NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4166 8.2893 120.3268 55.1696 33.7015 174.8749 2 D 4.5258 8.1293 119.5630 52.2511 41.9399 175.2975 3 L 4.0546 9.0825 122.0648 58.3412 42.5269 180.0139 4 T 3.8743 7.8799 115.5029 66.6962 68.4109 176.3141 5 S 4.1344 8.7864 115.4296 61.2022 62.4038 176.3760 6 K 4.0176 7.7108 120.6421 59.2644 31.7478 179.5712 7 V 3.5798 7.8819 118.7238 65.8577 31.3468 177.8652 8 N 4.2737 8.0998 116.3062 56.3848 37.9854 177.2763 9 R 3.8396 7.9543 120.0145 59.1531 30.0070 178.4476 10 L 3.9102 7.6042 119.7008 58.2218 42.2218 178.9946 11 L 3.9061 8.4171 118.8210 57.4483 41.4650 179.4669 12 A 4.0057 8.2751 121.4463 55.0499 17.8211 179.2541 13 E 3.9905 7.9958 117.2568 58.9045 29.6506 178.8610 14 F 4.2637 8.2038 120.9529 61.2101 39.5036 176.9551 15 A 3.9323 8.3387 120.6710 55.1465 17.9253 179.8874 16 G 3.6759 7.7289 102.8011 47.7419 0.0000 175.8743 17 R 4.1192 7.2736 119.0988 58.8101 30.3396 178.5591 18 I 3.9408 7.1814 111.7492 61.8001 37.8620 176.4419 19 G 4.1965 7.9992 109.4762 45.7288 0.0000 173.0666 20 L 4.6954 7.8830 119.4285 51.6588 43.7097 175.3628 21 P 4.3973 0.0000 0.0000 65.8054 31.4261 176.6376 22 S 4.5664 7.5328 111.3321 57.2575 66.6553 173.8762 23 L 4.3766 8.1077 124.3527 54.4137 43.6730 174.7515 24 S 4.7273 8.2478 119.7715 56.2208 66.1319 173.7023 25 L 4.3443 8.5417 122.8752 54.6143 42.3212 178.1958 26 D 4.7236 8.7058 123.1432 52.8909 41.1335 176.3443 27 E 3.9276 8.8476 117.0049 59.7985 29.5189 177.5443 28 E 4.3947 8.3752 115.6458 55.5176 29.9785 175.7909 29 G 3.9196 8.2110 107.2197 47.3832 0.0000 173.4695 30 M 6.0360 9.2800 117.4060 52.2736 35.9955 175.5815 31 A 5.0946 8.4561 122.0499 50.4469 23.3998 174.6867 32 S 5.1174 8.5497 112.6504 56.7844 65.7776 173.0491 33 L 4.8725 9.4267 124.9601 52.8976 46.4855 175.1732 34 L 4.9824 8.0052 121.6505 53.5583 44.7910 175.3225 35 F 4.6144 9.5367 126.1718 56.4581 40.9115 176.0905 36 D 4.1832 9.4429 122.2752 55.0732 38.3017 173.1838 37 E 3.9291 8.4915 114.4360 57.5793 27.2310 175.2870 38 Q 4.2825 8.2674 114.9613 57.0645 31.6241 175.6752 39 V 4.1783 7.8359 119.4639 61.5488 33.0818 174.0893 40 G 4.4607 8.6793 115.7193 44.9220 0.0000 172.0656 41 V 5.2079 9.0768 124.5035 61.1157 34.9593 174.1791 42 T 5.1496 8.9082 117.5839 59.9453 71.9196 172.7602 43 L 5.2844 9.1426 124.3897 53.1913 44.3118 175.2800 44 L 5.1634 8.8799 123.7139 52.8417 44.6815 175.1237 45 L 4.6748 8.6100 126.9238 53.9433 43.4619 176.2131 46 L 4.6353 8.7386 126.9482 52.6768 41.9795 177.0216 47 A 4.0749 8.6053 127.5897 54.6257 18.9629 179.0364 48 E 4.0774 8.3150 113.4171 59.3444 29.7853 178.0623 49 R 4.3019 7.9649 114.8811 54.6440 31.2643 175.7500 50 E 3.8481 7.9834 117.9818 56.9388 27.6250 173.7549 51 R 5.1448 7.2756 113.1968 54.6492 34.1381 174.9024 52 L 5.1150 9.0059 122.7220 53.4232 44.7297 174.8505 53 L 5.0828 9.1003 126.6637 53.2185 44.2453 175.2802 54 L 5.0873 9.4506 124.4929 53.0786 44.3168 175.1516 55 E 5.1259 9.1310 123.7630 54.5330 32.2462 174.7865 56 A 5.0782 8.4666 127.0754 49.9830 21.6622 175.0487 57 D 4.2808 8.8876 123.9323 54.2146 40.5089 176.5611 58 V 3.9863 8.9618 126.7838 64.1323 31.0748 175.9525 59 V 4.5825 7.3900 117.5885 59.9751 35.3824 174.4149 60 G 4.1200 8.5779 110.6292 45.0988 0.0000 173.8501 61 I 4.0417 8.5241 120.7359 63.4479 38.2359 177.9338 62 D 4.5426 8.2410 118.8035 55.1053 39.4583 176.9936 63 V 4.1866 7.6442 118.1300 61.6078 32.8047 175.6389 64 L 4.2480 7.4914 120.9218 54.2161 42.1207 176.9809 65 G 3.9618 8.2028 111.3191 44.3318 0.0000 173.1201 66 E 4.1345 8.3172 118.9398 57.2389 29.9886 177.7499 67 G 4.0413 8.9825 109.8145 45.6268 0.0000 175.4671 68 I 3.7435 7.6387 121.0995 64.1345 37.3278 177.9119 69 F 3.9700 8.0038 118.0706 60.5058 38.5346 177.5578 70 R 3.9723 8.0056 