NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.1880 8.2644 123.5821 55.9317 20.0492 178.1476 3 R 4.4232 6.9224 121.3282 60.1320 29.4136 173.5684 4 I 3.7512 8.8756 130.1382 61.8686 36.5505 177.7672 5 A 4.1576 9.3849 130.9735 52.3730 19.6851 177.8342 6 G 4.2846 8.5294 107.5568 46.3439 0.0000 173.3680 7 V 3.4326 8.5526 117.5359 61.7996 29.7287 173.6128 8 E 4.4267 8.9825 119.9960 56.4377 30.1796 176.1960 9 I 4.5623 7.5216 109.3701 60.1546 38.4118 171.7142 10 P 4.3572 0.0000 0.0000 63.3106 32.8433 176.5090 11 R 4.3382 8.1253 117.8223 56.4517 32.6089 175.1600 12 N 4.1198 8.7410 118.5552 54.2026 38.0876 174.4445 13 K 3.8630 7.2825 118.1174 56.2107 32.5001 176.3637 14 R 4.8136 8.3351 128.7039 57.0930 31.9673 177.8576 15 V 2.8719 7.2703 123.2241 63.9629 33.8223 176.9343 16 D 4.4924 7.5649 118.1823 56.6132 38.9843 178.3461 17 V 3.6244 7.8498 120.4260 65.3861 31.8772 177.8429 18 A 4.0398 8.2670 120.2206 55.1523 18.1691 179.6441 19 L 4.1269 8.7224 117.9690 57.9657 41.3822 179.5896 20 T 3.8853 7.6581 115.4923 66.9236 68.4611 175.3855 21 Y 4.0327 8.2597 116.5813 58.8658 37.8673 176.6104 22 I 5.1691 7.4649 121.5533 60.1943 38.3255 176.3109 23 Y 4.3284 8.7388 124.9341 60.9775 38.5667 177.8191 24 G 3.6219 7.9787 104.4419 45.6717 0.0000 173.2574 25 I 4.0277 7.0480 120.0420 60.0005 38.6959 175.0092 26 G 4.1140 7.8689 110.7782 42.8712 0.0000 173.3976 27 K 3.8375 8.8243 117.5789 60.4858 31.8410 178.0295 28 A 4.1639 8.1315 120.8966 53.7401 18.0604 178.9521 29 R 3.8697 7.9386 115.7914 59.3086 30.4090 177.9986 30 A 4.1649 8.1780 120.9886 54.0109 18.1365 179.0911 31 K 3.8466 8.1945 115.5431 60.1041 32.4525 177.6926 32 E 4.2042 8.6553 119.4588 56.9107 29.0557 178.0398 33 A 3.8430 8.4075 124.1469 55.5134 19.3865 179.5807 34 L 4.0706 8.7053 117.5190 57.9883 41.7125 179.4468 35 E 4.0439 7.9067 119.1143 58.9936 29.4028 178.5081 36 K 4.1442 7.9299 114.9217 57.2933 31.7488 177.0135 37 T 4.3162 7.2560 110.6106 61.8254 71.0294 175.9265 38 G 3.9782 8.4399 110.0364 45.5686 0.0000 174.4702 39 I 3.8955 6.9959 120.4920 60.8753 37.5447 175.6083 40 N 4.4381 8.5876 123.5709 53.4285 39.6238 172.9236 41 P 4.4208 0.0000 0.0000 64.9809 31.9898 177.8401 42 A 4.2505 7.9808 118.1251 53.4197 18.3686 177.0639 43 T 4.3095 7.6324 107.7910 60.3422 70.1712 174.9444 44 R 4.0133 8.3877 123.5050 56.2907 30.9033 178.0913 45 V 3.6119 8.3734 121.0820 65.6422 31.7595 177.9039 46 K 4.1231 8.0404 117.1961 58.5810 32.4868 176.8666 47 D 4.8899 7.8269 118.3864 53.8471 41.5102 176.1031 48 L 4.1379 7.7940 120.7459 54.6389 42.2717 177.6694 49 T 4.0370 8.4367 120.9516 63.2107 69.4038 175.5182 50 E 3.9130 9.0495 126.4300 59.5356 29.7470 178.2282 51 A 4.0580 8.0174 120.6027 55.2345 18.3810 179.0190 52 E 3.8948 8.0257 115.1227 59.3275 30.0270 179.5536 53 V 3.4303 7.9387 117.6667 65.3518 31.4043 177.1929 54 V 3.9728 7.6251 117.2207 65.1903 31.8659 177.1104 55 R 3.9149 7.8853 117.7144 59.6120 29.9365 178.0374 56 L 3.9540 8.6325 120.3857 58.9993 42.1824 177.9511 57 R 3.8400 7.8502 116.4970 59.2666 29.4746 178.0660 58 E 3.8685 9.0254 121.1146 60.4345 30.2189 178.4520 59 Y 3.7975 8.5020 118.8727 59.7011 38.4668 178.0755 60 V 2.9872 7.9505 117.8937 66.4180 32.0088 178.4892 61 E 4.1029 8.0280 116.2710 58.5006 29.2897 177.6048 62 N 4.8267 7.7519 113.3853 53.1947 39.2689 175.1321 63 T 3.8110 6.8860 115.2504 63.6276 69.4378 174.3015 64 W 5.2290 7.3423 118.5864 55.0743 33.3051 174.0633 65 K 4.4553 8.7066 120.5129 55.1538 31.9780 174.3437 66 L 4.9060 7.9793 129.2268 55.3393 44.8841 176.1326 67 E 3.6396 9.3016 116.1176 58.9998 30.4525 176.4003 68 G 4.2217 7.9391 109.8810 49.4694 0.0000 