NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.9819 8.2833 118.1888 52.3706 38.9083 174.5915 2 L 4.0290 8.0866 117.3420 57.0310 41.2518 174.7744 3 V 3.6292 8.6608 119.4509 65.8528 32.0239 177.3341 4 N 4.4639 8.3999 116.2423 56.3499 38.3140 177.0206 5 F 4.4718 8.2421 121.9564 61.8176 39.4733 176.5589 6 H 3.9216 8.4563 117.7283 59.3035 29.6393 177.4918 7 R 3.9787 8.1969 119.8742 59.2911 29.9479 178.3737 8 M 4.0127 8.5832 118.4141 59.0114 32.0770 178.3655 9 I 3.6499 7.9180 119.9766 64.2271 37.1895 178.3138 10 K 4.1159 7.8362 121.7506 58.9950 31.7568 178.8493 11 L 4.0392 7.9516 118.6525 57.7364 41.6099 178.9899 12 T 4.2400 7.7424 108.4199 63.4896 69.2849 176.1696 13 T 4.4477 8.2595 110.8120 60.6585 70.3711 175.7323 14 G 3.9373 8.2159 108.8416 45.1775 0.0000 173.5632 15 K 4.1700 7.4233 119.7861 55.0869 33.5230 175.8344 16 E 4.3035 8.4161 122.9653 54.8911 29.5935 176.7587 17 A 4.0461 8.5012 130.5550 55.2092 18.5534 179.1057 18 A 3.9942 8.3420 118.3626 55.0508 18.8056 179.3349 19 L 4.4855 8.4421 114.7456 57.3257 42.5212 178.5891 20 S 4.1143 7.9480 113.5090 61.0381 62.9623 174.7945 21 Y 4.7307 8.0555 115.3609 57.4324 39.4074 177.6743 22 G 3.4447 7.9703 108.3062 47.1800 0.0000 174.8180 23 F 5.0314 7.8124 114.7923 57.1719 41.9314 173.3103 24 Y 4.5449 7.6241 122.9412 58.4780 39.7145 176.2648 25 G 3.5536 8.0171 116.5310 47.4529 0.0000 173.8798 26 C 4.7440 9.7276 117.6285 57.6468 41.0165 174.5441 27 H 4.7819 8.7085 113.8291 55.1003 30.5102 172.8909 28 C 4.4826 8.2192 118.2745 58.1654 40.3397 171.8387 29 G 3.6796 8.7575 110.7345 44.4331 0.0000 172.2206 30 V 3.5682 8.3858 119.6743 63.9213 32.2513 178.2430 31 G 3.8812 8.6639 116.9295 47.2031 0.0000 172.2505 32 G 5.0617 7.9805 116.1526 45.7620 0.0000 171.9374 33 R 4.5472 7.8741 118.9808 55.6509 32.7404 176.4497 34 G 4.0768 9.0128 108.3886 45.3040 0.0000 172.5790 35 S 4.8508 8.6509 114.6203 56.9007 63.8355 172.3143 36 P 4.7979 0.0000 0.0000 62.4697 31.8432 176.8161 37 K 3.8556 8.9265 123.0530 58.9311 32.6625 175.9395 38 D 4.4424 7.4176 119.7452 51.6305 40.8005 176.0693 39 A 4.0584 8.8124 117.9230 55.7410 18.7610 179.5652 40 T 4.0773 7.9588 113.9421 66.7636 68.6953 176.3627 41 D 4.4483 8.7921 120.2273 57.3435 41.3351 178.5149 42 R 3.9395 7.7866 118.7751 59.3437 30.0780 178.2704 43 C 4.2069 7.9082 116.4918 60.0787 40.2851 175.6251 44 C 4.2398 8.0454 117.8663 59.7192 39.5462 176.0322 45 V 3.4770 7.7073 119.3684 66.4704 31.1152 178.0533 46 T 3.8227 7.6809 114.9548 66.9020 68.2736 176.1891 47 H 4.0203 8.0740 120.0081 59.2420 29.8150 177.0928 48 D 4.3037 8.3555 121.0517 57.4274 40.6867 178.1430 49 C 4.3108 8.1419 117.1823 59.9597 34.5698 175.2024 50 C 4.1961 8.1501 120.0867 60.0339 42.2410 175.3521 51 Y 3.9706 8.1450 118.2774 60.8524 37.3495 178.3109 52 K 3.9493 8.1810 120.6900 59.4785 32.3721 178.8322 53 R 3.8580 7.8725 118.4667 59.5081 30.0705 178.5689 54 L 4.0778 7.8098 118.4012 57.7233 41.5538 179.3629 55 E 4.1073 8.5302 119.1005 59.2007 29.2161 179.1523 56 K 4.0259 8.1619 118.5020 58.6463 32.2967 178.0529 57 R 4.2079 7.2397 116.3182 56.8514 30.2783 176.7290 58 G 4.0655 7.8646 105.2645 45.3654 0.0000 173.3506 59 C 4.4802 7.7504 117.0908 56.3794 40.8643 173.7876 60 G 4.0097 8.2556 111.2408 45.4066 0.0000 172.0193 61 T 4.1103 7.3670 106.4891 62.4289 71.4252 176.2025 62 K 3.9035 7.9753 121.2724 57.8079 32.7056 178.5604 63 F 4.5655 8.0538 114.0956 56.8447 39.5039 174.8548 64 L 4.4786 7.5338 124.3787 53.2141 41.7094 176.3936 65 S 4.2720 8.4427 121.3980 58.3023 63.8018 172.6318 66 Y 4.9929 7.5668 118.8148 55.7473 41.2839 173.7578 67 K 5.0182 9.0152 118.6689 54.8365 34.9866 175.7733 68 F 5.5116 8.3019 117.2383 56.1061 40.9857 173.3137 69 S 4.8035 9.9091 116.0072 56.6690 67.1211 172.8361 70 N 5.4935 8.7700 118.8153 51.6106 40.2309 174.6935 71 S 4.5585 9.1598 118.0378 56.8633 64.9115 177.1797 72 G 3.9076 9.2076 120.6685 46.9982 0.0000 173.0078 73 S 4.5856 9.1430 119.7173 58.4724 64.8253 176.8296 74 R 4.2044 8.1390 120.6396 56.8771 30.8885 175.2864 75 I 4.9932 8.4168 126.9045 59.9627 39.3891 174.9691 76 T 4.6113 9.5738 124.8700 61.7318 71.1270 172.9070 77 C 4.9505 8.9106 124.5876 56.5536 40.9252 173.9069 78 A 4.3726 8.8768 125.8372 51.6177 19.1813 177.1627 79 K 4.1980 8.4944 119.3985 55.9404 32.7225 176.8668 80 Q 4.4925 7.9229 121.2824 53.9957 31.4434 174.1271 81 D 4.5326 8.5438 117.4019 53.4549 41.1014 