NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6099 8.3649 120.3109 53.3763 40.7135 174.9035 2 C 4.8263 8.3691 115.1016 54.7895 39.7544 172.3578 3 L 4.2679 8.6464 122.7396 54.1153 42.9212 176.6682 4 S 4.3332 8.4325 116.9173 60.6064 62.9374 175.2220 5 G 4.0096 9.3519 113.3879 44.6901 0.0000 172.4958 6 W 4.9180 8.0441 119.3321 54.8770 31.5699 175.4855 7 S 4.8763 9.4944 121.1217 57.6812 64.1398 173.4562 8 S 5.3306 8.8071 118.8452 57.8964 64.0826 173.1575 9 Y 3.9863 9.3613 125.7913 57.7383 41.5669 174.5419 10 E 3.5070 9.1159 129.2054 57.4066 26.8257 175.7668 11 G 3.8581 8.0118 102.6783 45.8520 0.0000 171.3977 12 H 5.1129 8.1300 115.8218 53.9661 33.5420 171.5443 13 C 5.7689 9.3303 117.0154 55.7124 39.9546 173.0521 14 Y 6.0427 9.6685 119.5307 55.4406 42.4335 174.4449 15 K 4.4026 8.1930 121.7324 54.9457 35.6332 174.3619 16 A 4.7364 8.1097 129.0953 50.9288 20.3776 176.1609 17 F 4.2888 8.9368 120.6025 54.9457 41.9468 176.0372 18 E 4.1614 8.3889 123.8357 56.4421 30.2730 175.9720 19 K 4.4712 7.4655 117.2653 55.4114 34.8338 176.2312 20 Y 4.6809 8.6943 121.8573 56.7449 37.7373 174.8292 21 K 4.9428 8.9698 123.6034 54.2494 36.8195 176.4284 22 T 5.5345 8.2158 111.8005 60.2877 70.4019 175.4260 23 W 2.5400 8.0784 130.4055 60.0612 30.3705 177.5589 24 E 4.0464 8.0957 117.0652 59.7618 28.9410 178.6868 25 D 4.1874 7.8270 119.0759 56.5968 40.9314 178.6526 26 A 2.7765 7.7914 121.7592 54.6454 18.1749 179.1806 27 E 3.2282 7.2931 118.1662 59.1106 29.5152 179.0109 28 R 3.6830 7.4288 118.6565 59.4144 29.9121 178.7303 29 V 3.7740 7.0363 118.1673 65.3931 31.6183 177.2329 30 C 4.4284 7.6838 115.9181 60.4130 38.3796 176.1328 31 T 3.7801 7.7933 118.5836 65.8557 67.7825 175.9046 32 E 3.9945 8.0832 119.1390 58.0022 29.4078 178.8347 33 Q 4.2061 8.1817 118.4665 57.7666 29.4709 175.9072 34 A 4.2683 6.7073 119.2950 50.9085 22.4206 175.7489 35 K 4.2267 8.4528 120.3278 60.4967 31.3021 176.5537 36 G 3.8525 8.7274 112.7346 45.4691 0.0000 173.0324 37 A 4.4622 8.1267 124.1386 52.6283 19.3244 176.2814 38 H 4.9199 8.5529 116.7799 54.8551 33.5667 173.0058 39 L 4.6806 8.2593 119.0997 54.6764 42.4736 178.0064 40 V 3.9422 8.4832 121.4392 62.1128 32.5602 175.3618 41 S 4.8358 8.7584 118.7151 56.5443 63.8066 173.9469 42 I 4.3065 8.3460 127.3791 60.6774 36.8237 175.4252 43 E 4.7775 9.3518 124.7388 55.5565 30.5756 176.1776 44 S 4.6506 7.4878 113.3754 56.6219 66.5624 176.4327 45 S 4.2365 8.4872 118.0598 61.7786 62.6376 177.0618 46 G 3.7686 8.2044 107.9600 47.8928 0.0000 175.1485 47 E 3.3810 8.0837 119.9790 58.6238 29.6666 178.4617 48 A 4.1096 8.0480 120.9283 55.7116 18.4343 179.4940 49 D 4.3297 8.3215 117.0547 56.9596 40.8167 178.8989 50 F 3.8944 7.8260 121.4986 61.1512 39.2669 177.2529 51 V 3.1672 7.7251 117.5898 65.8584 31.3134 177.6348 52 A 4.0008 8.0259 120.4491 55.3924 18.2437 179.4625 53 Q 3.7959 7.9941 118.0196 58.8555 29.0931 177.9574 54 L 3.5247 7.7795 121.7170 57.9366 42.0106 179.0064 55 V 3.2825 7.6332 118.5529 66.2518 31.2317 178.1380 56 T 3.7197 7.1852 106.8056 63.9677 68.6764 175.5292 57 Q 4.2564 7.5218 119.2753 56.4478 29.3333 175.8676 58 N 4.7122 7.7966 115.6448 53.6673 40.0905 174.8656 59 M 4.3463 7.9000 119.0904 54.2853 32.5584 177.5160 60 K 4.0346 8.5885 123.5808 58.2987 32.5032 177.4523 61 R 4.5720 7.5540 117.8503 54.8235 32.9795 174.5888 62 L 4.6724 8.5876 122.3384 54.9228 41.7973 177.0370 63 D 4.3394 8.0197 117.0907 54.8253 40.9291 175.3525 64 F 4.8179 7.6643 116.9321 55.5082 42.6781 173.3308 65 Y 4.9662 8.4854 118.8672 57.4857 39.1197 175.4374 66 I 4.6397 8.6025 117.0353 58.7663 39.6895 175.1524 67 W 5.1047 9.1157 127.7188 56.8529 30.1295 175.2603 68 I 4.9344 8.7450 116.3248 58.5501 40.7637 176.5506 69 G 3.9864 9.2820 109.6873 46.6012 0.0000 172.8548 70 L 4.6355 7.6252 123.8291 53.4433 43.5971 175.6249 