NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.1433 8.3344 116.7738 58.0827 64.9012 173.6343 5 V 3.8338 7.5010 123.9016 60.4793 31.2881 169.9749 6 V 4.1265 8.9147 128.6136 61.7742 33.7404 174.6834 7 K 4.7310 8.1255 123.8556 54.3371 35.4783 177.1650 8 S 4.1626 8.9015 118.1129 62.1825 62.7608 176.7145 9 E 4.3859 8.2150 112.7906 57.3006 29.1710 176.4630 10 D 4.7196 7.9084 118.2289 54.5068 40.9867 177.9441 11 Y 4.1821 7.3122 118.0393 59.3696 37.8991 176.9401 12 A 4.2769 7.1638 121.2840 52.4960 19.3875 176.7457 13 L 4.6676 7.1723 115.7709 51.8174 43.6064 174.8705 14 P 4.3161 0.0000 0.0000 63.0320 31.7213 175.8168 15 S 4.8416 8.3362 115.4699 56.4424 66.1178 172.2846 16 Y 4.5600 8.3410 121.0864 56.4830 39.7194 174.9235 17 V 4.2971 6.9440 117.8843 59.8602 35.6403 174.7701 18 D 4.6071 8.4905 123.9479 52.6585 40.9722 175.6607 19 R 4.5351 7.7876 123.5216 54.0204 33.3828 176.0630 20 R 3.5664 8.6925 124.1356 59.1499 30.1588 177.1826 21 D 4.7958 7.9935 113.8306 53.5225 39.2121 176.1361 22 Y 4.7276 7.7703 120.4067 55.4513 38.8650 173.5401 23 P 4.4730 0.0000 0.0000 65.0850 31.8214 176.9804 24 L 4.7077 6.7262 116.5089 51.5345 41.2640 174.3292 25 P 4.6748 0.0000 0.0000 62.2997 32.0179 176.7928 26 D 4.5800 8.7850 119.4362 56.8075 40.9823 177.1592 27 V 4.5447 7.4434 109.4891 59.0122 35.5389 174.8920 28 A 4.2670 8.2800 124.0380 51.8038 19.2805 177.3539 29 H 3.7335 8.6601 121.4940 58.3596 29.9130 175.9829 30 V 4.2048 7.7345 118.8709 60.7851 32.9163 174.8136 31 K 4.2336 8.6061 126.1706 57.7760 33.7905 176.4240 32 N 4.7327 7.9265 116.8948 51.6774 39.5070 174.0930 33 L 4.7135 8.1722 123.0431 52.5589 44.4338 177.1795 34 S 4.4546 8.2958 117.3949 57.4103 65.6701 175.1364 35 A 3.9765 8.4258 122.7418 55.4114 18.0573 179.8362 36 S 4.0861 7.9864 112.2182 61.7888 63.1609 176.5694 37 Q 4.0000 7.9532 121.3305 58.5858 28.4671 178.8995 38 K 4.0293 8.4717 119.6264 59.2166 31.9487 179.3180 39 A 4.0219 7.9612 121.0667 54.9607 18.1896 179.4489 40 L 3.9102 7.9734 118.9122 58.2982 41.9884 179.4150 41 K 4.0069 7.9827 117.2330 59.1756 32.1899 178.9043 42 E 4.1647 7.9771 118.9142 59.1113 29.4785 178.9937 43 K 4.0089 8.2712 119.8860 59.3841 32.0316 178.3208 44 E 4.2386 8.2953 118.7911 58.6383 29.5976 178.2633 45 K 4.2377 8.0075 116.7680 57.7604 32.5186 176.5064 46 A 4.4692 7.6327 122.2423 50.0327 20.8702 176.4045 47 S 4.0087 8.3436 112.4066 58.6505 62.8862 175.4649 48 W 4.6243 8.5482 126.4610 59.4187 29.2191 178.6133 49 S 4.2848 7.7479 113.7539 61.4075 62.2763 175.4477 50 S 4.3887 7.7699 114.4000 59.2029 62.9391 173.9645 51 L 4.4604 7.5660 123.6972 54.2944 42.6602 177.0775 52 S 4.5691 9.7848 122.0712 57.4669 65.5027 175.4651 53 I 3.6677 8.2229 123.1735 64.9974 36.8954 178.4865 54 D 4.3617 8.0816 118.8070 57.2437 40.6452 178.5847 55 E 4.0354 7.9543 119.3062 59.1506 29.4900 179.3963 56 K 3.9716 8.3069 119.0193 59.4862 32.0426 179.6582 57 V 3.7165 8.1082 118.7074 65.7173 31.2652 177.7547 58 E 3.9662 8.1613 119.4303 59.0470 29.3168 178.7627 59 L 3.9878 8.0652 119.1828 57.8321 41.6789 178.8482 60 Y 4.0422 8.1194 119.4025 60.8635 38.6666 178.1255 61 R 4.5010 8.1801 118.0852 57.6217 30.3387 178.4975 62 L 4.1291 7.4997 119.9186 57.1917 41.6971 179.0661 63 K 3.5648 7.6078 119.5390 57.9083 32.2953 176.5170 64 F 5.2212 7.4014 117.3230 55.3523 41.3245 175.7434 65 K 3.5403 8.5798 125.2489 57.6825 32.5069 176.4988 66 E 4.9352 8.5075 119.4949 54.3186 32.2189 176.9835 67 S 5.1284 8.8639 119.0338 56.9112 65.7111 175.5831 68 F 3.8328 8.9580 119.7141 60.6768 38.3738 177.6582 69 A 4.0657 8.1032 118.4915 55.3158 18.3647 179.1120 70 E 4.1062 8.1316 116.9152 59.7495 29.3731 179.5141 71 M 4.2209 8.1744 116.1173 57.8812 31.3550 177.3287 72 N 4.7013 7.9459 115.2600 52.0446 39.3595 175.5151 73 R 4.0698 7.1041 118.3554 56.0658 30.1100 176.7046 74 S 4.5938 8.3453 115.1087 57.7108 64.5338 172.4427 75 T 4.7628 8.0215 109.9616 60.4962 71.9238 173.1418 76 N 4.8617 8.4715 115.3025 53.2948 38.8626 176.8103 77 E 3.9398 8.2057 122.4795 59.1766 29.4516 178.9194 78 W 4.2954 8.3989 116.2334 59.4327 27.9234 178.4218 79 K 3.0975 6.7945 119.1690 59.2522 31.2796 179.4373 80 T 3.7551 7.5014 115.4681 66.4505 68.3746 