NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2193 8.3293 121.6991 55.6940 30.4521 175.4893 4 S 4.2118 8.2596 120.4842 57.7897 65.3275 174.6104 5 F 4.1354 10.0071 123.4192 60.6384 39.0570 179.5380 6 T 3.9292 8.5119 116.1169 66.6691 68.3426 176.5139 7 S 4.1275 7.9897 114.6141 61.3246 62.3519 176.2459 8 I 3.6924 7.7268 122.2364 64.1562 36.7348 178.3324 9 A 3.9984 8.2623 121.8413 55.1539 18.2749 179.1197 10 R 3.8291 8.1076 117.1166 60.0380 30.1018 178.5639 11 I 3.7778 7.8698 118.7167 64.4820 37.2421 178.8633 12 G 3.6276 8.3618 106.6228 47.9296 0.0000 175.5865 13 D 4.4249 8.6590 121.8119 57.0492 40.4883 178.0660 14 Y 3.9870 8.0472 120.1042 60.9018 38.5417 178.4731 15 I 3.7992 7.6058 119.0843 64.3655 37.3084 178.2130 16 L 4.1292 7.7623 118.8477 57.0132 41.4318 179.3808 17 K 4.2987 7.6127 117.9289 57.8628 32.6277 177.2525 18 S 3.9729 7.1369 116.8482 57.9862 61.8542 172.7714 19 P 4.4462 0.0000 0.0000 63.8070 31.0996 178.4443 20 V 3.5397 7.5600 118.1586 66.0672 31.6088 177.6897 21 L 3.9587 7.5709 118.2356 57.7486 41.6475 179.3062 22 S 4.1046 8.3089 113.4101 61.4142 62.0275 176.1488 23 K 4.1719 7.4514 118.9596 57.9690 32.0563 178.5249 24 L 4.1822 7.1558 119.8632 57.5344 42.4960 177.7536 25 C 4.3349 8.3500 116.4925 62.0750 28.7187 175.9568 26 V 3.6092 7.2210 119.0092 65.8189 31.0361 176.2304 27 P 4.2712 0.0000 0.0000 65.4284 31.1208 178.6514 28 V 3.5693 7.7865 116.3079 66.0697 31.5683 177.7282 29 A 3.9889 8.4323 120.8212 55.3308 18.0603 179.3249 30 N 4.3523 8.8597 115.3027 56.5394 38.5886 177.4129 31 Q 4.0146 8.0936 120.5108 58.7609 29.1754 177.7133 32 F 4.2175 8.5418 122.0487 61.5128 39.3309 177.2392 33 I 3.8055 8.1283 119.3756 64.4242 36.6310 178.2388 34 N 4.1952 7.7298 116.8416 56.1245 38.4482 177.2517 35 L 4.0243 7.7422 119.4741 57.1789 41.7037 178.7585 36 A 3.9558 7.3972 120.5348 54.4925 18.6680 178.9428 37 G 3.7220 7.4866 104.3916 45.3873 0.0000 174.8591 38 Y 4.1619 7.5126 118.2649 59.8142 37.9304 178.2463 39 K 4.1536 7.0789 119.9365 58.8890 32.3148 178.7862 40 K 2.6468 7.5395 118.1067 57.5083 31.6385 178.1509 41 L 4.4908 7.5272 117.3510 54.3760 42.1361 177.0189 42 G 3.9572 7.9921 106.8148 45.4521 0.0000 173.0847 43 L 4.8265 7.5399 118.1599 52.8538 43.7715 176.2788 44 K 4.8740 9.0934 120.8781 54.8008 34.3575 177.5350 45 F 3.3604 9.3069 123.8511 61.7048 38.7671 177.6148 46 D 4.1174 8.1188 117.2434 56.8790 40.2876 178.1417 47 D 4.4388 7.8212 118.6767 56.5749 40.8463 177.7434 48 L 4.1293 7.3662 118.2717 54.5620 42.0643 177.1774 49 I 3.6214 6.4472 120.2319 60.5911 37.4167 175.8099 50 A 3.9906 8.6722 128.7771 52.7813 18.4244 176.7749 51 E 4.4477 8.6655 119.8569 56.3776 31.2254 176.4310 52 E 4.3822 7.8675 121.7197 54.4982 28.6309 175.1983 53 N 4.9246 7.2381 117.3517 50.1242 41.8095 173.5766 54 P 4.2893 0.0000 0.0000 65.9531 31.2618 178.7266 55 I 3.6872 7.7131 119.0575 64.7140 37.2280 178.2450 56 M 4.0572 8.0171 118.5336 58.0469 31.7603 178.7187 57 Q 4.0286 7.8620 118.1971 58.8468 28.7774 178.2438 58 T 3.8165 7.9941 115.9540 66.6388 68.8321 176.1010 59 A 4.1565 8.2130 122.6118 55.3411 18.6279 179.7986 60 L 3.9089 7.9646 117.3698 57.7109 41.3662 179.7558 61 R 3.9298 7.7512 118.2523 58.9699 30.1099 177.9925 62 R 4.1958 7.3206 115.1606 55.4936 30.7110 176.6348 63 L 3.3056 6.4741 120.9734 53.8755 42.6746 175.4562 64 P 4.2543 0.0000 0.0000 63.0002 32.9490 176.7482 65 E 3.4346 8.6894 120.0266 60.1075 29.2762 179.8190 66 D 4.4019 7.8284 117.8300 57.2846 40.9316 178.5607 67 E 3.8613 7.9511 118.8078 59.0885 29.5050 179.0647 68 S 3.9893 7.7149 113.2982 61.6910 62.4794 175.9387 69 Y 4.4054 7.7241 119.1458 60.9030 37.5219 178.4642 70 A 4.0641 7.9030 121.8877 