NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 35 M 4.3762 8.3044 120.3677 56.6394 33.7984 173.9524 36 N 3.9915 8.8990 118.7996 54.1544 37.3102 173.2079 37 Q 3.6558 7.0057 126.7552 56.8539 27.3791 179.2775 38 Q 2.6521 7.9730 122.9365 58.1139 32.1062 175.1142 39 G 4.1647 8.5543 119.1536 42.6055 0.0000 171.2779 40 F 4.2298 7.8643 128.5672 58.2058 47.8184 176.3965 41 V 3.6920 8.0222 113.7150 64.6463 30.8332 178.5143 42 I 3.6928 7.3975 118.5747 64.6705 37.1155 178.6976 43 S 4.0348 7.7039 115.2895 61.2811 62.6770 176.1625 44 N 4.3414 8.2981 119.6893 55.7323 38.3854 177.0983 45 E 4.2320 8.1194 120.9493 59.2110 29.6811 178.8340 46 L 4.0686 7.6443 118.1678 56.9330 41.3740 179.3403 47 R 3.9363 7.1052 114.4844 58.6502 29.6651 177.9722 48 Q 4.0897 8.4212 120.7570 59.2335 28.9725 178.6169 49 Q 4.0617 8.0330 118.7071 58.9815 28.6700 178.1063 50 Q 4.1724 7.7723 115.8428 57.2047 28.9423 177.1556 51 S 4.4001 8.1131 113.6914 60.7960 62.9357 175.3084 52 E 4.8918 7.6362 119.5902 56.4943 29.6235 178.5753 53 L 4.1081 7.5293 119.8535 57.6359 41.6866 179.2914 54 T 4.0840 7.6663 115.8025 66.5299 68.2552 176.4471 55 S 4.5036 8.2612 114.5385 59.9252 63.0889 176.3971 56 T 4.1279 8.1288 120.4153 66.7696 68.5521 175.8969 57 W 4.6514 8.5618 130.2790 60.4855 30.8150 177.0530 58 D 4.1790 8.2173 117.7796 57.7636 40.6144 179.0094 59 L 4.1628 7.4935 119.2685 57.9219 41.3684 179.1089 60 M 4.0670 8.1234 117.5288 56.8547 32.3380 178.0573 61 L 4.0807 7.1677 118.9602 57.1586 42.4266 178.3391 62 Q 3.9345 8.2587 118.1605 59.7291 28.6830 180.0549 63 T 3.9604 8.2095 116.7622 66.4630 68.2710 176.1537 64 R 4.1277 7.5064 116.1826 57.0781 30.0075 177.0217 65 I 4.2132 7.7116 118.6789 63.7535 38.0803 177.4441 66 N 4.4001 8.0251 114.6693 55.0882 38.5588 176.7592 67 L 4.2040 7.8091 121.2954 57.7437 42.0552 179.2356 68 S 4.0782 7.9788 114.5112 61.5064 62.6123 176.5401 69 R 3.8654 8.0792 120.3543 58.9434 29.9976 178.4859 70 S 4.3915 8.1369 114.5354 60.4792 63.4614 175.9481 71 A 3.6724 7.6726 122.6813 55.4404 17.7631 179.5258 72 A 4.0120 7.9857 117.5657 54.8015 18.4891 178.5275 73 R 4.3569 7.7063 115.4670 56.8084 32.5786 178.2688 74 M 4.4206 7.7132 118.0958 53.7178 29.1405 174.7895 75 M 4.3895 6.9978 121.3154 54.5833 34.3407 177.3499 76 M 4.7220 8.1863 117.7974 55.3964 29.4909 174.3203 77 D 4.4277 7.4480 122.2438 56.2991 44.5021 177.2121 78 A 4.0092 7.9378 117.2588 53.7311 18.4675 178.7101 79 S 4.1853 8.4079 109.7162 61.5431 63.0527 175.9420 80 N 4.4707 7.7815 123.3145 52.7899 36.2618 172.8343 81 Q 4.2133 8.0546 122.2792 55.5454 27.7893 175.0731 82 Q 4.3595 7.8066 122.2332 54.1383 30.2486 173.6785 83 S 4.1801 8.1905 116.1887 58.6064 61.5944 173.1814 84 S 4.0536 7.5176 122.0636 58.5280 62.5021 170.1062 85 A 3.8153 7.1292 123.5124 48.2395 20.7658 178.6992 86 K 4.2267 9.2971 121.0079 61.2110 33.2142 180.0329 87 T 3.6191 7.2235 111.5305 64.0596 68.9128 172.4928 88 D 4.7143 8.6426 119.0092 54.8947 45.3929 177.4777 89 L 4.1696 7.7806 118.0710 57.0697 41.8084 178.9630 90 L 4.1481 7.8207 117.9799 56.7857 41.5769 179.2055 91 Q 3.9898 7.9022 118.5577 59.1756 28.6465 178.4029 92 N 4.3614 8.1777 116.6640 55.6181 38.4476 176.2543 93 A 4.3654 7.5388 119.0256 52.4790 19.5474 178.4686 94 K 4.1814 7.6687 117.6543 58.6871 32.8262 179.1446 95 T 3.8396 7.8660 115.9321 66.9826 68.2237 176.8413 96 T 3.9118 8.0019 113.7817 64.5047 67.5294 175.9288 97 L 3.9879 7.7013 121.9617 58.1842 42.5125 178.2332 98 A 3.9779 8.0306 120.6943 55.5211 17.9946 179.7791 99 Q 3.8331 7.9632 115.8054 58.8764 28.8247 178.0125 100 A 3.9835 7.9506 121.6208 55.5906 18.1776 179.4440 101 A 4.6148 8.3430 118.0766 54.8015 18.7125 179.2645 102 A 4.1101 7.9561 118.7466 55.5330 18.5077 179.6161 103 H 4.2160 8.2888 115.0188 59.3114 28.8734 177.3814 104 Y 4.1494 8.3641 121.0667 60.6507 38.3885 178.1312 105 A 3.9433 7.9908 121.7312 54.5887 18.2576 178.3839 106 N 4.6104 7.7788 112.0981 54.1224 39.0147 175.9214 107 F 4.6885 7.6026 122.1830 58.6089 41.1194 176.0986 108 K 3.5054 7.3088 115.8450 56.9857 32.8089 176.7121 109 N 4.6411 7.6369 117.1458 53.1334 38.6664 174.0190 110 M 4.6040 6.9131 118.4528 53.3585 34.2701 175.8020 111 T 3.9516 8.2095 115.6335 60.8377 