NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3377 8.0333 117.3317 63.4615 70.6432 172.7472 2 E 4.6350 8.8363 126.1235 54.9464 29.3648 174.8351 3 L 4.4584 8.7041 125.7234 54.5647 43.3947 176.8485 4 T 4.4154 8.1896 110.8397 60.6054 70.7460 175.6563 5 K 3.2696 8.7352 122.7686 59.8078 32.0375 179.6181 6 C 4.2763 8.0233 116.2229 59.7660 41.0199 175.7862 7 K 3.8266 8.0189 120.1356 59.5206 31.5906 179.4417 8 V 3.4159 7.4689 118.0671 66.0938 31.2219 178.0473 9 S 4.0807 7.8704 113.6305 62.0331 62.4753 176.0304 10 H 4.2890 8.5016 120.7477 59.2358 29.3890 177.2093 11 A 3.9689 7.9388 121.8639 54.1582 18.4275 178.5500 12 I 4.1140 7.7291 110.3443 60.7399 38.0216 177.5752 13 K 3.7747 7.4627 121.8404 60.2894 31.9762 178.0073 14 D 4.4610 7.9112 115.0565 55.7429 41.5342 175.9729 15 I 3.8925 8.0834 118.3974 61.3915 38.7335 174.1943 16 D 4.4898 7.7903 120.3458 57.4563 41.1465 176.7110 17 G 4.1334 9.4856 116.8963 45.3496 0.0000 172.4294 18 Y 4.1706 7.9303 121.3674 59.0693 39.1377 175.7511 19 Q 3.4178 9.2341 125.3692 56.6426 27.7801 173.5898 20 G 3.8809 8.4047 102.3032 45.9934 0.0000 173.5157 21 I 4.3553 7.8637 121.5357 59.4627 38.3773 176.0779 22 S 5.1274 8.7089 122.2955 56.8216 65.4636 175.2795 23 L 4.1582 8.6279 122.0971 57.9706 41.4209 179.8464 24 L 4.1420 7.9752 118.4795 57.9784 41.6742 179.1820 25 E 3.9377 8.1564 118.2735 59.2266 29.3603 179.5642 26 W 4.0757 8.3877 118.9704 59.5859 29.1489 178.4168 27 A 4.2429 8.5155 121.2153 55.2236 17.8698 178.9717 28 C 2.0000 7.5008 116.3583 58.8041 44.2990 175.7683 29 V 3.4731 7.7372 120.1494 66.1926 31.0295 177.9731 30 L 4.0116 8.4085 118.9564 57.5918 41.3635 179.2792 31 F 2.9604 7.9467 120.4434 61.3209 39.1440 176.7279 32 H 4.2013 7.7440 112.9548 57.7611 28.6353 177.3987 33 T 4.3122 7.5862 117.7536 65.3872 69.0439 175.5887 34 S 4.4435 7.8288 111.3245 56.7779 64.5087 174.7812 35 G 2.9478 8.2450 108.4464 46.4849 0.0000 173.8371 36 Y 3.7204 7.3932 113.4155 58.5070 35.9750 168.9970 37 D 5.0333 7.8732 121.5431 53.0862 40.3239 177.1392 38 T 4.0540 8.7081 118.6297 63.8434 68.8239 175.7484 39 Q 4.5982 8.3947 119.7900 55.3095 29.3533 175.3086 40 A 4.1280 7.9417 121.8158 52.4651 19.5382 177.4409 41 V 4.4654 8.2484 121.0307 61.0908 34.4291 174.7606 42 V 4.4479 8.2859 127.5298 61.0541 34.7508 174.3829 43 N 5.0272 8.7731 124.7725 53.2281 39.9011 174.7463 44 D 4.2001 9.4250 122.3542 53.8625 43.7014 174.8673 45 N 3.9815 9.7792 127.3202 54.6002 36.8758 174.5345 46 G 3.9335 7.9882 106.0968 45.6255 0.0000 171.8247 47 S 4.8851 8.3049 115.7234 56.9544 65.8535 172.7070 48 T 5.0667 9.1031 117.4899 61.9778 72.0032 173.1049 49 E 5.3616 9.2306 125.6789 54.8781 32.4444 174.4821 50 Y 4.9645 9.2570 121.8410 57.3821 41.3012 177.6241 51 G 4.3490 8.9449 112.2738 44.6943 0.0000 173.0639 52 L 3.9070 8.9628 119.7414 58.3877 41.8095 179.2233 53 F 4.6842 8.5284 113.0012 57.3982 39.9558 175.2453 54 Q 3.5535 7.9866 119.4326 57.0127 26.6234 174.0067 55 I 4.2601 8.1030 119.0087 61.0205 39.2099 177.4454 56 S 5.2893 9.2460 122.4131 58.0598 63.4737 174.2423 57 D 5.0166 8.9874 124.5156 54.1909 39.4781 177.5653 58 R 3.8612 8.0752 120.1250 58.9452 30.3441 177.1840 59 F 4.7393 7.7124 112.9314 57.2127 41.9255 176.9147 60 W 4.4113 8.2424 120.0000 58.4592 29.6797 174.7129 61 C 5.4357 8.0929 111.4990 53.2685 42.8877 172.4783 62 K 4.5358 8.8205 121.9925 55.1180 32.9216 175.4855 63 S 4.5841 8.2752 122.9419 57.4684 64.3924 175.0274 64 S 4.3429 8.5193 116.9524 59.1539 63.3157 174.6022 65 E 4.1388 7.6703 122.7568 58.7040 29.7437 176.0345 66 F 4.9911 6.4593 109.6021 54.7743 40.7943 