NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3386 8.2893 120.3210 55.1009 32.9736 178.4720 2 E 3.9660 9.1550 109.0798 53.2664 30.7777 175.3046 3 K 3.7190 8.9666 119.8491 57.9691 33.8629 177.1119 4 K 4.5775 8.0160 117.7177 56.2067 36.6719 173.7687 5 T 5.3197 9.1105 119.9233 61.8521 71.2599 173.5557 6 I 4.9349 8.7766 119.2025 59.0464 41.2412 174.3661 7 V 4.6378 8.4468 124.1198 61.6988 33.3686 174.3961 8 L 5.2032 8.6937 129.2648 53.6006 45.6921 175.4614 9 G 4.3471 8.4208 111.4722 46.0122 0.0000 171.5355 10 V 5.0842 8.3574 119.5453 61.0591 34.0670 174.8099 11 I 4.7792 8.6403 128.3628 60.6627 39.8391 176.1185 12 G 4.2182 8.9915 113.7603 47.7119 0.0000 175.1576 13 S 4.4436 9.0636 121.3479 58.3155 63.1724 173.1149 14 D 4.0017 7.0503 121.4833 53.3748 41.1303 176.3791 15 C 4.4926 8.3640 120.1172 58.0119 30.4475 173.4432 16 H 4.1882 8.6559 119.3212 56.2723 28.7047 174.9634 17 A 4.6561 8.4491 125.2011 51.8123 21.3810 178.2559 18 V 3.6649 8.0050 115.5345 66.1161 31.7134 178.2345 19 G 3.6422 8.0617 105.0143 47.6321 0.0000 174.9380 20 N 4.3343 8.1236 118.8454 56.5806 38.9609 176.9792 21 K 4.0150 8.0380 119.8058 59.4591 32.0831 179.4811 22 I 3.7364 7.8397 120.1048 64.3695 36.9698 178.4950 23 L 4.1738 8.5129 120.2209 57.7267 41.3526 178.8932 24 D 4.3515 8.2671 117.9928 57.7294 41.1123 177.6238 25 H 4.0654 8.4896 118.4397 59.4506 29.8460 177.0204 26 A 3.9656 8.5456 122.6650 55.3372 18.3067 179.7213 27 F 4.0819 8.8582 116.7366 60.7134 38.9035 178.2104 28 T 4.2907 8.3075 117.1845 66.4025 68.0965 176.5457 29 N 4.3524 8.2523 116.9164 55.9660 38.6118 176.7844 30 A 4.1991 7.9466 120.5166 52.6636 18.5982 177.9581 31 G 3.9199 7.8692 104.7328 44.8061 0.0000 174.2500 32 F 4.5471 8.4589 118.9943 57.0312 40.8814 174.7089 33 N 4.7021 9.5094 121.2531 52.7522 39.4700 173.8704 34 V 4.3724 8.3369 127.1592 61.7807 32.8067 175.7297 35 V 4.0331 9.0196 129.9564 61.6623 31.8263 173.5441 36 N 5.2034 8.4411 126.5926 52.0211 38.9717 174.3052 37 I 3.7673 8.5506 120.4468 61.0073 38.5679 177.8772 38 G 3.7074 8.2141 112.6211 45.1260 0.0000 173.5503 39 V 4.1966 8.0701 112.6673 60.8758 32.7067 175.0239 40 L 4.2180 7.8036 117.2142 55.1290 39.5651 175.3716 41 S 4.5743 8.0609 114.9718 56.2394 64.0064 173.0578 42 P 4.8850 0.0000 0.0000 62.1211 32.5486 177.0284 43 Q 4.1771 9.0726 118.5370 59.8531 28.4628 179.8140 44 E 4.1778 8.3245 118.4126 59.2618 29.4663 179.1501 45 L 4.0373 8.1762 119.1958 57.2609 41.6896 179.3919 46 F 4.0669 8.2301 117.6374 60.4343 38.8802 177.5961 47 I 3.7423 7.9037 119.3802 64.3828 37.0156 178.3200 48 K 3.8608 8.3896 120.5288 59.5887 31.9413 178.6299 49 A 3.9860 8.1034 120.7930 54.9782 18.3115 179.4409 50 A 3.9783 8.1394 119.3690 55.2435 18.5440 179.9984 51 I 3.6475 8.0576 118.4618 64.7751 37.0842 178.6115 52 E 4.0726 8.1637 118.0052 58.6221 29.3292 178.4888 53 T 4.3912 7.6759 106.7948 60.0281 70.1524 174.0539 54 K 3.7571 7.8566 119.4052 57.6010 30.0932 175.5509 55 A 4.2486 7.8960 120.1099 52.4539 19.0236 178.0638 56 D 4.7478 8.9928 119.9426 56.1144 42.3543 176.2518 57 A 4.8512 7.5557 117.8875 50.9189 22.8540 175.0251 58 I 4.7402 8.5754 120.6710 59.5440 40.2405 174.8748 59 L 4.8824 9.0696 128.4894 53.2140 43.4766 175.7211 60 V 4.2372 8.8498 126.0835 61.5018 33.0997 174.4593 61 S 5.2469 8.9409 123.3973 56.9358 64.7269 172.9791 62 S 4.4644 9.1555 121.3067 57.3491 64.4097 173.8138 63 L 4.5679 9.4040 128.5463 55.9538 43.0534 178.1117 64 Y 4.2448 8.4245 114.1518 57.0171 38.5340 175.3795 65 G 4.0830 7.6263 109.7100 46.3359 0.0000 174.5921 66 Q 4.4108 7.5330 117.8787 55.9025 29.0187 177.7748 67 G 3.9274 8.3036 109.8671 47.4021 0.0000 175.6657 68 E 3.8590 8.2630 120.2350 59.1397 29.6212 178.6446 69 I 3.8958 7.6599 119.3164 64.6094 37.2498 178.0731 70 D 4.5482 8.5208 119.7759 57.1146 40.5532 178.0320 71 C 4.5486 8.4596 116.5711 59.7750 28.5802 173.7497 72 K 3.9641 7.0608 121.3956 57.7277 32.3396 176.9601 73 G 3.9948 8.9190 114.2834 45.4013 0.0000 175.0697 74 L 4.1059 7.5776 