NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.4786 8.3493 120.5183 53.9061 42.0496 175.3048 4 W 4.1338 7.9646 117.4100 56.5967 28.7073 171.2133 5 V 3.3412 6.4281 120.2637 61.6835 31.5888 174.8921 6 P 4.6810 0.0000 0.0000 61.0719 32.7857 175.4018 7 P 4.3652 0.0000 0.0000 65.7774 31.6033 178.1462 8 E 3.9457 8.5478 118.8452 59.9008 29.3369 179.1843 9 V 3.5801 7.5983 117.4335 66.3963 31.1226 178.1521 10 F 4.0389 8.1173 116.3846 60.2438 38.8713 177.1826 11 D 4.5493 8.6101 119.1576 57.3041 40.4727 178.3784 12 L 4.0048 7.9194 119.3421 58.1984 42.3310 178.0429 13 V 4.2099 7.9071 109.4645 61.8218 32.3586 177.7198 14 A 4.0529 7.9757 123.6141 55.3119 18.1558 179.3869 15 E 3.8958 8.1478 116.9650 59.7064 29.8818 178.6329 16 D 4.3727 8.0938 118.4783 56.9558 40.8604 178.3081 17 K 4.0077 8.6945 120.4795 59.6671 32.2068 178.5728 18 A 4.0401 8.1765 120.8069 55.1241 18.2291 179.5181 19 R 3.8232 8.0987 117.0780 59.9253 30.0890 178.0987 20 C 4.4182 8.7128 116.6631 60.4072 35.6914 176.0999 21 M 4.2278 8.6613 122.0247 57.9392 31.2955 179.0344 22 S 4.1315 7.9446 114.3573 61.7526 63.1321 176.2284 23 E 4.0680 8.3809 120.2662 58.8928 29.3789 178.1517 24 H 4.9282 8.0968 113.6201 54.4921 29.6000 175.2526 25 G 3.9100 8.0270 108.6638 46.6300 0.0000 174.0237 26 T 4.3175 7.8636 116.2809 63.0129 69.3584 174.2214 27 T 4.5354 8.4929 115.5346 59.8522 71.1187 175.5968 28 Q 3.8689 8.5155 122.9702 59.2751 29.0080 178.4757 29 A 4.0586 7.9530 121.5008 55.1736 18.4616 179.4725 30 Q 3.9813 8.0055 116.6823 59.0339 28.7516 178.9920 31 I 3.7069 7.4703 120.9717 64.5110 37.2228 178.0608 32 D 4.4288 8.4819 120.1407 57.5949 40.5557 178.7749 33 D 4.3813 8.2281 119.2127 57.3864 40.7638 178.9855 34 V 3.8870 7.7196 119.9412 65.7071 31.3450 177.7810 35 D 4.4865 8.0813 117.4774 56.9025 40.6692 177.9430 36 K 4.4661 7.6652 116.3158 55.9788 32.2325 177.5272 37 G 3.8451 8.2595 107.6946 45.5861 0.0000 173.3892 38 N 4.8052 8.4800 118.5277 51.2872 38.8458 173.9109 39 L 4.9238 8.2601 124.3980 53.3525 45.2834 175.5523 40 V 4.6267 8.2465 117.5997 59.5328 35.6468 175.4095 41 N 3.8989 8.0213 120.3417 52.5015 37.5234 175.3803 42 E 4.5282 7.4527 119.6891 54.2456 32.1431 174.8868 43 P 4.5284 0.0000 0.0000 65.0584 31.2096 178.7181 44 S 4.4600 8.0923 112.9749 60.2780 63.0831 175.3502 45 I 4.2777 7.6519 121.2979 62.8889 38.6419 177.4333 46 T 4.0620 8.2571 111.0795 65.1733 68.5910 176.0661 47 C 4.4269 8.6106 119.5442 59.3784 41.0210 175.4353 48 Y 4.0210 8.0313 121.0308 60.9975 38.5104 177.8507 49 M 3.9240 8.2675 119.5947 58.4749 32.0251 178.0721 50 Y 3.9962 8.0495 119.6519 60.7530 38.9930 177.2087 51 C 4.0636 8.4382 119.6928 59.7741 41.8314 175.4660 52 L 3.7806 7.6682 121.8129 57.8617 41.5208 178.7491 53 L 3.8876 7.7355 119.0355 57.7641 41.5570 179.1220 54 E 3.6557 8.0620 119.3237 59.1052 29.2731 178.6611 55 A 3.8565 7.7632 119.7847 54.1906 18.3042 178.6122 56 F 4.4646 7.3924 113.4097 56.6657 39.6336 175.8448 57 S 3.8007 7.7655 112.5675 59.7914 60.6550 173.0251 58 L 4.3459 8.0763 121.7430 56.0218 41.9958 177.1424 59 V 5.4008 7.5301 109.4201 58.6705 36.1569 174.4893 60 D 5.0936 8.1925 121.1118 52.0071 41.6701 176.3062 61 D 4.7044 8.7474 117.1251 55.8196 39.6141 176.3566 62 E 4.8496 8.4535 117.7057 54.7163 30.3416 175.1923 63 A 4.0462 8.0553 118.9713 53.2513 17.0422 178.1545 64 N 4.6070 8.5328 117.3416 54.3755 39.3618 175.1163 65 V 4.3140 8.2218 122.9219 62.2091 32.6530 175.9761 66 D 4.6137 8.8272 127.0341 53.1164 40.7107 176.4185 67 E 3.9467 8.5493 128.0645 59.1086 29.8422 178.0570 68 D 4.3379 8.1027 118.4736 57.4205 40.8052 178.5413 69 I 3.7195 7.6215 118.5688 64.4618 37.4618 177.8932 70 M 4.1706 8.2814 119.0935 58.8140 32.1855 178.1966 71 L 4.0961 8.4530 119.6374 57.8529 41.5574 179.8208 72 G 3.6935 8.0191 104.5638 47.5687 0.0000 175.3824 73 L 4.1645 7.5725 120.4838 56.6240 41.8969 177.7933 74 L 3.8225 6.9411 117.2896 52.6951 42.7725 174.9881 75 P 4.1839 0.0000 0.0000 62.4031 32.2847 177.2141 76 D 4.3283 8.8274 121.8054 57.8949 40.5059 179.3341 77 Q 4.1287 7.8518 115.1207 57.8714 29.1685 176.9944 78 L 4.3709 7.7474 120.5546 55.2807 42.1886 178.2950 79 Q 3.9383 7.7690 118.7897 58.4531 28.4571 177.7725 80 E 3.8729 8.0869 120.0657 59.5118 