NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4024 8.3044 120.3569 53.8396 34.5223 175.8629 2 L 5.5641 6.8539 129.1257 54.3833 43.7589 171.0756 3 M 4.3162 7.2345 116.4182 52.2830 34.6196 174.7225 4 P 4.5349 0.0000 0.0000 62.7262 29.4007 176.4797 5 R 3.9347 8.1955 121.5867 57.3833 29.5997 177.5063 6 R 4.4590 9.3587 113.7489 57.2790 33.1671 174.4295 7 M 3.8400 8.1143 117.2450 54.7245 33.1356 177.2616 8 K 3.9408 8.5485 121.1815 59.1895 32.4917 177.1467 9 Y 5.1405 7.2263 114.3011 55.9982 40.1624 175.7758 10 R 4.0722 8.8281 124.8051 58.7369 30.6417 176.3233 11 K 4.7256 7.7802 116.5350 54.4433 34.6160 175.5665 12 Q 4.6491 8.1299 118.4621 54.0038 31.7291 174.8674 13 Q 4.2621 8.4544 117.8702 56.2224 29.5568 177.4499 14 R 4.2339 8.8334 118.5498 59.1352 30.5354 174.3859 15 G 3.8895 8.0995 111.5421 44.7235 0.0000 173.3444 16 R 4.3557 8.3685 122.4472 55.2673 31.4057 175.0367 17 L 4.8519 8.1340 118.5138 52.7597 44.7035 176.4826 18 K 4.5969 8.3606 121.1642 54.0401 35.0118 177.4499 19 G 3.7622 8.2688 107.6103 46.6950 0.0000 172.8816 20 A 3.6792 8.4785 122.2732 53.9691 16.9503 176.8501 21 T 4.2888 7.6030 105.8629 63.2938 72.0333 174.3055 22 K 4.1437 8.7379 123.6684 57.4317 32.3149 177.6232 23 G 3.8051 7.9721 105.4456 44.5668 0.0000 172.2317 24 G 3.4275 8.1512 104.5740 47.0382 0.0000 174.2670 25 D 4.9367 7.6207 114.2367 52.3833 40.2101 175.2154 26 Y 4.2552 6.8699 116.4474 55.0567 41.1318 174.8785 27 V 4.0659 10.2317 122.8395 65.4587 31.5028 177.3901 28 A 3.8590 8.6013 115.8715 53.3833 17.3606 176.8590 29 F 4.1282 8.9292 111.2192 58.2611 42.0182 174.8436 30 G 4.4518 7.7902 107.3564 44.1083 0.0000 172.3989 31 D 4.3093 8.5463 118.2700 56.6254 41.3808 176.5755 32 Y 5.4439 7.3875 114.9577 55.2612 42.2532 174.6703 33 G 4.5719 8.7173 107.4416 44.8311 0.0000 170.8269 34 L 5.3145 9.5114 122.4156 53.2712 44.1335 175.6478 35 V 4.7228 8.6278 126.6050 60.5967 34.1001 174.7043 36 A 4.8648 8.7483 124.5464 50.8940 20.2573 177.9275 37 L 4.6221 8.8276 122.3766 55.6905 42.9900 176.9098 38 E 4.9275 7.9620 115.7710 53.4656 33.1330 173.7196 39 P 5.6142 0.0000 0.0000 62.1701 32.8035 175.1036 40 A 4.3393 7.9702 122.8545 51.6676 22.2029 175.2587 41 W 4.9488 8.7202 119.7126 56.3348 30.1096 176.2671 42 I 4.6901 8.9893 127.6476 59.7659 38.2654 176.1049 43 T 4.1925 9.5956 118.4293 61.0652 69.6009 175.6378 44 A 4.1046 8.2667 125.1635 55.1851 18.0233 180.5065 45 Q 3.9751 7.9751 115.8720 59.1290 29.2547 178.2240 46 Q 4.1982 8.2534 119.0737 59.9296 28.7890 178.1588 47 I 3.8601 8.0472 119.2132 64.7934 36.7668 177.0485 48 E 3.9050 8.5793 123.0655 59.1067 29.8547 178.9100 49 A 4.2104 7.8891 119.5044 54.4363 19.1442 178.7206 50 A 4.0443 8.3208 118.7535 53.9435 18.5445 179.5303 51 R 3.6239 7.6235 117.1547 58.8677 30.4370 178.3595 52 V 3.5301 7.4413 117.5322 65.5881 31.3631 177.6294 53 A 3.8749 7.5882 120.7312 56.2812 17.7330 178.6176 54 M 3.2721 7.5626 114.1647 58.5764 31.8188 178.8181 55 V 3.5664 7.5602 120.0971 65.5192 31.4516 179.1645 56 R 3.7849 7.7946 117.8639 60.1071 30.1329 177.5569 57 H 3.8244 8.5097 115.8139 59.1772 30.8200 175.1392 58 F 4.4698 7.3431 115.5288 55.3495 37.5321 176.2037 59 R 4.9130 7.3729 116.7932 59.9734 28.7978 176.1894 60 R 4.2794 8.8901 122.6742 56.2971 27.7658 177.1722 61 G 3.6899 8.2617 108.4873 44.7622 0.0000 174.6529 62 G 4.0455 7.7533 107.0921 44.6707 0.0000 172.8184 63 K 4.1621 8.4077 120.7523 56.1205 33.8710 177.0764 64 I 4.6940 7.9932 126.2401 59.6240 39.4791 174.8430 65 F 4.7942 9.5840 127.3213 56.2012 40.5940 174.8932 66 I 4.5818 8.5832 117.9663 59.1895 38.8347 175.3990 67 R 4.7293 9.0367 128.1026 55.5789 30.5360 176.5775 68 I 4.6955 7.6516 110.4443 59.1023 40.7397 174.0433 69 F 5.0499 8.4170 123.1101 55.9917 42.0514 172.9121 70 P 5.0359 0.0000 0.0000 61.6285 29.9956 174.8263 71 D 4.2915 7.9196 124.0467 53.4313 41.3170 176.8333 72 K 4.1407 7.6081 122.6112 55.3808 33.2714 173.9980 73 P 4.4949 0.0000 0.0000 62.3434 32.3213 175.1173 74 Y 4.6931 9.5556 126.8391 57.1118 40.3559 174.1227 75 T 4.8687 7.8467 121.9546 61.5848 71.8438 173.2442 76 K 4.4684 8.2205 125.8824 54.8998 36.0383 175.5727 77 K 4.3861 8.5102 125.6263 