175.2293 69 E 4.0263 8.1722 121.3390 57.4853 29.8535 178.1474 70 L 4.3226 8.9888 120.8990 58.2878 42.5720 178.0864 71 R 4.0102 8.2345 117.2356 59.6658 29.9818 178.3324 72 A 4.0029 7.9460 119.7419 55.9493 18.1515 178.6174 73 E 3.9537 9.0423 118.3262 58.2689 29.6625 178.9542 74 V 3.7407 7.6628 116.9621 66.1836 31.9438 177.9629 75 A 3.9453 8.4453 120.2282 55.3291 18.0618 179.2515 76 A 3.9606 7.7749 117.5305 56.2277 18.7265 178.8194 77 N 4.2134 9.1478 115.8051 55.6917 38.4602 177.2308 78 I 3.5630 8.1290 120.6913 64.6928 37.6098 177.9653 79 K 3.7959 8.0525 120.0452 59.7886 31.6889 178.4037 80 R 3.9729 8.0956 116.8922 59.6367 30.5144 178.3083 81 L 4.0787 7.9979 117.7163 58.5607 41.0570 179.4178 82 M 4.2505 8.1541 117.8195 57.5431 31.7710 177.3771 83 D 4.9040 8.1377 117.9553 53.7812 41.9221 177.4174 84 I 4.5991 7.5724 111.5909 60.4541 38.7428 176.0302 85 G 3.4725 8.5792 115.9495 47.2546 0.0000 171.5764 86 C 3.6465 8.6746 135.0000 58.9782 30.3500 172.2636 87 Y 4.2142 8.8088 128.4655 61.0377 38.2851 177.8916 88 R 3.8775 8.3204 118.8959 59.6256 30.2375 178.4359 89 G 4.0300 8.2255 106.8585 47.1042 0.0000 175.3163 90 L 3.9060 7.6706 122.0932 58.1009 42.0901 179.1540 91 R 3.7372 7.9470 118.3119 59.5215 29.6798 178.7963 92 H 4.1220 7.7737 115.0695 58.7793 28.7661 177.5573 93 R 4.0323 7.7543 119.0603 58.4594 29.9688 177.7280 94 R 4.3910 7.6775 115.8320 55.6819 30.9883 177.4314 95 G 3.9140 8.2648 106.0637 45.1922 0.0000 173.1518 96 L 4.4394 7.3432 118.8192 52.1748 42.9725 174.6205 97 P 4.3331 0.0000 0.0000 63.3856 31.4645 175.4836 98 V 4.4904 7.9795 116.5994 62.6969 32.3901 175.7542 99 R 4.6316 8.2363 113.9117 55.1683 31.1080 176.3510 100 G 3.9579 8.2734 106.1875 46.1538 0.0000 172.4652 101 Q 4.5906 7.6460 120.0651 54.2033 33.4498 174.8370 102 R 4.2529 8.4740 116.8178 56.0281 30.1675 176.5792 103 T 4.2913 8.3625 111.9993 61.5590 69.7510 175.5203 104 R 3.9447 8.0148 122.7573 59.3533 30.2122 176.0676 105 T 4.7280 7.0750 107.2122 61.0531 71.4139 172.4693 106 N 3.7697 7.5681 116.2658 52.0389 37.6126 174.5441 107 A 4.4273 8.5904 122.6873 52.8870 20.0695 177.5611 108 R 3.8139 8.0459 117.3256 61.4817 30.7270 179.4129 109 T 4.1024 7.6691 115.4084 66.9812 69.0751 175.5182 110 R 4.0409 8.0064 119.5537 59.3680 30.4052 177.7227 111 K 4.0252 8.2057 116.5726 58.0853 32.4735 176.8608 112 G 3.8438 8.7455 104.4352 43.3191 0.0000 171.1408 113 P 4.3702 0.0000 0.0000 62.3653 31.9491 176.5394 114 R 4.0562 8.4175 120.7189 56.5609 31.0031 177.5682 115 K 4.5811 8.0993 121.1117 56.2760 32.0967 176.8073 116 T 3.8123 7.3044 113.4788 63.8525 69.6171 174.3686 117 V 4.5867 7.9330 118.5302 60.0955 35.0050 175.5887 118 A 4.3343 8.4285 120.2753 50.6825 16.8781 177.3745 119 G 3.9110 7.9088 109.7319 44.6382 0.0000 171.1382 120 K 3.8547 8.4940 122.4436 56.6355 32.5736 176.5334 121 K 4.4616 8.7660 123.8804 53.1288 32.1457 175.5132 122 K 5.2090 7.3880 135.0000 56.3387 32.8102 174.1322 123 A 4.6064 7.5655 120.9463 49.3500 21.2994 173.3597 124 P 4.3141 0.0000 0.0000 62.8687 30.8775 176.8303 125 R 4.3220 8.4128 123.0669 56.2824 29.5810 176.9028 126 K 4.1678 8.0076 123.3136 58.0751 32.7401 175.5401 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 A 8.26 4.19 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 3 R 6.92 4.42 0.00 1.90 1.88 0.00 3.06 0.00 0.00 3.90 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 4 I 8.88 3.75 1.94 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 1.39 0.94 0.99 0.00 0.00 5 A 9.38 4.16 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 6 G 8.53 4.28 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 0.00 7 V 8.55 3.43 