NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3056 8.2993 120.1357 56.2821 34.1428 174.8809 2 E 4.4550 7.7291 113.3739 52.9041 32.4568 172.3926 3 T 4.6118 8.4243 110.5634 59.7520 73.3854 176.1288 4 A 4.0242 8.4093 122.6144 55.0976 18.4635 179.9437 5 A 3.9313 7.9241 118.6422 55.4294 18.7061 179.6700 6 A 4.0644 8.0060 119.0893 54.9541 18.3266 179.7479 7 K 3.9881 8.2368 118.6227 59.4032 32.1477 178.8881 8 F 4.1296 8.0296 121.3863 61.1960 39.3294 177.0237 9 E 4.0164 8.3514 118.0322 59.3096 29.0410 179.3242 10 R 3.8754 7.7991 117.6525 59.6896 30.3036 178.3167 11 Q 3.9462 7.9081 116.3130 57.9635 29.0966 176.2779 12 H 4.6828 7.9938 113.7360 53.9232 31.2114 173.0275 13 M 4.8958 8.0700 118.8456 53.6431 34.3229 176.2138 14 D 4.7598 9.0709 122.9039 53.1946 42.0167 175.5334 15 S 4.5397 8.5209 116.3308 58.9684 63.6476 175.5608 16 S 4.3686 7.7960 114.1248 59.8805 63.2722 174.4274 17 T 4.6937 7.5066 109.9085 59.7309 71.2519 174.2092 18 S 4.1750 8.6192 118.7154 60.8650 63.2688 173.4664 19 A 3.8283 7.0789 120.2834 50.6437 21.4958 175.2934 20 A 2.7978 8.3489 123.3657 52.4724 18.3908 178.3737 21 S 4.2654 8.3374 117.0166 59.1575 64.0202 173.6668 22 S 4.5727 7.2461 114.9511 57.8885 64.3861 177.3160 23 S 4.2823 8.8190 114.9035 60.2775 63.0037 174.2613 24 N 4.7404 7.9609 119.2624 53.6089 39.3311 175.3300 25 Y 4.0512 8.1317 119.3193 61.9829 38.6473 177.7073 26 C 4.1302 8.4221 116.9966 60.0003 38.5180 175.8854 27 N 4.3881 8.1398 117.6169 56.3669 38.1796 177.4028 28 Q 3.8132 7.9569 119.3725 59.1733 28.9219 178.5651 29 M 3.7365 7.6984 121.3585 57.9655 31.7918 178.7440 30 M 4.0210 7.9364 119.0244 57.9817 31.9446 178.8896 31 K 3.9294 7.5382 119.6993 59.5528 32.0447 179.2354 32 S 4.2058 8.0905 114.3016 60.8539 62.5373 175.4243 33 R 4.4267 7.6962 119.9242 54.8649 30.1052 175.4629 34 N 4.1741 7.7986 115.7584 54.8220 37.6434 174.6017 35 L 4.4885 8.0694 114.8946 54.7879 42.2444 177.9532 36 T 5.6165 7.5542 106.5672 60.1409 69.5535 174.7433 37 K 4.1922 8.4206 124.7354 59.5040 32.4226 177.2197 38 D 4.6986 7.9369 116.5294 55.4249 42.3288 175.9319 39 R 3.8942 7.2882 112.9528 55.3888 31.6537 174.6013 40 C 4.9448 8.6285 116.3673 55.4280 39.2423 173.4159 41 K 3.9518 8.2852 126.4591 56.5970 31.7581 174.6437 42 P 4.5747 0.0000 0.0000 65.2795 32.2186 176.4487 43 V 5.0451 7.4800 116.1329 61.4590 35.0499 173.9929 44 N 4.5842 8.7680 121.7652 52.9595 42.8984 173.0766 45 T 4.8988 7.8145 121.2361 61.6505 71.9789 172.8041 46 F 4.8364 8.8508 123.9192 55.6103 42.3441 174.5664 47 V 4.4833 8.7842 122.6413 60.8860 33.4875 175.9950 48 H 5.6657 8.5694 129.3553 54.4438 26.4914 174.0211 49 E 4.8161 7.7201 116.5680 53.3673 34.2203 176.8989 50 S 4.3620 8.3603 115.1949 58.2272 65.0115 175.0364 51 L 3.9742 8.5101 124.3912 58.4087 41.9259 179.0282 52 A 4.1602 8.0722 120.1637 55.5697 18.0534 179.2402 53 D 4.3361 7.7783 115.8431 57.3674 41.1604 178.8444 54 V 3.8093 7.7182 118.8659 65.9622 31.6664 178.2000 55 Q 3.9136 8.5981 118.0675 58.6493 28.5256 178.3914 56 A 4.0519 7.9991 121.5080 54.4556 18.3309 179.6387 57 V 3.4695 7.6243 117.0536 65.8884 31.2947 177.1318 58 C 3.7695 7.6642 114.6219 58.4306 39.8544 174.3542 59 S 4.6786 7.3431 115.4019 58.2796 63.8423 174.2120 60 Q 4.3171 7.0577 120.2271 54.9643 30.2821 178.8466 61 K 4.2718 8.7524 135.0000 56.7164 32.5893 174.5186 62 N 4.4369 8.7842 127.5745 53.7244 39.1255 174.2864 63 V 4.5858 8.4810 118.2502 59.5025 36.9304 174.4704 64 A 4.3982 8.3490 124.4727 52.0424 19.3085 178.3716 65 C 4.6123 9.0772 118.9773 55.8362 41.3390 175.3350 66 K 3.8072 8.7182 121.3330 59.7331 31.5767 178.2365 