54.6022 33.2651 174.8327 78 P 4.2838 0.0000 0.0000 62.3713 31.6982 175.8906 79 L 4.0230 8.2191 121.1817 56.2318 42.5247 177.3010 80 E 3.9639 8.9001 123.2043 56.6815 27.1358 174.9384 81 V 3.9032 7.0932 118.5070 61.1413 32.3159 175.8073 82 R 4.4327 8.0008 117.5062 54.4218 31.2602 175.7094 83 M 3.9444 8.3021 118.1510 56.7346 32.4183 177.9444 84 G 3.7693 8.5859 109.0469 45.6878 0.0000 172.7925 85 K 3.7013 8.9889 114.2843 57.5771 28.8497 176.5058 86 G 3.7662 8.3665 106.0474 44.1593 0.0000 172.7849 87 K 4.4536 8.0811 118.9998 54.0139 34.0898 176.8979 88 G 3.9069 8.4134 111.8915 46.8053 0.0000 171.9108 89 N 4.8248 8.1952 116.1457 52.1615 40.8840 174.8249 90 V 4.0681 7.9563 120.0632 62.4401 31.5915 175.4601 91 E 4.0448 9.3503 129.1226 58.6211 29.2855 177.2521 92 G 3.9871 7.5552 103.4015 46.1175 0.0000 170.6852 93 Y 4.9455 8.3545 116.5226 56.4907 41.3401 175.4315 94 V 4.6021 9.0279 113.5057 60.0276 37.2409 173.8231 95 A 4.9158 8.9259 123.5126 50.1499 21.3988 175.9492 96 V 4.2314 8.2917 122.7135 62.4197 32.9053 175.5149 97 V 4.3560 8.6612 126.7728 61.3583 34.3833 174.5030 98 K 4.8441 8.5315 127.1017 53.9344 34.9369 174.2115 99 P 4.3644 0.0000 0.0000 64.4457 31.0875 175.2904 100 G 4.1207 9.5892 115.8978 46.2333 0.0000 174.8126 101 R 3.7611 7.7168 119.7382 56.6513 30.3381 175.2988 102 V 4.4230 8.5862 125.3688 61.6893 31.2875 175.3331 103 M 4.0099 8.4245 128.5741 57.0377 32.0678 177.1654 104 F 5.6879 7.3781 115.5092 55.9603 43.1196 173.8861 105 E 5.8357 8.6537 112.3815 56.9364 33.0906 175.7671 106 V 4.8743 8.4940 117.6574 59.9820 34.5426 174.6391 107 A 5.1061 8.6082 124.0139 50.9777 23.3739 176.1068 108 G 4.0351 9.5099 105.1190 46.1446 0.0000 174.0489 109 V 4.2846 7.4314 116.2185 59.7770 34.7281 174.1895 110 T 4.0166 8.3632 118.0739 62.3516 69.1355 174.7902 111 E 3.5702 8.6574 123.8154 58.6684 30.0506 178.9207 112 E 3.9956 8.1389 119.2308 59.1844 29.6535 179.1585 113 Q 4.1733 7.9386 118.3854 58.6341 28.9128 177.7243 114 A 4.3521 7.8888 121.7503 55.8506 18.4606 179.4257 115 M 3.8492 7.7640 116.6759 58.3562 31.8712 178.6932 116 E 4.0143 7.7309 117.4957 58.7872 29.9906 178.1210 117 A 3.8425 8.8672 121.9681 55.3518 18.5775 179.6435 118 L 4.0122 8.3050 117.4352 57.4282 41.4397 179.5618 119 R 3.8557 7.2490 117.4992 59.6267 30.4129 178.1322 120 I 3.8612 8.0873 119.5916 64.4909 37.0748 178.3410 121 A 4.0536 7.8544 121.7921 55.0211 18.2653 179.7710 122 G 3.7370 8.0701 103.5461 47.8915 0.0000 175.3450 123 H 4.4026 7.8266 117.7339 58.3348 29.0103 177.0846 124 K 4.2337 8.0467 117.9262 56.6426 32.3561 176.9197 125 L 4.6999 6.5679 119.0034 52.6074 43.3024 174.6924 126 P 4.5869 0.0000 0.0000 63.1759 31.5457 175.3143 127 I 5.4462 7.0901 111.0797 58.4021 40.7628 173.7852 128 K 4.6306 8.4505 118.7623 55.8734 33.8241 176.3365 129 T 5.3475 8.1911 113.1913 60.3762 72.4502 172.2366 130 K 4.7036 8.7244 120.2741 55.5855 35.9816 174.8818 131 I 5.2325 8.3568 124.6125 60.0024 40.2013 174.9528 132 V 4.2579 8.5230 116.3691 61.4019 36.3569 174.6064 133 R 4.1336 8.9223 119.9547 55.3114 31.1237 176.7570 134 R 3.9249 6.0637 125.8363 56.2572 36.5220 175.3534 135 D 4.3336 8.4410 117.2798 55.4568 38.3176 178.7532 136 A 4.3832 9.2897 118.1940 51.6450 17.1861 176.9208 137 Y 4.1947 7.4247 118.6189 56.7734 40.6892 177.2426 138 D 3.9693 6.6177 117.7004 53.4538 40.3155 176.5704 139 E 4.3833 8.3137 125.7818 54.3296 28.6860 173.9435 140 A 4.5901 7.2436 122.1588 50.8928 22.3618 176.4892 141 Q 4.1019 8.4514 113.9795 56.5087 29.8585 175.1317 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 8.30 4.40 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 2 L 6.85 5.56 0.00 1.85 1.69 1.12 0.72 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 3 M 7.23 4.32 0.00 2.07 1.21 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 4 P 0.00 4.53 0.00 2.11 2.19 0.00 2.79 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 5 R 8.20 3.93 0.00 1.93 2.09 0.00 3.07 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 6 R 9.36 4.46 0.00 1.74 1.87 0.00 3.35 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.63 0.00 7 M 8.11 3.84 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.55 