29.7311 178.8686 81 R 3.8898 7.9110 117.8551 59.2231 30.1601 178.0077 82 A 4.0303 8.1722 120.7887 55.2068 18.3451 179.3141 83 Q 3.8919 8.3597 118.2759 59.3606 28.9510 178.5587 84 S 4.0703 7.9096 114.1116 61.3488 62.4664 176.2516 85 V 3.6132 7.7751 120.9680 66.4230 31.2658 177.9878 86 M 4.2804 8.5778 118.7852 58.0650 31.5118 178.8713 87 G 3.6688 7.8312 105.5725 47.5930 0.0000 175.2720 88 K 4.1385 7.7344 120.9840 58.7814 32.4657 177.4878 89 C 4.6065 8.1424 114.0461 56.1306 41.1690 173.5337 90 L 4.9017 7.0906 120.3744 51.7529 43.8019 174.5840 91 P 4.5269 0.0000 0.0000 62.3796 32.1155 176.2796 92 T 4.2025 8.1268 109.5608 61.9380 69.5837 173.7858 93 S 4.5776 7.8276 115.3426 56.4231 65.6579 174.3314 94 G 4.1761 7.9313 109.9180 45.3797 0.0000 172.0423 95 S 4.3353 8.1000 113.2486 59.9530 63.7173 173.6086 96 D 4.4171 7.3670 119.5817 51.6066 42.4968 175.7845 97 N 4.0962 8.2655 116.2558 56.6925 38.2056 178.3313 98 C 4.3484 7.9705 117.3356 60.0258 41.5896 175.5147 99 N 4.2274 9.1681 118.9509 56.3248 38.4419 177.1123 100 K 4.3779 8.2489 121.8134 59.1175 32.1088 179.3513 101 I 3.8292 7.7827 119.5893 64.1361 36.9714 177.6604 102 Y 4.0709 8.2669 120.7331 61.0282 38.6038 178.2044 103 N 4.0288 8.3608 117.1868 55.9473 38.5113 177.2024 104 L 3.6907 7.9278 121.4893 58.0047 42.1418 178.8056 105 A 2.0000 7.4404 120.8947 54.4527 18.1416 179.6769 106 K 3.5572 7.4021 116.8569 59.5783 31.8957 178.8025 107 C 4.1512 7.8173 118.6815 59.5442 44.6143 175.8338 108 V 3.5467 7.7548 120.1762 66.1629 30.9392 178.0628 109 Q 4.0778 7.8968 116.8532 59.0290 28.5824 178.4061 110 E 4.0897 8.1651 118.7266 58.7366 29.5089 178.5871 111 S 4.6009 7.5669 113.7516 58.3508 63.9804 174.5573 112 A 4.6811 7.6993 123.6139 49.9941 22.1023 174.1749 113 P 4.4279 0.0000 0.0000 65.6299 31.5670 177.2556 114 D 4.9058 8.1287 114.1454 54.3528 41.1334 177.0339 115 V 4.2520 7.8474 119.0039 64.5223 32.4469 175.8978 116 W 4.4444 8.2554 128.8792 57.0317 31.2320 175.0666 117 F 4.9614 7.5364 119.1053 55.1428 40.3323 173.7486 118 V 3.9607 8.4649 121.5738 61.1481 33.7438 175.6138 119 I 4.0194 8.1412 126.5713 61.4955 37.1070 175.4852 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 3 D 8.35 4.48 0.00 2.49 2.26 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 4 W 7.96 4.13 0.00 3.53 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 5 V 6.43 3.34 1.62 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 0.52 0.00 0.00 -1.05 0.00 0.00 6 P 0.00 4.68 0.00 2.50 2.19 0.00 3.73 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 7 P 0.00 4.37 0.00 2.24 2.31 0.00 3.75 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 2.09 1.98 0.00 8 E 8.55 3.95 0.00 2.11 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 0.00 2.43 2.49 0.00 9 V 7.60 3.58 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 0.78 0.00 0.00 0.88 0.00 0.00 10 F 8.12 4.04 0.00 3.26 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 11 D 8.61 4.55 0.00 2.92 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 12 L 7.92 4.00 0.00 1.60 1.81 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.91 4.21 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 0.27 0.00 0.00 0.93 0.00 0.00 14 A 7.98 4.05 1.44 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 15 E 8.15 3.90 0.00 2.07 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 2.38 2.41 0.00 16 D 8.09 4.37 0.00 2.82 2.70 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 0.00 0.00 0.00 0.00 17 K 8.69 4.01 0.00 1.92 2.14 0.00 1.87 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.72 7.81 18 A 8.18 4.04 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 19 R 8.10 3.82 0.00 1.92 2.10 0.00 3.21 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 20 C 8.71 4.42 0.00 3.14 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 21 M 8.66 4.23 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.10 0.00 22 S 7.94 4.13 0.00 3.88 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 23 E 8.38 4.07 0.00 1.89 1.72 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 2.31 2.53 0.00 24 H 8.10 4.93 0.00 3.32 3.38 0.00 5.69 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 25 G 8.03 