NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3331 8.3149 120.0043 56.2086 33.3064 175.4628 7 L 3.9817 8.4213 124.5988 53.0975 42.2336 174.8178 8 H 5.1188 8.7917 117.6892 53.9211 32.8308 172.3046 9 K 4.8350 8.6155 118.3077 55.5123 33.8167 175.9194 10 E 4.9034 9.0079 121.8278 53.8800 33.4286 173.9949 11 P 4.9661 0.0000 0.0000 63.0761 32.3317 175.1131 12 A 4.8607 8.2789 122.3502 51.4535 23.1225 175.6510 13 T 4.6103 8.5447 115.0994 61.3101 72.0698 173.9715 14 L 4.1871 8.7606 128.5384 55.9483 42.3214 175.7063 15 I 4.3576 8.2983 126.1385 62.1623 39.0351 176.0435 16 K 4.3928 7.5656 118.7861 55.6219 35.3168 173.6855 17 A 4.6983 8.7594 129.9282 51.5533 19.8406 176.9418 18 I 4.2971 8.3078 122.2623 62.4702 39.1263 174.9155 19 D 4.5858 7.5043 117.2789 52.9984 43.9792 175.6183 20 G 3.6574 8.7405 109.3880 47.8082 0.0000 174.0430 21 D 4.7904 8.0054 116.9714 53.2363 40.6876 175.5067 22 T 5.2125 7.6204 116.8632 62.1787 72.5481 173.3232 23 V 4.7818 8.7420 118.7515 59.3692 36.3238 174.4063 24 K 4.9132 9.6183 126.8026 55.6821 33.7183 175.5081 25 I 5.0596 8.9419 127.3234 59.7453 42.1368 174.2005 26 M 4.8463 9.4562 126.3237 55.0342 33.3070 174.2015 27 Y 4.8890 8.9541 128.2412 56.0397 41.7634 175.8267 28 K 3.7324 9.1100 127.7443 57.5300 29.7035 175.1293 29 G 3.9100 8.0991 100.8263 46.0757 0.0000 172.4290 30 Q 4.7092 7.9978 121.0362 52.9210 31.8983 172.9467 31 P 4.9362 0.0000 0.0000 63.5145 32.2155 175.2953 32 M 4.9070 9.0915 121.0299 54.7658 36.3856 173.2924 33 T 4.9353 8.5469 120.9981 62.6551 70.8577 173.5694 34 F 5.0472 9.2636 124.3395 55.6130 42.5314 173.9648 35 R 5.0066 8.9692 123.9799 54.4327 32.0839 175.1099 36 L 4.3693 8.7707 127.5705 54.2996 41.8817 177.2453 37 L 3.7547 8.4524 124.7934 56.5041 42.1535 178.2650 38 L 3.9690 8.8740 120.9672 54.9082 39.2942 173.9395 39 V 4.9578 7.2222 110.7421 59.5222 35.5555 174.9472 40 D 4.9033 9.0964 123.7068 52.8457 43.4277 175.4082 41 T 4.7108 8.3557 113.8823 59.3267 70.5691 173.1880 42 P 4.3834 0.0000 0.0000 62.8300 32.3464 175.5097 43 E 4.7123 9.9476 121.2861 54.9845 32.0407 177.0438 44 T 4.3613 8.2372 109.1707 62.0845 70.0203 175.5338 45 K 4.5601 7.4312 120.7790 55.6820 32.6244 175.8977 46 H 4.8877 8.1508 118.8770 55.3052 30.2289 174.1033 47 P 4.3249 0.0000 0.0000 65.2652 31.4948 177.4938 48 K 4.2763 8.3809 115.8658 58.0716 32.7942 177.5325 49 K 4.2054 7.4420 117.1910 55.9807 34.7550 176.7481 50 G 4.1309 8.3441 105.4508 44.6171 0.0000 175.1832 51 V 4.8611 8.4649 116.9838 60.4277 31.8813 173.3348 52 E 4.1508 8.7804 125.0711 54.9318 30.4511 176.3225 53 K 4.0346 8.1495 121.6178 58.0508 32.5258 176.4322 54 Y 4.1704 7.9570 122.6236 59.2909 35.8732 171.0074 55 G 3.7197 8.0755 107.6063 47.4517 0.0000 174.1329 56 P 4.2986 0.0000 0.0000 64.8744 31.2659 178.5793 57 E 3.9946 8.2066 116.6912 59.5409 29.5211 179.1317 58 A 3.9906 8.7456 121.1036 55.1181 18.3494 179.6703 59 S 4.0315 8.2890 111.5086 61.5882 62.5095 176.3248 60 A 4.0895 8.4184 123.7389 54.6832 17.9853 179.4000 61 F 3.9091 8.2612 119.4196 61.8659 39.5168 177.4139 62 T 3.9476 8.0788 115.2969 66.4952 68.2796 176.2023 63 K 3.8176 7.8647 120.9821 59.6525 32.2190 178.7395 64 K 3.8427 8.3749 118.7596 59.6587 31.7811 178.7262 65 M 3.8015 7.7580 117.0703 59.0534 32.2968 178.4597 66 V 3.7401 8.2161 112.7169 64.2248 31.4650 178.3483 67 E 3.9659 8.4667 118.8940 59.0119 29.5892 177.6776 68 N 4.6525 8.3338 113.6045 52.5027 39.0555 175.0199 69 A 4.6187 6.8887 124.0210 51.3150 19.8937 178.4694 70 K 4.1288 9.0175 120.7897 58.6917 32.5968 178.1465 71 K 4.6126 8.6628 118.5608 54.6294 35.5647 175.4810 72 I 4.9978 8.3959 125.6395 59.7870 39.7354 174.6240 73 E 5.1355 9.2113 124.3998 54.7878 34.1773 174.8651 74 V 4.8043 8.8404 115.2897 59.5368 35.4172 174.5463 75 E 4.9925 8.9752 124.0757 54.5425 32.2866 175.0779 76 F 4.7230 8.9800 125.7085 57.5407 40.2477 175.6381 77 D 4.9616 8.5018 120.8473 53.3176 43.2252 175.7461 78 K 4.3693 9.0686 117.0707 57.6457 33.8589 177.6935 79 G 4.1574 8.4700 112.1557 44.8311 0.0000 173.5764 80 Q 4.0756 8.6156 