.9863 8.0057 120.5151 55.1200 18.2546 179.6146 103 S 3.9255 8.3302 111.7446 61.5073 62.4697 176.1159 104 V 3.5434 7.7209 120.7612 66.2465 31.1132 177.6071 105 A 4.3731 7.8021 121.1437 54.8134 18.0096 179.4232 106 Q 3.8964 7.7291 116.4146 59.1738 29.1155 177.8946 107 D 4.5252 8.0103 119.4070 57.0785 41.2822 178.5897 108 S 4.3252 8.3422 113.0919 58.9062 63.3921 175.6460 109 G 3.9009 8.1307 109.4684 45.6231 0.0000 173.7253 110 V 3.9641 7.5658 121.0544 61.6384 33.0246 173.6047 111 P 4.5643 0.0000 0.0000 62.6507 32.5150 175.1743 112 V 4.8702 8.3785 123.4915 61.0180 34.0031 174.2536 113 A 4.4158 8.8760 130.4294 51.0536 20.2985 176.3360 114 F 4.6580 8.9962 126.7810 56.2241 38.3154 175.8973 115 G 3.9475 8.0797 117.8620 44.8984 0.0000 170.9668 116 V 4.5623 6.1266 117.5346 60.5960 33.9282 176.0449 117 L 4.2634 8.8522 129.6152 55.0879 42.7747 176.6109 118 T 5.4972 8.7587 112.8294 58.7150 68.9215 172.5843 119 T 4.6140 8.1639 120.9262 61.0143 72.1041 174.9347 120 E 4.1433 9.7842 120.4772 57.2219 30.5329 177.1888 121 S 4.7056 7.5823 112.0426 55.5897 67.6326 174.7875 122 I 3.6840 8.2291 123.1250 64.2748 36.5865 177.9958 123 E 3.9227 8.1817 119.0423 59.7350 29.6230 178.6637 124 Q 4.2829 8.0991 117.4630 58.7816 28.7492 178.4406 125 A 4.0059 7.7782 121.8056 55.4804 18.2926 179.6848 126 I 3.7423 7.8722 118.1060 64.7323 37.1554 178.5410 127 E 4.5332 8.0296 120.2655 58.1483 29.2822 178.4666 128 R 4.5426 7.9615 115.6914 55.6822 30.5281 176.7169 129 A 4.8251 7.2297 121.9013 52.6853 19.5172 177.1268 130 G 4.4608 8.0401 107.9150 48.1347 0.0000 175.4503 131 T 4.6259 7.5137 115.2298 60.1103 68.7767 175.7224 132 K 3.7919 9.2241 117.0864 59.3163 31.7511 177.7689 133 A 4.5838 7.7509 119.2525 52.0059 20.0421 178.9071 134 G 3.7400 8.1229 110.3697 47.3810 0.0000 173.9568 135 N 5.3015 8.2416 117.7761 50.9227 40.9523 175.4862 136 K 3.9725 8.9398 128.9521 59.3092 32.1066 178.8312 137 G 4.0997 8.2391 107.2695 47.3655 0.0000 175.5073 138 A 4.0539 7.8637 123.0857 54.3413 18.5175 179.2343 139 E 3.8865 8.4839 118.0980 59.2865 29.7104 178.8886 140 A 4.0726 8.6409 122.5103 54.3828 18.4197 179.4189 141 A 3.9005 8.1470 119.4005 55.3082 18.4674 179.9185 142 L 3.9363 8.0067 117.6583 58.2080 41.2479 179.9325 143 T 4.0529 8.0847 109.3076 64.4212 68.5071 176.3528 144 A 3.9677 7.9208 123.9203 55.0883 18.3987 179.1859 145 L 3.8884 7.8648 117.2003 58.1277 41.7518 179.2272 146 E 4.0849 8.5716 119.2403 59.9484 29.4295 178.8843 147 M 4.0464 7.9489 117.9579 58.3915 31.9212 178.4588 148 I 3.6944 7.7002 119.9112 64.8384 37.2753 178.1794 149 N 4.3219 7.9684 116.5489 56.2219 38.1545 177.5455 150 V 3.5771 7.8534 119.0376 66.1253 31.7404 177.9032 151 L 4.0789 8.3846 118.8971 57.7458 41.3881 179.1274 152 K 3.8158 8.1229 118.6013 59.5661 32.0681 176.9794 153 A 4.4820 8.0946 120.1177 51.7481 19.4141 177.2447 154 I 3.9011 7.8897 121.0448 63.1633 37.7064 174.0114 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 8.29 4.41 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 2 N 8.59 4.65 0.00 2.95 2.79 0.00 0.00 6.06 6.93 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 3 I 8.81 4.60 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 1.41 0.82 0.91 0.00 0.00 4 I 8.31 4.37 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 1.41 0.61 0.91 0.00 0.00 5 K 8.61 4.44 0.00 1.71 1.71 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.39 7.81 6 A 8.39 4.57 1.23 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 7 N 8.21 5.05 0.00 2.66 2.68 0.00 0.00 7.00 7.71 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 8 V 8.20 3.83 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 0.74 0.00 0.00 0.93 0.00 0.00 9 A 7.99 4.26 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 10 A 8.32 4.63 1.21 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 0.00 0.00 11 P 0.00 4.80 0.00 2.23 2.38 0.00 3.86 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 12 D 8.06 4.74 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 13 A 7.62 4.55 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 14 R 9.55 4.83 0.00 1.42 1.79 0.00 3.21 0.00 0.00 3.09 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 15 V 8.81 4.94 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 0.92 0.00 0.00 0.95 0.00 0.00 16 A 8.46 4.91 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.60 4.81 1.68 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.89 0.69 0.00 0.00 18 T 8.57 4.86 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 1.09 0.00 0.00 19 I 8.30 5.23 0.72 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 -0.06 0.28 0.00 0.00 20 A 8.43 5.02 1.34 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 21 R 9.31 4.44 0.00 2.10 2.52 0.00 2.87 0.00 0.00 3.11 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.64 0.00 22 F 8.19 4.60 0.00 3.16 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 23 N 9.84 4.66 0.00 2.97 2.99 0.00 0.00 6.88 8.20 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 24 Q 8.33 4.16 0.00 2.52 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 25 F 8.49 3.92 0.00 3.14 3.20 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 26 I 8.27 4.24 2.12 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 1.67 0.81 0.95 0.00 0.00 27 N 8.29 4.37 0.00 2.87 2.92 0.00 0.00 7.08 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 28 D 8.74 4.47 0.00 2.66 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 29 S 7.96 4.08 0.00 3.82 