NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.6472 8.4293 116.1991 55.1556 30.3592 173.2887 2 C 4.0829 7.6428 114.1641 56.9384 30.1157 172.0962 3 D 4.5571 8.3378 118.5490 55.1374 40.1629 175.4872 4 L 4.0683 8.0417 120.4612 57.0424 42.2588 175.7175 5 P 4.5659 0.0000 0.0000 62.2886 32.3227 175.3229 6 C 4.3248 8.4346 113.2142 57.6556 30.7685 175.0167 7 G 3.9129 8.2315 107.5444 45.4680 0.0000 172.8912 8 V 4.2880 7.1939 119.1251 61.0632 32.6750 174.3864 9 Y 4.7102 8.0428 123.5059 56.7175 42.1175 174.4178 10 D 3.6305 7.9065 117.4863 51.7240 43.7706 174.7340 11 P 4.0825 0.0000 0.0000 64.5395 31.1469 178.0328 12 A 3.9832 8.4293 120.6310 55.0918 17.6276 179.6645 13 Q 3.7608 7.9673 116.4552 59.1106 28.7811 178.8833 14 A 4.0754 7.7489 121.2721 55.0052 18.4279 179.4828 15 R 3.8517 8.1624 117.3852 59.6638 30.2311 178.8278 16 I 3.7262 8.0219 119.8773 64.4867 37.0748 178.3449 17 E 4.0012 7.9804 118.2899 59.3169 29.2937 179.2729 18 A 4.0809 8.2236 120.8665 55.0404 18.4065 179.5666 19 E 3.9713 8.5428 117.8119 59.6207 29.3952 179.7059 20 S 4.1528 7.9924 115.2839 61.3343 62.8571 176.7102 21 V 3.5642 7.7187 121.0437 66.0317 31.3046 178.0793 22 K 4.1241 8.0707 119.0020 59.4385 32.0505 178.5591 23 A 4.2068 8.1468 121.1080 55.3480 18.2423 179.7326 24 I 3.7584 8.1478 118.6282 64.5847 37.0284 178.6893 25 Q 4.0232 8.1334 118.9931 58.8965 28.3862 178.7205 26 E 3.9971 8.3425 119.6555 59.4652 29.5467 179.5899 27 K 4.1222 8.2341 118.4715 59.7151 31.9092 179.3703 28 M 4.3902 8.4184 118.9983 58.2270 31.6113 178.4650 29 A 3.9720 7.7773 119.6362 54.1691 18.6766 178.5849 30 A 4.5942 7.6090 117.1666 51.8434 19.4240 176.6514 31 N 4.6542 7.5471 114.8094 51.9777 40.6070 173.1929 32 D 4.7557 8.6884 124.6186 53.2630 40.1197 176.6422 33 D 4.4173 8.4592 120.7360 54.5023 42.5043 176.1780 34 L 3.9324 8.6821 128.5381 59.0402 42.1705 179.0687 35 H 4.1537 8.3223 115.3137 58.6655 28.6549 177.5219 36 F 4.1969 8.7604 122.7190 61.3267 39.2397 177.2379 37 Q 3.9401 8.4629 117.9276 58.8406 28.3899 178.9255 38 I 3.6329 7.8637 120.7860 64.4877 37.1314 178.6394 39 R 3.8113 7.9789 118.5627 59.2107 29.8138 179.0087 40 A 3.7132 7.9182 120.8095 55.3052 18.2734 179.8559 41 T 3.7304 7.8463 114.1973 66.6101 68.5941 177.0161 42 V 3.5277 7.8498 120.2212 66.2754 31.5405 178.2369 43 I 3.9223 7.9535 119.7480 64.1162 36.8326 178.3434 44 K 3.8890 8.3770 121.0543 59.3100 31.9822 178.4392 45 E 3.8916 8.1739 119.6253 59.4046 29.6067 178.8789 46 Q 3.9811 7.8768 117.4879 59.1635 28.7768 179.0924 47 R 3.9622 8.2628 118.9733 59.0501 30.0032 178.9707 48 A 3.9980 8.2639 120.9096 55.0057 18.3085 179.2889 49 E 3.8585 8.2372 117.9172 59.4376 29.6517 179.0929 50 L 3.9372 7.9576 118.7898 57.5970 41.6487 179.3010 51 A 4.0484 8.2078 120.8045 55.1816 18.2599 179.8085 52 K 3.9044 8.2905 117.1623 59.8170 32.0640 179.0305 53 H 4.1556 8.4094 118.5228 59.6924 29.9007 177.0264 54 H 4.1994 8.3535 118.1088 58.9060 28.4728 177.8663 55 L 4.1059 8.0406 120.8425 57.8039 41.4373 179.1450 56 D 4.5399 8.4850 119.2733 57.4575 40.7170 179.0780 57 V 3.7414 8.0902 118.8242 65.9120 31.5082 178.0796 58 L 3.8936 7.9754 118.5479 57.5501 41.2712 179.3479 59 W 4.6361 8.4821 127.3371 60.6369 30.8043 177.7391 60 S 4.0287 8.7894 113.3324 60.3319 62.9046 175.1883 61 D 4.7002 8.2915 120.9762 55.9710 41.7899 177.4318 62 Y 3.4176 7.4284 118.1554 60.1400 39.0090 175.6933 63 F 4.0543 7.9093 118.3245 57.2097 39.5299 174.8147 64 K 4.6948 7.9386 122.6810 52.9700 36.3074 175.2052 65 P 4.4077 0.0000 0.0000 65.9666 31.0103 176.9242 66 P 4.1758 0.0000 0.0000 65.9301 31.0916 178.4151 67 H 4.3699 7.9923 115.0277 58.9047 28.4566 177.9112 68 F 4.3667 7.5822 117.8377 60.2620 38.8156 177.1764 69 E 4.1969 8.2857 118.1580 59.4642 29.4351 179.0770 70 S 4.2737 7.9710 114.0976 59.8767 64.1436 174.1404 71 Y 4.7108 8.0066 119.4479 54.6823 37.9144 173.9720 72 P 4.4104 0.0000 0.0000 64.8322 32.0940 177.2302 73 E 4.3835 8.1605 114.4233 56.6026 30.6963 177.7975 74 L 3.9031 8.3149 122.8139 58.7316 42.0812 178.2244 75 H 4.3755 8.3403 115.5215 59.5042 28.7060 177.6792 76 T 3.8154 7.9347 116.7693 66.3758 68.3020 176.2091 77 L 3.7994 8.0235 122.2355 58.2996 42.1207 179.3365 78 V 3.5413 7.8796 118.1399 65.8570 31.4297 177.4799 