NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1418 8.2644 123.5686 52.0275 19.4461 176.0961 2 E 3.8546 8.7390 118.5180 56.7037 29.5634 176.2936 3 C 4.5308 8.7515 125.3725 57.1497 39.0741 172.2700 4 S 4.4530 7.3897 110.5663 56.9014 65.5501 173.9630 5 V 4.3195 8.0985 121.8020 60.1618 34.4240 173.7297 6 D 5.1672 8.6116 124.7819 52.9217 42.3587 175.6675 7 I 4.7771 9.4739 123.3713 59.2837 41.9978 173.6094 8 Q 5.0304 10.6524 127.8892 54.2523 31.2766 174.6790 9 G 5.0315 9.2428 111.6918 44.5441 0.0000 170.9044 10 N 5.6263 8.4411 125.9842 51.9512 39.1297 175.2923 11 D 4.5030 9.0062 115.0551 57.4547 41.0956 176.9848 12 Q 4.4698 8.7545 116.7576 55.7295 29.2694 174.9539 13 M 3.0485 7.6110 112.9397 56.6563 30.8275 175.6736 14 Q 4.4920 7.6328 113.9272 54.2587 32.8144 173.5506 15 F 6.3000 8.6282 116.2076 55.1913 41.3371 176.3546 16 N 4.7618 9.0645 120.3506 53.2407 36.7919 174.3086 17 T 4.5957 7.6869 110.5276 61.9875 70.4510 172.7372 18 N 5.2250 8.9934 121.3019 52.4250 38.9025 174.1416 19 A 5.1387 8.2448 120.4950 50.8025 22.2763 175.4434 20 I 4.5051 9.0823 123.5083 59.7888 40.1399 174.9733 21 T 4.8894 8.4392 122.0776 61.8504 71.1416 173.2861 22 V 3.9092 8.0513 126.8104 60.6643 33.6710 174.6234 23 D 4.6464 8.5697 127.7037 54.0764 41.5802 176.8085 24 K 4.2460 8.5954 125.4966 58.3395 32.5627 178.4250 25 S 4.1409 9.6903 116.5273 61.4218 62.8154 173.2252 26 C 4.1428 7.6959 118.5166 57.4184 40.1172 173.9099 27 K 4.0644 8.6718 125.4542 58.6865 32.8422 177.3161 28 Q 4.9166 7.8897 116.6410 53.8533 32.7769 174.6529 29 F 4.7286 8.2889 123.9967 56.5748 42.6633 173.5852 30 T 4.7625 7.4972 122.0205 61.6677 71.5839 173.5456 31 V 4.1364 9.2614 125.7824 61.1641 33.5750 173.9732 32 N 5.2776 9.0156 127.3548 51.1004 40.1524 174.0406 33 L 5.0909 9.2272 127.0406 53.1811 45.0090 175.2552 34 S 4.9409 9.1415 119.5015 56.9794 67.0566 172.5115 35 H 5.8710 8.9848 122.1020 53.2566 30.4482 171.8349 36 P 4.5672 0.0000 0.0000 62.1539 33.2486 176.6135 37 G 3.9528 8.4697 108.9690 45.2796 0.0000 172.2630 38 N 4.9397 8.9154 115.4994 51.4452 41.0028 172.8424 39 L 4.4078 8.3143 115.7463 52.3693 42.6853 172.3134 40 P 4.7433 0.0000 0.0000 61.7863 32.0797 177.4743 41 K 4.1640 8.5058 118.3641 59.3551 32.6427 178.5143 42 N 4.5688 8.1260 115.8731 54.1151 37.9600 175.6960 43 V 4.1498 7.5033 117.3450 64.3801 33.6846 175.8980 44 M 4.7661 8.0934 117.5323 54.2991 33.1557 174.5693 45 G 4.0730 7.7441 107.0266 46.1666 0.0000 172.7758 46 H 5.5795 8.9912 120.1104 54.0028 33.0012 172.4104 47 N 5.4934 8.8384 117.0472 51.4761 41.2278 172.6986 48 W 5.0550 9.3802 128.0860 55.7397 33.8008 174.2243 49 V 4.2940 8.2900 127.1345 60.7777 34.1106 173.7805 50 L 4.5813 7.3580 129.9310 53.3300 44.5329 175.2612 51 S 4.8100 7.9867 117.9936 58.1279 67.1719 175.9795 52 T 5.1714 8.4843 108.8393 61.1180 68.9920 174.9000 53 A 3.9825 8.7086 124.8805 55.3217 18.3156 179.6070 54 A 4.0745 7.9543 117.8723 55.4359 18.9862 178.8047 55 D 4.6140 8.3491 115.1460 54.7241 40.9977 178.0583 56 M 3.9701 7.7659 119.6438 58.8260 31.8911 177.8361 57 Q 3.9507 7.8593 117.1904 57.9830 29.6077 177.6644 58 G 3.7311 7.8363 104.8544 46.3305 0.0000 175.5827 59 V 3.7507 7.7048 120.6419 65.6437 31.5061 178.0718 60 V 3.8819 7.2482 117.9604 66.0549 31.2145 178.2163 61 T 4.0232 8.1338 115.5029 66.3869 68.5277 175.9866 62 D 4.4318 8.0680 118.9005 55.5091 41.4903 177.6713 63 G 4.4098 7.7746 105.0975 44.9305 0.0000 175.9175 64 M 4.6887 8.4491 118.7725 56.5840 31.1028 177.0528 65 A 4.8355 7.3828 121.1091 52.1939 20.8293 177.2576 66 S 4.3877 8.5421 117.5542 58.2671 65.5033 175.6191 67 G 3.7469 7.9294 107.7926 44.4915 0.0000 173.9642 68 L 3.3718 7.7699 119.7754 58.2445 41.5111 178.8810 69 D 4.5224 