NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4196 8.3349 115.2924 57.7022 64.2265 173.5545 2 L 4.6031 7.7157 118.3997 51.1115 43.8464 174.8977 3 S 4.8662 8.3728 117.1096 56.0803 67.7652 174.3390 4 L 3.8675 8.4763 125.3199 58.6789 41.6975 178.7210 5 W 4.6472 8.4792 127.1112 61.0040 30.5006 177.2898 6 Q 3.8486 8.3085 116.8756 59.3328 28.3218 179.3334 7 Q 3.9510 8.2089 119.9096 59.6162 29.0827 178.1608 8 C 3.9989 8.4893 117.9307 62.9346 28.0774 176.1587 9 L 4.0105 8.2378 120.2809 57.8523 41.2979 179.2248 10 A 3.9856 8.0863 120.5234 55.3566 18.2633 179.6521 11 R 3.7345 8.4074 117.4191 59.4830 30.1838 178.5879 12 L 3.7314 7.4341 120.1525 57.7139 41.7121 178.3558 13 Q 4.3378 7.6914 118.4068 58.0000 29.1296 176.6011 14 D 4.5471 7.7736 118.2407 56.7123 41.6962 177.7294 15 E 4.1281 8.3056 118.6929 58.4287 29.5212 176.8507 16 L 4.5434 6.9184 115.2290 52.9221 46.0430 174.2382 17 P 4.0540 0.0000 0.0000 64.2202 31.4602 175.2444 18 A 4.1841 7.2501 122.4289 53.2748 17.8899 177.2617 19 T 4.5028 8.4986 117.9136 65.4095 69.6905 177.2507 20 E 4.2194 8.7217 122.0913 59.8129 29.4959 178.8767 21 F 4.5840 8.8763 113.8925 60.4853 37.3513 177.2517 22 S 3.4864 7.8502 113.1270 60.3559 61.7989 175.4223 23 M 4.0699 8.4130 120.5770 56.0019 32.2146 176.5822 24 W 4.8838 7.5979 116.2444 56.2945 30.0389 176.7060 25 I 4.8307 7.7307 118.2352 63.0427 42.7868 177.2715 26 R 3.9230 7.7035 118.6409 59.0225 29.8707 176.3333 27 P 4.4247 0.0000 0.0000 64.2666 31.6363 176.0749 28 L 4.7536 7.7308 119.3844 54.0035 43.6003 176.0135 29 Q 4.1671 8.8977 121.5630 54.2133 31.1429 174.4111 30 A 4.2926 6.3634 128.3120 51.0505 20.0336 175.8490 31 E 4.3358 8.4194 120.8417 54.2584 32.8495 174.4323 32 L 4.7144 8.4804 126.9469 53.3964 43.0604 176.6675 33 S 4.5547 8.5220 118.1083 58.0958 62.6614 175.4014 34 D 4.7241 8.9669 116.9561 54.1512 38.9024 173.8059 35 N 4.6121 7.6616 115.3680 53.0000 43.8864 174.2893 36 T 4.7267 7.3706 117.2052 62.7456 72.8007 172.7883 37 L 4.5569 9.3154 131.1296 53.7062 42.4800 175.8176 38 A 4.5610 8.9820 128.9675 51.2019 20.5924 175.5983 39 L 4.7479 8.4462 120.4550 53.5230 45.6428 174.7144 40 Y 5.0823 8.9992 124.2230 56.4826 39.9375 174.7753 41 A 5.3114 8.8448 126.2525 49.1037 22.4814 175.1623 42 P 4.4052 0.0000 0.0000 64.8018 30.3149 175.4028 43 N 4.8160 7.5580 115.3025 51.2162 39.9542 174.9866 44 R 4.2756 8.3363 116.0837 58.6805 30.0637 178.7680 45 F 4.2339 8.0129 117.5359 60.8406 38.9342 177.4365 46 V 4.1680 8.2951 116.9105 66.3791 31.3393 177.4438 47 L 4.1522 7.5365 117.3736 58.1883 41.3298 178.8408 48 D 4.1708 7.9054 116.3113 57.2608 41.3381 178.0627 49 W 3.9723 8.1609 128.4509 60.3927 30.7534 177.7806 50 V 3.7600 8.7115 118.4072 66.3199 30.8573 177.9201 51 R 4.0094 8.1396 116.2268 58.2648 29.7103 177.6566 52 D 4.2654 7.8692 118.0452 57.1742 41.6129 176.8890 53 K 4.1500 7.3663 117.4709 58.6844 33.7426 177.3019 54 Y 4.0483 7.8941 121.1411 60.4149 38.7579 177.5429 55 L 4.0186 8.1801 120.0250 58.6695 42.0589 178.4006 56 N 4.1729 8.1391 115.0723 56.7893 38.6970 176.7051 57 N 4.1856 8.0310 117.2069 56.3860 38.6443 177.0929 58 I 3.4795 7.9961 121.0571 64.7210 37.3128 177.7545 59 N 4.3187 8.6652 117.2829 56.7914 38.5329 177.4040 60 G 3.7703 8.1101 106.5126 47.8727 0.0000 175.3785 61 L 3.9563 7.7823 122.1513 57.9200 41.6891 178.5747 62 L 3.9709 8.3550 119.3618 58.6240 41.4174 179.9594 63 T 4.0997 7.7550 113.7439 66.5445 68.5517 176.8425 64 S 4.2275 7.9846 113.9067 60.6017 62.3692 175.8220 65 F 4.3406 8.4179 123.4315 60.8494 39.3514 175.2173 66 C 4.3739 8.0316 110.7724 61.2853 31.5026 174.8380 67 G 4.3589 8.5296 114.2125 45.9162 0.0000 174.8329 68 A 4.3771 7.6236 120.4924 52.3734 18.7764 177.0400 69 D 4.6934 7.8440 112.7556 52.9692 42.9273 174.3378 70 A 4.0683 7.4479 120.4120 52.2203 18.1760 175.9842 71 P 4.5547 0.0000 0.0000 63.0874 32.9149 174.3624 