79 N 4.0262 8.0584 116.9043 56.6086 38.7218 176.7935 80 E 3.7181 8.3822 120.2464 58.8828 29.4517 179.1864 81 A 3.8613 7.5223 120.8796 55.3406 18.5138 180.2193 82 V 3.6068 7.8034 110.9403 64.3270 31.5627 179.0418 83 K 4.0032 8.0473 118.1861 59.0863 31.8335 179.2691 84 A 4.1009 8.0670 121.4685 55.0408 18.2803 179.6958 85 L 4.0184 7.8413 117.4988 57.9638 41.5271 179.8396 86 S 4.1265 8.1137 115.0823 61.4936 62.5064 176.5888 87 A 3.9984 7.8420 122.4975 55.0419 18.3659 179.2821 88 A 4.1771 8.0093 120.6886 54.4857 18.1583 180.0188 89 K 3.9414 7.8171 116.4085 59.3663 32.1867 178.4289 90 A 4.4662 7.3908 118.0774 51.2979 18.8334 176.6958 91 S 4.6284 7.2457 112.2388 57.6785 65.6279 173.9542 92 T 4.3523 8.3309 113.4614 61.2922 69.5692 173.8460 93 D 4.5239 8.2653 124.3203 53.2296 41.4035 175.0271 94 P 4.6873 0.0000 0.0000 64.7233 31.2335 178.3018 95 A 4.0243 8.7640 120.6404 55.1491 17.7004 179.7296 96 T 4.0068 8.3038 108.9360 64.8488 68.9338 177.2878 97 G 3.6382 8.0365 108.1800 47.5536 0.0000 175.3328 98 Q 3.9796 8.3020 122.0661 58.6711 29.0365 178.1254 99 K 3.7654 8.1341 120.5869 59.3724 32.1718 178.5702 100 A 4.1624 7.8923 120.5084 55.3609 18.3428 179.6241 101 L 3.9744 7.9662 117.4432 57.9786 41.5212 179.5532 102 D 4.3235 8.3264 119.3060 57.5559 40.7463 178.4468 103 Y 4.2721 7.8924 117.2660 61.1888 37.8125 178.4913 104 I 3.7995 8.2185 120.7020 64.3287 37.1466 178.3221 105 A 4.0764 8.2563 121.7048 55.2780 18.2637 179.7471 106 Q 4.0262 7.9642 116.3952 59.1795 28.7556 179.0268 107 I 3.8001 7.9980 120.9575 64.3149 37.1297 177.9572 108 D 4.3933 8.6178 119.4548 57.1164 41.0930 178.2262 109 K 4.1144 8.2210 120.2026 59.7075 32.2810 178.9164 110 I 3.5353 7.6527 119.5957 64.0534 37.0492 177.9104 111 F 4.0250 8.6305 122.0019 61.4662 39.1631 177.4554 112 W 4.2105 8.2155 118.0219 59.5517 28.7970 178.4879 113 E 4.1415 8.1591 118.7969 59.4944 28.6771 179.2540 114 T 4.1047 7.7973 108.8815 64.2861 69.0322 176.7272 115 K 4.0310 7.3842 120.6023 58.9239 32.1411 178.7118 116 K 4.1761 8.0117 118.9450 58.7863 32.2853 176.9767 117 A 4.3251 8.0083 124.8452 52.4355 18.4671 176.8670 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 H 8.43 4.65 0.00 3.27 3.33 0.00 5.48 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.64 4.08 0.00 3.10 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 3 D 8.34 4.56 0.00 2.87 2.84 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 4 L 8.04 4.07 0.00 1.59 1.73 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.57 0.00 2.27 2.08 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 6 C 8.43 4.32 0.00 3.00 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 7 G 8.23 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 8 V 7.19 4.29 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 0.87 0.00 0.00 0.91 0.00 0.00 9 Y 8.04 4.71 0.00 2.76 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 0.00 0.00 0.00 10 D 7.91 3.63 0.00 2.58 2.36 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 11 P 0.00 4.08 0.00 2.23 1.87 0.00 2.85 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 1.29 1.10 0.00 12 A 8.43 3.98 1.37 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 0.00 0.00 13 Q 7.97 3.76 0.00 1.81 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 14 A 7.75 4.08 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 15 R 8.16 3.85 0.00 1.89 2.07 0.00 3.12 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.69 0.00 16 I 8.02 3.73 1.86 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 1.52 0.99 0.91 0.00 0.00 17 E 7.98 4.00 0.00 2.18 2.21 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 2.56 2.55 0.00 18 A 8.22 4.08 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 19 E 8.54 3.97 0.00 2.25 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 2.34 2.46 0.00 20 S 7.99 4.15 0.00 4.10 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 21 V 7.72 3.56 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 1.00 0.00 0.00 0.97 0.00 0.00 22 K 8.07 4.12 0.00 1.90 1.79 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.18 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.59 7.81 23 A 8.15 4.21 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 24 I 