NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4022 8.3044 120.3573 53.8519 34.5186 175.8564 2 L 5.5422 6.8569 128.4885 54.3519 43.7524 171.1225 3 M 4.3311 7.2636 116.4585 52.2915 34.4874 174.7439 4 P 4.5542 0.0000 0.0000 62.7011 29.2996 176.4072 5 R 3.9214 8.1355 121.9068 57.4550 29.6935 177.5053 6 R 4.4584 9.4214 113.5574 57.1929 33.1791 174.4586 7 M 3.8576 8.1383 117.3195 54.7959 33.1257 177.2697 8 K 3.9496 8.5430 120.9446 59.1938 32.4914 177.1702 9 Y 5.1460 7.2328 114.2811 55.9809 40.1809 175.7596 10 R 4.0708 8.8148 124.7363 58.7229 30.6391 176.3316 11 K 4.7350 7.7743 116.5739 54.4484 34.6570 175.5744 12 Q 4.6425 8.1315 118.3684 54.0117 31.7096 174.8252 13 Q 4.2593 8.4756 117.9768 56.2803 29.5518 177.4531 14 R 4.2410 8.8275 118.3297 59.0836 30.5615 174.3761 15 G 3.8834 8.1197 111.4542 44.7259 0.0000 173.3495 16 R 4.3455 8.3782 122.4915 55.3450 31.3703 175.0406 17 L 4.8565 8.1328 118.4366 52.7635 44.7588 176.4782 18 K 4.6054 8.3668 121.1544 54.0384 35.0309 177.5613 19 G 3.7699 8.2791 107.6140 46.7012 0.0000 172.8644 20 A 3.6795 8.4686 122.3295 53.9395 16.9212 176.8390 21 T 4.3100 7.5984 105.9764 63.3081 72.0469 174.2950 22 K 4.1727 8.7033 123.4833 57.3430 32.3414 177.6303 23 G 3.8208 7.9503 105.0844 44.5288 0.0000 172.3102 24 G 3.4483 8.1689 104.7657 47.0336 0.0000 174.2716 25 D 4.9478 7.6492 114.3259 52.3615 40.1390 175.1718 26 Y 4.2717 6.9114 116.2957 55.1325 41.1706 174.8357 27 V 4.0774 10.2335 122.8051 65.4734 31.5283 177.7065 28 A 3.9276 8.5973 116.1045 53.3657 17.4618 176.9843 29 F 4.1181 8.9708 111.1879 58.2824 41.8824 174.8391 30 G 4.4499 7.7644 107.2539 44.1004 0.0000 172.3744 31 D 4.3086 8.6944 117.9488 56.5957 41.4329 176.2020 32 Y 5.6402 7.3686 114.9084 55.2891 42.3651 174.6558 33 G 4.5686 8.7041 107.3622 44.9086 0.0000 170.8385 34 L 5.2635 9.6069 122.7569 53.2776 44.1003 175.6664 35 V 4.7455 8.6657 126.5711 60.5940 34.1372 174.6833 36 A 4.8624 8.7373 124.5336 50.8883 20.1991 177.9659 37 L 4.5981 8.8499 122.7308 55.7901 42.9398 176.9617 38 E 4.9270 7.9711 115.7678 53.4681 33.1110 173.7342 39 P 5.6107 0.0000 0.0000 62.1638 32.8477 175.1192 40 A 4.3424 7.9701 122.8250 51.6394 22.2148 175.2905 41 W 4.9548 8.7227 119.7682 56.3558 30.0968 176.3284 42 I 4.6638 9.0067 127.8140 59.7491 38.1129 176.1200 43 T 4.1568 9.5837 118.5654 61.1131 69.5008 175.5820 44 A 4.0988 8.2770 125.2425 55.2391 18.0225 180.5022 45 Q 3.9651 7.9758 115.8428 59.1144 29.2420 178.2321 46 Q 4.1988 8.2685 119.0991 59.8192 28.8215 178.1654 47 I 3.8482 8.0934 118.9227 64.6310 36.8090 176.9875 48 E 3.9225 8.2645 124.1339 59.1618 29.9589 178.7575 49 A 4.2190 7.8901 119.4792 54.3964 19.1656 178.6437 50 A 4.0609 8.3544 118.6224 53.8303 18.6676 179.4797 51 R 3.6246 7.6097 117.1526 58.8067 30.4744 178.3503 52 V 3.5394 7.4521 117.6410 65.5809 31.3637 177.6261 53 A 3.8703 7.5938 120.7673 56.2503 17.8169 178.6302 54 M 3.2566 7.5851 114.0278 58.6520 31.8614 178.8295 55 V 3.5702 7.5754 120.0194 65.5103 31.4542 179.1723 56 R 3.7754 7.8264 117.9192 60.0790 30.1375 177.5517 57 H 3.8083 8.5256 115.6566 59.2211 30.8014 175.1459 58 F 4.4668 7.2217 115.4085 55.3516 37.5450 176.1987 59 R 4.9052 7.3543 116.8487 59.8749 28.7996 176.1844 60 R 4.2862 8.8805 122.7712 56.3185 27.7953 177.0894 61 G 3.7213 8.3203 108.5599 44.7659 0.0000 174.7863 62 G 4.0129 7.7613 107.0645 44.6566 0.0000 172.7941 63 K 4.1610 8.4204 120.9347 56.1181 33.8695 177.0625 64 I 4.6962 7.9995 126.3445 59.6324 39.4158 174.8332 65 F 4.8080 9.6118 127.3289 56.1747 40.5969 174.8818 66 I 4.5642 8.5836 118.0171 59.1815 38.8471 175.4581 67 R 4.7353 9.0629 128.1799 55.5575 30.5407 176.5511 68 I 4.6934 7.6556 110.4352 59.0900 40.7369 174.0428 69 F 5.0639 8.4314 123.1599 55.9902 42.0521 172.8694 70 P 5.0499 0.0000 0.0000 61.7342 30.0554 174.6399 71 D 4.3921 7.9300 124.1296 53.6346 41.7656 176.6054 72 K 4.1357 7.7064 121.9463 55.4565 33.3376 174.0149 73 P 4.5486 0.0000 0.0000 62.2836 32.3470 174.9993 74 Y 4.7152 9.4290 127.0668 57.0346 40.3512 174.1253 75 T 4.8689 7.8859 122.1310 61.5848 71.6956 173.2602 76 K 4.4694 8.2239 125.8084 54.8808 36.0455 175.5344 77 K 4.3525 