NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 4.0009 8.3549 109.7411 45.7318 0.0000 172.9362 5 S 4.3753 8.7025 113.8419 60.2166 63.7245 174.8069 6 R 3.8043 8.3011 120.5622 59.4516 31.0644 177.4341 7 R 3.6421 8.0340 116.8067 59.3496 29.8135 176.3750 8 Y 4.4522 7.8648 112.3018 57.6595 38.0008 174.8043 9 D 4.6125 7.6947 120.9059 53.5377 41.1755 176.6042 10 S 4.1443 8.7186 123.6354 59.6586 63.4552 173.9241 11 R 3.7967 8.6758 120.4576 57.0259 26.6513 176.9745 12 T 3.9203 7.8453 107.9300 63.4092 69.8034 175.7499 13 T 4.5409 7.1748 113.2216 61.3163 68.9195 173.4115 14 I 4.4174 7.5064 113.8265 60.0062 40.6592 174.3392 15 F 4.9151 8.3893 119.4979 56.5168 40.1785 176.1465 16 S 4.6396 8.3800 118.1818 55.6814 64.1916 173.5432 17 P 4.2796 0.0000 0.0000 65.5255 31.0365 177.4618 18 E 4.1509 8.0913 115.0961 56.3329 29.8545 176.1480 19 G 3.5159 8.4981 107.1567 46.8144 0.0000 173.6923 20 R 4.6209 8.0417 116.8096 53.7108 33.5463 175.7811 21 L 4.6395 8.0506 120.2549 53.6816 41.8158 177.0115 22 Y 3.7295 7.2855 122.8990 61.5854 37.8762 179.0794 23 Q 3.9854 7.9922 117.7078 59.0028 28.8501 179.1833 24 V 3.5682 7.6365 118.5623 66.1125 31.6632 177.6575 25 E 3.9600 8.1129 118.2351 59.8613 29.2792 179.1272 26 Y 4.4737 8.0622 116.5236 60.9120 37.8337 178.1325 27 A 4.0654 8.6179 122.3911 55.1404 18.4825 179.6740 28 L 3.9439 8.2737 117.7872 57.9222 41.4646 179.3063 29 E 3.9493 8.0749 118.3663 59.1950 29.8535 178.6554 30 S 4.3047 8.2409 113.3170 61.5262 62.5282 176.1356 31 I 3.7325 8.0603 123.1598 64.2796 36.6270 178.2316 32 S 4.2921 8.0411 113.6264 60.5695 62.7603 174.5101 33 H 4.6905 7.7303 117.8144 55.5683 29.4257 174.9732 34 A 4.2654 8.0498 123.4249 51.1507 18.9554 177.5518 35 G 3.9748 8.3870 106.8488 46.3069 0.0000 173.5963 36 T 4.3525 8.5831 119.7476 63.2430 69.8736 173.2615 37 A 5.1788 8.5366 126.4384 50.1927 21.9879 175.2483 38 I 4.5911 9.7049 123.2416 59.3176 41.0889 174.9410 39 G 4.3973 8.6747 111.8140 44.5571 0.0000 171.8857 40 I 4.7133 8.8598 125.9324 59.6900 40.9938 173.9788 41 M 4.6599 8.8387 126.8944 54.2251 33.3290 175.3270 42 A 4.7159 8.6955 131.0231 50.5790 21.6084 176.1308 43 S 4.3871 8.5905 111.1676 60.3745 63.4846 174.6973 44 D 4.8880 9.1328 118.9032 50.6988 39.6082 175.7854 45 G 4.1702 6.9661 108.9291 46.1124 0.0000 171.3840 46 I 5.0755 7.6614 119.2436 59.3028 40.8459 175.6287 47 V 4.4593 8.7394 123.8592 61.1078 34.6058 174.1162 48 L 5.2458 8.7154 126.8547 52.9295 43.9839 175.6652 49 A 4.8520 9.1892 125.3079 50.0939 22.3740 174.5385 50 A 4.7567 8.4734 122.1434 50.2385 22.4964 174.8102 51 E 4.4136 9.1778 122.3091 54.5123 31.4064 175.6428 52 R 4.2328 8.5675 126.6378 55.7840 30.2476 176.2559 53 K 3.9734 8.5795 125.3193 56.8989 32.8820 173.7807 54 V 3.1235 8.5734 129.1202 63.1237 31.9918 171.5951 55 T 4.6160 8.0032 114.2990 61.3444 71.6309 171.9357 56 S 4.5923 8.0381 113.3756 57.5613 65.2405 175.3075 57 T 3.8828 8.5023 120.5187 66.6926 68.1825 175.8989 58 L 4.1916 7.7658 118.6224 55.4756 42.0328 176.8547 59 L 3.9854 7.3305 122.2200 54.5418 42.0786 176.6526 60 E 4.1687 8.6066 127.2381 55.9304 28.1998 176.4297 61 Q 4.1714 8.4089 127.6390 58.5184 29.8066 177.9301 62 D 4.3537 8.2419 117.0378 57.4358 40.8492 177.3593 63 T 4.2574 7.1785 112.9342 63.8895 69.0709 175.1480 63A S 4.4026 7.3422 116.4822 58.3460 63.1354 173.6598 64 T 4.2147 7.8776 118.8153 63.0996 71.6387 173.3480 65 E 4.8609 8.5868 121.5969 55.6350 32.0288 175.7671 66 K 4.6488 7.8218 116.4701 55.7604 35.8315 175.4887 67 L 5.1931 7.6837 119.1545 53.0441 43.7737 175.6753 68 Y 4.7869 8.7857 121.4897 55.8580 41.8849 174.9438 69 K 4.5135 8.8082 124.4400 55.6934 33.1282 176.1140 70 L 4.3536 8.5279 126.6904 56.3435 42.5184 175.6089 71 N 4.9518 7.5111 113.3408 52.5756 41.7791 172.7097 72 D 4.6347 8.6845 115.9997 55.6642 41.4941 177.0329 73 K 4.7260 7.9757 116.5051 55.8571 34.5684 175.4926 74 I 5.2913 7.6707 120.5492 59.6286 41.5086 174.0602 75 A 5.1248 9.1257 126.0877 50.7504 23.2292 175.3330 76 V 4.9551 8.8879 111.5500 59.4695 36.3325 174.5424 77 A 5.2808 9.0501 124.8059 50.3175 