NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4270 8.2649 122.4702 52.1091 18.9578 176.9724 3 T 4.1053 7.8468 119.4374 63.1618 70.4588 174.2742 4 K 5.2722 9.0142 124.9990 54.8448 37.3302 174.5741 5 A 5.4340 9.0300 123.4875 50.7717 23.4608 175.1332 6 V 4.9665 8.9308 117.5550 60.9461 35.5605 173.5522 7 C 4.8778 8.8959 121.8253 58.2682 35.0602 172.8332 8 V 4.4770 8.4677 126.6095 61.5076 32.3886 174.4915 9 L 4.6324 8.6939 129.7805 54.5943 42.7462 176.7065 10 K 4.8426 9.2126 122.5445 55.6247 37.3676 175.3847 11 G 4.1840 7.9416 106.9780 46.9651 0.0000 172.8610 12 D 4.5894 9.0949 119.1186 56.4074 41.1110 176.6995 13 G 4.3910 7.5781 108.8700 43.6229 0.0000 171.6446 14 P 4.2647 0.0000 0.0000 64.5446 31.8813 176.6039 15 V 4.0995 7.0380 121.3180 63.0688 31.8346 175.1215 16 Q 4.7283 8.3352 124.8172 55.1972 32.6241 173.3943 17 G 4.2016 7.7967 106.8716 46.5162 0.0000 171.6794 18 I 5.1294 7.6545 119.8812 59.3767 40.9180 175.1921 19 I 4.6974 8.6641 126.8001 59.5340 40.5450 174.3353 20 N 4.8758 9.0313 124.7991 51.5007 41.0530 174.0002 21 F 5.3044 9.0966 120.0358 55.9584 43.3542 174.4454 22 E 5.0283 9.5228 123.4408 55.6225 32.8278 173.5912 23 Q 4.9769 8.9148 130.1783 54.3674 30.2004 176.4068 24 K 4.0993 8.9227 127.3442 58.7644 32.7735 177.7164 25 E 4.7652 7.8302 117.0460 54.0159 33.2712 176.2349 26 S 4.1687 9.0502 117.9914 61.4763 62.7499 175.1380 27 N 4.5463 8.1685 115.0315 52.9437 37.7701 174.5533 28 G 4.1027 8.0688 109.2784 43.3307 0.0000 171.3057 29 P 4.7182 0.0000 0.0000 62.4422 32.9919 175.8615 30 V 4.5752 8.8480 121.1666 61.1342 33.6406 174.8022 31 K 4.6470 8.9986 128.5760 56.1841 33.5333 176.2170 32 V 4.8769 8.8689 124.8788 60.8107 33.7748 174.2786 33 W 5.5382 8.8047 124.1581 54.8651 32.1616 175.5086 34 G 3.7736 7.2306 106.5173 45.9625 0.0000 170.4955 35 S 4.8366 7.8519 114.6977 56.9319 65.5612 174.1179 36 I 4.8022 8.5242 128.3960 59.5490 39.8898 174.9081 37 K 4.7864 8.9811 124.2040 55.8690 36.7019 176.7876 38 G 3.6714 8.8366 105.7608 45.9048 0.0000 173.0982 39 L 4.5096 7.7970 119.9243 52.6317 43.0490 176.4760 40 T 4.2636 8.3128 113.1722 61.1794 69.3407 173.8269 41 E 3.9973 8.6970 126.0415 57.5069 30.5880 174.9997 42 G 3.8528 8.6072 110.7563 43.9282 0.0000 172.5794 43 L 4.6939 8.2549 119.5380 55.1115 42.7984 176.5677 44 H 5.0703 9.3491 119.2272 53.7199 33.3452 173.4575 45 G 3.9824 8.9182 109.9838 46.8532 0.0000 172.9794 46 F 5.0843 8.4583 125.0937 57.6067 41.7802 172.5090 47 H 5.2552 8.8301 122.0851 53.7121 33.6880 172.7120 48 V 4.3767 8.5732 121.5878 62.4222 32.7561 175.2933 49 H 5.1291 9.5417 126.0882 54.5810 30.7093 176.1726 50 E 3.7744 8.8736 121.4357 59.0487 29.6241 177.0138 51 F 5.0587 8.0548 118.5659 55.7909 40.8847 176.3742 52 G 4.2961 8.5180 113.3541 44.8164 0.0000 173.0935 53 D 4.7756 8.0990 118.9275 52.4033 42.9484 174.8309 54 N 5.2262 8.4434 122.5985 52.7929 39.3919 175.5562 55 T 3.7415 8.2639 113.6595 66.4472 69.0226 175.6002 56 A 4.6403 8.4364 124.2758 51.4689 19.7895 177.5290 57 G 3.9084 7.9003 111.2897 46.6324 0.0000 174.6387 58 C 4.3412 8.6568 115.2894 60.0456 35.2689 175.6879 59 T 3.7826 7.9460 117.2270 66.7371 67.7833 176.3965 60 S 4.2083 8.0879 115.3933 61.0638 63.0931 175.9088 61 A 4.6071 7.4995 125.0269 54.4145 18.1893 178.4963 62 G 4.1717 8.1204 105.4467 44.5498 0.0000 170.4812 63 P 4.7645 0.0000 0.0000 61.8017 34.1643 175.0475 64 H 4.1810 8.6177 116.4948 55.9279 29.3842 175.5323 65 F 4.2823 8.9986 125.6983 58.1916 40.0618 174.8559 66 N 5.0349 7.9344 125.8099 51.6903 38.8929 172.8089 67 P 4.1980 0.0000 0.0000 64.7799 32.4140 177.9229 68 L 4.3386 7.6424 117.1913 53.8019 41.7241 176.3017 69 S 3.6136 7.4183 