67 N 4.5392 7.9997 112.9409 53.1480 37.5449 175.0133 68 G 4.0123 8.0230 108.1400 45.8842 0.0000 174.4675 69 Q 4.2489 8.1285 118.1714 56.5146 29.1849 176.2694 70 T 4.7119 8.1812 114.4212 63.6443 69.4545 174.1564 71 N 4.9683 8.1675 116.4545 53.2197 38.8047 174.5660 72 C 5.2499 7.3831 116.2769 56.6100 43.9694 172.5078 73 Y 5.1716 8.8565 118.8877 56.4329 42.0734 173.9643 74 Q 5.1644 9.2319 125.5354 54.1802 31.4201 174.9507 75 S 4.5660 8.5515 120.8562 58.6196 63.6570 174.1848 76 Y 4.4434 9.3900 121.1344 60.7360 37.8426 175.8546 77 S 4.9898 7.8713 112.1963 56.3787 65.2909 173.3865 78 T 4.3814 8.2046 112.0479 61.5164 70.0508 173.7242 79 M 5.0152 8.9649 121.1259 53.5087 37.2107 174.5897 80 S 4.8277 9.5289 117.0413 58.0995 63.4388 173.0846 81 I 5.2234 8.9752 120.4137 59.4535 41.7797 174.4173 82 T 4.9783 8.7674 118.8934 61.8854 71.8213 172.6981 83 D 4.8810 9.4137 127.8682 53.6954 42.9736 174.2303 84 C 5.4708 9.4118 124.1951 55.3498 38.6726 172.7989 85 R 5.2748 8.8132 124.6396 53.9627 32.7803 174.2522 86 E 3.9807 9.2321 128.2527 56.6709 30.1600 176.7213 87 T 4.1918 8.6344 121.3463 61.2850 68.2049 175.5946 88 G 3.6357 8.4997 113.7783 47.9001 0.0000 174.9183 89 S 4.3351 7.8350 113.0026 59.3491 63.8868 174.6461 90 S 4.0430 7.2818 116.3119 58.6933 62.6356 173.7204 91 K 4.5287 8.3719 124.8011 54.7568 35.8304 175.2241 92 Y 4.3739 8.7007 125.1765 57.5271 39.1155 174.4013 93 P 3.1605 0.0000 0.0000 63.6072 31.9329 177.1002 94 N 4.6111 7.7401 118.7603 51.7755 36.9398 172.7825 95 C 4.4145 7.9492 116.9807 56.5600 42.4416 173.2244 96 A 5.1301 8.5373 125.6889 50.3644 21.8603 174.4493 97 Y 5.1121 9.6411 118.5990 56.0551 42.3601 174.7926 98 K 4.5128 9.3944 124.0091 55.6747 34.0802 175.2193 99 T 5.0586 8.5729 124.0264 62.5796 70.2912 174.1843 100 T 4.5744 8.8873 122.7563 61.7939 71.9210 172.7232 101 Q 4.8587 8.7924 128.0540 55.2416 30.3996 174.3243 102 A 4.6792 8.9394 126.6907 51.1613 23.8237 174.5330 103 N 5.7907 8.5501 114.9324 50.7874 41.3623 174.2780 104 K 4.7652 8.3166 121.9558 54.8041 37.7277 175.2949 105 H 4.9029 8.8260 118.0930 55.7163 30.2003 174.8544 106 I 4.8646 8.5979 115.1807 59.2824 40.8350 174.4812 107 I 4.9042 8.3137 124.2642 59.7707 40.0975 175.0379 108 V 4.7569 8.5486 119.7174 59.2968 35.7937 174.4262 109 A 4.9898 8.8491 125.1130 50.9219 20.6413 175.5273 110 C 5.0679 8.7880 120.2235 55.2598 43.8037 173.2063 111 E 4.7555 8.5315 120.7423 56.2245 34.5701 176.3297 112 G 4.0852 9.3711 109.5023 45.1658 0.0000 172.2486 113 N 5.0684 8.3545 116.8725 50.9250 40.9171 172.7520 114 P 4.2644 0.0000 0.0000 62.5448 31.9200 175.6467 115 Y 4.8078 8.4239 122.3469 57.7023 38.9870 174.8834 116 V 4.5296 8.4733 119.8932 58.2405 36.6512 173.4370 117 P 4.3190 0.0000 0.0000 63.1126 30.8408 176.0856 118 V 4.2311 8.6198 123.6668 63.1528 34.0420 175.2240 119 H 5.2772 7.8904 115.7721 53.8539 33.2533 172.2084 120 F 4.8641 8.9647 124.0367 57.2370 39.6946 174.6539 121 D 4.5663 8.5581 126.9947 55.9898 42.0038 175.6635 122 A 4.6130 6.3723 117.7681 51.7593 22.3956 174.6911 123 S 5.2613 8.9055 113.1760 56.5984 65.8791 174.7438 124 V 4.1468 8.8886 121.9846 61.9647 30.9498 175.2539 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 8.30 4.31 0.00 1.77 1.95 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.39 7.81 2 E 7.73 4.46 0.00 2.12 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 2.19 2.38 0.00 3 T 8.42 4.61 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 1.22 0.00 0.00 4 A 8.41 4.02 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 5 A 7.92 3.93 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 