176.6010 82 S 4.0374 8.6587 114.1864 62.1436 62.1809 177.1503 83 C 4.2108 8.0983 117.9868 60.3096 39.6361 176.3825 84 R 3.8622 8.0336 119.0596 59.1260 29.5834 179.4675 85 S 3.9849 8.2091 115.1664 61.6579 62.8379 176.4427 86 Q 3.8598 8.1045 122.2633 58.9632 28.7518 177.8754 87 L 3.7370 7.8334 121.3599 58.1977 41.9856 178.0372 88 C 2.9263 7.5854 118.1479 59.5098 44.2551 175.5399 89 E 3.6939 7.9712 119.8794 59.2720 29.0039 178.7615 90 C 4.1758 8.1776 116.9104 60.1699 36.7874 175.7966 91 D 3.7535 7.9130 120.3504 57.1621 40.3622 178.9308 92 K 3.9702 8.2506 120.1761 59.2757 32.1212 178.7347 93 A 3.9022 8.0349 120.9601 54.9562 18.2037 179.5694 94 A 3.4281 7.8009 118.8192 54.9286 18.5846 179.5836 95 A 3.9015 8.4036 119.6496 55.6493 18.4112 179.9438 96 T 3.7503 8.3194 114.3052 67.0820 68.4782 175.9630 97 C 4.1067 8.3613 120.6269 59.7911 43.2426 175.7902 98 F 4.4410 8.0288 118.7523 60.4358 38.8841 177.1710 99 A 4.1977 7.9449 119.9502 55.4125 18.0238 179.9295 100 R 4.0137 8.1013 115.2861 58.4681 30.4070 177.9747 101 N 5.0411 7.7816 115.7050 52.8581 39.7195 176.9356 102 K 4.1716 8.0556 124.9864 59.4224 32.5245 178.8405 103 T 4.1357 7.8836 107.5872 63.8151 69.1590 175.3169 104 T 4.2773 7.5315 116.8600 63.8933 68.9902 174.4164 105 Y 4.0355 7.5747 124.0210 57.7718 39.2168 174.6871 106 N 4.9187 8.5442 125.3782 51.3283 41.2280 175.1813 107 K 3.9393 8.7044 125.4555 59.2455 32.4531 179.1123 108 K 3.8802 8.2083 119.5045 58.8009 32.2283 176.8514 109 Y 4.5048 7.4786 115.2677 57.8266 38.1475 176.6445 110 Q 3.4774 6.8624 120.9038 58.8233 29.6887 176.2826 111 Y 4.9290 7.3740 117.1047 56.4319 37.1891 173.8329 112 Y 4.5698 7.8604 121.5180 55.4259 40.2036 175.4425 113 S 4.2338 8.1528 122.7374 58.2559 63.7450 174.7512 114 N 4.6004 8.8482 122.5515 55.2343 38.5999 177.8114 115 K 3.9612 7.6994 120.1748 57.7374 31.9177 182.8434 116 H 4.6813 7.6838 113.3806 56.3393 28.7116 174.5222 117 C 4.7151 7.7777 121.1824 56.9831 36.7319 173.8714 118 R 4.4103 8.0697 121.0556 55.2160 33.3105 172.0446 119 G 4.4127 8.9326 101.2270 47.5083 0.0000 172.3556 120 S 4.5963 8.1928 113.2255 57.7467 63.7957 173.9795 121 T 4.9953 8.6681 121.5630 61.4117 68.7973 172.8505 122 P 4.3221 0.0000 0.0000 63.1700 31.7326 176.0467 123 R 4.4476 8.1488 119.0217 55.3000 31.6204 177.3286 124 C 4.4472 8.5551 116.4782 57.4254 41.3269 173.8302 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 N 8.28 4.98 0.00 3.11 3.12 0.00 0.00 6.14 5.79 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 2 L 8.09 4.03 0.00 1.65 1.80 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.66 3.63 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 1.10 0.00 0.00 0.94 0.00 0.00 4 N 8.40 4.46 0.00 2.40 2.54 0.00 0.00 6.67 7.69 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 5 F 8.24 4.47 0.00 3.36 3.21 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 6 H 8.46 3.92 0.00 3.37 3.45 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.20 3.98 0.00 2.35 2.18 0.00 3.33 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.93 0.00 8 M 8.58 4.01 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.54 0.00 9 I 7.92 3.65 1.61 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.17 0.79 0.00 0.00 10 K 7.84 4.12 0.00 1.96 1.81 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.61 1.48 7.81 11 L 7.95 4.04 0.00 1.91 1.78 1.12 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.74 4.24 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 13 T 8.26 4.45 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 1.28 0.00 0.00 14 G 8.22 3.94 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 0.00 0.00 0.00 15 K 7.42 4.17 0.00 1.77 1.56 0.00 1.51 0.00 0.00 0.92 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.14 1.21 7.81 16 E 8.42 4.30 0.00 2.05 1.83 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 2.38 2.37 0.00 17 A 8.50 4.05 1.14 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 18 A 8.34 3.99 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 19 L 8.44 4.49 0.00 1.68 1.81 1.12 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 20 S 7.95 4.11 0.00 3.55 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 21 Y 8.06 4.73 0.00 2.68 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 7.97 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 23 F 7.81 5.03 0.00 3.35 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 