113.3618 59.9034 60.7125 171.8012 70 R 4.5528 8.1101 118.1871 54.4381 32.9349 176.1720 71 K 4.4786 8.1030 117.8127 55.7552 33.7877 176.6917 72 H 4.0480 8.7832 122.6830 56.8939 30.6404 174.5018 73 G 3.8817 7.5866 108.6493 45.9350 0.0000 172.9801 74 G 4.0590 8.4792 109.1200 43.8459 0.0000 173.3532 75 P 4.3742 0.0000 0.0000 65.5116 31.4757 178.2231 76 K 4.1299 7.9898 117.3164 58.7640 32.3229 177.3976 77 D 4.4511 7.4277 118.2386 54.4396 41.3651 176.3081 78 E 3.9568 8.7860 124.4380 59.3456 29.8429 177.5920 79 E 4.2084 7.8569 122.0713 55.5613 27.8210 175.1767 80 R 4.7864 7.5235 118.8321 53.2380 33.1999 175.1350 81 H 4.4688 8.7983 115.8264 55.2996 29.3993 177.0764 82 V 3.4330 8.3446 122.7736 66.1047 31.3675 177.2192 83 G 3.8931 8.2742 106.4005 46.0582 0.0000 173.1195 84 D 4.8800 7.7681 120.7954 53.9583 39.1776 175.7589 85 L 4.5082 8.1981 121.7635 54.0523 43.1929 178.7255 86 G 4.0616 7.8862 108.8955 46.6514 0.0000 174.3797 87 N 5.6499 8.7224 121.1141 51.3260 41.7511 173.4261 88 V 4.4551 8.9542 113.5268 59.9144 35.3390 174.7462 89 T 4.9820 8.3951 119.8400 61.8620 70.9874 172.9832 90 A 5.1765 8.9330 129.0057 50.2938 21.3258 175.8685 91 D 4.7448 9.7303 122.6758 52.9883 41.5885 179.2290 92 K 4.7839 7.9645 117.0240 59.2450 32.8798 176.4924 93 D 4.5939 7.8719 116.2036 53.6282 39.4984 177.3107 94 G 4.3865 9.2665 109.1704 44.7709 0.0000 173.5987 95 V 4.4058 7.5810 119.9929 61.9521 33.5220 174.8801 96 A 4.9749 9.1827 128.3182 49.3278 21.4200 175.0361 97 D 5.0610 8.6642 122.9234 53.8348 40.4179 175.7108 98 V 3.6048 8.4489 123.6750 62.8649 32.9134 175.0468 99 S 4.8562 8.5839 122.3805 57.4354 63.4437 172.6099 100 I 4.6849 9.0372 126.6048 59.0901 40.6214 173.9786 101 E 5.1248 8.5885 123.9255 54.7766 32.3938 174.0527 102 D 4.9885 9.1623 125.5985 52.9341 44.7543 175.8113 103 S 4.8745 8.8671 118.2881 58.7650 64.9726 175.9240 104 V 3.8135 8.1140 119.8543 65.4037 31.5712 176.3925 105 I 4.0620 7.5079 111.0607 61.2487 38.1479 174.6639 106 S 4.6359 8.1861 113.5250 57.6802 64.9821 173.9629 107 L 4.7959 8.2105 124.2000 54.0635 41.4679 176.8008 108 S 4.5162 7.9268 111.3822 58.6905 66.5875 175.9655 109 G 3.8810 8.6583 109.3318 44.5738 0.0000 173.7289 110 D 4.3419 8.7970 118.2045 57.8622 41.2686 177.7917 111 H 4.8116 8.1209 112.6070 55.7035 28.8128 174.4908 112 C 4.2988 7.9350 121.5959 59.9270 31.5312 173.5665 113 I 3.7494 8.5254 120.7675 61.4962 38.0392 176.0404 114 I 3.6881 7.2627 122.9174 62.7496 37.2810 176.2449 115 G 3.8293 9.0374 112.9377 45.2235 0.0000 172.6505 116 R 4.5822 7.4721 118.2911 54.5235 33.9161 174.6386 117 T 4.8397 7.8221 115.3189 62.3628 70.3552 174.4899 118 L 4.5930 8.5686 128.5179 54.4728 44.4492 175.6981 119 V 4.9135 8.3765 124.4248 61.7130 35.0142 173.7606 120 V 5.0114 8.8106 127.8460 60.8303 33.7994 174.6487 121 H 5.0614 8.5302 118.5372 53.9299 31.7714 173.3562 122 E 4.0575 9.3350 121.3544 59.0634 29.4385 178.0481 123 K 4.6021 8.6774 117.7368 54.4945 35.0427 175.0354 124 A 4.5074 8.2591 123.0999 51.7451 19.2193 176.2944 125 D 4.9574 9.1368 122.4344 54.0194 41.4739 176.0765 126 D 4.5905 9.1968 125.5692 53.1620 39.5618 176.6347 127 L 3.4651 9.2523 118.2407 56.0577 39.6299 175.8978 128 G 4.0797 8.7541 106.5156 45.6910 0.0000 174.6880 129 K 4.4965 7.7274 118.2262 56.5334 32.2856 178.2544 130 G 3.7256 7.3441 110.3728 45.7125 0.0000 175.3539 131 G 4.0309 8.4272 107.5467 45.1835 0.0000 173.2607 132 N 4.7121 7.5400 115.7782 51.3580 39.0605 174.8413 133 E 4.0368 8.7274 118.3730 59.3921 29.9599 178.4553 134 E 3.9528 8.1920 118.6259 59.1511 29.5033 178.4030 135 S 4.2104 9.2809 114.0187 61.3698 62.3250 175.6381 136 T 4.1844 7.8286 117.1675 