NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B H 4.7386 8.4449 117.8399 54.6803 31.6286 172.4783 1C H 3.5093 7.8996 116.4685 58.5434 25.3400 172.9056 1D H 4.4696 8.8344 111.1915 56.8431 27.9377 174.6363 1E H 5.0452 7.7251 112.7848 53.8910 32.7848 173.2454 1F H 4.6229 8.9608 117.4792 56.0754 28.8285 174.3312 1G F 4.7056 8.3833 119.0825 57.8156 39.9382 173.8365 2 N 4.6350 8.5559 117.2651 52.3780 38.9044 174.7496 3 L 4.6873 8.1926 123.4816 52.4741 43.6467 174.2731 4 P 4.6067 0.0000 0.0000 60.8669 32.6172 173.9629 5 P 4.3257 0.0000 0.0000 62.3270 31.6019 176.0834 6 G 4.3062 7.8879 117.7479 45.2249 0.0000 171.5658 7 N 4.2805 8.2386 121.2570 51.7447 39.5109 174.2935 8 Y 4.9385 7.6485 114.1187 57.5331 38.3573 177.3386 9 K 4.2170 8.3918 121.4457 58.5376 33.1138 178.1374 10 K 4.6107 7.5777 116.2864 53.6249 34.2828 174.1564 11 P 4.7897 0.0000 0.0000 63.4224 32.7119 174.7730 12 V 4.6610 9.0856 112.5727 60.5861 37.0683 173.3429 13 L 4.8627 9.7747 121.9267 53.4459 44.0537 176.5750 14 L 4.8925 8.6164 124.2622 53.6045 42.0127 173.9304 15 Y 4.6819 9.2890 125.6166 57.2690 40.4740 173.1875 16 C 4.2308 8.6813 127.6119 57.5344 32.9612 173.3113 17 S 3.6701 8.4225 121.4182 62.0608 61.9758 175.1850 18 N 4.1008 7.3392 116.3561 56.3691 37.5316 177.3608 19 G 3.5198 7.6552 110.7305 45.7609 0.0000 173.8335 20 G 3.4052 7.7354 107.0147 46.4431 0.0000 172.9088 21 H 4.8518 7.4779 115.4832 54.0182 31.7221 173.7054 22 F 5.3285 8.7986 119.2170 55.5411 40.8868 175.4299 23 L 4.2170 9.0088 126.1740 55.5938 43.1917 175.6711 24 R 4.9087 9.1347 125.8979 54.7310 33.6285 173.9819 25 I 4.8441 8.2487 127.3856 59.2576 37.9479 175.6290 26 L 4.0378 8.4994 127.4884 53.6782 42.1426 177.2806 27 P 4.2896 0.0000 0.0000 65.1627 31.3740 177.0339 28 D 4.5772 8.0393 116.2961 53.1323 39.6348 177.2904 29 G 4.0086 8.3654 108.4932 45.8081 0.0000 174.0522 30 T 4.6135 7.5660 116.2100 62.7494 69.7202 173.7914 31 V 4.9472 7.9569 122.0364 61.4895 35.1679 174.3108 32 D 4.5014 8.7848 126.5654 52.8323 42.9917 173.9348 33 G 4.6818 8.4019 104.1190 45.1474 0.0000 172.1885 34 T 4.9977 8.4347 115.3600 60.5882 71.0036 174.3598 35 R 4.2900 8.8609 124.7934 56.5495 31.0737 176.3796 36 D 4.6040 8.0512 119.0693 53.2567 40.0343 176.3778 37 R 3.8019 8.5757 125.3865 57.3066 30.1666 176.9809 38 S 4.2825 7.8966 111.5780 60.6522 62.8913 174.0049 39 D 4.3280 7.6403 118.1093 55.1500 41.1267 176.3091 40 Q 4.5304 8.4155 122.3866 55.9215 29.2757 175.7462 41 H 4.9386 9.0005 116.3227 55.5067 29.1997 175.1754 42 I 4.5252 7.5885 110.1524 59.7789 38.2607 175.2594 43 Q 4.4210 7.8191 121.5529 55.4525 29.3724 174.3134 44 L 4.9043 8.7571 124.8828 52.7854 45.0064 175.5125 45 Q 4.8253 9.5678 125.4551 54.5791 30.7486 174.5451 46 L 5.7358 8.8130 126.1903 53.1691 44.1072 175.9005 47 S 4.5650 8.0492 113.4753 57.1793 66.4205 172.5718 48 A 4.8031 8.0981 123.3707 50.2628 19.5634 176.1239 49 E 3.9060 8.4748 124.6822 56.3131 30.7002 176.0921 50 S 4.8044 7.5323 113.4220 55.7943 66.3590 173.9636 51 V 3.6484 8.3526 121.0451 65.2385 31.4404 175.8403 52 G 3.9273 9.2940 115.2037 44.8513 0.0000 172.3904 53 E 5.0704 8.3971 119.0123 55.2597 32.0653 175.6957 54 V 4.5796 8.6282 114.6149 60.4938 37.3093 173.0712 55 Y 5.2936 8.7760 119.9630 56.5502 40.6719 174.9298 56 I 4.6476 8.6428 125.2769 59.6172 39.3684 174.6053 57 K 4.9090 8.7571 127.9541 54.2833 35.8442 175.0460 58 S 4.8310 8.7595 122.8756 58.5078 62.6368 174.9530 59 T 3.8179 8.6853 118.6596 64.6277 68.7458 175.8834 60 E 4.0552 8.3736 122.6494 58.3806 29.8461 177.0274 61 T 4.3301 7.6868 105.6963 60.4249 70.2134 175.2792 62 G 3.7416 8.3025 109.9182 45.6447 0.0000 173.8111 63 Q 4.2914 7.7112 119.0103 55.9913 30.3277 174.6061 64 Y 5.0275 8.5086 118.5526 56.0840 40.8668 175.3703 65 L 4.5643 9.4867 125.6178 55.4687 43.6014 175.4415 66 A 5.4367 8.2888 124.4300 52.0804 23.2400 174.7681 67 M 5.3090 8.3776 119.0660 53.7985 35.0489 175.5933 68 D 5.8500 9.3147 126.4142 52.7298 40.9888 176.7723 69 T 4.4676 8.5309 108.0310 62.9925 68.6774 174.4296 70 D 4.6604 8.3526 120.4946 54.1628 41.9859 177.0127 71 G 3.0462 8.0532 107.9499 44.7136 0.0000 172.5347 72 L 