55.1352 18.4732 179.4831 71 R 3.8123 8.3728 117.5109 59.5883 30.1052 178.5341 72 A 4.0120 8.0621 120.4491 55.3442 18.3333 179.0161 73 Y 4.1101 8.0939 117.9875 60.9756 38.8721 178.4164 74 R 3.6979 8.1737 119.0200 59.1375 30.1397 179.2046 75 I 3.6596 7.9645 119.7778 64.3977 37.1414 178.5800 76 I 3.7400 7.7672 120.6607 64.4016 36.9505 178.5222 77 R 3.7522 8.0364 119.6993 59.1274 29.6877 178.4521 78 A 3.9353 8.0534 120.7899 55.3930 18.3667 179.3543 79 H 4.0996 8.1675 114.7414 59.0188 28.5577 177.8366 80 Q 3.9572 7.8834 120.2473 59.4895 29.2778 178.2083 81 T 4.0031 7.9616 116.7929 66.4140 68.5251 176.1788 82 E 3.9223 8.4365 121.9309 59.3763 29.4374 178.9031 83 L 4.0579 7.9079 117.8408 57.8923 40.1441 178.1033 84 T 4.1766 7.5926 109.3068 60.9247 69.0794 174.3142 85 H 4.0270 7.7878 117.5449 57.7048 26.9215 173.7183 86 H 5.0110 7.5314 110.7797 54.0880 31.8507 173.0162 87 L 4.8268 8.0317 119.8478 52.8200 44.1994 176.6750 88 L 4.4066 8.3021 119.9566 53.9758 42.6741 175.7092 89 P 4.2338 0.0000 0.0000 63.3411 31.9783 177.9304 90 R 2.0000 8.5063 122.5213 58.4321 30.0250 178.2768 91 N 4.4282 7.7658 113.1377 54.3469 37.5297 175.2032 92 E 4.4873 8.1587 117.8896 56.4084 30.5157 176.3591 93 W 4.7847 7.6334 118.7900 56.9367 29.9837 175.9795 94 I 4.1123 8.2341 123.7945 61.3891 37.2350 176.3416 95 K 4.4892 9.3467 126.3891 55.4721 32.9534 178.0594 96 A 4.0938 8.7924 124.0047 55.6102 18.0025 180.3053 97 Q 4.0801 8.0536 115.4564 58.9418 28.9207 177.9639 98 E 4.2707 8.0674 118.7229 58.0246 30.9779 177.2051 99 D 4.8166 7.4910 118.7645 53.5279 39.5966 175.7841 100 V 4.2269 7.3688 120.1374 61.3519 33.8532 174.6723 101 P 4.8000 0.0000 0.0000 62.3754 29.2867 176.3532 102 Y 4.3185 7.9079 122.7005 59.8967 39.0229 177.5266 103 L 4.4082 7.4210 121.7334 55.8586 43.1261 177.7806 104 L 3.6522 7.5187 119.8980 57.8578 41.7990 177.2335 105 P 4.0918 0.0000 0.0000 66.0439 31.2051 177.9921 106 Y 4.0592 7.5178 115.9830 60.6739 37.7400 178.3038 107 I 3.6623 7.7357 120.7449 64.4375 37.2425 178.4370 108 L 3.9900 8.0415 120.0134 57.6906 41.4384 179.2188 109 E 3.8786 8.2996 118.9678 59.3617 29.6036 178.8236 110 A 4.0490 8.1319 120.7243 55.1847 18.3691 179.4625 111 E 3.9385 8.6258 117.3107 59.3685 29.4161 179.4931 112 A 3.9589 8.1464 120.6525 55.0597 18.4957 179.3894 113 A 3.9125 8.0966 119.1064 55.3610 18.4395 179.7669 114 A 3.9202 8.1700 119.1823 55.1956 18.4780 179.7611 115 K 3.8942 8.4793 118.6534 59.5540 32.2466 178.6272 116 E 3.9170 8.4854 119.9023 59.1207 29.5268 178.6601 117 K 3.9304 8.0314 119.7174 59.6311 32.0259 178.2823 118 D 4.3689 7.9623 117.3084 57.1806 41.4474 177.8651 119 E 4.1133 8.2532 119.2649 59.5075 29.1475 179.3524 120 L 4.0807 8.5402 119.2810 57.7047 41.4596 179.1315 121 D 4.6007 8.4892 118.1975 56.1184 40.7151 176.7766 122 N 4.9855 7.4150 114.4810 52.3475 39.6142 174.4645 123 I 3.7347 7.3185 112.0044 61.1598 37.8646 175.9583 124 E 4.4459 8.5089 123.8488 55.5242 30.7080 175.9320 125 V 4.4868 8.0012 112.6917 59.5642 34.9353 175.3273 126 S 4.6909 8.5975 117.4198 56.3638 64.7717 173.8914 127 K 4.2010 8.6458 125.4840 56.5784 32.1396 176.0137 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 Q 8.33 4.22 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.98 0.00 0.00 0.00 0.00 0.00 2.10 2.28 0.00 4 S 8.26 4.21 0.00 4.45 3.98 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 5 F 10.01 4.14 0.00 3.39 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 6 T 8.51 3.93 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 1.23 0.00 0.00 7 S 7.99 4.13 0.00 3.87 3.96 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 8 I 7.73 3.69 1.82 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.43 