64.9631 68.0145 174.8043 137 K 4.3710 8.2059 118.3090 57.2006 34.6153 177.1994 138 T 3.8632 7.6649 108.5784 61.2938 70.0109 175.9262 139 G 3.7759 7.9145 110.2203 44.8645 0.0000 173.2508 140 N 4.3520 7.7794 113.5076 54.0656 36.7640 174.9521 141 A 4.4531 7.4118 118.7897 51.6074 19.5002 179.7388 142 G 3.7333 7.9848 103.8993 44.3981 0.0000 173.1143 143 S 4.3936 8.5413 114.3941 58.5251 64.8608 173.8822 144 R 4.4191 8.2590 119.3611 55.0875 30.1258 176.8595 145 L 4.2602 8.5661 125.1951 57.2275 42.7425 177.2868 146 A 5.1144 7.7673 119.1124 50.7803 23.0108 173.4577 147 C 5.1417 9.3659 114.6358 54.8534 46.7496 172.7498 148 G 4.5025 8.4099 103.3958 46.0602 0.0000 172.9793 149 V 4.4045 8.3631 122.2866 62.3634 32.7177 175.5554 150 I 4.0118 9.0400 129.6180 61.0287 38.1243 175.3099 151 G 4.5117 9.1283 114.0231 43.9297 0.0000 171.9810 152 I 4.3436 8.3641 121.8239 61.0841 37.6436 175.4352 153 A 4.8255 8.2357 127.4388 49.6642 22.1836 176.1527 154 Q 4.0702 8.5107 118.7264 56.4444 29.2192 175.9596 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 4.43 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 T 7.85 4.11 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 1.22 0.00 0.00 4 K 9.01 5.27 0.00 1.71 1.73 0.00 1.87 0.00 0.00 1.98 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.49 7.81 5 A 9.03 5.43 1.10 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 0.00 0.00 6 V 8.93 4.97 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 0.76 0.00 0.00 0.92 0.00 0.00 7 C 8.90 4.88 0.00 3.10 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 8 V 8.47 4.48 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 0.93 0.00 0.00 0.92 0.00 0.00 9 L 8.69 4.63 0.00 1.80 1.60 1.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 10 K 9.21 4.84 0.00 1.61 1.63 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.39 7.81 11 G 7.94 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 9.09 4.59 0.00 2.68 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 13 G 7.58 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 0.00 0.00 0.00 0.00 14 P 0.00 4.26 0.00 2.18 2.18 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 15 V 7.04 4.10 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 0.80 0.00 0.00 0.95 0.00 0.00 16 Q 8.34 4.73 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.30 0.00 17 G 7.80 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 0.00 0.00 0.00 0.00 18 I 7.65 5.13 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.75 0.80 0.00 0.00 19 I 8.66 4.70 1.87 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 1.23 1.13 0.59 0.00 0.00 20 N 9.03 4.88 0.00 1.44 1.42 0.00 0.00 6.40 8.01 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 21 F 9.10 5.30 0.00 2.99 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 22 E 9.52 5.03 0.00 2.45 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 0.00 2.32 2.40 0.00 23 Q 8.91 4.98 0.00 2.26 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 24 K 8.92 4.10 0.00 1.81 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.48 7.81 25 E 7.83 4.77 0.00 1.98 1.88 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 2.30 2.28 0.00 26 S 9.05 4.17 0.00 3.98 4.04 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 27 N 8.17 4.55 0.00 2.85 2.97 0.00 0.00 5.87 7.00 0.00 0.00 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 8.07 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 0.00 0.00 0.00 29 P 0.00 4.72 0.00 2.13 2.09 0.00 3.75 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 30 V 8.85 4.58 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 1.23 0.00 0.00 