NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.7161 8.2493 122.4704 52.1796 19.9904 175.8438 2 T 4.6352 8.9275 111.8299 59.3885 72.4783 171.3576 3 K 5.3273 8.9240 123.0232 54.9997 37.2116 176.1518 4 A 5.3192 9.0876 123.8190 50.8654 23.4572 175.1629 5 V 4.9703 8.7876 117.3813 60.9078 35.5271 173.3674 6 C 4.9331 9.1509 122.2778 58.1303 35.3478 172.6834 7 V 4.5268 8.4763 126.3863 61.7131 32.7748 174.3428 8 L 4.6211 8.7463 129.6644 54.0415 42.8816 176.3358 9 K 4.8989 9.0314 122.4397 55.4074 36.9702 176.2950 10 G 4.2845 8.0207 108.7590 45.9570 0.0000 172.4029 11 D 4.6686 8.8062 118.7280 54.8916 42.2198 177.0202 12 G 4.3246 7.5325 109.3752 44.3561 0.0000 171.9063 13 P 4.3350 0.0000 0.0000 64.3770 31.9983 176.0466 14 V 4.2183 7.5869 120.4360 62.5041 32.0353 175.0626 15 Q 4.8444 8.9048 125.2125 55.2297 32.4563 173.8040 16 G 4.4894 8.7664 107.1603 45.8387 0.0000 171.6902 17 I 5.1208 8.4107 119.5359 59.4332 40.9505 175.0412 18 I 4.6299 8.6613 127.2838 59.4950 40.4718 174.4174 19 N 4.9306 8.1758 124.3919 51.4350 41.2280 173.9754 20 F 5.3290 8.7590 119.5588 55.7651 43.2791 173.7216 21 E 5.2163 9.6353 123.1124 54.6945 33.3719 173.7454 22 Q 4.8548 9.3339 127.8048 54.2635 31.1739 175.9340 23 K 4.0793 8.9929 127.2701 58.9291 32.7551 177.6586 24 E 4.7942 7.7989 116.7148 54.1669 33.4350 176.3644 25 S 4.3250 8.9041 117.1913 60.8130 63.0765 174.7872 26 N 4.7709 8.2130 116.0890 52.2121 37.2487 174.2763 27 G 4.0920 7.9908 108.6961 43.1327 0.0000 171.7189 28 P 4.6826 0.0000 0.0000 62.7835 32.5224 175.7545 29 V 4.6690 8.8799 120.9607 61.2102 33.9182 174.5604 30 K 4.9423 9.2437 128.1235 55.7222 33.9985 175.9736 31 V 4.8224 9.1971 124.5425 60.8195 34.4239 174.2159 32 W 5.5621 8.3728 124.0527 54.7673 31.9450 175.5822 33 G 3.8587 7.3738 106.3742 46.0196 0.0000 170.9239 34 S 5.1075 7.7236 113.3500 56.7578 66.6709 174.2191 35 I 5.1403 8.8313 125.7223 59.3520 40.8703 174.7163 36 K 4.8253 9.2474 125.6571 55.7644 35.8277 177.1377 37 G 3.9178 8.8780 107.6025 46.5637 0.0000 173.2963 38 L 4.3589 7.7650 120.4786 53.1785 42.7293 176.7854 39 T 4.2203 8.2651 112.7971 61.1702 69.3526 173.6531 40 E 4.0555 8.5935 124.1976 57.1318 30.4418 175.1445 41 G 3.7887 8.3616 111.5504 44.0534 0.0000 172.2811 42 L 4.7988 8.2200 119.3142 54.6032 43.0857 176.4754 43 H 5.0026 9.2048 119.3363 53.6927 32.5971 173.3805 44 G 4.0411 8.9781 111.2278 46.8987 0.0000 172.4772 45 F 5.4057 8.8476 124.6543 57.0277 42.1124 172.8639 46 H 5.0965 8.8486 122.7644 53.8675 33.6621 172.8030 47 V 4.3755 8.4765 121.2206 62.5657 32.5524 174.9573 48 H 5.0919 9.4857 125.7116 54.2860 30.8655 175.8256 49 E 3.7182 8.7968 122.4086 58.9664 29.4567 177.2207 50 F 4.9754 7.9032 118.2727 55.9135 41.0447 176.5272 51 G 4.2302 8.4458 114.2102 44.3469 0.0000 174.0808 52 D 4.7860 7.9334 117.6001 52.6312 42.9375 174.5148 53 N 5.1279 8.4772 125.8156 53.3943 39.5520 176.4406 54 T 3.8214 8.6647 109.4973 63.7449 68.5980 175.0550 55 A 4.5608 8.2466 123.2923 51.1642 19.7140 176.8359 56 G 3.8632 7.9583 108.3853 46.3956 0.0000 174.1601 57 C 4.2748 8.6705 114.4103 60.2369 36.3146 175.9738 58 T 3.7189 7.9738 114.2802 65.1422 66.6664 175.7696 59 S 4.2559 8.0607 115.6595 60.5745 63.1307 175.6598 60 A 4.5144 7.5237 124.7189 53.8940 18.2943 178.5155 61 G 4.1038 8.1003 105.9188 44.0834 0.0000 171.0623 62 P 4.6619 0.0000 0.0000 62.0433 33.4952 175.2960 63 H 4.3947 8.4218 116.7273 55.8102 29.4639 175.5485 64 F 4.2758 9.1176 125.6264 58.0290 40.3112 175.0790 65 N 5.0066 7.9000 125.8850 51.5440 38.8615 173.0338 66 P 4.1532 0.0000 0.0000 65.0348 32.0453 177.8866 67 L 4.3252 7.6139 116.6490 53.6438 42.1702 176.1811 68 