NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1978 8.3144 121.7901 56.3545 33.4053 173.8424 2 E 4.3768 8.3597 121.0324 52.4235 30.9044 174.7080 3 S 4.4462 8.7976 123.1997 57.7622 66.4312 174.4717 4 A 4.0214 8.5218 123.6262 55.2413 18.0421 179.8333 5 A 3.9604 8.0060 118.5534 55.3447 18.5971 179.5640 6 A 3.9818 7.9027 118.8791 55.1194 18.3484 179.7986 7 K 4.0727 8.2565 118.2339 59.5802 32.2033 178.8597 8 F 4.0801 8.4001 120.9599 61.3792 39.3495 176.8941 9 E 3.9794 8.5831 118.3190 59.4127 29.0148 179.4306 10 R 3.8273 7.8511 117.7430 59.5731 30.2718 178.3005 11 Q 4.0031 8.0239 116.8010 58.0007 28.8810 176.5401 12 H 4.6522 7.8941 113.7861 55.2605 30.4327 173.4960 13 M 4.5543 7.6276 119.9315 53.6780 33.7584 176.4797 14 D 4.7404 8.1687 122.8809 52.8999 40.3260 174.7894 15 S 4.1993 7.9252 118.5426 59.5129 63.9790 175.0842 16 G 4.1292 8.7879 111.0800 46.2238 0.0000 172.7005 17 N 5.0362 7.5341 114.0199 51.6852 42.5579 173.2165 18 S 4.7424 8.1712 115.3922 55.5738 65.8092 172.9312 19 P 4.2889 0.0000 0.0000 65.7021 31.1182 177.7812 20 S 4.2701 7.9009 110.1960 59.4912 63.6590 174.8170 21 S 4.3431 7.8140 116.9997 58.2059 60.1993 174.3481 22 S 4.3122 8.3993 123.6784 60.5620 62.9722 176.6540 23 S 4.2906 7.9983 113.5692 60.1005 63.4136 174.1301 24 N 4.7178 8.1811 119.6108 53.8877 39.0638 175.6776 25 Y 3.9867 8.0181 119.3394 61.6016 38.7441 177.4643 26 C 4.0838 8.2433 117.0378 59.9955 37.3698 175.8100 27 N 4.3827 8.1950 117.5017 56.3592 38.0906 177.2998 28 L 3.9237 7.6955 119.9759 58.0850 41.6887 179.4958 29 M 3.6654 7.7115 118.8690 58.5413 31.6486 178.8202 30 M 4.0305 8.0354 119.1251 58.3237 32.0567 178.3712 31 C 4.1552 7.6588 119.9674 62.1479 31.6327 174.9857 32 C 4.0551 8.0259 119.3574 62.4483 31.1145 174.8837 33 R 4.3815 8.0209 117.4141 55.2306 30.3620 176.4023 34 K 3.8496 7.7373 116.0321 58.2515 30.4053 175.7191 35 M 4.5611 8.4561 115.3394 55.4206 32.4439 177.4802 36 T 4.9831 7.6264 107.0153 60.3026 69.4726 173.4163 37 Q 4.3462 8.0527 123.8309 57.6043 27.6970 175.5460 38 G 3.5870 10.4625 114.6079 44.7839 0.0000 170.8860 39 K 3.8410 6.8200 116.5614 56.5947 34.7437 174.3687 40 C 5.1583 8.5206 116.5842 54.6438 41.3172 174.2357 41 K 4.2178 8.5185 127.0141 55.9605 32.6026 174.9318 42 P 4.7455 0.0000 0.0000 64.8084 32.1886 176.3783 43 V 5.0814 7.5008 116.0558 61.6428 34.9346 173.6558 44 N 4.6510 8.7114 121.7852 52.9858 42.8311 173.0941 45 T 4.7954 7.7765 119.9801 61.6194 71.8066 173.1604 46 F 4.6336 8.8893 124.4518 55.6849 41.7134 174.6709 47 V 4.5371 8.3608 122.5194 61.6609 32.8636 174.8732 48 H 4.9336 9.1128 124.1166 55.7799 29.3746 175.0327 49 E 4.3683 8.0503 119.0141 55.1564 30.6463 176.8686 50 S 4.3851 8.2359 114.8274 58.2031 65.0488 174.9173 51 L 3.9717 8.5017 124.2334 58.1913 41.8933 179.1069 52 A 3.9796 7.9955 120.3548 55.3512 18.1317 179.1337 53 D 4.3051 7.7782 115.8785 57.5992 41.3205 178.9858 54 V 3.7750 7.7102 118.3843 65.8402 31.3994 178.2384 55 K 3.9753 8.4434 118.4206 59.3311 31.8559 179.0840 56 A 4.0093 8.0273 120.7057 54.6638 18.1444 179.7042 57 V 3.6371 7.5968 116.7220 65.9972 31.3288 176.8548 58 C 4.0532 7.6927 114.6764 57.8506 39.8588 173.9366 59 S 4.6402 7.5991 114.7230 57.8966 64.0776 174.5454 60 Q 4.6953 7.5291 120.7108 56.4913 31.1113 178.2232 61 K 4.1492 8.9827 133.6541 56.9668 32.8530 175.4604 62 K 3.8273 8.6300 130.1618 56.4717 32.6646 176.1713 63 V 4.5385 8.0545 119.6505 59.8280 36.3276 175.0222 64 T 4.0887 8.2506 118.3392 63.3064 69.0211 176.0419 65 C 4.5347 8.4538 122.5558 57.0545 40.9692 173.6267 66 K 4.0944 9.0521 120.5570 57.1602 33.0756 