1.08 0.00 0.00 31 K 9.00 4.65 0.00 1.91 1.82 0.00 1.57 0.00 0.00 1.48 0.00 0.00 2.77 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.49 1.42 7.81 32 V 8.87 4.88 2.13 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 0.73 0.00 0.00 1.05 0.00 0.00 33 W 8.80 5.54 0.00 3.48 3.16 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 0.00 0.00 0.00 34 G 7.23 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 35 S 7.85 4.84 0.00 3.87 3.64 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 0.00 0.00 0.00 0.00 36 I 8.52 4.80 1.77 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 1.24 0.64 0.86 0.00 0.00 37 K 8.98 4.79 0.00 1.69 1.84 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.28 1.35 7.81 38 G 8.84 3.67 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 0.00 0.00 0.00 39 L 7.80 4.51 0.00 1.86 1.49 0.80 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.31 4.26 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 1.27 0.00 0.00 41 E 8.70 4.00 0.00 1.95 1.92 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 2.30 2.46 0.00 42 G 8.61 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 43 L 8.25 4.69 0.00 1.49 1.59 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 44 H 9.35 5.07 0.00 2.98 3.16 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.92 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 46 F 8.46 5.08 0.00 2.99 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 47 H 8.83 5.26 0.00 3.04 3.02 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.57 4.38 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.89 0.00 0.00 49 H 9.54 5.13 0.00 3.06 3.41 0.00 5.69 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.87 3.77 0.00 1.64 1.12 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 1.47 2.09 0.00 51 F 8.05 5.06 0.00 3.24 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 52 G 8.52 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 0.00 0.00 0.00 0.00 53 D 8.10 4.78 0.00 2.62 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 54 N 8.44 5.23 0.00 2.79 2.69 0.00 0.00 7.65 7.22 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 55 T 8.26 3.74 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 1.19 0.00 0.00 56 A 8.44 4.64 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 57 G 7.90 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 58 C 8.66 4.34 0.00 2.96 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 59 T 7.95 3.78 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 1.23 0.00 0.00 60 S 8.09 4.21 0.00 4.00 4.04 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 61 A 7.50 4.61 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 62 G 8.12 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.76 0.00 2.07 2.23 0.00 3.62 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 64 H 8.62 4.18 0.00 2.83 3.21 0.00 5.72 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 9.00 4.28 0.00 2.85 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 N 7.93 5.03 0.00 2.57 2.43 0.00 0.00 6.93 7.71 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 67 P 0.00 4.20 0.00 2.07 1.95 0.00 3.15 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.20 0.00 68 L 7.64 4.34 0.00 1.56 1.67 0.91 0.88 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 69 S 7.42 3.61 0.00 3.91 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 70 R 8.11 4.55 0.00 1.75 1.84 0.00 3.11 0.00 0.00 3.41 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 71 K 8.10 4.48 0.00 1.58 1.68 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.51 7.81 72 H 8.78 4.05 0.00 3.15 3.13 