NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2184 8.1727 120.1315 56.8164 34.8623 174.0862 2 V 4.5375 8.0386 121.4587 60.7266 32.4116 174.6245 3 F 4.4598 9.9537 128.8682 57.5942 40.2203 174.8947 4 E 4.2874 9.2234 121.0155 55.5331 31.0727 176.7720 5 R 3.3273 8.9863 120.8542 60.7784 29.9226 179.4623 6 C 4.3239 8.0233 115.3080 59.6811 36.9535 175.7682 7 E 3.8814 8.1017 120.6986 59.2216 29.2995 178.4686 8 L 3.4528 7.9390 120.0654 57.8103 42.0765 178.6146 9 A 3.9311 7.7971 120.6931 55.4559 18.2622 179.9309 10 R 3.9123 7.9421 116.4383 59.4611 29.9493 179.4598 11 T 3.8325 7.8322 115.6123 66.7339 68.4864 176.7196 12 L 3.8588 8.1469 121.2499 57.4339 41.5484 179.5528 13 K 3.8961 8.1053 119.6900 59.5598 31.9807 178.9247 14 R 3.9352 8.0204 117.8260 58.9246 29.9912 177.4288 15 L 4.4008 7.2975 116.6859 54.1184 41.7417 176.9557 16 G 3.8829 7.9153 106.9174 46.7453 0.0000 175.1304 17 M 3.9342 7.8736 121.7866 56.7249 32.3279 175.8468 18 D 4.6039 8.0495 118.0503 55.6608 41.3476 175.8637 19 G 3.9417 9.5017 115.5697 45.6074 0.0000 171.6311 20 Y 4.2327 8.3307 122.0942 58.7148 39.0276 176.4427 21 R 3.5600 8.8598 127.1379 57.3085 27.7857 177.1128 22 G 3.8230 8.1030 102.4612 45.9356 0.0000 173.8375 23 I 4.1121 7.6291 122.0445 59.1433 38.1972 175.9633 24 S 4.6394 8.3104 120.1462 57.6509 64.0192 174.8679 25 L 4.2146 8.8008 122.9605 58.5900 41.6726 179.2495 26 A 4.1251 8.1940 120.1057 55.3763 18.1815 179.2565 27 N 4.3796 8.1110 114.4858 56.3475 38.5498 177.6936 28 W 4.2169 8.0004 119.8539 59.9515 29.0879 178.3755 29 M 4.1675 8.5306 118.9404 58.6272 31.4583 177.9505 30 C 3.2059 8.1329 118.8227 59.0626 44.0836 175.4099 31 L 3.9637 8.2680 121.9296 58.2480 41.7857 178.8404 32 A 4.2209 8.4745 121.0337 54.8959 18.2773 179.3776 33 K 2.7756 8.3991 118.5297 59.4123 32.0606 179.0787 34 W 4.2991 7.7588 117.1148 59.0546 29.0958 178.2764 35 E 4.3911 8.4056 118.8327 58.5856 29.0133 177.6909 36 S 4.5207 7.8956 108.8740 56.8360 65.1435 174.3374 37 G 3.1882 8.2270 108.9196 47.0579 0.0000 173.3782 38 Y 3.6523 7.6789 113.3581 58.7253 34.8789 168.7078 39 N 5.3010 7.6618 118.3669 52.0334 39.7596 175.6162 40 T 4.1847 8.8630 117.4848 64.1492 69.2363 176.6155 41 R 4.1470 8.0443 119.8515 57.3873 30.7390 176.6277 42 A 4.2296 7.5103 119.7548 53.0113 19.2392 176.7595 43 T 4.9815 8.3846 111.1284 59.9623 72.2841 172.8808 44 N 4.9223 8.8308 122.5925 52.0588 41.8015 172.3378 45 Y 4.6743 8.7074 127.6789 57.2476 40.8766 173.8967 46 N 4.6623 8.3105 124.4556 50.6806 38.4903 174.7938 47 A 3.6417 8.1889 126.5488 54.8909 18.8993 179.4702 48 G 3.7694 8.0707 103.9268 48.1964 0.0000 173.8785 49 D 4.7538 7.4213 115.2600 51.8955 40.1098 175.3511 50 R 3.9503 8.1095 115.8742 56.8347 28.2251 175.8488 51 S 4.9757 7.5020 110.9559 56.9895 66.6440 172.6654 52 T 5.1143 8.9176 115.8136 62.0078 72.9252 172.8936 53 D 5.3794 8.9936 125.6205 53.3798 43.0803 175.0742 54 Y 5.0474 9.1884 121.2776 57.4164 41.5270 177.5341 55 G 4.6161 8.9968 111.8144 45.9477 0.0000 173.5747 56 I 3.9794 8.2184 116.8673 62.8727 37.9293 177.4149 57 F 4.8303 7.9414 115.6471 56.4112 39.9550 175.1539 58 Q 3.6042 7.9066 119.2783 57.0982 26.6544 174.2018 59 I 4.3533 8.0313 118.5602 61.1149 39.1567 176.9266 60 N 5.3308 9.1905 126.0185 53.3866 38.3055 175.9341 61 S 4.5420 9.2821 120.6374 60.8951 63.9193 176.3057 62 R 3.8838 8.5772 121.4636 58.6411 30.3060 178.1253 63 Y 4.2543 7.4787 113.5469 57.7996 40.6312 176.9463 64 W 4.8606 8.4464 118.9256 57.5560 31.1032 174.0653 65 C 5.6849 8.1567 112.2273 53.6627 45.7139 172.3497 66 N 5.2158 8.9352 118.9216 51.9609 40.3455 174.7178 67 D 4.8564 8.6569 123.5258 52.2181 40.3951 178.4079 68 G 4.0605 8.4893 108.5184 46.3481 0.0000 174.8232 69 K 4.3758 8.0359 116.4702 56.7408 33.2607 176.1444 70 T 4.5187 