72 Q 4.8346 8.3697 115.5662 54.9244 32.2624 173.9701 73 L 5.2501 8.4567 117.3189 53.1154 45.4242 176.3559 74 R 4.8062 8.6336 119.1611 54.6652 34.6771 174.3829 75 F 5.3894 8.4330 117.6750 56.4805 43.1863 173.4216 76 E 4.5467 9.1384 121.3356 55.6524 33.8670 174.4153 77 V 4.2280 8.3536 123.5563 61.8650 31.7617 176.3443 78 G 3.7581 8.6151 121.3581 46.5524 0.0000 171.8584 79 T 4.4584 8.2572 109.8825 60.4903 70.0803 174.6200 80 K 4.0121 8.4142 121.9226 55.7877 32.5566 175.0520 81 P 4.5160 0.0000 0.0000 62.6939 32.1217 175.4978 82 V 4.5032 8.0099 117.7672 61.1070 33.9078 174.6195 83 T 4.5577 7.8656 114.0807 59.7792 71.4531 173.5162 84 Q 4.6305 8.0972 119.6914 56.1571 30.4766 172.5628 85 T 4.7151 8.1320 114.3260 58.8787 72.0551 172.7610 86 P 4.5316 0.0000 0.0000 63.7255 32.6575 174.9495 87 Q 4.3400 7.8986 114.0928 56.0761 31.3152 172.9336 88 A 4.2304 7.8557 125.6388 52.2225 21.7490 174.3972 89 A 4.3708 8.0118 120.9751 52.4851 21.3197 175.9301 90 V 4.5498 8.0717 117.8839 60.6063 34.2340 174.0145 91 T 4.6688 7.8741 110.5148 60.7921 71.8823 171.7831 92 S 4.5061 7.4682 114.3414 58.6813 65.0833 174.0628 93 N 4.3387 8.1385 114.6035 53.3288 41.4307 174.4780 94 V 4.4455 8.1331 119.8266 61.7593 34.7719 173.5039 95 A 4.4408 7.5777 125.7291 51.9120 22.0174 176.0291 96 A 4.6139 7.7527 117.7064 51.5229 20.3125 174.1597 97 P 4.5017 0.0000 0.0000 61.9700 33.1600 175.1049 98 A 4.5276 7.9357 119.8235 52.1755 21.7288 175.3985 99 Q 4.3317 8.2694 115.1810 55.4633 30.1430 174.7389 100 V 3.7527 8.4063 116.5587 61.4788 32.2055 175.3734 101 A 4.5830 7.8081 122.5003 50.9051 21.6846 175.2739 102 Q 4.5549 7.8831 121.8382 56.1633 31.7971 173.1012 103 T 4.3034 8.3611 109.3456 61.5329 71.0307 173.6285 104 Q 3.2769 8.1203 120.6495 55.8719 26.5686 170.3990 105 P 4.5346 0.0000 0.0000 62.0552 32.6724 175.7058 106 Q 4.7149 8.1215 115.8143 54.5490 31.6573 175.4242 107 R 4.1265 8.1841 116.8499 56.8148 30.1044 174.2378 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 S 8.33 4.42 0.00 3.86 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 2 L 7.72 4.60 0.00 1.73 1.55 0.94 0.52 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 3 S 8.37 4.87 0.00 4.12 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 4 L 8.48 3.87 0.00 1.78 1.78 0.80 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 5 W 8.48 4.65 0.00 3.42 3.23 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 6 Q 8.31 3.85 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.65 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 7 Q 8.21 3.95 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.48 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 8 C 8.49 4.00 0.00 3.41 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 9 L 8.24 4.01 0.00 1.82 2.02 0.30 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.09 3.99 1.32 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 11 R 8.41 3.73 0.00 1.82 2.05 0.00 3.06 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 12 L 7.43 3.73 0.00 1.22 0.13 0.75 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 7.69 4.34 0.00 2.41 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.98 0.00 0.00 0.00 0.00 0.00 2.51 2.50 0.00 14 D 7.77 4.55 0.00 2.83 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 15 E 8.31 4.13 0.00 2.02 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 0.00 2.29 2.42 0.00 16 L 6.92 4.54 0.00 1.75 1.52 0.90 0.92 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 17 P 0.00 4.05 0.00 2.22 2.21 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 18 A 7.25 4.18 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 19 T 8.50 4.50 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 20 E 8.72 4.22 0.00 2.46 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 2.77 2.69 0.00 21 F 8.88 4.58 0.00 3.64 3.58 