NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 S 4.5466 8.3301 115.2863 57.9855 62.5918 173.1597 8 A 3.9335 9.2969 133.0687 53.3858 18.4669 176.6712 9 T 4.4474 7.7496 105.0017 61.8282 70.8258 172.5403 10 I 4.5462 8.4840 116.4046 59.1030 40.6815 174.0430 11 K 4.9695 8.5341 125.3666 55.4108 33.1402 175.8470 12 V 4.7946 8.6208 120.2731 59.8280 35.2758 174.6022 13 T 4.8898 8.4606 111.6511 59.1195 71.8482 174.8012 14 D 4.4091 9.2899 122.0569 57.0044 40.4121 179.1588 15 A 4.0726 7.9789 119.7788 54.6909 18.7397 178.8154 16 S 4.4515 8.0788 110.9396 59.1663 63.6495 176.0414 17 F 3.8419 8.0242 125.3674 61.3716 39.0533 176.6903 18 A 3.9821 8.0221 119.8236 55.4511 18.0776 179.6975 19 T 3.8780 7.5638 111.6940 66.4193 68.9105 175.9494 20 D 4.3529 8.2738 120.2450 56.5590 40.8153 176.7174 21 V 3.8563 6.9994 115.4816 64.2587 33.3451 177.4312 22 L 3.8148 7.5144 119.2040 57.4740 41.6160 178.6166 23 S 4.4230 8.1252 111.3662 58.4373 63.7035 174.0785 24 S 4.2301 7.3052 116.6329 58.3853 62.7709 173.5246 25 N 4.4117 8.7434 125.9217 56.4377 39.0645 175.6053 26 K 4.1864 7.1587 117.8987 55.2794 33.0292 174.5040 27 P 4.6250 0.0000 0.0000 62.7420 32.8132 175.2028 28 V 4.7490 8.4825 123.4272 61.0414 34.2503 173.8540 29 L 4.9475 9.1176 131.0339 53.9626 43.6793 175.0001 30 V 4.6075 9.0713 127.4867 61.4244 33.7874 173.8564 31 D 4.9027 9.1486 128.3575 52.8237 42.3523 175.1234 32 F 5.1333 9.2093 126.9922 56.3784 40.1159 175.2447 33 W 5.2343 8.8833 120.3022 54.6321 31.8539 173.8303 34 A 4.4317 8.1476 119.6388 49.9334 21.3024 177.7316 35 T 3.9292 7.4976 115.3755 65.5721 68.8596 175.6815 36 W 4.7377 6.4520 116.9453 57.8436 30.0375 176.7114 37 C 4.8684 6.7749 120.6616 58.5197 29.5712 173.5469 38 G 3.9175 8.1702 109.8763 45.8212 0.0000 171.0533 39 P 4.4221 0.0000 0.0000 64.1392 31.5118 176.8935 40 S 4.8280 8.4144 112.9306 57.8037 63.2246 174.7068 41 K 4.5101 7.7434 116.4429 56.6212 34.1785 178.0475 42 M 4.2040 7.4728 119.1884 58.2509 32.3447 178.9511 43 V 3.7214 7.7740 111.5350 63.8248 31.6820 177.9819 44 A 3.9102 7.4608 119.6694 54.8036 17.6410 177.8987 45 P 4.1715 0.0000 0.0000 65.6128 31.5798 179.0308 46 V 3.6047 7.6755 116.6895 65.9353 31.5165 177.9391 47 L 4.0052 7.7985 118.4128 57.6880 41.5255 179.0804 48 E 3.9200 8.0511 118.8889 59.1803 29.4558 178.7921 49 E 3.9589 7.8891 118.0572 59.4587 29.4621 179.3587 50 I 3.6264 7.6696 119.1989 64.2665 36.9155 178.3947 51 A 3.9746 7.9003 120.6420 55.3668 18.2775 179.6507 52 T 3.9670 7.5566 112.8499 66.9610 68.6891 176.7184 53 E 4.1668 8.6653 119.5734 58.2111 30.1191 177.9623 54 R 4.6515 8.3167 118.2814 55.1600 31.0547 177.7988 55 A 4.0384 8.2743 122.7337 55.5326 18.8405 179.9197 56 T 4.0355 7.8889 104.8912 64.9023 69.1803 175.5281 57 D 4.4910 8.1429 121.1636 56.6977 41.0602 175.8816 58 L 4.7602 7.7515 115.9181 55.1018 43.9284 174.8166 59 T 4.5872 8.8654 117.0286 62.0024 71.0607 173.8234 60 V 4.8381 8.3148 124.8563 61.1301 34.0012 174.1257 61 A 5.3316 9.3757 129.0826 50.0207 22.9683 174.6470 62 K 5.0315 8.8395 118.4907 54.4793 35.7787 175.1509 63 L 4.8859 8.8605 126.8624 53.0146 45.1298 174.7750 64 D 3.5633 8.4277 126.7666 53.4790 41.0034 177.0787 65 V 3.6346 8.2269 121.2337 64.4074 32.1683 179.0048 66 D 4.3412 8.0256 120.5176 57.3127 40.6699 177.6165 67 T 4.2220 7.5402 106.1254 62.6426 69.9963 174.3339 68 N 5.2622 8.1306 119.1483 49.4814 39.1307 173.4186 69 P 4.5210 0.0000 0.0000 65.1181 31.9750 178.6000 70 E 3.9152 8.0573 118.1338 59.7420 29.0203 179.2394 71 T 3.8045 7.9618 115.0269 66.4089 68.3461 176.6943 72 A 3.9654 7.5782 122.9038 55.1184 18.4218 179.7197 73 R 3.7742 7.7583 117.3194 59.5675 29.9418 178.4487 74 N 4.1124 7.6744 114.7717 56.1316 38.5592 175.8377 75 F 4.6288 7.7512 113.8852 56.5590 39.4726 176.0009 76 Q 3.2773 7.6762 118.2760 56.8830 26.2703 174.8730 77 V 3.7297 7.8935 116.6573 62.5997 32.0919 175.7365 78 V 4.4019 8.3025 118.9500 61.2016 32.9589 175.5779 79 S 4.7702 7.6856 114.5230 56.8721 66.8364 173.1452 80 I 4.5990 8.1668 123.2182 58.7845 