NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.3366 8.3649 120.2058 54.4900 40.8740 174.1608 3 H 4.4332 7.3970 119.8160 54.5935 30.4832 173.9150 4 D 4.4535 8.6364 119.7482 54.4968 41.6437 176.9248 5 T 3.8217 7.2218 117.4051 62.7154 65.2412 173.5206 6 E 4.3566 8.5672 128.4797 54.7163 26.9650 176.4302 7 V 3.4133 7.5889 121.5208 65.4180 32.1024 176.9212 8 I 3.7658 7.8111 119.5724 64.6912 37.0400 177.7580 9 V 3.8228 7.3641 118.3767 66.3349 31.3807 177.9917 10 K 4.0321 8.2070 117.4816 59.7498 31.9239 178.9515 11 D 4.4086 8.5294 119.5601 57.2498 40.7309 178.4115 12 F 3.9748 8.5322 121.3310 61.4480 39.3788 176.9916 13 N 4.4246 8.4209 116.0072 56.2656 38.1076 177.5198 14 S 4.0803 7.9442 115.5497 61.8121 63.4027 176.4058 15 I 3.7465 7.5600 122.2483 64.4527 36.7712 178.3149 16 L 3.8395 7.7077 120.8348 57.9736 41.5694 178.8769 17 E 4.0660 7.8143 118.0808 58.9548 29.4807 178.1289 18 E 4.3522 7.6450 115.6305 56.3311 30.8984 178.0382 19 L 4.1663 7.1548 121.0152 54.1973 39.8491 176.4436 20 T 4.4927 7.6417 117.1532 64.4453 69.7553 174.4123 21 F 3.7046 6.9467 113.7235 54.5898 41.3670 174.7007 22 N 4.4264 7.7548 117.5385 53.4263 36.5393 175.2558 23 S 3.9230 6.6734 113.8961 56.9962 63.0502 173.1554 24 R 3.8601 8.3533 130.4473 58.7723 29.9600 176.3623 25 P 4.2112 0.0000 0.0000 65.4874 31.3655 178.5488 26 I 3.5600 7.4750 118.3845 64.5912 37.1390 178.5501 27 I 3.6264 7.7034 120.4259 64.7581 36.7696 178.6920 28 T 3.9578 7.9670 116.6333 66.6721 68.1645 177.1279 29 T 3.8592 7.7725 117.8219 66.6475 68.4948 176.8495 30 L 3.8552 8.0215 121.0021 57.8521 41.5184 179.8226 31 T 3.9039 7.7603 115.7011 66.4586 68.3746 177.0620 32 K 4.0113 8.3833 120.8133 59.5482 32.1913 179.4218 33 L 4.0404 8.3300 119.3123 57.7039 41.2628 179.4447 34 A 4.3215 7.6618 120.0616 55.0825 18.3327 178.9288 35 E 4.2747 8.1810 117.0327 59.2333 29.9803 178.1784 36 E 4.3347 8.5312 116.6844 57.6033 30.4456 176.4743 37 N 5.1833 8.3936 117.0238 51.8536 39.9015 176.1635 38 I 3.4792 8.1617 120.8259 64.4498 37.6765 178.9693 39 S 4.0582 8.0298 113.3892 60.5430 63.0805 175.0804 40 C 4.1568 8.3785 118.4623 59.0905 27.8741 174.9531 41 A 4.0777 7.5403 125.8867 55.3646 17.8747 180.3736 42 Q 3.5538 7.9409 115.1515 59.0233 28.6884 179.0169 43 Y 3.6982 8.1281 117.8930 61.0672 37.9631 178.3389 44 F 4.2249 7.6371 118.1724 60.5459 38.9153 177.6215 45 V 3.5117 8.0940 117.9251 66.2273 31.2647 177.8107 46 D 4.3339 8.0781 118.2337 57.2322 40.5398 178.5081 47 A 4.1114 8.2830 121.2162 55.3455 18.4355 179.5569 48 I 3.7277 8.1991 117.8034 64.6544 37.3369 178.4673 49 E 3.9707 8.5701 119.4871 59.5221 29.2589 179.5705 50 S 4.1228 8.1616 114.1322 61.4234 62.7719 176.2323 51 R 4.0841 8.1883 122.5302 59.4451 29.5879 178.2918 52 I 3.5918 7.6523 118.0356 64.5543 37.0816 178.0038 53 E 4.1446 7.8905 118.3363 59.6185 29.5404 178.5153 54 K 4.0536 9.4907 119.6461 56.1323 32.0651 176.5454 55 C 3.6985 6.4830 118.0130 55.7166 32.6137 174.7724 56 M 4.1736 8.5448 120.6422 55.0932 32.0063 175.9792 57 P 4.3270 0.0000 0.0000 64.5464 31.5402 177.1914 58 K 4.3867 7.8515 116.1487 56.3089 32.3667 176.4884 59 Q 4.7843 8.1191 117.1609 55.0845 30.7745 177.6049 60 K 3.9162 7.9854 118.3648 59.2062 32.0199 178.3592 61 L 3.6042 7.5076 120.0839 58.4647 41.9136 178.6318 62 Y 4.2406 6.7312 115.6947 60.9414 37.6723 178.3956 63 A 4.0333 7.9308 121.3796 55.1718 18.5148 179.5492 64 F 4.0129 8.1439 116.3633 60.8556 38.8460 177.5396 65 Y 4.6093 8.0692 116.3475 60.8581 37.6051 178.4275 66 A 4.0160 