121.4867 56.6008 29.4310 176.3463 81 R 4.7377 8.4176 118.5879 56.3268 31.7812 175.6321 82 T 5.1243 7.6482 108.5101 59.8666 72.3582 173.5556 83 D 4.9138 8.8037 123.7334 51.9204 42.2323 176.8221 84 K 4.0507 8.6902 116.2551 58.8465 32.5835 176.8155 85 Y 4.2736 8.5646 117.1860 57.8498 38.1186 176.5582 86 G 3.9735 8.2222 109.3916 44.8423 0.0000 174.2401 87 R 4.2020 7.9844 119.8160 55.6201 31.4484 176.4498 88 G 3.1436 8.4865 111.6456 46.1350 0.0000 172.1648 89 L 5.2390 8.5630 123.5939 53.1780 43.3454 175.7233 90 A 4.1204 8.1634 124.3115 51.7203 23.7125 173.9145 91 Y 4.8827 8.4018 117.2719 56.9202 39.9265 175.3377 92 I 4.7541 8.6442 124.6837 59.7241 40.1682 174.0554 93 Y 5.0536 9.0984 124.2036 56.1259 40.7529 174.4729 94 A 4.8694 9.1075 126.8726 50.0764 21.0307 176.4708 95 D 4.5028 10.1751 125.5736 55.9949 39.0649 175.4690 96 G 4.0235 8.4923 106.0175 45.0492 0.0000 173.3582 97 K 4.5337 7.8741 119.9885 54.7755 33.8539 175.2348 98 M 4.0110 8.4565 123.1714 54.7873 32.9517 176.9474 99 V 3.6013 8.5390 127.7634 66.2961 31.1893 177.7273 100 N 4.3784 7.9645 115.7930 56.1087 38.4383 176.8879 101 E 3.9224 8.0476 120.1661 58.9955 29.9027 178.1782 102 A 4.0638 8.2646 121.1912 55.4284 18.3273 179.5835 103 L 3.5147 7.9143 117.2052 57.8692 41.8021 180.0412 104 V 3.8381 7.3764 118.4464 65.3927 31.2704 178.1246 105 R 3.9466 8.2656 117.9844 59.0714 30.0104 177.5984 106 Q 4.2956 7.7573 115.2611 55.2456 29.1846 176.1210 107 G 3.8450 7.8785 108.4551 46.6846 0.0000 174.6250 108 L 4.4252 7.7845 116.5314 53.7352 42.8000 176.0869 109 A 4.6532 7.4401 119.5839 50.9217 22.6912 175.7174 110 K 4.9894 8.4303 118.7358 54.2173 35.4768 176.1896 111 V 4.1773 9.0830 124.2538 62.9575 31.7809 175.9533 112 A 4.7979 8.6705 130.2680 51.0844 19.2830 176.8699 113 Y 4.2065 7.7417 117.4416 58.6130 38.4012 176.4866 114 V 4.0753 8.1034 123.8810 61.2928 33.5056 174.7747 115 Y 4.7352 8.0524 123.5906 55.9152 38.5618 175.6732 116 K 4.5615 8.5605 124.5123 56.0310 32.7857 175.2207 117 P 4.7842 0.0000 0.0000 63.1115 31.8934 176.9768 118 N 4.9312 7.9608 118.2428 52.5223 36.9863 175.0625 119 N 5.1850 7.6735 112.7327 52.9391 38.9629 177.6780 120 T 3.8673 8.9855 118.7094 67.6226 68.8111 175.1086 121 H 4.8952 7.8530 117.1340 55.7714 29.3004 176.7914 122 E 3.9835 8.3756 123.1301 59.4917 29.2867 178.4618 123 Q 3.9164 8.0619 118.9407 59.4619 29.3232 177.0658 124 H 4.0865 8.3842 118.8540 59.7924 29.6256 176.7892 125 L 3.9932 7.8415 119.7780 57.7195 41.4526 179.6788 126 R 3.9246 8.1705 118.1829 59.0418 29.6424 179.2592 127 K 3.9874 8.2322 118.7640 59.5344 32.0510 179.5649 128 S 4.1357 7.9231 115.2640 61.1259 62.6839 176.3255 129 E 3.9784 8.4078 122.4923 59.0833 29.3851 178.6099 130 A 3.7480 7.9037 120.9551 54.9791 18.3922 179.4877 131 Q 3.7755 7.7664 117.6012 59.3466 29.2307 178.2815 132 A 4.2012 7.9905 121.7407 54.8546 18.3415 179.8182 133 K 3.1982 7.7301 117.1786 59.3508 31.8578 179.2606 134 K 3.8535 7.9815 118.8505 59.4804 32.1118 177.6165 135 E 4.2354 8.4957 115.9349 55.1478 31.0629 176.2675 136 K 4.1226 8.1943 118.5432 56.1176 30.3449 174.5614 137 L 4.6714 8.2499 118.3569 54.4281 45.4229 177.3899 138 N 3.7149 8.8529 120.4639 53.9100 37.7005 176.1387 139 I 3.0161 5.4200 125.4876 64.7318 37.2774 176.4063 140 W 4.9499 7.8638 117.9810 56.4251 29.2485 176.6319 141 S 4.7691 7.9432 118.9775 57.9272 62.6395 173.9498 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 6 K 8.31 4.33 0.00 1.93 1.96 0.00 1.57 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.53 7.81 7 L 8.42 3.98 0.00 1.80 1.72 1.07 0.84 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 8 H 8.79 5.12 0.00 3.13 3.27 0.00 5.51 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.62 4.84 0.00 1.58 1.71 0.00 1.43 0.00 0.00 1.33 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 1.29 7.81 10 E 9.01 4.90 0.00 2.14 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 2.38 2.46 0.00 11 P 0.00 4.97 0.00 1.95 1.99 0.00 3.72 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 2.03 2.10 0.00 12 A 8.28 