NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4916 8.3044 120.3269 55.4431 33.4858 173.8046 2 S 4.3905 8.1584 112.7224 55.5881 65.6118 171.4311 3 S 3.9442 8.5796 120.1898 58.3638 63.2297 174.6939 4 Q 4.1621 8.8570 125.9954 58.0220 28.3036 176.7711 5 I 4.3284 7.1392 110.5611 60.2129 38.6132 175.6987 6 R 4.3127 7.7534 122.4407 56.0249 30.2413 175.6743 7 Q 4.2786 8.4205 126.0571 55.8361 31.5107 173.3185 8 N 4.1100 8.9745 125.3642 55.1191 37.1451 174.1496 9 Y 4.6034 7.8064 117.8042 54.4547 40.2788 174.8953 10 S 4.2252 8.0726 122.5074 58.2539 65.0986 175.1922 11 T 3.8591 8.3418 114.1952 64.6774 68.4255 176.6144 12 D 4.2188 7.8393 121.6786 57.3283 40.8939 178.4973 13 V 3.4083 7.1404 118.3575 65.7872 31.4471 177.3399 14 E 3.8770 7.7090 118.6809 59.4614 29.6014 178.6053 15 A 3.9498 8.2199 120.5824 55.2907 18.4284 179.5067 16 A 3.9633 8.2692 119.4241 54.9775 18.2742 180.1940 17 V 3.5135 7.9745 117.2746 66.3823 31.8125 178.0083 18 N 4.1791 8.1525 116.1879 56.3665 38.2848 177.3850 19 S 4.1101 7.9915 114.3242 61.2101 62.4770 175.9696 20 L 4.0913 8.0821 123.1661 57.8736 41.7608 179.1527 21 V 3.7205 8.1674 118.8885 66.0489 31.4986 177.5551 22 N 4.3456 8.0926 116.3633 56.4626 38.7546 176.6217 23 L 3.9752 7.9223 121.8915 58.4660 42.1526 178.6570 24 Y 4.0869 8.5188 116.8035 60.9134 37.7804 178.2089 25 L 3.9378 8.2852 120.1911 57.6822 41.7529 179.2558 26 Q 4.0347 8.2160 119.2542 59.3077 29.0543 178.3039 27 A 3.8610 8.0282 121.7053 54.9984 18.3613 179.4303 28 S 4.2814 8.6521 112.0331 61.9827 62.5958 175.7424 29 Y 4.4517 8.3557 122.1682 61.2550 38.4018 178.2674 30 T 3.8198 7.9414 116.4015 66.9167 68.4348 176.3022 31 Y 4.1161 7.9091 118.4670 60.6113 37.8214 178.0891 32 L 4.2174 8.1690 121.8475 58.0704 42.3551 178.9871 33 S 4.2910 8.3705 113.1571 61.5908 62.5196 176.0496 34 L 3.6997 8.0481 122.1630 57.4922 40.9007 179.9228 35 G 3.8911 8.2797 105.1022 48.0742 0.0000 175.6026 36 F 4.2515 8.5964 119.8198 58.9619 39.1039 177.3514 37 Y 4.3374 8.2873 119.9200 60.7591 38.7827 177.1590 38 F 4.1448 8.2361 115.4617 58.6540 38.9715 176.1367 39 D 4.6048 7.5781 116.9553 53.9819 41.8792 176.4845 40 R 4.1121 7.2897 118.7147 56.6964 30.6067 177.5068 41 D 4.3171 8.7197 120.9036 55.7289 39.5523 176.6795 42 D 4.7529 7.9564 117.4693 53.0061 39.9534 176.5722 43 V 3.7979 7.4299 118.3252 64.1309 34.0769 175.9017 44 A 3.8069 8.0859 119.9809 53.6766 16.0884 177.7350 45 L 4.7533 8.0209 125.4886 50.9902 42.7101 177.2944 46 E 3.9905 8.6032 123.2768 59.4208 29.9117 178.1804 47 G 3.5470 8.0166 104.8549 47.7312 0.0000 175.7124 48 V 3.1301 7.4668 120.0444 65.5164 31.6012 177.6464 49 S 4.1983 8.1303 113.1650 61.8302 62.1611 175.5119 50 H 4.0089 8.3339 120.7879 59.2861 29.0947 176.6008 51 F 3.8209 7.8068 121.9621 61.5743 39.0968 177.2329 52 F 4.3544 7.9816 117.0624 60.5650 38.8300 178.0309 53 R 4.0163 8.2365 117.8721 59.1916 29.7106 178.9558 54 E 3.8589 7.9482 118.5811 59.2344 29.3759 179.3735 55 L 3.6244 7.1357 118.2603 57.3832 41.4500 179.1957 56 A 4.2768 7.9834 120.8600 55.2574 18.1942 179.3210 57 E 3.9327 7.9875 117.3124 59.3049 29.8463 178.7646 58 E 3.8827 8.2492 118.9128 59.3402 29.4157 179.5195 59 K 4.3957 8.7069 119.0414 59.2693 32.1623 179.4398 60 R 2.9034 7.7602 118.8559 59.2206 30.0036 178.5291 61 E 3.9444 8.3442 118.5688 58.8432 29.4473 179.7389 62 G 3.3604 7.7237 106.1323 47.9095 0.0000 175.5484 63 Y 4.2827 8.0185 121.0304 59.5371 38.0646 177.9185 64 E 4.0607 7.8777 120.5125 59.3785 29.6445 179.2664 65 R 4.0093 8.1587 118.6696 59.2873 30.0582 178.6611 66 L 4.1916 8.0125 118.5225 57.9699 41.8146 179.4416 67 L 4.1720 8.3008 118.9632 57.4039 41.4812 179.6206 68 K 3.9008 8.0837 119.7705 59.7671 32.2542 178.5427 69 M 3.7979 