7.9921 121.5697 54.9823 18.5506 179.2838 67 L 3.5862 8.0666 119.0480 58.3190 42.0947 178.6727 68 D 4.6609 8.9188 118.2462 57.5345 41.1435 178.1930 69 S 4.1312 8.5680 113.9175 61.4759 62.3679 176.1201 70 I 3.6540 7.8791 122.4807 64.7612 36.7861 178.3242 71 C 4.2630 8.2990 117.4305 62.4192 27.6729 176.1555 72 K 4.1689 7.9769 119.4295 58.8201 32.0150 178.3929 73 N 4.6371 8.3874 115.3958 54.4080 38.9015 176.6443 74 V 4.2294 8.0487 118.6021 63.3866 33.5795 176.9569 75 G 3.9773 8.6116 106.9161 46.2603 0.0000 173.3874 76 S 4.1797 8.5331 119.5779 57.9408 65.1626 173.1035 77 P 4.1221 0.0000 0.0000 63.6227 30.9803 177.5938 78 Y 4.2484 7.2403 118.3946 61.8143 37.6689 178.5596 79 T 3.8934 7.9938 108.6907 64.8069 68.6480 175.9462 80 I 4.0107 7.4833 121.9009 64.1531 37.5941 177.6311 81 Y 4.4209 7.9476 117.8773 61.3320 37.5907 178.7533 82 F 4.6286 8.8339 118.5686 60.2539 38.7580 177.8681 83 S 4.1941 7.9648 114.5221 61.3749 62.6326 175.9913 84 R 4.1018 7.4506 119.6938 59.5623 30.1304 177.5455 85 N 4.7931 8.0044 113.0512 53.0913 39.0227 176.2519 86 L 3.9220 7.5524 123.2095 58.6464 41.9739 178.3732 87 F 4.1121 8.3215 119.3268 61.6152 39.3053 176.9807 88 N 3.9506 8.1727 115.1925 56.3183 38.4609 177.3474 89 L 4.0603 8.1515 120.4542 57.6794 41.5932 179.0258 90 Y 3.9202 8.4432 119.9260 60.5141 38.8474 177.5396 91 K 3.0633 7.7145 120.5978 59.3491 31.8797 178.5053 92 R 3.7844 7.3843 117.2496 59.6862 30.2536 178.3520 93 T 3.9725 7.8388 115.3755 66.7078 68.5044 175.7641 94 Y 3.7772 8.0120 121.8171 60.8940 38.6042 178.3265 95 L 4.4548 8.0058 117.1218 56.4377 41.6818 177.7047 96 L 4.7237 7.5500 117.2724 54.0864 42.5667 176.2595 97 V 4.4061 7.2029 111.2895 58.5076 34.9834 175.5179 98 D 4.5083 8.1452 121.7769 53.5341 41.2208 177.1452 99 N 4.2746 8.4330 116.3361 56.2478 38.3335 177.9912 100 T 3.8575 7.8630 117.1404 66.9052 68.6843 176.7358 101 T 3.7904 8.7709 117.9553 66.5013 68.2689 176.9562 102 R 3.5036 7.6446 120.0841 59.4044 29.9120 179.1236 103 T 3.8618 7.8451 115.4756 66.6310 68.3852 176.8381 104 K 4.0044 7.7472 120.2814 59.3760 31.9826 179.4851 105 L 3.8254 7.8409 119.3448 57.5462 41.3966 179.6689 106 I 3.8894 8.1365 120.3121 64.4686 37.0855 177.9892 107 N 4.3123 8.4303 118.1321 56.7488 38.5858 176.6597 108 M 3.8451 8.1034 119.8434 58.4183 32.2988 178.0114 109 F 3.5358 8.0928 121.1562 60.8371 39.4988 177.0061 110 K 3.7794 8.1314 119.4872 59.2823 31.7899 178.4608 111 L 4.2356 7.3524 117.1275 56.4373 41.9627 178.8415 112 W 4.7042 7.6892 119.6193 59.4971 28.8751 178.5902 113 L 4.0468 7.5914 118.2404 56.3863 42.8103 177.1985 114 N 5.1349 7.8562 117.0278 50.8237 38.3528 170.9799 115 P 4.5181 0.0000 0.0000 63.5296 32.4947 176.3900 116 N 4.2685 9.7704 117.4088 54.2143 36.2367 173.6930 117 D 4.5924 8.1842 113.1810 55.7875 39.5364 173.0675 118 T 4.5557 9.0195 115.0835 61.1419 69.8749 176.3061 119 G 3.8954 8.6617 117.3834 45.7047 0.0000 173.2955 120 L 4.4957 8.1000 124.3816 51.3248 42.1435 173.5836 121 P 4.6348 0.0000 0.0000 62.7400 31.5191 176.7920 122 L 3.8104 9.0057 122.3669 57.0550 42.1280 176.0910 123 F 4.8938 7.5765 114.8876 54.3874 42.9747 174.4112 124 E 4.1511 8.7532 120.7165 56.9831 30.0907 178.5762 125 G 3.8833 9.0379 111.2062 47.8645 0.0000 175.6038 126 S 4.1055 8.0957 115.5929 61.6068 63.0543 176.4450 127 A 4.0739 8.0098 124.5637 54.4879 18.0788 179.4565 128 L 4.3122 8.0240 117.2344 57.9439 41.6308 179.4698 129 E 4.0507 8.4866 118.7208 59.5068 29.5319 179.6207 130 K 3.7778 7.8903 117.9100 59.2268 