NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3433 8.2493 123.5831 52.5937 19.9196 176.2340 2 T 4.5432 8.3263 108.7358 61.5482 70.7876 172.7494 3 K 5.2961 8.2368 123.0476 55.1646 37.4085 176.0503 4 A 5.3515 9.2683 124.5328 51.0931 23.4790 175.0073 5 V 5.0638 8.7245 116.6850 60.8967 35.3084 173.0568 6 A 4.9918 9.0388 123.4601 50.4258 22.6922 175.1147 7 V 4.4180 8.4071 122.6602 61.4550 33.3243 174.5441 8 L 4.7774 8.9518 129.6273 54.1094 43.0071 176.3841 9 K 4.8565 9.1095 122.2949 55.4918 37.0380 176.1028 10 G 4.2592 7.9695 108.0634 46.5029 0.0000 172.5001 11 D 4.5491 8.8499 118.4446 55.6564 41.9951 176.8041 12 G 4.2015 7.6139 108.9623 44.0293 0.0000 171.4695 13 P 4.3645 0.0000 0.0000 64.3850 32.0320 176.6805 14 V 4.3638 7.8508 120.2059 62.7505 31.8941 174.9566 15 Q 5.2872 7.3856 123.9181 56.0977 32.1438 173.2765 16 G 4.2592 7.7154 106.2841 46.4891 0.0000 171.5167 17 I 5.0940 7.8317 119.5658 59.4272 40.7556 175.0629 18 I 4.4521 8.6498 127.8157 59.4181 40.0419 174.5128 19 N 5.0662 8.2956 124.2967 51.5129 41.2662 173.9482 20 F 5.3648 9.0201 119.7497 55.8044 43.1699 173.7165 21 E 5.0902 9.4338 123.3740 54.7200 33.2211 173.9110 22 Q 4.5796 9.2588 127.8304 54.4109 30.5994 174.6349 23 K 4.1594 8.9804 127.0605 58.5273 32.7202 177.7052 24 E 4.6820 7.9212 118.1793 54.0987 31.2457 176.7524 25 S 4.1809 8.8789 118.2646 61.0390 62.7657 174.9515 26 N 4.9463 8.0640 114.9296 52.0863 37.6332 174.3191 27 G 3.9998 8.0623 109.5826 43.9877 0.0000 172.0384 28 P 4.5947 0.0000 0.0000 62.9139 32.2725 175.9955 29 V 4.5815 9.0256 122.2065 61.3588 33.6153 174.6752 30 K 4.8125 9.1716 128.4632 55.7727 33.8812 176.0271 31 V 4.8707 9.4197 124.9005 60.7739 34.2903 174.2520 32 W 6.2158 8.3125 124.1792 53.8016 32.1532 175.7234 33 G 3.5701 7.7128 106.9233 46.1426 0.0000 170.5737 34 S 5.0920 7.5747 112.3574 56.7345 66.4009 174.1844 35 I 5.1316 8.5603 125.8112 59.4477 41.3917 174.5406 36 K 4.7287 8.7617 124.8612 55.5592 36.3439 176.9904 37 G 3.8390 8.8196 105.7515 45.8378 0.0000 173.4429 38 L 4.4824 7.5304 119.9748 53.0542 43.0731 176.3818 39 T 4.3555 8.1772 111.6901 60.9712 69.6015 174.1042 40 E 4.0901 8.6520 124.9047 57.9471 30.3417 175.2345 41 G 3.7734 8.7354 110.2658 43.7901 0.0000 172.4045 42 L 4.6210 8.2165 118.8052 55.1774 42.6417 176.7878 43 H 4.9916 9.2090 119.5430 53.7042 33.2485 173.2571 44 G 4.1661 9.2890 111.0362 47.1701 0.0000 172.5632 45 F 5.4746 8.8921 125.1056 57.2225 42.2668 172.8106 46 H 5.0789 8.9384 122.6538 54.1628 33.9844 172.7132 47 V 4.5910 8.4089 120.4404 61.9711 32.8413 175.0089 48 H 4.9892 9.5415 126.1250 54.7341 30.3568 176.0152 49 E 3.5838 9.1100 122.3696 59.1223 29.6992 177.1212 50 F 4.9626 8.1968 118.3393 54.9696 41.5272 176.7246 51 G 4.5759 8.4233 112.0017 44.4435 0.0000 173.9385 52 D 4.7141 7.9990 118.8548 52.6710 42.0537 174.5413 53 N 5.2095 8.7612 124.4483 52.6991 39.2531 175.6464 54 T 3.9292 8.6885 109.9152 63.3438 69.1595 174.3259 55 A 4.6903 7.8319 124.1431 50.9030 19.3644 175.2739 56 G 4.1868 7.6473 113.6728 46.2919 0.0000 174.5748 57 C 4.5676 8.5546 115.6790 58.7556 39.4182 175.7879 58 T 3.8657 7.6825 116.8493 66.3568 67.7486 175.7341 59 S 4.5679 7.8800 112.3046 59.1410 63.6032 175.2465 60 A 4.6227 7.4225 126.6702 54.2397 18.3359 178.7911 61 G 3.8337 7.9465 104.5697 44.2080 0.0000 170.6964 62 P 4.7047 0.0000 0.0000 61.9351 33.9906 175.0430 63 H 4.3883 8.4202 116.6082 55.6506 29.4932 175.5217 64 F 4.2411 9.0904 125.5761 58.4684 40.2235 174.6220 65 N 5.0156 8.1062 125.7245 51.2010 38.7804 172.7763 66 P 4.1447 0.0000 0.0000 65.2623 32.0094 178.0630 67 L 4.2316 7.6373 116.3690 53.8064 42.0265 176.4793 