118.0046 59.4596 30.0813 178.4117 71 Q 4.0937 7.5683 117.9673 58.7003 28.8407 178.4794 72 L 3.6612 7.9316 120.0363 57.3258 41.0001 179.3230 73 A 4.1411 8.0646 121.0482 55.2396 18.1019 179.8781 74 S 4.2226 7.8368 112.8088 61.4429 63.0397 176.4660 75 F 4.3662 8.1874 123.1350 61.5633 39.0328 176.9068 76 N 4.5982 8.2719 114.3334 56.5149 38.3618 176.8812 77 R 4.1903 7.7327 118.5792 58.6230 30.3595 176.3922 78 H 4.9781 8.3908 116.6394 54.7937 29.7889 176.1350 79 W 4.1431 8.8375 119.2145 59.5223 28.3133 177.5474 80 H 3.2915 6.6286 113.2328 57.3935 27.6824 176.1906 81 R 3.8192 6.9504 117.8700 57.4403 29.9576 176.8625 82 F 4.7578 7.7765 113.5886 55.6899 41.5408 174.2704 83 D 4.5955 8.3339 118.6424 55.0814 38.0791 173.2170 84 L 5.6309 8.4374 116.3065 52.5573 45.8437 175.8300 85 H 5.4311 8.6397 116.6895 54.1083 32.1791 172.6408 86 F 4.6587 9.7596 120.1264 57.7174 40.1242 174.7352 87 G 4.6528 8.9456 107.4697 45.6959 0.0000 171.1289 88 F 5.4019 8.9232 120.8127 56.3553 43.1902 173.9435 89 D 4.5309 6.7050 122.2829 52.2074 42.4936 175.9164 90 E 4.2395 8.9983 125.9959 59.5815 29.9084 179.1746 91 L 4.1363 8.0659 117.1651 58.0962 41.7900 178.6723 92 T 3.9826 7.7728 106.6692 62.1805 69.6602 174.3178 93 G 3.7054 8.4170 110.6895 46.7401 0.0000 173.2569 94 K 4.9848 7.1552 117.6840 53.7580 35.8518 176.9421 95 V 4.1517 8.8314 126.1752 63.3852 32.7395 174.8372 96 Q 5.0091 9.3352 125.9636 54.0113 32.8435 174.1580 97 L 4.3897 8.1355 121.3729 52.9572 44.6515 175.0594 98 Y 5.3298 7.9654 119.5965 56.2097 41.1323 174.6678 99 A 5.1823 9.1043 124.4570 50.3228 23.0213 174.7811 100 Q 5.0941 8.6588 116.5827 54.7148 32.4975 174.3996 101 I 4.6706 8.6937 120.4500 59.4438 41.1704 175.4415 102 L 4.3694 8.6777 126.7219 54.2739 41.9466 178.0596 103 A 4.0309 8.7698 124.5911 55.1446 18.5507 180.1554 104 A 4.0895 8.0259 117.8825 54.6894 18.6103 178.0917 105 Q 4.3775 7.7717 112.4385 55.8984 29.4376 176.5957 106 L 4.2299 7.2710 119.8471 54.9068 40.2287 175.2504 107 T 4.7601 7.7910 114.8228 58.6202 72.4327 175.3109 108 L 3.9293 8.5031 121.3246 58.4795 42.1725 178.0737 109 E 3.9956 8.2809 118.8246 59.6806 29.4119 178.2574 110 C 4.1506 8.0930 118.2299 62.2209 31.5455 175.2630 111 F 4.0090 8.2605 122.2763 61.5403 39.1057 177.1156 112 E 3.9319 8.5303 117.8034 59.0685 29.2400 179.3727 113 A 3.9952 7.9557 121.0054 55.4069 18.5233 179.8526 114 T 3.7690 8.0562 114.6148 66.4096 68.3774 176.8244 115 L 3.6012 7.8497 122.3713 58.1108 42.1808 178.7763 116 A 3.8458 7.8347 120.6461 55.2201 18.0774 179.1681 117 N 4.2683 8.0609 115.4347 56.6372 38.9576 176.9475 118 L 3.9203 7.8529 121.8136 58.1680 42.1049 179.0079 119 L 3.8875 8.0993 119.2664 57.6556 41.3426 179.0578 120 D 4.3344 7.9950 118.8859 57.8351 40.7966 178.7525 121 H 4.2388 8.1434 116.1391 58.5451 28.7632 177.4604 122 A 4.1191 8.3380 122.9949 55.6265 18.0083 179.6667 123 E 3.9491 8.2517 115.5434 59.2534 29.7332 179.0994 124 F 4.1286 7.9243 120.9691 61.2895 39.3982 177.3270 125 W 4.0244 8.4942 118.4468 59.6721 28.6848 178.3355 126 Q 3.9886 8.3722 118.6561 58.3312 28.5091 177.3221 127 R 4.3080 7.5034 117.2874 56.0746 30.6661 175.7235 128 L 4.2998 7.1426 117.7514 57.0105 44.0234 176.9357 129 L 4.1137 8.1558 117.6424 57.3002 41.6859 176.3946 130 P 4.4084 0.0000 0.0000 63.3316 31.6002 175.7478 131 C 4.5034 7.9671 113.7120 58.2848 31.0956 174.4556 132 A 4.0250 7.8880 123.5856 52.9632 18.6691 177.2878 133 S 4.0319 8.6626 114.7353 58.8957 64.4645 172.2676 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 M 8.29 4.42 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 2 D 8.13 4.53 0.00 2.98 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 9.08 4.05 0.00 1.78 1.70 0.93 0.74 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 4 T 7.88 3.87 