NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4331 8.3049 120.3221 54.7268 34.4751 175.1714 2 L 4.3141 7.6174 122.4564 52.5487 43.4759 176.1526 3 T 4.1199 9.0571 114.8760 61.3303 71.7533 175.2150 4 A 3.9250 8.4620 122.9525 55.2449 18.2487 179.5607 5 E 3.8733 8.0818 117.3626 59.5552 29.7895 178.8246 6 E 4.0434 8.2072 118.6682 59.2440 29.5162 179.2470 7 K 3.8530 8.3373 119.7791 59.2424 32.1260 178.8468 8 A 3.9651 8.1731 120.9744 54.9119 18.3469 179.2771 9 A 3.9812 8.1040 119.4137 55.5332 18.4307 180.0425 10 V 3.5981 7.8434 116.5798 66.4671 31.4930 178.4353 11 T 3.9904 8.1747 115.2898 66.5308 68.0990 176.6934 12 A 4.0541 8.2012 121.9466 55.0388 18.8537 179.1132 13 F 4.3061 8.5728 119.1640 61.4476 39.3752 177.2252 14 W 4.2904 8.8013 126.7657 60.3189 30.5393 177.6524 15 G 3.7983 8.2757 105.5276 47.4157 0.0000 175.0930 16 K 4.0805 7.4771 119.0958 57.6491 33.5970 177.9737 17 V 3.2501 6.4052 112.0896 60.4004 32.0209 175.9248 18 K 4.1757 8.2806 123.2734 55.8068 31.8804 176.6538 19 V 4.3905 7.8556 116.5588 60.9075 32.1803 177.4649 20 D 4.5418 8.1328 119.8177 55.0915 39.5909 176.4560 21 E 4.5233 7.8416 118.2327 56.1958 31.2748 177.8245 22 V 3.6357 7.8182 119.5666 65.9522 31.4198 178.1079 23 G 3.6794 8.1213 105.1022 47.6834 0.0000 175.7214 24 G 3.6169 8.0333 107.8767 47.4805 0.0000 175.1962 25 E 3.8625 8.1398 121.5225 58.8698 29.6488 178.7967 26 A 3.9275 8.2395 121.1243 55.0924 18.5009 179.4032 27 L 3.9592 8.2987 119.3841 58.0337 42.1337 179.2870 28 G 3.6067 8.2601 105.9193 48.0408 0.0000 175.8708 29 R 3.8839 8.1998 121.1897 58.5265 29.9425 178.6917 30 L 4.0919 8.0351 120.2518 58.5555 41.9446 179.2439 31 L 4.1788 7.6676 119.2614 56.6424 41.2707 179.6945 32 V 3.5504 7.4307 117.8725 65.8917 31.6656 177.9988 33 V 3.5603 7.8127 117.0027 64.2555 32.7353 175.5543 34 Y 4.1935 7.5284 116.2429 54.4924 37.9384 174.1531 35 P 4.6072 0.0000 0.0000 63.7098 31.8689 177.6748 36 W 4.3627 8.2890 115.8964 59.4131 27.8884 177.9990 37 T 4.2819 7.4857 110.6676 64.4037 68.0350 176.3190 38 Q 4.2214 8.1660 121.3028 58.6879 28.3849 178.2202 39 R 3.7509 7.7376 119.4287 59.4409 30.0352 177.7649 40 F 4.3413 7.5238 114.4277 58.1778 39.2231 175.7418 41 F 4.4600 7.9702 118.2774 56.5991 39.9850 176.7687 42 E 3.9362 8.4880 124.5830 59.4568 29.3985 178.4690 43 S 4.4807 7.9938 110.5763 59.7997 63.2598 174.6071 44 F 4.6828 8.4209 119.8904 58.5906 40.1631 175.8435 45 G 3.9903 7.5201 106.2097 44.2456 0.0000 176.3238 46 D 4.5736 8.6811 129.2797 53.7529 40.3380 175.1976 47 L 4.8747 8.2908 128.1602 54.5101 42.6831 178.2411 48 S 4.3784 8.4183 115.9291 60.3003 63.6952 174.4438 49 T 4.7087 7.4441 110.2681 58.6273 73.0317 174.1715 50 A 3.9497 8.5518 123.5089 55.7714 18.3329 179.8766 51 D 4.2619 8.0677 116.3934 57.3134 41.0450 178.6791 52 A 3.9516 8.1462 121.3343 55.1075 18.1930 179.6998 53 V 3.5357 7.8883 115.7368 66.7140 31.7042 177.9858 54 M 4.2004 8.0178 116.7421 57.6978 31.8692 177.5188 55 N 4.8226 7.7864 113.8841 51.7750 39.5229 174.6458 56 N 4.3478 7.5051 120.9172 53.0853 39.4270 173.8837 57 P 4.2793 0.0000 0.0000 65.4425 31.3341 178.8375 58 K 3.6489 8.0674 117.6711 58.9990 31.7039 179.5676 59 V 3.6651 7.7496 118.1432 65.9094 31.7033 178.0666 60 K 3.9084 7.9298 117.8541 59.4329 31.6924 179.2350 61 A 3.9776 8.0938 121.1216 55.3260 18.2126 179.2208 62 H 4.3118 8.4999 117.1029 59.4044 29.9525 177.4948 63 G 3.7510 8.4443 108.1678 47.8303 0.0000 175.5940 64 K 4.0155 7.9951 120.6058 59.8288 32.5736 179.4521 65 K 4.1504 7.8502 119.6789 59.0620 31.9597 179.5410 66 V 3.6584 7.9564 118.7800 66.0025 31.4520 177.9336 67 L 4.2187 8.3384 120.3436 58.1425 41.8162 178.4966 68 D 4.4893 8.6360 119.4817 57.5010 40.7023 178.7428 69 S 4.1528 8.3320 113.4770 61.3423 62.3746 175.8850 70 F 4.2224 8.4788 123.2963 61.6038 38.9607 177.1803 71 S 4.1278 8.9293 113.7790 61.5668 62.9945 175.7804 72 N 4.5130 8.6221 120.1250 56.8182 38.7215 176.7340 73 G 3.8633 8.2740 107.1729 48.5317 0.0000 175.4079 74 M 3.8777 7.6414 119.4806 57.0853 31.9348 177.9430 75 K 4.3165 7.5798 116.3525 56.4343 33.6072 176.1862 76 H 5.0613 7.8880 117.1746 54.8515 29.6631 175.2065 77 L 3.9936 7.8687 119.7964 57.3966 41.9969 178.6180 78 D 4.5437 7.9402 