40.0840 173.8133 81 P 4.9809 0.0000 0.0000 62.3043 33.3092 175.0820 82 T 4.8728 8.5607 117.0494 61.8821 72.5243 172.5215 83 L 5.4661 9.0295 126.0160 53.0597 44.6838 175.4139 84 I 4.8607 8.6383 124.1138 59.3291 40.5784 174.2204 85 L 4.8442 8.6181 129.5564 54.1462 43.6882 174.9801 86 F 5.2077 9.3167 125.9650 55.8136 41.4732 174.7857 87 K 4.6173 8.7611 124.6124 54.9649 35.1832 175.8092 88 D 4.6044 10.0189 127.8051 55.4778 38.3958 174.9253 89 G 4.0435 8.6525 105.6358 45.5447 0.0000 174.0017 90 Q 4.7631 7.8939 118.7093 53.2999 30.9989 173.3362 91 P 4.2287 0.0000 0.0000 62.0959 31.0582 175.8441 92 V 4.1869 8.0817 117.1478 61.5939 33.0130 176.5270 93 K 4.6138 7.5935 121.2276 54.8453 35.8079 174.6739 94 R 5.0654 8.5827 124.9865 54.4168 33.3254 174.6983 95 I 4.4959 9.1980 124.8980 59.4701 40.1216 174.5238 96 V 4.4358 8.7623 127.1581 62.0867 33.4933 174.7233 97 G 3.9008 8.4539 115.7448 45.6369 0.0000 173.2133 98 A 4.1264 8.3694 126.7077 52.1972 19.0726 176.3845 99 K 4.6723 8.2053 121.0687 53.5336 35.9076 176.8055 100 G 3.8348 8.3000 109.2142 44.0726 0.0000 174.6897 101 K 3.9121 8.5845 122.3027 59.3388 32.2547 179.1100 102 A 3.9720 7.9678 120.2705 55.1466 18.3975 179.3312 103 A 3.9566 7.9191 118.8599 55.0731 18.5443 179.4647 104 L 3.8933 8.0611 118.9172 58.3784 42.0737 179.2868 105 L 4.0306 7.8862 118.7486 57.5937 41.2585 179.4929 106 R 3.8922 7.7240 118.1466 59.4527 29.8524 178.1669 107 E 4.1159 8.1747 118.4319 59.4417 29.3887 179.3748 108 L 4.0847 7.9883 119.1737 57.4372 41.5400 179.3979 109 S 4.9028 7.8465 115.0980 60.3483 62.6632 176.1254 110 D 4.3315 7.6464 121.9827 56.7416 40.5960 177.6885 111 V 4.3873 7.6868 116.1889 62.1787 34.0221 175.3778 112 V 4.2983 7.8406 118.6200 59.5761 31.6616 173.6089 113 P 4.6300 0.0000 0.0000 64.3040 31.6831 178.6577 114 N 4.4119 8.1586 114.6432 56.0271 38.6817 176.1932 115 L 4.1285 7.8827 117.3469 57.5264 42.0109 176.4493 116 N 4.4417 8.0629 120.6765 53.9576 39.1115 173.5919 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 7 S 8.33 4.55 0.00 3.82 3.87 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 8 A 9.30 3.93 1.27 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 0.00 0.00 9 T 7.75 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 10 I 8.48 4.55 1.85 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 1.20 0.87 0.89 0.00 0.00 11 K 8.53 4.97 0.00 1.82 1.77 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.52 7.81 12 V 8.62 4.79 2.19 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 0.74 0.00 0.00 1.08 0.00 0.00 13 T 8.46 4.89 4.34 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 1.23 0.00 0.00 14 D 9.29 4.41 0.00 2.72 2.75 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 15 A 7.98 4.07 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 16 S 8.08 4.45 0.00 4.13 4.14 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 17 F 8.02 3.84 0.00 3.36 3.13 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 18 A 8.02 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 19 T 7.56 3.88 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 1.18 0.00 0.00 20 D 8.27 4.35 0.00 2.57 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 21 V 7.00 3.86 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 0.00 0.00 -0.04 0.00 0.00 0.04 0.00 0.00 22 L 7.51 3.81 0.00 1.77 1.69 1.11 0.61 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 23 S 8.13 4.42 0.00 3.97 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 24 S 7.31 4.23 0.00 3.79 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 25 N 8.74 4.41 0.00 2.69 2.81 0.00 0.00 7.02 6.68 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 26 K 7.16 4.19 0.00 1.73 1.67 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.40 7.81 27 P 0.00 4.63 0.00 2.12 1.96 0.00 3.74 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 2.11 2.09 0.00 28 V 8.48 4.75 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 0.88 0.00 0.00 0.86 0.00 0.00 29 L 9.12 4.95 0.00 1.78 