69.6848 173.0341 112 P 4.4480 0.0000 0.0000 61.8027 30.4077 174.6243 113 L 4.2169 8.2571 125.5371 54.2462 42.0291 176.3710 114 P 4.2678 0.0000 0.0000 64.7717 31.4550 178.4101 115 A 3.9972 8.0967 119.5730 55.3273 18.3146 177.7093 116 M 4.3799 8.8598 115.1363 55.4808 31.5829 177.9254 117 A 4.0793 7.6527 123.8528 55.0851 19.3762 178.8381 118 E 4.4371 7.7693 114.7967 55.4389 29.5625 176.2577 119 A 4.7200 7.5434 122.9999 53.9459 23.2214 178.8401 120 S 4.2774 9.1898 111.1731 61.7381 62.8835 176.9044 121 A 4.1449 8.2244 121.2453 53.8623 18.2488 178.1902 122 N 4.5994 8.2188 115.7103 55.8140 39.7373 177.0579 123 V 3.7516 7.8665 118.9368 65.8478 31.4162 177.4174 124 D 5.0219 8.6073 119.7527 56.9976 40.9652 177.6654 125 E 3.9772 8.2124 117.8990 59.2820 29.9169 178.4397 126 K 4.1289 8.5429 118.9339 59.7150 32.1689 178.7752 127 Y 3.8840 8.4069 119.9423 60.0124 38.4106 176.9872 128 Q 4.3468 7.9838 117.0234 56.3424 29.5751 177.3548 129 R 4.1984 7.8179 118.2886 58.8019 29.9163 177.5627 130 Y 4.4884 7.6937 118.8545 58.3461 39.1087 176.9541 131 Q 3.4848 7.8219 120.8104 59.0802 28.9832 177.8061 132 A 3.8558 7.7590 121.1087 55.1042 18.2984 179.2536 133 A 3.8873 7.5622 117.7443 55.1250 18.5730 179.7070 134 L 3.8833 7.3911 116.9080 57.7917 40.2711 179.3087 135 A 3.9255 7.7864 119.8519 54.2224 18.1911 178.9044 136 E 3.9166 7.5724 117.1202 58.1173 29.8002 178.3716 137 L 4.2598 7.7113 118.9250 56.5272 41.6336 179.3950 138 I 3.7021 7.4025 113.5254 64.0379 37.6127 177.8042 139 Q 4.0365 7.0782 118.8511 59.1932 28.9595 177.6036 140 F 4.5434 8.5139 119.4403 60.7412 38.7370 176.9002 141 L 4.2346 8.6168 119.8307 56.2464 41.8964 177.8814 142 D 4.6337 8.2754 118.1563 54.4131 40.4531 176.7236 143 N 4.8465 7.9543 117.7891 52.9770 39.0728 178.0711 144 G 4.0315 8.4018 107.3543 47.1980 0.0000 175.9211 145 N 4.6272 7.8474 120.3846 53.0860 36.3003 175.6920 146 M 4.0398 8.1248 122.5584 59.0930 32.2251 178.2713 147 D 4.3777 8.0350 117.3600 57.1278 41.2796 178.0371 148 A 3.9825 7.6222 120.6490 55.1422 18.5622 179.2100 149 Y 4.0178 7.0119 116.8993 60.3616 39.6490 177.6729 150 F 4.6158 8.1407 117.2949 57.6239 39.3024 176.3548 151 A 4.5100 8.2020 125.1528 53.7031 20.4412 178.6983 152 Q 4.1854 7.7798 112.5119 55.5252 29.6283 175.9608 153 P 4.5741 0.0000 0.0000 62.0923 29.0738 177.1049 154 T 3.9220 8.0970 119.4124 66.4745 68.6537 175.2092 155 Q 4.0852 8.2604 121.0345 59.3378 29.0131 178.8505 156 G 3.5348 7.9760 105.9598 48.0654 0.0000 175.2862 157 M 4.1776 7.8132 119.1229 56.8121 32.1757 177.6912 158 Q 3.3238 7.2204 119.4441 57.8730 29.8184 176.9183 159 N 4.3067 8.1859 117.4484 56.3476 38.5789 177.1512 160 A 4.7476 7.9399 123.2786 54.7312 18.4290 179.5158 161 L 3.9421 7.6748 118.4984 58.0251 42.2272 178.9886 162 G 3.2730 8.3796 106.1216 47.7023 0.0000 175.4436 163 E 3.8309 8.1219 120.3599 59.0668 29.5073 178.9240 164 A 3.9518 7.8790 120.5747 55.3756 18.4765 179.2576 165 L 3.8670 8.0075 117.8483 58.0884 41.6359 180.0901 166 G 3.6010 7.8384 105.0360 48.0107 0.0000 175.0954 167 N 4.3258 8.4641 120.5750 56.4234 38.8844 176.2838 168 Y 4.0287 8.5598 121.1721 60.3256 38.7649 177.8598 169 A 3.8530 8.1938 122.0875 55.1801 18.1631 179.7297 170 R 3.7945 8.3168 114.9966 59.3048 28.9583 178.6826 171 V 3.7984 7.4225 117.4469 64.8984 32.1543 177.8643 172 S 4.0515 8.1147 115.6372 61.2407 62.6120 176.2673 173 E 3.9290 8.2676 121.4420 59.6852 29.1385 179.1378 174 N 4.5722 7.5544 113.8839 55.8398 38.6241 176.8196 175 L 4.0762 7.4453 121.1945 58.1005 42.5599 177.6682 176 Y 3.8055 7.7715 117.8905 58.6751 39.8251 175.2804 177 R 4.8639 7.9112 121.4585 54.2515 29.0029 175.0583 178 Q 4.5173 6.9438 116.7292 56.1676 35.6893 174.9646 179 T 4.2424 6.9155 114.5728 61.9422 70.3818 173.9906 180 F 4.3583 8.3723 124.2779 58.3034 39.8917 173.9678 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 35 M 8.30 4.38 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 36 N 8.90 3.99 0.00 2.98 2.92 0.00 0.00 7.14 6.19 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 37 Q 7.01 3.66 0.00 2.29 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.06 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 38 Q 7.97 2.65 0.00 2.37 