NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.2776 0.0000 0.0000 61.6956 32.7489 174.9247 3 K 3.7759 8.4672 118.5053 56.0200 32.1270 175.7649 4 K 3.9828 8.6124 126.4030 57.2020 33.8512 175.2866 5 V 5.5398 8.0878 123.5375 60.2492 34.9506 174.2885 6 L 4.8587 8.2958 126.2719 52.9556 45.4136 175.4518 7 T 4.6281 8.6306 114.6524 61.3819 69.8547 174.1259 8 G 4.1541 9.0720 111.9892 45.4730 0.0000 171.9688 9 V 4.8306 8.2451 113.8791 59.2496 34.2460 176.3340 10 V 4.2289 8.2928 124.4840 63.5140 32.5527 177.2066 11 V 4.3823 8.2972 121.5040 62.2516 34.8206 174.2322 12 S 4.3385 7.8868 114.9259 58.1833 64.0034 174.0477 13 D 5.0050 8.4071 126.5630 53.1797 39.5142 177.6567 14 K 4.4563 8.0320 116.6333 57.4145 31.9972 176.2265 15 M 4.7342 7.2998 117.2689 53.2203 34.5918 175.4646 16 Q 4.1483 8.4617 119.5451 56.2989 29.2035 176.5466 17 K 4.7638 8.6822 120.4564 56.4177 30.4203 174.9119 18 T 5.2527 7.3620 112.7138 62.5798 73.0338 173.9318 19 V 4.7238 8.5340 116.2527 60.4837 36.8643 173.8120 20 T 4.8049 8.9336 122.1927 62.7066 70.1804 173.8736 21 V 4.7730 9.1227 126.3705 60.9340 34.6708 173.7140 22 L 5.0273 8.8979 130.2435 53.7428 43.9902 175.3437 23 V 4.7626 8.5011 118.5616 59.6676 35.1075 174.1960 24 E 5.0638 8.9448 125.3390 54.7854 30.9446 175.6022 25 R 4.9904 8.9028 120.7212 54.3540 32.9016 174.6188 26 Q 5.0457 8.3616 117.4870 54.8574 31.9656 174.0073 27 F 4.8326 8.1041 113.5580 55.5599 41.6399 171.3270 28 P 5.0623 0.0000 0.0000 61.9471 32.1557 175.9686 29 H 4.2927 9.0266 124.8466 55.6989 30.5060 174.3193 30 P 4.4832 0.0000 0.0000 64.5545 31.3003 176.1575 31 L 4.4083 7.8029 117.1209 56.4280 45.9373 175.9450 32 Y 4.5942 8.0176 113.3617 56.9259 38.8601 178.1253 33 G 4.2942 8.3827 110.3876 46.2999 0.0000 174.1398 34 K 4.0219 8.2348 121.0580 56.8817 33.5021 176.4432 35 V 4.2790 8.3599 126.0169 62.6176 31.6805 175.1427 36 I 4.3342 8.1559 122.3612 59.2310 40.3977 174.9341 37 K 4.5875 8.4021 123.8737 55.2215 34.4462 174.9164 38 R 4.9532 8.1944 127.4312 54.9823 33.9509 174.5907 39 S 4.9716 8.3492 112.9811 58.4893 65.8532 173.8785 40 K 4.6168 8.6341 119.8077 55.1781 35.8568 174.2997 41 K 5.0683 8.3789 124.4051 55.1949 33.7499 175.4319 42 Y 4.6563 9.1222 122.2391 56.0682 41.5900 174.5294 43 L 4.9787 8.6267 122.2476 53.5293 43.2552 175.6664 44 A 5.0480 9.0573 126.3384 50.1235 21.6282 174.8763 45 H 4.6719 9.1459 123.0133 56.3412 31.2162 174.0085 46 D 4.9912 8.9154 125.7228 51.5457 41.2310 173.7241 47 P 4.3122 0.0000 0.0000 64.6100 31.8252 178.2695 48 E 4.1174 8.3514 118.1473 56.6157 29.9916 177.2752 49 E 4.0947 8.4742 115.4066 56.9137 26.8800 175.5207 50 K 3.8834 7.4871 120.5650 59.1942 32.8398 176.6078 51 Y 4.3041 8.0512 118.2428 56.5657 37.7388 175.3223 52 K 4.4536 8.1915 125.8017 55.0202 35.1056 175.7186 53 L 4.0557 8.1910 120.3800 56.6249 42.2977 177.6582 54 G 3.8847 8.2425 111.5280 45.5469 0.0000 173.1676 55 D 4.7211 7.5727 119.7625 53.6180 41.9200 176.0472 56 V 4.0503 8.3794 125.4598 63.2794 32.5277 175.3728 57 V 5.1077 9.1781 120.8011 59.7213 36.3995 174.0890 58 E 5.1222 8.4183 120.4004 54.9064 32.2753 175.7795 59 I 5.1076 8.3898 122.7246 59.5986 41.7821 174.2324 60 I 5.1825 8.4222 122.8067 58.9364 41.6502 173.9175 61 E 2.8919 8.8601 130.3193 56.9532 29.8167 176.0128 62 S 4.6383 7.7889 121.5587 56.3394 67.7795 173.7198 63 R 3.8022 8.5394 120.4721 56.0280 30.0592 174.1339 64 P 4.2572 0.0000 0.0000 63.2850 31.6478 176.0238 65 I 4.0727 8.3315 125.0008 62.9324 37.8184 175.6561 66 S 4.5579 7.5193 110.9721 56.5494 65.5733 173.0104 67 K 3.7518 8.5232 120.4047 59.4771 32.2684 177.0424 68 R 4.4688 7.1670 117.5795 53.4442 29.5085 177.4460 69 K 4.3644 7.0756 115.0844 56.3158 