177.4682 67 N 4.6853 7.8305 116.5466 53.6715 38.0582 175.2368 68 G 3.9152 8.0486 111.3025 45.4748 0.0000 168.9364 69 Q 4.4723 7.1358 115.6411 55.7167 31.7305 172.9658 70 T 4.5505 7.6496 107.2827 60.4040 72.3825 172.5298 71 N 4.1248 8.3944 114.4442 54.7923 35.7411 174.5462 72 C 5.4445 7.4666 114.7684 55.6859 41.8750 174.2243 73 Y 5.0350 9.1953 119.7675 56.1898 41.6804 174.1054 74 Q 5.2416 9.0552 124.3607 54.0820 30.4933 174.8239 75 S 4.6689 8.8340 121.5207 57.9814 63.7224 175.6345 76 K 4.2488 9.3200 123.1853 59.1497 32.5226 176.6358 77 S 4.9579 7.1859 112.3794 56.3851 65.9367 173.9825 78 T 4.2376 8.1741 110.8961 61.7464 70.0908 174.0043 79 M 5.0716 9.0530 121.6196 53.5220 36.8678 174.8600 80 R 4.6225 9.1845 121.6746 56.1214 31.6511 175.8931 81 I 5.1497 8.6014 116.0942 59.6625 42.2250 174.0971 82 T 5.0796 8.7405 118.1746 62.0737 72.1993 172.8577 83 D 5.0391 9.3127 127.2979 53.0856 43.2140 174.8142 84 C 5.6032 9.1676 121.1334 55.1929 42.3056 172.9321 85 R 5.3318 8.9117 123.8859 54.1442 32.6484 174.3799 86 E 4.1371 9.2254 126.2580 56.9604 30.8669 176.4123 87 T 4.2176 8.8165 114.2035 60.7577 70.0301 176.0999 88 G 3.8356 8.9524 113.1798 48.5647 0.0000 173.8521 89 S 4.4038 7.3623 111.1147 58.1584 62.5906 173.6049 90 S 4.3987 8.3215 115.4639 58.4209 62.6916 173.7449 91 K 4.3928 8.6610 126.7871 55.1680 35.4536 174.7935 92 Y 4.2688 8.8188 125.1897 57.9698 38.8983 173.9852 93 P 3.2948 0.0000 0.0000 62.4054 32.0697 176.4937 94 N 4.8641 7.8780 117.9015 52.2100 37.8877 173.4079 95 C 4.5970 7.8576 116.6645 56.8489 39.0710 173.4081 96 A 4.9786 8.4050 123.7204 50.9129 22.4078 174.8811 97 Y 5.1531 9.4362 119.3563 56.0216 41.9729 174.8829 98 K 4.5948 9.1587 123.7693 55.3371 34.4191 175.0210 99 T 5.0968 8.5945 123.8921 62.4436 70.2144 174.0459 100 T 4.6887 8.8542 122.9832 61.8163 71.9832 172.9589 101 Q 5.2061 8.6583 125.0673 54.5057 31.4665 174.9950 102 V 4.4335 8.1874 120.7910 61.1850 35.6935 172.0324 103 E 5.0750 8.6666 119.2810 54.7467 32.1382 175.6392 104 K 4.7901 8.6803 122.5240 54.8736 37.6436 175.1943 105 H 5.0194 9.1616 118.8393 55.5483 30.1039 174.9734 106 I 4.9053 8.6683 115.8595 59.2623 40.7089 174.4148 107 I 4.9229 8.3131 124.6957 59.7393 39.9892 175.0578 108 V 4.6956 8.5300 119.6091 59.3170 35.8692 174.3703 109 A 5.0933 8.7804 125.1768 50.9595 20.5542 175.8197 110 C 5.2724 9.1385 120.9958 55.9866 43.6578 173.1388 111 G 3.9218 9.1550 107.4028 46.7942 0.0000 173.4845 112 G 4.2556 10.2398 107.8308 44.8098 0.0000 172.7761 113 K 4.3269 8.0752 119.6202 54.6232 33.7496 174.0495 114 P 4.2719 0.0000 0.0000 62.7645 31.8420 176.0926 115 S 4.5713 8.4452 116.2922 58.6896 62.7995 173.4805 116 V 4.5991 8.6867 119.6350 58.5643 36.4497 173.0405 117 P 4.7232 0.0000 0.0000 63.1085 30.8793 176.9085 118 V 4.2942 8.8850 118.2300 61.9104 33.8373 176.0029 119 H 5.0119 7.8537 116.1500 53.9146 33.4391 172.1451 120 F 4.4765 8.8814 124.4825 57.8674 39.5481 174.4223 121 D 4.5802 8.3650 126.7461 55.7252 41.7051 175.7283 122 A 4.6902 6.7293 117.1998 51.4575 22.6766 174.2494 123 S 5.2790 8.8586 113.4778 56.5700 65.9492 174.7182 124 V 4.1381 8.8286 121.7994 61.9737 31.5060 175.2284 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 K 8.31 4.20 0.00 1.74 1.82 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.39 7.81 2 E 8.36 4.38 0.00 2.04 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 0.00 2.22 2.37 0.00 3 S 8.80 4.45 0.00 4.10 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 4 A 8.52 4.02 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 5 A 8.01 3.96 