0.00 8 K 8.55 3.94 0.00 1.13 0.96 0.00 1.53 0.00 0.00 1.40 0.00 0.00 2.52 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.22 1.25 7.81 9 Y 7.23 5.14 0.00 2.98 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 10 R 8.83 4.07 0.00 1.83 1.99 0.00 3.22 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 11 K 7.78 4.73 0.00 1.75 1.66 0.00 1.72 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.38 7.81 12 Q 8.13 4.65 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.03 0.00 0.00 0.00 0.00 0.00 2.19 2.33 0.00 13 Q 8.45 4.26 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.12 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 14 R 8.83 4.23 0.00 1.99 2.35 0.00 3.50 0.00 0.00 3.49 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 1.86 0.00 15 G 8.10 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 0.00 0.00 0.00 16 R 8.37 4.36 0.00 1.80 1.89 0.00 3.17 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 17 L 8.13 4.85 0.00 1.64 1.56 0.98 1.14 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 18 K 8.36 4.60 0.00 1.72 1.72 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.35 7.81 19 G 8.27 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 0.00 0.00 0.00 20 A 8.48 3.68 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 21 T 7.60 4.29 4.21 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 1.24 0.00 0.00 22 K 8.74 4.14 0.00 1.73 1.85 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.44 7.81 23 G 7.97 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 24 G 8.15 3.43 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 0.00 25 D 7.62 4.94 0.00 2.68 2.65 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 26 Y 6.87 4.26 0.00 2.62 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 V 10.23 4.07 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 1.43 0.00 0.00 1.16 0.00 0.00 28 A 8.60 3.86 1.60 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 0.00 0.00 29 F 8.93 4.13 0.00 2.48 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 30 G 7.79 4.45 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 0.00 31 D 8.55 4.31 0.00 2.83 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 32 Y 7.39 5.44 0.00 3.02 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 33 G 8.72 4.57 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 0.00 34 L 9.51 5.31 0.00 1.91 1.77 1.10 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.63 4.72 2.13 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 0.72 0.00 0.00 1.03 0.00 0.00 36 A 8.75 4.86 1.23 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 0.00 0.00 37 L 8.83 4.62 0.00 1.54 1.74 1.00 0.93 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 38 E 7.96 4.93 0.00 1.97 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 2.27 2.26 0.00 39 P 0.00 5.61 0.00 2.10 2.09 0.00 3.45 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.80 0.00 40 A 7.97 4.34 1.24 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 0.00 0.00 0.00 0.00 0.00 41 W 8.72 4.95 0.00 3.13 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 42 I 8.99 4.69 1.86 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 1.27 0.63 0.95 0.00 0.00 43 T 9.60 4.19 4.21 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 1.17 0.00 0.00 44 A 8.27 4.10 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 45 Q 7.98 3.98 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.98 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 46 Q 8.25 4.20 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.69 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 47 I 8.05 3.86 2.13 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 1.48 0.77 1.10 0.00 0.00 48 E 8.58 3.91 0.00 2.14 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 0.00 2.34 2.42 0.00 49 A 7.89 4.21 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 50 A 8.32 4.04 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 R 7.62 3.62 0.00 1.80 1.86 0.00 3.21 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 52 V 7.44 3.53 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 