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 0.00 0.00 0.00 0.00 22 S 7.85 3.49 0.00 3.41 3.60 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 23 M 8.41 4.07 0.00 1.57 2.17 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 24 W 7.60 4.88 0.00 3.63 3.49 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 25 I 7.73 4.83 2.11 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.16 1.23 0.00 0.00 26 R 7.70 3.92 0.00 1.84 1.98 0.00 3.27 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 27 P 0.00 4.42 0.00 2.15 2.13 0.00 3.76 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.90 0.00 28 L 7.73 4.75 0.00 1.90 1.85 1.16 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.90 4.17 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.46 0.00 0.00 0.00 0.00 0.00 2.09 2.25 0.00 30 A 6.36 4.29 -0.41 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 31 E 8.42 4.34 0.00 1.67 1.42 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 2.06 2.12 0.00 32 L 8.48 4.71 0.00 1.52 1.54 0.97 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.52 4.55 0.00 3.97 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 34 D 8.97 4.72 0.00 2.88 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 N 7.66 4.61 0.00 2.63 2.73 0.00 0.00 6.67 7.07 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 36 T 7.37 4.73 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 1.20 0.00 0.00 37 L 9.32 4.56 0.00 1.67 1.57 1.10 0.93 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 38 A 8.98 4.56 1.24 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 0.00 0.00 0.00 39 L 8.45 4.75 0.00 1.52 1.53 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 9.00 5.08 0.00 2.99 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 41 A 8.84 5.31 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 42 P 0.00 4.41 0.00 2.22 2.21 0.00 3.89 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 2.03 1.95 0.00 43 N 7.56 4.82 0.00 3.03 3.07 0.00 0.00 6.56 7.83 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 44 R 8.34 4.28 0.00 1.56 1.87 0.00 3.01 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 45 F 8.01 4.23 0.00 3.22 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 46 V 8.30 4.17 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 1.19 0.00 0.00 47 L 7.54 4.15 0.00 1.90 1.77 0.98 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 7.91 4.17 0.00 2.66 2.83 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 49 W 8.16 3.97 0.00 3.06 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 50 V 8.71 3.76 2.49 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 1.23 0.00 0.00 1.45 0.00 0.00 51 R 8.14 4.01 0.00 0.67 1.59 0.00 3.25 0.00 0.00 2.91 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.24 0.00 52 D 7.87 4.27 0.00 2.58 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 7.37 4.15 0.00 1.88 1.74 0.00 0.76 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 1.14 7.81 54 Y 7.89 4.05 0.00 3.27 3.39 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 55 L 8.18 4.02 0.00 1.99 1.74 1.24 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.14 4.17 0.00 2.94 2.84 0.00 0.00 6.88 6.88 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 57 N 8.03 4.19 0.00 2.68 2.59 0.00 0.00 7.16 7.33 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 58 I 8.00 3.48 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 1.29 0.89 0.92 0.00 0.00 59 N 8.67 4.32 0.00 2.95 2.90 0.00 0.00 7.13 7.64 0.00 0.00 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 G 8.11 3.77 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 0.00 0.00 0.00 61 L 7.78 3.96 0.00 1.71 1.81 0.87 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.36 3.97 0.00 1.84 1.75 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 63 T 7.76 4.10 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 