116.1273 54.7051 40.4713 176.1298 79 D 4.7291 8.0152 120.8047 52.1404 41.8936 176.3244 80 L 4.1121 7.9961 122.5018 57.7446 41.8451 178.6208 81 K 3.8938 8.2764 119.3003 59.9796 31.7704 178.7411 82 G 3.5813 7.9944 104.2467 48.0714 0.0000 175.2976 83 T 3.8024 7.6921 117.1904 65.5968 68.6673 175.7483 84 F 4.6667 7.9725 116.7340 56.9217 39.5166 177.3194 85 A 4.0029 7.6666 122.4954 55.3257 18.2710 180.0122 86 A 3.9668 7.9181 118.5604 55.4506 18.4910 179.7568 87 L 4.0807 7.9499 116.9743 57.6471 41.6737 179.4609 88 S 4.1389 8.8009 113.7267 61.4855 62.3008 175.8334 89 E 4.1144 8.0670 121.4005 59.1161 29.2968 178.3465 90 L 3.9394 7.8768 120.1525 58.6539 42.1634 178.8442 91 H 4.1513 8.5983 116.2279 59.0443 28.4388 177.7077 92 C 4.2668 8.6579 118.8378 63.1098 27.9686 175.8217 93 D 4.5910 8.2977 118.9724 56.3670 41.1109 178.0886 94 K 4.1804 8.0413 116.8863 58.2667 32.7458 177.6561 95 L 4.2148 7.9271 116.1024 54.6706 42.0465 176.3001 96 H 4.3625 7.8675 113.6513 55.8934 26.0682 174.6533 97 V 3.7272 7.7702 119.1806 61.5089 32.1118 175.0521 98 D 4.2927 8.5909 127.1824 53.4316 41.8685 175.1479 99 P 2.9700 0.0000 0.0000 64.7859 31.8809 177.9249 100 E 3.8379 8.4906 119.3217 59.5032 29.2026 178.6557 101 N 4.3486 8.0837 116.2755 55.9434 38.4866 177.3715 102 F 4.4190 7.3539 119.6329 60.4052 38.8889 177.7917 103 K 4.0164 7.9920 117.7208 59.3164 31.9695 179.1245 104 L 3.8227 7.6979 119.0885 57.7329 41.5245 179.3804 105 L 4.0669 8.1996 120.5027 58.0641 42.0435 179.0813 106 G 3.6951 8.1265 105.6649 48.0890 0.0000 175.4233 107 N 4.4468 8.3854 119.0690 55.8282 38.5011 177.6574 108 V 3.6127 8.3382 120.1578 65.9253 31.5819 177.6390 109 L 3.8588 8.3157 120.4089 58.2895 41.7603 179.1492 110 V 3.6378 7.8498 117.9735 65.9638 31.4132 178.0718 111 V 3.5822 7.9814 118.0268 66.0229 31.3199 178.1065 112 V 3.4614 8.0816 118.2733 65.9600 31.3359 177.8799 113 L 3.8712 8.1368 118.8225 57.7390 41.4893 179.3814 114 A 3.9053 7.7541 120.7988 55.1369 18.0891 179.7118 115 R 3.8353 7.7381 116.3679 59.5291 30.2383 178.1227 116 N 4.1875 7.8255 115.1553 54.4809 38.5535 175.8678 117 F 5.0957 7.4889 116.1492 56.0442 41.0345 177.5090 118 G 3.8144 7.8120 109.8550 46.0877 0.0000 175.9267 119 K 4.1511 8.8099 118.3470 59.6730 32.9173 178.5288 120 E 4.1443 8.3359 118.3144 58.9323 29.7916 177.3881 121 F 4.3241 7.9988 122.8030 57.0914 37.8650 175.2970 122 T 4.2143 7.2857 115.9811 60.0001 71.5021 173.5258 123 P 4.1778 0.0000 0.0000 65.8326 31.2626 179.1810 124 V 3.5060 7.5438 116.3290 65.8713 31.6074 177.7453 125 L 3.8538 7.7063 120.1305 58.0775 41.8156 178.5344 126 Q 3.3514 7.9500 119.6144 59.0101 28.9063 178.3019 127 A 3.9823 8.0073 121.6835 55.1024 18.3561 179.3620 128 D 4.2237 8.0027 117.4381 57.6437 40.8201 179.0645 129 F 4.0235 8.4102 118.1865 60.4377 38.7976 177.7204 130 Q 4.1013 8.5194 118.3243 58.9212 28.4613 178.9922 131 K 3.9494 7.9442 119.4009 59.2814 31.9900 179.5757 132 V 3.4823 7.6021 118.4065 66.2665 31.4597 178.6488 133 V 3.7973 8.3532 112.2511 64.2393 31.2797 178.4802 134 A 4.1152 8.4145 121.0835 54.9315 18.1679 179.9712 135 G 3.4610 8.1786 104.3406 47.8714 0.0000 176.0645 136 V 3.1840 8.0355 121.2857 65.4951 31.5177 177.9378 137 A 3.8523 8.1974 120.7953 55.0989 18.0746 179.0921 138 N 4.2769 8.3887 115.4623 56.7972 38.8111 176.9662 139 A 4.0213 7.8341 121.1601 55.2025 18.5379 179.3445 140 L 3.8321 7.5568 116.3914 57.5420 41.8601 179.1410 141 A 4.2803 8.2286 119.9829 54.0857 18.3449 178.6694 142 H 3.9490 7.8459 118.1863 59.6849 29.8704 176.8442 143 R 4.1951 7.9969 113.7373 57.3512 29.5769 176.6196 144 Y 4.2876 8.3202 120.8248 58.8584 39.3422 175.0303 145 H 4.6019 8.1943 121.4140 55.7759 29.1022 173.8192 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 4.43 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 2 L 7.62 4.31 0.00 1.65 1.52 0.77 0.46 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 3 T 9.06 4.12 4.22 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 1.19 0.00 0.00 4 A 8.46 3.92 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 5 E 8.08 3.87 0.00 2.03 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 2.37 2.40 0.00 6 E 8.21 4.04 0.00 2.21 