7.8684 118.3250 58.4151 32.1294 177.5938 70 Q 3.8481 8.3405 120.1658 59.5601 29.2795 178.5892 71 N 4.3068 7.9977 116.9215 56.3760 38.3436 177.3663 72 Q 3.9345 7.7842 118.4576 59.0366 29.1510 178.8742 73 R 3.8601 7.7767 118.3807 56.8779 29.7930 178.1652 74 G 3.9303 7.4379 106.2125 45.0281 0.0000 173.7675 75 G 4.2709 7.5453 108.7775 44.0683 0.0000 173.5585 76 R 4.4472 8.1708 116.2935 53.7832 32.7801 175.7967 77 A 4.5513 8.5175 125.8808 51.6119 18.9720 176.4202 78 L 4.6172 7.9686 121.1972 52.9200 44.7431 176.0831 79 F 4.7584 8.7107 122.2640 55.9287 40.7856 175.1072 80 Q 4.7818 8.2885 121.5967 53.5508 32.3201 175.1096 81 D 4.4758 8.6046 119.0556 55.0247 41.3509 176.5047 82 I 4.4034 8.0217 122.3335 59.3003 38.2323 176.1759 83 K 4.1693 8.5859 125.7799 55.7571 32.5536 177.2961 84 K 3.8709 8.3514 121.5796 55.9221 33.4947 175.0029 85 P 4.3257 0.0000 0.0000 62.1958 31.7913 177.7422 86 A 4.0768 8.6333 123.6627 54.5534 18.4186 176.9274 87 E 4.3395 7.1563 112.1306 54.8751 33.4275 174.7367 88 D 4.7727 7.8652 116.4255 54.0093 42.7781 176.2971 89 E 3.9828 6.9597 117.5167 54.5763 33.3443 174.7855 90 W 4.3040 5.9659 121.0900 55.5778 30.7214 177.6235 91 G 3.7683 7.1169 108.3535 47.0645 0.0000 175.4806 92 K 4.6174 9.1984 125.5166 55.0032 34.0096 177.4802 93 T 4.2035 8.9665 116.5134 67.1449 68.2571 175.0023 94 P 4.4294 0.0000 0.0000 65.1774 31.3572 178.5959 95 D 4.4035 8.2799 117.9093 57.4439 40.8584 178.5493 96 A 4.2615 8.3262 120.7973 55.5448 18.4768 179.1633 97 M 4.2760 8.4759 116.7346 58.8091 32.2656 178.6612 98 K 4.0870 8.2044 118.1888 59.2465 32.1336 179.2230 99 A 4.0898 8.0563 120.6314 54.8292 18.1894 179.6569 100 A 3.8990 8.1550 119.4266 55.6713 18.6354 179.3727 101 M 4.0178 8.5459 116.9446 58.7813 32.1616 178.3042 102 A 3.9334 8.2175 120.7458 55.1403 18.6619 179.0753 103 L 3.8318 8.0755 118.9647 58.6026 42.0528 179.2181 104 E 4.0140 8.6206 118.5780 59.4487 29.4552 179.5294 105 K 4.1820 8.1127 118.4778 58.9779 32.0543 179.4320 106 K 3.8868 8.2180 120.1891 59.4978 32.1628 178.8961 107 L 3.8891 7.8145 119.1994 57.8861 41.4935 178.9099 108 N 4.3764 8.7588 117.2632 56.8540 38.7189 176.6655 109 Q 3.9241 8.0886 120.7105 59.0611 29.1275 177.8711 110 A 4.0685 7.8964 121.7432 55.0431 18.2769 179.6396 111 L 3.9279 8.3921 117.8229 58.1178 41.7971 179.6568 112 L 4.0143 8.1597 118.9747 57.8650 41.4367 179.4578 113 D 4.3008 8.5708 119.1515 57.3753 40.7812 178.4301 114 L 3.9419 8.1060 120.9009 58.5792 42.0483 178.4560 115 H 4.0721 8.6507 118.1546 59.0495 29.7428 177.1433 116 A 3.9570 8.0027 122.6140 55.2235 18.1045 179.1979 117 L 4.0065 8.1345 117.9439 58.2690 42.2845 179.2498 118 G 3.7165 8.3653 105.8684 48.0138 0.0000 175.5974 119 S 4.1496 8.0745 118.2696 61.1845 62.6727 176.7952 120 A 4.0413 7.8763 122.0259 54.9382 18.1481 178.9439 121 R 4.3058 7.6644 113.7703 54.8180 31.3482 176.8847 122 T 3.4316 7.5570 108.0663 63.2201 67.9860 173.8800 123 D 4.8384 7.3358 120.5496 52.1331 41.4807 173.8570 124 P 4.2975 0.0000 0.0000 65.3769 31.4716 177.9874 125 H 4.1168 8.3033 117.8196 59.1117 29.9399 176.7010 126 L 4.0784 8.0447 121.8755 58.4383 41.8502 178.8247 127 C 3.9194 7.8622 116.6948 62.8155 28.0444 175.5301 128 D 4.3132 8.3589 119.8830 57.1879 40.8039 177.8676 129 F 4.1712 8.7082 121.5284 61.5788 39.3068 177.2294 130 L 4.0335 8.0523 118.3867 57.6074 41.0042 179.3735 131 E 3.9902 8.3950 118.7061 59.7037 29.2239 179.5927 132 T 3.7378 7.7969 114.3194 66.5725 68.7009 175.8707 133 H 4.5830 7.5100 114.2352 55.5964 29.9039 175.5289 134 F 4.6420 7.6687 117.3484 59.0346 40.9797 176.7214 135 L 4.0260 8.2849 118.6463 58.3077 41.4738 179.2157 136 D 4.4013 7.7931 114.4905 57.2524 41.1684 178.5423 137 E 3.9156 8.0797 118.8404 