8.5162 125.6534 54.6507 33.2094 174.8408 78 P 4.2703 0.0000 0.0000 62.3108 31.6861 175.7812 79 L 4.0270 8.2125 121.0428 56.2149 42.4964 177.2653 80 E 3.9514 8.9230 123.3443 56.6353 27.1244 174.9105 81 V 3.8926 7.0981 118.5643 61.2004 32.2790 175.6751 82 R 4.4625 7.9802 117.3017 54.2902 31.3668 175.6879 83 M 3.9427 8.3002 118.1003 56.7683 32.4214 177.9631 84 G 3.7616 8.5597 109.0100 45.7024 0.0000 172.7743 85 K 3.7032 9.0248 114.2530 57.6049 28.9017 176.3534 86 G 3.7726 8.3726 105.8961 44.1022 0.0000 172.7878 87 K 4.4653 8.0869 119.0240 53.9747 34.1859 176.8743 88 G 3.9051 8.4245 111.9068 46.8098 0.0000 171.8964 89 N 4.8226 8.2072 116.2010 52.1950 40.9055 174.7647 90 V 4.1012 7.9515 119.9890 62.3606 31.6215 175.4372 91 E 4.0410 9.4612 129.3856 58.5592 29.4035 177.3184 92 G 3.9817 7.5502 103.3676 46.1007 0.0000 170.5905 93 Y 5.0052 8.3359 116.4893 56.4428 41.3424 175.4329 94 V 4.6416 9.0653 113.7090 59.9524 37.2177 173.9176 95 A 4.9490 8.7747 123.4837 50.1424 21.4180 175.9301 96 V 4.2210 8.2970 122.7093 62.4570 32.9304 175.5572 97 V 4.3472 8.6285 126.5554 61.3811 34.3172 174.5711 98 K 4.8060 8.5326 127.1668 54.0100 34.8748 174.2725 99 P 4.3150 0.0000 0.0000 64.3892 31.0606 175.3749 100 G 4.1210 9.5630 115.8066 46.2154 0.0000 174.8068 101 R 3.7684 7.7038 119.9170 56.6496 30.3509 175.2925 102 V 4.4339 8.6097 125.3513 61.6937 31.3956 175.3383 103 M 4.0154 8.4209 128.5078 57.1450 32.1063 177.0717 104 F 5.7035 7.3898 115.4835 55.9313 43.1830 173.8590 105 E 5.8773 8.6902 112.5117 56.9552 33.0372 175.7679 106 V 4.8795 8.5006 117.6293 60.0221 34.5326 174.6124 107 A 5.5473 8.0674 123.6681 50.4050 23.3683 176.2164 108 G 3.9450 9.7316 104.7769 46.1405 0.0000 173.8417 109 V 4.2868 7.4167 116.2648 59.7619 34.7228 174.2794 110 T 4.0170 8.3612 118.0387 62.3630 69.1434 174.7799 111 E 3.5697 8.6580 123.7981 58.6875 29.9553 178.9452 112 E 3.9852 8.1200 119.2556 59.2291 29.6459 179.1866 113 Q 4.1701 7.9398 118.3534 58.6439 28.9271 177.7801 114 A 4.3110 7.9011 121.7452 55.8289 18.4893 179.3934 115 M 3.8532 7.7722 116.6826 58.3902 31.8869 178.7225 116 E 4.0100 7.7454 117.3659 58.8413 29.9859 178.0877 117 A 3.8565 8.8214 121.9188 55.4080 18.5538 179.6367 118 L 4.0292 8.2585 117.2465 57.3926 41.4459 179.5604 119 R 3.8540 7.2452 117.4584 59.6093 30.3964 178.0782 120 I 3.8603 8.1106 119.6418 64.5363 37.1083 178.3034 121 A 4.0620 7.8669 121.7177 55.0260 18.0002 179.7593 122 G 3.7404 8.0560 103.3571 47.7538 0.0000 175.3272 123 H 4.2776 7.8401 117.8186 58.3386 29.0422 177.1196 124 K 4.2196 8.0396 118.0142 56.7580 32.3418 176.9454 125 L 4.7066 6.5446 119.2327 52.5449 43.3013 174.7477 126 P 4.5671 0.0000 0.0000 63.3002 31.4963 175.3547 127 I 5.4388 7.0706 111.0219 58.4150 40.7737 173.7569 128 K 4.6142 8.4622 118.8140 55.9165 33.7639 176.3730 129 T 5.3363 8.1861 113.3358 60.3945 72.4404 172.2421 130 K 4.6947 8.7127 120.2348 55.6453 35.9729 174.8916 131 I 5.2515 8.3505 124.5471 60.0104 40.2240 174.9354 132 V 4.2482 8.5362 116.2187 61.3608 36.3453 174.5163 133 R 4.1274 8.9695 119.9226 55.2395 31.0930 176.8661 134 R 4.0026 6.1928 127.0215 56.3548 36.4847 175.3756 135 D 4.3608 8.3639 117.5658 55.3031 38.3545 178.8191 136 A 4.3832 9.2918 118.0757 51.7093 17.0442 176.8551 137 Y 4.1887 7.3844 118.4968 56.6837 40.7509 177.2545 138 D 3.9673 6.6412 117.7101 53.5067 40.2683 176.5866 139 E 4.3755 8.3122 125.9685 54.3514 28.6560 173.9130 140 A 4.5978 7.2379 122.1531 50.8899 22.3748 176.4834 141 Q 4.1013 8.4513 113.9743 56.5090 29.8594 175.1303 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 8.30 4.40 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 2 L 6.86 5.54 0.00 1.85 1.68 1.12 0.72 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 3 M 7.26 4.33 0.00 2.11 1.25 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 4 P 0.00 4.55 0.00 2.11 2.21 0.00 2.80 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.65 0.00 5 R 8.14 3.92 0.00 1.93 2.10 0.00 3.07 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 6 R 9.42 4.46 0.00 1.74 1.87 0.00 3.35 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.63 0.00 7 M 8.14 3.86 0.00 