6 A 8.01 4.06 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 7 K 8.24 3.99 0.00 1.98 2.04 0.00 1.67 0.00 0.00 1.62 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.56 7.81 8 F 8.03 4.13 0.00 3.26 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 9 E 8.35 4.02 0.00 2.36 2.04 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 2.49 2.65 0.00 10 R 7.80 3.88 0.00 2.01 1.93 0.00 3.45 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 11 Q 7.91 3.95 0.00 1.61 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.44 0.00 0.00 0.00 0.00 0.00 2.26 2.51 0.00 12 H 7.99 4.68 0.00 1.96 2.61 0.00 5.58 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.07 4.90 0.00 1.95 2.15 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 14 D 9.07 4.76 0.00 2.74 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 0.00 0.00 0.00 0.00 15 S 8.52 4.54 0.00 3.93 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 16 S 7.80 4.37 0.00 4.05 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 17 T 7.51 4.69 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 1.23 0.00 0.00 18 S 8.62 4.17 0.00 3.83 3.93 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 19 A 7.08 3.83 1.08 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 20 A 8.35 2.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.34 4.27 0.00 4.00 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 22 S 7.25 4.57 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 23 S 8.82 4.28 0.00 4.03 4.06 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 24 N 7.96 4.74 0.00 2.76 2.83 0.00 0.00 6.67 8.93 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 25 Y 8.13 4.05 0.00 3.18 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 26 C 8.42 4.13 0.00 3.12 3.08 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 27 N 8.14 4.39 0.00 2.93 2.91 0.00 0.00 7.22 7.78 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 28 Q 7.96 3.81 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.61 0.00 29 M 7.70 3.74 0.00 0.67 1.12 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.30 0.00 30 M 7.94 4.02 0.00 1.65 1.82 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.34 0.00 31 K 7.54 3.93 0.00 1.89 1.89 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.43 7.81 32 S 8.09 4.21 0.00 4.03 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 33 R 7.70 4.43 0.00 1.95 2.11 0.00 3.64 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.99 0.00 34 N 7.80 4.17 0.00 2.82 2.86 0.00 0.00 7.06 7.96 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 35 L 8.07 4.49 0.00 1.86 1.63 0.75 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.55 5.62 4.40 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 1.46 0.00 0.00 37 K 8.42 4.19 0.00 1.78 1.93 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.51 7.81 38 D 7.94 4.70 0.00 2.66 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 39 R 7.29 3.89 0.00 1.82 1.76 0.00 2.92 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 40 C 8.63 4.94 0.00 3.09 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 41 K 8.29 3.95 0.00 1.93 1.81 0.00 1.77 0.00 0.00 1.61 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.63 1.46 7.81 42 P 0.00 4.57 0.00 2.15 2.11 0.00 3.63 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 43 V 7.48 5.05 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 0.86 0.00 0.00 0.98 0.00 0.00 44 N 8.77 4.58 0.00 2.65 2.27 0.00 0.00 6.07 5.64 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 45 T 7.81 4.90 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 