121.5759 57.4939 41.9369 178.6290 75 R 3.7324 7.6824 118.2451 59.4607 29.9630 178.0981 76 Q 3.9133 7.9279 118.7883 59.1900 29.2520 178.2386 77 K 4.1816 7.9886 119.5262 59.5185 31.9489 179.2076 78 C 4.1865 8.3844 117.6885 62.6676 27.8640 175.7461 79 D 4.3206 8.2853 120.7968 57.6198 40.3025 178.8278 80 E 4.0152 8.3670 117.3178 58.6820 29.4826 178.2905 81 A 4.4885 7.6122 118.2738 51.7404 19.2126 177.7700 82 G 3.9095 8.2905 106.1590 45.5367 0.0000 174.0995 83 L 4.7131 7.9909 119.0085 53.5875 42.2333 176.2851 84 E 4.3943 7.7327 115.6451 57.2553 29.6002 177.0244 85 G 3.8805 8.8658 108.1505 45.8643 0.0000 173.6149 86 I 3.7773 7.6379 119.6015 60.7586 38.6505 175.3890 87 L 4.5245 7.9830 126.0928 54.7773 42.9763 175.9937 88 L 5.1787 9.4675 123.1747 53.3490 45.1343 175.0530 89 Y 5.8142 9.2975 122.3903 56.2884 41.2201 175.3872 90 V 4.9441 8.9772 121.9203 60.4444 35.2086 174.8185 91 G 4.4110 9.0426 109.3950 44.0968 0.0000 172.8220 92 G 4.4639 9.0306 106.6581 44.6513 0.0000 176.1428 93 N 5.2547 8.8908 116.6982 51.1098 38.6884 173.7057 94 I 4.0878 7.7955 112.9782 61.2455 38.8243 176.5823 95 V 4.5495 7.3567 113.1348 59.2569 35.2264 174.9809 96 V 3.7302 8.2905 121.2107 64.0295 31.2782 176.7696 97 G 4.0096 8.6964 112.0709 44.7069 0.0000 172.1670 98 K 4.0594 8.2764 120.2286 56.4890 32.3864 175.9399 99 Q 4.6290 8.3456 123.7744 53.8788 33.1884 174.1783 100 H 4.4589 8.6429 118.6485 55.6519 30.0279 175.3225 101 W 4.4215 9.0937 135.0000 60.4244 30.6060 175.7450 102 P 4.0742 0.0000 0.0000 65.5715 30.6919 178.3094 103 D 4.2647 7.8095 117.3458 57.2089 40.7310 178.9734 104 V 3.4881 7.3453 118.1924 65.8479 31.5773 177.3401 105 E 3.3323 7.2627 119.3251 59.0218 29.2119 178.8784 106 K 3.8250 7.5952 118.0106 59.4226 31.9028 178.9901 107 R 3.7944 7.9004 118.8090 59.7628 29.9482 178.4423 108 F 4.1465 8.3519 116.9521 59.8950 38.9613 178.1748 109 K 4.4226 8.2545 119.9362 59.0630 31.5928 178.9935 110 D 4.5112 8.2720 118.6757 57.4473 40.7971 178.1169 111 M 4.2926 7.4961 117.0852 55.8689 32.1251 177.0386 112 G 3.9821 8.1610 107.6811 45.1690 0.0000 173.5227 113 Y 4.1984 8.1394 118.9106 57.6733 38.5926 176.3924 114 D 4.5398 9.0044 125.2196 57.0529 41.6438 177.2538 115 R 4.5077 7.9785 115.5922 54.2101 34.7006 174.5099 116 V 4.6935 7.8763 121.5607 61.3082 33.9741 174.0085 117 Y 4.9517 8.9869 125.0611 55.9247 40.7304 175.7482 118 A 2.8351 7.8904 125.5745 50.2124 19.2436 175.0087 119 P 4.6907 0.0000 0.0000 63.6848 31.6575 177.0167 120 G 3.8086 8.7542 109.1289 46.3777 0.0000 173.5179 121 T 3.8936 7.2517 115.8564 62.4223 69.0231 172.9717 122 P 4.4017 0.0000 0.0000 61.6221 32.2920 175.5403 123 P 4.2779 0.0000 0.0000 66.0598 31.1887 178.8189 124 E 3.8282 8.1030 116.6895 59.1782 29.3194 179.4969 125 V 3.6893 7.7243 118.2404 65.9858 31.5969 178.4085 126 G 3.6535 7.8594 105.0019 47.7250 0.0000 175.5487 127 I 3.5033 7.8983 122.2966 64.1450 37.1053 178.4199 128 A 4.0864 8.1208 121.5401 55.2535 18.1358 179.4816 129 D 4.4430 8.3924 117.5691 57.4189 40.9407 178.7462 130 L 4.6234 8.4656 122.4565 57.6600 42.0407 179.1196 131 K 4.1682 8.4836 118.6094 59.3010 31.9938 179.3073 132 K 4.1314 8.1963 119.8696 59.8102 32.0400 178.7984 133 D 4.5515 8.5805 117.9273 56.5600 40.8026 177.6876 134 L 4.4637 7.9578 117.1572 53.5705 42.3297 175.8755 135 N 4.3177 8.2354 115.6540 54.8916 36.2242 174.6617 136 I 4.5549 8.1452 108.3157 60.3166 38.4474 175.1403 137 E 4.1629 8.2608 124.3198 57.0545 29.6531 176.4016 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 M 8.29 4.34 0.00 2.00 1.64 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 2 E 9.15 3.97 0.00 2.16 1.90 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 2.24 2.33 0.00 3 K 8.97 3.72 0.00 1.85 1.86 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.43 7.81 4 K 8.02 4.58 0.00 1.82 1.96 0.00 1.69 0.00 0.00 1.85 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.45 7.81 5 T 9.11 5.32 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 1.23 0.00 