21.3677 175.6451 78 V 4.6327 8.9164 122.8265 61.2120 33.8491 175.4199 79 A 4.3167 9.2265 128.1939 53.3309 21.3616 174.1478 80 G 3.7072 8.6779 112.6574 45.2298 0.0000 172.6432 81 L 4.0365 8.4473 125.6365 55.1461 41.6266 177.7802 82 T 3.8524 8.8509 121.6041 66.6966 68.1996 176.1143 83 A 3.9889 7.9597 120.4616 55.3889 18.5925 178.8721 84 D 4.5562 8.1279 116.5176 57.4596 40.9928 178.6222 85 A 3.9993 8.1331 121.2896 55.4335 18.4169 179.4635 86 E 3.8157 8.3147 117.0753 59.4730 29.5062 179.7697 87 I 3.7151 7.5133 119.8952 64.4546 37.2345 178.4930 88 L 3.8514 7.7350 119.2011 57.6221 41.4424 179.2287 89 I 3.5008 8.1272 120.2004 64.4468 37.1289 177.8953 90 N 4.2698 8.1283 117.7450 56.9953 38.8601 177.0391 91 T 3.9087 7.8020 110.4347 64.5059 68.8167 176.3688 92 A 3.9429 8.3165 124.0801 55.2332 18.3281 179.7646 93 R 3.9185 8.3150 116.9118 59.4678 29.9600 179.4942 94 I 3.7767 7.6732 119.5622 64.4860 37.1249 177.7387 95 H 4.1625 8.3677 118.9240 59.2634 29.6338 177.0478 96 A 3.9747 7.9623 122.2983 55.4809 18.1615 179.7310 97 Q 4.0295 7.9746 116.4575 58.9383 28.7416 178.6589 98 N 4.3297 8.5515 118.1554 56.2767 38.5125 176.7690 99 Y 3.9059 8.1903 121.0119 60.5270 38.8964 177.7743 100 L 4.5676 8.1723 122.5995 57.7551 42.0169 178.9170 101 K 3.9689 8.1346 118.3883 59.6757 32.1201 178.6012 102 T 3.7960 7.6693 115.3549 65.7602 68.5313 175.6278 103 Y 4.5028 7.4936 115.0292 56.3106 39.7218 175.1432 104 N 4.3569 8.5857 116.7935 53.5301 36.8853 173.7923 105 E 4.8439 7.6343 114.3650 55.0656 34.0110 175.0315 106 D 4.7238 8.5455 121.7185 53.8383 41.6224 176.3683 107 I 2.6213 8.1539 123.4858 59.7767 38.4136 174.5234 108 P 4.1437 0.0000 0.0000 62.5592 32.9507 177.0804 109 V 3.4788 8.1626 121.6952 66.3885 31.3616 178.2094 110 E 3.7656 7.9371 118.0724 59.2569 29.6395 178.3490 111 I 3.6222 7.6419 119.3815 64.5405 37.1457 177.9470 112 L 3.9720 7.4763 120.8874 58.0506 41.8161 179.1940 113 V 3.0251 7.2903 117.8691 65.6616 31.2527 178.0410 114 R 3.7901 8.2835 119.0377 59.1435 29.8813 178.3893 115 R 3.7902 7.7332 118.0781 59.4391 30.2290 178.3019 116 L 3.9444 7.7372 118.5274 58.1828 41.6028 179.9404 117 S 4.2256 8.3581 115.1013 61.6544 62.7871 176.5049 118 D 4.3748 8.3899 122.0772 57.2908 40.2866 178.8628 119 I 3.8332 7.5556 119.5737 64.2567 37.2775 178.2880 120 K 4.2368 7.9890 119.1102 59.7182 31.9589 179.0365 121 Q 4.1296 8.5146 120.0506 59.1445 28.7426 178.9293 122 G 3.5996 7.9997 106.2436 47.9902 0.0000 174.9395 123 Y 4.0846 7.9308 115.6919 59.2026 37.7578 177.3632 124 T 4.3660 7.6640 116.8688 63.8082 69.7043 174.9197 125 Q 4.4346 7.8088 119.7181 56.1986 30.9285 174.2688 126 H 4.6855 7.6619 110.6593 55.1073 30.2444 173.1555 127 G 3.8081 8.7595 108.2508 44.0576 0.0000 174.6364 128 G 4.1124 7.8079 105.8629 46.4108 0.0000 173.1125 129 L 4.7790 6.9446 118.4492 51.9698 44.2289 176.9183 130 R 4.1216 8.1775 116.9787 55.4069 30.1261 174.7577 131 P 4.5495 0.0000 0.0000 62.0798 32.2552 175.8256 132 F 4.3651 8.5843 118.6363 57.3090 40.1621 177.3924 133 G 4.0347 9.0233 115.2610 45.2743 0.0000 172.9507 134 V 4.8300 7.3206 117.6023 61.2538 35.7817 175.3955 135 S 4.6714 8.4190 121.5935 56.7222 66.4444 173.0852 136 F 5.3631 8.8342 121.9242 55.6936 42.2278 174.8601 137 I 4.5581 8.3601 121.7516 59.9448 39.9998 174.0056 138 Y 5.1159 8.9770 124.8180 56.2919 39.7815 175.0586 139 A 4.7447 9.2526 126.2212 50.2724 21.7038 175.2928 140 G 5.1080 8.5345 108.2561 45.7755 0.0000 170.9014 141 Y 4.9651 8.3811 120.0823 55.8495 41.6713 173.8521 142 D 4.6639 7.4766 124.0665 51.6199 42.5376 174.7396 143 D 4.5000 8.5347 117.6598 53.7844 39.2776 176.3443 144 R 4.0923 8.5894 126.2679 56.7801 30.1168 175.2899 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 G 8.35 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 0.00 0.00 0.00 0.00 5 S 8.70 4.38 0.00 4.04 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 6 R 8.30 3.80 0.00 1.83 1.93 0.00 3.17 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 7 R 8.03 3.64 0.00 1.49 1.09 0.00 2.23 0.00 0.00 2.91 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.34 