NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.3586 8.4093 119.1828 53.6453 40.0328 173.0377 4 Y 4.7319 6.9999 121.6067 54.4073 41.4250 171.4999 5 T 4.7787 9.0225 110.4648 60.0498 73.0224 173.5268 6 Y 5.1838 8.8194 118.7614 57.1847 39.5078 175.2148 7 I 4.8723 9.0988 122.4967 59.3021 41.6658 175.2292 8 K 4.7724 9.3571 127.6867 54.8695 33.5708 176.3380 9 P 4.5497 0.0000 0.0000 66.0207 31.2179 178.9416 10 E 4.2659 8.2353 118.2896 59.0378 29.2331 179.0693 11 E 4.0014 8.2200 118.1663 59.2471 29.5569 179.0262 12 L 4.0043 8.0944 120.5085 58.0267 42.2760 179.1164 13 V 3.5245 7.9789 118.2721 66.0340 31.1613 177.5342 14 E 3.9539 7.8316 117.1052 59.8182 29.6043 179.2709 15 L 4.1402 7.5014 117.2684 57.6315 41.4895 179.4217 16 L 4.0573 7.7130 117.9703 56.9713 41.6768 178.1938 17 D 4.7889 7.6645 116.4163 53.3431 41.5368 175.5495 18 N 4.8170 7.2423 119.2087 50.9203 40.2816 172.9888 19 P 4.2243 0.0000 0.0000 66.3088 30.7872 177.7815 20 D 4.2523 8.0530 115.9110 57.2379 41.2427 178.0544 21 S 4.2388 8.3359 115.4912 61.1314 62.6830 176.5834 22 L 3.9577 8.0859 123.6684 58.1507 41.7881 179.3978 23 V 3.6859 7.5044 117.2067 64.0254 31.3840 177.2784 24 K 4.2492 7.8046 117.3684 55.7475 32.3915 175.3781 25 A 5.2667 7.6225 121.2956 49.9192 21.4617 175.8319 26 A 4.6892 9.0469 122.7913 49.9284 23.0532 175.2274 27 V 4.4983 8.1386 119.7631 61.1941 34.2908 174.4099 28 I 4.3963 8.6298 130.5657 59.5994 38.7645 174.3145 29 D 4.5162 8.7800 128.9995 53.1852 42.3805 176.1461 30 C 5.4362 8.8346 122.9635 58.9888 29.4802 174.3389 31 R 4.4376 8.2964 119.1051 55.9461 30.5984 174.9832 32 D 4.6440 8.4947 116.4778 53.6976 40.9288 176.4062 33 S 4.4232 8.6451 116.8884 58.2064 64.8927 175.0008 34 D 4.8106 7.7521 120.3464 53.1047 39.5538 177.9212 35 R 3.7866 7.9063 122.4231 59.9179 30.0788 177.3783 36 D 4.9107 7.9062 114.2059 54.4919 41.1340 176.2462 37 C 3.9657 7.7077 121.0665 60.5589 31.5378 174.2436 38 G 4.2225 6.0832 108.2282 46.1724 0.0000 171.4969 39 F 4.4510 6.9447 115.5543 55.3443 42.1195 172.9668 40 I 4.7901 8.4663 120.1622 60.2729 38.4293 176.4946 41 V 3.6253 8.3953 125.8164 62.7105 31.7891 175.4397 42 N 4.1210 8.7567 117.4095 53.9404 36.2363 174.5703 43 S 4.3352 7.9117 112.9493 58.6763 63.9546 173.7277 44 I 4.0773 8.4960 123.7524 60.2083 38.5206 174.3028 45 N 4.8358 8.5153 126.6280 53.2475 39.7834 174.5301 46 M 4.6633 9.0810 126.8471 52.3267 34.4801 171.7258 47 P 4.7281 0.0000 0.0000 62.7204 32.0588 177.5217 48 T 4.0255 8.8263 122.6281 66.6607 68.7074 176.3832 49 I 3.8618 7.8629 120.2373 63.1718 38.0944 176.1028 50 S 4.7024 7.4601 111.1285 57.4018 64.2149 174.1635 51 C 4.2502 8.2439 119.8550 60.0413 28.5260 172.8654 52 T 4.7360 8.0099 112.3316 59.3218 71.7117 174.7297 53 E 4.1035 8.9355 121.4890 59.7755 29.4062 178.3958 54 E 4.2084 8.2804 118.4147 59.3989 29.6223 178.5717 55 M 4.0256 7.9586 119.1056 58.5655 31.9298 178.2736 56 Y 4.1526 7.8688 116.3838 60.8697 38.0039 178.1022 57 E 4.0612 8.3109 119.4047 59.5143 29.5525 179.5619 58 K 4.0698 8.5293 118.8554 59.0851 32.1334 179.2742 59 L 3.9677 8.2769 120.7032 57.9281 42.0394 178.7331 60 A 4.3666 8.5870 121.0015 55.3634 18.2809 179.5863 61 K 3.5648 8.3932 118.1731 59.7832 32.1959 179.1580 62 T 3.8753 8.1714 116.1700 66.7192 68.3888 176.7088 63 L 3.9703 8.5433 121.2785 57.4858 41.5553 179.1646 64 F 4.0002 8.1837 120.6791 61.5543 39.0529 177.2013 65 E 3.8792 8.3207 116.8609 58.9940 29.3136 178.3075 66 E 4.1690 8.1175 116.1593 55.9850 29.5034 177.0327 67 K 3.7262 7.6713 117.3859 56.9706 30.0985 176.2996 