NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *4 F 4.3952 8.1827 120.9040 57.4991 41.5696 176.3593 5 S 4.1425 8.4558 106.8668 60.0131 63.3915 174.3665 6 K 4.8349 9.9795 116.2384 54.6852 34.3191 173.8991 7 I 4.3881 8.2685 127.8814 59.2941 40.8774 174.5881 8 E 4.4792 8.5891 126.7891 55.4681 30.0726 177.9821 9 S 4.9658 8.8040 118.8569 61.1599 63.3077 176.2017 10 E 4.4758 8.4766 118.6464 58.4750 29.6363 177.0573 11 E 4.2674 7.9387 119.3164 56.2670 29.9338 175.9583 12 Y 3.6872 7.2581 115.4810 57.1874 38.5131 175.3209 13 N 4.6026 8.6234 117.8426 55.1248 39.9954 174.9027 14 S 4.8511 7.6077 111.6607 57.7516 66.2996 172.4703 15 L 4.8021 7.9086 120.4472 55.0383 42.9493 173.9101 16 K 4.2466 7.9165 120.3009 55.1749 34.6461 174.8719 17 S 4.9648 7.8367 120.7919 58.0762 64.9389 176.3902 18 S 4.7629 8.8275 117.7169 58.0694 63.3297 174.6139 19 T 4.4499 7.5773 109.3784 62.4264 70.7747 174.4207 20 I 4.1165 7.5408 121.6760 61.5358 37.7989 175.6431 21 Q 4.6324 8.7576 122.5539 54.6691 33.8370 173.8872 22 T 4.9202 8.5251 118.4677 63.2269 69.4716 174.2516 23 I 4.6166 8.9442 119.8900 58.8381 41.4776 174.3820 24 G 4.3444 8.6469 109.8129 45.5968 0.0000 173.4159 25 T 4.7015 8.3035 114.6941 59.1238 71.5845 174.2818 26 S 4.1487 7.9749 117.4036 60.1116 63.4883 173.8311 27 D 4.2566 9.1402 119.2040 55.8893 37.5491 175.4617 28 G 3.9182 8.4007 103.9351 46.0275 0.0000 174.3061 29 G 3.8552 7.4637 109.7618 44.7375 0.0000 172.4400 30 S 5.1143 7.8225 112.6983 56.4192 65.7226 172.6421 31 G 4.2046 8.1217 107.8301 47.1432 0.0000 171.6605 32 I 5.1173 8.3957 120.4718 59.7976 40.4139 175.8530 33 G 4.1606 8.6139 112.1582 45.7175 0.0000 170.9729 34 Y 3.6335 7.7790 112.6427 58.8665 35.6796 170.5670 35 I 4.3810 7.1328 118.9437 60.2446 39.1089 175.4701 36 E 4.8835 8.7754 122.7004 53.8215 33.0338 175.2691 37 S 4.3161 8.6763 114.8157 60.4738 62.5880 173.7564 38 G 4.1900 9.3610 116.0423 45.6914 0.0000 173.7069 39 D 4.8707 8.1726 119.1860 55.0218 42.2893 175.2064 40 Y 6.1945 8.1936 116.3942 57.0146 41.8020 173.4280 41 L 5.1325 9.0794 120.3145 53.0667 45.4729 175.3023 42 V 4.3945 8.4719 121.9622 61.0878 34.4442 174.3222 43 F 5.2009 9.3501 126.8203 55.2907 40.8346 174.2129 44 N 4.6588 9.8961 121.6883 53.6852 39.0561 175.7188 45 K 3.9113 9.2279 120.7139 57.5798 30.3542 175.1381 46 I 3.9546 8.7241 121.4814 60.6281 38.3752 175.5873 47 N 5.2708 8.3363 123.6535 52.0068 38.9058 174.3171 48 F 4.2699 9.9046 125.2153 57.4096 40.4581 177.4772 49 G 3.8101 8.2837 111.2835 46.6522 0.0000 177.6242 50 N 4.3144 8.9858 121.5631 54.5287 38.5483 174.0072 51 G 4.8876 6.3928 103.6816 43.1113 0.0000 172.3516 52 A 5.0378 8.2599 121.7639 50.2294 22.8512 176.1472 53 N 5.4024 9.5532 117.1560 52.3272 39.5780 173.6043 54 S 5.2188 8.2443 113.3739 56.9326 66.7674 172.1333 55 F 5.2887 9.3468 127.1359 56.2925 42.4963 173.3447 56 K 4.8908 8.5431 126.7121 54.4393 35.5101 174.5755 57 A 4.8571 8.5528 127.8555 50.0423 22.9846 174.9024 58 R 4.6125 8.4141 122.8618 55.4438 30.9335 175.6621 59 V 5.2657 8.8221 119.1544 59.6075 36.5036 174.6484 60 A 4.7378 8.8141 122.9767 50.4121 22.6682 175.4011 61 S 3.7650 8.5638 115.4149 56.5005 66.1557 174.7289 62 G 3.0464 5.3800 114.7019 44.5602 0.0000 172.9328 63 A 4.3607 6.4827 122.1234 51.6774 18.8212 178.3461 64 D 4.6847 8.5443 118.1726 53.9303 40.1589 176.4340 65 T 4.7046 7.2808 108.9738 59.2127 71.7895 171.6682 66 P 4.6744 0.0000 0.0000 63.4019 32.4242 175.4637 67 T 4.7804 8.6535 117.3533 61.9886 71.8694 172.7020 68 N 5.3729 9.4203 122.8729 51.7457 41.6402 174.2352 69 I 4.4315 8.6796 123.7442 59.5426 39.5543 174.8183 70 Q 4.4303 8.8320 127.4476 55.3496 30.4127 