NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 M 3.7772 8.2893 120.3252 54.9895 33.0249 173.3549 27 W 4.6252 6.9933 116.7024 55.7494 31.0479 176.9481 28 G 3.4882 8.9885 112.9652 45.8385 0.0000 173.7315 29 K 4.2412 8.8905 122.7650 56.3224 30.5281 175.7590 30 K 4.6947 7.5614 115.9016 55.0482 35.3061 175.9543 31 D 4.5773 8.8564 120.2415 54.4955 40.4423 176.8393 32 A 4.3807 7.9660 122.9987 54.0644 20.1333 179.1696 33 G 3.8531 8.3133 102.6563 48.0822 0.0000 175.4320 34 T 3.6450 7.9907 111.7333 65.0139 68.4300 175.7899 35 E 3.4301 8.0941 120.5146 58.3982 29.8267 178.8572 36 L 3.9385 7.5100 119.6733 57.8325 41.7005 179.5078 37 T 3.8139 8.1355 110.0501 64.5292 68.5646 175.9660 38 N 4.0370 7.6077 119.8081 56.6660 38.9960 176.2870 39 Y 4.1573 7.6764 118.2283 61.4248 37.8965 179.0181 40 Q 3.4594 7.7252 118.1137 58.5437 28.6839 178.8105 41 T 3.6553 7.8416 114.8131 65.0412 67.4306 175.9416 42 L 3.8737 7.9558 122.1791 57.9959 42.0099 178.7433 43 A 3.6118 7.6197 120.6927 55.2837 17.9093 179.5006 44 T 3.8480 7.6196 110.5341 65.1411 67.6925 176.1530 45 N 4.3793 8.6003 119.2053 56.3224 38.4560 177.1922 46 T 3.8053 8.2712 115.2569 64.8010 67.4754 175.3407 47 I 3.6999 6.9147 119.8401 63.9747 38.6181 175.9571 48 G 4.0824 7.6908 104.0161 45.3214 0.0000 172.1326 49 M 4.5140 7.8538 117.3860 56.4606 34.7820 177.8362 50 M 4.8247 7.4204 117.7423 54.3904 33.3803 174.9967 51 K 4.3831 8.2023 115.6531 57.4201 33.6635 176.8754 52 G 3.8667 8.2496 104.0939 47.3132 0.0000 175.5651 53 V 4.1693 7.3358 115.9322 61.4342 30.6153 173.3662 54 D 4.7353 8.0983 122.1298 55.5330 47.3800 174.6459 55 G 3.7566 7.8784 105.6064 46.1532 0.0000 171.6082 56 Y 4.3078 7.5366 118.9091 55.9338 40.7884 175.4506 57 A 3.9567 8.1776 124.0561 52.5627 18.9537 176.7717 58 F 4.0700 7.9072 121.3530 57.2388 38.3891 176.1858 59 T 4.0809 8.7284 117.4242 65.0408 69.1350 175.5981 60 S 3.6841 8.2777 116.3220 59.5946 60.1873 173.4254 61 G 3.8132 7.9854 101.6062 45.9143 0.0000 172.4298 62 A 4.5398 7.6228 121.4902 53.6226 20.6247 179.1881 63 K 3.8967 7.8993 116.1145 60.0270 32.4967 178.7145 64 M 4.0197 7.8017 119.9383 59.0749 31.9326 178.8473 65 T 3.9494 7.8190 114.9595 66.4390 68.7577 176.0018 66 D 4.3555 8.2132 120.1330 58.0098 41.1305 178.8839 67 T 3.9058 8.3294 116.2992 66.3022 68.5471 176.5321 68 L 3.9256 7.9502 122.2439 58.2428 42.1760 179.0665 69 I 3.8087 8.2335 121.1322 64.1578 36.9363 178.6394 70 Q 4.3056 8.3818 117.1361 58.4457 28.5738 178.0018 71 A 4.2588 7.9303 119.9979 52.1574 18.4094 177.7946 72 G 3.7119 8.2599 105.3791 46.1494 0.0000 175.1682 73 A 4.0790 7.1564 122.3943 53.8989 19.2283 180.0613 74 A 4.0615 7.8908 119.5069 53.8966 18.9945 178.2368 75 K 4.3849 7.6180 115.3631 55.5394 35.6779 176.1501 76 G 4.0065 8.4540 117.8243 45.0285 0.0000 170.7066 77 M 4.8097 7.2214 116.8599 53.3872 36.3613 174.0138 78 T 4.1180 8.2367 114.5684 61.7756 68.0779 173.2329 79 V 4.5651 8.0404 125.7956 61.1838 35.1429 174.9498 80 S 4.5582 8.7306 120.1651 56.1641 63.5287 173.1809 81 G 3.8833 8.8329 115.4137 46.4357 0.0000 171.0541 82 D 4.4750 8.8726 125.9777 52.5696 39.0975 176.2981 83 P 4.2209 0.0000 0.0000 64.5438 31.6695 176.8042 84 A 4.2841 7.9543 119.8494 51.3242 19.4382 176.4884 85 S 3.7767 6.9440 110.0523 57.3679 60.1310 170.2725 86 G 4.1351 9.4628 113.4032 45.8201 0.0000 172.0444 87 S 4.5037 7.8493 114.3762 56.8528 65.0070 174.7279 88 A 4.2897 8.4164 126.7357 52.2989 20.0069 175.7701 89 T 4.9098 8.4284 113.3127 60.3608 70.9546 172.3273 90 L 4.9512 8.8163 131.1142 53.5473 44.3482 175.3375 91 W 4.7571 9.0661 126.1833 55.7031 29.6114 175.6764 92 N 4.7219 8.4571 123.9037 52.3375 38.1023 176.0867 93 S 4.3593 9.1252 120.7650 61.6843 63.5024 176.2192 94 W 4.2363 8.5941 