68 S 3.5726 7.4302 114.2102 59.9087 60.7112 170.8895 69 R 4.5747 8.5334 118.0004 54.3847 33.1555 176.2525 70 K 4.5435 8.5977 117.9930 55.5889 34.0683 176.3878 71 H 4.2854 8.6817 122.6999 56.7899 30.4652 174.7447 72 G 4.0255 7.9467 110.2656 45.4148 0.0000 172.3259 73 G 4.0938 9.3050 109.4451 43.5592 0.0000 173.1672 74 P 4.3281 0.0000 0.0000 65.6714 31.0576 177.7806 75 K 4.1906 7.9028 115.7275 57.5576 32.4446 176.7353 76 D 4.6236 7.7458 119.6412 53.4854 41.6334 176.3047 77 E 3.8836 8.7742 124.1159 58.9384 29.8745 176.5224 78 E 4.2011 7.8996 121.0241 55.6560 28.9896 174.8246 79 R 5.0266 7.5856 120.3804 56.7013 31.9431 173.8046 80 H 4.6224 9.1143 115.8936 54.8594 29.5763 177.2476 81 V 3.4628 8.1403 121.8455 65.9309 31.5657 177.1474 82 G 3.8898 8.1527 106.9245 45.7172 0.0000 173.0274 83 D 4.8600 7.8412 120.4385 54.1046 39.3962 175.6884 84 L 4.6605 8.4015 122.7536 53.9693 43.2379 178.4589 85 G 4.0376 7.8456 110.3970 46.8584 0.0000 175.1193 86 N 5.6626 8.7523 121.0503 51.2259 42.3355 172.7329 87 V 4.4613 8.5268 112.4100 59.8811 36.0109 174.8947 88 T 5.1034 8.3197 118.6897 61.8239 71.5173 172.8276 89 A 4.8827 8.8612 128.5567 50.4691 21.4994 177.0817 90 D 4.7152 8.8179 121.9990 51.8864 41.3472 177.2110 91 K 4.0938 8.5195 117.2924 59.6522 32.4205 177.1214 92 D 4.5685 8.4656 118.5327 53.9259 41.0490 177.0271 93 G 4.3490 8.5447 108.2748 44.9559 0.0000 172.7773 94 V 4.7521 7.8373 119.2457 60.7665 34.1040 174.2850 95 A 5.0489 9.2132 130.3038 49.8629 20.5595 175.2469 96 D 5.0309 8.5333 123.0691 53.4472 40.1137 175.5502 97 V 3.5202 8.1994 122.3428 63.0497 32.9331 174.7522 98 S 4.7748 8.4531 122.7489 57.5082 64.0804 172.6822 99 I 4.8495 9.1929 127.8528 59.4493 41.9231 174.1671 100 E 5.0663 8.8064 124.7598 54.6246 32.3337 174.1423 101 D 5.0389 9.3256 126.4924 52.4033 44.6362 175.8126 102 S 4.7558 8.8811 118.2787 58.1854 63.6959 174.4765 103 V 4.0630 8.2155 121.9358 64.6798 32.2019 176.5970 104 I 4.1268 7.7534 111.0984 60.8102 38.4615 174.3976 105 S 4.6833 8.3850 114.7381 57.4413 65.5047 173.9161 106 L 4.8025 8.5494 122.1896 53.8828 41.6730 176.5813 107 S 4.3709 7.8625 110.8344 58.7680 65.8422 175.9178 108 G 3.9214 8.3875 109.0243 44.8059 0.0000 174.0399 109 D 4.4550 8.4432 117.2219 57.3421 40.8703 177.3396 110 H 4.8644 8.1879 114.8558 55.6645 28.9428 174.7910 111 S 4.9442 8.2939 115.0988 58.1206 62.8123 173.9247 112 I 3.9157 8.0153 118.7220 60.3708 38.1010 175.4039 113 I 3.8135 7.1183 123.1654 63.0252 37.3693 176.4742 114 G 3.8096 9.4527 113.4691 45.4135 0.0000 172.7695 115 R 4.9906 7.4233 119.1371 54.6253 33.8743 174.3533 116 T 4.9667 7.9315 115.5177 62.0599 71.0979 173.7874 117 L 4.6526 8.6790 129.2831 54.3251 43.7581 175.5107 118 V 4.9848 8.9431 125.9513 60.9444 35.3456 174.1981 119 V 5.0999 8.6510 126.4906 60.4592 33.8630 174.9154 120 H 5.2710 9.1996 121.7650 54.4115 30.4426 175.1612 121 E 4.1746 9.1691 121.1910 59.1491 30.0329 176.4707 122 K 4.7564 8.5279 117.4710 53.8958 36.1095 175.3258 123 A 4.5613 8.3417 121.9090 52.2125 19.7693 176.0044 124 D 4.8890 9.5133 121.0500 53.0555 41.9257 176.1294 125 D 4.6280 9.2760 124.9929 52.9439 39.3524 176.5499 126 L 3.5205 9.9936 118.9629 56.1261 39.7890 175.6476 127 G 3.9209 8.7717 103.8994 46.3832 0.0000 174.8928 128 K 4.5508 8.0375 116.6740 55.8950 32.1757 177.6322 129 G 3.7060 8.0902 109.3243 45.1723 0.0000 176.4385 130 G 3.9283 8.3271 107.3331 45.4405 0.0000 172.3394 131 N 5.0597 7.1890 115.6473 50.0330 40.4826 174.9362 132 E 4.0312 8.6873 118.0269 59.3700 29.6114 177.8988 133 E 3.8887 8.2332 118.8868 59.4989 29.3935 178.4176 134 S 4.1304 9.3354 114.1801 61.6770 62.4005 