NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3292 8.3001 120.3300 55.4533 32.2302 174.5347 2 A 4.4490 8.0980 127.5547 49.3565 21.2898 174.4960 3 Y 3.9352 9.5886 120.1852 59.6057 39.5546 173.8634 4 S 3.6451 8.1375 114.7781 59.0625 59.4791 171.3885 5 E 4.4370 8.3639 122.9258 54.5787 27.5534 177.0850 6 K 4.4142 7.3505 124.2076 56.4513 33.6461 175.6654 7 V 4.2167 7.7329 111.1140 61.2081 34.6602 175.5561 8 I 3.2318 8.0805 122.4567 61.8377 33.3396 172.7377 9 D 5.0352 7.8614 121.0632 51.7238 41.9996 176.7378 10 H 4.8805 8.1196 114.9650 55.1637 29.8127 173.9251 11 Y 4.1268 8.6749 122.8458 57.1981 36.4227 174.8635 12 E 3.8269 8.8373 122.8256 56.8015 28.7424 173.7534 13 N 4.1657 7.6441 111.9882 52.8775 35.6229 172.0007 14 P 4.6470 0.0000 0.0000 62.4349 33.3591 177.6690 15 R 4.4503 7.7995 113.9578 55.7044 30.4717 175.0898 16 N 4.1193 8.1598 120.5952 53.9356 36.3997 175.6555 17 V 3.6506 7.4234 116.3582 62.7010 32.6302 176.8316 18 G 3.9100 9.5869 112.1257 46.5687 0.0000 172.4173 19 S 4.8495 7.5711 111.5625 56.3553 66.0029 173.0242 20 F 4.3584 8.3049 121.9671 57.6914 39.1990 174.3902 21 D 4.0327 8.7484 121.0498 54.5059 37.2010 174.0476 22 N 4.0734 8.3434 122.6798 52.6223 39.0986 172.8546 23 N 4.7954 8.3556 116.0538 52.9822 39.7826 174.2908 24 D 4.7882 7.9467 114.8690 54.0998 41.9998 175.7171 25 E 3.8462 8.8093 113.2908 56.2582 27.2617 174.2474 26 N 4.8807 7.4228 112.8792 52.5161 39.3384 173.5660 27 V 4.5288 8.3018 119.4301 61.9482 33.8239 174.6155 28 G 4.3064 8.1482 114.5865 44.6755 0.0000 172.3238 29 S 5.0063 8.7012 119.1003 56.3361 66.4545 173.2979 30 G 4.6379 8.5807 110.2968 43.5994 0.0000 171.0545 31 M 5.5266 8.6438 125.4480 52.7330 34.8413 175.0308 32 V 4.6261 8.3326 117.7334 60.1413 36.6855 174.3312 33 G 4.5265 8.4364 108.5432 45.1692 0.0000 171.5756 34 A 4.9392 8.2757 119.8282 49.7858 22.3616 175.9160 35 P 4.0971 0.0000 0.0000 65.9060 31.7021 178.0318 36 A 4.1849 7.8604 120.3552 53.8436 18.8155 177.9976 37 C 4.1229 8.2500 115.5167 60.3026 32.4365 173.4558 38 G 3.9264 7.7786 106.9939 45.3387 0.0000 170.6805 39 A 4.5531 7.0285 118.2373 51.5425 23.4779 176.7003 40 V 4.7024 8.0542 118.6118 61.9637 35.2160 174.2599 41 M 4.5746 9.4931 128.0845 53.9255 33.9151 174.9068 42 K 5.1067 8.6100 123.8882 54.5266 34.8309 175.5483 43 L 5.1735 8.5764 124.3621 53.1406 46.2303 175.7734 44 Q 4.8049 9.1312 121.0874 54.5786 31.6653 174.4833 45 I 4.9905 7.8217 112.5882 59.7612 41.9600 173.8158 46 K 4.3852 8.8651 123.6027 54.9323 34.9131 174.9435 47 V 4.6589 7.7833 127.4798 61.1808 34.1273 175.0667 48 N 4.8945 7.8761 122.7080 51.2502 39.9099 175.0264 49 D 4.5139 8.7952 117.0225 58.1051 41.0454 177.7256 50 E 4.0420 8.6787 116.7855 60.3404 29.3628 178.5587 51 G 4.3959 7.5615 106.5754 46.0519 0.0000 172.9799 52 I 4.6414 7.7727 119.2107 58.6524 40.3295 175.0297 53 I 4.2214 8.7084 125.8781 61.7210 37.1252 176.0521 54 E 4.5040 9.0250 128.3696 56.5011 31.6274 175.6256 55 D 4.9669 7.7947 117.4897 52.4278 45.6600 174.5421 56 A 4.9413 8.5100 122.6966 50.7879 22.1039 175.5312 57 R 4.8143 8.7108 121.6531 54.7427 34.4397 174.7450 58 F 5.1694 7.4164 114.2113 56.0994 41.1974 173.4601 59 K 4.8973 8.6398 120.5051 54.9145 35.0345 176.0222 60 T 4.3784 8.4529 119.4437 63.6749 68.8083 174.3187 61 Y 4.4347 8.1489 120.3626 60.4627 41.0659 171.2996 62 G 3.9434 8.4280 112.4129 43.3986 0.0000 171.0049 63 C 4.2547 8.2479 124.4622 58.9103 31.2827 173.0596 64 G 3.9344 7.8863 115.4625 45.5270 0.0000 171.1369 65 S 4.2773 8.3088 115.4178 57.3948 63.4113 174.1364 66 A 3.8896 8.4772 124.4403 52.9067 17.9014 178.1382 67 I 3.9607 8.3424 124.4356 61.3384 38.0273 176.8016 68 A 3.8676 8.5619 127.8122 54.4381 18.5136 179.0161 69 S 4.0383 8.1205 112.5679 61.5723 62.7442 176.8721 70 S 4.1844 7.8222 