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.02 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 39 G 8.55 4.16 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 0.00 0.00 0.00 40 F 7.86 4.23 0.00 3.20 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 41 V 8.02 3.69 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.02 0.00 0.00 42 I 7.40 3.69 1.97 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 1.52 1.25 0.91 0.00 0.00 43 S 7.70 4.03 0.00 3.35 3.58 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 44 N 8.30 4.34 0.00 2.65 2.81 0.00 0.00 6.54 7.24 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 45 E 8.12 4.23 0.00 2.28 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 2.31 2.40 0.00 46 L 7.64 4.07 0.00 1.56 1.49 0.81 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 47 R 7.11 3.94 0.00 1.95 1.91 0.00 3.09 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.79 0.00 48 Q 8.42 4.09 0.00 2.23 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 49 Q 8.03 4.06 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.76 0.00 0.00 0.00 0.00 0.00 2.66 2.68 0.00 50 Q 7.77 4.17 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 51 S 8.11 4.40 0.00 3.91 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 52 E 7.64 4.89 0.00 2.10 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 2.25 2.18 0.00 53 L 7.53 4.11 0.00 1.37 1.51 -0.02 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54 T 7.67 4.08 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 55 S 8.26 4.50 0.00 3.94 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 56 T 8.13 4.13 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 57 W 8.56 4.65 0.00 3.47 3.34 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 58 D 8.22 4.18 0.00 3.08 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 59 L 7.49 4.16 0.00 1.90 1.79 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 60 M 8.12 4.07 0.00 1.83 2.32 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.49 0.00 61 L 7.17 4.08 0.00 1.47 1.44 0.58 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 8.26 3.93 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 63 T 8.21 3.96 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 1.15 0.00 0.00 64 R 7.51 4.13 0.00 2.00 1.92 0.00 3.44 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 65 I 7.71 4.21 2.00 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 1.50 0.72 0.90 0.00 0.00 66 N 8.03 4.40 0.00 2.66 2.86 0.00 0.00 6.91 7.85 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 67 L 7.81 4.20 0.00 1.78 1.80 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.98 4.08 0.00 4.02 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.08 3.87 0.00 1.73 2.00 0.00 3.30 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 70 S 8.14 4.39 0.00 3.83 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 71 A 7.67 3.67 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 72 A 7.99 4.01 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 R 7.71 4.36 0.00 2.07 1.93 0.00 3.19 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 74 M 7.71 4.42 0.00 1.93 2.18 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.56 0.00 75 M 7.00 4.39 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.52 0.00 76 M 8.19 4.72 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.58 0.00 77 D 7.45 4.43 0.00 2.62 2.59 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 78 A 7.94 4.01 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 79 S 8.41 4.19 0.00 3.94 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 80 N 7.78 4.47 0.00 2.68 2.80 0.00 0.00 6.91 7.08 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 81 Q 8.05 4.21 0.00 2.20 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 82 Q 7.81 4.36 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 83 S 8.19 4.18 0.00 3.85 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 84 S 7.52 4.05 0.00 4.32 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 85 A 7.13 3.82 1.32 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 0.00 0.00 0.00 86 K 9.30 4.23 0.00 1.98 2.06 0.00 1.41 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.54 