NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 M 4.4055 8.3049 120.3501 55.4667 33.3614 174.6522 1 D 4.4692 8.4573 117.2752 53.7258 42.0050 174.0909 2 I 4.3122 9.7964 124.3497 60.2744 39.6679 174.8647 3 I 4.8423 8.3984 127.5672 59.6418 39.8052 174.7356 4 L 4.9075 9.0666 127.4867 52.9194 45.4385 176.2476 5 G 4.5405 8.3819 107.5016 45.0294 0.0000 172.0618 6 I 4.6275 8.8064 124.1305 59.2919 41.6826 173.6156 7 R 4.6985 8.7100 130.3871 54.9920 30.1563 175.8661 8 V 4.2189 8.1418 129.8453 61.4629 31.1231 177.2438 9 Q 4.1210 8.7580 124.4030 59.9126 29.2008 177.8716 10 D 5.1420 7.5296 115.6991 53.4152 42.2112 175.4468 11 S 4.6815 7.5547 111.7749 57.8167 65.1726 173.7046 12 V 4.8776 8.3470 120.2135 61.1318 34.0881 174.3776 13 I 4.5952 8.7185 127.9229 59.4393 39.9894 174.3249 14 L 5.2585 8.6455 126.0354 52.7970 44.2033 175.5381 15 A 4.8116 8.8057 125.3502 50.1938 21.9038 175.2710 16 S 5.0948 8.4535 117.7132 56.4412 66.5106 174.1674 17 S 4.1989 8.7022 120.0911 59.4245 62.9373 174.8673 18 K 4.7736 9.0039 119.2966 56.4975 33.3837 176.4825 19 A 4.7338 7.9305 121.8399 51.8000 19.6002 177.6071 20 V 4.2562 8.7130 119.9293 61.7553 34.3097 174.0586 21 T 5.0197 8.5542 124.2962 61.7785 70.9942 174.9235 22 R 4.4181 8.8988 124.8028 54.7648 33.2400 178.3807 23 G 3.8876 9.1143 117.2593 46.6865 0.0000 173.4073 24 I 4.0858 9.0053 124.6053 61.4984 39.3530 174.4111 25 S 4.6862 7.7535 116.0840 56.5481 65.6381 173.3220 26 V 4.2387 8.2514 124.0406 62.0607 31.2435 175.8197 27 L 4.2886 8.7152 128.6537 56.4334 42.3093 177.1943 28 K 4.5667 7.5990 118.0302 55.4249 34.8153 174.9140 29 D 4.9484 8.7335 122.8992 53.0333 39.8646 175.7748 30 S 4.7612 7.8742 111.8478 58.3492 64.3900 173.1311 31 D 4.4017 8.4381 121.4383 55.0574 42.1245 174.5471 32 D 4.8546 8.6661 126.2031 51.9435 41.7614 176.7943 33 K 3.9389 7.8201 131.5979 55.7016 31.6803 176.1793 34 T 4.9401 6.9792 111.9150 60.7901 71.5581 173.7974 35 R 4.7668 9.0128 123.6108 54.6789 35.1965 173.9577 36 Q 4.4734 8.7253 124.8310 55.4171 29.7676 176.2677 37 L 4.1831 8.9117 127.7611 56.9933 42.4501 176.8841 38 S 4.6186 7.7103 110.7559 56.1247 65.4714 173.0869 39 P 4.7323 0.0000 0.0000 65.0772 30.7067 176.7001 40 H 4.9269 9.4087 114.2395 55.2811 29.4828 172.7388 41 T 5.0099 8.4099 117.2323 61.8190 72.0945 172.6384 42 L 5.1425 9.3365 128.8539 53.3137 45.4940 174.6299 43 M 5.3991 9.0564 125.0181 53.8577 35.3654 174.3043 44 S 5.1384 8.9741 120.9433 56.9964 65.9684 172.9492 45 F 5.6599 7.6671 114.9576 56.1498 41.1759 173.2454 46 A 4.7072 8.7991 120.1846 50.4882 22.6043 176.8325 47 G 3.9243 8.6115 106.5437 45.2612 0.0000 171.9901 48 E 3.9437 8.7034 123.7491 56.2207 30.3488 178.1437 49 A 3.9862 8.8467 129.8017 55.6916 18.6488 179.6732 50 G 3.7762 8.2193 101.4510 47.9049 0.0000 175.3194 51 D 4.6444 8.2742 121.5398 57.8433 40.9053 178.5477 52 T 3.6699 7.7951 114.7208 67.5397 68.4735 176.4184 53 V 3.1140 7.4022 118.6239 65.9055 31.9561 177.9566 54 Q 4.0218 7.6869 117.6998 59.2262 28.5317 179.2745 55 F 3.6964 8.5064 121.3712 60.9001 39.3323 176.9356 56 A 3.7332 7.4633 119.9328 55.3853 18.1035 179.5225 57 E 3.9336 8.4622 117.2913 59.4838 29.5755 179.0878 58 Y 4.0497 7.8192 119.4706 60.7418 38.8617 178.1743 59 I 3.3748 7.5011 120.8376 64.1567 37.0482 177.8907 60 Q 3.8422 8.2639 120.5300 59.2551 28.7743 178.1188 61 A 3.9367 8.1204 121.8147 55.5368 18.2854 179.3837 62 N 4.1232 7.6769 114.0445 56.5759 38.6021 177.8023 63 I 3.5197 7.7165 121.1802 64.3138 37.0972 178.6059 64 Q 3.9752 8.3196 119.2813 58.7758 28.5527 178.3889 65 L 3.9153 8.0803 121.5589 58.3636 42.0642 178.4073 66 Y 3.8294 8.2200 119.5980 60.6062 38.6614 178.1921 67 S 4.9035 8.0535 117.4194 61.2613 62.7818 176.7157 68 I 3.6551 7.5858 120.8734 64.4816 36.9734 178.1274 69 R 3.9334 7.7977 117.9831 58.9063 29.9919 177.4572 70 E 4.2067 8.0246 115.2668 54.8507 31.2131 175.0479 71 D 4.4127 8.2036 