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 2.45 2.27 0.00 7 K 8.34 3.85 0.00 1.75 1.76 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.39 7.81 8 A 8.17 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 9 A 8.10 3.98 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 10 V 7.84 3.60 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 0.78 0.00 0.00 0.10 0.00 0.00 11 T 8.17 3.99 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 1.26 0.00 0.00 12 A 8.20 4.05 1.43 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 13 F 8.57 4.31 0.00 3.46 3.67 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 14 W 8.80 4.29 0.00 3.82 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 15 G 8.28 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 0.00 0.00 0.00 16 K 7.48 4.08 0.00 1.83 1.85 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.09 7.81 17 V 6.41 3.25 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 0.00 0.00 -1.16 0.00 0.00 -0.06 0.00 0.00 18 K 8.28 4.18 0.00 1.74 1.75 0.00 1.50 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.43 7.81 19 V 7.86 4.39 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 0.30 0.00 0.00 0.58 0.00 0.00 20 D 8.13 4.54 0.00 2.74 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 7.84 4.52 0.00 1.97 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 2.26 2.22 0.00 22 V 7.82 3.64 2.27 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 1.18 0.00 0.00 0.94 0.00 0.00 23 G 8.12 3.68 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 0.00 0.00 0.00 24 G 8.03 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 25 E 8.14 3.86 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 2.25 2.27 0.00 26 A 8.24 3.93 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 27 L 8.30 3.96 0.00 1.89 1.62 0.90 1.11 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 28 G 8.26 3.61 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 0.00 0.00 0.00 29 R 8.20 3.88 0.00 2.02 1.95 0.00 3.10 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 30 L 8.04 4.09 0.00 1.89 1.88 0.88 0.58 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 31 L 7.67 4.18 0.00 1.77 1.66 0.69 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.43 3.55 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 0.71 0.00 0.00 0.90 0.00 0.00 33 V 7.81 3.56 1.52 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 -0.07 0.00 0.00 0.79 0.00 0.00 34 Y 7.53 4.19 0.00 2.41 1.43 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 35 P 0.00 4.61 0.00 2.22 2.10 0.00 3.97 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 36 W 8.29 4.36 0.00 3.56 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 37 T 7.49 4.28 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 0.84 0.00 0.00 38 Q 8.17 4.22 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.77 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 39 R 7.74 3.75 0.00 1.72 1.37 0.00 3.11 0.00 0.00 2.87 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.52 0.00 40 F 7.52 4.34 0.00 2.55 2.30 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 41 F 7.97 4.46 0.00 2.88 2.36 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 42 E 8.49 3.94 0.00 1.98 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 2.41 2.34 0.00 43 S 7.99 4.48 0.00 4.15 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 44 F 8.42 4.68 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 45 G 7.52 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.68 4.57 0.00 2.67 2.64 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 0.00 0.00 0.00 0.00 47 L 8.29 4.87 0.00 1.66 1.63 1.07 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 48 S 8.42 4.38 0.00 4.01 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 49 T 7.44 4.71 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 1.21 0.00 0.00 50 A 8.55 3.95 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 51 D 8.07 4.26 0.00 2.69 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 52 A 8.15 3.95 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 53 V 7.89 3.54 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 0.89 0.00 0.00 0.99 0.00 0.00 54 M 