71 R 4.5257 7.9018 120.8537 55.0450 32.2834 174.2055 72 V 3.7477 7.7775 120.3448 62.5457 32.2157 175.3967 73 Q 4.0405 8.4231 127.1177 55.5852 29.3192 174.2688 74 G 3.6489 8.1814 108.1883 44.1402 0.0000 173.5300 75 K 4.4614 8.1727 117.7232 54.3425 31.6294 174.8447 76 V 4.4027 7.2379 112.6894 59.0849 34.8680 176.6153 77 K 3.6688 8.7062 122.9856 57.9142 32.3623 177.1196 78 Q 4.4192 7.3066 113.3710 55.5653 30.6780 173.6310 79 C 4.4777 8.4748 116.2012 59.4904 28.8745 173.0869 80 N 4.5976 7.8809 119.8489 52.7192 39.1283 174.7981 81 S 4.4953 8.5559 119.3737 58.8359 64.1350 173.4242 82 E 5.1021 7.7101 119.5493 54.2756 33.2381 175.3248 83 W 4.4271 8.9511 122.3332 55.9263 29.8989 177.8384 84 S 4.2846 8.8763 114.6141 60.7730 62.3561 174.7550 85 D 4.5999 8.0705 119.0636 53.1491 39.8802 175.9154 86 G 4.1969 8.5728 108.7197 46.2982 0.0000 174.9611 87 S 4.3217 8.4306 115.1477 58.9835 63.5276 173.9620 88 S 4.8313 8.4290 118.1290 57.8114 63.7553 174.9282 89 V 4.2256 8.3192 124.1018 62.4707 30.2086 175.4970 90 S 4.6123 8.5537 121.8449 60.2866 64.3364 174.2856 91 Y 4.5090 7.9375 121.2299 57.2977 39.3575 174.4600 92 E 4.2599 7.8661 122.9435 55.2649 33.2319 174.8844 93 N 4.8784 7.5394 116.0621 52.3662 39.2929 174.5114 94 W 4.2896 8.2187 118.8493 56.6269 30.5390 176.7364 95 I 4.2096 8.3351 122.2207 60.2323 37.5183 176.5548 96 E 3.7458 9.0214 125.8082 59.3925 29.4269 178.3043 97 A 2.8061 7.4499 118.4716 53.1343 18.6243 177.6414 98 E 4.2011 7.9629 114.8744 57.7390 30.1173 177.2638 99 S 4.0600 7.5219 115.3354 57.7027 61.6491 173.0679 100 K 4.6770 8.0768 127.5108 55.2286 30.6527 176.5256 101 T 4.5030 7.7081 108.6367 61.2730 70.6295 175.3099 102 C 5.1453 8.3112 118.9717 55.4729 38.8319 172.9121 103 L 6.0585 7.9501 120.4280 52.6260 45.1636 175.7458 104 G 4.6537 8.5342 107.1535 45.4154 0.0000 170.9700 105 L 5.7004 9.1315 119.8074 53.2466 44.6455 175.9557 106 E 4.7801 8.3413 117.9519 54.6344 32.9226 175.8607 107 K 2.7163 8.3565 122.2508 59.2114 32.4139 178.3353 108 E 3.9785 7.9648 118.3127 58.7360 29.3393 177.2927 109 T 4.3605 7.4262 106.0373 60.8100 69.1311 173.9659 110 D 4.1434 8.3783 119.7276 55.5230 38.5649 173.6884 111 F 3.9988 7.3403 114.3296 58.7928 37.0212 176.5282 112 R 4.6040 7.7009 118.4093 55.9390 31.9978 176.3678 113 K 4.5528 7.8673 115.8952 54.2788 34.6488 175.6964 114 W 5.2110 8.4737 122.8848 55.8313 30.4719 175.8237 115 V 4.5451 9.2635 124.6882 61.1041 33.9617 174.2360 116 N 5.2213 8.7895 124.8221 52.8930 39.1381 174.4066 117 I 4.7132 9.1683 117.2090 58.7056 42.1165 173.9705 118 Y 4.7681 8.5956 124.5772 57.9171 39.1936 177.3184 119 C 3.9718 9.1149 124.7964 59.8997 40.4641 175.3945 120 G 3.3333 5.4907 105.6265 45.7011 0.0000 173.5402 121 Q 4.4508 8.2257 119.7051 55.8089 30.4385 175.4915 122 Q 5.1648 8.8193 120.7969 54.9006 29.7012 174.6611 123 N 5.1931 9.6409 121.8646 50.3144 43.3968 172.7207 124 P 5.4599 0.0000 0.0000 62.5761 33.6591 174.1977 125 F 5.2692 7.9716 113.9997 56.3927 41.8843 172.7714 126 V 4.9214 8.4038 117.8474 61.4051 34.4565 173.5623 127 C 5.5651 9.5422 124.5740 55.3312 40.5278 172.4147 128 E 5.2656 9.2666 121.8448 54.4580 33.2059 175.3951 129 A 4.3481 8.9896 126.9477 52.2650 19.6485 175.7598 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 D 8.36 4.61 0.00 2.79 2.79 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 0.00 0.00 0.00 2 C 8.37 4.83 0.00 3.12 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 3 L 8.65 4.27 0.00 1.25 1.45 0.71 0.57 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 4 S 8.43 4.33 0.00 3.92 3.87 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 5 G 9.35 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 6 W 8.04 4.92 0.00 3.27 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 7 S 9.49 4.88 0.00 4.11 4.12 