NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9862 8.3549 109.7366 45.4531 0.0000 172.3433 2 S 4.4718 8.2937 114.6873 55.1530 66.3635 172.2705 3 S 4.4166 8.9956 121.0073 58.6165 66.1193 176.4085 4 G 4.3023 7.9019 113.9212 45.7827 0.0000 174.2628 5 S 4.1866 9.1321 120.5314 58.0760 63.4113 174.3536 6 S 4.5672 8.5731 122.0239 56.8133 62.5909 174.0670 7 G 4.1618 8.0025 116.2393 44.0667 0.0000 170.4073 8 E 4.1109 8.1739 120.8057 58.6767 30.4439 176.4494 9 E 4.8307 7.6020 115.6221 53.6350 33.3533 174.4799 10 W 4.3758 8.8700 119.1458 57.0367 30.5022 175.5023 11 L 4.5466 8.7352 123.4702 53.9683 43.3752 175.3813 12 D 4.6171 8.7401 126.4809 53.8444 40.2915 176.3117 13 I 3.8161 8.1483 124.7234 64.2403 36.9296 177.9868 14 L 4.1817 7.7848 119.6355 55.3751 42.3362 176.7349 15 G 4.2041 8.3999 105.9995 46.0251 0.0000 174.7164 16 N 4.3858 8.1667 116.2217 57.0440 37.3342 174.7817 17 G 3.4087 8.3130 108.6839 44.9602 0.0000 174.1505 18 L 3.8416 7.4677 121.6389 57.6285 41.8349 175.9392 19 L 4.1414 7.2481 122.8351 54.9969 43.3203 175.6535 20 R 4.9554 8.5331 124.5361 54.2896 34.6186 174.5417 21 K 5.3003 9.0031 119.6701 55.0375 36.3792 175.1392 22 K 4.1761 9.2419 127.4749 54.5191 34.8339 175.3352 23 T 4.1687 8.3350 125.0185 64.0310 68.0324 174.5669 24 L 4.1006 8.5192 127.6358 57.1640 42.7641 178.1529 25 V 4.3886 8.3864 120.5672 60.5056 34.4073 172.9754 26 P 4.8601 0.0000 0.0000 62.4472 32.3424 176.1169 27 G 4.1508 8.3011 108.8556 43.9663 0.0000 171.2157 28 P 4.6687 0.0000 0.0000 61.4411 31.9770 175.6030 29 P 4.4231 0.0000 0.0000 65.0523 31.5386 177.9395 30 G 3.6763 8.0245 107.9339 47.9673 0.0000 173.8654 31 S 4.4015 7.3002 112.6278 58.8044 64.1431 173.2735 32 S 5.0014 7.9267 112.2199 58.1400 65.5527 174.3330 33 R 4.3893 8.6303 122.7020 55.5877 30.4733 176.1200 34 P 4.5511 0.0000 0.0000 62.2528 32.7754 175.4112 35 V 4.3847 7.9378 116.3420 59.7998 33.7639 174.9929 36 K 4.1380 8.4553 123.0158 57.9682 31.9565 175.8493 37 G 3.8788 8.1477 115.0807 45.1795 0.0000 172.2719 38 Q 4.6686 7.9170 118.8363 53.4300 33.2658 174.6273 39 V 4.1323 8.6695 120.7733 62.7622 32.2660 174.9648 40 V 4.4705 7.9142 122.3611 59.7417 34.0018 175.0845 41 T 4.7644 8.4063 122.4753 62.0941 70.7675 174.0427 42 V 5.3697 8.6435 119.1987 58.9305 35.9745 173.8282 43 H 4.9376 8.8176 120.4470 54.8944 31.6866 171.8212 44 L 5.2021 8.2284 126.9771 52.7364 44.6054 175.1584 45 Q 4.6652 8.5174 123.6628 54.5243 32.5853 174.2327 46 T 4.7980 8.3932 120.9720 62.9996 70.2443 174.4048 47 S 5.1013 8.5320 119.2808 56.7077 66.9166 173.9707 48 L 4.3453 8.4849 123.0772 54.5087 42.0425 177.7836 49 E 3.9409 8.9391 122.9187 59.4488 29.7281 178.3777 50 N 4.4618 8.1849 115.2056 56.3086 37.7084 174.8466 51 G 3.1500 6.6805 109.5415 45.1772 0.0000 174.0993 52 T 4.3017 7.2569 119.9888 60.7128 67.6664 172.8589 53 R 4.2100 8.3425 123.3635 56.9170 30.5040 176.9065 54 V 4.0551 8.4479 124.3675 65.3647 32.0702 175.6879 55 Q 4.6776 7.8182 116.0404 55.2736 32.3969 173.6621 56 E 4.3294 8.6107 120.5941 55.3473 31.9436 174.0745 57 E 4.5200 8.9642 130.7236 53.9682 30.3542 174.8541 58 P 3.6798 0.0000 0.0000 65.1242 31.9787 177.1360 59 E 4.4337 7.6691 119.8111 53.6494 28.7960 172.9984 60 L 4.6727 8.4828 124.0933 53.9419 43.6776 175.7963 61 V 4.9964 8.3719 125.3676 59.1201 34.5011 174.4365 62 F 4.7242 7.7937 115.4995 56.9655 41.0198 173.0774 63 T 4.6656 8.5763 116.6557 61.4705 68.7803 173.6891 64 L 4.2992 8.3916 128.3121 57.2482 42.5610 178.0819 65 G 4.2139 9.1686 112.2405 45.6114 0.0000 173.2619 66 D 4.7643 7.4933 115.7784 52.7265 42.6737 174.9865 67 C 4.0937 8.0686 118.1489 60.3195 29.9708 173.9629 68 D 4.4650 8.0362 115.9879 55.3429 40.7487 176.0295 69 V 4.3785 6.5460 110.8482 58.5862 35.7157 174.8243 70 I 3.5688 7.9555 120.2461 62.0773 36.8549 177.4279 71 Q 3.9824 8.4450 121.5087 57.9837 28.7449 177.7237 72 A 4.1944 7.8301 118.8499 52.4395 19.9560 177.6480 