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 0.71 0.00 0.00 0.94 0.00 0.00 8 E 8.98 4.43 0.00 2.10 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 2.60 2.47 0.00 9 I 7.52 4.56 1.87 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 1.48 0.31 0.98 0.00 0.00 10 P 0.00 4.36 0.00 2.09 2.21 0.00 3.82 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 11 R 8.13 4.34 0.00 1.77 1.68 0.00 3.31 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 12 N 8.74 4.12 0.00 2.82 2.83 0.00 0.00 6.97 6.68 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 13 K 7.28 3.86 0.00 1.60 1.54 0.00 1.81 0.00 0.00 1.56 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.41 7.81 14 R 8.34 4.81 0.00 1.89 1.81 0.00 3.26 0.00 0.00 3.52 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.39 0.00 15 V 7.27 2.87 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 0.94 0.00 0.00 0.99 0.00 0.00 16 D 7.56 4.49 0.00 2.94 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 17 V 7.85 3.62 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 1.00 0.00 0.00 0.97 0.00 0.00 18 A 8.27 4.04 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 19 L 8.72 4.13 0.00 1.90 1.85 1.05 0.58 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 20 T 7.66 3.89 4.66 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 1.11 0.00 0.00 21 Y 8.26 4.03 0.00 3.10 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 22 I 7.46 5.17 2.05 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 1.28 1.51 1.04 0.00 0.00 23 Y 8.74 4.33 0.00 3.15 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 24 G 7.98 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 25 I 7.05 4.03 2.02 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.62 0.93 0.00 0.00 26 G 7.87 4.11 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 0.00 0.00 0.00 27 K 8.82 3.84 0.00 1.74 1.90 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.49 7.81 28 A 8.13 4.16 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 29 R 7.94 3.87 0.00 1.33 0.83 0.00 2.43 0.00 0.00 2.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.23 0.00 30 A 8.18 4.16 1.38 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 0.00 0.00 31 K 8.19 3.85 0.00 2.04 2.01 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.51 7.81 32 E 8.66 4.20 0.00 2.28 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 2.61 2.50 0.00 33 A 8.41 3.84 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.71 4.07 0.00 1.81 1.74 1.04 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.91 4.04 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 2.30 2.33 0.00 36 K 7.93 4.14 0.00 1.63 1.24 0.00 1.86 0.00 0.00 1.88 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.21 1.39 7.81 37 T 7.26 4.32 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 1.17 0.00 0.00 38 G 8.44 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 39 I 7.00 3.90 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 1.34 0.69 0.95 0.00 0.00 40 N 8.59 4.44 0.00 2.68 2.72 0.00 0.00 7.14 7.69 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 41 P 0.00 4.42 0.00 2.23 2.08 0.00 3.66 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 2.09 2.08 0.00 42 A 7.98 4.25 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 43 T 7.63 4.31 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 1.26 0.00 0.00 44 R 8.39 4.01 0.00 2.09 1.89 0.00 3.17 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 45 V 8.37 3.61 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 1.08 0.00 0.00 0.93 0.00 0.00 46 K 8.04 4.12 0.00 1.89 1.91 