S 3.6062 7.4693 113.4411 59.7821 60.6287 171.6667 69 R 4.5140 8.1909 117.6943 54.4313 32.1467 176.6485 70 K 4.4292 8.7837 118.8683 55.7769 33.7626 176.4414 71 H 3.9953 8.4952 122.4639 57.0114 30.4435 175.0635 72 G 4.0896 7.8531 110.1032 46.3463 0.0000 172.3323 73 G 4.1712 8.9299 110.0302 43.0488 0.0000 173.2372 74 P 4.2850 0.0000 0.0000 65.2230 31.2758 177.4126 75 K 4.3551 7.9414 115.7747 56.3239 32.3531 175.9957 76 D 4.7759 7.6886 119.6110 52.9435 42.1331 176.4733 77 E 3.8971 8.7483 123.6546 59.1829 29.6880 176.9488 78 E 4.2441 7.9727 123.0825 55.3661 28.5397 174.8240 79 R 4.8012 7.5912 119.6334 55.1002 32.4823 175.0029 80 H 4.3991 8.5318 116.2802 55.4738 29.5207 176.7362 81 V 3.4544 8.3324 122.4555 66.4386 31.3274 177.2808 82 G 3.8409 8.3185 104.5179 47.3697 0.0000 173.4077 83 D 4.9834 8.1733 121.4018 53.5236 40.1276 175.6992 84 L 4.5678 8.4547 121.4365 53.0939 42.7232 177.9160 85 G 4.1338 8.6432 109.2682 46.0632 0.0000 174.4803 86 N 5.5628 8.5945 120.2386 51.3609 42.3044 173.2360 87 V 4.3341 8.6579 114.8890 60.0410 34.3539 174.9285 88 T 5.0102 8.3013 119.2799 61.8467 71.3245 172.8619 89 A 5.1445 8.8378 128.3128 50.0487 21.8498 176.3813 90 D 5.1788 8.2138 120.3739 52.8075 43.5393 177.3720 91 K 3.9750 8.7355 117.8212 59.6969 32.0480 178.1825 92 D 4.3076 7.9950 116.5172 54.1085 39.6564 176.7196 93 A 4.4699 8.3168 122.1587 52.9853 16.9515 176.4777 94 V 4.9451 8.1442 118.0003 61.9679 34.2203 174.3154 95 A 5.0872 8.8161 129.7970 49.5157 21.0193 175.3578 96 D 4.7003 8.6905 123.4892 54.0552 41.9288 176.0634 97 V 4.1101 8.8465 124.9414 61.3726 33.3992 174.8362 98 S 4.7010 8.4929 122.7423 57.3337 64.6029 172.8397 99 I 4.7749 9.0696 128.1510 59.4768 41.3903 174.0090 100 E 5.2114 8.9674 126.9535 54.4497 31.9418 174.3696 101 D 5.0582 9.1998 125.9389 52.6028 44.6190 175.7959 102 S 4.6495 8.9793 118.2949 58.2929 64.0244 174.5127 103 V 4.1079 7.9376 120.6239 64.7096 32.3119 176.2038 104 I 4.0305 7.8453 111.4268 61.2088 38.1131 174.5609 105 S 4.6632 8.4484 114.5895 57.4503 65.4799 174.0629 106 L 4.4086 8.8283 122.4144 54.1931 41.4931 176.1556 107 S 4.4379 7.9531 112.7025 58.0980 66.4101 174.6184 108 G 3.8557 8.4716 108.3013 44.9635 0.0000 173.3436 109 D 4.5105 8.6933 116.8512 56.6336 41.5551 177.4017 110 H 4.9467 8.1356 114.9990 55.7038 29.0591 173.9465 111 C 4.4115 8.0540 121.4666 59.6346 31.9554 173.4385 112 I 3.9128 8.1532 119.0882 60.5536 38.2316 175.7731 113 I 3.6763 7.2816 122.8752 62.8545 37.6098 176.3539 114 G 3.8149 9.2955 113.2402 45.3157 0.0000 172.9938 115 R 4.8762 7.3404 118.7832 54.8003 33.7304 174.5777 116 T 4.9950 7.9870 115.5894 62.0459 71.4554 173.5572 117 L 4.8115 8.6136 128.5381 53.9244 44.1254 175.3508 118 V 4.9540 8.6789 125.3576 61.0007 35.2654 174.1469 119 V 5.0772 8.5680 126.8522 60.4745 33.7011 174.8482 120 H 5.2496 9.0575 121.9731 54.1746 30.4760 174.8521 121 E 4.2009 9.1617 121.7279 59.0801 30.1349 176.3329 122 K 4.8189 8.4727 116.9355 53.8163 36.7054 175.6024 123 A 4.4606 8.3534 123.2887 52.2937 18.8127 176.3244 124 D 4.9045 9.3339 123.2007 54.0196 41.7451 175.9437 125 D 4.5886 9.1557 125.7086 53.1746 39.5176 176.7911 126 L 3.6760 9.5578 119.6904 56.1464 39.4842 175.9578 127 G 4.0758 8.3272 104.0645 46.1655 0.0000 174.9208 128 K 4.4868 8.0499 117.1815 56.0482 32.0944 177.6302 129 G 3.6894 8.2502 108.9301 45.8503 0.0000 175.4853 130 G 3.8849 8.3743 107.4799 45.8096 0.0000 172.4579 131 N 5.1499 7.6981 115.2022 49.9828 40.6808 174.1186 132 E 4.1056 8.6695 116.1234 59.4349 29.9561 179.2186 133 E 3.9792 8.1574 118.8658 59.0044 29.3250 178.8472 134 S 4.0974 8.5264 113.7906 61.3548 62.4128 175.4854 