73 L 4.5278 7.4398 117.9152 56.0942 43.1003 177.6998 74 D 4.1868 7.8843 116.2885 56.5152 41.1880 177.1376 75 L 4.3847 7.1855 117.8771 55.2194 41.9789 177.5829 76 S 4.5977 7.5959 114.1072 59.2843 64.5942 175.9285 77 V 3.6906 8.1206 122.9963 65.5288 31.1931 175.7679 78 P 4.5503 0.0000 0.0000 63.8777 31.0848 176.2435 79 L 4.7328 8.2753 118.5844 54.5401 42.0586 175.8678 80 M 5.1056 7.7213 114.8895 52.8033 34.2457 174.8391 81 D 4.5500 8.6669 121.8203 53.5445 41.8184 176.0515 82 V 3.6945 7.8820 122.1094 64.4696 31.2010 176.3041 83 G 4.0353 9.0750 113.9222 44.5996 0.0000 171.8655 84 E 4.7415 8.2452 121.4188 54.4129 32.1870 174.9377 85 T 4.3417 9.0298 124.7795 62.9425 69.8030 173.6686 86 A 5.0995 8.9326 128.4273 50.2720 22.5351 174.6347 87 M 4.9998 9.0607 121.4595 54.4668 35.2576 175.1986 88 V 5.6786 9.4403 115.5063 59.1779 36.7204 174.6326 89 T 4.5234 8.6906 114.3242 59.8761 70.5767 172.3741 90 A 5.6351 8.1486 127.7182 48.5723 23.1350 174.7571 91 D 4.6326 8.9143 118.8379 53.9323 42.2351 177.4466 92 S 4.1968 8.9317 120.2040 61.6824 62.4034 176.7695 93 K 3.7232 8.5242 121.7410 60.3570 32.1590 178.0659 94 Y 4.2727 8.3846 117.6299 60.3541 37.6778 176.7144 95 C 4.3780 8.0912 117.7502 61.1480 28.4618 173.6935 96 Y 4.2919 9.2546 119.1512 58.9367 40.8252 175.6191 97 G 4.1933 8.0700 103.9818 42.5214 0.0000 172.4663 98 P 4.2934 0.0000 0.0000 63.4842 31.2792 176.8368 99 Q 4.1437 7.8296 116.8510 56.0055 29.8627 175.3737 100 G 3.4398 7.7450 103.0185 44.5603 0.0000 171.4238 101 S 4.6459 7.0741 112.7455 56.5481 64.2356 172.4184 102 R 4.4306 7.8969 118.3067 56.6887 31.7977 176.8703 103 S 4.4719 7.5377 120.0226 56.1724 64.1851 172.3021 104 P 4.4662 0.0000 0.0000 62.6684 31.8960 175.5278 105 Y 4.3296 8.2743 121.2016 57.1566 40.1349 174.5500 106 I 4.6024 6.2581 117.1062 58.4240 40.9963 172.3292 107 P 4.7193 0.0000 0.0000 62.0057 31.7097 174.3319 108 P 4.2102 0.0000 0.0000 63.1819 32.8967 175.3822 109 H 4.0515 8.6714 114.1895 55.4089 26.3960 175.0833 110 A 4.4446 7.3184 121.6598 49.7902 18.5391 177.1328 111 A 4.2618 8.2418 122.8048 53.5451 19.4167 176.6829 112 L 4.7373 7.8222 118.3014 53.4977 46.0077 175.5135 113 C 4.4163 9.3434 125.3434 58.8759 32.8512 172.0071 114 L 5.5400 8.7102 126.4985 52.0931 44.4408 175.1320 115 E 4.8388 8.8431 124.9338 54.7021 31.3344 174.4294 116 V 4.2783 8.5486 128.0562 62.2422 33.8900 175.2304 117 T 4.7635 8.1272 120.4107 61.6780 72.3270 173.0194 118 L 4.0159 8.5694 130.1199 55.3459 42.5305 176.8351 119 K 4.3414 8.6243 126.6403 58.1128 32.6125 177.1519 120 T 4.7720 7.4905 108.3975 60.2126 72.5517 171.8934 121 A 4.9025 8.4625 124.0975 50.6611 21.7311 175.3618 122 V 4.4103 8.5660 114.9119 60.4643 36.2512 176.0322 123 D 4.4069 8.6798 119.2877 56.4040 41.6699 177.2289 124 R 4.1385 7.6837 117.0945 54.9624 30.7379 174.5843 125 P 4.4471 0.0000 0.0000 62.9953 32.2643 175.4590 126 D 4.4328 8.5231 118.3535 55.7576 42.1170 176.4422 127 L 4.1781 7.6311 122.4796 53.6005 41.2481 175.5191 128 E 4.0324 8.6377 127.2081 56.2752 30.7128 175.9758 129 M 3.2947 8.5262 116.7025 55.4089 30.1184 176.9824 130 S 4.6095 6.9603 112.6092 57.3900 67.4757 174.8171 131 G 4.2101 8.0577 115.5210 44.5099 0.0000 170.3681 132 P 4.4828 0.0000 0.0000 62.6571 32.0165 175.3782 133 S 4.5975 7.9855 112.4236 56.6154 65.6405 172.9660 134 S 4.4453 8.6022 118.7277 56.5715 62.8279 174.2131 135 G 3.7662 8.5807 115.6394 46.6070 0.0000 171.9809 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 G 8.35 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 2 S 8.29 4.47 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 3 S 9.00 4.42 0.00 3.97 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 4 G 7.90 4.30 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 0.00 5 S 9.13 4.19 0.00 3.87 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 6 S 8.57 4.57 0.00 3.97 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 