172.3927 67 P 4.5139 0.0000 0.0000 63.8957 31.3121 176.4325 68 E 4.6187 8.1642 115.8189 56.1114 29.9270 175.9914 69 S 4.3413 7.9104 113.3432 58.3805 63.0171 174.0878 70 E 3.9526 8.7360 123.9905 57.5751 29.9478 176.6290 71 N 4.2305 8.2721 117.1558 53.8348 37.9827 175.2587 72 I 3.6780 8.1797 120.1484 65.0262 37.6366 177.6872 73 C 4.4432 8.5570 115.6177 57.6150 40.3471 173.5399 74 G 3.8376 8.3400 108.1275 46.0205 0.0000 173.5751 75 I 4.5531 7.1414 116.7633 58.6763 41.7273 173.6027 76 S 4.5487 8.4209 121.0586 58.1055 63.1309 175.8419 77 C 4.0046 8.7900 125.2116 59.9369 35.3038 176.2281 78 D 4.1334 7.6723 120.1877 56.7797 40.1269 178.0900 79 K 4.2877 7.8329 117.1106 57.4646 32.2661 177.3123 80 L 4.9099 7.7044 118.7056 53.9355 41.9031 177.1991 81 L 5.1210 8.1103 117.3907 53.5522 41.9054 175.4617 82 D 5.1650 7.7971 119.2493 51.9407 41.9107 175.0897 83 D 4.5876 8.5748 117.5683 54.7054 41.1175 176.6609 84 E 4.3490 8.0069 120.1188 55.3708 28.6759 176.6483 85 L 4.6076 8.1000 125.1024 54.9609 42.1051 178.4733 86 D 4.2779 7.9278 120.0568 57.2055 40.8087 177.9570 87 D 4.3655 7.9870 119.2134 56.1672 39.6467 178.2837 88 D 4.2346 7.9610 120.0631 57.3094 40.8418 178.5436 89 I 3.1269 7.8457 120.3032 63.9078 36.8810 178.3057 90 A 3.7616 7.7493 121.7029 55.2069 18.1658 178.9396 91 C 4.1050 7.9691 116.7113 59.6502 44.1433 175.4059 92 A 3.7861 7.7385 122.7374 55.2330 17.7067 179.7863 93 K 3.5534 7.8471 116.8979 59.2983 31.9176 179.7856 94 K 4.0610 7.6108 118.9398 59.4340 31.9976 179.3465 95 I 2.7926 7.5411 120.0649 64.0461 36.9604 178.4221 96 L 4.1671 8.2833 119.6217 58.0372 41.3693 179.6109 97 A 4.1507 8.6098 119.5102 54.3422 18.3020 178.9360 98 I 4.2027 7.7750 117.1977 63.2871 38.2800 177.3432 99 K 4.3798 8.5734 118.5511 56.5798 33.1689 176.4593 100 G 4.2465 8.1487 103.6467 45.0164 0.0000 173.4547 101 I 3.9051 8.4058 117.3836 64.1763 37.7333 176.9973 102 D 4.6879 8.1590 117.8002 55.9308 40.8068 176.5313 103 Y 3.8808 7.9687 120.9605 59.8887 39.0925 175.8972 104 W 4.2384 8.5127 121.4366 55.2492 28.2551 177.1714 105 K 4.0705 8.4193 123.8129 58.7054 31.9910 178.7710 106 A 4.1315 8.0801 121.5811 54.7152 19.0054 178.7608 107 Y 4.0891 8.1320 117.2931 60.9699 39.0659 178.4001 108 K 3.6805 8.2573 117.5537 58.9467 32.3169 176.8341 109 P 4.3449 0.0000 0.0000 65.0723 31.4669 176.7416 110 M 4.5849 7.9509 115.6475 55.2612 33.1532 175.3425 111 C 5.0142 7.9343 115.9641 56.8457 41.4754 174.9227 112 S 4.0508 8.0469 115.1764 58.9450 63.0171 173.2967 113 E 4.5202 7.9010 116.6130 55.5877 32.3089 174.4935 114 K 3.8452 8.4707 115.8296 57.5978 29.4495 176.4987 115 L 4.6341 7.5514 118.1937 57.0561 42.4658 178.8352 116 E 4.1402 8.2886 118.5841 59.0153 29.1615 178.8700 117 Q 3.9584 7.9582 116.6181 58.4264 28.6916 177.4514 118 W 4.5618 7.6619 118.7386 56.0756 29.6395 176.2267 119 R 4.1825 7.2900 119.9052 55.7689 30.2319 175.0419 120 C 4.4703 8.6933 124.7778 56.5539 43.8079 172.7548 121 E 4.3985 8.6718 125.8050 56.1508 29.4434 176.3439 122 K 4.2295 7.6732 119.2212 55.4057 32.9742 175.2373 123 P 4.4230 0.0000 0.0000 62.8644 31.3163 176.2605 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 T 8.03 4.34 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 2 E 8.84 4.63 0.00 1.99 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 2.33 2.45 0.00 3 L 8.70 4.46 0.00 1.50 1.52 0.