NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1815 8.1727 122.0516 56.2961 34.0704 173.9188 2 V 4.5799 8.2231 127.4666 60.7900 32.2784 174.5679 3 F 4.3514 10.2370 129.2978 57.5381 40.2424 174.8377 4 E 4.2407 8.6315 119.7140 55.5426 30.9301 176.8075 5 R 3.2535 8.9691 121.3829 60.8478 29.9737 179.4290 6 C 4.2915 8.0104 115.3626 59.7626 35.6505 175.7875 7 E 3.8975 8.0862 120.8094 59.1389 29.2509 178.4681 8 L 3.6480 8.0922 120.2855 57.7180 42.0676 178.6012 9 A 3.9451 7.9855 120.8513 55.4396 18.3324 179.9122 10 R 3.9054 8.0439 116.4018 59.5969 30.2243 179.4972 11 T 3.8680 7.8390 115.4594 66.6237 68.4424 176.7857 12 L 3.8801 8.1674 121.3317 57.4874 41.6177 179.4268 13 K 3.8995 8.0550 119.6715 59.5919 31.9423 178.8991 14 R 3.9870 7.8375 117.6682 58.7240 30.0373 177.4175 15 L 4.3809 7.4327 116.3696 53.9517 41.8380 176.6752 16 G 3.8500 7.8470 106.8807 47.0205 0.0000 175.1965 17 M 3.8568 7.8363 121.2551 56.4779 32.3784 175.8336 18 D 4.3901 8.0090 117.8572 56.0064 41.0702 175.8687 19 G 3.9596 9.5299 116.1813 45.3147 0.0000 171.4477 20 Y 4.1444 8.2016 121.8558 58.8274 38.9491 176.3781 21 R 3.5848 8.9688 126.6474 57.2728 27.8097 177.2685 22 G 3.7983 8.2802 103.5655 45.6826 0.0000 174.1681 23 I 4.0344 7.6833 122.2762 59.2005 37.7042 175.9196 24 S 4.7508 8.3151 120.4047 57.7190 63.9610 174.9726 25 L 4.2065 9.1180 123.2322 58.6268 41.7804 179.2976 26 A 4.1582 8.2233 119.9093 55.1902 18.1589 179.1227 27 N 4.4829 8.2324 115.1907 56.0618 38.6399 177.7038 28 W 4.1694 7.9839 120.0038 59.9137 29.1986 178.3622 29 M 4.1790 8.4795 118.9072 58.5537 31.4379 177.9668 30 C 3.2924 7.9223 118.6266 59.0537 42.5796 175.3435 31 L 3.9571 8.2193 121.8146 58.2325 41.7203 178.7126 32 A 4.1101 8.3546 120.8201 55.0209 18.2738 179.2722 33 K 2.7364 8.1116 117.9590 59.4531 32.0150 179.1041 34 W 4.1554 7.6987 117.3190 59.2200 29.0602 178.3079 35 E 4.3445 8.4685 118.9883 58.6253 29.4560 177.7262 36 S 4.5043 8.0410 109.1933 56.6489 64.9870 174.2055 37 G 3.2390 8.1347 108.9832 47.1141 0.0000 173.3030 38 Y 3.6583 7.5818 112.8674 58.6218 35.6878 168.9722 39 N 5.3832 7.5908 117.6721 51.9939 40.2742 175.6129 40 T 4.2018 9.0690 117.4348 63.7739 69.2529 175.9598 41 R 4.4690 7.9124 116.5924 55.6285 30.0777 176.0770 42 A 4.3541 7.6297 121.2665 52.5927 19.3276 177.1564 43 T 5.0269 8.3957 111.3951 60.0041 72.4504 173.2578 44 N 4.9312 9.0631 121.0008 51.8251 42.7410 172.8041 45 Y 4.7522 8.7304 125.8209 57.2019 40.7288 173.8527 46 N 4.7605 8.6722 124.8739 51.1759 38.9451 175.2931 47 A 3.6039 8.3208 127.7909 54.7470 18.8108 179.2006 48 G 3.7204 7.9627 104.1309 48.0464 0.0000 173.7926 49 D 4.6884 7.3279 115.0544 52.0380 40.4001 175.5147 50 R 3.9599 8.0848 116.0608 56.7498 28.3633 175.8814 51 S 4.9813 7.6251 112.0285 57.1291 66.1753 172.8936 52 T 5.1189 8.4122 116.1537 61.9792 72.4442 172.4318 53 D 5.5607 8.9635 124.8831 53.0187 43.5084 174.9661 54 Y 4.8531 9.1366 120.9883 57.4466 41.3158 177.3436 55 G 4.1402 9.2834 112.8529 45.2560 0.0000 173.1372 56 I 3.8345 8.3199 116.9045 63.0515 37.7389 177.3804 57 F 4.6705 7.9717 114.9591 56.4958 39.8378 175.3555 58 Q 3.6232 8.0338 119.2306 57.1592 26.4782 174.0473 59 I 4.3831 8.2423 119.1867 61.1291 39.2874 176.8162 60 N 5.3162 9.3057 125.8683 53.3840 39.4694 175.5253 61 A 4.3712 9.1070 128.6415 54.7817 18.6794 178.6106 62 R 3.6804 8.8234 116.7915 58.7320 30.6792 178.1615 63 Y 4.2554 7.6380 114.3459 57.8616 40.7190 177.1353 64 W 4.7223 8.0953 119.0139 57.6800 30.2389 173.5570 65 C 5.6162 7.9242 109.9691 53.5837 45.5699 172.2414 66 N 4.8865 8.9056 119.3008 52.0430 39.6437 174.6318 67 D 4.7730 8.6164 123.3546 52.3627 40.5415 177.8112 68 G 4.0937 8.3862 109.3474 45.6878 0.0000 174.7190 69 K 4.3440 7.6915 116.1616 57.1979 33.6644 176.6846 70 T 