7.5089 116.6033 61.7654 68.9886 173.1405 71 P 4.2623 0.0000 0.0000 63.5743 32.2087 176.3033 72 G 3.9067 8.3346 108.1241 46.6263 0.0000 172.6071 73 A 4.8688 7.6073 118.2093 50.1606 21.8804 177.4138 74 V 4.3488 8.3210 112.3844 59.3479 35.7122 175.9890 75 N 4.9438 8.1254 118.0639 51.7835 37.7784 174.3696 76 A 3.9113 8.7934 125.0648 54.7552 19.0752 178.6412 77 C 4.4917 8.6431 111.7625 57.5853 41.1136 173.0305 78 H 4.0882 7.8505 116.0241 56.5030 26.1246 173.7992 79 L 4.7967 8.2150 117.8939 53.0020 46.6074 176.4453 80 S 4.6434 8.3384 114.7814 57.9911 63.2605 175.9968 81 C 4.1152 8.7618 124.2382 59.5538 40.8119 176.4200 82 S 3.9234 7.8953 115.1282 61.2339 61.7028 175.9075 83 A 4.0948 7.7803 122.3234 54.3867 18.1881 177.9647 84 L 4.3952 7.7048 116.4093 55.2310 41.8108 177.7046 85 L 5.0438 7.7845 117.3399 54.4441 42.5352 176.7876 86 Q 4.3216 7.8415 117.7438 55.4752 29.4859 176.0080 87 D 4.3980 8.5692 120.2360 57.2366 41.1119 176.8514 88 N 4.5498 8.0298 118.1987 53.3228 39.2058 174.5597 89 I 4.2459 8.4500 118.9456 61.0231 37.9419 177.0625 90 A 3.9340 8.5617 125.2156 55.9796 18.1812 180.1954 91 D 4.2617 8.0716 116.4990 57.3578 40.9737 178.6393 92 A 4.0822 7.9779 120.8416 55.2632 18.4067 179.6952 93 V 3.4729 8.2001 116.8516 66.0368 31.6600 178.0833 94 A 3.8349 8.1515 120.7048 55.1933 18.0742 178.8658 95 C 4.2278 8.3411 116.8528 59.6928 39.6137 175.5623 96 A 3.9850 8.4350 122.8333 55.1016 17.6040 179.7935 97 K 3.7731 7.6920 116.2234 59.4291 32.4473 179.1814 98 R 4.0839 7.7442 118.7945 59.3983 29.9375 178.5015 99 V 2.6325 7.6548 118.2150 65.8935 31.4979 177.9424 100 V 3.9381 7.7842 109.8970 62.6777 31.3841 177.9306 101 R 4.2989 7.7071 117.1840 57.0106 30.4737 176.3933 102 D 4.7313 7.3998 119.1874 52.7239 42.0046 175.4569 103 P 4.2039 0.0000 0.0000 66.1684 30.9399 178.3934 104 Q 4.0162 8.2058 116.0750 56.7143 29.8968 177.7215 105 G 3.8926 7.9344 107.4579 46.7294 0.0000 175.8889 106 I 3.4519 7.8412 119.6795 63.6449 37.8379 177.8227 107 R 4.2205 7.3690 117.3504 57.5744 29.9346 177.4929 108 A 4.1320 7.6301 120.8210 53.7026 18.7783 177.7253 109 W 4.5946 8.0798 117.2294 55.6096 29.5338 176.8991 110 R 3.9955 9.1538 124.2556 59.8012 29.3495 178.0494 111 A 4.0441 8.2984 119.7200 54.8607 18.2840 179.1852 112 W 4.0087 8.3688 126.5848 60.6704 30.5448 178.3822 113 R 3.7648 7.8762 117.0210 59.4505 29.6227 178.5490 114 N 4.3700 8.0202 114.5029 55.3755 38.7782 176.6155 115 R 4.0541 7.8530 116.9143 55.9596 31.5735 176.1642 116 C 4.5104 7.7687 114.9637 57.6599 42.8624 174.4252 117 Q 3.0355 6.4883 119.0579 57.3477 28.6097 175.5310 118 N 4.2031 8.6567 120.8290 54.3887 36.2200 173.9032 119 R 4.5421 7.2651 115.1115 53.9977 33.3402 175.7996 120 D 4.5339 8.5005 119.2322 54.3747 40.3548 175.7044 121 V 4.6573 8.1642 118.9674 61.2002 32.3133 178.5577 122 R 4.0671 8.1175 123.3510 59.2341 30.2852 179.0563 123 Q 4.0189 8.1269 115.5540 59.1672 28.5168 178.3326 124 Y 4.1677 7.7113 115.2433 60.0834 38.2844 176.8837 125 V 4.3784 7.8808 110.9067 60.7189 33.0346 175.5613 126 Q 4.1996 7.5096 119.9621 57.2548 28.7519 177.1177 127 G 3.9787 8.9225 110.4776 45.9119 0.0000 174.6475 128 C 4.3916 7.9922 115.9076 57.2449 40.5932 173.9852 129 G 3.8196 8.2076 107.0677 46.7988 0.0000 173.9823 130 V 4.0179 7.8278 117.9565 61.1080 32.2307 175.8371 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 1 K 8.17 4.22 0.00 1.63 2.11 0.00 1.08 0.00 0.00 1.25 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 1.11 7.81 2 V 8.04 4.54 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 0.87 0.00 0.00 0.95 0.00 0.00 3 F 9.95 4.46 0.00 2.90 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 4 E 9.22 4.29 0.00 1.95 1.87 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 2.31 2.25 0.00 5 R 8.99 3.33 