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.45 7.81 47 D 7.83 4.89 0.00 2.79 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 48 L 7.79 4.14 0.00 1.85 1.61 0.93 0.88 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 49 T 8.44 4.04 4.39 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 1.25 0.00 0.00 50 E 9.05 3.91 0.00 1.93 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 2.30 2.46 0.00 51 A 8.02 4.06 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 52 E 8.03 3.89 0.00 2.02 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 2.39 2.37 0.00 53 V 7.94 3.43 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 1.01 0.00 0.00 1.00 0.00 0.00 54 V 7.63 3.97 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 0.96 0.00 0.00 0.98 0.00 0.00 55 R 7.89 3.91 0.00 1.91 2.08 0.00 3.30 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 56 L 8.63 3.95 0.00 1.81 1.73 0.97 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.85 3.84 0.00 2.30 1.98 0.00 3.20 0.00 0.00 3.26 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 58 E 9.03 3.87 0.00 2.12 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 2.53 2.52 0.00 59 Y 8.50 3.80 0.00 3.08 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 60 V 7.95 2.99 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 1.32 0.00 0.00 61 E 8.03 4.10 0.00 1.98 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 2.39 2.51 0.00 62 N 7.75 4.83 0.00 2.68 2.69 0.00 0.00 6.94 7.44 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 63 T 6.89 3.81 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 -0.01 0.00 0.00 64 W 7.34 5.23 0.00 3.38 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 65 K 8.71 4.46 0.00 1.74 1.77 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.46 7.81 66 L 7.98 4.91 0.00 1.73 1.76 1.18 1.21 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 67 E 9.30 3.64 0.00 2.16 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 2.47 2.45 0.00 68 G 7.94 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 69 E 8.17 4.03 0.00 1.98 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 2.48 0.00 70 L 8.99 4.32 0.00 1.90 2.06 0.74 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.23 4.01 0.00 1.94 1.96 0.00 3.01 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 1.40 1.55 0.00 72 A 7.95 4.00 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 73 E 9.04 3.95 0.00 2.00 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 0.00 2.32 2.32 0.00 74 V 7.66 3.74 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 1.01 0.00 0.00 0.99 0.00 0.00 75 A 8.45 3.95 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 76 A 7.77 3.96 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.15 4.21 0.00 2.89 2.78 0.00 0.00 7.00 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 78 I 8.13 3.56 1.77 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 1.18 0.76 0.66 0.00 0.00 79 K 8.05 3.80 0.00 1.93 2.05 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.82 1.50 7.81 80 R 8.10 3.97 0.00 1.96 2.00 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 1.68 1.90 0.00 81 L 8.00 4.08 0.00 1.84 1.79 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 82 M 8.15 4.25 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.80 0.00 83 D 8.14 4.90 0.00 2.69 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 84 I 7.57 4.60 1.88 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 0.52 0.92 0.00 0.00 85 G 8.58 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 C 8.67 3.65 0.00 3.29 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 87 Y 8.81 4.21 0.00 3.05 