118.0350 61.3590 62.6490 176.5608 71 S 4.1528 7.3020 118.3998 60.1896 62.2986 176.5968 72 L 3.9489 8.0594 123.7762 58.1603 42.0393 179.2673 73 V 3.8978 7.5606 112.3354 64.1876 31.4617 178.8758 74 T 3.9235 7.8866 110.2563 64.8555 68.6670 176.7444 75 E 4.0381 7.6238 118.8008 58.0104 29.5324 178.7978 76 W 4.5226 7.7390 119.4655 59.8842 29.6256 178.7648 77 V 4.1143 8.0426 112.1693 63.0957 31.1049 175.6561 78 K 4.1696 7.7141 117.6627 59.5216 30.3272 176.5033 79 G 4.0815 8.7331 110.9613 44.7864 0.0000 171.4526 80 K 4.5226 8.3390 121.1893 54.1816 34.5736 175.9099 81 S 4.6693 8.1425 117.7620 57.3696 63.9698 174.9364 82 L 4.0541 8.0750 121.1560 57.9929 40.9496 179.5906 83 D 4.3421 7.9589 117.1425 57.2266 41.1732 178.0297 84 E 4.0335 8.2158 118.3873 59.5684 29.6706 179.1233 85 A 3.9579 7.8099 119.9104 55.3012 18.3215 179.2588 86 Q 4.0446 7.9506 115.7143 58.1814 29.1950 177.3046 87 A 4.1926 7.6669 120.4625 53.1644 19.3085 177.7928 88 I 3.5376 6.6958 117.4715 61.8732 37.9130 175.4384 89 K 4.6239 8.2199 122.9620 54.0963 34.6901 176.7928 90 N 4.2501 9.1290 120.9657 56.7861 36.8369 176.9611 91 T 3.8681 8.0240 114.4441 65.4293 67.3486 175.4442 92 D 4.3757 8.4187 121.0070 57.3219 40.8819 178.6677 93 I 3.9375 7.6313 119.3726 63.5360 37.2086 178.2509 94 A 4.0109 8.2957 122.5976 55.2823 18.1635 179.3922 95 E 4.1321 7.9263 114.7198 58.5257 29.6586 178.9693 96 E 4.2005 7.9167 118.1828 58.8040 29.7337 177.7750 97 L 4.5074 7.2488 113.7287 53.5272 43.3825 176.1070 98 E 3.8557 8.0474 117.6249 56.8834 27.0399 174.5471 99 L 4.1522 7.5445 117.8915 54.0023 43.2327 176.2107 100 P 4.4985 0.0000 0.0000 61.9582 31.9147 175.5685 101 P 4.3878 0.0000 0.0000 64.3866 31.4454 177.5730 102 V 3.6728 7.0502 118.6754 65.6039 32.0018 176.5730 103 K 4.6266 7.4609 119.6832 53.1543 32.3544 176.1960 104 I 3.9477 7.9446 123.7174 64.4350 37.4070 176.7204 105 H 4.4762 8.4269 118.4049 59.4363 29.2563 176.5207 106 C 4.1881 8.3759 117.8068 62.2642 27.9735 175.2018 107 S 4.3707 8.4928 115.1271 60.6571 62.2236 176.0643 108 I 3.7572 7.6290 122.6079 64.0709 36.7031 178.2585 109 L 4.0486 7.8124 119.1834 57.1367 41.5008 179.1211 110 A 3.9775 7.6279 121.5603 55.0254 18.5464 179.2769 111 E 4.1654 8.0835 115.1279 58.8803 29.9598 178.3994 112 D 4.5013 7.9792 119.6359 56.5775 41.0835 178.5627 113 A 4.0200 8.3063 122.1748 55.0273 18.3497 179.6322 114 I 3.6939 7.3966 110.3653 64.1000 37.5315 178.3885 115 K 3.9303 7.7792 120.0311 59.1454 32.1539 178.5168 116 A 4.0361 7.8943 120.9536 55.0835 18.1641 179.4978 117 A 4.6167 7.6735 120.5038 54.7429 18.2643 179.8896 118 I 3.7719 7.6881 117.6668 64.3994 37.0140 178.1632 119 A 4.2025 7.9603 120.4381 54.4910 18.0617 178.8940 120 D 4.4929 7.6726 116.4840 57.0177 40.9338 178.3166 121 Y 4.2853 8.0227 120.1678 60.8619 38.8089 178.1330 122 K 3.5752 7.6009 117.8173 59.2024 31.6186 179.0943 123 S 4.2316 7.6169 113.8075 60.4873 62.6341 176.3859 124 K 3.8926 8.1893 121.3963 58.0447 31.9720 178.2590 125 R 4.4344 7.5642 113.3731 56.4643 30.4456 177.3708 126 E 4.3683 7.7131 119.0825 57.2142 29.8587 176.0083 127 A 4.4932 6.9477 120.2304 50.5094 20.0038 175.7133 128 K 4.0148 8.2995 121.1866 58.0189 32.1568 174.9473 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 M 8.30 4.33 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.62 0.00 2 A 8.10 4.45 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 3 Y 9.59 3.94 0.00 2.91 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 4 S 8.14 3.65 0.00 3.99 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 5 E 8.36 4.44 0.00 2.00 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 2.49 2.40 0.00 6 K 7.35 4.41 0.00 1.72 1.77 0.00 1.45 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.16 1.26 7.81 7 V 7.73 4.22 