1.03 0.00 0.00 46 F 8.85 4.84 0.00 3.00 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 47 V 8.78 4.48 2.16 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 1.15 0.00 0.00 1.06 0.00 0.00 48 H 8.57 5.67 0.00 3.15 3.47 0.00 5.61 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.72 4.82 0.00 1.95 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 2.26 2.27 0.00 50 S 8.36 4.36 0.00 4.07 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 51 L 8.51 3.97 0.00 1.82 1.74 1.01 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.07 4.16 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 53 D 7.78 4.34 0.00 2.83 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 54 V 7.72 3.81 2.29 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 1.21 0.00 0.00 1.05 0.00 0.00 55 Q 8.60 3.91 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.30 2.53 0.00 56 A 8.00 4.05 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 57 V 7.62 3.47 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 0.98 0.00 0.00 0.94 0.00 0.00 58 C 7.66 3.77 0.00 2.83 2.64 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 0.00 0.00 0.00 0.00 59 S 7.34 4.68 0.00 3.89 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 60 Q 7.06 4.32 0.00 1.70 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 7.00 0.00 0.00 0.00 0.00 0.00 1.63 1.98 0.00 61 K 8.75 4.27 0.00 1.94 1.73 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.61 1.65 7.81 62 N 8.78 4.44 0.00 2.80 2.68 0.00 0.00 6.94 6.45 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 63 V 8.48 4.59 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 0.70 0.00 0.00 0.81 0.00 0.00 64 A 8.35 4.40 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 65 C 9.08 4.61 0.00 3.10 3.10 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 66 K 8.72 3.81 0.00 1.90 1.87 0.00 1.70 0.00 0.00 2.04 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.37 7.81 67 N 8.00 4.54 0.00 2.79 2.90 0.00 0.00 6.35 6.96 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 68 G 8.02 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 0.00 0.00 0.00 69 Q 8.13 4.25 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 70 T 8.18 4.71 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 1.20 0.00 0.00 71 N 8.17 4.97 0.00 3.05 3.11 0.00 0.00 6.08 7.95 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 72 C 7.38 5.25 0.00 2.82 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 73 Y 8.86 5.17 0.00 2.77 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 74 Q 9.23 5.16 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.94 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 75 S 8.55 4.57 0.00 4.01 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 76 Y 9.39 4.44 0.00 3.06 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 77 S 7.87 4.99 0.00 3.93 3.80 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 78 T 8.20 4.38 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 1.02 0.00 0.00 79 M 8.96 5.02 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 80 S 9.53 4.83 0.00 3.88 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 81 I 8.98 5.22 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.72 1.07 0.00 0.00 82 T 8.77 4.98 4.50 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 1.44 0.00 0.00 83 D 9.41 4.88 0.00 2.72 2.58 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 84 C 9.41 5.47 0.00 2.97 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 85 R 8.81 5.27 0.00 1.93 1.80 0.00 3.14 