4.8659 7.9413 119.7874 52.9535 43.6848 176.3819 73 L 5.5440 8.7229 122.6191 54.5331 43.1189 175.2475 74 Y 4.6334 7.8845 116.9181 56.6741 41.0064 173.2258 75 G 4.0491 8.7427 108.6213 44.9694 0.0000 173.7468 76 S 4.7674 9.0855 122.6380 57.9555 63.4829 175.3030 77 Q 4.0585 8.9891 124.4435 58.2521 29.0688 176.4799 78 T 4.7120 7.5477 105.4462 58.5644 71.3431 171.8253 79 P 4.0572 0.0000 0.0000 62.5814 31.7566 175.0165 80 N 5.0394 7.9975 122.3833 51.2091 39.8416 173.3921 81 E 4.0299 8.6517 113.7787 59.4638 30.3486 177.6628 82 E 4.3798 8.3756 118.1677 56.7026 29.3820 177.7465 83 I 4.4796 6.8391 118.3532 61.0338 38.4413 175.8550 84 L 4.5270 7.4440 121.4505 54.1975 42.7233 175.9260 85 F 5.3148 8.9448 122.1197 55.6049 43.3312 174.8188 86 L 4.7032 9.1539 123.2651 53.7172 42.0502 175.3731 87 E 4.3391 8.9366 126.7069 55.7764 30.1314 176.1540 88 R 4.7642 8.4983 125.1108 54.0412 34.8167 174.5436 89 L 4.6554 8.8278 124.8700 55.2642 43.0446 175.8348 90 E 4.6886 9.0220 125.1409 55.1398 33.5784 174.9570 91 E 3.9626 9.6290 123.7683 58.1164 27.2986 174.3530 92 N 4.3164 8.6049 110.3211 54.2406 36.7770 174.0010 93 H 4.7887 8.5618 116.1978 57.8440 35.5241 173.5260 94 Y 4.5717 7.8659 115.9572 57.6086 40.0982 173.6510 95 N 5.3782 9.3076 118.5123 51.9871 40.9004 174.7458 96 T 5.2826 8.7766 113.7565 60.2053 72.9681 172.7204 97 Y 5.2519 8.5419 118.4086 56.7046 42.2334 174.1844 98 I 4.8939 8.4293 124.8118 59.0984 39.9250 175.1671 99 S 4.2483 8.8975 121.6506 58.4986 63.0666 174.8254 100 K 3.7541 8.7073 129.2944 59.4488 32.2929 178.6750 101 K 3.7472 7.9489 118.0550 59.1719 32.1321 176.7500 102 H 4.7545 8.3319 114.8293 55.1600 29.4584 176.1389 103 A 4.0010 8.2119 124.9548 54.5941 18.0903 180.6886 104 E 4.1331 8.1346 110.9547 58.2775 29.5186 177.4459 105 K 4.1033 7.6673 118.0147 55.3273 33.0317 175.6821 106 N 3.8286 7.9182 115.9518 54.2724 36.2533 175.7802 107 W 4.9682 7.4977 117.8040 55.5138 31.1284 177.7473 108 F 5.1632 8.9594 123.9871 56.2556 40.5101 175.5199 109 V 4.2935 8.6367 119.8365 62.3625 33.0330 174.9531 110 G 4.6925 8.1728 110.6815 45.4880 0.0000 171.9577 111 L 5.3199 8.3559 120.4599 52.5237 45.4987 176.9432 112 K 4.2672 8.9535 122.5696 55.4653 32.9317 178.3147 113 K 4.1039 8.4450 118.9962 58.4908 31.9334 177.7550 114 N 4.6620 8.1530 114.8817 52.2866 38.0154 175.6532 115 G 3.4970 8.2661 108.1004 45.2546 0.0000 172.7908 116 S 4.9456 7.4530 114.2959 55.9064 65.3643 173.9664 117 V 3.9632 8.4278 122.0869 63.8215 32.0601 175.4597 118 K 4.3659 8.4771 128.1333 54.5737 32.8530 175.2387 119 R 3.6827 8.4444 126.7143 55.8411 30.9717 176.7142 120 G 3.4681 9.1310 116.3118 48.2790 0.0000 173.8438 121 P 4.4763 0.0000 0.0000 65.0605 31.3760 177.8883 122 R 4.1963 7.8451 115.6487 57.6121 30.3939 176.8309 123 T 5.1021 7.9926 108.2000 60.6910 70.1641 173.5251 124 H 4.8356 8.1461 115.7847 54.7645 30.8130 172.8670 125 Y 3.9583 8.5434 118.3836 59.7953 38.1293 176.9686 126 G 3.9708 8.8893 111.1896 45.5513 0.0000 173.9321 127 Q 4.1494 7.2966 118.4594 55.4585 29.6851 176.8142 128 K 3.8627 8.1609 117.2911 57.9986 33.0954 179.1782 129 A 4.2661 8.0713 121.1953 53.8938 18.2006 178.4198 130 I 4.2738 7.1274 105.6035 60.1982 38.3864 175.3363 131 L 4.3088 7.2242 123.0193 53.7304 42.3727 175.5056 132 F 5.4651 9.0123 123.0069 55.6987 42.7480 174.7986 133 L 5.1255 9.3248 121.7598 52.6128 44.3766 174.3884 134 P 5.3792 0.0000 0.0000 62.0647 30.5347 174.7322 135 L 4.4394 9.2633 128.3871 54.0901 43.1252 174.9601 136 P 4.4083 0.0000 0.0000 62.3585 32.6658 176.7225 137 V 3.5919 8.2757 119.4030 63.6530 32.4874 172.4020 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 1B H 8.44 4.74 0.00 3.15 3.66 0.00 5.84 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1C H 7.90 3.51 0.00 3.49 3.22 0.00 5.96 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.83 4.47 0.00 3.19 3.29 0.00 5.65 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.73 5.05 0.00 3.48 3.26 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.96 4.62 0.00 3.32 3.41 0.00 5.66 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 1G F 8.38 4.71 0.00 2.91 3.03 