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.84 4.04 0.00 1.92 1.64 0.96 0.56 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 31 L 8.47 3.86 0.00 1.77 1.79 0.77 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.41 4.51 0.00 2.87 2.71 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 33 G 8.07 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.89 3.92 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 35 V 7.93 3.44 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 0.98 0.00 0.00 0.97 0.00 0.00 36 D 8.19 4.32 0.00 2.83 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 37 A 8.31 3.92 1.39 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 0.00 0.00 38 L 8.52 3.86 0.00 1.85 1.73 0.89 0.61 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 39 T 8.27 4.19 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 1.28 0.00 0.00 40 R 8.31 3.87 0.00 1.83 2.23 0.00 3.24 0.00 0.00 3.46 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 41 I 7.80 4.24 2.09 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 1.45 0.97 0.91 0.00 0.00 42 G 7.81 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 7.98 3.81 0.00 2.37 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.95 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 44 V 7.54 3.94 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 0.93 0.00 0.00 0.99 0.00 0.00 45 K 8.56 4.24 0.00 1.80 1.67 0.00 1.92 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.37 7.81 46 D 8.80 4.68 0.00 2.83 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 47 D 7.99 4.81 0.00 2.78 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 N 8.49 4.72 0.00 2.89 3.00 0.00 0.00 6.92 7.25 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 49 I 7.60 4.97 1.88 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 1.40 0.52 0.89 0.00 0.00 50 T 8.83 4.71 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 51 V 8.42 4.62 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 0.50 0.00 0.00 0.83 0.00 0.00 52 V 8.98 4.31 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 0.94 0.00 0.00 0.86 0.00 0.00 53 W 8.99 4.93 0.00 3.20 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 54 V 8.66 4.38 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 0.83 0.00 0.00 1.04 0.00 0.00 55 P 0.00 4.33 0.00 2.19 2.31 0.00 3.75 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 2.16 2.04 0.00 56 G 7.97 4.47 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 0.00 57 A 8.50 4.03 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 58 Y 8.14 4.16 0.00 2.94 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 59 E 8.20 4.10 0.00 2.01 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 2.64 2.58 0.00 60 L 7.53 3.89 0.00 1.78 1.71 0.88 0.74 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 61 P 0.00 4.18 0.00 2.02 1.85 0.00 3.66 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 62 L 7.71 3.88 0.00 1.64 1.67 0.92 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 63 A 7.84 3.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 8.19 3.82 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 1.19 0.00 0.00 65 E 8.96 3.85 0.00 2.00 2.18 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 2.31 2.33 0.00 66 A 8.03 4.01 1.40 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 0.00 0.00 67 L 7.58 4.12 0.00 1.75 1.68 0.64 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.34 4.21 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 69 K 8.14 3.82 0.00 1.87 1.92 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.65 1.61 7.81 70 S 8.05 4.20 0.00 3.93 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 71 G 8.63 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 72 K 7.71 3.94 0.00 1.83 1.74 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 1.28 7.81 73 Y 6.92 5.11 0.00 2.97 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 D 9.22 4.73 0.00 2.55 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 75 A 7.44 4.57 1.23 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 76 V 8.31 4.73 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 0.92 0.00 0.00 0.85 0.00 0.00 77 V 8.76 4.34 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 0.87 0.00 0.00 0.88 0.00 0.00 78 A 8.66 4.92 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 79 L 7.97 5.32 0.00 1.38 1.40 0.85 0.64 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 80 G 7.76 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 0.00 0.00 0.00 81 T 8.16 5.12 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 1.19 0.00 0.00 82 V 9.14 4.22 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 0.93 0.00 0.00 0.87 0.00 0.00 83 I 8.20 4.79 1.85 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 1.24 0.69 0.85 0.00 0.00 84 R 8.43 3.65 0.00 0.67 1.38 0.00 3.05 0.00 0.00 2.98 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.18 0.00 85 G 8.32 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 0.00 0.00 0.00 0.00 86 G 8.79 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 87 T 7.59 4.52 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 1.24 0.00 0.00 88 A 8.36 4.46 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 89 H 8.34 4.29 0.00 3.27 3.41 0.00 5.62 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 90 F 8.49 4.03 0.00 3.10 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 91 E 7.94 3.61 0.00 1.95 1.12 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 