NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.2815 8.1593 110.9399 61.1861 70.0112 172.7797 13 N 4.2730 7.9888 118.5267 53.7344 38.1171 171.9530 14 L 4.8967 8.8281 119.4913 52.9870 45.7334 177.1034 15 L 4.6087 8.3394 119.7975 53.9691 43.0479 176.6947 16 Y 4.4036 8.4960 123.0383 58.0925 39.4618 174.8559 17 T 3.9599 7.1535 118.5918 60.7246 70.2370 173.5370 18 R 3.9551 8.0171 124.7393 56.8474 30.0298 176.1914 19 N 4.3119 7.5138 118.1225 53.2993 38.9515 174.5101 20 D 4.4031 8.7617 125.8528 56.6755 41.5654 176.7943 21 V 3.6786 7.4898 118.5963 62.6558 32.0842 176.2949 22 S 4.2734 8.5288 121.8287 58.4301 64.6790 174.9063 23 D 4.2006 8.8858 124.5312 57.9153 40.6126 179.2084 24 S 4.0523 8.0404 112.7855 61.4931 62.4339 175.6734 25 E 3.9114 8.3368 121.7237 59.2424 29.3825 178.5886 26 K 3.8396 8.7971 119.1143 59.7929 32.0625 179.1516 27 K 3.9134 8.3864 118.1956 59.5312 31.9994 179.3289 28 A 3.9895 7.9369 120.6448 55.4368 18.3780 179.8280 29 T 3.7337 8.2431 114.6209 66.9098 68.5948 176.8647 30 V 3.6343 8.1184 120.5241 66.2376 31.3301 177.7279 31 E 3.9331 7.9932 118.9742 59.0291 29.0541 178.4368 32 L 3.9580 7.7896 120.4215 58.0247 42.0926 178.9820 33 L 3.9345 8.4500 119.1343 58.0793 41.6812 179.1853 34 N 4.3891 8.1600 116.2296 56.3199 38.3926 177.6772 35 R 3.9230 7.8061 119.0788 59.3942 30.2048 179.0778 36 Q 4.0950 7.7417 116.9895 58.9581 28.6490 178.6429 37 V 3.5295 8.0677 119.7199 66.3990 31.4678 178.1597 38 I 3.7281 7.8229 119.1583 64.3728 36.9408 178.2555 39 Q 3.9815 7.9654 119.9668 59.1674 28.8751 178.3854 40 F 3.8727 9.1483 119.0963 60.4983 39.0402 177.5413 41 I 3.7174 8.1271 119.7894 64.6706 36.9316 177.9446 42 D 4.3043 8.1695 118.5229 57.2621 41.0147 177.8869 43 L 3.7748 7.9643 121.1015 58.1003 41.9702 179.1931 44 S 4.0650 8.4385 114.6517 61.3706 62.9974 176.4301 45 L 3.8842 7.9270 122.6461 57.4380 41.2679 179.5613 46 I 3.4008 7.7909 119.7552 64.6180 36.9524 178.4356 47 T 3.7567 7.8388 116.5697 66.6731 68.2588 176.5363 48 K 3.3053 7.6473 121.3028 58.8430 32.0506 178.6566 49 Q 3.8534 7.4152 119.7235 59.1042 28.5297 178.2179 50 A 3.8351 7.6630 121.7403 55.2404 18.1766 178.7217 51 H 3.8331 7.8750 115.8284 59.5143 29.8808 177.1220 52 W 4.6383 7.8848 118.9183 59.4164 28.9740 177.5062 53 N 5.0232 8.1630 114.6972 52.4633 38.5505 174.5229 54 M 4.9245 6.9498 117.5623 54.4452 33.4259 175.2924 55 R 4.2833 8.9216 117.7268 55.7145 34.7632 173.6066 56 G 3.8826 8.6497 103.8158 43.9783 0.0000 173.2248 57 A 3.9828 8.5125 121.8894 53.5342 18.8261 177.1115 58 N 4.1441 8.8675 119.4611 54.8238 37.1545 176.2230 59 F 4.2936 7.9594 118.6747 60.3003 39.6808 174.9941 60 I 2.9812 7.8273 117.1215 64.1231 37.7742 177.7281 61 A 3.7996 7.7118 120.5602 55.1858 18.3181 179.6691 62 V 3.3154 7.2936 116.8342 65.9800 31.1218 177.3944 63 H 3.8577 8.4649 118.8547 59.6204 29.5301 177.0872 64 E 3.8496 8.0063 119.9923 59.3139 29.0934 178.9080 65 M 3.5707 7.8134 118.3669 58.5012 32.1403 178.3267 66 L 3.3628 7.4933 118.9806 57.3717 41.4946 178.8084 67 D 4.1103 7.2634 116.9777 57.1977 40.9382 178.6120 68 G 3.4975 7.4507 105.6250 47.7463 0.0000 175.5577 69 F 3.8899 7.0457 120.3160 60.0915 38.8077 177.3806 70 R 3.8898 7.8304 118.2838 59.9941 29.8242 178.2135 71 T 3.8706 7.5748 114.8270 66.9019 68.5462 176.3133 72 A 4.1218 7.9100 122.3641 55.0559 18.3934 179.4464 73 L 4.2764 8.6229 117.9857 58.4835 41.7591 179.9991 74 I 3.8087 8.1105 119.5913 64.3436 37.0275 178.1324 75 C 4.0831 8.0263 119.5700 62.7274 31.3595 175.4237 76 H 4.0834 8.2685 117.6687 58.7378 28.2732 177.1323 77 L 3.6066 8.2105 122.3786 58.5010 41.7663 179.1068 78 A 3.9567 8.2045 120.3307 55.3858 18.0449 179.7404 79 T 3.8081 7.5065 113.4246 66.8622 68.7642 176.6730 80 M 4.0727 8.3349 120.7394 58.2920 