7 G 8.00 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 0.00 0.00 0.00 0.00 8 E 8.17 4.11 0.00 1.99 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 0.00 2.31 2.33 0.00 9 E 7.60 4.83 0.00 2.01 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 2.26 2.34 0.00 10 W 8.87 4.38 0.00 3.12 3.27 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 0.00 11 L 8.74 4.55 0.00 1.76 1.72 0.93 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.74 4.62 0.00 2.62 2.72 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 13 I 8.15 3.82 1.80 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 1.23 0.48 0.87 0.00 0.00 14 L 7.78 4.18 0.00 1.65 1.74 0.38 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.40 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 16 N 8.17 4.39 0.00 2.87 3.00 0.00 0.00 6.18 6.92 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 17 G 8.31 3.41 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 0.00 0.00 0.00 0.00 18 L 7.47 3.84 0.00 1.74 1.79 0.99 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.25 4.14 0.00 1.08 1.10 0.85 0.64 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 20 R 8.53 4.96 0.00 1.61 2.03 0.00 3.02 0.00 0.00 2.75 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 21 K 9.00 5.30 0.00 1.88 1.64 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.53 7.81 22 K 9.24 4.18 0.00 0.79 0.74 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.54 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.80 0.62 7.81 23 T 8.34 4.17 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 1.21 0.00 0.00 24 L 8.52 4.10 0.00 1.61 1.68 0.92 0.80 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 25 V 8.39 4.39 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 0.95 0.00 0.00 0.91 0.00 0.00 26 P 0.00 4.86 0.00 2.09 2.01 0.00 3.38 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.79 0.00 27 G 8.30 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 28 P 0.00 4.67 0.00 2.22 2.20 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 29 P 0.00 4.42 0.00 2.19 2.22 0.00 3.75 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 1.98 1.95 0.00 30 G 8.02 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 31 S 7.30 4.40 0.00 3.96 3.99 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 0.00 0.00 0.00 32 S 7.93 5.00 0.00 3.86 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 33 R 8.63 4.39 0.00 1.74 1.86 0.00 3.64 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.58 0.00 34 P 0.00 4.55 0.00 2.17 2.09 0.00 3.72 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 2.00 1.95 0.00 35 V 7.94 4.38 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 0.77 0.00 0.00 0.94 0.00 0.00 36 K 8.46 4.14 0.00 1.76 1.79 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.55 7.81 37 G 8.15 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 38 Q 7.92 4.67 0.00 1.96 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 39 V 8.67 4.13 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 0.97 0.00 0.00 40 V 7.91 4.47 1.68 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 0.69 0.00 0.00 -0.00 0.00 0.00 41 T 8.41 4.76 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 1.23 0.00 0.00 42 V 8.64 5.37 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 0.86 0.00 0.00 1.05 0.00 0.00 43 H 8.82 4.94 0.00 3.20 3.15 0.00 5.66 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.23 5.20 0.00 1.85 1.57 0.98 0.62 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 45 Q 8.52 4.67 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 46 T 8.39 4.80 4.33 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 1.34 0.00 0.00 47 S 8.53 5.10 0.00 3.87 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 48 L 8.48 4.35 0.00 1.84 1.64 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.94 3.94 0.00 1.91 