4.86 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 13 T 8.54 4.61 4.26 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 0.00 0.00 1.22 0.00 0.00 14 L 8.76 4.19 0.00 1.62 1.57 0.98 1.07 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 15 I 8.30 4.36 2.03 0.00 0.00 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 1.14 0.86 0.94 0.00 0.00 16 K 7.57 4.39 0.00 1.79 1.59 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.35 1.38 7.81 17 A 8.76 4.70 1.25 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 18 I 8.31 4.30 2.03 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.72 0.90 0.00 0.00 19 D 7.50 4.59 0.00 2.61 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 20 G 8.74 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.01 4.79 0.00 2.87 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.62 5.21 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 1.26 0.00 0.00 23 V 8.74 4.78 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 0.72 0.00 0.00 0.92 0.00 0.00 24 K 9.62 4.91 0.00 1.90 1.71 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.54 7.81 25 I 8.94 5.06 1.82 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.74 0.89 0.00 0.00 26 M 9.46 4.85 0.00 2.14 2.00 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 2.60 2.55 0.00 27 Y 8.95 4.89 0.00 3.21 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 28 K 9.11 3.73 0.00 1.45 1.59 0.00 1.57 0.00 0.00 1.28 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.06 0.50 7.81 29 G 8.10 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 30 Q 8.00 4.71 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.93 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 31 P 0.00 4.94 0.00 2.17 2.09 0.00 3.87 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 2.03 2.00 0.00 32 M 9.09 4.91 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.48 0.00 33 T 8.55 4.94 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 1.23 0.00 0.00 34 F 9.26 5.05 0.00 3.05 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 35 R 8.97 5.01 0.00 1.86 1.76 0.00 3.29 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 36 L 8.77 4.37 0.00 1.54 1.60 0.96 0.84 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 37 L 8.45 3.75 0.00 1.16 1.13 0.27 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.87 3.97 0.00 2.04 1.92 1.13 1.02 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 39 V 7.22 4.96 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 0.75 0.00 0.00 0.91 0.00 0.00 40 D 9.10 4.90 0.00 2.39 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 0.00 0.00 0.00 0.00 41 T 8.36 4.71 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 1.17 0.00 0.00 42 P 0.00 4.38 0.00 2.23 2.09 0.00 3.52 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 2.14 2.04 0.00 43 E 9.95 4.71 0.00 2.29 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 2.33 0.00 44 T 8.24 4.36 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 1.22 0.00 0.00 45 K 7.43 4.56 0.00 1.90 1.79 0.00 1.59 0.00 0.00 1.62 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.36 7.81 46 H 8.15 4.89 0.00 3.33 3.35 0.00 5.64 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.32 0.00 2.06 2.07 0.00 3.40 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.01 0.00 48 K 8.38 4.28 0.00 1.90 1.86 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.44 7.81 49 K 7.44 4.21 0.00 1.45 1.66 0.00 1.59 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.42 7.81 50 G 8.34 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 0.00 0.00 0.00 0.00 51 V 8.46 4.86 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 0.85 0.00 0.00 0.97 0.00 0.00 52 E 8.78 4.15 0.00 2.06 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 0.00 2.26 2.22 0.00 53 K 8.15 4.03 0.00 1.57 1.67 0.00 1.44 0.00 0.00 1.41 0.00 0.00 2.34 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.28 0.83 7.81 54 Y 7.96 4.17 0.00 3.15 3.12 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 0.00 0.00 