34.1801 174.4654 70 R 4.7825 8.2895 130.1604 55.0694 30.7965 174.7151 71 F 5.2465 8.1386 115.3264 56.4352 44.4910 174.6367 72 R 5.0257 8.5690 118.5873 54.3013 34.5287 175.2647 73 V 3.8553 7.9372 119.9932 63.3497 31.8793 174.4684 74 L 4.6825 8.1816 125.9895 55.0021 43.4602 176.3598 75 R 4.8577 7.1867 111.6681 55.6446 31.9327 173.2145 76 L 4.3361 9.1464 123.2554 55.7719 42.5653 176.2976 77 V 4.4569 8.3174 121.5280 64.0105 33.9989 175.5564 78 E 4.4192 7.6742 114.1382 55.9839 31.6214 175.8792 79 S 4.2273 9.1841 117.0987 60.2685 63.2008 173.9863 80 G 3.7447 7.7278 118.4937 46.7103 0.0000 173.8634 81 R 4.8416 7.9666 127.0168 54.5495 31.6747 177.7979 82 M 4.1768 8.3636 120.7130 58.1170 31.8990 177.5421 83 D 4.4067 8.1541 119.3221 56.5716 39.0958 178.6551 84 L 4.1296 7.8086 120.1721 57.4828 41.6193 179.4802 85 V 3.6630 7.8118 117.6744 65.7147 31.3143 177.7161 86 E 3.9586 8.2228 118.5874 59.5373 29.2750 179.1543 87 K 3.5685 7.7379 117.6693 59.8186 32.2051 178.7983 88 Y 4.0025 7.8216 119.2651 60.8019 38.8594 177.7466 89 L 3.8999 8.3665 120.2640 57.7227 41.7770 179.6539 90 I 3.6328 8.6373 120.9752 64.1561 36.7804 178.2873 91 R 3.5915 7.2350 118.7221 59.3299 30.2372 178.4353 92 R 3.6116 7.2440 117.2454 59.3382 29.6496 178.9721 93 Q 3.9847 7.8155 117.6596 59.1762 28.6559 178.9378 94 N 4.3986 7.8938 117.1219 56.3773 38.2722 176.9326 95 Y 4.4681 7.5133 117.8820 61.3027 37.7226 178.5243 96 Q 4.0958 7.7973 118.4697 57.9439 29.4558 176.6440 97 S 4.9046 7.9253 114.7102 58.0875 63.5463 174.9922 98 L 4.6720 7.8114 119.6805 56.5406 44.8642 178.0470 99 S 4.4957 7.2584 112.6729 57.5647 64.6872 174.3495 100 K 4.1754 8.4916 119.3061 57.1646 32.3451 175.8217 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 P 0.00 4.28 0.00 2.05 2.09 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.10 0.00 3 K 8.47 3.78 0.00 1.69 1.87 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.47 7.81 4 K 8.61 3.98 0.00 1.97 1.77 0.00 1.46 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.49 7.81 5 V 8.09 5.54 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 0.79 0.00 0.00 1.01 0.00 0.00 6 L 8.30 4.86 0.00 1.32 1.32 0.14 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.63 4.63 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 1.19 0.00 0.00 8 G 9.07 4.15 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 0.00 9 V 8.25 4.83 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 0.63 0.00 0.00 0.89 0.00 0.00 10 V 8.29 4.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.06 0.00 0.00 11 V 8.30 4.38 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.21 0.00 0.00 12 S 7.89 4.34 0.00 3.85 3.70 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 13 D 8.41 5.00 0.00 2.87 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 14 K 8.03 4.46 0.00 1.77 1.89 0.00 1.50 0.00 0.00 1.73 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.53 7.81 15 M 7.30 4.73 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 16 Q 8.46 4.15 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.36 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 17 K 8.68 4.76 0.00 2.03 1.83 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.36 7.81 18 T 7.36 5.25 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 19 V 8.53 4.72 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 0.72 0.00 0.00 0.96 0.00 0.00 20 T 8.93 4.80 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 1.13 0.00 0.00 21 V 9.12 4.77 2.03 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 0.92 0.00 0.00 0.86 0.00 0.00 22 L 8.90 5.03 0.00 1.58 1.41 1.01 0.84 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 23 V 8.50 4.76 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 0.87 0.00 0.00 1.12 0.00 0.00 24 E 8.94 5.06 0.00 1.87 1.91 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 2.28 2.31 0.00 25 R 8.90 4.99 0.00 1.97 2.06 0.00 2.78 0.00 0.00 3.