176.7315 81 V 3.5972 7.9371 120.2246 66.1419 31.6704 178.2430 82 V 3.7679 8.1632 118.2006 65.9678 31.3916 178.2397 83 G 3.5925 8.3712 105.4694 47.7814 0.0000 175.6265 84 A 4.1343 8.4634 123.4472 54.6377 18.4039 179.5000 85 A 4.1656 8.4211 119.5761 55.9127 18.5321 179.8585 86 M 4.1069 8.2884 117.0868 58.3831 31.8710 178.8399 87 F 4.0470 8.2402 121.0249 61.3238 39.5500 177.3036 88 F 4.0249 8.4554 117.4118 60.4256 38.4786 177.8504 89 I 3.9934 8.0076 119.1250 64.0328 37.0041 178.4053 90 G 3.6157 8.0796 106.9379 47.6725 0.0000 175.5776 91 F 3.9492 8.0551 123.5067 61.1884 39.2610 177.2761 92 T 3.6815 7.9405 115.2758 66.5317 68.2272 176.3368 93 A 4.0153 7.7355 122.4837 55.0005 18.2558 179.7221 94 L 3.8847 7.5273 117.8045 57.8468 41.6209 179.6111 95 L 3.9040 7.3074 118.5019 57.6985 41.5606 179.3952 96 L 4.0704 7.9339 119.0505 57.6809 41.5175 179.6220 97 I 3.7144 7.8795 119.9173 64.1151 37.0052 178.1843 98 W 4.1857 8.4291 129.2957 60.4095 30.4576 177.6247 99 E 3.8340 8.5260 119.2304 59.2515 28.9377 178.6609 100 K 4.0634 7.9270 118.3046 59.6652 32.2410 178.0093 101 H 4.0081 7.9110 117.6582 59.0584 29.9898 176.1823 102 Y 4.1639 7.4493 115.7519 57.9007 38.3548 176.5242 103 V 3.9832 7.3793 118.3899 64.4508 32.8087 175.7432 104 Y 4.5380 7.5274 116.3036 57.8948 38.3861 176.0245 105 G 4.0707 8.3372 113.5870 43.3542 0.0000 171.3448 106 P 4.3603 0.0000 0.0000 62.3116 31.9379 176.0540 107 I 4.0248 7.7706 113.5181 59.0832 39.0532 173.7477 108 P 4.3329 0.0000 0.0000 62.9226 31.7581 177.5344 109 H 4.3002 8.5300 116.1590 58.1270 28.5489 177.1208 110 T 2.6329 7.0241 109.0972 62.8059 68.5074 174.6881 111 F 4.4987 7.5752 119.6550 57.9622 39.8043 176.6925 112 E 4.2061 8.0356 121.7713 55.9984 31.1614 177.0809 113 E 3.9775 8.9635 123.0328 59.6812 29.6523 179.1046 114 E 3.9168 8.2136 118.4433 59.0427 29.8834 178.1748 115 W 3.9007 8.3316 127.9078 60.6251 30.6602 177.8024 116 V 3.7512 8.3353 117.9932 65.9905 31.0542 177.8231 117 A 4.0447 8.0457 120.5508 54.9989 18.1505 179.8725 118 K 3.7696 8.0209 116.9203 59.6433 32.1000 179.2163 119 Q 3.8581 8.3151 120.0996 59.6511 28.8522 178.7869 120 T 4.0117 8.2831 116.8992 66.4567 68.4371 176.5606 121 K 3.6046 7.7416 121.1593 59.4526 32.1949 178.6954 122 R 3.8205 8.2007 119.3271 59.8441 29.8438 178.3741 123 M 4.0577 8.3503 118.6270 58.3703 31.9195 178.7689 124 L 4.1147 7.9317 119.2449 57.7018 41.4619 179.2375 125 D 4.4517 8.1893 119.0642 56.9548 40.8473 177.6006 126 M 4.2900 8.0649 114.7450 54.0177 32.4711 176.0660 127 K 4.1703 7.7311 116.9952 56.3748 30.4172 176.2664 128 V 3.4634 8.2668 118.5302 64.4399 32.8944 175.1553 129 A 4.1473 8.7683 129.6005 52.9132 15.5814 175.5713 130 P 4.5141 0.0000 0.0000 64.4721 32.6427 178.8950 131 I 4.1050 7.8510 119.4281 63.9194 37.5971 176.0740 132 Q 4.6441 8.0578 114.4396 57.4240 34.8720 176.1942 133 G 3.8790 8.4319 105.3931 48.2297 0.0000 172.9736 134 F 4.8710 8.3679 121.3033 59.3019 42.4659 176.6255 135 S 4.2460 9.2267 116.6933 61.3567 63.0404 176.7920 136 A 4.2448 8.2211 121.9430 54.4624 18.4274 177.9359 137 K 4.4706 8.4559 114.7065 56.0774 32.5110 175.7136 138 W 4.6522 7.9231 129.6265 55.2352 32.6691 174.7109 139 D 4.4809 7.9335 125.7762 53.0081 39.9755 176.5258 140 Y 4.3294 8.4699 125.2356 60.5345 38.4279 177.6367 141 D 4.4984 8.2784 119.1585 57.2230 41.1898 177.7121 142 K 3.9880 7.9214 114.8703 56.2426 32.6336 176.3122 143 N 3.8963 7.3925 116.6961 53.4151 37.7156 171.7990 144 E 3.3359 5.9000 113.8518 54.3765 33.5094 175.3781 145 W 4.5195 7.8723 120.2291 56.2770 29.6810 176.7920 146 K 3.8997 8.6998 124.5879 56.5644 32.1997 177.3721 147 K 4.1451 8.5426 122.8336 56.7733 32.0641 176.8672 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 4 S 8.33 4.14 0.00 3.80 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 5 V 7.50 3.83 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 0.74 0.00 0.00 0.91 0.00 0.00 6 V 8.91 4.13 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 0.89 0.00 0.00 0.96 0.00 0.00 7 K 8.13 4.73 0.00 1.82 1.66 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.90 4.16 0.00 3.