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 2 N 8.56 4.63 0.00 2.93 2.79 0.00 0.00 6.93 6.74 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 3 L 8.19 4.69 0.00 1.55 1.47 0.81 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.61 0.00 2.24 2.01 0.00 3.70 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 5 P 0.00 4.33 0.00 2.17 2.10 0.00 3.87 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 6 G 7.89 4.31 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 0.00 0.00 0.00 7 N 8.24 4.28 0.00 2.68 2.70 0.00 0.00 5.99 7.55 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 8 Y 7.65 4.94 0.00 3.03 3.12 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 9 K 8.39 4.22 0.00 1.89 1.87 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.51 7.81 10 K 7.58 4.61 0.00 1.74 1.72 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.40 7.81 11 P 0.00 4.79 0.00 2.07 2.17 0.00 3.77 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 12 V 9.09 4.66 2.27 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 0.70 0.00 0.00 1.05 0.00 0.00 13 L 9.77 4.86 0.00 1.51 1.73 0.45 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.62 4.89 0.00 1.54 1.49 0.36 0.88 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 15 Y 9.29 4.68 0.00 3.28 3.12 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 16 C 8.68 4.23 0.00 2.93 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.42 3.67 0.00 3.59 3.48 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 18 N 7.34 4.10 0.00 2.79 2.83 0.00 0.00 5.90 7.07 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 19 G 7.66 3.52 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 0.00 20 G 7.74 3.41 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 21 H 7.48 4.85 0.00 3.07 3.29 0.00 5.79 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.80 5.33 0.00 3.06 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 23 L 9.01 4.22 0.00 1.61 1.45 0.85 0.50 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 24 R 9.13 4.91 0.00 1.95 1.88 0.00 3.37 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 25 I 8.25 4.84 1.84 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 1.18 0.72 0.89 0.00 0.00 26 L 8.50 4.04 0.00 1.91 1.56 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.29 0.00 1.99 2.08 0.00 3.51 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.88 0.00 28 D 8.04 4.58 0.00 2.77 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 29 G 8.37 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 30 T 7.57 4.61 4.69 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 1.22 0.00 0.00 31 V 7.96 4.95 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 0.90 0.00 0.00 0.94 0.00 0.00 32 D 8.78 4.50 0.00 2.71 2.68 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 0.00 0.00 0.00 0.00 33 G 8.40 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.43 5.00 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 1.37 0.00 0.00 35 R 8.86 4.29 0.00 1.88 1.99 0.00 3.22 0.00 0.00 3.08 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.47 0.00 36 D 8.05 4.60 0.00 2.85 2.66 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 0.00 0.00 0.00 0.00 37 R 8.58 3.80 0.00 1.89 1.90 0.00 3.32 0.00 0.00 3.13 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.02 0.00 38 S 7.90 4.28 0.00 3.82 4.37 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 39 D 7.64 4.33 0.00 2.94 2.61 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 40 Q 8.42 4.53 0.00 1.88 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.22 0.00 0.00 0.00 0.00 0.00 2.26 2.21 0.00 41 H 9.00 4.94 0.00 3.32 3.42 0.00 5.76 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.59 4.53 1.88 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.91 1.04 0.00 0.00 43 Q 7.82 4.42 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.90 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 44 L 8.76 4.90 0.00 1.52 1.47 0.80 0.47 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 45 Q 9.57 4.83 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 46 L 8.81 5.74 0.00 1.70 1.50 