59.3010 29.5600 178.8043 138 E 3.9914 8.2623 118.4978 59.4628 29.5359 179.2831 139 V 3.6021 7.7674 118.1737 66.3045 31.6236 178.1939 140 K 3.9525 8.0327 117.8461 59.3600 31.8573 179.1745 141 L 4.0021 8.0442 120.5953 58.0565 41.9569 178.9295 142 I 3.7242 8.2123 120.1962 64.5216 37.2678 178.2589 143 K 3.8854 8.2852 120.3576 59.4188 31.8410 178.6676 144 K 3.9501 7.8946 119.5780 59.6276 32.1437 178.8179 145 M 4.2819 8.4307 119.2819 58.0514 31.7646 178.8116 146 G 3.6875 8.4613 106.4153 48.2191 0.0000 175.4610 147 D 4.3554 7.9326 121.3890 57.1433 40.7421 178.7805 148 H 4.2702 8.0497 116.8621 58.6724 28.5861 177.8614 149 L 4.0057 8.3198 121.2393 58.0554 41.5017 179.4499 150 T 3.8652 8.0610 115.8076 67.0554 68.2378 176.4323 151 N 4.4090 7.9924 116.6113 56.1025 38.6638 177.2868 152 L 4.1284 8.1200 120.6899 57.8763 41.4727 178.9059 153 H 4.1148 8.3818 117.6100 59.3938 29.9500 177.0932 154 R 4.0349 7.9952 118.9283 59.0160 29.8742 176.6628 155 L 4.3239 7.5057 122.8181 54.8942 41.9023 176.3772 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 4.49 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 2 S 8.16 4.39 0.00 3.85 3.66 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 3 S 8.58 3.94 0.00 3.97 3.75 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 4 Q 8.86 4.16 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 5 I 7.14 4.33 1.82 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 1.14 0.67 0.88 0.00 0.00 6 R 7.75 4.31 0.00 1.81 1.98 0.00 3.16 0.00 0.00 3.05 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 7 Q 8.42 4.28 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 8 N 8.97 4.11 0.00 2.88 2.88 0.00 0.00 6.93 7.54 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 9 Y 7.81 4.60 0.00 2.82 2.83 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 0.00 0.00 0.00 10 S 8.07 4.23 0.00 3.98 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 11 T 8.34 3.86 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 1.19 0.00 0.00 12 D 7.84 4.22 0.00 2.62 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 13 V 7.14 3.41 1.61 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 0.82 0.00 0.00 0.78 0.00 0.00 14 E 7.71 3.88 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.67 0.00 15 A 8.22 3.95 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 16 A 8.27 3.96 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 17 V 7.97 3.51 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 1.13 0.00 0.00 1.01 0.00 0.00 18 N 8.15 4.18 0.00 2.86 2.74 0.00 0.00 6.73 6.38 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 19 S 7.99 4.11 0.00 4.08 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 20 L 8.08 4.09 0.00 1.93 1.85 1.10 0.68 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 21 V 8.17 3.72 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 1.01 0.00 0.00 1.00 0.00 0.00 22 N 8.09 4.35 0.00 2.84 2.97 0.00 0.00 6.89 6.35 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 23 L 7.92 3.98 0.00 2.03 1.91 0.92 0.96 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 24 Y 8.52 4.09 0.00 3.32 3.36 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 25 L 8.29 3.94 0.00 1.84 1.62 0.91 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.22 4.03 0.00 2.38 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 27 A 8.03 3.86 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.65 4.28 0.00 4.35 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Y 8.36 4.45 0.00 3.15 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 30 T 7.94 3.82 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 0.72 0.00 0.00 31 Y 7.91 4.12 0.00 3.27 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 