0.88 0.00 0.00 9 A 8.26 4.00 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 10 R 8.11 3.83 0.00 2.06 2.08 0.00 3.10 0.00 0.00 3.13 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 11 I 7.87 3.78 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.88 0.00 0.00 12 G 8.36 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 0.00 0.00 0.00 13 D 8.66 4.42 0.00 2.79 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 14 Y 8.05 3.99 0.00 3.12 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 15 I 7.61 3.80 2.06 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 1.65 0.98 0.92 0.00 0.00 16 L 7.76 4.13 0.00 1.89 1.72 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.61 4.30 0.00 1.62 1.76 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.50 7.81 18 S 7.14 3.97 0.00 3.54 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 19 P 0.00 4.45 0.00 2.17 2.03 0.00 3.60 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 2.07 2.19 0.00 20 V 7.56 3.54 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 1.06 0.00 0.00 0.90 0.00 0.00 21 L 7.57 3.96 0.00 1.87 1.70 0.94 0.82 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 22 S 8.31 4.10 0.00 4.09 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 23 K 7.45 4.17 0.00 1.87 1.84 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.42 7.81 24 L 7.16 4.18 0.00 1.84 1.88 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 25 C 8.35 4.33 0.00 3.03 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 26 V 7.22 3.61 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 0.98 0.00 0.00 27 P 0.00 4.27 0.00 2.20 2.09 0.00 3.60 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.15 0.00 28 V 7.79 3.57 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 1.11 0.00 0.00 0.96 0.00 0.00 29 A 8.43 3.99 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 30 N 8.86 4.35 0.00 3.01 2.91 0.00 0.00 6.67 7.36 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 31 Q 8.09 4.01 0.00 2.21 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 32 F 8.54 4.22 0.00 3.03 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 33 I 8.13 3.81 2.09 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.08 0.93 0.00 0.00 34 N 7.73 4.20 0.00 2.76 2.83 0.00 0.00 7.08 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 35 L 7.74 4.02 0.00 1.65 1.63 0.93 0.84 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 36 A 7.40 3.96 1.29 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 0.00 0.00 0.00 37 G 7.49 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 0.00 0.00 0.00 38 Y 7.51 4.16 0.00 3.20 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 39 K 7.08 4.15 0.00 1.43 1.88 0.00 1.88 0.00 0.00 1.79 0.00 0.00 2.62 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 0.79 7.81 40 K 7.54 2.65 0.00 1.41 1.07 0.00 1.16 0.00 0.00 1.14 0.00 0.00 2.58 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.30 0.21 7.81 41 L 7.53 4.49 0.00 1.71 1.67 0.85 0.93 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 42 G 7.99 3.96 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 0.00 0.00 0.00 43 L 7.54 4.83 0.00 2.01 1.64 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 44 K 9.09 4.87 0.00 2.11 1.95 0.00 1.82 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.47 7.81 45 F 9.31 3.36 0.00 3.07 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 46 D 8.12 4.12 0.00 2.34 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 0.00 0.00 0.00 47 D 7.82 4.44 0.00 2.73 2.72 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 48 L 7.37 4.13 0.00 1.11 1.29 0.75 0.17 