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 88 R 8.32 3.88 0.00 2.02 1.96 0.00 3.31 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 89 G 8.23 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 0.00 0.00 0.00 90 L 7.67 3.91 0.00 1.72 1.63 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.95 3.74 0.00 1.65 2.06 0.00 2.85 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.30 0.00 92 H 7.77 4.12 0.00 3.30 3.33 0.00 5.66 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.75 4.03 0.00 1.83 2.12 0.00 3.23 0.00 0.00 3.21 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 94 R 7.68 4.39 0.00 1.76 1.92 0.00 3.37 0.00 0.00 3.20 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.70 0.00 95 G 8.26 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 0.00 0.00 0.00 96 L 7.34 4.44 0.00 1.57 1.57 0.89 1.03 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 97 P 0.00 4.33 0.00 2.43 2.09 0.00 3.69 0.00 0.00 3.57 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 98 V 7.98 4.49 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 0.78 0.00 0.00 0.72 0.00 0.00 99 R 8.24 4.63 0.00 1.89 1.83 0.00 3.37 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 100 G 8.27 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 0.00 101 Q 7.65 4.59 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 102 R 8.47 4.25 0.00 1.92 1.95 0.00 3.02 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 103 T 8.36 4.29 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 1.22 0.00 0.00 104 R 8.01 3.94 0.00 1.77 2.02 0.00 3.24 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 105 T 7.07 4.73 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 0.00 106 N 7.57 3.77 0.00 2.88 2.91 0.00 0.00 5.65 7.26 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 0.00 107 A 8.59 4.43 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 R 8.05 3.81 0.00 1.84 1.94 0.00 3.33 0.00 0.00 3.33 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 109 T 7.67 4.10 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 0.00 110 R 8.01 4.04 0.00 1.74 2.03 0.00 3.28 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 111 K 8.21 4.03 0.00 1.76 1.85 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.57 7.81 112 G 8.75 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.37 0.00 2.05 2.00 0.00 3.68 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 2.02 2.11 0.00 114 R 8.42 4.06 0.00 1.80 1.86 0.00 3.17 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 115 K 8.10 4.58 0.00 1.69 1.76 0.00 1.67 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.48 7.81 116 T 7.30 3.81 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 0.00 117 V 7.93 4.59 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 0.73 0.00 0.00 0.93 0.00 0.00 118 A 8.43 4.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 7.91 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 0.00 0.00 0.00 120 K 8.49 3.85 0.00 1.70 1.76 0.00 1.61 0.00 0.00 1.63 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.53 7.81 121 K 8.77 4.46 0.00 1.67 1.65 0.00 1.85 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.44 7.81 122 K 7.39 5.21 0.00 1.80 1.83 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.18 1.23 7.81 123 A 7.57 4.61 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 0.00 124 P 0.00 4.31 0.00 2.05 2.05 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 125 R 8.41 4.32 0.00 1.90 2.02 0.00 3.04 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 126 K 8.01 4.17 0.00 1.85 1.79 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.39 7.81