68 K 4.2604 7.9487 118.0614 56.8075 32.4762 176.7880 69 E 4.7798 9.7542 121.2998 56.2483 32.3701 175.7555 70 L 5.5561 7.9553 118.6605 52.7778 46.3145 175.1895 71 A 5.0051 9.5682 124.6331 50.1859 22.0115 174.9929 72 V 4.8191 8.8892 123.9039 61.4695 33.5574 174.5391 73 F 4.8706 9.7379 128.4739 56.8962 40.5398 174.9354 74 H 5.4763 9.2245 118.2141 53.4633 32.4603 172.1698 75 C 4.9644 8.7523 116.5351 58.3438 32.2862 176.2161 76 A 4.3468 9.1597 116.1152 54.3949 18.7796 178.8016 77 Q 4.6735 8.2786 109.9598 54.9795 30.4355 175.8269 78 S 3.9024 8.1851 112.3531 59.7360 60.4393 172.8374 79 L 4.6174 8.2171 120.6889 55.2534 43.4344 176.6643 80 V 4.2919 7.4648 114.6007 64.2668 33.9165 177.5932 81 R 4.0043 7.9474 117.8824 58.9047 29.9601 178.9582 82 A 4.0572 7.9243 120.4226 54.6969 18.5442 177.7806 83 P 3.4498 0.0000 0.0000 65.5383 31.1590 178.6688 84 K 3.9656 8.0507 118.3919 59.3070 32.0376 179.2985 85 G 3.7689 8.1843 105.6411 47.9577 0.0000 175.5322 86 A 2.6436 7.8042 123.2421 54.2069 18.1702 179.3594 87 N 4.2392 8.1759 115.2664 56.6762 38.6225 177.6726 88 R 3.6043 7.8796 119.4711 59.0789 29.9888 178.9178 89 F 4.2370 8.3181 120.3610 61.3782 39.4362 177.1096 90 A 3.8110 8.1595 120.6662 54.9439 18.1160 179.6087 91 L 3.8380 8.0228 117.4877 57.8275 41.7021 179.5748 92 A 3.9571 8.0951 120.9060 55.1360 18.2206 179.7198 93 Q 3.8665 8.0909 116.9569 58.9014 28.9056 178.8853 94 K 3.8044 7.8871 120.5768 59.4575 32.0242 178.7491 95 K 3.8948 7.9373 118.5933 58.9921 32.1505 177.9525 96 L 4.2544 7.5668 117.4135 54.6362 41.9484 177.4684 97 G 3.6620 7.5561 106.4442 45.5604 0.0000 172.6939 98 Y 4.6522 7.5371 116.4908 55.9757 39.9226 176.2393 99 V 4.5295 8.4071 118.7094 60.9115 33.0154 175.1886 100 L 4.9824 7.9461 119.9749 52.1453 44.6499 174.3313 101 P 4.8289 0.0000 0.0000 62.7507 32.3582 175.7139 102 A 4.4009 9.0717 122.7803 51.8791 20.2436 176.4424 103 V 4.8759 7.9961 119.1697 61.5496 33.8775 174.3060 104 Y 5.2668 9.3828 124.6865 56.2556 42.7789 174.2213 105 V 4.7993 8.4496 121.3756 60.9351 34.6401 174.3577 106 L 4.8232 9.0549 130.8581 54.1945 42.8665 176.1171 107 R 4.3408 9.0486 128.5561 58.2022 30.5262 176.8204 108 G 3.9435 9.0970 113.8989 44.1716 0.0000 174.4597 109 G 4.3278 8.0674 108.7350 45.0791 0.0000 173.5219 110 W 4.2687 8.9727 127.2811 60.6858 30.4942 178.9751 111 E 3.9125 8.5550 118.2348 59.4879 28.9819 179.2845 112 A 4.0316 8.0509 120.6837 54.9331 18.3824 179.2939 113 F 4.1730 8.2809 119.2828 61.8919 39.5534 176.8624 114 Y 3.4132 7.9715 119.3764 60.4680 38.2082 177.4000 115 H 4.0944 8.2933 119.1823 59.3605 30.0076 176.5480 116 M 3.8529 7.7150 118.9274 57.3572 31.9314 176.1317 117 Y 4.2432 7.2510 114.1149 57.0629 40.2177 177.6838 118 G 2.5372 7.6952 109.3375 47.5504 0.0000 174.2014 119 D 4.5428 7.4705 116.6252 53.4414 40.2604 177.0980 120 V 4.2588 7.3556 110.8617 61.1727 34.5917 175.6996 121 R 4.7546 8.3894 118.7478 54.2459 30.0652 174.5978 122 P 4.4267 0.0000 0.0000 64.2609 32.0377 178.4502 123 D 4.4290 7.9225 118.1170 55.2161 39.7186 176.7992 124 L 4.5794 7.9676 118.7565 55.2989 42.5271 175.8735 125 M 5.0882 7.7724 120.1164 53.9760 34.0801 174.7394 126 Y 4.8227 8.9896 121.5211 56.2823 41.6180 175.1364 127 V 4.3388 8.3002 114.0051 59.7567 36.8816 174.1240 128 K 5.2135 8.6190 120.1975 54.9142 34.3614 175.9971 129 L 4.6049 9.1074 125.4534 54.8337 46.3363 176.3119 130 G 3.9608 8.8230 110.4715 43.9231 0.0000 172.1837 131 P 4.2926 0.0000 0.0000 65.0500 31.2771 177.5045 132 E 4.2345 8.1918 115.0430 55.8021 30.4607 175.6572 133 Q 3.3171 