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 0.68 0.00 0.00 0.89 0.00 0.00 8 I 8.08 3.23 1.90 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 0.38 0.95 0.00 0.00 9 D 7.86 5.04 0.00 2.76 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 10 H 8.12 4.88 0.00 3.28 3.30 0.00 5.51 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.67 4.13 0.00 3.10 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 12 E 8.84 3.83 0.00 2.15 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 2.22 2.34 0.00 13 N 7.64 4.17 0.00 2.95 2.86 0.00 0.00 6.90 7.92 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 14 P 0.00 4.65 0.00 2.20 2.15 0.00 3.79 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 15 R 7.80 4.45 0.00 1.75 1.85 0.00 3.34 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 16 N 8.16 4.12 0.00 2.79 2.81 0.00 0.00 7.26 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 17 V 7.42 3.65 2.03 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 0.74 0.00 0.00 0.81 0.00 0.00 18 G 9.59 3.91 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 0.00 0.00 0.00 19 S 7.57 4.85 0.00 3.92 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 20 F 8.30 4.36 0.00 3.18 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 21 D 8.75 4.03 0.00 2.79 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.34 4.07 0.00 2.84 2.84 0.00 0.00 7.30 7.80 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 23 N 8.36 4.80 0.00 2.78 2.78 0.00 0.00 6.52 8.07 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 24 D 7.95 4.79 0.00 2.72 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 25 E 8.81 3.85 0.00 2.19 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 2.23 2.30 0.00 26 N 7.42 4.88 0.00 2.81 3.06 0.00 0.00 6.30 7.76 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 27 V 8.30 4.53 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 0.87 0.00 0.00 0.83 0.00 0.00 28 G 8.15 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 0.00 0.00 0.00 0.00 29 S 8.70 5.01 0.00 3.75 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 30 G 8.58 4.64 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 31 M 8.64 5.53 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 32 V 8.33 4.63 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 0.68 0.00 0.00 0.99 0.00 0.00 33 G 8.44 4.53 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 0.00 0.00 0.00 34 A 8.28 4.94 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 35 P 0.00 4.10 0.00 2.21 2.21 0.00 3.79 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 2.00 1.98 0.00 36 A 7.86 4.18 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 37 C 8.25 4.12 0.00 2.99 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 38 G 7.78 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 0.00 0.00 0.00 39 A 7.03 4.55 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 40 V 8.05 4.70 2.38 0.00 0.00 0.00 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 1.08 0.00 0.00 41 M 9.49 4.57 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 42 K 8.61 5.11 0.00 1.64 1.66 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.68 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.40 1.27 7.81 43 L 8.58 5.17 0.00 1.57 1.55 0.98 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 9.13 4.80 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.65 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 45 I 7.82 4.99 1.80 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.74 0.91 0.00 0.00 46 K 8.87 4.39 0.00 1.50 1.37 0.00 1.33 0.00 0.00 1.43 0.00 0.00 2.57 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.95 0.74 7.81 47 V 7.78 4.66 0.69 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 