NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -6 N 4.8824 8.2676 118.1561 53.4491 40.5789 176.4434 -5 L 3.7491 7.9177 115.9919 57.5435 40.5116 175.7243 -4 Y 4.3831 8.6499 116.4018 58.4108 39.8184 176.4166 -3 F 4.7943 8.1039 118.4667 56.2973 39.8599 174.9247 -2 Q 4.2443 7.7999 119.1541 55.3310 29.9401 177.1109 -1 G 3.8703 8.2643 110.3174 44.6919 0.0000 173.1513 0 H 4.3328 8.2904 117.1505 55.4659 29.3208 175.9107 1 M 4.1766 8.6278 123.4278 55.9758 32.5856 175.9303 2 N 4.7339 9.1705 120.4116 51.5643 40.6657 176.2560 3 A 3.9148 8.4355 121.9556 54.9860 18.2447 179.9654 4 K 3.3671 7.7761 116.5115 59.5927 32.1043 179.0912 5 E 3.9214 8.6224 119.0095 59.4999 29.3479 179.6280 6 I 3.6675 7.7585 119.7361 64.1052 37.1430 178.1939 7 L 3.8345 7.9763 121.2032 58.1680 42.0610 179.1766 8 V 3.5106 7.8301 118.1423 66.2393 31.4906 177.4621 9 H 4.2189 8.3858 118.1985 59.2168 29.7400 177.2040 10 S 4.2457 8.5252 116.5351 61.7574 62.6242 176.5813 11 L 3.8231 7.9164 122.6227 57.2211 41.2224 179.4177 12 R 3.9540 7.9109 118.2561 59.4401 29.9351 178.4956 13 L 4.0463 8.0518 118.7340 57.9061 41.5568 179.5781 14 L 3.9212 8.1341 118.8574 57.8146 41.3285 179.2047 15 E 4.4086 8.2914 118.9968 58.9218 29.5607 178.5678 16 N 4.7061 8.2706 113.5815 53.1479 38.8110 175.9406 17 G 4.0583 8.0568 108.5909 46.8242 0.0000 175.3400 18 D 4.7112 8.2015 121.5111 52.4852 38.3313 176.3028 19 A 4.1206 8.0749 125.8900 54.8470 19.0355 179.1526 20 R 3.5611 8.3135 116.9199 59.4640 29.9604 178.8841 21 G 3.7175 8.3822 105.9308 46.7214 0.0000 175.3118 22 W 4.3183 8.4007 130.6574 60.7681 30.8118 177.9141 23 C 4.3407 8.6891 116.7114 63.0289 27.3543 175.8092 24 D 4.4027 8.0146 119.4314 56.9790 40.5532 178.3462 25 L 4.0394 7.8571 119.0656 55.7332 41.7308 177.0050 26 F 4.4843 7.5792 118.0817 56.6885 39.8446 175.0239 27 H 4.2523 8.8232 124.4355 55.6632 30.4464 174.3361 28 P 4.3488 0.0000 0.0000 65.4742 31.2522 177.6596 29 E 4.7507 8.3470 114.3726 55.8864 29.9748 176.1415 30 G 4.0963 8.4910 108.0591 46.5596 0.0000 173.0792 31 V 5.0388 8.8207 120.6612 60.6890 35.0439 173.8919 32 L 5.4007 8.8049 129.1709 53.4275 44.6588 174.8049 33 E 4.9724 9.3650 124.8765 54.5921 33.7989 174.9219 34 F 5.3134 8.4584 122.7323 54.3677 39.5290 173.7062 35 P 4.0694 0.0000 0.0000 64.3128 31.3329 176.7524 36 Y 4.7744 7.0239 114.9442 55.9694 39.8943 174.6019 37 A 4.3269 8.1061 126.0456 49.5321 22.3681 173.6663 38 P 4.1669 0.0000 0.0000 61.6957 31.8710 174.7939 39 P 4.2743 0.0000 0.0000 64.2216 31.7032 176.9128 40 G 4.1164 9.1037 108.8588 45.1615 0.0000 173.5281 41 W 4.7067 7.6714 118.9856 55.4293 30.3148 175.7909 42 K 4.2303 8.6754 122.8246 56.3959 32.1934 176.4599 43 T 4.7928 8.4009 114.7341 61.3581 70.3571 173.2032 44 R 4.8482 7.2010 121.4697 55.0345 33.4927 173.9535 45 F 4.5817 9.3422 124.5905 55.7213 42.4001 173.5442 46 E 4.7254 8.9334 123.7072 55.6362 31.2729 176.6368 47 G 3.9726 9.4687 112.7611 45.5347 0.0000 174.1814 48 R 3.7575 8.8901 123.5957 59.6618 30.0567 178.7823 49 E 4.2769 8.1546 117.1415 58.9946 29.4456 179.0723 50 T 3.9742 7.9192 115.1115 66.6122 69.0021 176.0097 51 I 3.7166 7.9015 121.7536 64.1337 37.0436 178.1533 52 W 4.4819 8.4470 128.8840 60.6916 30.3155 177.7090 53 A 3.7191 8.1013 119.3866 54.7480 17.7797 178.2667 54 H 4.5600 7.6582 111.4304 56.1320 29.5337 175.7938 55 M 4.5368 7.8562 120.8100 54.9595 33.3512 177.7326 56 R 3.0811 7.2593 117.7544 59.0068 30.3285 177.2110 57 L 4.5259 7.5651 115.1116 54.7182 42.0881 177.9400 58 F 4.0616 8.5031 124.0073 61.1507 38.9466 175.6254 59 P 4.0992 0.0000 0.0000 65.2854 31.1707 177.1447 60 E 4.2072 7.9010 116.3648 57.4051 29.8479 176.2718 61 H 4.7526 8.1280 116.1658 55.7862 32.1247 173.6753 62 L 4.7234 7.2332 118.4302 53.7767 45.1308 174.4043 63 T 4.6961 8.3842 120.4415 60.2281 70.0493 173.0550 64 V 4.8706 8.0403 126.1928 60.3330 35.2408 173.4733 65 R 4.7022 8.8907 121.5086 54.4694 33.5779 174.4267 66 F 5.6757 9.4811 122.3708 