175.5020 71 L 4.8951 8.7969 123.5139 53.2711 43.7926 175.7384 72 R 5.6769 8.7213 122.6738 53.3774 34.0932 174.9102 73 L 4.9834 8.3566 120.4823 54.5789 44.4571 176.8750 74 G 4.1763 10.5361 116.5303 45.3841 0.0000 173.7088 75 S 3.5702 6.8023 112.2699 55.0986 65.8855 172.8946 76 P 3.8474 0.0000 0.0000 64.7361 30.9075 177.5022 77 T 4.3196 7.0637 106.1028 60.7548 69.0994 174.1608 78 G 4.3262 7.6931 110.2014 45.8789 0.0000 173.2674 79 T 3.8688 8.3947 115.5601 64.1611 69.3662 173.5842 80 L 4.7600 8.5175 129.4732 54.5267 42.1987 176.0695 81 I 4.1285 8.6691 120.8848 60.6540 39.2098 175.5492 82 G 4.2998 7.1633 110.8389 46.7606 0.0000 172.1253 83 T 5.0150 8.1940 116.1628 61.7817 72.3683 173.2649 84 L 4.5506 8.8482 129.6457 53.9947 43.7221 175.1544 85 T 4.9032 8.4837 123.4282 61.8976 69.9652 174.5912 86 V 4.2528 9.1897 127.5045 61.0176 32.7508 174.9234 87 A 4.5143 8.3961 129.4948 50.8741 19.5075 176.7681 88 S 3.9744 8.5618 113.8251 59.3185 62.6959 174.3041 89 T 4.2816 8.5419 116.0239 61.2709 68.6018 175.5185 90 G 3.7973 8.3834 110.4953 44.8928 0.0000 174.0517 91 G 3.8575 6.6222 109.3787 45.0098 0.0000 174.0447 92 W 4.2292 8.3957 119.4151 58.2058 29.2920 176.9923 93 N 5.1060 8.0359 114.2436 53.0618 38.8442 174.9288 94 N 4.8004 7.2557 118.2213 52.2447 37.1964 173.4613 95 Y 4.6643 8.2125 119.5101 57.4116 39.4724 174.2806 96 E 4.7783 9.0859 120.0095 55.1417 33.8194 173.6034 97 E 4.8432 8.6622 120.4701 55.5168 30.6265 175.9568 98 K 4.7574 8.8708 123.7612 54.6850 35.6500 175.4589 99 S 5.4086 8.5648 118.0759 57.2095 66.9085 172.8673 100 C 4.9721 8.9871 115.8201 57.0117 33.2063 173.4749 101 S 5.1961 8.6429 115.1216 57.9546 64.2707 172.9248 102 I 4.9242 8.2383 113.2697 59.0644 40.7662 174.9004 103 T 3.9157 8.3964 118.4805 61.9249 67.9832 172.9943 104 N 4.4361 8.8577 126.5382 55.0228 39.6025 173.6601 105 T 4.6062 8.8081 123.5382 61.8413 71.2901 173.7489 106 T 4.8753 7.9588 114.6575 60.9177 72.8255 174.6649 107 G 3.8399 8.9243 111.2890 44.8319 0.0000 171.5552 108 Q 5.1718 8.3155 119.3393 55.3848 30.3242 175.3409 109 H 5.0417 9.7148 121.8464 54.7635 34.3788 171.9186 110 D 5.0511 8.8563 120.2152 53.4671 42.5494 175.2109 111 L 5.1360 9.0862 126.5559 54.0824 44.2104 174.6128 112 Y 5.1730 9.1977 123.5092 56.1509 41.4478 174.4885 113 L 4.9468 9.0667 123.8779 53.0563 44.3757 175.4176 114 V 4.7867 8.3248 124.9002 61.2247 33.6824 174.4268 115 F 5.4285 9.2694 126.9960 56.2178 40.9346 176.5720 116 S 4.5744 8.7693 116.5324 58.5812 63.8470 174.1324 117 G 4.0181 7.4110 106.8576 45.0958 0.0000 170.6167 118 P 4.9433 0.0000 0.0000 62.4904 31.9412 176.2636 119 V 4.5955 7.8589 118.7854 61.5491 33.6323 170.8870 120 N 5.3103 8.9864 120.2644 51.7095 41.3707 173.6863 121 I 4.9480 8.6837 122.7211 59.8935 41.3186 174.5963 122 D 4.6109 9.5724 130.7159 56.1309 41.8655 175.4049 123 Y 5.3547 6.9504 114.0065 56.1351 41.6550 172.2206 124 F 5.3583 8.6115 114.0451 55.4338 41.9558 173.5632 125 I 5.7162 8.8765 120.3161 58.6007 41.5097 174.2014 126 F 5.4950 8.5386 123.6898 56.1511 41.1845 174.5493 127 D 4.9929 9.1907 122.2802 53.0647 45.6147 174.8339 128 S 4.9655 8.4642 114.1458 56.4689 64.2187 174.8239 129 N 4.5283 8.5197 120.2006 53.3606 38.3139 175.2860 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 *4 F 8.18 4.40 0.00 1.99 2.37 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 4.14 0.00 3.97 3.25 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 6 K 9.98 4.83 0.00 1.61 1.50 0.00 1.31 0.00 0.00 1.35 0.00 0.00 2.40 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.00 1.05 7.81 7 I 8.27 4.39 0.56 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.51 0.56 