32.1561 178.3472 81 A 3.9616 8.0310 121.0595 55.6247 18.6733 179.6733 82 E 3.9757 8.5498 116.9355 59.2060 29.2902 179.6004 83 R 3.8820 8.0549 119.0606 58.9720 30.0876 178.3034 84 A 3.9439 7.8751 120.2258 55.3255 18.6096 179.6112 85 V 3.7355 7.6063 116.1255 66.3182 31.2703 178.2531 86 Q 4.0375 7.7088 116.7900 58.3800 28.6102 177.5954 87 L 4.3534 7.2809 117.5655 54.7080 42.1320 177.6115 88 G 3.9587 8.0952 108.5876 45.0335 0.0000 174.5864 89 G 3.8937 7.5044 108.3071 44.4755 0.0000 172.6205 90 V 4.2138 8.0121 118.2760 60.5563 33.4948 175.5868 91 A 4.2657 8.6531 130.8797 51.9630 18.8684 176.1114 92 L 4.6879 9.4499 123.9270 53.2251 42.9718 177.2284 93 G 4.2147 8.4125 111.8767 44.7391 0.0000 172.8445 94 T 4.2410 7.8459 110.3967 60.9508 71.2042 174.7219 95 T 3.8735 8.5365 116.8201 65.4911 67.3168 176.2891 96 Q 3.9809 7.9909 118.9825 59.4555 28.6473 178.6184 97 V 3.6251 7.4245 119.4765 65.4013 31.5133 178.1352 98 I 3.8091 7.8611 119.6979 64.4349 36.8252 177.9351 99 N 4.4288 8.1694 116.0838 55.8260 38.8715 175.8859 100 S 4.5558 7.6906 112.3628 58.9802 62.8376 174.4968 101 K 4.5366 7.5158 114.7853 56.9169 35.7423 176.0065 102 T 3.8726 7.9908 115.6972 61.8347 67.2949 171.9015 103 P 4.5787 0.0000 0.0000 63.0033 31.8963 175.4489 104 L 4.5255 7.3118 120.2256 52.7885 42.8303 176.4125 105 K 3.8664 8.6820 124.8137 56.3139 32.5594 176.0547 106 S 4.0522 8.8506 119.7760 58.9851 62.6505 173.2339 107 Y 4.1464 8.6798 128.8012 56.3502 39.3276 172.8862 108 P 4.2788 0.0000 0.0000 63.1609 31.7794 175.9153 109 L 4.6666 8.5309 121.3062 54.5330 41.7574 176.4581 110 D 4.8459 7.8446 116.6884 52.6980 40.5509 176.0847 111 I 4.1503 7.3322 113.2840 60.7646 39.1599 175.0707 112 H 5.1820 8.3488 114.8553 55.2723 32.3742 173.7959 113 N 4.8612 8.0735 116.9147 53.3101 40.5977 175.2260 114 V 3.6873 8.4202 127.2730 66.6715 31.5911 178.5543 115 Q 4.1173 8.8604 117.8241 58.9726 28.4199 178.6801 116 D 4.3211 8.1820 119.3205 57.7752 40.9244 178.2680 117 H 4.4454 8.0932 117.8390 58.3114 28.7403 177.5325 118 L 4.1294 8.5378 120.9995 58.0614 41.5563 179.8644 119 K 3.9633 8.3042 118.0766 59.5198 31.9077 178.9780 120 E 3.9801 8.5884 119.9141 59.3244 29.5219 178.9712 121 L 4.2134 8.9803 119.5105 57.7469 41.6741 178.9103 122 A 4.0176 8.6108 121.1518 55.6708 18.2465 179.1006 123 D 4.3680 8.2649 116.8421 58.0142 40.8551 179.5052 124 R 4.0223 8.0292 118.2108 59.5232 29.9983 178.9339 125 Y 3.7619 8.9110 116.8771 60.6817 37.8529 177.9620 126 A 3.9994 8.4966 122.1824 55.2576 18.4429 179.4327 127 I 3.5926 7.7460 118.1957 64.7390 37.1753 178.7544 128 V 3.4449 7.4893 118.4413 65.8764 31.3525 177.6324 129 A 3.8955 8.5238 120.8219 55.5010 18.1574 179.2768 130 N 4.2404 8.7336 114.7189 56.3871 38.5779 177.1003 131 D 4.2897 8.2721 119.6037 57.4776 40.9230 178.7048 132 V 3.7858 8.0295 119.7440 64.9308 31.0354 178.1449 133 R 3.8941 7.7632 118.4698 59.0818 29.7937 178.4477 134 K 4.0974 7.8708 117.9167 59.3524 32.1497 179.0604 135 A 4.0209 8.1657 121.0629 55.0585 17.4471 179.6724 136 I 3.6958 7.4807 118.0262 64.7461 37.0657 178.8520 137 G 3.7172 7.5990 104.3851 47.2222 0.0000 174.7457 138 E 4.2623 7.4215 120.8501 57.1323 29.7500 176.2946 139 A 4.1854 7.3720 122.5221 51.6503 18.5541 177.4045 140 K 4.0551 8.6015 123.4236 59.1657 32.8512 177.8370 141 D 4.4566 7.9584 118.9321 53.7744 41.9046 175.5599 142 D 4.3656 8.8643 127.5286 58.0097 40.9027 178.4645 143 D 4.4036 8.1339 118.1202 58.2085 40.9527 179.3688 144 T 3.8337 7.7725 114.6526 66.5613 68.3086 176.5854 145 A 3.9821 8.0720 122.8045 54.9590 18.3797 179.1120 146 D 4.2330 8.1917 116.5793 57.6180 41.3508 178.4913 147 I 3.6829 7.8068 120.2073 64.5399 37.0844 178.4878 148 L 3.9815 7.9849 119.6735 57.8472 41.3196 179.6699 149 T 3.7766 8.3002 