2.10 2.03 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 2.64 2.54 0.00 8 K 8.54 3.95 0.00 1.14 0.96 0.00 1.53 0.00 0.00 1.39 0.00 0.00 2.52 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.23 1.25 7.81 9 Y 7.23 5.15 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 10 R 8.81 4.07 0.00 1.83 1.99 0.00 3.22 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 11 K 7.77 4.73 0.00 1.75 1.66 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.38 7.81 12 Q 8.13 4.64 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.03 0.00 0.00 0.00 0.00 0.00 2.19 2.33 0.00 13 Q 8.48 4.26 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.10 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 14 R 8.83 4.24 0.00 1.99 2.35 0.00 3.51 0.00 0.00 3.50 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 1.86 0.00 15 G 8.12 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 16 R 8.38 4.35 0.00 1.80 1.89 0.00 3.17 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 17 L 8.13 4.86 0.00 1.64 1.56 0.97 1.13 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 18 K 8.37 4.61 0.00 1.72 1.72 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.35 7.81 19 G 8.28 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 20 A 8.47 3.68 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 21 T 7.60 4.31 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 1.26 0.00 0.00 22 K 8.70 4.17 0.00 1.73 1.84 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.44 7.81 23 G 7.95 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 24 G 8.17 3.45 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 0.00 25 D 7.65 4.95 0.00 2.68 2.65 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 26 Y 6.91 4.27 0.00 2.62 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 27 V 10.23 4.08 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 1.41 0.00 0.00 1.20 0.00 0.00 28 A 8.60 3.93 1.64 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 0.00 0.00 29 F 8.97 4.12 0.00 2.49 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 30 G 7.76 4.45 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 0.00 31 D 8.69 4.31 0.00 2.84 2.35 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 32 Y 7.37 5.64 0.00 3.02 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 33 G 8.70 4.57 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 L 9.61 5.26 0.00 1.90 1.78 1.09 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.67 4.75 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 0.70 0.00 0.00 1.03 0.00 0.00 36 A 8.74 4.86 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 37 L 8.85 4.60 0.00 1.54 1.74 1.01 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.97 4.93 0.00 1.98 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 0.00 2.27 2.26 0.00 39 P 0.00 5.61 0.00 2.10 2.09 0.00 3.45 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.80 0.00 40 A 7.97 4.34 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 41 W 8.72 4.95 0.00 3.11 2.93 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 42 I 9.01 4.66 1.86 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 1.27 0.49 0.92 0.00 0.00 43 T 9.58 4.16 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 1.15 0.00 0.00 44 A 8.28 4.10 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 45 Q 7.98 3.97 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.98 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 46 Q 8.27 4.20 0.00 2.27 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 47 I 8.09 3.85 2.13 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.72 1.09 0.00 0.00 48 E 8.26 3.92 0.00 2.14 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 2.35 2.43 0.00 49 A 7.89 4.22 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 50 A 8.35 4.06 1.44 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 0.00 0.00 0.00 51 R 7.61 3.62 0.00 1.80 1.87 0.00 3.21 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 52 V 7.45 3.54 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 0.99 0.00 0.00 0.96 0.00 0.00 53 A 7.59 3.87 