118.6834 59.8529 30.1528 177.7509 95 G 4.5889 7.8163 110.8576 44.7089 0.0000 174.6768 96 G 4.3069 9.3378 112.7482 46.2075 0.0000 171.8906 97 Q 4.8502 5.7400 117.6922 53.9282 34.1043 175.4329 98 I 5.0241 8.4880 121.5670 59.5796 41.9168 174.9105 99 V 4.5978 8.6292 124.5655 61.3923 34.0173 174.4920 100 V 4.6027 8.6728 122.5849 60.0778 33.1984 175.4198 101 A 4.8434 8.8717 127.3831 49.4508 22.4709 173.6622 102 P 4.0160 0.0000 0.0000 62.3172 31.0458 176.2974 103 D 4.7798 8.7987 120.1694 53.2695 41.1743 175.0441 104 T 4.5055 7.8583 108.8111 60.0773 68.9207 174.9339 105 A 4.3072 8.2607 130.4804 52.6057 21.4315 174.8298 106 G 3.5680 8.9680 112.6252 46.0677 0.0000 171.8913 107 G 4.2468 7.6671 110.5189 44.4596 0.0000 170.7728 108 T 4.4595 8.3753 106.0269 62.4746 72.7008 174.8762 109 G 4.1458 7.4665 107.5384 44.6953 0.0000 171.8421 110 F 3.8025 7.5667 109.5919 58.5481 37.1117 176.3303 111 N 4.8600 8.2545 117.1299 52.4715 39.6038 175.1813 112 N 5.0355 8.9365 121.7408 51.5864 41.6057 174.2930 113 G 4.2665 8.4577 109.9354 44.9508 0.0000 172.1891 114 F 5.4338 9.4560 126.0727 55.6271 41.8822 175.1450 115 T 5.0779 8.9708 113.5438 60.0999 71.3989 173.0242 116 I 4.8233 8.8031 127.9719 59.3151 40.0352 174.9176 117 T 4.6793 8.6417 123.3144 62.0606 68.8719 173.4667 118 T 5.0165 8.8158 117.3832 60.2982 72.4312 172.4560 119 N 5.0802 8.8192 122.9050 52.0615 40.9732 173.2967 120 K 4.0177 8.6400 127.5117 57.1705 36.2823 174.3242 121 V 3.5606 8.2333 119.9411 62.2982 31.1354 174.1158 122 P 4.6236 0.0000 0.0000 62.0556 33.6070 175.8595 123 Q 3.9726 8.6221 117.1985 59.6939 28.8272 178.6552 124 S 4.1411 8.1585 114.5535 61.6921 62.9144 176.2094 125 A 4.1445 8.0166 123.9264 54.3426 18.3419 177.9788 126 C 4.3121 8.6826 113.5504 58.6943 36.5351 176.4897 127 V 3.7685 7.4912 119.4572 65.6234 31.4181 178.0246 128 S 4.1241 7.7894 114.3986 61.7486 62.7664 176.7372 129 I 3.7626 8.2542 122.6246 64.6542 36.8074 178.6786 130 S 4.1245 7.7266 114.2914 61.9559 62.4612 176.6221 131 T 3.9834 8.3673 117.6193 66.9231 67.9789 176.4206 132 G 3.7633 8.2867 107.3013 47.8750 0.0000 175.5307 133 M 4.2546 8.7814 120.7680 57.8537 31.9771 178.2913 134 S 4.2786 8.1762 114.5193 61.0004 63.4504 176.1967 135 R 4.1443 7.5620 117.7806 58.1699 29.7563 177.0451 136 S 4.5896 7.9292 114.3597 57.3531 62.3876 174.9894 137 G 3.6963 8.6821 109.7174 49.0858 0.0000 176.1065 138 G 3.6199 7.4110 106.6705 45.4892 0.0000 173.9884 139 T 3.9314 7.4990 117.3743 62.7236 69.4888 173.2592 140 S 4.5123 7.5654 117.8836 57.9098 67.0418 176.2300 141 G 4.8786 6.9697 116.3251 45.8720 0.0000 172.8679 142 I 4.4002 7.0818 121.1388 60.3579 38.7964 177.1138 143 K 4.6168 8.4602 128.0797 54.5455 34.2501 176.4024 144 I 4.4785 8.1149 126.1882 59.9498 39.2663 174.8660 145 N 4.1841 8.3301 122.7332 54.8613 39.0335 174.3325 146 G 4.1481 8.8445 114.0233 46.4615 0.0000 172.0167 147 N 4.7229 8.0885 115.5016 52.8056 39.4852 172.7799 148 N 4.0755 8.1176 117.1274 53.4273 38.2708 172.3949 149 H 5.0979 8.0219 120.1916 55.1288 33.2749 172.5769 150 T 4.7330 8.3028 105.4564 64.0683 73.2940 174.9333 151 D 4.6850 8.0472 119.0520 53.6556 40.6572 175.8766 152 A 3.8211 7.9003 122.9515 52.4383 18.0942 178.0903 153 K 4.2903 8.4795 125.0272 55.5416 32.1492 175.7398 154 V 4.3964 8.1581 120.1230 59.7016 33.7740 175.9888 155 T 4.7380 8.0329 113.4000 58.8161 73.4042 174.7361 156 A 3.9579 8.4356 121.8222 55.4545 18.2234 179.5697 157 E 3.9605 8.1562 115.4548 59.4946 29.4919 179.3376 158 I 3.6437 7.6229 120.4426 64.3040 37.0155 178.3191 159 A 3.9767 8.5006 121.9192 54.8070 17.8834 179.7303 160 S 4.1868 8.1236 112.4531 60.6553 63.0663 175.5746 161 S 4.5017 7.1594 114.4389 59.8909 63.3261 174.9607 162 E 4.0539 8.5517 120.9683 