0.00 0.00 8 E 8.59 4.48 0.00 2.03 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 0.00 2.32 2.34 0.00 9 S 8.80 4.97 0.00 4.61 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 10 E 8.48 4.48 0.00 2.25 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 0.00 2.43 2.33 0.00 11 E 7.94 4.27 0.00 2.28 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 2.26 2.25 0.00 12 Y 7.26 3.69 0.00 2.91 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 13 N 8.62 4.60 0.00 2.61 2.94 0.00 0.00 6.69 7.59 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 14 S 7.61 4.85 0.00 3.91 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 15 L 7.91 4.80 0.00 1.50 1.13 0.80 -0.28 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 16 K 7.92 4.25 0.00 0.87 0.74 0.00 1.64 0.00 0.00 1.46 0.00 0.00 2.55 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.10 1.18 7.81 17 S 7.84 4.96 0.00 3.79 3.54 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 18 S 8.83 4.76 0.00 3.95 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 7.58 4.45 4.32 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 1.23 0.00 0.00 20 I 7.54 4.12 1.76 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.98 0.80 0.00 0.00 21 Q 8.76 4.63 0.00 1.88 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.97 0.00 0.00 0.00 0.00 0.00 2.13 2.29 0.00 22 T 8.53 4.92 4.29 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 1.34 0.00 0.00 23 I 8.94 4.62 1.99 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.91 1.10 0.00 0.00 24 G 8.65 4.34 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 0.00 25 T 8.30 4.70 3.35 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 1.17 0.00 0.00 26 S 7.97 4.15 0.00 3.79 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 27 D 9.14 4.26 0.00 2.85 2.74 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 28 G 8.40 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.46 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.82 5.11 0.00 3.81 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 31 G 8.12 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 32 I 8.40 5.12 1.98 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.39 0.85 0.00 0.00 33 G 8.61 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 34 Y 7.78 3.63 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 7.13 4.38 1.63 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 1.01 0.75 0.60 0.00 0.00 36 E 8.78 4.88 0.00 1.97 1.78 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 2.19 2.17 0.00 37 S 8.68 4.32 0.00 3.97 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.36 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 39 D 8.17 4.87 0.00 2.80 2.59 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 40 Y 8.19 6.19 0.00 3.29 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 41 L 9.08 5.13 0.00 2.03 1.59 1.32 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.47 4.39 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 0.36 0.00 0.00 0.80 0.00 0.00 43 F 9.35 5.20 0.00 3.17 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 44 N 9.90 4.66 0.00 2.73 2.80 0.00 0.00 7.24 8.09 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 45 K 9.23 3.91 0.00 1.82 1.85 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.44 7.81 46 I 8.72 3.95 1.87 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.06 0.33 0.00 0.00 47 N 8.34 5.27 0.00 2.66 2.72 0.00 0.00 7.15 7.02 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 48 F 9.90 4.27 0.00 3.14 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 49 G 8.28 3.81 