135 T 4.3551 7.7694 110.1598 62.2531 68.6346 175.4413 136 K 4.3004 7.7258 119.3921 57.9100 34.4099 176.6847 137 T 4.0679 7.8296 105.1187 60.0758 70.3386 174.9568 138 G 3.8096 8.2928 109.9334 45.5118 0.0000 173.4113 139 N 4.3235 7.9289 114.2135 54.2298 36.4399 175.0314 140 A 4.3962 7.3976 119.0702 51.9081 19.4339 179.3412 141 G 3.8552 7.9365 103.0183 43.9426 0.0000 173.1606 142 S 4.4493 8.6938 113.9510 58.4594 64.8401 173.7177 143 R 4.4558 8.3336 119.5315 55.1275 29.9901 176.5184 144 L 4.3604 8.8888 125.5708 57.2028 43.1774 177.0215 145 A 4.8630 7.6094 117.8182 51.3991 22.7682 174.0384 146 C 5.4698 8.6262 112.9635 56.2005 46.8515 172.7302 147 G 4.5113 8.0613 105.1983 46.0122 0.0000 172.0297 148 V 4.5340 8.1685 120.2975 62.0720 32.7992 175.3921 149 I 4.1689 8.7801 129.4606 60.9584 38.0472 175.3374 150 G 4.4507 9.0597 114.3425 43.8304 0.0000 172.0912 151 I 4.2636 8.3268 121.3064 61.1660 37.5915 175.5605 152 A 4.8280 8.4761 128.0014 49.5797 22.0453 176.2402 153 Q 4.0718 8.5399 118.8995 56.4562 29.1781 176.1593 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 8.25 4.72 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 2 T 8.93 4.64 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 1.23 0.00 0.00 3 K 8.92 5.33 0.00 1.73 1.75 0.00 1.89 0.00 0.00 1.94 0.00 0.00 3.12 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.50 7.81 4 A 9.09 5.32 1.07 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 5 V 8.79 4.97 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 0.76 0.00 0.00 0.95 0.00 0.00 6 C 9.15 4.93 0.00 3.13 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 7 V 8.48 4.53 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.92 0.00 0.00 8 L 8.75 4.62 0.00 1.74 1.60 1.05 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 9 K 9.03 4.90 0.00 1.66 1.62 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.38 7.81 10 G 8.02 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 11 D 8.81 4.67 0.00 2.68 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 12 G 7.53 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 0.00 0.00 0.00 0.00 13 P 0.00 4.34 0.00 2.22 2.31 0.00 3.69 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 2.18 1.94 0.00 14 V 7.59 4.22 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 0.79 0.00 0.00 0.94 0.00 0.00 15 Q 8.90 4.84 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.27 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 16 G 8.77 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 0.00 0.00 0.00 0.00 17 I 8.41 5.12 1.83 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 1.21 1.44 0.84 0.00 0.00 18 I 8.66 4.63 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.24 0.42 0.00 0.00 19 N 8.18 4.93 0.00 1.44 1.49 0.00 0.00 6.36 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 20 F 8.76 5.33 0.00 2.87 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 21 E 9.64 5.22 0.00 2.50 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 22 Q 9.33 4.85 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 23 K 8.99 4.08 0.00 1.82 1.88 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.50 7.81 24 E 7.80 4.79 0.00 1.98 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 0.00 2.30 2.30 0.00 25 S 8.90 4.33 0.00 3.98 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 26 N 8.21 4.77 0.00 2.82 2.93 0.00 0.00 5.86 7.00 0.00 0.00 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 G 7.99 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 0.00 0.00 0.00 28 P 0.00 4.68 0.00 2.26 2.11 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 29 V 8.88 