0.00 8 Y 7.86 4.45 0.00 2.96 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 9 D 7.69 4.61 0.00 2.71 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 10 S 8.72 4.14 0.00 3.91 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 11 R 8.68 3.80 0.00 2.00 1.98 0.00 3.12 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 12 T 7.85 3.92 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 13 T 7.17 4.54 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 1.17 0.00 0.00 14 I 7.51 4.42 1.95 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.31 0.98 0.00 0.00 15 F 8.39 4.92 0.00 3.09 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 16 S 8.38 4.64 0.00 3.68 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 17 P 0.00 4.28 0.00 2.09 2.19 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 18 E 8.09 4.15 0.00 1.88 1.95 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 2.28 2.34 0.00 19 G 8.50 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 4.62 0.00 1.64 1.67 0.00 3.05 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 21 L 8.05 4.64 0.00 1.59 1.49 0.83 0.23 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 22 Y 7.29 3.73 0.00 2.86 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.99 3.99 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 24 V 7.64 3.57 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 1.15 0.00 0.00 0.92 0.00 0.00 25 E 8.11 3.96 0.00 1.96 2.02 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 2.42 2.38 0.00 26 Y 8.06 4.47 0.00 3.00 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 27 A 8.62 4.07 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 28 L 8.27 3.94 0.00 1.94 1.75 0.93 1.06 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 29 E 8.07 3.95 0.00 2.05 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 2.36 2.43 0.00 30 S 8.24 4.30 0.00 3.98 4.03 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 31 I 8.06 3.73 1.97 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.67 0.94 0.00 0.00 32 S 8.04 4.29 0.00 3.95 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 33 H 7.73 4.69 0.00 3.30 3.35 0.00 5.65 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 34 A 8.05 4.27 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 35 G 8.39 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 36 T 8.58 4.35 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 1.21 0.00 0.00 37 A 8.54 5.18 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 38 I 9.70 4.59 1.88 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 1.17 0.82 0.92 0.00 0.00 39 G 8.67 4.40 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 0.00 40 I 8.86 4.71 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.72 0.92 0.00 0.00 41 M 8.84 4.66 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.55 0.00 42 A 8.70 4.72 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 43 S 8.59 4.39 0.00 4.01 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 44 D 9.13 4.89 0.00 2.76 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 45 G 6.97 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.66 5.08 1.91 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 1.28 0.78 0.94 0.00 0.00 47 V 8.74 4.46 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 1.06 0.00 0.00 0.94 0.00 0.00 48 L 8.72 5.25 0.00 1.53 1.55 0.94 0.77 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 49 A 9.19 4.85 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 50 A 8.47 4.76 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 51 E 9.18 4.41 0.00 2.01 1.82 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 2.24 2.27 0.00 52 R 8.57 4.23 0.00 1.83 1.96 0.00 3.25 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.60 0.00 53 K 8.58 3.97 0.00 1.79 1.72 0.00 2.06 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 V 8.57 3.12 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 8.00 4.62 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 1.21 0.00 0.00 56 