8.02 4.20 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.89 0.00 55 N 7.79 4.82 0.00 2.77 2.83 0.00 0.00 6.96 8.16 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 56 N 7.51 4.35 0.00 2.98 2.81 0.00 0.00 7.16 7.40 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 57 P 0.00 4.28 0.00 2.13 2.04 0.00 3.61 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 2.08 2.14 0.00 58 K 8.07 3.65 0.00 1.71 0.74 0.00 1.58 0.00 0.00 1.26 0.00 0.00 2.80 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.15 1.26 7.81 59 V 7.75 3.67 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 1.13 0.00 0.00 1.06 0.00 0.00 60 K 7.93 3.91 0.00 1.98 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.58 7.81 61 A 8.09 3.98 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 62 H 8.50 4.31 0.00 3.46 3.58 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 8.44 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.00 4.02 0.00 2.10 2.24 0.00 1.43 0.00 0.00 1.67 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.69 7.81 65 K 7.85 4.15 0.00 1.93 1.96 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.77 1.66 7.81 66 V 7.96 3.66 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 1.05 0.00 0.00 0.91 0.00 0.00 67 L 8.34 4.22 0.00 1.89 1.79 1.06 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.64 4.49 0.00 3.02 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.33 4.15 0.00 4.18 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 70 F 8.48 4.22 0.00 3.28 3.41 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 71 S 8.93 4.13 0.00 4.22 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 0.00 72 N 8.62 4.51 0.00 2.82 2.93 0.00 0.00 7.09 8.52 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 73 G 8.27 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 74 M 7.64 3.88 0.00 1.71 2.07 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 75 K 7.58 4.32 0.00 1.70 1.62 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.60 7.81 76 H 7.89 5.06 0.00 3.07 3.12 0.00 5.62 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 77 L 7.87 3.99 0.00 1.56 1.66 0.80 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 78 D 7.94 4.54 0.00 2.77 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 D 8.02 4.73 0.00 2.71 2.52 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 80 L 8.00 4.11 0.00 1.77 1.84 0.91 0.75 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 81 K 8.28 3.89 0.00 1.77 1.79 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.33 7.81 82 G 7.99 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 7.69 3.80 4.07 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 0.00 0.00 0.54 0.00 0.00 84 F 7.97 4.67 0.00 3.01 2.94 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 0.00 0.00 0.00 85 A 7.67 4.00 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 86 A 7.92 3.97 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 87 L 7.95 4.08 0.00 2.01 1.87 1.10 0.93 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 88 S 8.80 4.14 0.00 4.08 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 89 E 8.07 4.11 0.00 2.19 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 2.33 2.40 0.00 90 L 7.88 3.94 0.00 1.85 1.87 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 91 H 8.60 4.15 0.00 3.41 3.61 0.00 5.86 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 92 C 8.66 4.27 0.00 3.18 3.24 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 93 D 8.30 4.59 0.00 2.92 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.04 4.18 0.00 1.90 1.82 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.45 7.81 95 L 7.93 4.21 0.00 1.71 1.59 0.71 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 96 H 7.87 4.36 0.00 3.51 3.48 0.00 5.74 0.00 0.00 0.00 0.00 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 7.77 3.73 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 0.25 0.00 0.00 0.14 0.00 0.00 98 D 8.59 4.29 0.00 2.72 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 0.00 0.00 0.00 0.00 99 P 0.00 2.97 0.00 1.81 1.81 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.06 0.00 100 E 8.49 3.84 0.00 2.04 