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 6 A 7.90 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.26 4.07 0.00 1.88 2.00 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 8 F 8.40 4.08 0.00 3.16 3.20 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 9 E 8.58 3.98 0.00 2.24 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 2.48 2.68 0.00 10 R 7.85 3.83 0.00 1.80 2.07 0.00 3.23 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 11 Q 8.02 4.00 0.00 1.70 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.47 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 12 H 7.89 4.65 0.00 2.07 2.81 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.63 4.55 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 14 D 8.17 4.74 0.00 2.52 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.93 4.20 0.00 3.93 3.78 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 16 G 8.79 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 17 N 7.53 5.04 0.00 2.61 2.91 0.00 0.00 6.71 7.51 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 18 S 8.17 4.74 0.00 3.83 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 19 P 0.00 4.29 0.00 2.07 2.12 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 2.09 0.00 20 S 7.90 4.27 0.00 3.98 3.98 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 0.00 0.00 0.00 21 S 7.81 4.34 0.00 3.91 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 22 S 8.40 4.31 0.00 3.92 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 23 S 8.00 4.29 0.00 4.01 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 24 N 8.18 4.72 0.00 2.87 2.98 0.00 0.00 6.65 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 8.02 3.99 0.00 3.07 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 26 C 8.24 4.08 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 27 N 8.20 4.38 0.00 3.05 2.91 0.00 0.00 7.14 6.74 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 28 L 7.70 3.92 0.00 1.65 1.56 0.89 0.90 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 29 M 7.71 3.67 0.00 0.86 1.31 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.54 0.00 30 M 8.04 4.03 0.00 1.73 1.88 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 1.08 2.40 0.00 31 C 7.66 4.16 0.00 3.05 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 32 C 8.03 4.06 0.00 2.95 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 33 R 8.02 4.38 0.00 1.99 2.00 0.00 3.59 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.91 0.00 34 K 7.74 3.85 0.00 1.92 2.00 0.00 1.70 0.00 0.00 1.94 0.00 0.00 3.02 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.39 1.54 7.81 35 M 8.46 4.56 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.43 0.00 36 T 7.63 4.98 4.42 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 1.46 0.00 0.00 37 Q 8.05 4.35 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.66 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 38 G 10.46 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 39 K 6.82 3.84 0.00 1.80 1.69 0.00 1.43 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.24 1.36 7.81 40 C 8.52 5.16 0.00 3.07 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 41 K 8.52 4.22 0.00 1.79 1.80 0.00 1.80 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.44 7.81 42 P 0.00 4.75 0.00 2.15 2.10 0.00 3.91 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 2.13 1.95 0.00 43 V 7.50 5.08 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 0.98 0.00 0.00 44 N 8.71 4.65 0.00 2.69 2.30 0.00 0.00 7.10 6.51 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 