1.00 0.00 0.00 0.96 0.00 0.00 53 A 7.59 3.87 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 54 M 7.56 3.27 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 55 V 7.56 3.57 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 0.93 0.00 0.00 0.90 0.00 0.00 56 R 7.79 3.78 0.00 2.04 1.96 0.00 3.32 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 57 H 8.51 3.82 0.00 2.88 2.95 0.00 5.76 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 7.34 4.47 0.00 3.09 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 59 R 7.37 4.91 0.00 1.94 2.23 0.00 2.60 0.00 0.00 3.88 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.68 0.00 60 R 8.89 4.28 0.00 1.90 2.44 0.00 3.21 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 61 G 8.26 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 62 G 7.75 4.05 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 0.00 0.00 0.00 63 K 8.41 4.16 0.00 1.67 1.32 0.00 0.94 0.00 0.00 1.13 0.00 0.00 2.82 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.63 1.13 7.81 64 I 7.99 4.69 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.85 0.92 0.00 0.00 65 F 9.58 4.79 0.00 3.18 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 66 I 8.58 4.58 2.01 0.00 0.00 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 1.42 0.67 1.34 0.00 0.00 67 R 9.04 4.73 0.00 1.86 1.86 0.00 3.01 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.40 0.00 68 I 7.65 4.70 1.82 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.60 0.79 0.00 0.00 69 F 8.42 5.05 0.00 2.76 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 70 P 0.00 5.04 0.00 2.07 1.97 0.00 3.42 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.83 0.00 71 D 7.92 4.29 0.00 2.67 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 72 K 7.61 4.14 0.00 1.64 1.54 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.62 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.11 1.25 7.81 73 P 0.00 4.49 0.00 1.94 1.90 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 2.20 2.38 0.00 74 Y 9.56 4.69 0.00 2.93 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 75 T 7.85 4.87 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 1.10 0.00 0.00 76 K 8.22 4.47 0.00 1.48 1.32 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.26 1.35 7.81 77 K 8.51 4.39 0.00 1.75 1.68 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.41 7.81 78 P 0.00 4.28 0.00 2.01 2.01 0.00 3.65 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 79 L 8.22 4.02 0.00 1.67 1.52 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.90 3.96 0.00 2.17 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 0.00 2.19 2.28 0.00 81 V 7.09 3.90 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 0.70 0.00 0.00 0.92 0.00 0.00 82 R 8.00 4.43 0.00 1.92 1.97 0.00 3.05 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 83 M 8.30 3.94 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 84 G 8.59 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 85 K 8.99 3.70 0.00 1.92 1.96 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.36 7.81 86 G 8.37 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 87 K 8.08 4.45 0.00 1.68 1.65 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.29 1.38 7.81 88 G 8.41 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 89 N 8.20 4.82 0.00 2.73 2.72 0.00 0.00 7.05 7.56 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 90 V 7.96 4.07 1.93 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 0.46 0.00 0.00 0.87 0.00 0.00 91 E 9.35 4.04 0.00 1.83 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 0.00 2.20 2.30 0.00 92 G 7.56 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 93 Y 8.35 4.95 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 94 V 9.03 4.60 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 0.53 0.00 0.00 0.44 0.00 0.00 95 A 8.93 4.92 1.17 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 0.00 0.00 96 V 8.29 4.23 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 0.92 0.00 0.00 0.85 0.00 0.00 97 V 8.66 4.36 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 0.90 