0.00 6 I 8.78 4.93 1.60 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.79 0.60 0.00 0.00 7 V 8.45 4.64 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 0.93 0.00 0.00 0.97 0.00 0.00 8 L 8.69 5.20 0.00 1.58 1.35 0.78 0.94 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 9 G 8.42 4.35 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 0.00 10 V 8.36 5.08 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 1.00 0.00 0.00 11 I 8.64 4.78 1.92 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.62 1.03 0.00 0.00 12 G 8.99 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 0.00 0.00 0.00 0.00 13 S 9.06 4.44 0.00 4.22 4.03 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 0.00 0.00 0.00 14 D 7.05 4.00 0.00 1.58 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 0.00 0.00 0.00 15 C 8.36 4.49 0.00 3.06 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 16 H 8.66 4.19 0.00 3.18 3.31 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.45 4.66 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 18 V 8.00 3.66 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 1.04 0.00 0.00 0.93 0.00 0.00 19 G 8.06 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 20 N 8.12 4.33 0.00 2.76 3.03 0.00 0.00 7.24 6.70 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 21 K 8.04 4.01 0.00 2.09 1.85 0.00 1.60 0.00 0.00 1.92 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.53 7.81 22 I 7.84 3.74 1.99 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 1.73 0.90 0.93 0.00 0.00 23 L 8.51 4.17 0.00 1.65 1.75 0.90 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.27 4.35 0.00 2.86 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 25 H 8.49 4.07 0.00 3.36 3.59 0.00 5.83 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 26 A 8.55 3.97 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 27 F 8.86 4.08 0.00 3.21 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 28 T 8.31 4.29 4.48 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 1.24 0.00 0.00 29 N 8.25 4.35 0.00 2.81 2.84 0.00 0.00 7.08 8.07 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 30 A 7.95 4.20 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 31 G 7.87 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 0.00 0.00 0.00 32 F 8.46 4.55 0.00 3.33 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 33 N 9.51 4.70 0.00 2.84 2.91 0.00 0.00 7.02 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 34 V 8.34 4.37 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 0.77 0.00 0.00 1.04 0.00 0.00 35 V 9.02 4.03 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 0.93 0.00 0.00 0.93 0.00 0.00 36 N 8.44 5.20 0.00 2.79 2.70 0.00 0.00 7.26 7.94 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 37 I 8.55 3.77 1.61 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.27 0.75 0.00 0.00 38 G 8.21 3.71 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 0.00 0.00 0.00 39 V 8.07 4.20 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 0.80 0.00 0.00 0.89 0.00 0.00 40 L 7.80 4.22 0.00 1.76 1.72 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.06 4.57 0.00 3.84 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 42 P 0.00 4.88 0.00 2.46 2.23 0.00 3.72 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 43 Q 9.07 4.18 0.00 2.18 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.93 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 44 E 8.32 4.18 0.00 2.09 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 2.43 2.50 0.00 45 L 8.18 4.04 0.00 1.80 1.53 0.92 0.82 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 46 F 8.23 4.07 0.00 3.28 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 47 I 7.90 3.74 1.93 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 1.44 0.75 0.94 0.00 0.00 48 K 8.39 3.86 0.00 1.81 2.00 0.00 1.63 0.00 0.00 1.64 0.00 0.00 3.33 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.57 7.81 49 A 8.10 