31.8783 179.6075 131 I 4.0065 7.6565 120.0479 64.2635 36.9802 178.0168 132 E 3.6651 8.5150 120.5748 59.1559 29.5036 178.4701 133 Q 3.9629 8.3939 119.9846 59.3617 28.7144 178.3128 134 F 4.2916 8.2874 121.3127 61.1854 39.4257 177.1962 135 L 3.4467 7.6979 118.8381 57.4448 41.2259 179.3974 136 I 3.8438 8.0201 120.2600 64.2792 36.8551 178.2793 137 K 4.1643 7.6883 116.5359 57.6295 31.9319 178.0693 138 A 4.4848 6.7396 118.9619 50.6779 19.7987 176.1628 139 S 3.5903 7.5781 113.5556 61.3087 61.0399 173.0424 140 A 4.6468 8.4433 120.0171 51.7066 19.9698 177.0033 141 A 4.6302 7.4420 117.9093 49.5542 22.3001 175.7020 142 A 4.1539 8.4257 124.0019 53.4785 18.7752 177.8548 143 L 3.8121 8.4081 119.2262 54.1561 40.9187 174.1194 144 E 4.1240 7.3700 121.4115 57.6758 30.1629 174.5696 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 2 D 8.36 4.34 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 3 H 7.40 4.43 0.00 3.25 3.11 0.00 5.76 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.64 4.45 0.00 2.89 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 5 T 7.22 3.82 4.24 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 1.21 0.00 0.00 6 E 8.57 4.36 0.00 2.46 1.79 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 2.46 2.24 0.00 7 V 7.59 3.41 2.11 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 1.26 0.00 0.00 0.95 0.00 0.00 8 I 7.81 3.77 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.47 1.11 0.00 0.00 9 V 7.36 3.82 2.32 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 1.23 0.00 0.00 0.71 0.00 0.00 10 K 8.21 4.03 0.00 1.89 1.92 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.61 7.81 11 D 8.53 4.41 0.00 3.04 2.78 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 12 F 8.53 3.97 0.00 3.34 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 13 N 8.42 4.42 0.00 3.06 2.92 0.00 0.00 7.05 7.66 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 14 S 7.94 4.08 0.00 4.00 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 15 I 7.56 3.75 1.74 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.27 0.75 0.00 0.00 16 L 7.71 3.84 0.00 1.69 1.77 0.79 1.17 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 17 E 7.81 4.07 0.00 2.19 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 2.56 2.50 0.00 18 E 7.64 4.35 0.00 2.11 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 2.33 2.48 0.00 19 L 7.15 4.17 0.00 1.81 1.62 0.91 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.64 4.49 4.48 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 0.00 0.00 0.00 1.30 0.00 0.00 21 F 6.95 3.70 0.00 2.81 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 22 N 7.75 4.43 0.00 3.02 2.91 0.00 0.00 6.84 7.63 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 23 S 6.67 3.92 0.00 2.72 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 24 R 8.35 3.86 0.00 1.86 1.90 0.00 3.39 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 25 P 0.00 4.21 0.00 2.18 2.07 0.00 3.57 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 2.14 2.18 0.00 26 I 7.48 3.56 1.78 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.46 0.74 0.00 0.00 27 I 7.70 3.63 1.83 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.14 0.93 0.00 0.00 28 T 7.97 3.96 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 1.20 0.00 0.00 29 T 7.77 3.86 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 1.17 0.00 0.00 30 L 8.02 3.86 0.00 1.55 1.52 0.61 -0.39 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 31 T 7.76 3.90 4.38 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 1.22 0.00 0.00 32 K 8.38 4.01 0.00 1.90 1.88 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.66 1.63 7.81 33 L 8.33 4.04 0.00 1.81 1.64 0.