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 26 Q 8.36 5.05 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.88 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 27 F 8.10 4.83 0.00 3.17 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 5.06 0.00 2.05 2.20 0.00 3.96 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 29 H 9.03 4.29 0.00 3.33 3.31 0.00 5.60 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.48 0.00 2.17 2.17 0.00 3.49 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 1.78 1.95 0.00 31 L 7.80 4.41 0.00 1.31 1.32 0.68 0.42 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 32 Y 8.02 4.59 0.00 2.96 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 33 G 8.38 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 0.00 0.00 0.00 0.00 34 K 8.23 4.02 0.00 1.81 1.72 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.40 7.81 35 V 8.36 4.28 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 0.83 0.00 0.00 0.93 0.00 0.00 36 I 8.16 4.33 1.70 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 0.53 -0.29 0.84 0.00 0.00 37 K 8.40 4.59 0.00 1.71 1.71 0.00 1.74 0.00 0.00 1.91 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.45 7.81 38 R 8.19 4.95 0.00 1.95 1.92 0.00 3.27 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 39 S 8.35 4.97 0.00 3.99 3.86 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 40 K 8.63 4.62 0.00 1.74 1.63 0.00 0.61 0.00 0.00 0.97 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.92 1.22 7.81 41 K 8.38 5.07 0.00 1.60 1.65 0.00 1.68 0.00 0.00 1.91 0.00 0.00 2.78 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.47 7.81 42 Y 9.12 4.66 0.00 2.58 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.63 4.98 0.00 1.70 1.66 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 44 A 9.06 5.05 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 45 H 9.15 4.67 0.00 3.30 3.24 0.00 5.73 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 46 D 8.92 4.99 0.00 2.75 2.49 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 47 P 0.00 4.31 0.00 2.23 2.20 0.00 3.78 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 48 E 8.35 4.12 0.00 2.06 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 2.37 2.35 0.00 49 E 8.47 4.09 0.00 2.13 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 2.22 2.40 0.00 50 K 7.49 3.88 0.00 1.62 1.78 0.00 1.63 0.00 0.00 1.50 0.00 0.00 2.23 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.26 0.29 7.81 51 Y 8.05 4.30 0.00 3.23 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 52 K 8.19 4.45 0.00 1.91 1.98 0.00 1.59 0.00 0.00 1.77 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.64 1.37 7.81 53 L 8.19 4.06 0.00 1.85 1.62 0.91 1.02 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 54 G 8.24 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 55 D 7.57 4.72 0.00 2.96 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 56 V 8.38 4.05 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 1.00 0.00 0.00 0.93 0.00 0.00 57 V 9.18 5.11 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 0.75 0.00 0.00 0.87 0.00 0.00 58 E 8.42 5.12 0.00 1.80 1.78 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 2.19 2.23 0.00 59 I 8.39 5.11 1.66 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.58 0.99 0.00 0.00 60 I 8.42 5.18 1.88 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 1.07 1.62 0.97 