0.00 1.94 1.90 0.00 3.38 0.00 0.00 3.44 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.80 0.00 6 C 8.02 4.32 0.00 3.00 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 7 E 8.10 3.88 0.00 2.07 2.26 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 2.58 2.42 0.00 8 L 7.94 3.45 0.00 1.32 1.33 -0.16 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.80 3.93 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 10 R 7.94 3.91 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.83 3.83 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 1.19 0.00 0.00 12 L 8.15 3.86 0.00 1.72 1.58 0.93 0.38 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 13 K 8.11 3.90 0.00 1.93 1.95 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 8.02 3.94 0.00 2.02 1.93 0.00 3.30 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 15 L 7.30 4.40 0.00 1.61 1.55 0.84 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.92 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 17 M 7.87 3.93 0.00 1.38 2.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.22 0.00 18 D 8.05 4.60 0.00 2.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.50 3.94 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 0.00 0.00 0.00 20 Y 8.33 4.23 0.00 3.35 3.17 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 21 R 8.86 3.56 0.00 1.90 1.85 0.00 3.39 0.00 0.00 3.00 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 1.44 0.00 22 G 8.10 3.82 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 0.00 0.00 0.00 23 I 7.63 4.11 1.84 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.71 -0.22 0.00 0.00 24 S 8.31 4.64 0.00 4.06 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 25 L 8.80 4.21 0.00 2.09 1.81 0.98 1.30 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 26 A 8.19 4.13 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 4.38 0.00 2.75 2.74 0.00 0.00 6.99 8.43 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 28 W 8.00 4.22 0.00 3.54 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 29 M 8.53 4.17 0.00 2.18 2.37 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.93 0.00 30 C 8.13 3.21 0.00 2.33 3.09 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 0.00 0.00 0.00 31 L 8.27 3.96 0.00 1.82 1.81 0.64 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.47 4.22 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.40 2.78 0.00 1.78 1.71 0.00 0.61 0.00 0.00 1.36 0.00 0.00 2.72 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.13 0.46 7.81 34 W 7.76 4.30 0.00 3.34 3.26 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 35 E 8.41 4.39 0.00 2.05 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 0.00 2.59 2.43 0.00 36 S 7.90 4.52 0.00 4.08 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.23 3.19 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 0.00 38 Y 7.68 3.65 0.00 3.30 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 39 N 7.66 5.30 0.00 2.89 2.80 0.00 0.00 7.01 7.10 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 40 T 8.86 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 1.41 0.00 0.00 41 R 8.04 4.15 0.00 2.01 2.05 0.00 3.19 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 1.67 1.66 0.00 42 A 7.51 4.23 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 43 T 8.38 4.98 4.09 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 0.00 0.00 1.17 0.00 0.00 44 N 8.83 4.92 0.00 2.85 2.77 0.00 0.00 6.63 7.33 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 45 Y 8.71 4.67 0.00 2.99 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 46 N 8.31 4.66 0.00 2.62 2.56 0.00 0.00 6.66 7.21 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 47 A 8.19 3.64 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 