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 49 I 6.45 3.62 1.75 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.06 1.07 0.00 0.00 50 A 8.67 3.99 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 51 E 8.67 4.45 0.00 2.06 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 2.18 2.30 0.00 52 E 7.87 4.38 0.00 1.96 1.96 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 2.29 2.35 0.00 53 N 7.24 4.92 0.00 2.88 2.88 0.00 0.00 5.85 7.76 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 54 P 0.00 4.29 0.00 2.29 2.36 0.00 3.71 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 2.08 2.06 0.00 55 I 7.71 3.69 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.98 0.95 0.00 0.00 56 M 8.02 4.06 0.00 2.01 2.26 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.61 0.00 57 Q 7.86 4.03 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.56 2.53 0.00 58 T 7.99 3.82 4.43 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 1.23 0.00 0.00 59 A 8.21 4.16 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 60 L 7.96 3.91 0.00 1.71 1.69 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 61 R 7.75 3.93 0.00 2.01 2.09 0.00 3.23 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 62 R 7.32 4.20 0.00 1.98 1.88 0.00 3.29 0.00 0.00 3.36 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 63 L 6.47 3.31 0.00 1.41 1.47 0.86 0.97 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 64 P 0.00 4.25 0.00 2.25 2.16 0.00 3.51 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 65 E 8.69 3.43 0.00 1.89 1.79 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 0.00 2.12 2.30 0.00 66 D 7.83 4.40 0.00 2.66 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 67 E 7.95 3.86 0.00 2.01 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 0.00 2.34 2.29 0.00 68 S 7.71 3.99 0.00 3.70 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 0.00 69 Y 7.72 4.41 0.00 3.07 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 70 A 7.90 4.06 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 71 R 8.37 3.81 0.00 1.82 2.09 0.00 3.20 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 1.67 1.98 0.00 72 A 8.06 4.01 1.52 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 73 Y 8.09 4.11 0.00 3.14 3.18 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 74 R 8.17 3.70 0.00 2.04 1.94 0.00 3.43 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 75 I 7.96 3.66 2.01 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 1.50 0.93 0.95 0.00 0.00 76 I 7.77 3.74 1.85 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 1.42 0.90 0.92 0.00 0.00 77 R 8.04 3.75 0.00 1.16 1.69 0.00 2.93 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.47 0.00 78 A 8.05 3.94 1.29 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 0.00 0.00 0.00 79 H 8.17 4.10 0.00 3.39 3.32 0.00 5.82 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 7.88 3.96 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 81 T 7.96 4.00 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 1.26 0.00 0.00 82 E 8.44 3.92 0.00 2.12 2.12 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 2.30 2.37 0.00 83 L 7.91 4.06 0.00 1.78 1.76 0.88 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.59 4.18 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 1.23 0.00 0.00 85 H 7.79 4.03 0.00 3.39 3.46 0.00 5.59 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 H 7.53 5.01 0.00 3.07 3.25 0.00 5.81 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.03 4.83 0.00 1.64 1.77 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.30 4.41 0.00 1.98 1.79 1.02 0.85 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 