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 5 S 8.79 4.13 0.00 3.94 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 6 K 7.71 4.02 0.00 2.11 1.83 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.64 7.81 7 V 7.88 3.58 2.18 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 0.98 0.00 0.00 0.97 0.00 0.00 8 N 8.10 4.27 0.00 2.93 2.84 0.00 0.00 6.64 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 9 R 7.95 3.84 0.00 1.93 2.10 0.00 3.13 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 10 L 7.60 3.91 0.00 1.83 1.66 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.42 3.91 0.00 1.72 1.69 0.89 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.28 4.01 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 13 E 8.00 3.99 0.00 2.08 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 2.35 2.33 0.00 14 F 8.20 4.26 0.00 3.06 3.16 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 15 A 8.34 3.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.73 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 0.00 0.00 0.00 17 R 7.27 4.12 0.00 1.86 1.97 0.00 3.22 0.00 0.00 3.52 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 18 I 7.18 3.94 1.70 0.00 0.00 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 1.23 0.30 0.41 0.00 0.00 19 G 8.00 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 20 L 7.88 4.70 0.00 1.53 1.55 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.40 0.00 2.16 2.17 0.00 3.76 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 22 S 7.53 4.57 0.00 3.83 3.75 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 23 L 8.11 4.38 0.00 1.59 1.75 0.99 1.08 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 24 S 8.25 4.73 0.00 3.95 3.75 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 25 L 8.54 4.34 0.00 1.68 1.55 0.92 1.04 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 26 D 8.71 4.72 0.00 2.89 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 27 E 8.85 3.93 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 28 E 8.38 4.39 0.00 1.94 1.97 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 2.26 2.35 0.00 29 G 8.21 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 30 M 9.28 6.04 0.00 1.91 2.22 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 2.67 2.31 0.00 31 A 8.46 5.09 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 32 S 8.55 5.12 0.00 3.85 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 9.43 4.87 0.00 1.52 1.03 1.22 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.01 4.98 0.00 1.53 1.42 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 35 F 9.54 4.61 0.00 3.04 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 9.44 4.18 0.00 2.90 2.79 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 0.00 0.00 0.00 0.00 37 E 8.49 3.93 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 2.22 2.31 0.00 38 Q 8.27 4.28 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 39 V 7.84 4.18 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 0.98 0.00 0.00 0.99 0.00 0.00 40 G 8.68 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 9.08 5.21 2.43 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 0.88 0.00 0.00 1.04 0.00 0.00 42 T 8.91 5.15 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 43 L 9.14 5.28 0.00 1.64 1.71 1.08 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.88 5.16 0.00 1.63 1.56 0.97 0.33 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 45 L 8.61 4.67 0.00 1.66 1.58 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 46 L 8.74 4.64 0.00 1.79 1.69 1.01 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.61 4.07 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 48 E 8.31 4.08 0.00 2.09 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 