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.22 4.39 0.00 2.03 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 0.00 2.28 2.28 0.00 10 D 7.91 4.72 0.00 3.01 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 11 Y 7.31 4.18 0.00 3.10 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 12 A 7.16 4.28 1.02 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 0.00 0.00 13 L 7.17 4.67 0.00 1.77 1.57 0.87 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 14 P 0.00 4.32 0.00 2.06 2.02 0.00 3.61 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 15 S 8.34 4.84 0.00 3.98 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 16 Y 8.34 4.56 0.00 2.98 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 17 V 6.94 4.30 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 0.67 0.00 0.00 0.80 0.00 0.00 18 D 8.49 4.61 0.00 2.70 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 19 R 7.79 4.54 0.00 1.72 1.71 0.00 3.55 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 20 R 8.69 3.57 0.00 1.83 2.07 0.00 3.42 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.48 0.00 21 D 7.99 4.80 0.00 2.84 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 22 Y 7.77 4.73 0.00 3.00 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 23 P 0.00 4.47 0.00 2.29 2.43 0.00 3.72 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.04 0.00 24 L 6.73 4.71 0.00 1.50 1.67 0.95 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.67 0.00 2.14 1.70 0.00 3.89 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.05 0.00 26 D 8.78 4.58 0.00 2.74 2.80 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 27 V 7.44 4.54 2.13 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 0.79 0.00 0.00 1.12 0.00 0.00 28 A 8.28 4.27 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 H 8.66 3.73 0.00 2.60 3.37 0.00 5.89 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.73 4.20 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 0.83 0.00 0.00 0.75 0.00 0.00 31 K 8.61 4.23 0.00 1.87 1.88 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.41 7.81 32 N 7.93 4.73 0.00 2.70 2.77 0.00 0.00 6.73 7.85 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 33 L 8.17 4.71 0.00 1.58 1.53 0.90 0.91 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 34 S 8.30 4.45 0.00 4.04 4.01 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 0.00 0.00 0.00 35 A 8.43 3.98 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 36 S 7.99 4.09 0.00 4.06 4.14 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 37 Q 7.95 4.00 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.84 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 38 K 8.47 4.03 0.00 1.78 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.60 7.81 39 A 7.96 4.02 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 40 L 7.97 3.91 0.00 1.80 1.86 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.98 4.01 0.00 1.92 1.88 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.66 1.62 7.81 42 E 7.98 4.16 0.00 2.17 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 2.54 2.46 0.00 43 K 8.27 4.01 0.00 1.85 2.00 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.30 4.24 0.00 2.18 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.47 0.00 45 K 8.01 4.24 0.00 1.91 1.86 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.53 1.76 7.81 46 A 7.63 4.47 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 47 S 8.34 4.01 0.00 3.81 3.76 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 48 W 8.55 4.62 0.00 3.48 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 49 S 7.75 4.28 0.00 3.92 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 50 S 7.77 4.39 0.00 3.97 3.94 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 51 L 7.57 4.46 0.00 1.90 1.59 1.01 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 52 S 9.78 4.57 0.00 4.04 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 53 I 8.22 3.67 1.87 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 1.64 0.85 0.90 0.00 0.00 54 D 8.08 4.36 0.00 2.72 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 55 E 7.95 4.04 0.00 2.23 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 2.36 0.00 56 K 8.31 3.97 0.00 