32 L 8.17 4.22 0.00 2.02 2.23 1.21 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.37 4.29 0.00 4.05 4.17 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 34 L 8.05 3.70 0.00 1.42 0.83 -0.33 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.28 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 36 F 8.60 4.25 0.00 3.36 3.28 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 0.00 37 Y 8.29 4.34 0.00 3.43 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 38 F 8.24 4.14 0.00 3.25 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 39 D 7.58 4.60 0.00 2.56 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 40 R 7.29 4.11 0.00 1.86 1.92 0.00 3.37 0.00 0.00 3.32 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 41 D 8.72 4.32 0.00 2.79 2.82 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 42 D 7.96 4.75 0.00 2.78 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 43 V 7.43 3.80 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.43 0.00 0.00 44 A 8.09 3.81 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 45 L 8.02 4.75 0.00 1.97 1.61 1.15 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.60 3.99 0.00 2.02 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 0.00 2.35 2.38 0.00 47 G 8.02 3.55 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 0.00 48 V 7.47 3.13 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 -0.52 0.00 0.00 0.63 0.00 0.00 49 S 8.13 4.20 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.33 4.01 0.00 3.31 3.42 0.00 5.66 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 7.81 3.82 0.00 3.01 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 7.98 4.35 0.00 3.22 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 53 R 8.24 4.02 0.00 1.88 1.96 0.00 2.72 0.00 0.00 3.03 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.93 0.00 54 E 7.95 3.86 0.00 1.84 1.75 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 2.12 2.18 0.00 55 L 7.14 3.62 0.00 0.89 0.48 0.32 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.98 4.28 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 7.99 3.93 0.00 2.22 2.00 0.00 0.00 0.00 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 2.46 0.00 58 E 8.25 3.88 0.00 2.11 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 0.00 2.22 2.48 0.00 59 K 8.71 4.40 0.00 2.00 2.28 0.00 1.81 0.00 0.00 2.10 0.00 0.00 3.04 0.00 0.00 3.41 0.00 0.00 0.00 0.00 1.88 1.98 7.81 60 R 7.76 2.90 0.00 2.02 1.98 0.00 3.10 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.65 0.00 61 E 8.34 3.94 0.00 2.08 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 2.22 2.35 0.00 62 G 7.72 3.36 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 0.00 63 Y 8.02 4.28 0.00 3.26 3.35 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 64 E 7.88 4.06 0.00 2.04 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 2.36 2.34 0.00 65 R 8.16 4.01 0.00 2.03 2.20 0.00 2.78 0.00 0.00 2.92 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.71 0.00 66 L 8.01 4.19 0.00 2.09 1.77 0.79 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.30 4.17 0.00 1.99 1.84 1.33 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.08 3.90 0.00 2.14 1.97 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.50 7.81 69 M 7.87 3.80 0.00 1.74 1.26 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.17 0.00 70 Q 8.34 3.85 0.00 2.22 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 71 N 8.00 4.31 0.00 2.92 2.81 0.00 0.00 7.09 7.13 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 72 Q 7.78 3.93 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.01 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 