0.00 2.28 2.27 0.00 49 R 7.96 4.30 0.00 1.82 2.00 0.00 3.35 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 50 E 7.98 3.85 0.00 2.18 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 2.25 2.23 0.00 51 R 7.28 5.14 0.00 1.85 1.98 0.00 2.92 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 52 L 9.01 5.11 0.00 1.79 1.60 1.00 0.78 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 53 L 9.10 5.08 0.00 1.63 1.61 0.91 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 54 L 9.45 5.09 0.00 1.50 1.53 0.68 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.13 5.13 0.00 1.98 1.93 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 2.65 2.37 0.00 56 A 8.47 5.08 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 57 D 8.89 4.28 0.00 2.57 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 58 V 8.96 3.99 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 0.94 0.00 0.00 0.98 0.00 0.00 59 V 7.39 4.58 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 0.63 0.00 0.00 0.93 0.00 0.00 60 G 8.58 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 I 8.52 4.04 2.35 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.33 1.10 0.00 0.00 62 D 8.24 4.54 0.00 2.85 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 63 V 7.64 4.19 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 0.92 0.00 0.00 64 L 7.49 4.25 0.00 1.81 1.55 0.94 0.45 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 65 G 8.20 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.32 4.13 0.00 1.98 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 2.32 2.26 0.00 67 G 8.98 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 68 I 7.64 3.74 1.60 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.31 0.43 0.00 0.00 69 F 8.00 3.97 0.00 3.06 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.01 3.97 0.00 1.91 2.10 0.00 3.19 0.00 0.00 3.36 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 71 Q 7.57 4.09 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 72 L 7.93 3.66 0.00 1.67 1.36 0.32 -0.62 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 73 A 8.06 4.14 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 74 S 7.84 4.22 0.00 4.08 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 75 F 8.19 4.37 0.00 3.17 3.36 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 76 N 8.27 4.60 0.00 3.05 2.93 0.00 0.00 7.04 6.94 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 77 R 7.73 4.19 0.00 1.86 2.23 0.00 3.21 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.64 0.00 78 H 8.39 4.98 0.00 3.09 3.07 0.00 5.67 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 W 8.84 4.14 0.00 3.96 3.67 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 80 H 6.63 3.29 0.00 2.66 2.02 0.00 5.72 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 R 6.95 3.82 0.00 1.18 1.29 0.00 2.94 0.00 0.00 3.01 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.20 0.00 82 F 7.78 4.76 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.33 4.60 0.00 2.87 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 84 L 8.44 5.63 0.00 1.63 1.44 0.74 1.11 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 85 H 8.64 5.43 0.00 3.44 3.48 0.00 5.45 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 9.76 4.66 0.00 2.85 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 87 G 8.95 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 F 8.92 5.40 0.00 3.23 3.01 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 89 D 6.71 4.53 0.00 2.74 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.00 4.24 0.00 2.06 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 0.00 2.59 2.40 0.00 91 L 8.07 4.14 0.00 1.60 1.71 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 