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 2.29 2.31 0.00 50 N 8.18 4.46 0.00 2.86 2.93 0.00 0.00 6.04 7.01 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 51 G 6.68 3.15 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 52 T 7.26 4.30 4.25 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 1.22 0.00 0.00 53 R 8.34 4.21 0.00 1.81 1.95 0.00 3.23 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 54 V 8.45 4.06 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 0.75 0.00 0.00 0.94 0.00 0.00 55 Q 7.82 4.68 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.66 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 56 E 8.61 4.33 0.00 1.99 1.89 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 2.25 2.41 0.00 57 E 8.96 4.52 0.00 2.13 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 2.23 2.24 0.00 58 P 0.00 3.68 0.00 2.15 2.09 0.00 3.75 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 1.95 1.93 0.00 59 E 7.67 4.43 0.00 1.89 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 2.17 2.23 0.00 60 L 8.48 4.67 0.00 1.81 1.81 1.20 1.10 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 61 V 8.37 5.00 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 0.99 0.00 0.00 0.85 0.00 0.00 62 F 7.79 4.72 0.00 3.07 3.18 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 63 T 8.58 4.67 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 64 L 8.39 4.30 0.00 1.90 1.68 1.26 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 65 G 9.17 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 66 D 7.49 4.76 0.00 2.93 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 67 C 8.07 4.09 0.00 3.00 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 68 D 8.04 4.46 0.00 2.73 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 69 V 6.55 4.38 1.81 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 0.71 0.00 0.00 -0.17 0.00 0.00 70 I 7.96 3.57 1.76 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.70 0.89 0.00 0.00 71 Q 8.45 3.98 0.00 2.38 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.29 0.00 72 A 7.83 4.19 1.26 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 73 L 7.44 4.53 0.00 1.74 1.66 1.06 1.29 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 74 D 7.88 4.19 0.00 2.45 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 75 L 7.19 4.38 0.00 1.86 1.65 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 76 S 7.60 4.60 0.00 4.05 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 0.00 77 V 8.12 3.69 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 1.03 0.00 0.00 1.25 0.00 0.00 78 P 0.00 4.55 0.00 2.24 2.18 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 79 L 8.28 4.73 0.00 1.68 1.69 0.92 0.81 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 80 M 7.72 5.11 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.77 0.00 81 D 8.67 4.55 0.00 2.72 2.69 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 82 V 7.88 3.69 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 0.72 0.00 0.00 0.97 0.00 0.00 83 G 9.07 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 84 E 8.25 4.74 0.00 2.17 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 2.18 2.43 0.00 85 T 9.03 4.34 4.23 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 1.26 0.00 0.00 86 A 8.93 5.10 1.20 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 87 M 9.06 5.00 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.92 0.00 88 V 9.44 5.68 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 0.83 0.00 0.00 1.08 0.00 0.00 89 T 8.69 4.52 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 1.00 0.00 0.00 90 A 8.15 5.64 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 91 D 8.91 4.63 0.00 2.84 2.71 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 92 S 8.93 4.20 0.00 4.08 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 