S 8.04 4.59 0.00 3.83 3.69 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 57 T 8.50 3.88 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 1.21 0.00 0.00 58 L 7.77 4.19 0.00 1.63 1.71 0.92 0.88 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 59 L 7.33 3.99 0.00 1.54 1.70 0.92 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.61 4.17 0.00 2.08 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 2.37 2.35 0.00 61 Q 8.41 4.17 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.51 6.66 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 62 D 8.24 4.35 0.00 2.68 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 63 T 7.18 4.26 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 1.21 0.00 0.00 63A S 7.34 4.40 0.00 3.96 3.73 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 64 T 7.88 4.21 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 0.58 0.00 0.00 65 E 8.59 4.86 0.00 2.05 2.00 0.00 0.00 0.00 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 2.30 0.00 66 K 7.82 4.65 0.00 1.64 1.81 0.00 1.67 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.43 7.81 67 L 7.68 5.19 0.00 1.34 1.47 0.91 0.72 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 68 Y 8.79 4.79 0.00 2.88 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 69 K 8.81 4.51 0.00 1.74 1.76 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.50 7.81 70 L 8.53 4.35 0.00 1.85 1.69 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.51 4.95 0.00 2.62 2.77 0.00 0.00 6.97 8.47 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 72 D 8.68 4.63 0.00 2.73 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 73 K 7.98 4.73 0.00 1.72 2.02 0.00 1.68 0.00 0.00 2.10 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.47 7.81 74 I 7.67 5.29 1.89 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 1.29 0.69 0.97 0.00 0.00 75 A 9.13 5.12 1.21 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 76 V 8.89 4.96 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 0.19 0.00 0.00 0.89 0.00 0.00 77 A 9.05 5.28 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 78 V 8.92 4.63 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 0.66 0.00 0.00 1.26 0.00 0.00 79 A 9.23 4.32 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00 80 G 8.68 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 0.00 0.00 0.00 81 L 8.45 4.04 0.00 1.67 1.65 0.92 1.19 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 82 T 8.85 3.85 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 1.33 0.00 0.00 83 A 7.96 3.99 1.31 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 0.00 0.00 84 D 8.13 4.56 0.00 2.94 2.94 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 85 A 8.13 4.00 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 86 E 8.31 3.82 0.00 2.12 1.95 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 2.01 2.44 0.00 87 I 7.51 3.72 2.16 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 1.77 1.31 1.02 0.00 0.00 88 L 7.74 3.85 0.00 1.90 1.64 0.49 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.13 3.50 1.82 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.59 0.78 0.00 0.00 90 N 8.13 4.27 0.00 2.82 2.94 0.00 0.00 7.04 6.53 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 91 T 7.80 3.91 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 1.24 0.00 0.00 92 A 8.32 3.94 1.33 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 93 R 8.31 3.92 0.00 1.99 2.01 0.00 3.13 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.93 0.00 94 I 7.67 3.78 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.72 0.94 0.00 0.00 95 H 8.37 4.16 0.00 3.26 3.47 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.96 3.97 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 97 Q 7.97 4.03 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 98 N 8.55 4.33 0.00 2.91 2.87 0.00 0.00 6.55 8.14 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 99 Y 8.19 3.91 0.00 3.15 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 0.00 100 L 8.17 