89 P 0.00 4.23 0.00 2.07 1.98 0.00 3.79 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.18 0.00 90 R 8.51 2.00 0.00 1.26 0.66 0.00 2.40 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.27 0.00 91 N 7.77 4.43 0.00 2.75 2.84 0.00 0.00 5.96 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 92 E 8.16 4.49 0.00 2.25 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 0.00 2.34 2.30 0.00 93 W 7.63 4.78 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 94 I 8.23 4.11 1.96 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.91 1.03 0.00 0.00 95 K 9.35 4.49 0.00 1.92 1.89 0.00 1.87 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.46 7.81 96 A 8.79 4.09 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 97 Q 8.05 4.08 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.05 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 98 E 8.07 4.27 0.00 2.16 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 2.38 2.36 0.00 99 D 7.49 4.82 0.00 2.80 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 0.00 100 V 7.37 4.23 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 0.99 0.00 0.00 1.08 0.00 0.00 101 P 0.00 4.80 0.00 2.26 2.25 0.00 3.82 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 102 Y 7.91 4.32 0.00 3.32 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 0.00 103 L 7.42 4.41 0.00 0.89 1.35 0.88 0.34 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 0.00 104 L 7.52 3.65 0.00 1.79 1.74 0.85 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.09 0.00 1.85 2.10 0.00 3.64 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.91 0.00 106 Y 7.52 4.06 0.00 3.21 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 0.00 107 I 7.74 3.66 1.68 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.73 0.00 0.00 108 L 8.04 3.99 0.00 1.63 1.71 0.92 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.30 3.88 0.00 2.06 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 0.00 2.32 2.32 0.00 110 A 8.13 4.05 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 0.00 111 E 8.63 3.94 0.00 2.19 2.05 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 2.39 2.52 0.00 112 A 8.15 3.96 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 0.00 113 A 8.10 3.91 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 0.00 114 A 8.17 3.92 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 0.00 115 K 8.48 3.89 0.00 1.95 1.97 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.50 7.81 116 E 8.49 3.92 0.00 2.07 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 0.00 2.31 2.32 0.00 117 K 8.03 3.93 0.00 1.89 1.94 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.61 1.45 7.81 118 D 7.96 4.37 0.00 2.80 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 0.00 119 E 8.25 4.11 0.00 2.32 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 2.33 2.35 0.00 120 L 8.54 4.08 0.00 1.64 1.71 0.92 1.05 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 0.00 121 D 8.49 4.60 0.00 2.62 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 0.00 122 N 7.42 4.99 0.00 2.77 2.78 0.00 0.00 6.99 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 0.00 123 I 7.32 3.73 1.87 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 1.53 0.52 0.98 0.00 0.00 124 E 8.51 4.45 0.00 1.98 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 2.28 2.32 0.00 125 V 8.00 4.49 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 0.71 0.00 0.00 0.93 0.00 0.00 126 S 8.60 4.69 0.00 3.78 3.70 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 0.00 127 K 8.65 4.20 0.00 1.74 1.67 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.46 7.81