58.5625 29.6978 176.5891 163 C 4.5524 7.2282 113.9570 56.1725 41.0729 173.9272 164 T 4.0352 8.5095 120.5312 63.5441 68.7591 173.9204 165 A 4.0180 8.2837 126.8337 53.7474 18.3525 177.7553 166 D 4.3965 7.1799 109.2277 54.2269 43.6744 175.6819 167 N 5.0617 8.6885 126.9484 53.0975 41.2052 178.1870 168 G 3.8720 8.4134 107.0067 46.5572 0.0000 176.8201 169 R 4.3581 8.7499 118.6834 53.9949 29.5004 174.6465 170 T 4.0116 7.9386 111.7068 60.5621 69.6062 175.0231 171 G 3.8588 8.5737 111.3155 45.7746 0.0000 173.2255 172 T 3.7498 8.5153 111.2264 62.3748 68.5000 174.2599 173 N 4.5940 8.4657 124.9168 52.1655 37.3594 172.8527 174 T 4.1742 7.9916 118.1373 63.1237 70.1215 173.1920 175 L 4.9046 8.7616 126.8412 52.8876 45.2942 175.8155 176 V 4.3591 8.8015 125.1499 61.6584 33.2901 174.1724 177 F 4.7221 8.8702 130.4859 56.6072 41.1452 173.6099 178 N 5.6546 8.3143 121.7265 52.0989 41.2813 173.2117 179 Y 4.5296 9.1704 126.0840 56.0314 41.6840 173.7284 180 N 5.0855 8.8460 124.5173 53.2558 40.3720 175.8321 181 G 4.0720 8.5600 110.6654 45.9464 0.0000 173.2390 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 26 M 8.29 3.78 0.00 1.86 1.94 0.00 0.00 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.08 0.00 27 W 6.99 4.63 0.00 3.37 3.13 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 28 G 8.99 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 0.00 0.00 0.00 29 K 8.89 4.24 0.00 1.98 2.00 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.41 7.81 30 K 7.56 4.69 0.00 1.83 1.76 0.00 1.60 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.44 7.81 31 D 8.86 4.58 0.00 2.85 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 32 A 7.97 4.38 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 33 G 8.31 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 0.00 0.00 0.00 34 T 7.99 3.65 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 1.07 0.00 0.00 35 E 8.09 3.43 0.00 1.63 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 2.34 1.89 0.00 36 L 7.51 3.94 0.00 1.86 1.83 1.08 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.14 3.81 4.12 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 1.24 0.00 0.00 38 N 7.61 4.04 0.00 2.70 2.56 0.00 0.00 6.99 7.64 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 39 Y 7.68 4.16 0.00 2.48 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 40 Q 7.73 3.46 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.00 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 41 T 7.84 3.66 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 1.22 0.00 0.00 42 L 7.96 3.87 0.00 1.69 1.71 0.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 43 A 7.62 3.61 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.62 3.85 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 1.20 0.00 0.00 45 N 8.60 4.38 0.00 2.83 2.74 0.00 0.00 6.51 6.91 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 46 T 8.27 3.81 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 0.93 0.00 0.00 47 I 6.91 3.70 1.92 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 1.39 0.90 0.87 0.00 0.00 48 G 7.69 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 49 M 7.85 4.51 0.00 1.90 2.03 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 2.45 2.55 0.00 50 M 7.42 4.82 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 51 K 8.20 4.38 0.00 2.03 2.07 0.00 1.47 0.00 0.00 1.80 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.57 1.52 7.81 52 G 8.25 3.87 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 0.00 0.00 0.00 53 V 7.34 4.17 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 0.88 0.00 0.00 0.98 0.00 0.00 54 D 8.10 4.74 0.00 2.69 2.83 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 