175.7256 135 T 4.2412 7.8427 109.6521 62.6450 68.4837 175.4376 136 K 4.2884 7.6852 119.7208 57.8259 34.1335 176.7025 137 T 4.1029 8.1383 106.2408 60.0711 70.2263 175.3191 138 G 3.9450 7.9544 110.7513 45.3333 0.0000 173.4339 139 N 4.3307 7.7666 113.6911 54.0734 36.6621 175.2503 140 A 4.4111 6.9151 119.9333 52.3000 19.2668 179.6564 141 G 3.6020 7.9432 103.3762 44.1502 0.0000 173.0831 142 S 4.3862 8.4675 113.7227 58.6347 64.7149 174.0032 143 R 4.4557 8.3061 119.6602 54.8852 29.9398 176.5312 144 L 4.2712 8.5964 125.3895 57.4723 42.8164 177.3795 145 A 5.1721 7.7681 118.1139 51.1393 22.8311 173.9435 146 C 5.6874 8.8742 113.7304 55.2483 46.8489 172.9166 147 G 4.6972 8.0640 103.4479 45.9770 0.0000 172.7637 148 V 4.2503 8.3480 123.1898 62.4711 32.7187 175.5903 149 I 4.1086 8.9903 129.8271 61.1672 37.7810 175.3668 150 G 4.3899 8.8952 114.9899 43.9186 0.0000 171.9558 151 I 4.2191 8.2992 121.6036 61.4016 36.9670 175.8358 152 A 4.5877 9.1156 128.8584 52.9297 21.3261 176.5000 153 Q 4.0845 7.7630 120.7142 56.7726 29.0488 173.6118 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 A 8.25 4.34 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 2 T 8.33 4.54 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 1.24 0.00 0.00 3 K 8.24 5.30 0.00 1.82 1.75 0.00 1.77 0.00 0.00 1.92 0.00 0.00 2.94 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.53 1.52 7.81 4 A 9.27 5.35 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 5 V 8.72 5.06 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 0.74 0.00 0.00 0.93 0.00 0.00 6 A 9.04 4.99 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 7 V 8.41 4.42 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 0.97 0.00 0.00 0.92 0.00 0.00 8 L 8.95 4.78 0.00 1.68 1.59 1.04 0.57 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 9 K 9.11 4.86 0.00 1.63 1.62 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 7.97 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 0.00 0.00 0.00 0.00 11 D 8.85 4.55 0.00 2.68 2.73 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 12 G 7.61 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 13 P 0.00 4.36 0.00 2.19 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 2.09 1.94 0.00 14 V 7.85 4.36 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 1.06 0.00 0.00 0.97 0.00 0.00 15 Q 7.39 5.29 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.62 0.00 0.00 0.00 0.00 0.00 2.42 2.19 0.00 16 G 7.72 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 0.00 0.00 0.00 0.00 17 I 7.83 5.09 1.77 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 1.18 0.99 0.76 0.00 0.00 18 I 8.65 4.45 1.82 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 1.24 1.17 0.48 0.00 0.00 19 N 8.30 5.07 0.00 1.44 2.25 0.00 0.00 6.38 8.16 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 20 F 9.02 5.36 0.00 2.90 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 21 E 9.43 5.09 0.00 2.21 1.90 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 2.28 2.34 0.00 22 Q 9.26 4.58 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 23 K 8.98 4.16 0.00 1.81 1.88 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.48 1.50 7.81 24 E 7.92 4.68 0.00 2.07 1.86 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 2.33 2.28 0.00 25 S 8.88 4.18 0.00 3.98 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 26 N 8.06 4.95 0.00 2.80 2.88 0.00 0.00 5.95 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 27 G 8.06 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 0.00 0.00 0.00 28 P 0.00 4.59 0.00 2.13 2.10 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 