7.81 87 T 7.22 3.62 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 88 D 8.64 4.71 0.00 2.71 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 89 L 7.78 4.17 0.00 1.70 1.67 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 90 L 7.82 4.15 0.00 1.66 1.69 1.00 0.87 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 91 Q 7.90 3.99 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.61 0.00 92 N 8.18 4.36 0.00 2.88 2.85 0.00 0.00 6.90 7.86 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 93 A 7.54 4.37 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 94 K 7.67 4.18 0.00 1.73 1.82 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.69 7.81 95 T 7.87 3.84 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 1.20 0.00 0.00 96 T 8.00 3.91 4.55 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 0.00 0.00 0.00 1.30 0.00 0.00 97 L 7.70 3.99 0.00 1.71 1.78 0.77 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.03 3.98 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 99 Q 7.96 3.83 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 100 A 7.95 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 0.00 101 A 8.34 4.61 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 0.00 102 A 7.96 4.11 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 0.00 103 H 8.29 4.22 0.00 3.39 3.42 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.36 4.15 0.00 2.74 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 0.00 105 A 7.99 3.94 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.78 4.61 0.00 2.97 2.87 0.00 0.00 6.75 7.74 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 0.00 107 F 7.60 4.69 0.00 2.92 2.86 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 0.00 108 K 7.31 3.51 0.00 1.42 0.74 0.00 1.52 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.97 1.10 7.81 109 N 7.64 4.64 0.00 2.74 2.78 0.00 0.00 6.71 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 0.00 110 M 6.91 4.60 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 111 T 8.21 3.95 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 1.18 0.00 0.00 112 P 0.00 4.45 0.00 2.26 2.27 0.00 3.67 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.96 0.00 113 L 8.26 4.22 0.00 1.74 1.66 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.27 0.00 2.17 2.12 0.00 3.90 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 115 A 8.10 4.00 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 0.00 116 M 8.86 4.38 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.81 0.00 117 A 7.65 4.08 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 E 7.77 4.44 0.00 2.12 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 2.29 2.33 0.00 119 A 7.54 4.72 1.49 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 0.00 120 S 9.19 4.28 0.00 3.97 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 0.00 121 A 8.22 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 0.00 122 N 8.22 4.60 0.00 2.85 2.97 0.00 0.00 6.67 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 0.00 123 V 7.87 3.75 2.27 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 1.27 0.00 0.00 0.86 0.00 0.00 124 D 8.61 5.02 0.00 3.04 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 0.00 125 E 8.21 3.98 0.00 2.04 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 2.31 2.43 0.00 126 K 8.54 4.13 0.00 1.95 1.84 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.69 1.59 7.81 127 Y 8.41 3.88 0.00 2.77 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 0.00 128 Q 7.98 4.35 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.64 0.00 0.00 0.00 0.00 0.00 2.47 2.66 0.00 129 R 7.82 4.20 0.00 2.06 2.18 0.00 2.76 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.67 0.00 130 Y 7.69 4.49 0.00 3.09 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 0.00 131 Q 7.82 3.48 0.00 1.60 1.85 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 2.01 2.30 0.00 132 A 7.76 3.86 1.32 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 0.00 0.00 0.00 133 A 7.56 3.89 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 0.00 134 L 7.39 3.88 0.00 1.61 1.50 0.57 