55.7968 41.4780 175.7795 67 T 4.3919 9.0808 113.1612 61.0699 69.9664 174.0276 68 D 4.4336 8.5756 122.0822 54.2761 41.3554 176.7285 69 V 3.8277 8.1445 123.8758 63.0378 32.4179 175.1396 70 Q 4.3562 8.9437 127.7205 54.7385 29.7976 174.7004 71 F 5.0319 8.5754 123.2819 56.5257 40.5270 175.4493 72 Y 4.5585 8.6754 120.9299 57.3311 39.0036 175.3448 73 E 4.1950 8.9931 123.4286 56.2788 30.0128 176.7057 74 T 4.5353 8.2090 113.7932 59.6552 71.1448 174.6905 75 A 4.0578 8.5298 124.9390 54.1732 18.8048 177.4943 76 D 4.9032 7.7694 115.5823 51.6489 43.0859 175.1039 77 P 4.1928 0.0000 0.0000 65.2808 31.6759 177.2137 78 D 4.8376 8.7134 117.2076 53.3534 40.7832 174.9212 79 L 5.2446 8.0142 121.8337 53.1340 44.5177 175.5497 80 A 4.9370 9.1125 127.3094 50.2079 22.8304 174.8472 81 I 5.1563 8.6849 120.6537 59.7281 41.0240 174.6748 82 G 4.2079 9.3470 113.8827 44.3235 0.0000 170.6995 83 E 5.5897 8.8888 121.9677 53.7797 32.7170 175.0860 84 F 5.1537 7.8533 116.3059 56.6853 41.4632 171.7331 85 H 5.5890 9.7151 118.9662 54.3914 33.0219 172.3567 86 G 4.6666 9.4760 111.7141 44.5280 0.0000 171.4078 87 D 5.4584 8.9202 123.6647 52.4954 44.3117 175.6800 88 G 4.0197 8.7728 109.6198 45.7565 0.0000 171.1965 89 V 4.8742 8.3397 118.7631 60.7394 34.7883 174.9539 90 A 4.3973 8.9823 130.8196 51.9505 18.6222 178.0497 91 T 3.7088 8.4860 120.5815 67.2164 68.8497 176.4453 92 V 3.6803 7.7542 119.3167 65.6019 31.6738 176.9267 93 S 4.2679 8.0047 112.2053 58.3283 63.5436 175.3493 94 G 3.8956 8.3041 108.2815 45.2347 0.0000 174.0728 95 G 4.0373 7.6924 107.8836 45.7265 0.0000 173.3613 96 K 4.7076 8.6102 122.8219 55.7718 33.8666 175.4042 97 L 4.7646 8.9964 126.6886 53.2986 44.1860 174.8658 98 A 4.9999 8.5967 127.2469 50.3569 21.3121 174.5414 99 Q 4.5281 9.1114 123.0279 54.9141 32.6720 173.9021 100 D 5.3047 8.2090 122.9240 52.7710 44.6194 174.2104 101 Y 4.9655 8.9381 121.2475 56.0376 41.7889 174.7794 102 I 4.9055 8.5565 121.6602 59.6252 41.1980 173.9805 103 S 5.4323 9.3089 126.4894 57.0360 65.4194 173.4472 104 V 4.8474 8.9055 124.6455 61.3192 33.4470 174.1049 105 L 5.1763 9.0021 128.6775 52.9768 44.5350 175.6500 106 R 5.1303 8.8761 123.0586 54.7096 32.2001 175.4279 107 T 5.1385 8.8394 112.9600 60.2333 73.3103 172.9750 108 R 4.6216 8.9338 121.1223 56.5222 33.2560 174.5836 109 D 4.2985 9.7928 124.8944 55.4520 38.4678 174.6442 110 G 3.9848 8.4529 103.9180 45.4772 0.0000 173.8666 111 Q 4.7147 7.6492 118.2188 53.5761 31.7086 174.6595 112 I 4.0195 8.1438 122.3703 61.3118 37.6884 176.7390 113 L 4.2483 8.9675 127.7456 56.4828 43.4382 176.9105 114 L 5.1234 7.7011 120.2701 53.6811 45.8128 174.1306 115 Y 4.8905 9.6424 128.2241 56.1397 41.2004 174.4184 116 R 4.7385 9.3903 129.8633 55.2044 31.7984 174.2040 117 D 5.6063 9.4049 128.9908 52.8824 41.7697 174.1131 118 F 4.3332 9.1300 123.2597 56.3819 40.4698 174.5485 119 W 5.5753 7.8288 118.4866 54.9536 31.6223 174.1093 120 N 4.7439 8.8856 118.8997 52.2012 38.9378 173.5848 121 P 4.6705 0.0000 0.0000 65.7816 31.4554 178.3794 122 L 3.9675 8.2582 119.2082 57.8786 41.5262 179.6043 123 R 3.9604 8.1079 117.5541 59.2932 30.0634 178.4570 124 H 4.0236 8.2054 117.9304 59.2056 29.8450 177.3469 125 L 3.9798 8.0924 120.8661 57.6788 41.1458 179.3404 126 E 3.9054 8.0282 117.5995 59.3293 29.7011 178.9042 127 A 4.2908 7.7462 121.9792 54.7453 18.2559 179.7800 128 L 4.0840 7.8850 116.1843 56.8930 41.6954 178.2175 129 G 3.8707 7.8833 109.7378 44.7363 0.0000 173.2354 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 -6 N 8.27 4.88 0.00 2.88 2.96 0.00 0.00 6.76 5.85 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 -5 L 7.92 3.75 0.00 1.59 1.68 0.05 0.10 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 -4 Y 8.65 4.38 0.00 3.06 2.54 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 0.00 0.00 0.00 0.00 -3 F 8.10 4.79 0.00 2.99 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 -2 Q 7.80 4.24 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 -1 G 8.26 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 0.00 0.00 0.00 0 H 8.29 4.33 0.00 3.14 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.63 4.18 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.48 0.00 2 N 9.17 4.73 0.00 3.07 2.90 0.00 0.00 6.92 6.95 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 3 A 8.44 3.91 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 4 K 7.78 3.37 0.00 1.60 1.20 0.00 1.30 0.00 0.00 1.10 0.00 0.00 2.57 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 0.99 7.81 5 E 8.62 3.92 0.00 2.07 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 2.26 2.33 0.00 6 I 7.76 3.67 1.89 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.58 0.73 0.00 0.00 7 L 7.98 3.83 0.00 1.75 1.98 0.75 0.78 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 8 V 7.83 3.51 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 0.96 0.00 0.00 1.14 0.00 0.00 9 H 8.39 4.22 0.00 3.34 3.41 0.00 5.85 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.53 4.25 0.00 4.09 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 11 L 7.92 3.82 0.00 1.61 1.33 -0.34 -0.46 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 12 R 7.91 3.95 0.00 1.98 2.10 0.00 3.36 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 13 L 8.05 4.05 0.00 2.09 1.83 0.95 0.37 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 14 L 8.13 3.92 0.00 2.07 1.85 0.57 -0.63 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 15 E 8.29 4.41 0.00 2.23 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 2.59 2.74 0.00 16 N 8.27 4.71 0.00 2.91 2.91 0.00 0.00 7.07 7.25 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 17 G 8.06 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 18 D 8.20 4.71 0.00 2.85 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 19 A 8.07 4.12 1.61 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 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.31 3.56 0.00 1.65 1.81 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.39 0.00 21 G 8.38 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 22 W 8.40 4.32 0.00 3.51 3.43 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 23 C 8.69 4.34 0.00 3.26 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 24 D 8.01 4.40 0.00 2.85 2.70 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 25 L 7.86 4.04 0.00 1.40 1.42 0.80 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 26 F 7.58 4.48 0.00 3.09 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 27 H 8.82 4.25 0.00 3.23 3.31 0.00 5.80 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 28 P 0.00 4.35 0.00 2.15 2.07 0.00 2.98 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 1.98 2.05 0.00 29 E 8.35 4.75 0.00 2.05 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 2.28 2.36 0.00 30 G 8.49 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.82 5.04 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 1.05 0.00 0.00 1.02 0.00 0.00 32 L 8.80 5.40 0.00 1.64 1.41 1.11 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 33 E 9.36 4.97 0.00 1.85 1.65 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 2.15 2.26 0.00 34 F 8.46 5.31 0.00 2.86 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.07 0.00 0.70 1.53 0.00 2.91 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.32 0.00 36 Y 7.02 4.77 0.00 2.73 2.57 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 37 A 8.11 4.33 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 38 P 0.00 4.17 0.00 0.91 1.60 0.00 2.46 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 0.50 1.63 0.00 39 P 0.00 4.27 0.00 2.21 2.07 0.00 3.68 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 2.01 1.96 0.00 40 G 9.10 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 41 W 7.67 4.71 0.00 3.53 3.42 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 42 K 8.68 4.23 0.00 1.65 1.70 0.00 1.49 