8.15 3.76 2.00 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 1.53 0.80 0.85 0.00 0.00 25 Q 8.13 4.02 0.00 2.29 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.62 0.00 26 E 8.34 4.00 0.00 2.24 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 2.34 2.51 0.00 27 K 8.23 4.12 0.00 2.18 2.18 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.75 7.81 28 M 8.42 4.39 0.00 2.10 2.31 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 2.88 2.47 0.00 29 A 7.78 3.97 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 30 A 7.61 4.59 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 31 N 7.55 4.65 0.00 2.40 2.33 0.00 0.00 7.15 8.35 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 32 D 8.69 4.76 0.00 2.83 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 33 D 8.46 4.42 0.00 2.82 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 34 L 8.68 3.93 0.00 1.79 1.65 0.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 35 H 8.32 4.15 0.00 3.47 3.40 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.76 4.20 0.00 3.17 3.26 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 37 Q 8.46 3.94 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.68 2.59 0.00 38 I 7.86 3.63 1.99 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.76 0.88 0.00 0.00 39 R 7.98 3.81 0.00 1.70 1.89 0.00 3.16 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 1.64 1.84 0.00 40 A 7.92 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.85 3.73 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 1.18 0.00 0.00 42 V 7.85 3.53 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 1.01 0.00 0.00 0.96 0.00 0.00 43 I 7.95 3.92 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.49 0.89 0.00 0.00 44 K 8.38 3.89 0.00 1.81 1.97 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.17 3.89 0.00 2.29 2.07 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 2.29 2.38 0.00 46 Q 7.88 3.98 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 47 R 8.26 3.96 0.00 1.82 2.09 0.00 3.29 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.79 0.00 48 A 8.26 4.00 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 49 E 8.24 3.86 0.00 2.19 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 0.00 2.29 2.38 0.00 50 L 7.96 3.94 0.00 1.94 1.70 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.21 4.05 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 52 K 8.29 3.90 0.00 1.99 1.87 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.64 7.81 53 H 8.41 4.16 0.00 3.21 3.41 0.00 5.79 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 54 H 8.35 4.20 0.00 3.36 3.28 0.00 5.67 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 55 L 8.04 4.11 0.00 1.88 1.76 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.48 4.54 0.00 2.92 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 57 V 8.09 3.74 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 1.30 0.00 0.00 0.91 0.00 0.00 58 L 7.98 3.89 0.00 2.09 1.69 0.76 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.48 4.64 0.00 3.43 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 0.00 60 S 8.79 4.03 0.00 4.04 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 61 D 8.29 4.70 0.00 3.00 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 62 Y 7.43 3.42 0.00 1.43 2.38 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 63 F 7.91 4.05 0.00 2.95 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 0.00 0.00 0.00 0.00 64 K 7.94 4.69 0.00 1.49 1.55 0.00 1.51 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.39 7.81 65 P 0.00 4.41 0.00 2.14 2.18 0.00 3.57 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.29 0.00 66 P 0.00 4.18 0.00 1.88 2.00 0.00 3.38 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.10 0.00 67 H 7.99 4.37 0.00 2.83 3.18 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 68 F 7.58 4.37 0.00 3.05 3.02 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 69 E 8.29 4.20 0.00 2.09 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 2.38 2.61 0.00 70 S 7.97 4.27 0.00 3.73 3.45 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 71 Y 8.01 4.71 0.00 2.99 2.91 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 