7.6419 117.6501 56.7263 26.8629 173.9622 134 K 4.4720 8.3739 117.8468 55.3031 34.3428 178.5788 135 L 4.7821 8.5498 124.1808 55.5649 42.3064 176.3628 136 I 4.6813 8.7494 122.3033 59.8534 42.0545 174.2701 137 S 3.7823 8.1618 122.2574 57.3567 64.0674 175.0865 138 E 3.9527 8.6804 121.6815 59.0774 29.0487 179.2824 139 E 3.8528 7.9897 119.2893 59.5883 29.6263 178.5792 140 D 4.3649 7.8580 118.2566 57.0403 40.8547 178.7530 141 L 3.9380 7.9066 119.6002 57.8913 41.6685 179.0229 142 N 4.2944 8.6753 116.6494 56.6547 38.2726 177.5928 143 S 4.0939 7.9484 114.7756 61.6477 63.0364 176.3807 144 A 4.1426 8.0251 122.3833 54.9388 18.1353 179.5202 145 V 3.8300 7.6861 116.1025 65.4786 32.6987 176.3887 146 D 4.5055 7.4238 120.3550 53.7153 39.0757 176.4405 147 H 4.3828 8.5168 119.1567 55.9110 28.4058 175.2920 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 3 N 8.41 4.36 0.00 2.58 2.65 0.00 0.00 6.79 6.66 0.00 0.00 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 Y 7.00 4.73 0.00 2.79 2.67 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 0.00 0.00 0.00 0.00 5 T 9.02 4.78 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 1.20 0.00 0.00 6 Y 8.82 5.18 0.00 2.97 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 7 I 9.10 4.87 1.83 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 1.25 1.74 1.05 0.00 0.00 8 K 9.36 4.77 0.00 1.92 1.95 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.61 7.81 9 P 0.00 4.55 0.00 2.46 2.54 0.00 3.72 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 10 E 8.24 4.27 0.00 2.13 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 2.47 2.48 0.00 11 E 8.22 4.00 0.00 2.22 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 2.43 2.41 0.00 12 L 8.09 4.00 0.00 1.78 1.91 0.86 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.98 3.52 1.98 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 0.73 0.00 0.00 0.12 0.00 0.00 14 E 7.83 3.95 0.00 2.20 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 2.36 2.52 0.00 15 L 7.50 4.14 0.00 1.87 1.67 0.81 0.53 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 16 L 7.71 4.06 0.00 1.78 1.75 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 17 D 7.66 4.79 0.00 2.89 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 18 N 7.24 4.82 0.00 2.83 2.67 0.00 0.00 6.76 7.59 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 19 P 0.00 4.22 0.00 2.29 2.31 0.00 3.75 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 2.08 2.04 0.00 20 D 8.05 4.25 0.00 2.69 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 21 S 8.34 4.24 0.00 4.15 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 22 L 8.09 3.96 0.00 1.85 1.82 0.90 0.72 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 23 V 7.50 3.69 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 0.87 0.00 0.00 0.91 0.00 0.00 24 K 7.80 4.25 0.00 1.95 1.87 0.00 1.61 0.00 0.00 1.99 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.54 7.81 25 A 7.62 5.27 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 26 A 9.05 4.