24 Y 7.62 4.54 0.00 3.03 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.02 3.55 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 0.00 0.00 0.00 26 C 9.73 4.74 0.00 3.09 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 27 H 8.71 4.78 0.00 3.12 3.32 0.00 5.65 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 C 8.22 4.48 0.00 3.29 3.38 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 29 G 8.76 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 30 V 8.39 3.57 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.98 0.00 0.00 31 G 8.66 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 32 G 7.98 5.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.87 4.55 0.00 1.88 1.86 0.00 3.09 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 34 G 9.01 4.08 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 0.00 0.00 0.00 35 S 8.65 4.85 0.00 3.85 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 36 P 0.00 4.80 0.00 2.01 1.97 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 37 K 8.93 3.86 0.00 1.09 0.74 0.00 1.37 0.00 0.00 1.34 0.00 0.00 2.45 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.63 0.21 7.81 38 D 7.42 4.44 0.00 2.85 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 39 A 8.81 4.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 7.96 4.08 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 0.82 0.00 0.00 41 D 8.79 4.45 0.00 3.05 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 42 R 7.79 3.94 0.00 2.03 1.94 0.00 3.17 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00 43 C 7.91 4.21 0.00 2.93 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 C 8.05 4.24 0.00 3.31 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 0.00 45 V 7.71 3.48 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.64 0.00 0.00 46 T 7.68 3.82 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 1.14 0.00 0.00 47 H 8.07 4.02 0.00 3.11 3.26 0.00 5.59 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 8.36 4.30 0.00 2.98 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 49 C 8.14 4.31 0.00 3.15 3.11 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 50 C 8.15 4.20 0.00 3.10 3.17 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 51 Y 8.15 3.97 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 52 K 8.18 3.95 0.00 1.87 1.83 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 53 R 7.87 3.86 0.00 2.13 2.03 0.00 3.12 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 54 L 7.81 4.08 0.00 1.92 1.55 0.89 0.58 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 55 E 8.53 4.11 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.53 0.00 56 K 8.16 4.03 0.00 1.92 1.83 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.44 7.81 57 R 7.24 4.21 0.00 1.99 2.06 0.00 3.25 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 58 G 7.86 4.07 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 0.00 0.00 0.00 59 C 7.75 4.48 0.00 3.10 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 60 G 8.26 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 0.00 0.00 0.00 61 T 7.37 4.11 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 62 K 7.98 3.90 0.00 1.55 1.48 0.00 1.63 0.00 0.00 1.84 0.00 0.00 3.01 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.69 1.56 7.81 63 F 8.05 4.57 0.00 3.06 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 64 L 7.53 4.48 0.00 1.58 1.61 0.96 0.99 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 65 S 8.44 4.27 0.00 3.97 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 66 Y 7.57 4.99 0.00 3.20 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 67 K 9.02 5.02 0.00 1.84 1.77 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.41 7.81 68 F 8.30 5.51 0.00 3.23 3.17 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 69 S 9.91 4.80 0.00 3.70 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 70 N 8.77 5.49 0.00 2.86 2.92 0.00 0.00 5.87 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 9.16 4.56 0.00 3.83 3.82 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 72 G 9.21 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 S 9.14 4.59 0.00 3.63 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 74 R 8.14 4.20 0.00 1.96 1.98 0.00 3.09 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 75 I 8.42 4.99 1.90 