115.9463 66.4888 68.3295 176.3169 150 A 4.0327 8.0599 122.3576 55.2876 18.4271 179.5080 151 A 3.2530 7.9066 119.0630 55.0778 18.3893 179.8015 152 S 3.9428 8.4528 111.9157 61.5809 62.6721 176.1316 153 R 3.7814 8.6081 122.3250 59.7669 29.5608 178.1309 154 D 3.9980 7.7142 118.1570 56.8843 40.7622 178.7572 155 L 3.7131 7.5625 119.5491 57.7374 41.5707 179.2867 156 D 4.3703 8.1095 118.9378 56.9415 40.6373 178.7955 157 K 4.0234 7.4079 119.1655 59.3849 32.1639 179.0049 158 F 3.9975 7.9060 118.3547 60.2902 38.7538 177.0656 159 L 3.8772 8.2175 120.4321 58.1190 41.7407 178.6345 160 W 4.4143 8.1621 127.9156 60.8612 30.3571 177.8200 161 F 4.1330 7.8858 116.0562 60.5749 38.6001 177.5486 162 I 3.8543 8.2777 119.7387 64.5795 37.1275 178.1762 163 E 4.0151 8.6827 119.6838 59.8214 29.1423 179.6345 164 S 4.3440 8.2652 113.6638 60.5497 62.9618 175.3292 165 N 4.7141 7.8580 117.6649 52.5703 38.8543 175.0677 166 I 4.1738 6.9754 122.3642 60.5479 37.6705 175.8764 167 E 4.1506 9.3204 124.9796 56.7488 29.1654 176.8283 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 12 T 8.16 4.28 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 13 N 7.99 4.27 0.00 2.95 2.91 0.00 0.00 6.18 6.90 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 14 L 8.83 4.90 0.00 1.53 1.71 1.01 0.95 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 15 L 8.34 4.61 0.00 1.51 1.61 0.94 1.00 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 16 Y 8.50 4.40 0.00 2.95 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 17 T 7.15 3.96 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 1.06 0.00 0.00 18 R 8.02 3.96 0.00 1.75 1.91 0.00 3.25 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.50 0.00 19 N 7.51 4.31 0.00 2.62 2.66 0.00 0.00 7.03 8.07 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 20 D 8.76 4.40 0.00 2.64 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 21 V 7.49 3.68 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 0.84 0.00 0.00 0.94 0.00 0.00 22 S 8.53 4.27 0.00 4.09 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 23 D 8.89 4.20 0.00 2.79 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 24 S 8.04 4.05 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 25 E 8.34 3.91 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 26 K 8.80 3.84 0.00 1.96 1.94 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.45 1.77 7.81 27 K 8.39 3.91 0.00 1.97 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.62 7.81 28 A 7.94 3.99 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.24 3.73 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 1.19 0.00 0.00 30 V 8.12 3.63 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 0.98 0.00 0.00 0.97 0.00 0.00 31 E 7.99 3.93 0.00 2.11 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 0.00 2.30 2.45 0.00 32 L 7.79 3.96 0.00 1.81 1.81 0.97 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.45 3.93 0.00 1.84 1.65 0.87 0.63 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 34 N 8.16 4.39 0.00 2.82 2.88 0.00 0.00 7.13 7.45 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 35 R 7.81 3.92 0.00 2.09 2.00 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 36 Q 7.74 4.10 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.72 0.00 0.00 0.00 0.00 0.00 2.59 2.48 0.00 37 V 8.07 3.53 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 1.18 0.00 0.00 0.92 0.00 0.00 38 I 7.82 3.73 2.05 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 1.42 0.96 0.93 0.00 0.00 39 Q 7.97 3.98 0.00 2.35 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 40 F 9.15 3.87 0.00 3.11 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 41 I 8.13 3.72 1.94 0.00 0.00 