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.66 4.32 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 35 E 8.18 4.27 0.00 2.08 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 2.39 2.43 0.00 36 E 8.53 4.33 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 2.39 2.45 0.00 37 N 8.39 5.18 0.00 3.26 2.77 0.00 0.00 6.85 6.95 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 38 I 8.16 3.48 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.89 0.83 0.00 0.00 39 S 8.03 4.06 0.00 3.88 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 40 C 8.38 4.16 0.00 1.77 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 0.00 0.00 0.00 0.00 41 A 7.54 4.08 1.17 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 42 Q 7.94 3.55 0.00 1.84 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.86 0.00 0.00 0.00 0.00 0.00 1.58 1.47 0.00 43 Y 8.13 3.70 0.00 2.77 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 44 F 7.64 4.22 0.00 3.16 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.09 3.51 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 0.70 0.00 0.00 0.47 0.00 0.00 46 D 8.08 4.33 0.00 2.90 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 47 A 8.28 4.11 1.81 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 0.00 0.00 0.00 0.00 0.00 0.00 48 I 8.20 3.73 2.29 0.00 0.00 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 1.67 1.16 0.90 0.00 0.00 49 E 8.57 3.97 0.00 2.07 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 2.59 2.87 0.00 50 S 8.16 4.12 0.00 4.08 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 51 R 8.19 4.08 0.00 1.95 2.28 0.00 3.24 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 52 I 7.65 3.59 1.87 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.60 0.69 0.00 0.00 53 E 7.89 4.14 0.00 2.10 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 2.33 2.58 0.00 54 K 9.49 4.05 0.00 1.62 1.68 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.64 7.81 55 C 6.48 3.70 0.00 3.08 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 56 M 8.54 4.17 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.58 0.00 57 P 0.00 4.33 0.00 2.00 2.19 0.00 3.64 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 2.01 2.09 0.00 58 K 7.85 4.39 0.00 1.75 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.42 7.81 59 Q 8.12 4.78 0.00 2.14 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 60 K 7.99 3.92 0.00 1.74 1.88 0.00 1.65 0.00 0.00 1.83 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.53 7.81 61 L 7.51 3.60 0.00 1.27 0.74 0.41 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 6.73 4.24 0.00 3.16 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 63 A 7.93 4.03 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 64 F 8.14 4.01 0.00 3.13 3.06 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 0.00 0.00 0.00 65 Y 8.07 4.61 0.00 3.31 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 66 A 7.99 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 67 L 8.07 3.59 0.00 1.40 1.87 0.46 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.92 4.66 0.00 3.38 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 69 S 8.57 4.13 0.00 4.04 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 70 