0.00 0.00 61 E 8.86 2.89 0.00 1.87 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 2.09 1.93 0.00 62 S 7.79 4.64 0.00 3.66 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.54 3.80 0.00 1.72 1.80 0.00 3.21 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 64 P 0.00 4.26 0.00 2.06 1.99 0.00 3.68 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 65 I 8.33 4.07 1.88 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 1.44 0.78 0.82 0.00 0.00 66 S 7.52 4.56 0.00 3.93 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 67 K 8.52 3.75 0.00 1.74 1.89 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.47 7.81 68 R 7.17 4.47 0.00 1.79 1.84 0.00 3.32 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 69 K 7.08 4.36 0.00 1.82 1.68 0.00 1.77 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.58 7.81 70 R 8.29 4.78 0.00 1.84 1.66 0.00 3.26 0.00 0.00 3.39 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 71 F 8.14 5.25 0.00 3.07 2.85 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 72 R 8.57 5.03 0.00 1.68 1.79 0.00 3.17 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 73 V 7.94 3.86 1.77 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 -0.52 0.00 0.00 0.77 0.00 0.00 74 L 8.18 4.68 0.00 1.69 1.64 0.93 1.20 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 75 R 7.19 4.86 0.00 1.94 2.02 0.00 3.22 0.00 0.00 3.25 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.39 0.00 76 L 9.15 4.34 0.00 1.89 1.71 1.16 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.32 4.46 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.95 0.00 0.00 78 E 7.67 4.42 0.00 2.03 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 2.20 2.24 0.00 79 S 9.18 4.23 0.00 3.86 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 80 G 7.73 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.97 4.84 0.00 2.12 1.87 0.00 3.78 0.00 0.00 3.30 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 82 M 8.36 4.18 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.15 4.41 0.00 2.87 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.81 4.13 0.00 1.80 1.76 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.81 3.66 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 1.21 0.00 0.00 0.98 0.00 0.00 86 E 8.22 3.96 0.00 2.28 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 2.58 2.51 0.00 87 K 7.74 3.57 0.00 1.96 1.90 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.68 1.63 7.81 88 Y 7.82 4.00 0.00 3.07 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 89 L 8.37 3.90 0.00 1.82 1.70 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.64 3.63 1.80 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 1.58 1.39 0.85 0.00 0.00 91 R 7.23 3.59 0.00 1.75 1.61 0.00 3.23 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.48 0.00 92 R 7.24 3.61 0.00 1.86 1.81 0.00 3.28 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.43 0.00 93 Q 7.82 3.98 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 94 N 7.89 4.40 0.00 2.75 2.81 0.00 0.00 6.97 6.98 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 95 Y 7.51 4.47 0.00 3.16 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 96 Q 7.80 4.10 0.00 2.11 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.45 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 97 S 7.93 4.90 0.00 4.02 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 98 L 7.81 4.67 0.00 1.72 1.70 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.26 4.50 0.00 4.00 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 0.00 100 K 8.49 4.18 0.00 1.72 1.70 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.32 7.81