7.7963 116.7139 55.7111 39.6371 177.1789 70 K 4.1945 7.8189 119.6317 55.4817 31.9352 176.2097 71 D 4.1885 8.3370 116.1701 56.2850 39.0473 172.9662 72 Y 3.8616 7.5024 112.6158 59.1862 35.7699 170.6931 73 L 4.9219 7.5197 116.5698 52.4961 45.6455 176.7208 74 K 4.1302 8.5159 123.1294 55.0897 32.5518 174.4150 75 P 4.2943 0.0000 0.0000 64.5725 31.5385 176.0908 76 D 4.3679 8.5520 120.3333 54.4674 39.0527 172.7510 77 D 4.3369 7.9850 119.8001 54.0500 40.7775 177.7727 78 S 4.2900 8.6606 122.3163 61.0821 63.5371 175.8772 79 R 4.0248 8.3206 120.2218 58.8287 29.9767 177.6559 80 V 3.8684 7.3145 116.7642 62.9504 32.0240 175.5563 81 I 4.1937 8.0733 127.2945 63.3833 38.2354 175.7110 82 A 4.7088 7.3020 120.7956 51.5554 22.5358 174.9940 83 H 5.3545 8.2778 112.2083 54.9865 31.0795 174.5376 84 T 4.4238 9.0219 113.5047 61.3657 70.2888 173.8813 85 K 4.4183 9.4448 122.1565 55.5217 33.1746 176.2414 86 L 4.6355 10.0362 124.2647 55.0153 42.5405 176.0282 87 I 4.7961 8.8438 119.7927 59.0848 40.2414 175.7153 88 G 4.2812 9.1007 113.5071 44.9371 0.0000 172.7779 89 S 3.6769 8.3503 115.5386 60.1065 62.8429 174.0010 90 G 4.1287 9.5851 116.0479 45.7535 0.0000 173.5433 91 E 4.0833 7.4726 119.2094 55.3911 31.1067 175.9013 92 K 5.0032 8.4544 121.4939 54.9540 35.9901 174.7928 93 D 4.8828 9.4193 124.2318 52.7520 45.2121 174.1030 94 S 5.4081 8.7319 120.5568 56.7352 66.2576 173.2865 95 V 4.7936 8.7194 122.0087 60.3452 35.0235 174.2222 96 T 4.9260 8.5951 118.5148 61.8071 71.4947 173.3633 97 F 5.0101 8.6449 119.8389 54.6383 42.1661 172.8312 98 D 4.2922 9.0687 120.6203 54.8449 41.4257 177.1425 99 V 3.7600 8.9786 128.1164 65.5289 31.8827 178.1010 100 S 4.1261 8.4417 113.6945 61.5460 62.4623 175.5252 101 K 4.3485 8.1939 116.9266 56.7488 31.5885 177.8118 102 L 4.5568 7.6041 119.8370 52.4414 40.6966 176.2359 103 K 3.9884 8.5248 120.0987 56.0946 33.0769 176.5896 104 E 3.9257 8.8821 123.5253 58.3209 29.2926 175.6048 105 G 4.3079 8.7196 121.4875 46.1003 0.0000 173.9695 106 E 4.0306 7.6210 119.5249 55.6294 30.4647 176.2957 107 Q 4.3956 7.8938 118.4152 54.5137 31.2867 174.5598 108 Y 5.4466 8.1844 119.3219 56.5335 42.4156 174.1976 109 M 5.4286 9.6176 122.2319 53.6530 35.8463 174.6254 110 F 5.0195 9.3667 119.2489 55.2878 41.0386 174.4000 111 F 6.0021 7.7356 114.2971 57.6810 41.6201 171.7165 112 C 5.5122 9.0542 119.9588 58.2016 32.6010 173.3929 113 T 4.5155 9.2281 115.4153 60.9251 69.7496 173.3072 114 P 3.3167 0.0000 0.0000 61.5698 31.7665 173.1523 115 P 4.1637 0.0000 0.0000 65.1592 31.4022 176.8709 116 G 3.9688 8.8725 112.0740 45.5177 0.0000 174.1809 117 H 4.2700 8.3727 118.0300 58.5319 28.8748 177.9099 118 S 4.2373 8.0385 112.5467 60.6368 63.0752 175.0972 119 A 4.0674 7.4261 122.9187 54.7068 18.0643 178.2020 120 L 4.4612 7.7214 112.4459 55.0512 44.1820 176.9903 121 Q 4.5637 7.8949 119.2014 54.3916 27.0064 174.3645 122 K 5.0180 7.5479 117.8207 54.9467 36.8161 177.2366 123 G 3.5337 7.5973 107.0030 46.1062 0.0000 172.1040 124 T 5.0057 7.8972 110.6537 60.1036 71.2387 173.1434 125 L 5.3819 9.3795 126.8727 53.8240 44.8295 175.9286 126 T 4.4480 8.9848 122.6605 61.3276 71.0187 172.3398 127 L 4.5859 8.8185 130.0727 54.9481 40.0293 176.8238 128 K 4.3032 8.8917 122.4779 56.3638 32.2610 176.4481 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 A 8.26 4.14 1.17 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 0.00 0.00 2 E 8.74 3.85 0.00 1.99 1.84 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 2.22 2.36 0.00 3 C 8.75 4.53 0.00 3.04 3.27 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 4 S 7.39 4.45 0.00 3.47 3.44 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 5 V 8.10 4.32 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 