1.00 0.00 0.00 0.57 0.00 0.00 48 N 7.88 4.89 0.00 3.00 2.92 0.00 0.00 7.24 7.98 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 49 D 8.80 4.51 0.00 2.71 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 50 E 8.68 4.04 0.00 2.17 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 2.33 2.41 0.00 51 G 7.56 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 0.00 0.00 0.00 0.00 52 I 7.77 4.64 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.53 0.94 0.00 0.00 53 I 8.71 4.22 2.21 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 1.21 1.29 0.95 0.00 0.00 54 E 9.03 4.50 0.00 1.90 1.85 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 2.20 2.37 0.00 55 D 7.79 4.97 0.00 2.32 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 0.00 0.00 0.00 0.00 56 A 8.51 4.94 1.22 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 0.00 0.00 0.00 57 R 8.71 4.81 0.00 1.71 1.94 0.00 3.20 0.00 0.00 2.91 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 58 F 7.42 5.17 0.00 3.18 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 59 K 8.64 4.90 0.00 1.66 1.73 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.74 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.48 7.81 60 T 8.45 4.38 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 1.26 0.00 0.00 61 Y 8.15 4.43 0.00 3.01 2.86 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 62 G 8.43 3.94 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 0.00 0.00 0.00 63 C 8.25 4.25 0.00 2.91 2.86 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 64 G 7.89 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 0.00 0.00 0.00 65 S 8.31 4.28 0.00 3.88 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 66 A 8.48 3.89 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 67 I 8.34 3.96 1.85 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 1.67 1.11 0.95 0.00 0.00 68 A 8.56 3.87 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 69 S 8.12 4.04 0.00 4.06 4.15 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 0.00 0.00 0.00 0.00 70 S 7.82 4.18 0.00 3.79 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 71 S 7.30 4.15 0.00 3.69 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 72 L 8.06 3.95 0.00 1.78 1.74 1.04 1.31 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 73 V 7.56 3.90 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 0.90 0.00 0.00 1.05 0.00 0.00 74 T 7.89 3.92 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 1.40 0.00 0.00 75 E 7.62 4.04 0.00 1.98 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 2.41 2.08 0.00 76 W 7.74 4.52 0.00 3.53 3.15 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 0.00 0.00 0.00 0.00 77 V 8.04 4.11 2.12 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 0.83 0.00 0.00 1.07 0.00 0.00 78 K 7.71 4.17 0.00 2.03 1.82 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.19 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.43 7.81 79 G 8.73 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 80 K 8.34 4.52 0.00 2.14 1.69 0.00 1.65 0.00 0.00 2.04 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.41 7.81 81 S 8.14 4.67 0.00 3.91 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 82 L 8.07 4.05 0.00 1.78 1.75 1.03 1.36 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 83 D 7.96 4.34 0.00 2.62 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 84 E 8.22 4.03 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 2.40 2.41 0.00 85 A 7.81 3.96 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 86 Q 7.95 4.04 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 87 A 7.67 4.19 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 88 I 6.70 3.54 1.89 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.71 