48 G 8.07 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 49 D 7.42 4.75 0.00 2.69 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 50 R 8.11 3.95 0.00 2.02 2.16 0.00 3.11 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 51 S 7.50 4.98 0.00 3.83 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 52 T 8.92 5.11 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 0.55 0.00 0.00 53 D 8.99 5.38 0.00 2.71 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 54 Y 9.19 5.05 0.00 2.91 2.88 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 55 G 9.00 4.62 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 56 I 8.22 3.98 1.69 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.89 0.03 0.00 0.00 57 F 7.94 4.83 0.00 3.24 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 58 Q 7.91 3.60 0.00 2.55 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.72 0.00 59 I 8.03 4.35 2.13 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.05 1.07 0.00 0.00 60 N 9.19 5.33 0.00 3.12 3.06 0.00 0.00 6.97 7.63 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 61 S 9.28 4.54 0.00 4.09 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 62 R 8.58 3.88 0.00 1.50 1.42 0.00 2.64 0.00 0.00 2.91 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.02 0.00 63 Y 7.48 4.25 0.00 1.96 1.94 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 64 W 8.45 4.86 0.00 3.50 3.29 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 65 C 8.16 5.68 0.00 3.05 3.21 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 66 N 8.94 5.22 0.00 2.85 2.70 0.00 0.00 7.08 8.19 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 67 D 8.66 4.86 0.00 2.97 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.49 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 69 K 8.04 4.38 0.00 1.91 1.94 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.46 7.81 70 T 7.51 4.52 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 1.20 0.00 0.00 71 P 0.00 4.26 0.00 2.02 1.98 0.00 3.81 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 72 G 8.33 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 73 A 7.61 4.87 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 74 V 8.32 4.35 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 0.64 0.00 0.00 0.88 0.00 0.00 75 N 8.13 4.94 0.00 2.78 2.63 0.00 0.00 6.76 8.64 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 76 A 8.79 3.91 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 C 8.64 4.49 0.00 3.26 3.24 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 78 H 7.85 4.09 0.00 3.34 3.36 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.21 4.80 0.00 1.69 1.50 1.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.34 4.64 0.00 3.83 3.68 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 81 C 8.76 4.12 0.00 2.27 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 82 S 7.90 3.92 0.00 3.86 3.82 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 83 A 7.78 4.09 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 84 L 7.70 4.40 0.00 1.96 1.82 1.07 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.78 5.04 0.00 1.78 1.71 1.12 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.84 4.32 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.66 7.08 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 87 D 8.57 4.40 0.00 2.62 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 88 N 8.03 4.55 0.00 2.69 2.75 0.00 0.00 6.95 7.94 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 89 I 8.45 4.25 1.74 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.88 0.95 0.00 0.00 90 A 8.56 3.93 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 91 D 8.07 4.26 0.00 2.75 2.74 