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 8 S 8.81 5.33 0.00 3.98 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 9 Y 9.36 3.99 0.00 1.43 2.16 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 10 E 9.12 3.51 0.00 1.70 1.71 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 1.77 1.47 0.00 11 G 8.01 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 0.00 0.00 0.00 12 H 8.13 5.11 0.00 3.26 2.82 0.00 5.56 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 C 9.33 5.77 0.00 2.90 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 14 Y 9.67 6.04 0.00 3.08 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 15 K 8.19 4.40 0.00 0.79 0.74 0.00 1.03 0.00 0.00 0.61 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.44 7.81 16 A 8.11 4.74 0.98 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 0.00 0.00 17 F 8.94 4.29 0.00 1.51 2.31 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 18 E 8.39 4.16 0.00 1.81 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 2.08 2.14 0.00 19 K 7.47 4.47 0.00 1.82 1.81 0.00 1.79 0.00 0.00 1.92 0.00 0.00 2.90 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.52 1.49 7.81 20 Y 8.69 4.68 0.00 2.83 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 21 K 8.97 4.94 0.00 1.66 1.58 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.60 7.81 22 T 8.22 5.53 4.33 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 1.25 0.00 0.00 23 W 8.08 2.54 0.00 1.98 2.59 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 24 E 8.10 4.05 0.00 2.23 2.25 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 2.30 2.33 0.00 25 D 7.83 4.19 0.00 2.78 2.64 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 26 A 7.79 2.78 0.34 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 27 E 7.29 3.23 0.00 1.16 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 2.10 2.12 0.00 28 R 7.43 3.68 0.00 1.88 1.95 0.00 3.09 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 29 V 7.04 3.77 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 0.83 0.00 0.00 0.92 0.00 0.00 30 C 7.68 4.43 0.00 3.07 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 31 T 7.79 3.78 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 1.12 0.00 0.00 32 E 8.08 3.99 0.00 2.17 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 0.00 2.29 2.47 0.00 33 Q 8.18 4.21 0.00 2.33 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.69 0.00 0.00 0.00 0.00 0.00 2.89 3.07 0.00 34 A 6.71 4.27 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 35 K 8.45 4.23 0.00 1.70 1.78 0.00 1.59 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.46 7.81 36 G 8.73 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 37 A 8.13 4.46 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 38 H 8.55 4.92 0.00 3.02 3.26 0.00 5.62 0.00 0.00 0.00 0.00 6.76 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 4.68 0.00 1.37 1.58 -0.31 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.48 3.94 2.30 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 0.87 0.00 0.00 1.32 0.00 0.00 41 S 8.76 4.84 0.00 4.04 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 42 I 8.35 4.31 2.31 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.14 1.23 0.00 0.00 43 E 9.35 4.78 0.00 2.08 2.03 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 2.32 2.50 0.00 44 S 7.49 4.65 0.00 4.08 4.02 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 45 S 8.49 4.24 0.00 3.93 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 46 G 8.20 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 0.00 0.00 0.00 47 E 8.08 3.38 0.00 2.32 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 2.40 2.34 0.00 48 A 8.05 4.11 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 49 D 8.32 4.33 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 