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 0.00 0.00 0.00 50 N 8.99 4.31 0.00 2.76 2.92 0.00 0.00 6.75 7.65 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 51 G 6.39 4.89 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 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.26 5.04 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.55 5.40 0.00 2.80 3.02 0.00 0.00 6.18 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 54 S 8.24 5.22 0.00 3.98 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 55 F 9.35 5.29 0.00 3.13 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 56 K 8.54 4.89 0.00 1.70 1.43 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.24 1.40 7.81 57 A 8.55 4.86 1.03 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 0.00 0.00 58 R 8.41 4.61 0.00 0.96 0.88 0.00 2.90 0.00 0.00 2.88 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 59 V 8.82 5.27 2.17 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 0.74 0.00 0.00 0.98 0.00 0.00 60 A 8.81 4.74 0.03 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 0.00 0.00 61 S 8.56 3.76 0.00 3.71 3.40 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 62 G 5.38 3.05 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 0.00 0.00 0.00 0.00 0.00 0.00 63 A 6.48 4.36 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 64 D 8.54 4.68 0.00 2.80 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 7.28 4.70 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 66 P 0.00 4.67 0.00 2.10 2.08 0.00 3.70 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 1.99 2.00 0.00 67 T 8.65 4.78 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 1.42 0.00 0.00 68 N 9.42 5.37 0.00 2.59 2.69 0.00 0.00 6.63 7.29 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 69 I 8.68 4.43 1.83 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.89 0.49 0.00 0.00 70 Q 8.83 4.43 0.00 1.88 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 71 L 8.80 4.90 0.00 1.36 1.40 -0.03 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 72 R 8.72 5.68 0.00 1.65 1.64 0.00 3.03 0.00 0.00 3.16 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.31 0.00 73 L 8.36 4.98 0.00 1.48 1.50 0.47 0.76 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 74 G 10.54 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 0.00 0.00 0.00 0.00 75 S 6.80 3.57 0.00 3.65 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 76 P 0.00 3.85 0.00 1.86 1.73 0.00 3.27 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.34 0.00 77 T 7.06 4.32 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 78 G 7.69 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 0.00 0.00 0.00 0.00 79 T 8.39 3.87 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 1.13 0.00 0.00 80 L 8.52 4.76 0.00 1.59 1.54 0.87 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.67 4.13 1.75 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.62 0.79 0.00 0.00 82 G 7.16 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 83 T 8.19 5.01 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 1.18 0.00 0.00 84 L 8.85 4.55 0.00 1.95 1.65 1.01 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.48 4.90 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 1.26 0.00 0.00 86 V 9.19 4.25 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 0.92 0.00 0.00 0.99 0.00 0.00 87 A 8.40 4.51 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 88 S 8.56 3.97 0.00 3.84 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 89 T 8.54 4.28 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 90 G 8.38 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 