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 2.28 2.37 0.00 101 N 8.08 4.35 0.00 2.59 2.80 0.00 0.00 6.97 7.82 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 0.00 102 F 7.35 4.42 0.00 3.07 2.84 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 0.00 103 K 7.99 4.02 0.00 1.98 1.85 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.55 7.81 104 L 7.70 3.82 0.00 1.63 1.07 0.69 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.20 4.07 0.00 1.77 1.70 0.93 1.40 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 0.00 106 G 8.13 3.70 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 0.00 0.00 0.00 107 N 8.39 4.45 0.00 3.03 2.93 0.00 0.00 6.68 7.22 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 0.00 108 V 8.34 3.61 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 1.11 0.00 0.00 1.14 0.00 0.00 109 L 8.32 3.86 0.00 1.66 1.75 0.83 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 110 V 7.85 3.64 2.33 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 1.35 0.00 0.00 1.15 0.00 0.00 111 V 7.98 3.58 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 1.00 0.00 0.00 1.04 0.00 0.00 112 V 8.08 3.46 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 1.10 0.00 0.00 0.91 0.00 0.00 113 L 8.14 3.87 0.00 1.01 0.86 0.69 1.16 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 0.00 114 A 7.75 3.91 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 0.00 115 R 7.74 3.84 0.00 1.85 1.92 0.00 3.19 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 116 N 7.83 4.19 0.00 1.73 1.42 0.00 0.00 6.87 7.14 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 0.00 117 F 7.49 5.10 0.00 3.25 3.24 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 0.00 118 G 7.81 3.81 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 0.00 0.00 0.00 119 K 8.81 4.15 0.00 1.92 2.01 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.52 7.81 120 E 8.34 4.14 0.00 2.27 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 121 F 8.00 4.32 0.00 2.97 3.05 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 0.00 122 T 7.29 4.21 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 1.31 0.00 0.00 123 P 0.00 4.18 0.00 2.13 2.12 0.00 3.55 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 124 V 7.54 3.51 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 0.99 0.00 0.00 0.90 0.00 0.00 125 L 7.71 3.85 0.00 1.67 1.34 1.04 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 7.95 3.35 0.00 1.20 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 127 A 8.01 3.98 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 0.00 128 D 8.00 4.22 0.00 2.79 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.41 4.02 0.00 3.35 3.33 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 0.00 130 Q 8.52 4.10 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.70 2.59 0.00 131 K 7.94 3.95 0.00 1.97 1.81 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.59 7.81 132 V 7.60 3.48 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.67 0.00 0.00 133 V 8.35 3.80 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 1.04 0.00 0.00 1.12 0.00 0.00 134 A 8.41 4.12 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 0.00 135 G 8.18 3.46 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 0.00 136 V 8.04 3.18 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 0.29 0.00 0.00 0.88 0.00 0.00 137 A 8.20 3.85 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 0.00 138 N 8.39 4.28 0.00 2.87 2.97 0.00 0.00 7.11 7.32 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 0.00 139 A 7.83 4.02 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 0.00 140 L 7.56 3.83 0.00 0.89 0.23 0.11 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 141 A 8.23 4.28 1.43 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 0.00 142 H 7.85 3.95 0.00 3.27 3.40 0.00 5.79 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.00 4.20 0.00 1.96 2.02 0.00 3.42 0.00 0.00 3.20 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.86 0.00 144 Y 8.32 4.29 0.00 3.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 H 8.19 4.60 0.00 3.05 3.13 0.00 5.74 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00