72 P 0.00 4.41 0.00 2.07 2.17 0.00 3.69 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 2.04 2.23 0.00 73 E 8.16 4.38 0.00 2.16 2.24 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 2.39 2.30 0.00 74 L 8.31 3.90 0.00 1.83 1.90 0.51 0.09 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 H 8.34 4.38 0.00 3.24 3.34 0.00 5.68 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 76 T 7.93 3.82 4.39 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 1.18 0.00 0.00 77 L 8.02 3.80 0.00 1.85 1.84 1.06 0.78 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 78 V 7.88 3.54 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 0.93 0.00 0.00 1.15 0.00 0.00 79 N 8.06 4.03 0.00 2.69 2.74 0.00 0.00 7.21 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 80 E 8.38 3.72 0.00 1.35 1.12 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 2.15 2.35 0.00 81 A 7.52 3.86 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 82 V 7.80 3.61 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 0.81 0.00 0.00 0.88 0.00 0.00 83 K 8.05 4.00 0.00 1.91 1.80 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.44 7.81 84 A 8.07 4.10 1.57 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 0.00 0.00 85 L 7.84 4.02 0.00 1.91 1.73 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.11 4.13 0.00 4.04 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 87 A 7.84 4.00 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 88 A 8.01 4.18 1.41 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 89 K 7.82 3.94 0.00 1.98 2.00 0.00 1.69 0.00 0.00 1.94 0.00 0.00 3.21 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.63 7.81 90 A 7.39 4.47 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 91 S 7.25 4.63 0.00 3.76 3.76 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 92 T 8.33 4.35 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 1.21 0.00 0.00 93 D 8.27 4.52 0.00 2.70 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 94 P 0.00 4.69 0.00 2.20 2.11 0.00 3.94 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.93 0.00 95 A 8.76 4.02 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 96 T 8.30 4.01 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 1.22 0.00 0.00 97 G 8.04 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.30 3.98 0.00 2.17 2.25 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 2.34 2.38 0.00 99 K 8.13 3.77 0.00 1.95 1.96 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.31 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.28 7.81 100 A 7.89 4.16 1.41 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 0.00 101 L 7.97 3.97 0.00 1.91 1.74 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.33 4.32 0.00 2.59 2.52 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 0.00 103 Y 7.89 4.27 0.00 3.20 2.91 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 0.00 104 I 8.22 3.80 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.94 0.94 0.00 0.00 105 A 8.26 4.08 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.96 4.03 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 107 I 8.00 3.80 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.85 1.08 0.00 0.00 108 D 8.62 4.39 0.00 2.95 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 0.00 109 K 8.22 4.11 0.00 1.98 2.02 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.18 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.58 7.81 110 I 7.65 3.54 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 0.97 0.71 -0.10 0.00 0.00 111 F 8.63 4.03 0.00 3.03 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 0.00 112 W 8.22 4.21 0.00 3.56 3.26 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 0.00 113 E 8.16 4.14 0.00 2.29 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 0.00 2.45 2.72 0.00 114 T 7.80 4.10 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 1.36 0.00 0.00 115 K 7.38 4.03 0.00 1.98 1.94 0.00 1.48 0.00 0.00 0.85 0.00 0.00 2.91 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.35 0.32 7.81 116 K 8.01 4.18 0.00 1.86 2.07 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.49 7.81 117 A 8.01 4.33 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00