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.05 4.56 0.00 3.90 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 48 A 8.10 4.80 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 49 E 8.47 3.91 0.00 1.16 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.43 0.00 50 S 7.53 4.80 0.00 4.20 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 51 V 8.35 3.65 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 0.93 0.00 0.00 1.01 0.00 0.00 52 G 9.29 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 53 E 8.40 5.07 0.00 1.95 1.70 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 2.22 2.28 0.00 54 V 8.63 4.58 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 0.51 0.00 0.00 1.18 0.00 0.00 55 Y 8.78 5.29 0.00 2.89 2.81 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 56 I 8.64 4.65 1.72 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 0.62 0.60 0.72 0.00 0.00 57 K 8.76 4.91 0.00 1.55 1.71 0.00 1.30 0.00 0.00 0.61 0.00 0.00 2.61 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.16 1.20 7.81 58 S 8.76 4.83 0.00 3.90 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 59 T 8.69 3.82 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 1.19 0.00 0.00 60 E 8.37 4.06 0.00 1.95 2.01 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 2.23 2.38 0.00 61 T 7.69 4.33 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 1.24 0.00 0.00 62 G 8.30 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 63 Q 7.71 4.29 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 64 Y 8.51 5.03 0.00 2.92 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 65 L 9.49 4.56 0.00 1.65 1.57 0.79 -0.01 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 66 A 8.29 5.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.38 5.31 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 68 D 9.31 5.85 0.00 3.00 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 69 T 8.53 4.47 4.37 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 1.33 0.00 0.00 70 D 8.35 4.66 0.00 2.77 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 71 G 8.05 3.05 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 72 L 7.94 4.87 0.00 1.79 1.60 0.88 0.43 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 73 L 8.72 5.54 0.00 1.55 1.59 0.87 1.01 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 74 Y 7.88 4.63 0.00 3.19 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 75 G 8.74 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 76 S 9.09 4.77 0.00 3.80 3.79 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 77 Q 8.99 4.06 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 78 T 7.55 4.71 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 79 P 0.00 4.06 0.00 1.85 1.61 0.00 3.72 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.88 0.00 80 N 8.00 5.04 0.00 2.76 2.82 0.00 0.00 6.32 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 81 E 8.65 4.03 0.00 2.11 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 2.34 2.30 0.00 82 E 8.38 4.38 0.00 2.23 2.28 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 2.37 2.33 0.00 83 I 6.84 4.48 1.75 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.66 0.66 0.00 0.00 84 L 7.44 4.53 0.00 1.47 1.47 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.94 5.31 0.00 3.04 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 86 L 9.15 4.70 0.00 1.50 1.59 0.84 0.71 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 87 E 8.94 4.34 0.00 2.05 1.85 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 2.20 1.80 0.00 88 R 8.50 4.76 0.00 1.77 1.74 0.00 3.01 0.00 0.00 2.76 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 89 L 8.83 4.66 0.00 1.70 1.72 1.01 0.78 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 90 E 9.02 4.69 0.00 2.20 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 91 E 9.63 3.96 0.00 2.39 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 2.29 2.37 0.00 92 N 8.60 4.32 0.00 2.82 2.87 0.00 0.00 6.86 8.16 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 93 H 8.56 4.79 0.00 2.83 2.92 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.87 