1.95 1.81 0.00 1.66 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.39 1.60 7.81 57 V 8.11 3.72 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 1.11 0.00 0.00 0.93 0.00 0.00 58 E 8.16 3.97 0.00 2.23 2.13 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 2.31 2.36 0.00 59 L 8.07 3.99 0.00 1.98 1.67 0.89 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.12 4.04 0.00 3.25 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 61 R 8.18 4.50 0.00 1.87 2.04 0.00 3.48 0.00 0.00 3.42 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.77 0.00 62 L 7.50 4.13 0.00 1.74 1.63 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.61 3.56 0.00 1.43 1.30 0.00 1.04 0.00 0.00 1.29 0.00 0.00 2.79 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 0.21 7.81 64 F 7.40 5.22 0.00 2.63 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 65 K 8.58 3.54 0.00 0.95 1.96 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.27 7.81 66 E 8.51 4.94 0.00 2.28 1.86 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 2.28 2.24 0.00 67 S 8.86 5.13 0.00 4.13 4.14 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 68 F 8.96 3.83 0.00 3.07 3.18 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 69 A 8.10 4.07 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 70 E 8.13 4.11 0.00 2.19 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 2.36 2.35 0.00 71 M 8.17 4.22 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.52 0.00 72 N 7.95 4.70 0.00 2.88 2.91 0.00 0.00 7.03 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 73 R 7.10 4.07 0.00 1.90 1.96 0.00 3.08 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.59 0.00 74 S 8.35 4.59 0.00 4.05 3.94 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 75 T 8.02 4.76 4.28 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 1.25 0.00 0.00 76 N 8.47 4.86 0.00 2.72 2.70 0.00 0.00 6.44 7.66 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 77 E 8.21 3.94 0.00 2.11 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 2.35 2.34 0.00 78 W 8.40 4.30 0.00 3.72 3.36 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 79 K 6.79 3.10 0.00 1.47 1.38 0.00 1.30 0.00 0.00 1.26 0.00 0.00 2.81 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.50 3.76 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 1.18 0.00 0.00 81 V 7.94 3.60 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 1.14 0.00 0.00 1.01 0.00 0.00 82 V 8.16 3.77 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 1.08 0.00 0.00 1.20 0.00 0.00 83 G 8.37 3.59 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 0.00 84 A 8.46 4.13 1.53 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 0.00 0.00 85 A 8.42 4.17 1.51 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 0.00 0.00 86 M 8.29 4.11 0.00 2.14 2.33 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 2.96 2.61 0.00 87 F 8.24 4.05 0.00 3.08 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 88 F 8.46 4.02 0.00 3.44 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 89 I 8.01 3.99 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.73 0.94 0.00 0.00 90 G 8.08 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 91 F 8.06 3.95 0.00 2.49 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 92 T 7.94 3.68 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 1.20 0.00 0.00 93 A 7.74 4.02 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 94 L 7.53 3.88 0.00 1.45 1.53 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.31 3.90 0.00 1.71 1.61 0.84 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.93 4.07 0.00 1.86 1.74 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 97 I 7.88 3.71 2.06 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 1.41 0.78 0.92 0.00 0.00 98 W 8.43 4.19 0.00 3.53 3.42 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 99 E 8.53 3.83 0.00 2.31 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 1.53 2.06 0.00 100 K 7.93 4.06 0.00 1.86 1.99 0.00 1.87 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.49 7.81 101 H 7.91 4.01 0.00 2.96 3.11 0.00 5.99 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 