73 R 7.78 3.86 0.00 0.87 0.66 0.00 2.93 0.00 0.00 2.92 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.14 0.00 74 G 7.44 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 75 G 7.55 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 0.00 0.00 0.00 0.00 76 R 8.17 4.45 0.00 1.79 1.81 0.00 3.34 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 77 A 8.52 4.55 1.05 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 78 L 7.97 4.62 0.00 1.48 1.49 0.89 0.83 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 79 F 8.71 4.76 0.00 3.05 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 80 Q 8.29 4.78 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.95 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 81 D 8.60 4.48 0.00 2.69 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 82 I 8.02 4.40 1.95 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.57 1.07 0.00 0.00 83 K 8.59 4.17 0.00 1.97 1.75 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.45 7.81 84 K 8.35 3.87 0.00 1.70 1.76 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.40 7.81 85 P 0.00 4.33 0.00 2.41 2.16 0.00 3.27 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.58 0.00 86 A 8.63 4.08 1.27 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 0.00 0.00 0.00 87 E 7.16 4.34 0.00 1.16 1.12 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 1.51 1.47 0.00 88 D 7.87 4.77 0.00 2.43 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 89 E 6.96 3.98 0.00 1.58 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 90 W 5.97 4.30 0.00 2.95 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 G 7.12 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 92 K 9.20 4.62 0.00 2.09 1.86 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.47 7.81 93 T 8.97 4.20 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 1.16 0.00 0.00 94 P 0.00 4.43 0.00 2.23 2.16 0.00 3.70 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 95 D 8.28 4.40 0.00 3.25 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 96 A 8.33 4.26 1.78 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 0.00 0.00 97 M 8.48 4.28 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.62 0.00 98 K 8.20 4.09 0.00 2.17 1.91 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.65 7.81 99 A 8.06 4.09 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.16 3.90 1.77 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 0.00 101 M 8.55 4.02 0.00 2.33 2.17 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 2.65 2.66 0.00 102 A 8.22 3.93 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 103 L 8.08 3.83 0.00 1.80 1.84 0.80 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.62 4.01 0.00 2.08 2.19 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 2.69 2.63 0.00 105 K 8.11 4.18 0.00 2.08 1.88 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.60 7.81 106 K 8.22 3.89 0.00 1.90 1.94 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.47 7.81 107 L 7.81 3.89 0.00 1.84 1.55 0.44 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.76 4.38 0.00 2.92 3.01 0.00 0.00 6.91 7.31 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 0.00 109 Q 8.09 3.92 0.00 2.38 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 110 A 7.90 4.07 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.39 3.93 0.00 1.94 1.79 1.19 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.16 4.01 0.00 1.86 1.74 1.01 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.57 4.30 0.00 2.89 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 0.00 114 L 8.11 3.94 0.00 1.85 1.85 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 115 H 8.65 4.07 0.00 3.35 