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 1.45 1.12 0.93 0.00 0.00 42 D 8.17 4.30 0.00 2.89 2.64 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 43 L 7.96 3.77 0.00 1.72 1.53 -0.34 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.44 4.07 0.00 4.04 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 45 L 7.93 3.88 0.00 1.86 1.73 0.94 0.71 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 46 I 7.79 3.40 1.93 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 1.47 0.76 0.47 0.00 0.00 47 T 7.84 3.76 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 48 K 7.65 3.31 0.00 1.56 1.10 0.00 1.66 0.00 0.00 1.40 0.00 0.00 2.68 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.30 0.77 7.81 49 Q 7.42 3.85 0.00 2.20 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.51 2.59 0.00 50 A 7.66 3.84 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 51 H 7.88 3.83 0.00 2.91 3.08 0.00 5.96 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 52 W 7.88 4.64 0.00 3.51 3.07 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 53 N 8.16 5.02 0.00 2.92 3.01 0.00 0.00 6.72 8.21 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 54 M 6.95 4.92 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.95 0.00 55 R 8.92 4.28 0.00 1.82 1.67 0.00 3.03 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.50 0.00 56 G 8.65 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 57 A 8.51 3.98 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 58 N 8.87 4.14 0.00 2.96 2.85 0.00 0.00 6.85 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 59 F 7.96 4.29 0.00 3.20 2.98 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 60 I 7.83 2.98 1.91 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.94 0.87 0.00 0.00 61 A 7.71 3.80 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.29 3.32 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 0.90 0.00 0.00 0.90 0.00 0.00 63 H 8.46 3.86 0.00 2.19 2.81 0.00 5.83 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 64 E 8.01 3.85 0.00 1.88 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 2.25 2.38 0.00 65 M 7.81 3.57 0.00 1.82 1.74 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.47 0.00 66 L 7.49 3.36 0.00 1.66 1.49 0.83 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 67 D 7.26 4.11 0.00 2.44 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 7.45 3.50 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 69 F 7.05 3.89 0.00 2.95 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 70 R 7.83 3.89 0.00 1.79 1.99 0.00 3.03 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 71 T 7.57 3.87 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 1.24 0.00 0.00 72 A 7.91 4.12 1.74 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 0.00 0.00 73 L 8.62 4.28 0.00 2.16 1.88 1.14 0.73 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 74 I 8.11 3.81 2.04 0.00 0.00 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 1.45 0.82 0.93 0.00 0.00 75 C 8.03 4.08 0.00 3.02 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 76 H 8.27 4.08 0.00 3.44 3.13 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.21 3.61 0.00 1.88 1.90 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.20 3.96 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 79 T 7.51 3.81 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 1.18 0.00 0.00 80 M 8.33 4.07 0.00 1.88 2.04 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.37 0.00 81 A 8.03 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.55 3.98 0.00 2.11 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 2.31 2.29 0.00 83 R 8.05 3.88 0.00 2.00 2.07 0.00 3.12 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 84 A 7.88 3.94 