4.67 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 1.27 0.00 0.00 1.05 0.00 0.00 30 K 9.24 4.94 0.00 2.00 1.88 0.00 1.59 0.00 0.00 1.49 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.45 7.81 31 V 9.20 4.82 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 0.79 0.00 0.00 1.08 0.00 0.00 32 W 8.37 5.56 0.00 3.47 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 33 G 7.37 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 34 S 7.72 5.11 0.00 3.85 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 35 I 8.83 5.14 1.79 0.00 0.00 0.77 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 0.42 0.94 0.00 0.00 36 K 9.25 4.83 0.00 1.77 1.87 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.34 7.81 37 G 8.88 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.76 4.36 0.00 1.80 1.43 0.81 0.14 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 39 T 8.27 4.22 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 40 E 8.59 4.06 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 41 G 8.36 3.79 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 0.00 0.00 0.00 42 L 8.22 4.80 0.00 1.49 1.58 0.91 0.94 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 43 H 9.20 5.00 0.00 3.01 3.32 0.00 5.63 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 44 G 8.98 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.85 5.41 0.00 2.98 2.88 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 46 H 8.85 5.10 0.00 3.11 3.01 0.00 5.68 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.48 4.38 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 0.95 0.00 0.00 0.87 0.00 0.00 48 H 9.49 5.09 0.00 3.04 3.34 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.80 3.72 0.00 1.66 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 1.49 2.13 0.00 50 F 7.90 4.98 0.00 3.14 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 51 G 8.45 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 0.00 0.00 0.00 52 D 7.93 4.79 0.00 2.63 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 53 N 8.48 5.13 0.00 2.81 2.70 0.00 0.00 6.89 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 54 T 8.66 3.82 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 1.24 0.00 0.00 55 A 8.25 4.56 1.26 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 0.00 0.00 0.00 56 G 7.96 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 57 C 8.67 4.27 0.00 2.95 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 58 T 7.97 3.72 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 1.25 0.00 0.00 59 S 8.06 4.26 0.00 4.13 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 60 A 7.52 4.51 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 61 G 8.10 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.66 0.00 2.03 2.18 0.00 3.54 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 63 H 8.42 4.39 0.00 2.81 3.17 0.00 5.72 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 64 F 9.12 4.28 0.00 2.86 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 65 N 7.90 5.01 0.00 2.58 2.43 0.00 0.00 6.92 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 66 P 0.00 4.15 0.00 2.06 1.91 0.00 3.