4.2060 7.5797 116.8269 62.2179 68.7838 172.8871 71 P 4.2651 0.0000 0.0000 63.7835 32.0817 176.3499 72 G 3.9122 8.4594 109.4978 46.5428 0.0000 172.6077 73 A 4.7260 7.6771 118.0673 50.2502 21.4650 177.5588 74 V 4.2892 8.3231 112.7921 59.1986 35.4506 175.8740 75 N 4.9462 8.0097 117.4836 51.8881 37.5296 174.2163 76 A 4.0210 8.9394 123.9290 54.8081 19.2270 178.7617 77 C 4.4668 8.7476 110.7703 56.4641 40.9031 173.7820 78 H 3.9998 7.7130 115.4299 56.7985 26.3609 174.0627 79 L 4.8631 8.4088 117.5484 52.8789 46.3342 176.4612 80 S 4.6969 8.3021 114.8767 57.7758 63.3617 176.0317 81 C 4.0892 8.5966 124.3645 59.7344 36.5354 176.3442 82 S 3.8774 7.9902 114.3922 61.2999 61.6506 175.8043 83 A 4.1486 7.8577 122.4090 54.2703 18.1199 177.8823 84 L 4.4996 7.8397 116.7840 54.9187 41.7259 177.5753 85 L 5.3857 7.6855 116.3613 53.7226 42.4091 176.7219 86 Q 4.3967 7.7783 117.8299 55.2605 29.6453 175.9022 87 D 4.3855 8.5216 119.6057 57.1457 41.0972 176.6579 88 N 4.5678 8.0185 118.1633 53.1457 38.8492 174.4879 89 I 4.2225 8.4781 119.2969 61.1339 37.9140 176.9665 90 A 3.9422 8.2875 124.8799 56.0955 18.1832 180.2203 91 D 4.3244 8.0908 116.4480 57.2980 40.8955 178.6864 92 A 4.1092 7.9807 120.9984 55.1143 18.4087 179.7472 93 V 3.3785 8.1435 116.7576 66.0536 31.5038 178.1703 94 A 3.8151 7.9344 120.5806 55.2244 18.1836 178.8011 95 C 4.2325 8.4147 116.8695 59.5514 38.6759 175.6503 96 A 3.9023 8.0850 122.7516 54.8734 17.5992 179.7089 97 K 3.6992 7.6242 116.4632 59.4289 32.4221 179.1822 98 R 4.0635 7.5467 119.1101 59.3659 30.0345 178.6269 99 V 2.2065 7.2810 117.9281 65.6562 31.0598 177.9790 100 V 3.8587 7.6982 110.1192 62.7228 31.3919 177.7322 101 R 4.1164 7.6186 117.5609 57.2136 30.5148 176.0146 102 D 4.7093 7.3435 118.5029 53.2355 41.7499 175.2345 103 P 4.2386 0.0000 0.0000 66.2916 31.1253 177.8727 104 Q 4.0222 8.1286 117.3755 56.4947 30.2022 177.0681 105 G 3.7766 7.9600 106.9602 47.0620 0.0000 176.6623 106 I 3.5655 7.7886 121.2397 63.5088 37.9077 177.8477 107 R 4.2743 7.2068 118.2447 58.0250 29.9861 177.4653 108 A 3.9248 7.5733 120.5179 54.1440 18.6627 177.6289 109 W 4.8041 8.1890 116.4175 55.3715 30.2783 177.5985 110 V 3.7467 8.7409 123.3629 65.9850 30.9507 177.6997 111 A 4.0555 8.2876 120.1710 54.6830 18.0914 179.2816 112 W 3.9453 8.2842 126.6305 60.6735 30.5959 178.3633 113 R 3.5996 8.1576 116.2014 59.3009 29.6431 178.4181 114 N 4.3872 7.9811 115.1204 55.4017 38.6994 176.8102 115 R 4.1797 7.6469 113.3207 55.8815 30.2756 175.2534 116 C 4.5415 7.0980 115.7799 58.2755 42.9722 174.2569 117 Q 3.2543 6.6689 120.0443 57.2193 28.6171 175.5752 118 N 4.1933 8.6835 120.7839 54.3076 36.1528 173.7763 119 R 4.5136 7.3543 115.1291 54.0427 33.2080 175.6452 120 D 4.5660 8.4539 118.9165 54.0917 40.4160 175.7146 121 V 4.6272 8.1951 118.9678 61.4142 32.3474 178.4469 122 R 4.0482 8.1445 122.9314 59.3826 29.9131 178.5509 123 Q 3.9424 8.2366 116.9480 59.9567 27.8587 178.8167 124 Y 4.2701 7.7336 116.8958 59.9095 38.3012 177.0780 125 V 4.3737 7.9188 110.8401 60.7423 33.0907 175.6544 126 Q 4.1744 7.5155 119.4082 57.2410 28.8186 177.2843 127 G 3.9546 8.8425 109.6880 46.1385 0.0000 174.6754 128 C 4.4285 8.0970 115.9181 56.8499 40.5353 173.7728 129 G 3.8486 8.1092 107.2992 46.9220 0.0000 174.2192 130 V 4.0196 7.8551 117.9432 61.1157 32.2658 175.8581 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 K 8.17 4.18 0.00 1.97 1.71 0.00 1.30 0.00 0.00 1.07 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.95 1.13 7.81 2 V 8.22 4.58 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 10.24 4.35 0.00 2.80 2.82 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 4 E 8.63 4.24 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.23 0.00 5 R 8.97 3.25 0.00 1.90 1.89 0.00 3.45 0.00 0.00 