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 85 V 7.61 3.74 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 1.01 0.00 0.00 0.97 0.00 0.00 86 Q 7.71 4.04 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 87 L 7.28 4.35 0.00 1.68 1.67 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.10 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 89 G 7.50 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 90 V 8.01 4.21 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 0.93 0.00 0.00 91 A 8.65 4.27 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 92 L 9.45 4.69 0.00 1.58 1.61 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.41 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 0.00 0.00 0.00 0.00 94 T 7.85 4.24 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 95 T 8.54 3.87 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 1.23 0.00 0.00 96 Q 7.99 3.98 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 97 V 7.42 3.63 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 1.03 0.00 0.00 0.94 0.00 0.00 98 I 7.86 3.81 2.03 0.00 0.00 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 1.72 1.00 0.93 0.00 0.00 99 N 8.17 4.43 0.00 2.79 2.86 0.00 0.00 7.20 7.25 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 0.00 100 S 7.69 4.56 0.00 3.94 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 0.00 101 K 7.52 4.54 0.00 1.79 1.75 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.38 7.81 102 T 7.99 3.87 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 1.24 0.00 0.00 103 P 0.00 4.58 0.00 2.22 2.14 0.00 3.81 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 104 L 7.31 4.53 0.00 1.78 1.66 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.68 3.87 0.00 1.73 1.76 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.45 7.81 106 S 8.85 4.05 0.00 3.90 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 0.00 107 Y 8.68 4.15 0.00 3.10 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 0.00 108 P 0.00 4.28 0.00 2.01 1.86 0.00 2.56 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.71 0.00 109 L 8.53 4.67 0.00 1.70 1.80 0.98 1.21 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 0.00 110 D 7.84 4.85 0.00 2.72 2.72 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 0.00 111 I 7.33 4.15 1.69 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.31 0.78 0.00 0.00 112 H 8.35 5.18 0.00 3.18 3.32 0.00 5.90 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.07 4.86 0.00 2.78 2.96 0.00 0.00 6.82 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 0.00 114 V 8.42 3.69 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.16 0.00 0.00 115 Q 8.86 4.12 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 116 D 8.18 4.32 0.00 2.84 2.63 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 0.00 0.00 0.00 0.00 117 H 8.09 4.45 0.00 3.45 3.48 0.00 5.65 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 0.00 118 L 8.54 4.13 0.00 1.93 1.77 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.30 3.96 0.00 1.95 1.88 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.68 7.81 120 E 8.59 3.98 0.00 2.23 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 0.00 1.69 2.22 0.00 121 L 8.98 4.21 0.00 1.96 1.73 0.93 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.61 4.02 1.44 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 0.00 0.00 0.00 123 D 8.26 4.37 0.00 3.00 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 0.00 124 R 8.03 4.02 0.00 1.94 2.01 0.00 3.46 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.92 0.00 125 Y 8.91 3.76 0.00 3.23 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 0.00 126 A 8.50 4.00 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 