0.00 0.00 0.89 0.00 0.00 98 K 8.53 4.84 0.00 1.84 1.75 0.00 1.75 0.00 0.00 2.22 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.48 7.81 99 P 0.00 4.36 0.00 1.93 2.20 0.00 3.65 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 2.03 2.09 0.00 100 G 9.59 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 0.00 0.00 0.00 101 R 7.72 3.76 0.00 1.85 1.87 0.00 3.25 0.00 0.00 3.05 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 102 V 8.59 4.42 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 0.97 0.00 0.00 0.97 0.00 0.00 103 M 8.42 4.01 0.00 1.30 1.58 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.33 0.00 104 F 7.38 5.69 0.00 3.09 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 0.00 105 E 8.65 5.84 0.00 2.36 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 0.00 2.39 2.30 0.00 106 V 8.49 4.87 2.32 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 1.12 0.00 0.00 1.17 0.00 0.00 107 A 8.61 5.11 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.51 4.04 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 0.00 109 V 7.43 4.28 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.42 0.00 0.00 110 T 8.36 4.02 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 1.23 0.00 0.00 111 E 8.66 3.57 0.00 2.09 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 2.35 2.25 0.00 112 E 8.14 4.00 0.00 2.23 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 0.00 2.27 2.34 0.00 113 Q 7.94 4.17 0.00 2.29 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.48 2.41 0.00 114 A 7.89 4.35 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 M 7.76 3.85 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.78 0.00 116 E 7.73 4.01 0.00 2.25 2.11 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 2.13 2.07 0.00 117 A 8.87 3.84 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 0.00 118 L 8.31 4.01 0.00 1.83 1.82 1.13 1.14 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 0.00 119 R 7.25 3.86 0.00 2.23 2.16 0.00 3.29 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 120 I 8.09 3.86 1.78 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 1.56 0.66 0.86 0.00 0.00 121 A 7.85 4.05 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 0.00 122 G 8.07 3.74 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 0.00 0.00 0.00 123 H 7.83 4.40 0.00 3.49 3.35 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 8.05 4.23 0.00 1.86 1.88 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.62 1.79 7.81 125 L 6.57 4.70 0.00 1.96 1.63 1.08 1.13 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 0.00 126 P 0.00 4.59 0.00 2.18 2.15 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.14 0.00 127 I 7.09 5.45 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 1.44 0.30 1.00 0.00 0.00 128 K 8.45 4.63 0.00 1.70 1.76 0.00 1.62 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.42 7.81 129 T 8.19 5.35 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 1.25 0.00 0.00 130 K 8.72 4.70 0.00 1.87 1.67 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.46 7.81 131 I 8.36 5.23 1.96 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 1.40 0.81 1.08 0.00 0.00 132 V 8.52 4.26 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 1.12 0.00 0.00 133 R 8.92 4.13 0.00 1.73 1.55 0.00 3.36 0.00 0.00 3.21 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.76 0.00 134 R 6.06 3.92 0.00 1.49 1.55 0.00 3.06 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.29 0.00 135 D 8.44 4.33 0.00 2.81 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 0.00 136 A 9.29 4.38 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 0.00 137 Y 7.42 4.19 0.00 2.79 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 0.00 138 D 6.62 3.97 0.00 2.69 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 0.00 139 E 8.31 4.38 0.00 1.63 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 2.09 2.25 0.00 140 A 7.24 4.59 1.16 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 0.00 0.00 141 Q 8.45 4.10 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.60 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00