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 26 T 7.86 4.32 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 0.88 0.00 0.00 27 T 8.49 4.54 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 1.20 0.00 0.00 28 Q 8.52 3.87 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 29 A 7.95 4.06 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 30 Q 8.01 3.98 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 31 I 7.47 3.71 1.94 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.40 0.99 0.00 0.00 32 D 8.48 4.43 0.00 2.82 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 33 D 8.23 4.38 0.00 2.98 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 34 V 7.72 3.89 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 1.50 0.00 0.00 1.13 0.00 0.00 35 D 8.08 4.49 0.00 3.00 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 36 K 7.67 4.47 0.00 1.89 1.86 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.73 7.81 37 G 8.26 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 38 N 8.48 4.81 0.00 3.03 2.80 0.00 0.00 6.38 6.39 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 39 L 8.26 4.92 0.00 1.58 1.51 1.09 0.92 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 40 V 8.25 4.63 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 0.81 0.00 0.00 0.94 0.00 0.00 41 N 8.02 3.90 0.00 1.44 2.30 0.00 0.00 6.92 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 42 E 7.45 4.53 0.00 2.00 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 0.00 2.28 2.30 0.00 43 P 0.00 4.53 0.00 2.16 2.12 0.00 3.86 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 44 S 8.09 4.46 0.00 4.05 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 45 I 7.65 4.28 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.42 1.05 0.00 0.00 46 T 8.26 4.06 4.56 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 0.00 0.00 0.00 1.35 0.00 0.00 47 C 8.61 4.43 0.00 3.00 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 48 Y 8.03 4.02 0.00 3.24 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 49 M 8.27 3.92 0.00 2.36 2.43 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.09 2.78 0.00 50 Y 8.05 4.00 0.00 3.16 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 51 C 8.44 4.06 0.00 3.20 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 52 L 7.67 3.78 0.00 1.19 1.29 0.97 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.74 3.89 0.00 1.74 1.58 1.07 0.44 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 54 E 8.06 3.66 0.00 1.26 1.76 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 2.15 2.34 0.00 55 A 7.76 3.86 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 56 F 7.39 4.46 0.00 2.99 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 57 S 7.77 3.80 0.00 4.04 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 58 L 8.08 4.35 0.00 1.81 1.68 0.87 1.07 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 59 V 7.53 5.40 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 1.04 0.00 0.00 0.66 0.00 0.00 60 D 8.19 5.09 0.00 2.92 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 61 D 8.75 4.70 0.00 2.85 2.89 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 62 E 8.45 4.85 0.00 1.95 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 2.19 2.23 0.00 63 A 8.06 4.05 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 64 N 8.53 4.61 0.00 3.11 2.78 0.00 0.00 6.68 7.19 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 65 V 8.22 4.31 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 0.85 0.00 0.00 1.03 0.00 0.00 66 D 8.83 4.61 0.00 2.75 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 67 E 8.55 3.95 0.00 2.10 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 2.39 2.43 0.00 68 D 8.10 4.34 0.00 2.86 2.70 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 0.00 0.00 0.00 0.00 69 I 7.62 3.72 2.00 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 0.68 0.93 0.00 0.00 70 M 8.28 4.17 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.64 0.00 71 L 8.45 4.10 0.00 1.67 1.69 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.02 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 0.00 0.00 0.00 73 L 7.57 4.16 0.00 1.96 1.89 