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.14 4.50 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 1.03 0.00 0.00 0.86 0.00 0.00 28 I 8.63 4.40 0.56 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.25 -0.36 0.44 0.00 0.00 29 D 8.78 4.52 0.00 2.53 2.35 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 30 C 8.83 5.44 0.00 2.97 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 31 R 8.30 4.44 0.00 1.92 1.99 0.00 3.11 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.59 0.00 32 D 8.49 4.64 0.00 2.76 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 33 S 8.65 4.42 0.00 3.99 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 34 D 7.75 4.81 0.00 2.85 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 35 R 7.91 3.79 0.00 1.87 1.88 0.00 3.13 0.00 0.00 3.08 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.44 0.00 36 D 7.91 4.91 0.00 2.72 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 37 C 7.71 3.97 0.00 3.09 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 38 G 6.08 4.22 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 0.00 39 F 6.94 4.45 0.00 2.99 2.85 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 40 I 8.47 4.79 1.94 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 1.33 0.74 0.95 0.00 0.00 41 V 8.40 3.63 0.67 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 0.55 0.00 0.00 0.50 0.00 0.00 42 N 8.76 4.12 0.00 2.81 2.86 0.00 0.00 6.99 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 7.91 4.34 0.00 3.78 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 44 I 8.50 4.08 1.64 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.54 0.75 0.00 0.00 45 N 8.52 4.84 0.00 2.51 2.57 0.00 0.00 6.99 7.65 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 46 M 9.08 4.66 0.00 1.73 1.88 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 47 P 0.00 4.73 0.00 2.10 2.32 0.00 3.64 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 2.03 1.94 0.00 48 T 8.83 4.03 4.30 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 1.27 0.00 0.00 49 I 7.86 3.86 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 1.49 0.76 0.92 0.00 0.00 50 S 7.46 4.70 0.00 3.97 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 51 C 8.24 4.25 0.00 3.12 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 52 T 8.01 4.74 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 1.28 0.00 0.00 53 E 8.94 4.10 0.00 2.12 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 0.00 2.58 2.43 0.00 54 E 8.28 4.21 0.00 2.10 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 2.43 0.00 55 M 7.96 4.03 0.00 1.90 2.19 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 56 Y 7.87 4.15 0.00 3.34 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 57 E 8.31 4.06 0.00 2.27 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 0.00 2.38 2.55 0.00 58 K 8.53 4.07 0.00 1.80 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.49 1.59 7.81 59 L 8.28 3.97 0.00 1.88 2.09 0.83 0.71 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 60 A 8.59 4.37 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 61 K 8.39 3.56 0.00 1.99 2.03 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.64 7.81 62 T 8.17 3.88 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 1.21 0.00 0.00 63 L 8.54 3.97 0.00 1.78 1.76 0.76 0.91 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 64 F 8.18 4.00 0.00 2.45 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 65 E 8.32 3.88 0.00 2.06 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 2.51 2.67 0.00 66 E 8.12 4.17 0.00 1.88 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 2.30 2.42 0.00 67 K 7.67 3.73 0.00 1.83 1.84 0.00 1.50 0.00 0.00 1.43 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.24 1.45 7.81 68 K 7.95 4.26 0.00 1.88 1.75 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.52 7.81 69 E 9.75 4.78 0.00 1.83 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 2.25 2.41 0.00 70 L 7.96 5.56 0.00 1.62 1.60 0.95 