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.35 1.05 7.81 43 T 8.40 4.79 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 1.48 0.00 0.00 44 R 7.20 4.85 0.00 1.64 1.58 0.00 3.27 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.57 0.00 45 F 9.34 4.58 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 46 E 8.93 4.73 0.00 1.82 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 2.21 2.24 0.00 47 G 9.47 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 0.00 0.00 0.00 48 R 8.89 3.76 0.00 2.13 1.97 0.00 3.18 0.00 0.00 3.45 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 49 E 8.15 4.28 0.00 2.09 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 2.42 2.38 0.00 50 T 7.92 3.97 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 1.36 0.00 0.00 51 I 7.90 3.72 1.81 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.14 0.80 0.00 0.00 52 W 8.45 4.48 0.00 3.37 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 53 A 8.10 3.72 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 54 H 7.66 4.56 0.00 3.00 3.12 0.00 5.61 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 M 7.86 4.54 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.63 0.00 56 R 7.26 3.08 0.00 1.41 1.46 0.00 2.71 0.00 0.00 2.87 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 57 L 7.57 4.53 0.00 1.70 1.66 0.88 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 58 F 8.50 4.06 0.00 3.13 3.03 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 59 P 0.00 4.10 0.00 2.27 2.25 0.00 3.96 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.28 0.00 60 E 7.90 4.21 0.00 2.06 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 61 H 8.13 4.75 0.00 2.94 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 7.23 4.72 0.00 1.21 0.52 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.38 4.70 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 1.19 0.00 0.00 64 V 8.04 4.87 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 0.73 0.00 0.00 0.31 0.00 0.00 65 R 8.89 4.70 0.00 1.61 1.78 0.00 3.04 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.49 0.00 66 F 9.48 5.68 0.00 2.81 2.96 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 67 T 9.08 4.39 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 1.39 0.00 0.00 68 D 8.58 4.43 0.00 2.72 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 69 V 8.14 3.83 1.54 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 -0.43 0.00 0.00 0.48 0.00 0.00 70 Q 8.94 4.36 0.00 1.88 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 71 F 8.58 5.03 0.00 2.92 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 72 Y 8.68 4.56 0.00 2.99 2.91 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 73 E 8.99 4.19 0.00 2.03 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 2.37 2.27 0.00 74 T 8.21 4.54 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 1.31 0.00 0.00 75 A 8.53 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 76 D 7.77 4.90 0.00 2.65 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 77 P 0.00 4.19 0.00 2.17 2.04 0.00 3.62 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 78 D 8.71 4.84 0.00 2.84 2.81 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 79 L 8.01 5.24 0.00 1.57 1.63 1.02 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 80 A 9.11 4.94 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 81 I 8.68 5.16 2.13 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 1.38 0.91 1.09 0.00 0.00 82 G 9.35 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 0.00 0.00 0.00 0.00 83 E 8.89 5.59 0.00 1.84 1.84 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 2.31 2.16 0.00 84 F 7.85 5.15 0.00 3.22 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 85 H 9.72 5.59 0.00 3.37 3.31 0.00 5.72 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 86 G 9.48 4.67 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 0.00 0.00 0.00 87 D 