29 V 9.03 4.58 2.31 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 1.28 0.00 0.00 1.06 0.00 0.00 30 K 9.17 4.81 0.00 1.88 1.84 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.45 7.81 31 V 9.42 4.87 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 0.76 0.00 0.00 1.07 0.00 0.00 32 W 8.31 6.22 0.00 3.46 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 33 G 7.71 3.57 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 0.00 34 S 7.57 5.09 0.00 3.88 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.56 5.13 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.78 0.95 0.00 0.00 36 K 8.76 4.73 0.00 1.77 1.88 0.00 1.37 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.34 7.81 37 G 8.82 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.53 4.48 0.00 1.81 1.40 0.81 0.44 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 39 T 8.18 4.36 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 1.25 0.00 0.00 40 E 8.65 4.09 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 2.48 0.00 41 G 8.74 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 42 L 8.22 4.62 0.00 1.51 1.60 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.21 4.99 0.00 3.02 3.28 0.00 5.64 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 44 G 9.29 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 45 F 8.89 5.47 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 46 H 8.94 5.08 0.00 3.10 3.04 0.00 5.84 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.41 4.59 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 0.91 0.00 0.00 0.85 0.00 0.00 48 H 9.54 4.99 0.00 3.07 3.42 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 9.11 3.58 0.00 1.61 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 2.06 0.00 50 F 8.20 4.96 0.00 3.10 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 51 G 8.42 4.58 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 0.00 0.00 0.00 52 D 8.00 4.71 0.00 2.63 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 53 N 8.76 5.21 0.00 2.69 2.73 0.00 0.00 7.37 7.70 0.00 0.00 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 T 8.69 3.93 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 1.26 0.00 0.00 55 A 7.83 4.69 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 56 G 7.65 4.19 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 57 C 8.55 4.57 0.00 2.98 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 58 T 7.68 3.87 4.40 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 1.23 0.00 0.00 59 S 7.88 4.57 0.00 4.02 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.42 4.62 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 61 G 7.95 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 62 P 0.00 4.70 0.00 2.05 2.21 0.00 3.75 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 1.98 2.00 0.00 63 H 8.42 4.39 0.00 2.91 3.25 0.00 5.73 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 F 9.09 4.24 0.00 2.95 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 65 N 8.11 5.02 0.00 2.53 2.41 0.00 0.00 6.91 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 66 P 0.00 4.14 0.00 2.06 1.90 0.00 3.03 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 1.50 1.16 0.00 67 L 7.64 4.23 0.00 1.55 1.67 0.86 0.93 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 68 S 7.43 3.57 0.00 3.94 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 69 R 8.53 4.57 0.00 1.86 1.98 0.00 3.10 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 70 K 8.60 4.54 0.00 1.79 1.70 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.37 7.81 71 H 8.68 4.29 0.00 3.09 