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 71 A 9.57 5.01 1.23 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 0.00 0.00 0.00 72 V 8.89 4.82 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 1.00 0.00 0.00 0.94 0.00 0.00 73 F 9.74 4.87 0.00 3.02 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 74 H 9.22 5.48 0.00 3.26 3.38 0.00 5.40 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 C 8.75 4.96 0.00 2.96 2.67 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 0.00 0.00 0.00 0.00 76 A 9.16 4.35 1.54 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 77 Q 8.28 4.67 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.87 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 78 S 8.19 3.90 0.00 4.22 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 79 L 8.22 4.62 0.00 1.66 1.75 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.46 4.29 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 1.07 0.00 0.00 0.97 0.00 0.00 81 R 7.95 4.00 0.00 1.94 2.12 0.00 3.27 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 82 A 7.92 4.06 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 83 P 0.00 3.45 0.00 2.22 1.94 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.14 0.00 84 K 8.05 3.97 0.00 1.92 1.88 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.58 7.81 85 G 8.18 3.77 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 0.00 0.00 0.00 86 A 7.80 2.64 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.18 4.24 0.00 2.94 2.83 0.00 0.00 7.02 8.38 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 88 R 7.88 3.60 0.00 1.04 0.66 0.00 2.71 0.00 0.00 2.69 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.54 0.00 89 F 8.32 4.24 0.00 3.31 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 90 A 8.16 3.81 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 91 L 8.02 3.84 0.00 1.59 1.65 0.85 0.56 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 92 A 8.10 3.96 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 93 Q 8.09 3.87 0.00 1.99 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.08 1.40 0.00 94 K 7.89 3.80 0.00 1.87 1.86 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.38 7.81 95 K 7.94 3.89 0.00 1.73 1.98 0.00 1.81 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 96 L 7.57 4.25 0.00 1.56 1.36 1.12 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.56 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.54 4.65 0.00 2.82 2.93 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 99 V 8.41 4.53 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 0.84 0.00 0.00 0.95 0.00 0.00 100 L 7.95 4.98 0.00 1.92 1.78 1.02 1.16 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 0.00 101 P 0.00 4.83 0.00 2.27 2.19 0.00 4.08 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.11 0.00 102 A 9.07 4.40 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 0.00 103 V 8.00 4.88 2.22 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 1.01 0.00 0.00 1.23 0.00 0.00 104 Y 9.38 5.27 0.00 2.99 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 0.00 105 V 8.45 4.80 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 0.91 0.00 0.00 0.11 0.00 0.00 106 L 9.05 4.82 0.00 1.85 1.65 1.08 0.60 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 0.00 107 R 9.05 4.34 0.00 1.96 1.98 0.00 3.24 0.00 0.00 3.05 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 108 G 9.10 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 0.00 109 G 8.07 4.33 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 