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.16 0.00 67 L 7.61 4.33 0.00 1.54 1.67 0.92 0.89 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 68 S 7.47 3.61 0.00 3.99 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 69 R 8.19 4.51 0.00 1.85 1.93 0.00 3.38 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 70 K 8.78 4.43 0.00 1.63 1.70 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.51 7.81 71 H 8.50 4.00 0.00 3.22 3.27 0.00 5.98 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 72 G 7.85 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 0.00 0.00 0.00 73 G 8.93 4.17 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 0.00 74 P 0.00 4.28 0.00 2.23 2.25 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 75 K 7.94 4.36 0.00 1.77 1.88 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.47 7.81 76 D 7.69 4.78 0.00 2.76 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 77 E 8.75 3.90 0.00 1.92 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 0.00 2.28 2.29 0.00 78 E 7.97 4.24 0.00 2.06 1.81 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 2.33 2.30 0.00 79 R 7.59 4.80 0.00 1.83 1.87 0.00 2.87 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.56 0.00 80 H 8.53 4.40 0.00 3.48 3.38 0.00 5.66 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 81 V 8.33 3.45 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 0.79 0.00 0.00 0.47 0.00 0.00 82 G 8.32 3.84 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 0.00 0.00 0.00 83 D 8.17 4.98 0.00 2.70 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 84 L 8.45 4.57 0.00 1.82 1.88 0.91 0.93 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 85 G 8.64 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 86 N 8.59 5.56 0.00 2.58 2.69 0.00 0.00 6.65 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 87 V 8.66 4.33 1.83 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 -0.14 0.00 0.00 0.82 0.00 0.00 88 T 8.30 5.01 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 1.20 0.00 0.00 89 A 8.84 5.14 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 90 D 8.21 5.18 0.00 2.83 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.74 3.97 0.00 1.74 1.88 0.00 1.77 0.00 0.00 1.81 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.61 1.38 7.81 92 D 7.99 4.31 0.00 2.78 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 93 A 8.32 4.47 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 94 V 8.14 4.95 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 0.96 0.00 0.00 0.96 0.00 0.00 95 A 8.82 5.09 1.16 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 96 D 8.69 4.70 0.00 2.56 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 97 V 8.85 4.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.59 0.00 0.00 98 S 8.49 4.70 0.00 3.89 3.71 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 99 I 9.07 4.77 1.97 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.64 1.03 0.00 0.00 100 E 8.97 5.21 0.00 1.98 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 2.48 0.00 101 D 9.20 5.06 0.00 2.88 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 0.00 102 S 8.98 4.65 0.00 4.03 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 0.00 103 V 7.94 4.11 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 0.86 0.00 0.00 0.95 0.00 0.00 104 I 7.85 4.03 1.94 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.82 1.03 0.00 0.00 105 S 8.45 4.66 0.00 3.82 3.82 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 0.00 106 L 8.83 4.41 0.00 1.75 1.62 0.98 0.73 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 0.00 107 S 7.95 4.44 0.00 3.96 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 0.00 108 G 8.47 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 0.00 109 D 8.69 4.51 0.00 2.67 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.14 4.95 0.00 3.27 3.42 0.00 5.69 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 0.00 111 C 8.05 4.41 0.00 3.12 2.85 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 0.00 112 I 8.15 3.91 1.62 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 1.30 0.09 0.97 0.00 0.00 113 I 7.28 3.68 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.35 0.83 0.00 0.00 114 G 9.30 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 0.00 115 R 7.34 4.88 0.00 1.65 1.80 0.00 2.21 0.00 0.00 2.36 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.28 0.00 116 T 7.99 4.99 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 1.18 0.00 0.00 117 L 8.61 4.81 0.00 1.76 1.51 0.41 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.68 4.