3.25 0.00 5.97 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 72 G 7.95 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 73 G 9.30 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 0.00 0.00 0.00 0.00 74 P 0.00 4.33 0.00 2.22 2.36 0.00 3.79 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 2.02 2.05 0.00 75 K 7.90 4.19 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.75 4.62 0.00 2.76 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 77 E 8.77 3.88 0.00 1.91 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 2.28 2.23 0.00 78 E 7.90 4.20 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 2.24 2.31 0.00 79 R 7.59 5.03 0.00 1.96 1.77 0.00 2.69 0.00 0.00 3.84 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 80 H 9.11 4.62 0.00 3.48 3.38 0.00 5.64 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 81 V 8.14 3.46 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 0.73 0.00 0.00 0.47 0.00 0.00 82 G 8.15 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 83 D 7.84 4.86 0.00 2.77 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 84 L 8.40 4.66 0.00 2.02 1.98 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.85 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 0.00 0.00 0.00 86 N 8.75 5.66 0.00 2.59 2.71 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 87 V 8.53 4.46 1.76 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 -0.29 0.00 0.00 0.75 0.00 0.00 88 T 8.32 5.10 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 1.20 0.00 0.00 89 A 8.86 4.88 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 90 D 8.82 4.72 0.00 2.85 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 91 K 8.52 4.09 0.00 1.88 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.47 7.81 92 D 8.47 4.57 0.00 2.83 2.73 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 93 G 8.54 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 0.00 0.00 0.00 0.00 94 V 7.84 4.75 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 1.09 0.00 0.00 0.92 0.00 0.00 95 A 9.21 5.05 1.15 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 0.00 0.00 96 D 8.53 5.03 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 97 V 8.20 3.52 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 0.71 0.00 0.00 0.58 0.00 0.00 98 S 8.45 4.77 0.00 3.89 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 99 I 9.19 4.85 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.80 1.01 0.00 0.00 100 E 8.81 5.07 0.00 1.96 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 2.22 2.32 0.00 101 D 9.33 5.04 0.00 2.80 2.53 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 0.00 102 S 8.88 4.76 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 0.00 103 V 8.22 4.06 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.94 0.00 0.00 104 I 7.75 4.13 1.91 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.80 1.03 0.00 0.00 105 S 8.39 4.68 0.00 3.84 3.80 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 0.00 106 L 8.55 4.80 0.00 1.88 1.62 1.00 0.91 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 0.00 107 S 7.86 4.37 0.00 3.91 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 0.00 108 G 8.39 3.92 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 0.00 0.00 0.00 109 D 8.44 4.46 0.00 2.72 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 0.00 110 H 8.19 4.86 0.00 3.22 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.29 4.94 0.00 4.03 3.80 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 0.00 112 I 8.02 3.92 1.58 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.10 0.90 0.00 