I 7.88 3.65 2.02 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.55 0.33 0.00 0.00 71 C 8.30 4.26 0.00 3.06 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 72 K 7.98 4.17 0.00 1.87 1.90 0.00 1.93 0.00 0.00 1.79 0.00 0.00 3.18 0.00 0.00 3.55 0.00 0.00 0.00 0.00 1.53 1.71 7.81 73 N 8.39 4.64 0.00 2.82 2.89 0.00 0.00 6.84 8.40 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 74 V 8.05 4.23 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 1.13 0.00 0.00 1.00 0.00 0.00 75 G 8.61 3.98 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 0.00 0.00 0.00 76 S 8.53 4.18 0.00 3.89 3.80 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 77 P 0.00 4.12 0.00 0.84 1.86 0.00 3.21 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.73 0.00 78 Y 7.24 4.25 0.00 3.33 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 79 T 7.99 3.89 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 0.98 0.00 0.00 80 I 7.48 4.01 1.73 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.66 0.87 0.00 0.00 81 Y 7.95 4.42 0.00 2.80 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 82 F 8.83 4.63 0.00 3.55 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 83 S 7.96 4.19 0.00 4.22 4.06 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 0.00 0.00 0.00 84 R 7.45 4.10 0.00 1.97 2.15 0.00 3.25 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 85 N 8.00 4.79 0.00 3.14 2.87 0.00 0.00 6.58 6.74 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 86 L 7.55 3.92 0.00 1.76 1.63 0.47 -0.14 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 87 F 8.32 4.11 0.00 3.36 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 88 N 8.17 3.95 0.00 2.90 2.83 0.00 0.00 7.10 6.74 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 89 L 8.15 4.06 0.00 2.11 1.86 0.98 0.61 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 90 Y 8.44 3.92 0.00 3.24 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 91 K 7.71 3.06 0.00 0.79 1.02 0.00 1.06 0.00 0.00 1.14 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.85 0.21 7.81 92 R 7.38 3.78 0.00 1.88 1.90 0.00 3.30 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 93 T 7.84 3.97 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 1.19 0.00 0.00 94 Y 8.01 3.78 0.00 2.77 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 95 L 8.01 4.45 0.00 1.72 1.80 0.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.55 4.72 0.00 1.57 1.60 0.90 0.70 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 97 V 7.20 4.41 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 0.76 0.00 0.00 0.72 0.00 0.00 98 D 8.15 4.51 0.00 2.87 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 99 N 8.43 4.27 0.00 2.69 2.83 0.00 0.00 6.82 7.05 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 0.00 100 T 7.86 3.86 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 1.19 0.00 0.00 101 T 8.77 3.79 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 0.96 0.00 0.00 102 R 7.64 3.50 0.00 1.76 1.55 0.00 2.99 0.00 0.00 2.51 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.22 0.00 103 T 7.85 3.86 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 0.00 104 K 7.75 4.00 0.00 1.88 1.92 0.00 1.67 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.65 7.81 105 L 7.84 3.83 0.00 1.71 1.33 0.45 -0.11 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 0.00 106 I 8.14 3.89 2.11 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.98 1.00 0.00 0.00 107 N 8.43 4.31 