55 G 7.88 3.76 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 0.00 0.00 0.00 56 Y 7.54 4.31 0.00 2.94 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 57 A 8.18 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 7.91 4.07 0.00 3.30 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 59 T 8.73 4.08 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 1.21 0.00 0.00 60 S 8.28 3.68 0.00 4.07 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 61 G 7.99 3.81 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 0.00 62 A 7.62 4.54 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 63 K 7.90 3.90 0.00 2.01 2.08 0.00 1.39 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.76 7.81 64 M 7.80 4.02 0.00 2.10 2.28 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.68 0.00 65 T 7.82 3.95 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 1.24 0.00 0.00 66 D 8.21 4.36 0.00 2.79 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 67 T 8.33 3.91 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 1.19 0.00 0.00 68 L 7.95 3.93 0.00 1.79 1.91 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 69 I 8.23 3.81 2.07 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 1.71 1.05 1.02 0.00 0.00 70 Q 8.38 4.31 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.73 0.00 71 A 7.93 4.26 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 72 G 8.26 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 0.00 0.00 0.00 73 A 7.16 4.08 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 74 A 7.89 4.06 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 75 K 7.62 4.38 0.00 1.78 1.61 0.00 1.58 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.44 1.58 7.81 76 G 8.45 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 0.00 0.00 0.00 77 M 7.22 4.81 0.00 1.95 1.95 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 2.48 2.60 0.00 78 T 8.24 4.12 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 1.09 0.00 0.00 79 V 8.04 4.57 2.25 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 1.03 0.00 0.00 0.96 0.00 0.00 80 S 8.73 4.56 0.00 4.25 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 81 G 8.83 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 82 D 8.87 4.48 0.00 2.90 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 83 P 0.00 4.22 0.00 2.20 2.23 0.00 3.77 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 84 A 7.95 4.28 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 85 S 6.94 3.78 0.00 3.95 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 86 G 9.46 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 0.00 0.00 0.00 87 S 7.85 4.50 0.00 3.90 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 88 A 8.42 4.29 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 89 T 8.43 4.91 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 1.37 0.00 0.00 90 L 8.82 4.95 0.00 1.77 1.55 1.02 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 91 W 9.07 4.76 0.00 3.18 3.27 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 92 N 8.46 4.72 0.00 2.67 2.83 0.00 0.00 7.17 8.98 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 93 S 9.13 4.36 0.00 4.05 4.10 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 94 W 8.59 4.24 0.00 3.25 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 95 G 7.82 4.59 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 0.00 0.00 0.00 96 G 9.34 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 97 Q 5.74 4.85 0.00 1.75 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.26 6.11 0.00 0.00 0.00 0.00 0.00 1.86 1.84 0.00 98 I 8.49 5.02 2.