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 54 M 7.59 3.26 0.00 1.87 1.84 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 55 V 7.58 3.57 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 0.91 0.00 0.00 0.90 0.00 0.00 56 R 7.83 3.78 0.00 2.05 1.96 0.00 3.32 0.00 0.00 3.11 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 57 H 8.53 3.81 0.00 2.89 2.94 0.00 5.76 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 7.22 4.47 0.00 3.11 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 59 R 7.35 4.91 0.00 1.94 2.23 0.00 2.60 0.00 0.00 3.88 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.68 0.00 60 R 8.88 4.29 0.00 1.90 2.44 0.00 3.21 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 1.48 1.55 0.00 61 G 8.32 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 0.00 0.00 0.00 62 G 7.76 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 0.00 0.00 0.00 63 K 8.42 4.16 0.00 1.67 1.32 0.00 0.95 0.00 0.00 1.11 0.00 0.00 2.82 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.61 1.12 7.81 64 I 8.00 4.70 1.84 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 1.59 0.84 0.92 0.00 0.00 65 F 9.61 4.81 0.00 3.18 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 66 I 8.58 4.56 2.01 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.67 1.35 0.00 0.00 67 R 9.06 4.74 0.00 1.85 1.86 0.00 3.02 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.39 0.00 68 I 7.66 4.69 1.82 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.60 0.78 0.00 0.00 69 F 8.43 5.06 0.00 2.75 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 70 P 0.00 5.05 0.00 2.06 1.97 0.00 3.40 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.82 0.00 71 D 7.93 4.39 0.00 2.57 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 72 K 7.71 4.14 0.00 1.65 1.54 0.00 1.22 0.00 0.00 0.61 0.00 0.00 2.59 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.12 1.25 7.81 73 P 0.00 4.55 0.00 1.95 1.93 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 74 Y 9.43 4.72 0.00 2.76 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 75 T 7.89 4.87 4.13 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 1.10 0.00 0.00 76 K 8.22 4.47 0.00 1.47 1.32 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.34 7.81 77 K 8.52 4.35 0.00 1.75 1.68 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.41 7.81 78 P 0.00 4.27 0.00 2.01 2.02 0.00 3.65 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 79 L 8.21 4.03 0.00 1.67 1.52 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.92 3.95 0.00 2.17 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 0.00 2.19 2.28 0.00 81 V 7.10 3.89 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 0.69 0.00 0.00 0.92 0.00 0.00 82 R 7.98 4.46 0.00 1.92 1.97 0.00 3.05 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 83 M 8.30 3.94 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 84 G 8.56 3.76 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 0.00 0.00 0.00 85 K 9.02 3.70 0.00 1.92 1.95 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.36 7.81 86 G 8.37 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 87 K 8.09 4.47 0.00 1.68 1.65 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.28 1.37 7.81 88 G 8.42 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 89 N 8.21 4.82 0.00 2.73 2.72 0.00 0.00 7.04 7.56 0.00 0.00 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 V 7.95 4.10 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 0.46 0.00 0.00 0.87 0.00 0.00 91 E 9.46 4.04 0.00 1.84 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 2.19 2.29 0.00 92 G 7.55 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 93 Y 8.34 5.01 0.00 2.84 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 94 V 9.07 4.64 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 0.58 0.00 0.00 0.38 0.00 0.00 95 A 8.77 4.95 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 0.00 0.00 96 V 8.30 4.22 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 0.91 0.00 0.00 0.85 0.00 0.00 97 V 8.63 4.35 2.21 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 0.90 0.00 0.00 0.89 0.00 