118.6517 54.2479 40.3998 171.5531 72 Y 4.5341 7.1608 117.7681 56.9659 42.0127 172.0736 73 E 4.7226 8.0052 124.7825 53.8803 30.7735 175.7171 74 L 4.1444 8.6169 126.7007 54.9269 42.4221 178.1679 75 S 4.3629 8.4826 116.8011 57.8396 64.8883 173.7426 76 P 4.2196 0.0000 0.0000 65.6473 31.0286 178.6445 77 Q 3.9240 8.0931 117.6967 59.2220 29.0022 178.2117 78 A 3.9495 7.8671 121.4735 55.1632 18.4455 179.6417 79 V 3.5533 7.9089 117.0296 66.2642 31.4981 178.4188 80 S 4.2192 8.4131 114.1951 61.6433 62.8324 176.6267 81 S 4.1290 8.4023 118.9302 61.1320 62.5343 176.4624 82 F 4.2175 8.3964 123.4607 61.3221 39.1673 177.3242 83 V 3.4706 7.9651 117.8978 65.9076 31.3001 177.9172 84 R 3.8681 8.2944 118.6710 59.4755 29.9608 178.0725 85 Q 3.9472 8.0332 119.3098 59.3208 28.9853 178.3238 86 E 3.9576 7.9935 119.2948 59.5442 29.5041 179.4384 87 L 3.9317 8.1997 118.7772 57.6676 41.4264 179.2887 88 A 3.9804 8.4043 120.1315 55.0759 18.5364 179.6948 89 K 4.0469 8.1122 116.8871 59.7007 32.1780 179.2030 90 S 4.0301 8.0280 113.4413 61.7562 61.9948 176.1301 90A I 3.6771 7.7807 119.6478 63.1916 37.6117 176.4088 90B R 4.4538 7.5984 116.3594 55.6678 30.4037 176.0299 91 S 4.4711 7.7038 114.3087 57.0743 64.5286 174.4412 92 R 3.8301 8.5157 119.8175 58.8369 29.7078 176.4885 93 R 4.3443 7.4043 119.8560 53.4003 31.0620 172.6141 94 P 4.3396 0.0000 0.0000 62.0363 32.0752 176.3332 95 Y 4.1973 8.8876 121.1990 58.5077 38.5809 177.3279 96 Q 4.4628 8.8109 127.3873 54.5406 27.0549 174.6387 97 V 4.8886 7.3586 118.7354 60.9575 35.4290 174.4782 98 N 5.2120 9.3657 124.2215 51.7495 41.6737 173.9884 99 V 5.1675 8.3080 113.8913 59.9597 36.5209 174.2792 100 L 4.8626 8.8312 121.6807 53.0493 45.0385 175.7131 101 I 4.8267 8.6109 123.7984 59.5601 39.7715 174.9665 102 G 4.1692 9.3709 115.7711 44.3762 0.0000 172.2155 103 G 4.6081 8.6342 111.1996 45.0049 0.0000 170.9653 104 Y 4.4959 8.6920 122.5028 55.3353 40.3945 175.2598 105 D 4.3766 8.0021 125.2420 54.4651 41.3928 175.6373 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 4.41 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 1 D 8.46 4.47 0.00 2.80 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 2 I 9.80 4.31 1.86 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 1.22 0.90 0.90 0.00 0.00 3 I 8.40 4.84 1.87 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 1.33 0.43 0.91 0.00 0.00 4 L 9.07 4.91 0.00 1.52 1.51 0.91 0.59 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 5 G 8.38 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.81 4.63 1.87 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 1.12 1.63 0.96 0.00 0.00 7 R 8.71 4.70 0.00 1.87 1.85 0.00 3.27 0.00 0.00 3.22 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 8 V 8.14 4.22 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 0.70 0.00 0.00 1.00 0.00 0.00 9 Q 8.76 4.12 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 7.48 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 10 D 7.53 5.14 0.00 2.69 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 11 S 7.55 4.68 0.00 3.97 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 12 V 8.35 4.88 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 0.86 0.00 0.00 1.02 0.00 0.00 13 I 8.72 4.60 1.87 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 1.23 0.64 0.91 0.00 0.00 14 L 8.65 5.26 0.00 1.47 1.53 0.91 0.77 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 15 A 8.81 4.81 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 16 S 8.45 5.09 0.00 3.61 3.62 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 17 S 8.70 4.20 0.00 3.86 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 18 K 9.00 4.77 0.00 1.73 1.91 0.00 1.93 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.26 7.81 19 A 7.93 4.73 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 20 V 8.71 4.26 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 