4.57 0.00 3.00 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 95 N 9.31 5.38 0.00 3.09 2.69 0.00 0.00 6.97 7.90 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 96 T 8.78 5.28 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 97 Y 8.54 5.25 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 98 I 8.43 4.89 1.71 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.58 0.60 0.00 0.00 99 S 8.90 4.25 0.00 4.11 3.95 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 0.00 100 K 8.71 3.75 0.00 1.76 1.63 0.00 1.75 0.00 0.00 1.48 0.00 0.00 2.81 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.25 1.11 7.81 101 K 7.95 3.75 0.00 1.61 1.64 0.00 1.90 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.05 1.33 7.81 102 H 8.33 4.75 0.00 3.24 2.58 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 8.21 4.00 1.31 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 0.00 0.00 104 E 8.13 4.13 0.00 2.12 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 0.00 2.19 2.25 0.00 105 K 7.67 4.10 0.00 0.79 1.06 0.00 1.32 0.00 0.00 1.37 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 0.95 7.81 106 N 7.92 3.83 0.00 2.94 3.08 0.00 0.00 6.79 7.64 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 0.00 107 W 7.50 4.97 0.00 3.30 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 0.00 108 F 8.96 5.16 0.00 2.94 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 0.00 109 V 8.64 4.29 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 0.63 0.00 0.00 0.66 0.00 0.00 110 G 8.17 4.69 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 0.00 111 L 8.36 5.32 0.00 1.45 1.49 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.95 4.27 0.00 1.82 1.69 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.36 7.81 113 K 8.44 4.10 0.00 1.71 1.84 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.36 7.81 114 N 8.15 4.66 0.00 2.78 2.88 0.00 0.00 6.22 7.00 0.00 0.00 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 G 8.27 3.50 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 0.00 116 S 7.45 4.95 0.00 3.87 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 0.00 117 V 8.43 3.96 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 0.75 0.00 0.00 1.00 0.00 0.00 118 K 8.48 4.37 0.00 1.76 1.71 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.33 1.32 7.81 119 R 8.44 3.68 0.00 1.79 1.70 0.00 3.15 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 120 G 9.13 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.48 0.00 1.98 2.27 0.00 3.08 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.01 0.00 122 R 7.85 4.20 0.00 1.90 1.98 0.00 3.32 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 123 T 7.99 5.10 4.38 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 1.34 0.00 0.00 124 H 8.15 4.84 0.00 3.40 3.48 0.00 5.47 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.54 3.96 0.00 3.12 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 0.00 126 G 8.89 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 0.00 0.00 0.00 127 Q 7.30 4.15 0.00 1.82 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.63 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 128 K 8.16 3.86 0.00 1.62 1.62 0.00 1.48 0.00 0.00 1.49 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.24 7.81 129 A 8.07 4.27 1.21 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 0.00 0.00 130 I 7.13 4.27 1.66 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.17 0.60 0.00 0.00 131 L 7.22 4.31 0.00 0.85 0.51 0.41 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.01 5.47 0.00 3.40 3.07 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 0.00 133 L 9.32 5.13 0.00 1.96 1.78 0.97 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.38 0.00 2.19 2.27 0.00 3.86 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 135 L 9.26 4.44 0.00 1.81 1.69 1.07 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.41 0.00 1.94 2.00 0.00 3.84 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 2.03 2.10 0.00 137 V 8.28 3.59 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 0.68 0.00 0.00 0.92 0.00 0.00