3.45 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 6 C 8.01 4.29 0.00 3.00 3.12 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 7 E 8.09 3.90 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.40 0.00 8 L 8.09 3.65 0.00 1.37 1.36 -0.22 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.99 3.95 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 10 R 8.04 3.91 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 11 T 7.84 3.87 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 12 L 8.17 3.88 0.00 1.74 1.60 0.98 0.38 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 13 K 8.05 3.90 0.00 1.84 1.95 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.84 3.99 0.00 1.98 2.06 0.00 3.30 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.43 4.38 0.00 1.69 1.55 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.85 3.85 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 0.00 0.00 0.00 17 M 7.84 3.86 0.00 1.28 1.97 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.22 0.00 18 D 8.01 4.39 0.00 2.68 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 19 G 9.53 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 20 Y 8.20 4.14 0.00 3.34 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 21 R 8.97 3.58 0.00 1.92 1.85 0.00 3.20 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.45 0.00 22 G 8.28 3.80 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 0.00 0.00 0.00 23 I 7.68 4.03 1.82 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.78 -0.26 0.00 0.00 24 S 8.32 4.75 0.00 4.07 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 25 L 9.12 4.21 0.00 2.07 1.81 0.98 0.99 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 26 A 8.22 4.16 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 27 N 8.23 4.48 0.00 2.77 2.74 0.00 0.00 6.87 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 28 W 7.98 4.17 0.00 3.57 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 29 M 8.48 4.18 0.00 2.20 2.36 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.93 0.00 30 C 7.92 3.29 0.00 2.52 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 31 L 8.22 3.96 0.00 1.85 1.86 0.59 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.35 4.11 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 0.00 0.00 33 K 8.11 2.74 0.00 1.58 1.81 0.00 0.70 0.00 0.00 1.20 0.00 0.00 2.60 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.06 0.21 7.81 34 W 7.70 4.16 0.00 3.36 3.30 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 35 E 8.47 4.34 0.00 1.98 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 2.55 2.34 0.00 36 S 8.04 4.50 0.00 4.03 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 37 G 8.13 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 0.00 0.00 0.00 38 Y 7.58 3.66 0.00 3.23 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 7.59 5.38 0.00 2.85 2.78 0.00 0.00 7.01 7.10 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 40 T 9.07 4.20 4.47 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 1.48 0.00 0.00 41 R 7.91 4.47 0.00 2.01 2.09 0.00 3.08 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 42 A 7.63 4.35 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 43 T 8.40 5.03 4.00 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 44 N 9.06 4.93 0.00 2.94 2.73 0.00 0.00 6.56 7.17 0.00 0.00 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 Y 8.73 4.75 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 46 N 8.67 4.76 0.00 2.60 2.62 0.00 0.00 6.53 7.88 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 47 A 8.32 3.60 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 G 7.96 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 49 D 7.33 4.69 0.00 2.70 