45 T 7.78 4.80 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 0.95 0.00 0.00 46 F 8.89 4.63 0.00 3.00 2.91 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 47 V 8.36 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 0.87 0.00 0.00 1.01 0.00 0.00 48 H 9.11 4.93 0.00 3.03 3.26 0.00 5.70 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.05 4.37 0.00 1.99 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 2.34 2.26 0.00 50 S 8.24 4.39 0.00 4.06 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 51 L 8.50 3.97 0.00 1.80 1.72 0.94 1.02 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 52 A 8.00 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 53 D 7.78 4.31 0.00 2.88 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 54 V 7.71 3.78 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 1.08 0.00 0.00 1.01 0.00 0.00 55 K 8.44 3.98 0.00 2.06 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.56 7.81 56 A 8.03 4.01 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.60 3.64 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 1.15 0.00 0.00 1.00 0.00 0.00 58 C 7.69 4.05 0.00 2.87 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 59 S 7.60 4.64 0.00 3.87 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 60 Q 7.53 4.70 0.00 2.13 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 61 K 8.98 4.15 0.00 1.84 1.81 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.39 7.81 62 K 8.63 3.83 0.00 1.74 1.56 0.00 1.53 0.00 0.00 1.28 0.00 0.00 2.66 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.93 1.26 7.81 63 V 8.05 4.54 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 0.71 0.00 0.00 0.83 0.00 0.00 64 T 8.25 4.09 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 65 C 8.45 4.53 0.00 2.99 3.16 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 66 K 9.05 4.09 0.00 1.70 1.84 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.35 7.81 67 N 7.83 4.69 0.00 2.84 2.74 0.00 0.00 7.19 8.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.05 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 69 Q 7.14 4.47 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.70 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 70 T 7.65 4.55 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 71 N 8.39 4.12 0.00 3.02 3.02 0.00 0.00 6.73 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 72 C 7.47 5.44 0.00 2.90 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 73 Y 9.20 5.04 0.00 2.85 2.96 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 0.00 0.00 0.00 74 Q 9.06 5.24 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.01 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 75 S 8.83 4.67 0.00 4.02 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 76 K 9.32 4.25 0.00 1.91 2.02 0.00 1.57 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.67 1.44 7.81 77 S 7.19 4.96 0.00 3.71 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 78 T 8.17 4.24 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 79 M 9.05 5.07 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 80 R 9.18 4.62 0.00 1.88 1.90 0.00 3.06 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 81 I 8.60 5.15 1.91 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.75 1.04 0.00 0.00 82 T 8.74 5.08 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 1.41 0.00 0.00 83 D 9.31 5.04 0.00 2.60 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 C 9.17 5.60 0.00 2.94 2.92 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 85 R 8.91 5.33 0.00 