0.00 55 G 8.08 3.72 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 0.00 0.00 0.00 56 P 0.00 4.30 0.00 2.15 2.10 0.00 3.56 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 2.07 2.15 0.00 57 E 8.21 3.99 0.00 2.38 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 0.00 2.55 2.51 0.00 58 A 8.75 3.99 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 59 S 8.29 4.03 0.00 4.11 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 60 A 8.42 4.09 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 61 F 8.26 3.91 0.00 3.23 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 62 T 8.08 3.95 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 1.28 0.00 0.00 63 K 7.86 3.82 0.00 1.91 2.01 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.59 7.81 64 K 8.37 3.84 0.00 1.82 1.71 0.00 1.86 0.00 0.00 1.49 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.41 7.81 65 M 7.76 3.80 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 66 V 8.22 3.74 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 0.73 0.00 0.00 1.05 0.00 0.00 67 E 8.47 3.97 0.00 2.16 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 2.31 2.34 0.00 68 N 8.33 4.65 0.00 2.69 2.79 0.00 0.00 7.02 7.37 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 69 A 6.89 4.62 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 70 K 9.02 4.13 0.00 1.94 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.40 7.81 71 K 8.66 4.61 0.00 1.82 1.67 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.40 5.00 1.86 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 1.34 1.51 0.86 0.00 0.00 73 E 9.21 5.14 0.00 1.91 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 2.22 2.28 0.00 74 V 8.84 4.80 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 0.11 0.00 0.00 0.58 0.00 0.00 75 E 8.98 4.99 0.00 2.15 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 2.60 2.44 0.00 76 F 8.98 4.72 0.00 3.03 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 77 D 8.50 4.96 0.00 2.68 2.97 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 78 K 9.07 4.37 0.00 1.90 1.95 0.00 1.71 0.00 0.00 1.93 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.56 7.81 79 G 8.47 4.16 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 0.00 80 Q 8.62 4.08 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 81 R 8.42 4.74 0.00 1.41 1.35 0.00 2.75 0.00 0.00 2.54 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.57 0.00 82 T 7.65 5.12 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 1.12 0.00 0.00 83 D 8.80 4.91 0.00 2.82 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 84 K 8.69 4.05 0.00 1.60 1.80 0.00 1.29 0.00 0.00 1.56 0.00 0.00 3.02 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.14 0.47 7.81 85 Y 8.56 4.27 0.00 3.09 3.01 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 86 G 8.22 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 0.00 0.00 0.00 87 R 7.98 4.20 0.00 2.18 1.81 0.00 3.11 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 88 G 8.49 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 0.00 0.00 0.00 89 L 8.56 5.24 0.00 1.53 1.59 1.01 0.84 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 90 A 8.16 4.12 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 91 Y 8.40 4.88 0.00 3.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.64 4.75 1.79 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.94 0.83 0.00 0.00 93 Y 9.10 5.05 0.00 2.91 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 9.11 4.87 1.22 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 0.00 0.00 95 D 10.18 4.50 0.00 2.73 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 96 G 8.49 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 0.00 0.00 0.00 97 K 7.87 4.53 0.00 1.97 1.76 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.39 7.81 98 M 8.46 4.01 0.00 1.90 1.59 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.38 0.00 99 V 8.54 3.60 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 1.02 0.00 0.00 0.91 0.00 