0.00 93 K 8.52 3.72 0.00 1.52 1.92 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 0.24 7.81 94 Y 8.38 4.27 0.00 3.05 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 95 C 8.09 4.38 0.00 3.23 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 96 Y 9.25 4.29 0.00 2.74 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 97 G 8.07 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 98 P 0.00 4.29 0.00 2.11 2.12 0.00 3.68 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.90 0.00 99 Q 7.83 4.14 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 5.54 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 100 G 7.75 3.44 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 0.00 101 S 7.07 4.65 0.00 3.25 3.50 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 0.00 102 R 7.90 4.43 0.00 1.86 1.90 0.00 3.45 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 103 S 7.54 4.47 0.00 3.81 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 0.00 104 P 0.00 4.47 0.00 2.20 2.06 0.00 3.91 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 105 Y 8.27 4.33 0.00 3.18 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 0.00 106 I 6.26 4.60 1.49 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 -0.23 0.16 0.00 0.00 107 P 0.00 4.72 0.00 2.10 2.17 0.00 3.67 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 108 P 0.00 4.21 0.00 1.91 2.13 0.00 3.84 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.97 0.00 109 H 8.67 4.05 0.00 3.28 3.35 0.00 5.71 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 A 7.32 4.44 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 0.00 111 A 8.24 4.26 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 0.00 112 L 7.82 4.74 0.00 1.64 1.59 1.05 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 113 C 9.34 4.42 0.00 3.00 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 0.00 114 L 8.71 5.54 0.00 1.67 1.57 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.84 4.84 0.00 2.07 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 2.31 2.31 0.00 116 V 8.55 4.28 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 1.06 0.00 0.00 0.99 0.00 0.00 117 T 8.13 4.76 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 1.22 0.00 0.00 118 L 8.57 4.02 0.00 1.71 1.68 0.90 0.64 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 0.00 119 K 8.62 4.34 0.00 1.62 1.82 0.00 1.77 0.00 0.00 1.94 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.67 1.53 7.81 120 T 7.49 4.77 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 1.19 0.00 0.00 121 A 8.46 4.90 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 0.00 122 V 8.57 4.41 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 0.68 0.00 0.00 0.93 0.00 0.00 123 D 8.68 4.41 0.00 2.60 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 0.00 124 R 7.68 4.14 0.00 1.83 1.83 0.00 3.25 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 125 P 0.00 4.45 0.00 2.17 2.04 0.00 3.73 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 126 D 8.52 4.43 0.00 2.61 2.68 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 0.00 127 L 7.63 4.18 0.00 1.62 1.60 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 0.00 128 E 8.64 4.03 0.00 1.96 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 2.29 2.30 0.00 129 M 8.53 3.29 0.00 2.24 2.22 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 2.50 2.54 0.00 130 S 6.96 4.61 0.00 4.12 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 0.00 131 G 8.06 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 0.00 132 P 0.00 4.48 0.00 2.20 2.08 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 133 S 7.99 4.60 0.00 3.79 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 0.00 134 S 8.60 4.45 0.00 3.87 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 0.00 135 G 8.58 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