92 T 7.77 3.98 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 1.24 0.00 0.00 93 G 8.42 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 94 K 7.16 4.98 0.00 1.53 1.63 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.30 7.81 95 V 8.83 4.15 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 1.05 0.00 0.00 0.94 0.00 0.00 96 Q 9.34 5.01 0.00 1.59 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.55 0.00 0.00 0.00 0.00 0.00 2.14 2.44 0.00 97 L 8.14 4.39 0.00 1.27 1.19 0.80 -0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 7.97 5.33 0.00 2.58 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 99 A 9.10 5.18 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 0.00 100 Q 8.66 5.09 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 101 I 8.69 4.67 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.84 0.96 0.00 0.00 102 L 8.68 4.37 0.00 1.73 1.60 0.94 0.83 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 0.00 103 A 8.77 4.03 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 0.00 104 A 8.03 4.09 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 0.00 105 Q 7.77 4.38 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.17 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 106 L 7.27 4.23 0.00 1.82 1.79 1.00 0.88 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 0.00 107 T 7.79 4.76 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 1.23 0.00 0.00 108 L 8.50 3.93 0.00 1.82 1.75 1.07 0.86 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 0.00 109 E 8.28 4.00 0.00 2.11 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 2.41 2.42 0.00 110 C 8.09 4.15 0.00 3.11 3.20 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 0.00 111 F 8.26 4.01 0.00 3.24 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 0.00 112 E 8.53 3.93 0.00 2.19 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 2.81 2.80 0.00 113 A 7.96 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 T 8.06 3.77 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 1.14 0.00 0.00 115 L 7.85 3.60 0.00 0.99 1.28 0.72 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.83 3.85 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 0.00 117 N 8.06 4.27 0.00 3.00 2.96 0.00 0.00 6.79 6.61 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 0.00 118 L 7.85 3.92 0.00 1.82 1.71 0.81 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 119 L 8.10 3.89 0.00 1.53 1.52 -0.11 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 120 D 8.00 4.33 0.00 2.88 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 0.00 121 H 8.14 4.24 0.00 3.21 3.50 0.00 5.83 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 0.00 122 A 8.34 4.12 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 0.00 123 E 8.25 3.95 0.00 1.97 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 2.36 2.46 0.00 124 F 7.92 4.13 0.00 3.01 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 W 8.49 4.02 0.00 3.55 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 0.00 126 Q 8.37 3.99 0.00 2.28 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 127 R 7.50 4.31 0.00 1.87 1.90 0.00 3.16 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.53 0.00 128 L 7.14 4.30 0.00 0.89 1.11 0.75 0.55 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 0.00 129 L 8.16 4.11 0.00 1.64 1.67 0.76 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 130 P 0.00 4.41 0.00 2.00 1.99 0.00 3.50 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 131 C 7.97 4.50 0.00 3.09 3.01 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 0.00 132 A 7.89 4.03 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 0.00 133 S 8.66 4.03 0.00 4.09 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