1.08 0.00 0.00 0.96 0.00 0.00 21 T 8.55 5.02 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 1.26 0.00 0.00 22 R 8.90 4.42 0.00 1.77 1.84 0.00 3.41 0.00 0.00 3.19 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 23 G 9.11 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 0.00 0.00 0.00 24 I 9.01 4.09 1.87 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 1.42 0.77 0.91 0.00 0.00 25 S 7.75 4.69 0.00 3.84 3.70 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 26 V 8.25 4.24 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 0.81 0.00 0.00 0.94 0.00 0.00 27 L 8.72 4.29 0.00 1.67 1.72 0.93 0.80 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 28 K 7.60 4.57 0.00 1.75 1.60 0.00 1.67 0.00 0.00 1.89 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.43 7.81 29 D 8.73 4.95 0.00 2.77 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 30 S 7.87 4.76 0.00 3.84 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 31 D 8.44 4.40 0.00 2.79 2.73 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 32 D 8.67 4.85 0.00 2.70 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.82 3.94 0.00 1.58 1.38 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.47 7.81 34 T 6.98 4.94 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 1.25 0.00 0.00 35 R 9.01 4.77 0.00 1.86 1.81 0.00 3.39 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 36 Q 8.73 4.47 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 37 L 8.91 4.18 0.00 1.66 1.68 0.94 1.12 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 38 S 7.71 4.62 0.00 4.01 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 39 P 0.00 4.73 0.00 1.98 2.19 0.00 3.31 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 1.97 0.00 40 H 9.41 4.93 0.00 3.36 3.49 0.00 5.75 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.41 5.01 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 1.23 0.00 0.00 42 L 9.34 5.14 0.00 1.69 1.48 0.95 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 43 M 9.06 5.40 0.00 2.18 1.91 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.63 0.00 44 S 8.97 5.14 0.00 3.78 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 45 F 7.67 5.66 0.00 3.07 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 46 A 8.80 4.71 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 47 G 8.61 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 48 E 8.70 3.94 0.00 2.02 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 2.38 2.33 0.00 49 A 8.85 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 50 G 8.22 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 0.00 0.00 0.00 51 D 8.27 4.64 0.00 2.79 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 52 T 7.80 3.67 4.44 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 1.23 0.00 0.00 53 V 7.40 3.11 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 1.01 0.00 0.00 0.95 0.00 0.00 54 Q 7.69 4.02 0.00 2.37 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 55 F 8.51 3.70 0.00 1.98 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 56 A 7.46 3.73 1.02 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 0.00 0.00 57 E 8.46 3.93 0.00 1.97 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 2.32 2.45 0.00 58 Y 7.82 4.05 0.00 3.13 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 59 I 7.50 3.37 1.70 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 -0.13 0.88 0.00 0.00 60 Q 8.26 3.84 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 61 A 8.12 3.94 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 62 N 7.68 4.12 0.00 2.75 2.51 0.00 0.00 7.11 6.54 0.00 0.00 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 I 7.72 3.52 1.88 0.00 0.00 0.56 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 0.78 0.88 0.00 0.00 64 Q 8.32 3.98 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.62 