0.00 102 Y 7.45 4.16 0.00 1.57 2.37 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 0.00 103 V 7.38 3.98 1.78 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 0.64 0.00 0.00 0.81 0.00 0.00 104 Y 7.53 4.54 0.00 3.12 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 0.00 105 G 8.34 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 0.00 0.00 0.00 0.00 106 P 0.00 4.36 0.00 2.16 2.03 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 107 I 7.77 4.02 1.52 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.50 0.60 0.00 0.00 108 P 0.00 4.33 0.00 2.27 1.92 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.08 0.00 109 H 8.53 4.30 0.00 3.26 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.02 2.63 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 111 F 7.58 4.50 0.00 3.14 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 E 8.04 4.21 0.00 2.28 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 2.40 2.39 0.00 113 E 8.96 3.98 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 114 E 8.21 3.92 0.00 2.15 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 2.39 2.40 0.00 115 W 8.33 3.90 0.00 3.57 3.21 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 0.00 116 V 8.34 3.75 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 1.14 0.00 0.00 1.14 0.00 0.00 117 A 8.05 4.04 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 0.00 118 K 8.02 3.77 0.00 1.65 1.57 0.00 1.40 0.00 0.00 1.26 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.43 7.81 119 Q 8.32 3.86 0.00 2.16 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 120 T 8.28 4.01 4.49 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 1.48 0.00 0.00 121 K 7.74 3.60 0.00 1.70 1.85 0.00 1.50 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.37 7.81 122 R 8.20 3.82 0.00 1.79 1.99 0.00 3.06 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 1.58 1.62 0.00 123 M 8.35 4.06 0.00 1.96 2.32 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.46 0.00 124 L 7.93 4.11 0.00 1.57 1.28 -0.99 0.70 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 0.00 125 D 8.19 4.45 0.00 2.78 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 0.00 126 M 8.06 4.29 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.80 0.00 127 K 7.73 4.17 0.00 1.91 1.92 0.00 1.51 0.00 0.00 1.17 0.00 0.00 2.45 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.52 1.24 7.81 128 V 8.27 3.46 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 0.79 0.00 0.00 0.91 0.00 0.00 129 A 8.77 4.15 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 0.00 130 P 0.00 4.51 0.00 2.25 2.37 0.00 3.82 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 131 I 7.85 4.11 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.45 0.95 0.00 0.00 132 Q 8.06 4.64 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 133 G 8.43 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 8.37 4.87 0.00 3.05 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 S 9.23 4.25 0.00 4.22 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 0.00 136 A 8.22 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 0.00 137 K 8.46 4.47 0.00 2.14 1.96 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.45 7.81 138 W 7.92 4.65 0.00 2.81 2.59 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 0.00 139 D 7.93 4.48 0.00 2.37 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 Y 8.47 4.33 0.00 3.08 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.28 4.50 0.00 2.81 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 0.00 142 K 7.92 3.99 0.00 1.57 1.69 0.00 1.85 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.28 7.81 143 N 7.39 3.90 0.00 2.78 2.74 0.00 0.00 6.93 7.76 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 0.00 144 E 5.90 3.34 0.00 1.69 1.63 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 1.93 1.91 0.00 145 W 7.87 4.52 0.00 3.16 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 0.00 146 K 8.70 3.90 0.00 1.68 1.76 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.40 1.41 7.81 147 K 8.54 4.15 0.00 1.72 1.71 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.40 7.81