0.00 2.83 2.95 0.00 0.00 6.90 8.12 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 0.00 108 M 8.10 3.85 0.00 1.91 2.03 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 1.67 0.00 109 F 8.09 3.54 0.00 2.90 3.19 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 0.00 110 K 8.13 3.78 0.00 2.13 1.92 0.00 1.60 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.50 7.81 111 L 7.35 4.24 0.00 1.76 1.78 0.94 1.30 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 0.00 112 W 7.69 4.70 0.00 3.38 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 0.00 113 L 7.59 4.05 0.00 1.58 1.61 0.80 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 114 N 7.86 5.13 0.00 2.75 2.62 0.00 0.00 7.27 7.73 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 0.00 115 P 0.00 4.52 0.00 2.23 1.99 0.00 3.98 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.48 0.00 116 N 9.77 4.27 0.00 2.79 2.87 0.00 0.00 6.99 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 0.00 117 D 8.18 4.59 0.00 2.82 2.78 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 0.00 118 T 9.02 4.56 4.41 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 1.25 0.00 0.00 119 G 8.66 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 0.00 120 L 8.10 4.50 0.00 1.52 1.57 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.63 0.00 2.44 2.12 0.00 3.90 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 122 L 9.01 3.81 0.00 1.66 0.88 0.72 0.36 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 0.00 123 F 7.58 4.89 0.00 2.92 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 0.00 124 E 8.75 4.15 0.00 2.14 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 2.37 2.40 0.00 125 G 9.04 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 0.00 126 S 8.10 4.11 0.00 4.05 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 0.00 127 A 8.01 4.07 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.02 4.31 0.00 1.88 1.97 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.49 4.05 0.00 2.19 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 2.37 2.60 0.00 130 K 7.89 3.78 0.00 1.50 0.74 0.00 1.29 0.00 0.00 0.89 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.10 1.40 7.81 131 I 7.66 4.01 2.02 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.98 -0.44 0.00 0.00 132 E 8.52 3.67 0.00 2.31 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 2.36 2.38 0.00 133 Q 8.39 3.96 0.00 2.41 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 134 F 8.29 4.29 0.00 3.41 3.41 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 0.00 135 L 7.70 3.45 0.00 1.72 1.48 0.37 0.69 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 0.00 136 I 8.02 3.84 1.98 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 1.68 1.38 0.94 0.00 0.00 137 K 7.69 4.16 0.00 1.76 1.81 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.66 1.61 7.81 138 A 6.74 4.48 0.78 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 0.00 139 S 7.58 3.59 0.00 3.91 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 0.00 140 A 8.44 4.65 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 0.00 141 A 7.44 4.63 1.19 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 0.00 0.00 142 A 8.43 4.15 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 0.00 143 L 8.41 3.81 0.00 1.76 1.93 0.92 1.01 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 0.00 144 E 7.37 4.12 0.00 1.90 1.83 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 2.27 2.23 0.00