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 92 A 7.98 4.08 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 93 V 8.20 3.47 2.19 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 0.72 0.00 0.00 0.90 0.00 0.00 94 A 8.15 3.83 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 95 C 8.34 4.23 0.00 3.16 3.32 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 96 A 8.44 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.69 3.77 0.00 1.60 1.29 0.00 1.29 0.00 0.00 0.79 0.00 0.00 2.31 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.96 7.81 98 R 7.74 4.08 0.00 2.01 2.14 0.00 3.29 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.97 0.00 99 V 7.65 2.63 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 -0.28 0.00 0.00 -0.60 0.00 0.00 100 V 7.78 3.94 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.44 0.00 0.00 101 R 7.71 4.30 0.00 2.07 2.06 0.00 3.25 0.00 0.00 3.44 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.14 0.00 102 D 7.40 4.73 0.00 2.99 2.62 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 0.00 103 P 0.00 4.20 0.00 2.01 2.13 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 104 Q 8.21 4.02 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.94 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 G 7.93 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 0.00 106 I 7.84 3.45 0.98 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.35 -0.58 0.00 0.00 107 R 7.37 4.22 0.00 2.06 2.01 0.00 3.21 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.49 0.00 108 A 7.63 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.08 4.59 0.00 3.48 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 0.00 110 R 9.15 4.00 0.00 1.96 2.06 0.00 3.24 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.77 0.00 111 A 8.30 4.04 1.50 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 0.00 112 W 8.37 4.01 0.00 3.47 3.48 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 0.00 113 R 7.88 3.76 0.00 2.03 2.00 0.00 3.30 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 114 N 8.02 4.37 0.00 2.52 2.73 0.00 0.00 6.76 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 0.00 115 R 7.85 4.05 0.00 1.32 0.82 0.00 2.21 0.00 0.00 2.33 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.01 0.00 116 C 7.77 4.51 0.00 1.58 2.62 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 0.00 117 Q 6.49 3.04 0.00 0.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.91 0.00 0.00 0.00 0.00 0.00 2.16 2.26 0.00 118 N 8.66 4.20 0.00 2.79 2.82 0.00 0.00 6.86 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 0.00 119 R 7.27 4.54 0.00 1.78 1.78 0.00 3.10 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 120 D 8.50 4.53 0.00 2.64 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 0.00 121 V 8.16 4.66 2.39 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 0.94 0.00 0.00 1.04 0.00 0.00 122 R 8.12 4.07 0.00 1.94 2.01 0.00 3.16 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 123 Q 8.13 4.02 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.90 0.00 0.00 0.00 0.00 0.00 2.11 1.54 0.00 124 Y 7.71 4.17 0.00 3.24 3.17 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 0.00 125 V 7.88 4.38 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 1.02 0.00 0.00 1.06 0.00 0.00 126 Q 7.51 4.20 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.66 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 127 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 0.00 128 C 7.99 4.39 0.00 3.09 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.21 3.82 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 0.00 0.00 0.00 130 V 7.83 4.02 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 0.76 0.00 0.00 0.96 0.00 0.00