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.85 0.91 0.00 0.00 99 V 8.63 4.60 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 1.07 0.00 0.00 0.87 0.00 0.00 100 V 8.67 4.60 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 0.86 0.00 0.00 0.94 0.00 0.00 101 A 8.87 4.84 1.13 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 0.00 102 P 0.00 4.02 0.00 1.83 1.29 0.00 3.60 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.73 0.00 103 D 8.80 4.78 0.00 2.74 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 0.00 104 T 7.86 4.51 4.34 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 1.34 0.00 0.00 105 A 8.26 4.31 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 0.00 106 G 8.97 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 7.67 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 0.00 108 T 8.38 4.46 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 1.20 0.00 0.00 109 G 7.47 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 0.00 0.00 0.00 110 F 7.57 3.80 0.00 3.24 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 0.00 111 N 8.25 4.86 0.00 2.62 2.82 0.00 0.00 7.13 8.02 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 0.00 112 N 8.94 5.04 0.00 2.70 3.06 0.00 0.00 7.11 7.81 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 0.00 113 G 8.46 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 0.00 0.00 0.00 0.00 114 F 9.46 5.43 0.00 2.98 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 0.00 115 T 8.97 5.08 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 1.29 0.00 0.00 116 I 8.80 4.82 1.77 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.02 0.79 0.00 0.00 117 T 8.64 4.68 4.21 0.00 0.00 0.00 0.00 0.00 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 0.00 118 T 8.82 5.02 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 0.76 0.00 0.00 119 N 8.82 5.08 0.00 2.61 2.74 0.00 0.00 6.17 7.09 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 0.00 120 K 8.64 4.02 0.00 1.85 1.92 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.27 1.32 7.81 121 V 8.23 3.56 2.15 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 0.97 0.00 0.00 1.09 0.00 0.00 122 P 0.00 4.62 0.00 2.32 2.23 0.00 3.80 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 2.10 2.05 0.00 123 Q 8.62 3.97 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 124 S 8.16 4.14 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 0.00 125 A 8.02 4.14 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 0.00 126 C 8.68 4.31 0.00 3.13 3.61 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 0.00 127 V 7.49 3.77 2.21 0.00 0.00 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 1.08 0.00 0.00 128 S 7.79 4.12 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 0.00 129 I 8.25 3.76 2.04 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.93 1.03 0.00 0.00 130 S 7.73 4.12 0.00 4.15 3.99 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 0.00 131 T 8.37 3.98 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 132 G 8.29 3.76 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 0.00 0.00 0.00 133 M 8.78 4.25 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 134 S 8.18 4.28 0.00 4.05 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 0.00 135 R 7.56 4.14 0.00 2.02 2.14 0.00 3.15 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 136 S 7.93 4.59 0.00 3.88 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 0.00 137 G 8.68 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 0.00 0.00 0.00 138 G 7.41 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 0.00 0.00 0.00 139 T 7.50 3.93 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 1.24 0.00 0.00 140 S 7.57 4.51 0.00 3.71 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 