0.00 110 W 8.97 4.27 0.00 3.54 3.32 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 0.00 111 E 8.55 3.91 0.00 2.24 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 2.49 2.64 0.00 112 A 8.05 4.03 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.28 4.17 0.00 3.12 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 0.00 114 Y 7.97 3.41 0.00 1.66 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.29 4.09 0.00 3.19 3.45 0.00 6.00 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 M 7.72 3.85 0.00 1.71 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.17 0.00 117 Y 7.25 4.24 0.00 2.53 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.70 2.54 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 0.00 119 D 7.47 4.54 0.00 2.66 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 0.00 120 V 7.36 4.26 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 0.67 0.00 0.00 0.78 0.00 0.00 121 R 8.39 4.75 0.00 1.71 1.83 0.00 3.28 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 122 P 0.00 4.43 0.00 2.26 2.25 0.00 3.73 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 2.03 1.91 0.00 123 D 7.92 4.43 0.00 2.83 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 0.00 124 L 7.97 4.58 0.00 1.82 2.01 0.75 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.77 5.09 0.00 2.35 2.15 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.85 0.00 126 Y 8.99 4.82 0.00 2.62 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 0.00 0.00 0.00 0.00 127 V 8.30 4.34 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 0.64 0.00 0.00 0.91 0.00 0.00 128 K 8.62 5.21 0.00 1.75 1.78 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.68 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.61 1.80 7.81 129 L 9.11 4.60 0.00 1.76 1.44 0.92 1.10 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 0.00 130 G 8.82 3.96 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 0.00 0.00 0.00 131 P 0.00 4.29 0.00 2.06 2.13 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 132 E 8.19 4.23 0.00 1.96 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 2.27 2.27 0.00 133 Q 7.64 3.32 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 134 K 8.37 4.47 0.00 1.71 1.75 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.43 7.81 135 L 8.55 4.78 0.00 1.65 1.83 1.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.75 4.68 1.89 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 1.20 1.10 0.90 0.00 0.00 137 S 8.16 3.78 0.00 3.38 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 0.00 138 E 8.68 3.95 0.00 2.14 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 2.32 2.47 0.00 139 E 7.99 3.85 0.00 2.05 1.87 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 2.35 2.38 0.00 140 D 7.86 4.36 0.00 2.82 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.91 3.94 0.00 1.86 1.69 0.90 0.41 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 0.00 142 N 8.68 4.29 0.00 2.90 2.87 0.00 0.00 7.09 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 0.00 143 S 7.95 4.09 0.00 4.01 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 0.00 144 A 8.03 4.14 1.29 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 0.00 0.00 0.00 145 V 7.69 3.83 2.14 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 0.86 0.00 0.00 0.98 0.00 0.00 146 D 7.42 4.51 0.00 2.89 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 0.00 147 H 8.52 4.38 0.00 3.37 3.55 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00