50 F 7.83 3.89 0.00 2.44 2.48 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 0.00 51 V 7.73 3.17 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 1.06 0.00 0.00 1.00 0.00 0.00 52 A 8.03 4.00 1.55 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 53 Q 7.99 3.80 0.00 2.19 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.74 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 54 L 7.78 3.52 0.00 1.01 1.43 0.67 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.63 3.28 1.69 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 0.35 0.00 0.00 0.79 0.00 0.00 56 T 7.19 3.72 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 1.17 0.00 0.00 57 Q 7.52 4.26 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 58 N 7.80 4.71 0.00 2.55 2.63 0.00 0.00 6.99 7.44 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 59 M 7.90 4.35 0.00 1.92 1.86 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 60 K 8.59 4.03 0.00 1.97 1.87 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.53 7.81 61 R 7.55 4.57 0.00 2.12 2.08 0.00 3.25 0.00 0.00 3.40 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 62 L 8.59 4.67 0.00 1.68 1.92 0.83 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.02 4.34 0.00 1.96 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 0.00 0.00 0.00 64 F 7.66 4.82 0.00 3.02 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 65 Y 8.49 4.97 0.00 2.59 2.67 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 66 I 8.60 4.64 1.88 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 1.28 0.98 0.96 0.00 0.00 67 W 9.12 5.10 0.00 3.29 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 68 I 8.75 4.93 1.85 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.05 1.08 0.00 0.00 69 G 9.28 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 0.00 0.00 0.00 70 L 7.63 4.64 0.00 1.30 1.28 0.69 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.90 4.53 0.00 1.29 0.95 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.99 0.00 72 V 7.78 3.75 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 0.63 0.00 0.00 0.80 0.00 0.00 73 Q 8.42 4.04 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.11 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 74 G 8.18 3.65 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 0.00 0.00 0.00 75 K 8.17 4.46 0.00 1.60 1.64 0.00 1.56 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 1.42 7.81 76 V 7.24 4.40 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 0.75 0.00 0.00 0.82 0.00 0.00 77 K 8.71 3.67 0.00 1.17 0.74 0.00 1.57 0.00 0.00 2.28 0.00 0.00 3.13 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.27 1.16 7.81 78 Q 7.31 4.42 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.98 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 79 C 8.47 4.48 0.00 2.92 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 80 N 7.88 4.60 0.00 2.64 2.63 0.00 0.00 7.07 7.63 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 81 S 8.56 4.50 0.00 4.03 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 82 E 7.71 5.10 0.00 1.94 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 0.00 2.25 2.31 0.00 83 W 8.95 4.43 0.00 3.59 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 84 S 8.88 4.28 0.00 4.04 4.09 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 85 D 8.07 4.60 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 86 G 8.57 4.20 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 0.00 0.00 0.00 87 S 8.43 4.32 0.00 4.13 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 88 S 8.43 4.83 0.00 3.94 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 89 V 8.32 4.23 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 0.68 0.00 0.00 0.57 0.00 0.00 90 S 8.55 4.61 0.00 4.04 