1.54 0.95 0.73 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 30 V 9.07 4.61 2.39 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 0.35 0.00 0.00 0.97 0.00 0.00 31 D 9.15 4.90 0.00 2.82 2.71 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 32 F 9.21 5.13 0.00 3.12 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 33 W 8.88 5.23 0.00 3.54 3.28 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 34 A 8.15 4.43 0.03 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 35 T 7.50 3.93 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 1.36 0.00 0.00 36 W 6.45 4.74 0.00 3.42 3.26 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 37 C 6.77 4.87 0.00 2.60 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 38 G 8.17 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 39 P 0.00 4.42 0.00 2.12 2.16 0.00 3.73 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 2.11 2.13 0.00 40 S 8.41 4.83 0.00 3.93 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 41 K 7.74 4.51 0.00 1.67 1.57 0.00 1.82 0.00 0.00 2.02 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 42 M 7.47 4.20 0.00 2.03 2.13 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 2.64 2.87 0.00 43 V 7.77 3.72 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 0.94 0.00 0.00 0.92 0.00 0.00 44 A 7.46 3.91 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 45 P 0.00 4.17 0.00 2.14 2.07 0.00 3.64 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 2.07 2.08 0.00 46 V 7.68 3.60 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 1.06 0.00 0.00 0.92 0.00 0.00 47 L 7.80 4.01 0.00 1.89 1.67 0.91 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.05 3.92 0.00 2.05 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 0.00 2.27 2.37 0.00 49 E 7.89 3.96 0.00 2.06 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 2.31 2.56 0.00 50 I 7.67 3.63 1.99 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 1.45 0.71 0.90 0.00 0.00 51 A 7.90 3.97 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 52 T 7.56 3.97 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 1.20 0.00 0.00 53 E 8.67 4.17 0.00 1.97 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 0.00 2.34 2.46 0.00 54 R 8.32 4.65 0.00 1.77 2.05 0.00 3.29 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 1.69 1.66 0.00 55 A 8.27 4.04 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 56 T 7.89 4.04 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 57 D 8.14 4.49 0.00 2.85 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 58 L 7.75 4.76 0.00 1.80 1.59 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.87 4.59 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 1.17 0.00 0.00 60 V 8.31 4.84 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 0.97 0.00 0.00 0.92 0.00 0.00 61 A 9.38 5.33 1.14 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 0.00 0.00 62 K 8.84 5.03 0.00 1.88 1.89 0.00 1.53 0.00 0.00 1.51 0.00 0.00 2.58 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.15 1.30 7.81 63 L 8.86 4.89 0.00 1.49 1.09 0.92 0.86 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 64 D 8.43 3.56 0.00 2.11 2.21 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 65 V 8.23 3.63 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 0.92 0.00 0.00 0.83 0.00 0.00 66 D 8.03 4.34 0.00 2.71 2.71 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 67 T 7.54 4.22 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 1.20 0.00 0.00 68 N 8.13 5.26 0.00 2.74 2.93 0.00 0.00 7.01 8.19 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 69 P 0.00 4.52 0.00 2.25 2.30 0.00 3.91 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.90 0.00 70 E 8.06 3.92 0.00 2.27 1.99 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 2.37 2.32 0.00 71 T 7.96 3.80 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 0.63 0.00 0.00 72 A 7.58 3.97 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 73 R 7.76 3.77 0.00 1.91 1.88 