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 7.59 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 74 G 8.48 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 0.00 0.00 0.00 75 P 0.00 4.37 0.00 2.22 2.34 0.00 3.79 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 2.01 2.04 0.00 76 K 7.99 4.13 0.00 1.77 1.92 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 77 D 7.43 4.45 0.00 2.80 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.79 3.96 0.00 1.92 1.95 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 2.27 2.28 0.00 79 E 7.86 4.21 0.00 1.92 1.85 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 2.26 2.31 0.00 80 R 7.52 4.79 0.00 1.82 1.88 0.00 2.96 0.00 0.00 3.89 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 81 H 8.80 4.47 0.00 3.55 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.34 3.43 1.61 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 0.68 0.00 0.00 0.53 0.00 0.00 83 G 8.27 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 7.77 4.88 0.00 2.84 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 85 L 8.20 4.51 0.00 1.78 1.79 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.89 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 0.00 0.00 0.00 87 N 8.72 5.65 0.00 2.61 2.73 0.00 0.00 6.53 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 88 V 8.95 4.46 1.80 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 -0.08 0.00 0.00 0.77 0.00 0.00 89 T 8.40 4.98 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 90 A 8.93 5.18 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 D 9.73 4.74 0.00 2.70 2.79 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 92 K 7.96 4.78 0.00 1.79 1.84 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.06 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.43 1.43 7.81 93 D 7.87 4.59 0.00 2.76 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 94 G 9.27 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 0.00 0.00 0.00 0.00 95 V 7.58 4.41 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 0.72 0.00 0.00 0.92 0.00 0.00 96 A 9.18 4.97 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 97 D 8.66 5.06 0.00 2.56 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 98 V 8.45 3.60 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 0.77 0.00 0.00 0.66 0.00 0.00 99 S 8.58 4.86 0.00 3.91 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 9.04 4.68 1.99 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.69 1.00 0.00 0.00 101 E 8.59 5.12 0.00 1.94 1.80 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 2.21 2.33 0.00 102 D 9.16 4.99 0.00 2.88 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 0.00 103 S 8.87 4.87 0.00 3.90 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 0.00 104 V 8.11 3.81 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 0.78 0.00 0.00 0.94 0.00 0.00 105 I 7.51 4.06 1.95 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 1.09 0.00 0.00 106 S 8.19 4.64 0.00 3.89 3.74 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 0.00 0.00 0.00 0.00 107 L 8.21 4.80 0.00 1.80 1.64 1.03 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.93 4.52 0.00 3.92 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 0.00 109 G 8.66 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 0.00 110 D 8.80 4.34 0.00 2.65 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 0.00 111 H 8.12 4.81 0.00 3.20 3.36 0.00 5.78 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 C 7.94 4.30 0.00 3.21 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 0.00 113 I 8.53 3.75 1.64 