0.59 0.00 0.00 0.84 0.00 0.00 6 D 8.61 5.17 0.00 2.50 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 9.47 4.78 1.55 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.61 0.66 0.00 0.00 8 Q 10.65 5.03 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.51 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 9 G 9.24 5.03 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 0.00 0.00 0.00 10 N 8.44 5.63 0.00 2.97 2.92 0.00 0.00 6.24 8.07 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 11 D 9.01 4.50 0.00 2.70 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 12 Q 8.75 4.47 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 13 M 7.61 3.05 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.25 0.00 14 Q 7.63 4.49 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.78 6.63 0.00 0.00 0.00 0.00 0.00 2.36 2.64 0.00 15 F 8.63 6.30 0.00 3.14 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 16 N 9.06 4.76 0.00 2.88 2.98 0.00 0.00 5.94 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 17 T 7.69 4.60 4.29 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 1.18 0.00 0.00 18 N 8.99 5.23 0.00 2.93 2.99 0.00 0.00 5.78 7.26 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 19 A 8.24 5.14 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 20 I 9.08 4.51 1.91 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 0.95 0.15 0.82 0.00 0.00 21 T 8.44 4.89 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 1.21 0.00 0.00 22 V 8.05 3.91 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 0.80 0.00 0.00 0.12 0.00 0.00 23 D 8.57 4.65 0.00 2.74 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.60 4.25 0.00 1.80 1.86 0.00 1.97 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.48 7.81 25 S 9.69 4.14 0.00 3.77 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 26 C 7.70 4.14 0.00 3.19 3.32 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 27 K 8.67 4.06 0.00 1.74 1.84 0.00 1.49 0.00 0.00 1.92 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.52 1.53 7.81 28 Q 7.89 4.92 0.00 1.78 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.68 0.00 0.00 0.00 0.00 0.00 2.19 2.47 0.00 29 F 8.29 4.73 0.00 2.70 1.66 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 30 T 7.50 4.76 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 1.03 0.00 0.00 31 V 9.26 4.14 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 0.13 0.00 0.00 -0.25 0.00 0.00 32 N 9.02 5.28 0.00 2.51 2.63 0.00 0.00 6.30 6.75 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 33 L 9.23 5.09 0.00 1.64 1.65 1.06 1.06 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 34 S 9.14 4.94 0.00 3.90 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 H 8.98 5.87 0.00 3.26 3.40 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.57 0.00 2.17 2.12 0.00 4.34 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.18 0.00 37 G 8.47 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 38 N 8.92 4.94 0.00 2.89 2.73 0.00 0.00 7.09 7.73 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 39 L 8.31 4.41 0.00 1.82 1.81 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.74 0.00 2.56 1.99 0.00 3.60 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 2.17 2.07 0.00 41 K 8.51 4.16 0.00 2.01 2.18 0.00 1.52 0.00 0.00 1.90 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.50 7.81 42 N 8.13 4.57 0.00 2.89 3.02 0.00 0.00 5.85 7.68 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 43 V 7.50 4.15 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 0.83 0.00 0.00 0.95 0.00 0.00 44 M 8.09 4.77 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.61 0.00 45 G 7.74 