3.45 0.00 5.64 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 0.00 116 A 8.00 3.96 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 0.00 117 L 8.13 4.01 0.00 1.59 1.91 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.37 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.07 4.15 0.00 4.07 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 0.00 120 A 7.88 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 R 7.66 4.31 0.00 1.87 1.92 0.00 3.44 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 122 T 7.56 3.43 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 1.22 0.00 0.00 123 D 7.34 4.84 0.00 2.68 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 0.00 124 P 0.00 4.30 0.00 2.34 2.32 0.00 3.83 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.05 0.00 125 H 8.30 4.12 0.00 3.24 3.52 0.00 5.68 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.04 4.08 0.00 2.03 1.87 1.03 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 127 C 7.86 3.92 0.00 3.07 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 0.00 128 D 8.36 4.31 0.00 2.86 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 0.00 129 F 8.71 4.17 0.00 2.99 3.31 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 0.00 130 L 8.05 4.03 0.00 1.94 1.75 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.39 3.99 0.00 2.17 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 2.41 2.66 0.00 132 T 7.80 3.74 3.83 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 0.00 0.00 1.02 0.00 0.00 133 H 7.51 4.58 0.00 2.54 2.79 0.00 5.59 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 0.00 134 F 7.67 4.64 0.00 3.09 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 0.00 135 L 8.28 4.03 0.00 1.71 1.74 0.98 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 136 D 7.79 4.40 0.00 2.80 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 0.00 137 E 8.08 3.92 0.00 2.15 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 0.00 2.31 2.19 0.00 138 E 8.26 3.99 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.61 0.00 139 V 7.77 3.60 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 1.11 0.00 0.00 0.99 0.00 0.00 140 K 8.03 3.95 0.00 2.01 1.84 0.00 1.70 0.00 0.00 1.56 0.00 0.00 3.21 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.63 7.81 141 L 8.04 4.00 0.00 1.79 1.85 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 142 I 8.21 3.72 2.13 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.66 0.94 0.00 0.00 143 K 8.29 3.89 0.00 1.86 2.06 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.50 7.81 144 K 7.89 3.95 0.00 2.05 1.96 0.00 1.75 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.44 7.81 145 M 8.43 4.28 0.00 2.22 2.31 0.00 0.00 0.00 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.82 0.00 146 G 8.46 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 0.00 147 D 7.93 4.36 0.00 2.86 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 0.00 148 H 8.05 4.27 0.00 3.21 3.16 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 L 8.32 4.01 0.00 1.85 1.74 0.97 0.70 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 0.00 150 T 8.06 3.87 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 151 N 7.99 4.41 0.00 2.81 2.87 0.00 0.00 7.15 7.69 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 0.00 152 L 8.12 4.13 0.00 1.89 1.73 0.88 0.76 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 0.00 153 H 8.38 4.11 0.00 3.24 3.56 0.00 5.76 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 8.00 4.03 0.00 1.89 2.15 0.00 3.31 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 155 L 7.51 4.32 0.00 1.61 1.56 0.91 0.79 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