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.18 0.99 0.00 0.00 114 I 7.26 3.69 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.38 0.83 0.00 0.00 115 G 9.04 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 R 7.47 4.58 0.00 1.61 1.79 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.32 0.00 117 T 7.82 4.84 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 1.18 0.00 0.00 118 L 8.57 4.59 0.00 1.83 1.56 0.55 0.63 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 0.00 119 V 8.38 4.91 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.77 0.00 0.00 120 V 8.81 5.01 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 0.85 0.00 0.00 1.01 0.00 0.00 121 H 8.53 5.06 0.00 3.24 3.51 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 9.33 4.06 0.00 2.08 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 2.37 2.34 0.00 123 K 8.68 4.60 0.00 1.78 1.75 0.00 1.89 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.42 7.81 124 A 8.26 4.51 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 0.00 125 D 9.14 4.96 0.00 2.76 2.81 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 0.00 126 D 9.20 4.59 0.00 2.95 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 0.00 127 L 9.25 3.47 0.00 1.82 1.78 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.75 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 0.00 129 K 7.73 4.50 0.00 1.80 1.83 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.49 7.81 130 G 7.34 3.73 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 0.00 0.00 0.00 131 G 8.43 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 0.00 132 N 7.54 4.71 0.00 2.84 2.85 0.00 0.00 5.97 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 0.00 133 E 8.73 4.04 0.00 2.06 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 2.37 2.36 0.00 134 E 8.19 3.95 0.00 2.11 1.92 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 2.37 2.41 0.00 135 S 9.28 4.21 0.00 4.16 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 0.00 136 T 7.83 4.18 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 137 K 8.21 4.37 0.00 1.78 1.70 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.31 7.81 138 T 7.66 3.86 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 1.22 0.00 0.00 139 G 7.91 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 N 7.78 4.35 0.00 3.04 2.90 0.00 0.00 6.85 7.61 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 0.00 141 A 7.41 4.45 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 0.00 142 G 7.98 3.73 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 0.00 0.00 0.00 143 S 8.54 4.39 0.00 3.93 4.05 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 0.00 144 R 8.26 4.42 0.00 1.67 1.86 0.00 3.18 0.00 0.00 3.13 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.59 0.00 145 L 8.57 4.26 0.00 1.54 1.69 0.91 0.80 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 0.00 146 A 7.77 5.11 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 C 9.37 5.14 0.00 3.06 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 0.00 148 G 8.41 4.50 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 0.00 0.00 0.00 149 V 8.36 4.40 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 0.77 0.00 0.00 0.93 0.00 0.00 150 I 9.04 4.01 1.74 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.74 0.49 0.00 0.00 151 G 9.13 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 0.00 0.00 0.00 0.00 152 I 8.36 4.34 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 1.25 0.54 0.91 0.00 0.00 153 A 8.24 4.83 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Q 8.51 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00