0.00 141 G 6.97 4.88 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 0.00 142 I 7.08 4.40 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 0.93 0.68 0.81 0.00 0.00 143 K 8.46 4.62 0.00 1.60 1.70 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.43 7.81 144 I 8.11 4.48 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.00 0.91 0.00 0.00 145 N 8.33 4.18 0.00 2.72 2.76 0.00 0.00 7.25 7.81 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 0.00 146 G 8.84 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 0.00 0.00 0.00 147 N 8.09 4.72 0.00 2.75 2.68 0.00 0.00 6.66 7.87 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 0.00 148 N 8.12 4.08 0.00 2.68 2.75 0.00 0.00 6.95 7.88 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 0.00 149 H 8.02 5.10 0.00 3.32 3.11 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 T 8.30 4.73 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 1.22 0.00 0.00 151 D 8.05 4.69 0.00 2.64 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 0.00 152 A 7.90 3.82 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 0.00 153 K 8.48 4.29 0.00 1.69 1.74 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.36 7.81 154 V 8.16 4.40 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 0.90 0.00 0.00 0.94 0.00 0.00 155 T 8.03 4.74 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 0.00 156 A 8.44 3.96 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 0.00 157 E 8.16 3.96 0.00 2.21 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 0.00 2.36 2.41 0.00 158 I 7.62 3.64 1.93 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 1.45 1.08 0.96 0.00 0.00 159 A 8.50 3.98 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 S 8.12 4.19 0.00 4.06 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 0.00 161 S 7.16 4.50 0.00 4.12 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 0.00 162 E 8.55 4.05 0.00 2.03 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 2.42 0.00 163 C 7.23 4.55 0.00 3.19 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 0.00 164 T 8.51 4.04 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 0.00 165 A 8.28 4.02 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 0.00 166 D 7.18 4.40 0.00 2.58 2.53 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 0.00 167 N 8.69 5.06 0.00 2.70 2.75 0.00 0.00 7.20 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 0.00 168 G 8.41 3.87 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 0.00 0.00 0.00 169 R 8.75 4.36 0.00 1.77 1.86 0.00 3.25 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 170 T 7.94 4.01 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 1.22 0.00 0.00 171 G 8.57 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 0.00 0.00 0.00 172 T 8.52 3.75 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 1.20 0.00 0.00 173 N 8.47 4.59 0.00 2.89 2.86 0.00 0.00 7.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 T 7.99 4.17 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 1.24 0.00 0.00 175 L 8.76 4.90 0.00 1.64 1.56 0.94 0.64 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 0.00 176 V 8.80 4.36 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 1.07 0.00 0.00 0.94 0.00 0.00 177 F 8.87 4.72 0.00 2.99 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 0.00 178 N 8.31 5.65 0.00 2.98 2.80 0.00 0.00 7.02 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 Y 9.17 4.53 0.00 3.19 2.83 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 0.00 180 N 8.85 5.09 0.00 2.63 2.72 0.00 0.00 7.31 7.68 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 0.00 181 G 8.56 4.07 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 0.00