0.00 3.07 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 74 N 7.67 4.11 0.00 2.63 2.31 0.00 0.00 7.04 8.31 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 75 F 7.75 4.63 0.00 2.96 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 76 Q 7.68 3.28 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 77 V 7.89 3.73 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 0.65 0.00 0.00 -0.02 0.00 0.00 78 V 8.30 4.40 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 0.85 0.00 0.00 0.92 0.00 0.00 79 S 7.69 4.77 0.00 3.81 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 80 I 8.17 4.60 1.84 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.75 0.95 0.00 0.00 81 P 0.00 4.98 0.00 2.18 2.24 0.00 3.84 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.87 0.00 82 T 8.56 4.87 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 1.19 0.00 0.00 83 L 9.03 5.47 0.00 1.60 1.61 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.64 4.86 1.93 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.78 0.44 0.00 0.00 85 L 8.62 4.84 0.00 1.75 1.47 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 86 F 9.32 5.21 0.00 3.07 2.82 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 87 K 8.76 4.62 0.00 1.79 1.63 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.40 7.81 88 D 10.02 4.60 0.00 2.87 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 89 G 8.65 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 90 Q 7.89 4.76 0.00 2.35 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 91 P 0.00 4.23 0.00 1.94 1.40 0.00 3.91 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.20 0.00 92 V 8.08 4.19 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 0.63 0.00 0.00 0.96 0.00 0.00 93 K 7.59 4.61 0.00 1.78 1.52 0.00 1.52 0.00 0.00 1.80 0.00 0.00 3.05 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.50 7.81 94 R 8.58 5.07 0.00 1.65 1.75 0.00 3.17 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.55 0.00 95 I 9.20 4.50 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.82 0.92 0.00 0.00 96 V 8.76 4.44 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 0.80 0.00 0.00 0.94 0.00 0.00 97 G 8.45 3.90 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 0.00 0.00 0.00 98 A 8.37 4.13 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 99 K 8.21 4.67 0.00 1.65 1.64 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.46 7.81 100 G 8.30 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 0.00 0.00 0.00 101 K 8.58 3.91 0.00 1.82 1.82 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.51 7.81 102 A 7.97 3.97 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 0.00 103 A 7.92 3.96 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 0.00 104 L 8.06 3.89 0.00 1.86 1.93 0.93 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.89 4.03 0.00 1.93 1.70 0.92 0.73 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 0.00 106 R 7.72 3.89 0.00 1.97 2.07 0.00 3.26 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 107 E 8.17 4.12 0.00 2.25 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 2.33 2.46 0.00 108 L 7.99 4.08 0.00 1.86 1.71 0.92 0.82 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 0.00 109 S 7.85 4.90 0.00 4.02 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 0.00 110 D 7.65 4.33 0.00 2.87 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 0.00 111 V 7.69 4.39 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 0.85 0.00 0.00 0.92 0.00 0.00 112 V 7.84 4.30 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 0.95 0.00 0.00 0.93 0.00 0.00 113 P 0.00 4.63 0.00 2.21 2.09 0.00 3.93 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 114 N 8.16 4.41 0.00 2.69 2.97 0.00 0.00 6.94 7.85 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 0.00 115 L 7.88 4.13 0.00 1.63 1.73 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 116 N 8.06 4.44 0.00 2.64 2.61 0.00 0.00 7.08 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00