0.00 65 L 8.08 3.92 0.00 1.77 1.81 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 8.22 3.83 0.00 2.99 2.97 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 67 S 8.05 4.90 0.00 4.17 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 68 I 7.59 3.66 1.85 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 1.40 0.73 0.89 0.00 0.00 69 R 7.80 3.93 0.00 1.69 1.71 0.00 3.00 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 70 E 8.02 4.21 0.00 1.64 1.91 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 1.90 2.15 0.00 71 D 8.20 4.41 0.00 2.71 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 72 Y 7.16 4.53 0.00 3.22 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 73 E 8.01 4.72 0.00 1.91 1.72 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 2.20 2.31 0.00 74 L 8.62 4.14 0.00 1.51 1.46 -0.01 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.48 4.36 0.00 4.04 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 76 P 0.00 4.22 0.00 2.15 2.14 0.00 3.57 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 2.13 2.14 0.00 77 Q 8.09 3.92 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 78 A 7.87 3.95 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 79 V 7.91 3.55 2.23 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 1.07 0.00 0.00 0.89 0.00 0.00 80 S 8.41 4.22 0.00 4.11 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 81 S 8.40 4.13 0.00 4.08 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 82 F 8.40 4.22 0.00 2.98 3.25 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 83 V 7.97 3.47 2.30 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 1.12 0.00 0.00 1.04 0.00 0.00 84 R 8.29 3.87 0.00 2.03 1.92 0.00 3.17 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 85 Q 8.03 3.95 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 86 E 7.99 3.96 0.00 2.21 2.24 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 1.66 2.02 0.00 87 L 8.20 3.93 0.00 1.78 1.62 0.87 -0.27 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 88 A 8.40 3.98 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 89 K 8.11 4.05 0.00 2.02 1.87 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.69 7.81 90 S 8.03 4.03 0.00 4.02 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 90A I 7.78 3.68 1.84 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 1.50 0.78 0.93 0.00 0.00 90B R 7.60 4.45 0.00 1.81 1.88 0.00 3.20 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.51 0.00 91 S 7.70 4.47 0.00 3.89 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 92 R 8.52 3.83 0.00 1.74 1.93 0.00 3.14 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 93 R 7.40 4.34 0.00 1.66 1.66 0.00 3.24 0.00 0.00 3.17 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.54 0.00 94 P 0.00 4.34 0.00 2.02 1.93 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.25 0.00 95 Y 8.89 4.20 0.00 2.64 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 96 Q 8.81 4.46 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.28 0.00 97 V 7.36 4.89 1.71 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 0.90 0.00 0.00 0.85 0.00 0.00 98 N 9.37 5.21 0.00 2.74 2.68 0.00 0.00 6.61 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.31 5.17 2.33 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 0.94 0.00 0.00 1.05 0.00 0.00 100 L 8.83 4.86 0.00 1.58 1.53 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 101 I 8.61 4.83 1.91 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 1.34 0.68 0.94 0.00 0.00 102 G 9.37 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 0.00 0.00 0.00 0.00 103 G 8.63 4.61 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 0.00 0.00 0.00 104 Y 8.69 4.50 0.00 3.02 2.91 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 0.00 105 D 8.00 4.38 0.00 2.53 2.28 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