0.00 100 N 7.96 4.38 0.00 2.91 2.89 0.00 0.00 6.80 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 0.00 101 E 8.05 3.92 0.00 1.94 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 2.27 2.13 0.00 102 A 8.26 4.06 1.60 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 0.00 103 L 7.91 3.51 0.00 1.83 1.61 0.95 0.75 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 0.00 104 V 7.38 3.84 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 1.20 0.00 0.00 0.98 0.00 0.00 105 R 8.27 3.95 0.00 1.91 2.06 0.00 3.34 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.76 4.30 0.00 1.64 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.25 0.00 0.00 0.00 0.00 0.00 2.42 2.13 0.00 107 G 7.88 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 0.00 108 L 7.78 4.43 0.00 1.25 1.46 0.54 0.71 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 0.00 109 A 7.44 4.65 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 0.00 0.00 0.00 0.00 0.00 110 K 8.43 4.99 0.00 1.66 1.73 0.00 1.44 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.64 1.30 7.81 111 V 9.08 4.18 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 0.97 0.00 0.00 112 A 8.67 4.80 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 0.00 113 Y 7.74 4.21 0.00 2.78 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.10 4.08 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 0.84 0.00 0.00 1.01 0.00 0.00 115 Y 8.05 4.74 0.00 3.10 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 0.00 116 K 8.56 4.56 0.00 1.80 1.79 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.62 1.48 7.81 117 P 0.00 4.78 0.00 2.21 2.15 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 118 N 7.96 4.93 0.00 2.99 2.88 0.00 0.00 6.62 7.52 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 0.00 119 N 7.67 5.19 0.00 2.86 3.00 0.00 0.00 6.11 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 0.00 120 T 8.99 3.87 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 1.16 0.00 0.00 121 H 7.85 4.90 0.00 2.94 3.15 0.00 5.62 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 0.00 122 E 8.38 3.98 0.00 2.21 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 0.00 123 Q 8.06 3.92 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.56 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 124 H 8.38 4.09 0.00 3.25 3.51 0.00 5.92 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 0.00 125 L 7.84 3.99 0.00 1.94 1.71 1.04 0.92 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 0.00 126 R 8.17 3.92 0.00 2.11 1.97 0.00 3.14 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 127 K 8.23 3.99 0.00 2.02 1.83 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.58 7.81 128 S 7.92 4.14 0.00 3.94 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 0.00 129 E 8.41 3.98 0.00 2.17 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 0.00 2.27 2.59 0.00 130 A 7.90 3.75 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 0.00 131 Q 7.77 3.78 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 132 A 7.99 4.20 1.54 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 0.00 0.00 133 K 7.73 3.20 0.00 1.50 1.24 0.00 0.89 0.00 0.00 0.61 0.00 0.00 2.52 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.30 0.51 7.81 134 K 7.98 3.85 0.00 1.59 1.97 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.50 7.81 135 E 8.50 4.24 0.00 1.93 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 2.31 2.53 0.00 136 K 8.19 4.12 0.00 1.91 1.87 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.36 7.81 137 L 8.25 4.67 0.00 1.77 1.55 1.03 0.58 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 0.00 138 N 8.85 3.71 0.00 2.56 1.42 0.00 0.00 7.10 7.49 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 0.00 139 I 5.42 3.02 1.06 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 -0.22 -1.10 0.00 0.00 140 W 7.86 4.95 0.00 3.49 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 0.00 141 S 7.94 4.77 0.00 4.04 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