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 135 A 7.79 3.93 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 0.00 136 E 7.57 3.92 0.00 1.68 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 2.04 2.29 0.00 137 L 7.71 4.26 0.00 1.75 1.96 0.64 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 138 I 7.40 3.70 1.82 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 1.35 0.49 0.85 0.00 0.00 139 Q 7.08 4.04 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.01 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 140 F 8.51 4.54 0.00 3.24 3.02 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 0.00 0.00 0.00 141 L 8.62 4.23 0.00 1.80 1.68 0.40 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.28 4.63 0.00 2.75 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 0.00 143 N 7.95 4.85 0.00 3.09 2.89 0.00 0.00 6.77 7.46 0.00 0.00 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 G 8.40 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 0.00 145 N 7.85 4.63 0.00 2.98 2.77 0.00 0.00 6.99 7.43 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 0.00 146 M 8.12 4.04 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.77 0.00 147 D 8.04 4.38 0.00 2.61 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 0.00 148 A 7.62 3.98 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 7.01 4.02 0.00 3.01 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 0.00 150 F 8.14 4.62 0.00 3.01 2.92 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 0.00 151 A 8.20 4.51 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 0.00 152 Q 7.78 4.19 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 7.34 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 153 P 0.00 4.57 0.00 2.19 2.06 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 154 T 8.10 3.92 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 1.33 0.00 0.00 155 Q 8.26 4.09 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 156 G 7.98 3.53 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 0.00 0.00 0.00 157 M 7.81 4.18 0.00 2.14 2.46 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.58 0.00 158 Q 7.22 3.32 0.00 1.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.28 0.00 159 N 8.19 4.31 0.00 2.73 2.84 0.00 0.00 6.95 7.90 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 0.00 160 A 7.94 4.75 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 0.00 161 L 7.67 3.94 0.00 1.60 1.68 1.36 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 162 G 8.38 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 0.00 0.00 0.00 163 E 8.12 3.83 0.00 2.21 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 164 A 7.88 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 L 8.01 3.87 0.00 1.50 1.44 0.20 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 166 G 7.84 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 4.33 0.00 2.74 2.93 0.00 0.00 6.94 7.32 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 0.00 168 Y 8.56 4.03 0.00 3.12 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 A 8.19 3.85 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 0.00 170 R 8.32 3.79 0.00 2.01 2.21 0.00 2.76 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 171 V 7.42 3.80 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 0.81 0.00 0.00 0.97 0.00 0.00 172 S 8.11 4.05 0.00 3.57 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 0.00 173 E 8.27 3.93 0.00 2.00 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 2.31 2.49 0.00 174 N 7.55 4.57 0.00 2.88 2.89 0.00 0.00 7.10 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 L 7.45 4.08 0.00 1.64 1.88 0.89 0.76 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 0.00 176 Y 7.77 3.81 0.00 2.84 2.59 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 0.00 177 R 7.91 4.86 0.00 1.86 2.01 0.00 3.40 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 178 Q 6.94 4.52 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.44 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 179 T 6.92 4.24 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 0.85 0.00 0.00 180 F 8.37 4.36 0.00 2.84 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