8.92 5.46 0.00 2.53 2.54 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 0.00 0.00 0.00 0.00 88 G 8.77 4.02 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 0.00 0.00 0.00 89 V 8.34 4.87 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 0.90 0.00 0.00 0.89 0.00 0.00 90 A 8.98 4.40 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 91 T 8.49 3.71 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 1.13 0.00 0.00 92 V 7.75 3.68 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 0.78 0.00 0.00 0.82 0.00 0.00 93 S 8.00 4.27 0.00 3.99 4.02 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 94 G 8.30 3.90 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 0.00 95 G 7.69 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 96 K 8.61 4.71 0.00 1.71 1.71 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.50 1.41 7.81 97 L 9.00 4.76 0.00 1.63 1.45 0.85 0.96 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 98 A 8.60 5.00 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 99 Q 9.11 4.53 0.00 1.96 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.70 0.00 0.00 0.00 0.00 0.00 1.58 1.16 0.00 100 D 8.21 5.30 0.00 2.63 2.51 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 0.00 101 Y 8.94 4.97 0.00 1.43 2.32 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 0.00 102 I 8.56 4.91 1.90 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 1.27 1.61 0.73 0.00 0.00 103 S 9.31 5.43 0.00 3.97 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 0.00 104 V 8.91 4.85 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 1.05 0.00 0.00 1.12 0.00 0.00 105 L 9.00 5.18 0.00 1.52 1.39 0.23 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.88 5.13 0.00 1.74 1.80 0.00 3.07 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 107 T 8.84 5.14 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 1.09 0.00 0.00 108 R 8.93 4.62 0.00 1.77 1.71 0.00 3.22 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 109 D 9.79 4.30 0.00 2.69 2.33 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 0.00 0.00 0.00 0.00 110 G 8.45 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 0.00 111 Q 7.65 4.71 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 112 I 8.14 4.02 0.88 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.40 0.62 0.00 0.00 113 L 8.97 4.25 0.00 1.67 1.68 0.87 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 114 L 7.70 5.12 0.00 1.75 1.48 1.11 0.80 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 0.00 115 Y 9.64 4.89 0.00 3.12 2.97 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 0.00 116 R 9.39 4.74 0.00 1.94 2.02 0.00 3.24 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.32 0.00 117 D 9.40 5.61 0.00 3.39 3.28 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 0.00 118 F 9.13 4.33 0.00 3.20 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 0.00 119 W 7.83 5.58 0.00 3.23 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 0.00 120 N 8.89 4.74 0.00 2.83 2.80 0.00 0.00 6.62 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 0.00 121 P 0.00 4.67 0.00 2.27 2.26 0.00 3.78 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 122 L 8.26 3.97 0.00 1.89 1.75 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.11 3.96 0.00 1.94 2.06 0.00 3.38 0.00 0.00 3.37 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.62 0.00 124 H 8.21 4.02 0.00 3.13 3.20 0.00 5.59 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 0.00 125 L 8.09 3.98 0.00 1.85 1.68 0.86 0.73 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 0.00 126 E 8.03 3.91 0.00 2.10 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 2.33 2.50 0.00 127 A 7.75 4.29 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 0.00 128 L 7.89 4.08 0.00 1.61 1.79 0.77 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 129 G 7.88 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 0.00 0.00 0.00