3.99 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 50 A 8.14 3.98 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 51 I 8.06 3.65 1.88 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 1.53 1.24 0.92 0.00 0.00 52 E 8.16 4.07 0.00 2.00 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 2.35 2.47 0.00 53 T 7.68 4.39 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 1.25 0.00 0.00 54 K 7.86 3.76 0.00 1.94 1.92 0.00 1.60 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.41 7.81 55 A 7.90 4.25 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 56 D 8.99 4.75 0.00 2.76 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 57 A 7.56 4.85 0.93 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 0.00 0.00 58 I 8.58 4.74 1.88 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 1.28 0.85 1.00 0.00 0.00 59 L 9.07 4.88 0.00 1.49 1.46 0.45 -0.05 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 60 V 8.85 4.24 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 0.77 0.00 0.00 0.61 0.00 0.00 61 S 8.94 5.25 0.00 3.95 3.80 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 62 S 9.16 4.46 0.00 3.90 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 63 L 9.40 4.57 0.00 1.59 1.51 0.91 0.92 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 64 Y 8.42 4.24 0.00 3.10 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 65 G 7.63 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 66 Q 7.53 4.41 0.00 1.64 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.82 0.00 0.00 0.00 0.00 0.00 2.16 1.72 0.00 67 G 8.30 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 0.00 0.00 0.00 68 E 8.26 3.86 0.00 2.06 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 2.12 2.30 0.00 69 I 7.66 3.90 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.98 0.94 0.00 0.00 70 D 8.52 4.55 0.00 2.83 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 71 C 8.46 4.55 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 72 K 7.06 3.96 0.00 1.70 1.71 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.34 7.81 73 G 8.92 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 74 L 7.58 4.11 0.00 1.82 1.52 0.90 0.80 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 75 R 7.68 3.73 0.00 1.71 1.75 0.00 3.22 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 76 Q 7.93 3.91 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 77 K 7.99 4.18 0.00 1.98 1.85 0.00 1.89 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.73 7.81 78 C 8.38 4.19 0.00 3.07 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 79 D 8.29 4.32 0.00 2.81 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 80 E 8.37 4.02 0.00 1.91 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 2.45 0.00 81 A 7.61 4.49 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 82 G 8.29 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 83 L 7.99 4.71 0.00 1.83 1.65 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 84 E 7.73 4.39 0.00 2.06 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 2.28 2.23 0.00 85 G 8.87 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 86 I 7.64 3.78 1.93 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 1.28 0.84 0.95 0.00 0.00 87 L 7.98 4.52 0.00 1.65 1.49 0.94 0.66 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 88 L 9.47 5.18 0.00 1.55 1.60 0.62 0.72 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 89 Y 9.30 5.81 0.00 2.91 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 90 V 8.98 4.94 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 0.26 0.00 0.00 0.65 0.00 0.00 91 G 9.04 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 92 G 9.03 4.46 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 0.00 93 N 8.89 5.25 0.00 2.83 2.72 0.00 0.00 6.97 7.08 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 94 I 7.80 4.09 1.31 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.48 0.82 0.00 0.00 95 V 7.36 4.55 