4.57 0.00 1.98 1.89 1.05 0.33 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 0.00 101 K 8.13 3.97 0.00 1.85 1.91 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.45 7.81 102 T 7.67 3.80 3.59 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 0.23 0.00 0.00 103 Y 7.49 4.50 0.00 2.60 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 0.00 104 N 8.59 4.36 0.00 2.84 2.91 0.00 0.00 6.74 7.24 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 0.00 105 E 7.63 4.84 0.00 2.17 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 2.36 2.56 0.00 106 D 8.55 4.72 0.00 2.70 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.15 2.62 1.55 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.36 0.77 0.00 0.00 108 P 0.00 4.14 0.00 1.99 1.82 0.00 2.90 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.02 0.00 109 V 8.16 3.48 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 0.92 0.00 0.00 0.89 0.00 0.00 110 E 7.94 3.77 0.00 1.97 1.82 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 2.28 2.30 0.00 111 I 7.64 3.62 1.79 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 1.47 0.63 0.87 0.00 0.00 112 L 7.48 3.97 0.00 1.57 1.68 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.29 3.03 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 0.43 0.00 0.00 -0.04 0.00 0.00 114 R 8.28 3.79 0.00 1.80 1.98 0.00 3.13 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.60 0.00 115 R 7.73 3.79 0.00 1.95 1.97 0.00 3.10 0.00 0.00 2.82 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.57 0.00 116 L 7.74 3.94 0.00 1.87 1.75 0.72 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.36 4.23 0.00 3.99 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 0.00 118 D 8.39 4.37 0.00 2.97 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 0.00 119 I 7.56 3.83 2.02 0.00 0.00 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 1.57 0.64 0.96 0.00 0.00 120 K 7.99 4.24 0.00 2.09 1.94 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.43 1.50 7.81 121 Q 8.51 4.13 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 122 G 8.00 3.60 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 0.00 0.00 0.00 123 Y 7.93 4.08 0.00 3.12 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 0.00 124 T 7.66 4.37 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 1.15 0.00 0.00 125 Q 7.81 4.43 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.21 0.00 126 H 7.66 4.69 0.00 3.18 3.21 0.00 5.74 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 0.00 127 G 8.76 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 0.00 128 G 7.81 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 6.94 4.78 0.00 1.85 1.63 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.18 4.12 0.00 1.91 1.92 0.00 3.00 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 131 P 0.00 4.55 0.00 2.10 2.11 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 132 F 8.58 4.37 0.00 2.85 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 0.00 133 G 9.02 4.03 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 0.00 134 V 7.32 4.83 1.80 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 -0.21 0.00 0.00 0.83 0.00 0.00 135 S 8.42 4.67 0.00 3.83 3.63 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 0.00 136 F 8.83 5.36 0.00 2.56 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 0.00 0.00 0.00 137 I 8.36 4.56 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.71 0.95 0.00 0.00 138 Y 8.98 5.12 0.00 2.76 2.86 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 0.00 139 A 9.25 4.74 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 0.00 140 G 8.53 5.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.38 4.97 0.00 2.97 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 0.00 142 D 7.48 4.66 0.00 2.60 2.42 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 0.00 143 D 8.53 4.50 0.00 2.82 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 0.00 144 R 8.59 4.09 0.00 1.64 1.83 0.00 3.23 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00