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.75 0.00 0.00 119 V 8.57 5.08 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 0.81 0.00 0.00 0.99 0.00 0.00 120 H 9.06 5.25 0.00 3.31 3.59 0.00 5.66 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.16 4.20 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 122 K 8.47 4.82 0.00 1.74 1.67 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.35 4.46 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 0.00 124 D 9.33 4.90 0.00 2.70 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 0.00 125 D 9.16 4.59 0.00 2.95 2.90 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 0.00 126 L 9.56 3.68 0.00 1.87 1.80 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.33 4.08 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 0.00 0.00 0.00 128 K 8.05 4.49 0.00 1.88 1.82 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.50 7.81 129 G 8.25 3.69 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 0.00 0.00 0.00 130 G 8.37 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 0.00 131 N 7.70 5.15 0.00 2.76 2.77 0.00 0.00 6.22 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 0.00 132 E 8.67 4.11 0.00 2.21 2.25 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 2.36 2.39 0.00 133 E 8.16 3.98 0.00 2.28 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 2.39 2.41 0.00 134 S 8.53 4.10 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 0.00 135 T 7.77 4.36 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 136 K 7.73 4.30 0.00 1.67 1.80 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.44 7.81 137 T 7.83 4.07 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 1.12 0.00 0.00 138 G 8.29 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 0.00 139 N 7.93 4.32 0.00 3.03 2.93 0.00 0.00 6.85 7.35 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 0.00 140 A 7.40 4.40 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 0.00 141 G 7.94 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 0.00 0.00 0.00 142 S 8.69 4.45 0.00 3.94 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.33 4.46 0.00 1.68 1.85 0.00 3.18 0.00 0.00 3.12 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.64 0.00 144 L 8.89 4.36 0.00 1.71 1.70 0.93 0.53 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 0.00 145 A 7.61 4.86 1.26 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 0.00 0.00 0.00 146 C 8.63 5.47 0.00 3.04 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 0.00 147 G 8.06 4.51 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 0.00 148 V 8.17 4.53 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 0.77 0.00 0.00 0.98 0.00 0.00 149 I 8.78 4.17 1.81 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.44 0.39 0.00 0.00 150 G 9.06 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 0.00 0.00 0.00 0.00 151 I 8.33 4.26 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.48 4.83 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 0.00 153 Q 8.54 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00