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 74 L 6.94 3.82 0.00 1.56 1.14 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.18 0.00 1.79 1.72 0.00 2.36 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.49 0.00 76 D 8.83 4.33 0.00 2.61 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 77 Q 7.85 4.13 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.84 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 78 L 7.75 4.37 0.00 1.43 1.48 0.57 0.94 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 79 Q 7.77 3.94 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 80 E 8.09 3.87 0.00 2.00 1.92 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 2.37 2.36 0.00 81 R 7.91 3.89 0.00 1.91 1.89 0.00 3.24 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 82 A 8.17 4.03 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 83 Q 8.36 3.89 0.00 2.27 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 84 S 7.91 4.07 0.00 3.88 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 85 V 7.78 3.61 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 1.02 0.00 0.00 1.05 0.00 0.00 86 M 8.58 4.28 0.00 2.09 2.23 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.97 0.00 87 G 7.83 3.67 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 0.00 0.00 0.00 88 K 7.73 4.14 0.00 1.71 2.02 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.46 7.81 89 C 8.14 4.61 0.00 2.99 3.06 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 90 L 7.09 4.90 0.00 1.79 1.57 0.96 1.12 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 91 P 0.00 4.53 0.00 2.19 2.07 0.00 3.77 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 1.99 1.96 0.00 92 T 8.13 4.20 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 1.26 0.00 0.00 93 S 7.83 4.58 0.00 3.97 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 94 G 7.93 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 95 S 8.10 4.34 0.00 3.97 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 96 D 7.37 4.42 0.00 2.83 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 97 N 8.27 4.10 0.00 2.11 1.59 0.00 0.00 6.84 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 98 C 7.97 4.35 0.00 3.04 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 99 N 9.17 4.23 0.00 2.76 2.81 0.00 0.00 7.24 6.74 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 0.00 100 K 8.25 4.38 0.00 2.03 1.88 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.50 7.81 101 I 7.78 3.83 2.05 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.26 1.17 0.00 0.00 102 Y 8.27 4.07 0.00 3.05 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 0.00 103 N 8.36 4.03 0.00 3.01 2.78 0.00 0.00 6.74 6.25 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 0.00 104 L 7.93 3.69 0.00 1.75 1.65 0.91 1.25 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 0.00 105 A 7.44 2.00 0.49 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 0.00 106 K 7.40 3.56 0.00 1.49 1.58 0.00 1.40 0.00 0.00 1.25 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.59 0.60 7.81 107 C 7.82 4.15 0.00 2.97 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 0.00 108 V 7.75 3.55 1.97 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 1.26 0.00 0.00 1.00 0.00 0.00 109 Q 7.90 4.08 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 110 E 8.17 4.09 0.00 2.04 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 2.31 2.36 0.00 111 S 7.57 4.60 0.00 3.79 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 0.00 112 A 7.70 4.68 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 0.00 113 P 0.00 4.43 0.00 2.11 2.17 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 114 D 8.13 4.91 0.00 2.78 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 0.00 115 V 7.85 4.25 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 0.96 0.00 0.00 1.03 0.00 0.00 116 W 8.26 4.44 0.00 3.45 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 0.00 117 F 7.54 4.96 0.00 2.93 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 0.00 118 V 8.46 3.96 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 0.99 0.00 0.00 1.02 0.00 0.00 119 I 8.14 4.02 1.63 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.61 0.55 0.00 0.00