0.00 127 I 7.75 3.59 2.02 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 1.41 0.74 0.89 0.00 0.00 128 V 7.49 3.44 1.74 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 0.54 0.00 0.00 0.78 0.00 0.00 129 A 8.52 3.90 1.44 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 0.00 0.00 0.00 130 N 8.73 4.24 0.00 2.72 2.88 0.00 0.00 6.77 7.98 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 0.00 131 D 8.27 4.29 0.00 2.81 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 0.00 132 V 8.03 3.79 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 0.88 0.00 0.00 1.03 0.00 0.00 133 R 7.76 3.89 0.00 1.92 2.16 0.00 3.23 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 134 K 7.87 4.10 0.00 2.15 1.83 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.19 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.49 7.81 135 A 8.17 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 I 7.48 3.70 1.97 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 1.43 1.10 0.89 0.00 0.00 137 G 7.60 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 0.00 0.00 0.00 138 E 7.42 4.26 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 2.31 2.31 0.00 139 A 7.37 4.19 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.60 4.06 0.00 2.04 1.89 0.00 1.99 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.55 7.81 141 D 7.96 4.46 0.00 2.72 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.86 4.37 0.00 2.71 2.71 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 0.00 143 D 8.13 4.40 0.00 2.84 2.72 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 0.00 144 T 7.77 3.83 4.36 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 1.18 0.00 0.00 145 A 8.07 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 D 8.19 4.23 0.00 2.79 2.84 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 0.00 147 I 7.81 3.68 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.87 0.84 0.00 0.00 148 L 7.98 3.98 0.00 1.84 1.69 0.93 0.46 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 0.00 149 T 8.30 3.78 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 1.18 0.00 0.00 150 A 8.06 4.03 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 7.91 3.25 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.45 3.94 0.00 3.88 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 0.00 153 R 8.61 3.78 0.00 1.96 1.98 0.00 3.09 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 154 D 7.71 4.00 0.00 2.61 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 0.00 0.00 0.00 155 L 7.56 3.71 0.00 1.71 1.59 0.79 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.11 4.37 0.00 2.62 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 7.41 4.02 0.00 1.86 1.68 0.00 1.62 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.06 1.37 7.81 158 F 7.91 4.00 0.00 2.90 1.82 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 0.00 159 L 8.22 3.88 0.00 1.88 1.91 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 160 W 8.16 4.41 0.00 3.40 3.39 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 0.00 161 F 7.89 4.13 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 0.00 162 I 8.28 3.85 1.95 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.81 0.89 0.00 0.00 163 E 8.68 4.02 0.00 2.27 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 164 S 8.27 4.34 0.00 3.81 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 0.00 165 N 7.86 4.71 0.00 2.81 2.81 0.00 0.00 7.01 7.07 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 0.00 166 I 6.98 4.17 2.03 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 1.32 0.66 0.96 0.00 0.00 167 E 9.32 4.15 0.00 1.94 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 2.35 2.27 0.00