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 50 R 8.08 3.96 0.00 2.04 2.19 0.00 3.13 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 51 S 7.63 4.98 0.00 3.85 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 52 T 8.41 5.12 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 0.65 0.00 0.00 53 D 8.96 5.56 0.00 2.70 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 54 Y 9.14 4.85 0.00 3.01 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 55 G 9.28 4.14 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 0.00 56 I 8.32 3.83 1.69 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.81 0.11 0.00 0.00 57 F 7.97 4.67 0.00 3.23 2.99 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 58 Q 8.03 3.62 0.00 2.51 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.83 0.00 0.00 0.00 0.00 0.00 2.51 2.68 0.00 59 I 8.24 4.38 2.15 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.16 1.18 0.00 0.00 60 N 9.31 5.32 0.00 3.04 3.10 0.00 0.00 7.10 7.99 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 61 A 9.11 4.37 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.82 3.68 0.00 1.61 1.33 0.00 2.68 0.00 0.00 2.89 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.15 0.00 63 Y 7.64 4.26 0.00 1.43 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 W 8.10 4.72 0.00 3.57 3.34 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 65 C 7.92 5.62 0.00 3.12 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 66 N 8.91 4.89 0.00 2.78 2.69 0.00 0.00 7.14 9.17 0.00 0.00 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 D 8.62 4.77 0.00 2.90 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 68 G 8.39 4.09 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 0.00 0.00 0.00 69 K 7.69 4.34 0.00 1.88 1.96 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.48 7.81 70 T 7.58 4.21 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 1.16 0.00 0.00 71 P 0.00 4.27 0.00 2.02 1.97 0.00 3.82 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 72 G 8.46 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 73 A 7.68 4.73 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 74 V 8.32 4.29 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 0.62 0.00 0.00 0.81 0.00 0.00 75 N 8.01 4.95 0.00 2.76 2.61 0.00 0.00 6.76 7.95 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 76 A 8.94 4.02 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 77 C 8.75 4.47 0.00 3.21 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 78 H 7.71 4.00 0.00 3.32 3.39 0.00 5.79 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.41 4.86 0.00 1.66 1.50 0.97 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.30 4.70 0.00 3.83 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 81 C 8.60 4.09 0.00 2.24 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 82 S 7.99 3.88 0.00 3.85 3.83 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 83 A 7.86 4.15 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.84 4.50 0.00 1.93 1.82 1.06 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.69 5.39 0.00 1.80 1.72 1.12 1.21 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 86 Q 7.78 4.40 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 D 8.52 4.39 0.00 2.65 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 88 N 8.02 4.57 0.00 2.70 2.77 0.00 0.00 6.98 7.94 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 89 I 8.48 4.22 1.79 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 1.60 0.37 0.97 0.00 0.00 90 A 8.29 3.94 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 91 D 8.09 4.32 0.00 2.72 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 92 A 7.98 4.11 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 93 V 8.14 3.38 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 0.71 0.00 0.00 0.95 0.00 0.00 94 A 7.93 3.82 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 95 C 8.41 4.23 0.00 3.15 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 96 A 8.08 3.