0.00 98 K 8.53 4.81 0.00 1.84 1.75 0.00 1.75 0.00 0.00 2.23 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.48 7.81 99 P 0.00 4.31 0.00 1.93 2.21 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 100 G 9.56 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 0.00 101 R 7.70 3.77 0.00 1.82 1.87 0.00 3.25 0.00 0.00 3.05 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 102 V 8.61 4.43 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 0.94 0.00 0.00 0.96 0.00 0.00 103 M 8.42 4.02 0.00 1.32 1.60 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.33 0.00 104 F 7.39 5.70 0.00 3.08 2.90 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 0.00 0.00 0.00 105 E 8.69 5.88 0.00 2.35 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 2.39 2.30 0.00 106 V 8.50 4.88 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 1.03 0.00 0.00 1.17 0.00 0.00 107 A 8.07 5.55 1.53 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 0.00 108 G 9.73 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 0.00 109 V 7.42 4.29 1.67 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 0.44 0.00 0.00 0.46 0.00 0.00 110 T 8.36 4.02 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 1.23 0.00 0.00 111 E 8.66 3.57 0.00 2.09 2.24 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 2.35 2.25 0.00 112 E 8.12 3.99 0.00 2.23 2.23 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 2.27 2.34 0.00 113 Q 7.94 4.17 0.00 2.28 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 114 A 7.90 4.31 0.90 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 0.00 0.00 0.00 0.00 0.00 115 M 7.77 3.85 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.79 0.00 116 E 7.75 4.01 0.00 2.24 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 2.13 2.08 0.00 117 A 8.82 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 0.00 118 L 8.26 4.03 0.00 1.83 1.82 1.13 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.25 3.85 0.00 2.24 2.15 0.00 3.30 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 120 I 8.11 3.86 1.78 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 1.55 0.53 0.86 0.00 0.00 121 A 7.87 4.06 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 0.00 122 G 8.06 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 0.00 123 H 7.84 4.28 0.00 3.50 3.35 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 8.04 4.22 0.00 1.87 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.79 7.81 125 L 6.54 4.71 0.00 1.76 1.63 1.07 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.57 0.00 2.17 2.15 0.00 3.74 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 1.99 2.14 0.00 127 I 7.07 5.44 1.87 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 1.44 0.30 0.91 0.00 0.00 128 K 8.46 4.61 0.00 1.70 1.76 0.00 1.62 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.42 7.81 129 T 8.19 5.34 4.41 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 1.25 0.00 0.00 130 K 8.71 4.69 0.00 1.87 1.67 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.46 7.81 131 I 8.35 5.25 1.96 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 1.40 0.82 1.05 0.00 0.00 132 V 8.54 4.25 2.29 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 0.95 0.00 0.00 1.17 0.00 0.00 133 R 8.97 4.13 0.00 1.73 1.56 0.00 3.37 0.00 0.00 3.22 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.77 0.00 134 R 6.19 4.00 0.00 1.50 1.56 0.00 3.07 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.28 0.00 135 D 8.36 4.36 0.00 2.82 2.28 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 0.00 136 A 9.29 4.38 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 0.00 137 Y 7.38 4.19 0.00 2.79 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 0.00 138 D 6.64 3.97 0.00 2.69 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 0.00 139 E 8.31 4.38 0.00 1.63 1.72 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 2.09 2.25 0.00 140 A 7.24 4.60 1.16 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 0.00 141 Q 8.45 4.10 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.60 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00