2.01 2.18 0.00 92 Y 7.39 4.34 0.00 2.99 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 93 V 7.70 3.70 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 1.06 0.00 0.00 0.79 0.00 0.00 94 A 7.83 4.08 0.91 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 95 G 8.09 3.62 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 0.00 96 G 8.64 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.84 4.24 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 98 S 8.23 4.13 0.00 3.73 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 99 N 8.46 4.43 0.00 2.80 2.83 0.00 0.00 6.95 7.72 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 0.00 100 G 7.72 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 0.00 0.00 0.00 101 L 8.00 3.98 0.00 2.04 1.82 1.05 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 102 A 8.01 3.99 1.34 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 0.00 103 S 8.33 3.93 0.00 3.97 4.02 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 0.00 104 V 7.72 3.54 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 1.07 0.00 0.00 0.98 0.00 0.00 105 A 7.80 4.37 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.73 3.90 0.00 2.08 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 107 D 8.01 4.53 0.00 2.70 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 0.00 108 S 8.34 4.33 0.00 4.02 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 0.00 109 G 8.13 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 0.00 110 V 7.57 3.96 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 1.00 0.00 0.00 1.01 0.00 0.00 111 P 0.00 4.56 0.00 2.12 1.96 0.00 3.78 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 112 V 8.38 4.87 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 0.81 0.00 0.00 0.96 0.00 0.00 113 A 8.88 4.42 1.27 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 0.00 0.00 114 F 9.00 4.66 0.00 3.00 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 0.00 115 G 8.08 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 0.00 116 V 6.13 4.56 1.23 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 0.67 0.00 0.00 0.08 0.00 0.00 117 L 8.85 4.26 0.00 1.60 1.58 0.92 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.76 5.50 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 119 T 8.16 4.61 4.41 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 1.25 0.00 0.00 120 E 9.78 4.14 0.00 1.95 1.92 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 2.30 2.30 0.00 121 S 7.58 4.71 0.00 3.95 3.85 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 0.00 0.00 0.00 122 I 8.23 3.68 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.69 0.86 0.00 0.00 123 E 8.18 3.92 0.00 1.93 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 0.00 2.30 2.49 0.00 124 Q 8.10 4.28 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 125 A 7.78 4.01 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 0.00 126 I 7.87 3.74 2.01 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 1.83 0.91 0.99 0.00 0.00 127 E 8.03 4.53 0.00 2.24 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 2.40 0.00 128 R 7.96 4.54 0.00 1.87 1.94 0.00 3.11 0.00 0.00 3.19 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 129 A 7.23 4.83 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 0.00 130 G 8.04 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 7.51 4.63 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 0.00 132 K 9.22 3.79 0.00 1.77 1.96 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.49 7.81 133 A 7.75 4.58 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 0.00 134 G 8.12 3.74 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 0.00 135 N 8.24 5.30 0.00 2.70 2.65 0.00 0.00 6.93 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 K 8.94 3.97 0.00 1.82 1.82 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.47 7.81 137 G 8.24 4.10 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 0.00 0.00 0.00 138 A 7.86 4.05 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 0.00 139 E 8.48 3.89 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 140 A 8.64 4.07 1.34 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 0.00 141 A 8.15 3.90 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 0.00 142 L 8.01 3.94 0.00 2.00 1.72 0.91 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 143 T 8.08 4.05 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 1.31 0.00 0.00 144 A 7.92 3.97 1.39 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 0.00 0.00 145 L 7.86 3.89 0.00 1.86 1.90 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.57 4.08 0.00 1.99 1.97 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 2.32 2.38 0.00 147 M 7.95 4.05 0.00 2.11 2.34 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.92 0.00 148 I 7.70 3.69 2.05 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 1.68 0.92 0.92 0.00 0.00 149 N 7.97 4.32 0.00 2.92 2.86 0.00 0.00 6.72 9.02 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 0.00 150 V 7.85 3.58 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 0.83 0.00 0.00 0.98 0.00 0.00 151 L 8.38 4.08 0.00 1.92 1.69 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.12 3.82 0.00 1.83 2.09 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.50 7.81 153 A 8.09 4.48 1.34 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 0.00 154 I 7.89 3.90 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 0.72 0.91 0.00 0.00