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 1.56 1.04 0.99 0.00 0.00 76 T 9.57 4.61 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 1.24 0.00 0.00 77 C 8.91 4.95 0.00 2.96 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 78 A 8.88 4.37 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 79 K 8.49 4.20 0.00 1.77 1.77 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.43 7.81 80 Q 7.92 4.49 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 81 D 8.54 4.53 0.00 2.97 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 82 S 8.66 4.04 0.00 3.89 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 83 C 8.10 4.21 0.00 3.16 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 R 8.03 3.86 0.00 1.87 2.08 0.00 3.20 0.00 0.00 3.61 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.86 0.00 85 S 8.21 3.98 0.00 3.98 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 86 Q 8.10 3.86 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 87 L 7.83 3.74 0.00 1.74 1.73 0.48 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 88 C 7.59 2.93 0.00 2.29 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 89 E 7.97 3.69 0.00 2.05 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 2.42 2.42 0.00 90 C 8.18 4.18 0.00 3.10 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 7.91 3.75 0.00 2.73 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.25 3.97 0.00 1.70 1.70 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.42 7.81 93 A 8.03 3.90 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.80 3.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 8.40 3.90 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 96 T 8.32 3.75 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 1.18 0.00 0.00 97 C 8.36 4.11 0.00 2.94 2.93 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 98 F 8.03 4.44 0.00 3.00 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 99 A 7.94 4.20 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.10 4.01 0.00 1.93 2.02 0.00 3.11 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 101 N 7.78 5.04 0.00 2.75 2.85 0.00 0.00 6.55 6.75 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 0.00 102 K 8.06 4.17 0.00 2.04 1.84 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.35 7.81 103 T 7.88 4.14 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 1.24 0.00 0.00 104 T 7.53 4.28 4.41 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 1.28 0.00 0.00 105 Y 7.57 4.04 0.00 3.00 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 0.00 106 N 8.54 4.92 0.00 2.72 2.49 0.00 0.00 6.81 6.69 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 0.00 107 K 8.70 3.94 0.00 1.85 1.85 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.63 1.56 7.81 108 K 8.21 3.88 0.00 1.48 1.33 0.00 1.67 0.00 0.00 1.53 0.00 0.00 2.73 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.20 1.30 7.81 109 Y 7.48 4.50 0.00 2.42 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 6.86 3.48 0.00 1.98 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.91 0.00 0.00 0.00 0.00 0.00 1.32 2.28 0.00 111 Y 7.37 4.93 0.00 2.99 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 0.00 112 Y 7.86 4.57 0.00 3.08 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.15 4.23 0.00 3.78 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 0.00 114 N 8.85 4.60 0.00 2.87 2.91 0.00 0.00 7.26 7.06 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 0.00 115 K 7.70 3.96 0.00 1.77 1.73 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.03 7.81 116 H 7.68 4.68 0.00 2.53 3.27 0.00 5.63 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 C 7.78 4.72 0.00 3.11 3.23 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 0.00 118 R 8.07 4.41 0.00 1.66 1.76 0.00 3.27 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.17 0.00 119 G 8.93 4.41 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 0.00 120 S 8.19 4.60 0.00 4.00 3.89 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 0.00 121 T 8.67 5.00 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 1.27 0.00 0.00 122 P 0.00 4.32 0.00 2.13 2.04 0.00 3.88 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.91 0.00 123 R 8.15 4.45 0.00 1.81 1.88 0.00 3.20 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 124 C 8.56 4.45 0.00 2.95 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