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.19 4.42 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 1.23 0.00 0.00 5 K 8.74 3.27 0.00 2.10 1.91 0.00 2.05 0.00 0.00 2.03 0.00 0.00 2.96 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.59 1.77 7.81 6 C 8.02 4.28 0.00 2.98 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 7 K 8.02 3.83 0.00 1.99 1.82 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.44 7.81 8 V 7.47 3.42 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 0.95 0.00 0.00 0.42 0.00 0.00 9 S 7.87 4.08 0.00 3.87 3.95 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 10 H 8.50 4.29 0.00 3.22 3.51 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.94 3.97 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 12 I 7.73 4.11 1.65 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.75 0.81 0.00 0.00 13 K 7.46 3.77 0.00 1.77 1.92 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.68 1.52 7.81 14 D 7.91 4.46 0.00 2.57 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 15 I 8.08 3.89 1.53 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.86 0.38 0.00 0.00 16 D 7.79 4.49 0.00 2.88 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 17 G 9.49 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 18 Y 7.93 4.17 0.00 3.20 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 19 Q 9.23 3.42 0.00 2.23 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.19 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 20 G 8.40 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 0.00 0.00 0.00 21 I 7.86 4.36 1.84 0.00 0.00 0.52 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 0.69 0.04 0.00 0.00 22 S 8.71 5.13 0.00 4.12 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 23 L 8.63 4.16 0.00 1.79 1.85 0.96 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.98 4.14 0.00 1.78 2.02 1.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.16 3.94 0.00 2.13 1.96 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 2.40 2.40 0.00 26 W 8.39 4.08 0.00 3.44 3.04 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 27 A 8.52 4.24 1.62 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 0.00 0.00 28 C 7.50 2.00 0.00 1.23 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 29 V 7.74 3.47 1.95 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 0.86 0.00 0.00 0.80 0.00 0.00 30 L 8.41 4.01 0.00 1.94 1.76 0.38 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 31 F 7.95 2.96 0.00 2.88 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 0.00 32 H 7.74 4.20 0.00 3.16 3.31 0.00 5.90 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.59 4.31 4.35 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 1.51 0.00 0.00 34 S 7.83 4.44 0.00 3.94 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 0.00 35 G 8.25 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 0.00 0.00 0.00 36 Y 7.39 3.72 0.00 3.35 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.87 5.03 0.00 2.71 2.69 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 0.00 0.00 0.00 0.00 38 T 8.71 4.05 4.47 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 39 Q 8.39 4.60 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.52 2.38 0.00 40 A 7.94 4.13 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 41 V 8.25 4.47 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 0.56 0.00 0.00 0.93 0.00 0.00 42 V 8.29 4.45 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 0.82 0.00 0.00 0.94 0.00 0.00 43 N 8.77 5.03 0.00 2.63 2.71 0.00 0.00 6.75 8.06 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 44 D 9.42 4.20 0.00 2.56 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.78 3.98 0.00 2.78 2.82 0.00 0.00 7.29 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 46 G 7.99 