0.00 113 I 7.12 3.81 1.79 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.75 0.85 0.00 0.00 114 G 9.45 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 0.00 0.00 0.00 115 R 7.42 4.99 0.00 1.62 1.84 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.20 0.00 116 T 7.93 4.97 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 1.17 0.00 0.00 117 L 8.68 4.65 0.00 1.76 1.52 0.41 0.75 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 0.00 118 V 8.94 4.98 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 0.76 0.00 0.00 0.74 0.00 0.00 119 V 8.65 5.10 2.31 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 0.71 0.00 0.00 1.03 0.00 0.00 120 H 9.20 5.27 0.00 3.17 3.57 0.00 5.66 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 0.00 121 E 9.17 4.17 0.00 2.03 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 2.36 2.33 0.00 122 K 8.53 4.76 0.00 1.76 1.70 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.38 7.81 123 A 8.34 4.56 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 0.00 124 D 9.51 4.89 0.00 2.77 2.77 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 0.00 125 D 9.28 4.63 0.00 2.88 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 9.99 3.52 0.00 1.82 1.76 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.77 3.92 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 0.00 0.00 0.00 128 K 8.04 4.55 0.00 1.84 1.79 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.52 7.81 129 G 8.09 3.71 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 0.00 0.00 0.00 130 G 8.33 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 0.00 0.00 0.00 131 N 7.19 5.06 0.00 2.60 2.80 0.00 0.00 6.83 7.54 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 0.00 132 E 8.69 4.03 0.00 2.05 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 0.00 133 E 8.23 3.89 0.00 2.11 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 2.42 2.43 0.00 134 S 9.34 4.13 0.00 4.03 4.01 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 0.00 135 T 7.84 4.24 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 0.00 136 K 7.69 4.29 0.00 1.81 1.81 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.32 1.55 7.81 137 T 8.14 4.10 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 1.18 0.00 0.00 138 G 7.95 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 0.00 139 N 7.77 4.33 0.00 2.88 2.91 0.00 0.00 6.86 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 0.00 140 A 6.92 4.41 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.94 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 0.00 142 S 8.47 4.39 0.00 3.95 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 0.00 143 R 8.31 4.46 0.00 1.67 1.84 0.00 3.26 0.00 0.00 3.13 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 144 L 8.60 4.27 0.00 1.62 1.71 0.99 0.88 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 0.00 145 A 7.77 5.17 1.21 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 0.00 146 C 8.87 5.69 0.00 2.93 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 0.00 147 G 8.06 4.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.35 4.25 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 0.96 0.00 0.00 149 I 8.99 4.11 1.83 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 1.04 0.36 0.48 0.00 0.00 150 G 8.90 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 0.00 151 I 8.30 4.22 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.55 0.94 0.00 0.00 152 A 9.12 4.59 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 0.00 153 Q 7.76 4.08 0.00 2.09 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00