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.62 3.70 0.00 1.62 1.34 0.00 1.29 0.00 0.00 0.78 0.00 0.00 2.24 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.30 1.05 7.81 98 R 7.55 4.06 0.00 1.91 2.13 0.00 3.28 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.96 0.00 99 V 7.28 2.21 1.70 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 -0.30 0.00 0.00 -0.61 0.00 0.00 100 V 7.70 3.86 2.14 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 1.04 0.00 0.00 1.43 0.00 0.00 101 R 7.62 4.12 0.00 2.22 2.02 0.00 3.34 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 102 D 7.34 4.71 0.00 3.10 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.24 0.00 2.15 2.20 0.00 3.77 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 2.00 0.00 104 Q 8.13 4.02 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.84 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.96 3.78 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 0.00 0.00 0.00 106 I 7.79 3.57 1.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.11 -0.72 0.00 0.00 107 R 7.21 4.27 0.00 1.99 2.06 0.00 3.25 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.68 0.00 108 A 7.57 3.92 0.85 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 0.00 0.00 109 W 8.19 4.80 0.00 3.54 3.22 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 0.00 110 V 8.74 3.75 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 1.09 0.00 0.00 1.00 0.00 0.00 111 A 8.29 4.06 1.51 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 0.00 0.00 112 W 8.28 3.95 0.00 3.46 3.51 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 0.00 113 R 8.16 3.60 0.00 2.06 1.96 0.00 3.61 0.00 0.00 3.59 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.05 0.00 114 N 7.98 4.39 0.00 2.66 2.69 0.00 0.00 6.90 6.96 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 0.00 115 R 7.65 4.18 0.00 0.79 1.06 0.00 2.73 0.00 0.00 2.81 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.50 0.00 116 C 7.10 4.54 0.00 1.87 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 0.00 117 Q 6.67 3.25 0.00 0.93 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.79 0.00 0.00 0.00 0.00 0.00 2.12 2.07 0.00 118 N 8.68 4.19 0.00 2.79 2.82 0.00 0.00 6.88 7.66 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 0.00 119 R 7.35 4.51 0.00 1.82 1.80 0.00 3.17 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.56 0.00 120 D 8.45 4.57 0.00 2.65 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 V 8.20 4.63 2.39 0.00 0.00 0.00 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 1.06 0.00 0.00 122 R 8.14 4.05 0.00 1.92 2.02 0.00 3.38 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 123 Q 8.24 3.94 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.90 0.00 0.00 0.00 0.00 0.00 2.08 1.46 0.00 124 Y 7.73 4.27 0.00 3.27 3.19 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 0.00 125 V 7.92 4.37 2.14 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 1.02 0.00 0.00 1.07 0.00 0.00 126 Q 7.52 4.17 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.78 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 127 G 8.84 3.95 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 0.00 0.00 0.00 128 C 8.10 4.43 0.00 3.03 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 0.00 129 G 8.11 3.85 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 0.00 0.00 0.00 130 V 7.86 4.02 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 0.84 0.00 0.00 0.96 0.00 0.00