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 46 H 8.99 5.58 0.00 3.10 3.34 0.00 5.57 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.84 5.49 0.00 2.79 3.05 0.00 0.00 5.77 8.88 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 48 W 9.38 5.06 0.00 3.32 3.07 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 49 V 8.29 4.29 1.05 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 0.63 0.00 0.00 0.85 0.00 0.00 50 L 7.36 4.58 0.00 0.60 0.83 0.86 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 51 S 7.99 4.81 0.00 3.99 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 52 T 8.48 5.17 4.27 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 1.50 0.00 0.00 53 A 8.71 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 54 A 7.95 4.07 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 55 D 8.35 4.61 0.00 2.72 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 56 M 7.77 3.97 0.00 2.25 1.95 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.29 0.00 57 Q 7.86 3.95 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 58 G 7.84 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 59 V 7.70 3.75 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 1.19 0.00 0.00 1.11 0.00 0.00 60 V 7.25 3.88 2.12 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 0.98 0.00 0.00 0.84 0.00 0.00 61 T 8.13 4.02 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 1.20 0.00 0.00 62 D 8.07 4.43 0.00 2.98 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 63 G 7.77 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 0.00 0.00 0.00 0.00 64 M 8.45 4.69 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.76 0.00 65 A 7.38 4.84 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 66 S 8.54 4.39 0.00 3.75 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 7.93 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 68 L 7.77 3.37 0.00 1.68 1.57 0.99 1.11 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 69 D 7.80 4.52 0.00 2.81 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 70 K 7.82 4.19 0.00 2.05 1.79 0.00 1.64 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.65 7.81 71 D 8.34 4.19 0.00 2.81 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 7.50 3.86 0.00 3.15 2.95 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 73 L 7.52 4.92 0.00 1.57 1.46 0.68 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.52 4.13 0.00 1.95 1.70 0.00 1.76 0.00 0.00 2.06 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.46 7.81 75 P 0.00 4.29 0.00 2.07 2.02 0.00 3.85 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 76 D 8.55 4.37 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 77 D 7.98 4.34 0.00 2.89 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.66 4.29 0.00 4.03 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 79 R 8.32 4.02 0.00 2.13 2.08 0.00 3.18 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 80 V 7.31 3.87 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 0.77 0.00 0.00 0.91 0.00 0.00 81 I 8.07 4.19 1.56 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 1.04 0.61 0.74 0.00 0.00 82 A 7.30 4.71 1.10 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 83 H 8.28 5.35 0.00 3.08 3.18 0.00 5.73 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 9.02 4.42 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 1.34 0.00 0.00 85 K 9.44 4.42 0.00 1.88 1.85 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.83 7.81 86 L 10.04 4.64 0.00 1.68 1.65 1.09 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.84 4.80 1.97 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.06 0.95 0.00 0.00 88 G 9.10 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 