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 91 Y 7.94 4.51 0.00 2.93 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 92 E 7.87 4.26 0.00 2.00 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 2.28 2.36 0.00 93 N 7.54 4.88 0.00 2.42 2.57 0.00 0.00 7.05 7.95 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 94 W 8.22 4.29 0.00 3.25 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 95 I 8.34 4.21 1.93 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 1.32 0.64 0.91 0.00 0.00 96 E 9.02 3.75 0.00 2.01 1.86 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 2.42 2.17 0.00 97 A 7.45 2.81 0.97 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 98 E 7.96 4.20 0.00 2.42 2.30 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 2.38 2.52 0.00 99 S 7.52 4.06 0.00 3.67 3.57 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 0.00 100 K 8.08 4.68 0.00 1.75 1.91 0.00 1.78 0.00 0.00 1.93 0.00 0.00 3.10 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.54 7.81 101 T 7.71 4.50 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 1.04 0.00 0.00 102 C 8.31 5.15 0.00 3.10 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 0.00 103 L 7.95 6.06 0.00 1.51 1.61 0.93 0.93 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 0.00 104 G 8.53 4.65 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 0.00 0.00 0.00 105 L 9.13 5.70 0.00 1.96 1.93 1.14 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.34 4.78 0.00 1.71 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 0.00 2.32 2.17 0.00 107 K 8.36 2.72 0.00 1.88 1.66 0.00 1.81 0.00 0.00 1.94 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.35 7.81 108 E 7.96 3.98 0.00 1.85 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 2.25 2.26 0.00 109 T 7.43 4.36 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 1.18 0.00 0.00 110 D 8.38 4.14 0.00 2.78 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 0.00 111 F 7.34 4.00 0.00 3.24 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 0.00 112 R 7.70 4.60 0.00 1.81 1.95 0.00 3.15 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.81 0.00 113 K 7.87 4.55 0.00 1.61 1.69 0.00 1.65 0.00 0.00 1.53 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.33 7.81 114 W 8.47 5.21 0.00 3.37 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 0.00 115 V 9.26 4.55 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 1.15 0.00 0.00 1.15 0.00 0.00 116 N 8.79 5.22 0.00 2.67 2.90 0.00 0.00 6.74 7.45 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 0.00 117 I 9.17 4.71 1.68 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.96 0.03 0.00 0.00 118 Y 8.60 4.77 0.00 3.29 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 0.00 119 C 9.11 3.97 0.00 2.66 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 0.00 120 G 5.49 3.33 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 0.00 121 Q 8.23 4.45 0.00 2.43 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.65 6.72 0.00 0.00 0.00 0.00 0.00 2.58 2.67 0.00 122 Q 8.82 5.16 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 123 N 9.64 5.19 0.00 1.44 2.53 0.00 0.00 6.48 7.58 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 0.00 124 P 0.00 5.46 0.00 1.90 1.61 0.00 3.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.58 0.00 125 F 7.97 5.27 0.00 3.15 3.34 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 0.00 126 V 8.40 4.92 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 1.15 0.00 0.00 0.91 0.00 0.00 127 C 9.54 5.57 0.00 3.11 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 0.00 128 E 9.27 5.27 0.00 1.99 1.71 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 1.87 1.47 0.00 129 A 8.99 4.35 1.10 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 0.00 0.00 0.00 0.00 0.00