1.93 1.78 0.00 3.14 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 86 E 9.23 4.14 0.00 1.97 1.72 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 1.77 2.10 0.00 87 T 8.82 4.22 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 1.21 0.00 0.00 88 G 8.95 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 89 S 7.36 4.40 0.00 3.91 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 90 S 8.32 4.40 0.00 3.84 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.66 4.39 0.00 1.77 1.65 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.52 7.81 92 Y 8.82 4.27 0.00 2.94 2.98 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 0.00 0.00 0.00 93 P 0.00 3.29 0.00 1.77 1.20 0.00 3.60 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 94 N 7.88 4.86 0.00 2.77 2.72 0.00 0.00 7.04 7.23 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 95 C 7.86 4.60 0.00 3.08 2.99 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 96 A 8.41 4.98 1.13 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 97 Y 9.44 5.15 0.00 2.80 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 98 K 9.16 4.59 0.00 1.85 1.86 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.44 7.81 99 T 8.59 5.10 4.33 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 1.36 0.00 0.00 100 T 8.85 4.69 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 0.00 101 Q 8.66 5.21 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.71 0.00 0.00 0.00 0.00 0.00 2.18 2.27 0.00 102 V 8.19 4.43 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 0.64 0.00 0.00 0.95 0.00 0.00 103 E 8.67 5.07 0.00 1.83 1.88 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 2.20 2.31 0.00 104 K 8.68 4.79 0.00 1.72 1.86 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 105 H 9.16 5.02 0.00 3.21 3.22 0.00 5.58 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.67 4.91 1.79 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.88 1.14 0.00 0.00 107 I 8.31 4.92 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.74 0.89 0.00 0.00 108 V 8.53 4.70 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 0.61 0.00 0.00 0.94 0.00 0.00 109 A 8.78 5.09 1.28 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 0.00 110 C 9.14 5.27 0.00 2.92 2.96 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 0.00 0.00 0.00 111 G 9.15 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 0.00 112 G 10.24 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 0.00 0.00 0.00 0.00 113 K 8.08 4.33 0.00 1.67 1.67 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.40 7.81 114 P 0.00 4.27 0.00 2.05 1.96 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 115 S 8.45 4.57 0.00 3.83 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.69 4.60 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 0.71 0.00 0.00 1.00 0.00 0.00 117 P 0.00 4.72 0.00 1.95 2.01 0.00 3.63 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 2.10 0.00 118 V 8.88 4.29 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.97 0.00 0.00 119 H 7.85 5.01 0.00 3.03 3.12 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.88 4.48 0.00 3.07 2.96 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 0.00 0.00 0.00 121 D 8.37 4.58 0.00 2.59 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 0.00 122 A 6.73 4.69 1.19 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 0.00 0.00 123 S 8.86 5.28 0.00 3.95 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 0.00 124 V 8.83 4.14 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 0.73 0.00 0.00 0.93 0.00 0.00