0.78 0.00 0.00 89 K 8.22 4.62 0.00 1.77 1.64 0.00 1.60 0.00 0.00 1.86 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.41 7.81 90 N 9.13 4.25 0.00 2.91 3.31 0.00 0.00 5.86 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 91 T 8.02 3.87 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 1.24 0.00 0.00 92 D 8.42 4.38 0.00 2.90 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 93 I 7.63 3.94 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.77 0.93 0.00 0.00 94 A 8.30 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.93 4.13 0.00 2.01 2.03 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 2.48 2.49 0.00 96 E 7.92 4.20 0.00 2.17 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 0.00 2.49 2.70 0.00 97 L 7.25 4.51 0.00 1.74 1.66 0.97 0.95 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 98 E 8.05 3.86 0.00 2.10 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 2.26 2.36 0.00 99 L 7.54 4.15 0.00 1.62 1.62 0.93 1.14 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 0.00 100 P 0.00 4.50 0.00 2.22 2.18 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 101 P 0.00 4.39 0.00 2.20 2.22 0.00 3.79 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 1.95 0.00 102 V 7.05 3.67 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 0.70 0.00 0.00 0.94 0.00 0.00 103 K 7.46 4.63 0.00 1.82 1.62 0.00 1.70 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.55 7.81 104 I 7.94 3.95 1.89 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 1.53 0.66 0.93 0.00 0.00 105 H 8.43 4.48 0.00 3.23 3.34 0.00 5.87 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 C 8.38 4.19 0.00 3.12 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 0.00 107 S 8.49 4.37 0.00 3.84 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 0.00 108 I 7.63 3.76 1.99 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 1.58 0.91 0.92 0.00 0.00 109 L 7.81 4.05 0.00 1.64 1.69 0.85 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 110 A 7.63 3.98 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 0.00 111 E 8.08 4.17 0.00 2.18 2.20 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 2.37 2.59 0.00 112 D 7.98 4.50 0.00 2.90 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 0.00 113 A 8.31 4.02 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 0.00 114 I 7.40 3.69 1.89 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 1.55 0.74 1.00 0.00 0.00 115 K 7.78 3.93 0.00 2.01 1.99 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.60 7.81 116 A 7.89 4.04 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 0.00 117 A 7.67 4.62 1.39 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 0.00 0.00 118 I 7.69 3.77 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.34 1.01 0.00 0.00 119 A 7.96 4.20 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 0.00 120 D 7.67 4.49 0.00 3.21 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 0.00 121 Y 8.02 4.29 0.00 3.00 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 0.00 122 K 7.60 3.58 0.00 1.79 1.71 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.66 7.81 123 S 7.62 4.23 0.00 4.08 3.89 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 0.00 124 K 8.19 3.89 0.00 1.94 1.93 0.00 1.72 0.00 0.00 1.79 0.00 0.00 3.31 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.73 1.71 7.81 125 R 7.56 4.43 0.00 1.83 1.90 0.00 2.97 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.73 0.00 126 E 7.71 4.37 0.00 2.00 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 0.00 2.27 2.44 0.00 127 A 6.95 4.49 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 0.00 128 K 8.30 4.01 0.00 1.66 1.60 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.24 1.34 7.81