91 G 6.62 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 W 8.40 4.23 0.00 3.27 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 93 N 8.04 5.11 0.00 2.73 2.91 0.00 0.00 6.90 8.00 0.00 0.00 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 N 7.26 4.80 0.00 2.59 2.71 0.00 0.00 6.90 8.36 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 95 Y 8.21 4.66 0.00 2.83 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 96 E 9.09 4.78 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.25 0.00 97 E 8.66 4.84 0.00 1.86 1.90 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 2.23 2.34 0.00 98 K 8.87 4.76 0.00 1.66 1.66 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.35 7.81 99 S 8.56 5.41 0.00 3.70 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 0.00 100 C 8.99 4.97 0.00 3.01 3.04 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 0.00 101 S 8.64 5.20 0.00 3.94 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 0.00 102 I 8.24 4.92 1.97 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.79 1.05 0.00 0.00 103 T 8.40 3.92 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 1.18 0.00 0.00 104 N 8.86 4.44 0.00 2.75 2.74 0.00 0.00 6.90 7.70 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 0.00 105 T 8.81 4.61 3.61 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 0.05 0.00 0.00 106 T 7.96 4.88 4.42 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 1.29 0.00 0.00 107 G 8.92 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 0.00 0.00 0.00 108 Q 8.32 5.17 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 109 H 9.71 5.04 0.00 3.22 3.19 0.00 5.66 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.86 5.05 0.00 2.86 2.74 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 0.00 111 L 9.09 5.14 0.00 2.03 1.94 1.13 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 112 Y 9.20 5.17 0.00 2.96 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 0.00 113 L 9.07 4.95 0.00 1.60 1.13 0.78 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.32 4.79 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 1.16 0.00 0.00 0.92 0.00 0.00 115 F 9.27 5.43 0.00 3.13 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 0.00 116 S 8.77 4.57 0.00 3.94 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 0.00 117 G 7.41 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 0.00 118 P 0.00 4.94 0.00 2.18 2.08 0.00 3.50 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.90 0.00 119 V 7.86 4.60 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 0.81 0.00 0.00 1.10 0.00 0.00 120 N 8.99 5.31 0.00 2.80 2.99 0.00 0.00 6.56 6.86 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 0.00 121 I 8.68 4.95 2.11 0.00 0.00 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 1.37 2.01 1.14 0.00 0.00 122 D 9.57 4.61 0.00 2.47 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 0.00 0.00 0.00 0.00 123 Y 6.95 5.35 0.00 3.02 3.13 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 0.00 124 F 8.61 5.36 0.00 2.55 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 0.00 125 I 8.88 5.72 1.80 0.00 0.00 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 1.14 1.24 1.00 0.00 0.00 126 F 8.54 5.50 0.00 3.20 3.07 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 0.00 0.00 0.00 0.00 127 D 9.19 4.99 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.46 4.97 0.00 3.78 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 0.00 129 N 8.52 4.53 0.00 2.73 2.77 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 * Residues marked with a * may have inaccurate shift predictions.