0.00 0.00 0.00 0.00 89 S 8.35 3.68 0.00 4.07 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 90 G 9.59 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 91 E 7.47 4.08 0.00 2.21 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 2.36 2.33 0.00 92 K 8.45 5.00 0.00 1.72 1.62 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.30 1.53 7.81 93 D 9.42 4.88 0.00 2.79 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 94 S 8.73 5.41 0.00 3.72 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 95 V 8.72 4.79 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 0.98 0.00 0.00 1.00 0.00 0.00 96 T 8.60 4.93 4.21 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 1.10 0.00 0.00 97 F 8.64 5.01 0.00 3.02 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 98 D 9.07 4.29 0.00 2.81 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 99 V 8.98 3.76 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 1.03 0.00 0.00 0.90 0.00 0.00 100 S 8.44 4.13 0.00 4.04 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 0.00 101 K 8.19 4.35 0.00 1.79 1.88 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.70 7.81 102 L 7.60 4.56 0.00 1.84 1.71 1.01 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.52 3.99 0.00 1.96 1.84 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.51 1.45 7.81 104 E 8.88 3.93 0.00 1.93 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 2.32 2.42 0.00 105 G 8.72 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 0.00 0.00 0.00 0.00 106 E 7.62 4.03 0.00 1.77 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 2.25 2.24 0.00 107 Q 7.89 4.40 0.00 1.84 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.84 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 108 Y 8.18 5.45 0.00 3.11 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 0.00 109 M 9.62 5.43 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 110 F 9.37 5.02 0.00 2.25 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 0.00 111 F 7.74 6.00 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 0.00 112 C 9.05 5.51 0.00 3.34 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 T 9.23 4.52 4.37 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 1.41 0.00 0.00 114 P 0.00 3.32 0.00 1.29 1.36 0.00 3.60 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.04 0.00 115 P 0.00 4.16 0.00 1.89 1.97 0.00 2.83 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.93 0.00 116 G 8.87 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 0.00 117 H 8.37 4.27 0.00 3.33 3.28 0.00 5.65 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 0.00 118 S 8.04 4.24 0.00 3.82 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 0.00 119 A 7.43 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 0.00 120 L 7.72 4.46 0.00 1.54 1.71 0.88 0.80 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 0.00 121 Q 7.89 4.56 0.00 1.80 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.65 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 122 K 7.55 5.02 0.00 1.59 1.91 0.00 1.56 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.20 1.30 7.81 123 G 7.60 3.53 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 0.00 124 T 7.90 5.01 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 1.23 0.00 0.00 125 L 9.38 5.38 0.00 1.97 1.82 1.24 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 126 T 8.98 4.45 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 1.24 0.00 0.00 127 L 8.82 4.59 0.00 1.83 1.71 1.04 0.64 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 0.00 128 K 8.89 4.30 0.00 1.73 1.85 0.00 1.58 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.39 7.81