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 86 E 9.23 3.98 0.00 1.93 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 2.11 1.85 0.00 87 T 8.63 4.19 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 1.25 0.00 0.00 88 G 8.50 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.83 4.34 0.00 3.97 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 90 S 7.28 4.04 0.00 3.76 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 91 K 8.37 4.53 0.00 1.84 1.65 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.59 7.81 92 Y 8.70 4.37 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 93 P 0.00 3.16 0.00 1.78 1.46 0.00 3.58 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 1.85 1.77 0.00 94 N 7.74 4.61 0.00 2.79 2.71 0.00 0.00 6.83 6.99 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 95 C 7.95 4.41 0.00 3.11 3.05 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 96 A 8.54 5.13 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 97 Y 9.64 5.11 0.00 2.77 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 98 K 9.39 4.51 0.00 1.80 1.74 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.59 7.81 99 T 8.57 5.06 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 1.33 0.00 0.00 100 T 8.89 4.57 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 1.24 0.00 0.00 101 Q 8.79 4.86 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.72 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 102 A 8.94 4.68 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 0.00 103 N 8.55 5.79 0.00 2.55 2.74 0.00 0.00 7.04 7.62 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 0.00 104 K 8.32 4.77 0.00 1.71 1.71 0.00 1.71 0.00 0.00 1.88 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.49 7.81 105 H 8.83 4.90 0.00 3.16 3.23 0.00 5.77 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.60 4.86 1.80 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 1.27 0.89 1.14 0.00 0.00 107 I 8.31 4.90 1.68 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 1.15 0.75 0.83 0.00 0.00 108 V 8.55 4.76 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 0.75 0.00 0.00 0.86 0.00 0.00 109 A 8.85 4.99 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 0.00 110 C 8.79 5.07 0.00 1.85 1.70 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 0.00 111 E 8.53 4.76 0.00 1.84 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 2.28 2.24 0.00 112 G 9.37 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 0.00 113 N 8.35 5.07 0.00 2.65 2.72 0.00 0.00 6.74 8.00 0.00 0.00 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 P 0.00 4.26 0.00 2.18 2.06 0.00 3.77 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.42 4.81 0.00 2.78 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 0.00 116 V 8.47 4.53 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 0.73 0.00 0.00 0.88 0.00 0.00 117 P 0.00 4.32 0.00 0.51 1.55 0.00 3.46 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.65 0.00 118 V 8.62 4.23 1.89 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 0.57 0.00 0.00 0.88 0.00 0.00 119 H 7.89 5.28 0.00 3.10 3.17 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.96 4.86 0.00 2.65 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 0.00 121 D 8.56 4.57 0.00 2.58 2.60 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 0.00 122 A 6.37 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 0.00 123 S 8.91 5.26 0.00 3.97 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 0.00 124 V 8.89 4.15 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 0.69 0.00 0.00 0.94 0.00 0.00