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 47 S 8.30 4.89 0.00 3.97 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 48 T 9.10 5.07 4.49 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 0.72 0.00 0.00 49 E 9.23 5.36 0.00 1.97 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 2.34 2.28 0.00 50 Y 9.26 4.96 0.00 2.93 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 51 G 8.94 4.35 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 0.00 52 L 8.96 3.91 0.00 1.62 1.81 0.93 0.46 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 53 F 8.53 4.68 0.00 3.23 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 54 Q 7.99 3.55 0.00 2.37 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.82 0.00 0.00 0.00 0.00 0.00 2.57 2.69 0.00 55 I 8.10 4.26 2.02 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 0.99 0.79 1.00 0.00 0.00 56 S 9.25 5.29 0.00 4.23 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 57 D 8.99 5.02 0.00 2.73 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 58 R 8.08 3.86 0.00 1.65 1.73 0.00 2.99 0.00 0.00 3.03 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.95 0.00 59 F 7.71 4.74 0.00 1.96 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 0.00 0.00 0.00 0.00 60 W 8.24 4.41 0.00 3.59 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 61 C 8.09 5.44 0.00 3.07 3.17 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 0.00 62 K 8.82 4.54 0.00 1.91 1.63 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.29 7.81 63 S 8.28 4.58 0.00 3.54 3.85 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 0.00 0.00 0.00 64 S 8.52 4.34 0.00 3.94 3.95 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 65 E 7.67 4.14 0.00 1.71 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 2.34 0.00 66 F 6.46 4.99 0.00 3.19 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 67 P 0.00 4.51 0.00 2.24 2.24 0.00 3.93 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 2.07 2.01 0.00 68 E 8.16 4.62 0.00 2.09 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 0.00 2.25 2.28 0.00 69 S 7.91 4.34 0.00 3.94 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 70 E 8.74 3.95 0.00 1.97 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 0.00 2.24 2.33 0.00 71 N 8.27 4.23 0.00 2.85 2.75 0.00 0.00 7.02 7.22 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 72 I 8.18 3.68 1.74 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.51 1.01 0.00 0.00 73 C 8.56 4.44 0.00 3.26 3.18 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 74 G 8.34 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 75 I 7.14 4.55 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.18 0.89 0.00 0.00 76 S 8.42 4.55 0.00 3.82 3.63 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 77 C 8.79 4.00 0.00 2.06 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 78 D 7.67 4.13 0.00 2.58 2.69 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 0.00 0.00 0.00 0.00 79 K 7.83 4.29 0.00 1.86 2.03 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.58 7.81 80 L 7.70 4.91 0.00 1.89 1.78 0.95 0.61 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 81 L 8.11 5.12 0.00 1.86 1.72 1.14 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.80 5.17 0.00 2.73 2.68 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 0.00 0.00 0.00 0.00 83 D 8.57 4.59 0.00 2.67 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 84 E 8.01 4.35 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 2.29 2.41 0.00 85 L 8.10 4.61 0.00 1.72 1.71 0.97 