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 1.03 0.00 0.00 1.08 0.00 0.00 96 V 8.29 3.73 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 0.77 0.00 0.00 0.93 0.00 0.00 97 G 8.70 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 98 K 8.28 4.06 0.00 1.75 1.77 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.49 7.81 99 Q 8.35 4.63 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.57 0.00 100 H 8.64 4.46 0.00 3.19 3.23 0.00 5.70 0.00 0.00 0.00 0.00 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 W 9.09 4.42 0.00 3.40 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 0.00 102 P 0.00 4.07 0.00 2.03 2.01 0.00 3.04 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.16 0.00 103 D 7.81 4.26 0.00 2.85 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 0.00 104 V 7.35 3.49 1.56 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 0.87 0.00 0.00 1.02 0.00 0.00 105 E 7.26 3.33 0.00 1.16 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 2.10 2.13 0.00 106 K 7.60 3.83 0.00 2.03 1.78 0.00 1.77 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.41 7.81 107 R 7.90 3.79 0.00 1.98 2.17 0.00 3.02 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.55 0.00 108 F 8.35 4.15 0.00 3.00 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 0.00 109 K 8.25 4.42 0.00 1.97 1.86 0.00 1.61 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.64 1.42 7.81 110 D 8.27 4.51 0.00 2.77 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 0.00 111 M 7.50 4.29 0.00 2.06 2.44 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.45 0.00 112 G 8.16 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 0.00 0.00 0.00 113 Y 8.14 4.20 0.00 3.38 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 0.00 114 D 9.00 4.54 0.00 2.96 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 0.00 115 R 7.98 4.51 0.00 0.73 0.91 0.00 2.38 0.00 0.00 2.97 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.40 0.00 116 V 7.88 4.69 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 0.61 0.00 0.00 0.94 0.00 0.00 117 Y 8.99 4.95 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 0.00 118 A 7.89 2.84 0.04 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 0.00 0.00 119 P 0.00 4.69 0.00 1.92 1.94 0.00 3.39 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.98 0.00 120 G 8.75 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 T 7.25 3.89 4.13 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 1.06 0.00 0.00 122 P 0.00 4.40 0.00 2.13 1.93 0.00 3.57 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 123 P 0.00 4.28 0.00 2.11 2.16 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 124 E 8.10 3.83 0.00 2.00 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 2.36 2.36 0.00 125 V 7.72 3.69 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 1.14 0.00 0.00 0.93 0.00 0.00 126 G 7.86 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 0.00 127 I 7.90 3.50 1.76 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 -0.36 0.89 0.00 0.00 128 A 8.12 4.09 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 0.00 129 D 8.39 4.44 0.00 3.10 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 0.00 130 L 8.47 4.62 0.00 2.09 1.99 0.73 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.48 4.17 0.00 2.10 1.92 0.00 1.76 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.62 1.88 7.81 132 K 8.20 4.13 0.00 2.04 2.10 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.61 7.81 133 D 8.58 4.55 0.00 2.84 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 0.00 134 L 7.96 4.46 0.00 1.83 1.79 1.13 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.24 4.32 0.00 2.93 2.95 0.00 0.00 6.70 7.08 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 0.00 136 I 8.15 4.55 1.85 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 1.62 0.68 0.92 0.00 0.00 137 E 8.26 4.16 0.00 2.14 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 2.30 2.33 0.00