64 S 7.98 4.23 0.00 3.93 4.12 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 65 F 8.42 4.34 0.00 3.07 3.29 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 66 C 8.03 4.37 0.00 3.24 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.53 4.36 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 0.00 68 A 7.62 4.38 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 69 D 7.84 4.69 0.00 2.69 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 70 A 7.45 4.07 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 71 P 0.00 4.55 0.00 2.19 2.08 0.00 3.71 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 72 Q 8.37 4.83 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 73 L 8.46 5.25 0.00 1.56 1.37 1.04 0.96 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 74 R 8.63 4.81 0.00 1.55 1.70 0.00 3.09 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 75 F 8.43 5.39 0.00 2.83 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 E 9.14 4.55 0.00 1.81 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 1.95 2.11 0.00 77 V 8.35 4.23 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.95 0.00 0.00 78 G 8.62 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 0.00 0.00 0.00 79 T 8.26 4.46 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 1.34 0.00 0.00 80 K 8.41 4.01 0.00 1.79 1.80 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.45 7.81 81 P 0.00 4.52 0.00 2.17 2.06 0.00 3.70 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 82 V 8.01 4.50 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 0.88 0.00 0.00 0.93 0.00 0.00 83 T 7.87 4.56 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 1.21 0.00 0.00 84 Q 8.10 4.63 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.84 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 85 T 8.13 4.72 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 1.21 0.00 0.00 86 P 0.00 4.53 0.00 2.20 2.14 0.00 3.80 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 87 Q 7.90 4.34 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.14 2.24 0.00 88 A 7.86 4.23 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 89 A 8.01 4.37 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 90 V 8.07 4.55 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 0.86 0.00 0.00 0.93 0.00 0.00 91 T 7.87 4.67 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 1.21 0.00 0.00 92 S 7.47 4.51 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 93 N 8.14 4.34 0.00 2.68 2.71 0.00 0.00 6.51 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 94 V 8.13 4.45 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 0.72 0.00 0.00 0.93 0.00 0.00 95 A 7.58 4.44 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 96 A 7.75 4.61 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.50 0.00 2.19 2.11 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 98 A 7.94 4.53 1.23 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 99 Q 8.27 4.33 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 100 V 8.41 3.75 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 0.65 0.00 0.00 0.93 0.00 0.00 101 A 7.81 4.58 1.18 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 0.00 0.00 102 Q 7.88 4.55 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 103 T 8.36 4.30 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 1.21 0.00 0.00 104 Q 8.12 3.28 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.07 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 105 P 0.00 4.53 0.00 2.22 2.05 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 106 Q 8.12 4.71 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.84 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00 107 R 8.18 4.13 0.00 1.74 1.76 0.00 3.43 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00