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 86 D 7.93 4.28 0.00 2.67 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 87 D 7.99 4.37 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 88 D 7.96 4.23 0.00 2.92 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 89 I 7.85 3.13 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.66 0.62 0.00 0.00 90 A 7.75 3.76 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 91 C 7.97 4.10 0.00 2.94 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 92 A 7.74 3.79 0.44 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 93 K 7.85 3.55 0.00 1.65 1.31 0.00 1.29 0.00 0.00 0.95 0.00 0.00 2.54 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 1.08 7.81 94 K 7.61 4.06 0.00 1.94 2.00 0.00 1.70 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.47 7.81 95 I 7.54 2.79 1.80 0.00 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.10 -0.34 0.00 0.00 96 L 8.28 4.17 0.00 2.24 2.08 1.31 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.61 4.15 1.49 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 0.00 0.00 98 I 7.78 4.20 2.22 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.95 1.05 0.00 0.00 99 K 8.57 4.38 0.00 1.96 1.99 0.00 2.12 0.00 0.00 2.04 0.00 0.00 3.27 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.57 7.81 100 G 8.15 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 0.00 0.00 0.00 101 I 8.41 3.91 1.58 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.22 0.49 0.74 0.00 0.00 102 D 8.16 4.69 0.00 2.78 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 0.00 103 Y 7.97 3.88 0.00 2.57 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 0.00 0.00 0.00 0.00 104 W 8.51 4.24 0.00 3.68 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 0.00 105 K 8.42 4.07 0.00 1.70 1.86 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.28 7.81 106 A 8.08 4.13 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 0.00 107 Y 8.13 4.09 0.00 2.97 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 0.00 108 K 8.26 3.68 0.00 1.79 1.82 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.43 7.81 109 P 0.00 4.34 0.00 2.14 2.15 0.00 3.71 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 110 M 7.95 4.58 0.00 1.87 2.09 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.52 0.00 111 C 7.93 5.01 0.00 2.85 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 0.00 112 S 8.05 4.05 0.00 3.74 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 0.00 113 E 7.90 4.52 0.00 2.04 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 0.00 2.18 2.34 0.00 114 K 8.47 3.85 0.00 1.96 1.90 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.37 1.46 7.81 115 L 7.55 4.63 0.00 1.78 1.85 0.97 1.01 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 0.00 116 E 8.29 4.14 0.00 1.98 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 2.43 2.33 0.00 117 Q 7.96 3.96 0.00 1.80 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.17 0.00 0.00 0.00 0.00 0.00 2.13 1.16 0.00 118 W 7.66 4.56 0.00 3.53 3.36 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 0.00 119 R 7.29 4.18 0.00 1.85 2.12 0.00 3.28 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.60 0.00 120 C 8.69 4.47 0.00 3.00 3.01 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 0.00 121 E 8.67 4.40 0.00 1.98 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 2.24 2.23 0.00 122 K 7.67 4.23 0.00 1.74 1.73 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.39 7.81 123 P 0.00 4.42 0.00 2.03 1.95 0.00 3.70 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00