NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 M 4.4157 8.3044 118.7825 53.9219 32.5274 174.6580 4 R 4.1351 8.3804 126.0615 54.7539 30.7480 174.6734 5 L 4.5322 8.7198 127.3711 54.8646 42.9994 176.7068 6 T 4.2018 9.0806 113.5131 61.0165 70.4555 175.2549 7 E 3.9135 8.9684 121.8566 59.7380 29.4674 178.6506 8 E 3.9787 8.1126 117.8482 59.5134 29.5894 179.0900 9 E 3.9165 8.0655 118.1938 59.1705 29.4077 179.6051 10 V 3.5049 8.0714 118.6337 66.1286 31.7864 178.1185 11 Q 4.0105 8.1435 117.5873 58.8664 28.2854 178.7618 12 A 3.9446 7.6713 120.8955 55.1774 18.6584 179.4375 13 L 3.7793 7.6231 117.5028 57.6694 41.5084 179.7310 14 L 4.2446 8.1410 119.4458 57.6862 41.3291 179.0742 15 E 4.0781 8.0107 118.0378 58.2139 29.5764 177.9042 16 K 4.5997 7.5919 115.7388 55.2388 33.8888 176.8038 17 A 4.7976 7.7194 124.8113 49.5849 18.4566 174.9038 18 D 4.6289 8.2660 120.1295 55.6974 41.6936 177.0380 19 G 3.8164 9.0206 111.7850 44.7687 0.0000 173.3062 20 W 4.7477 7.6889 119.2709 55.6713 30.2854 176.2925 21 K 4.8197 9.2092 123.7225 54.1695 35.4377 175.4100 22 L 4.8157 8.7295 125.9790 55.3752 42.8923 175.7479 23 A 4.7028 9.5347 126.6383 50.7396 23.4938 175.2088 24 D 4.2683 9.6827 115.9451 55.4063 38.8033 177.0379 25 E 4.1134 8.7962 120.9759 57.6719 28.8452 175.8695 26 R 4.7907 8.6670 113.0038 55.5027 30.5442 174.4611 27 W 5.2302 8.6625 117.4656 55.5664 33.5566 174.1841 28 I 5.1882 8.6857 115.6752 59.3085 39.8151 174.5920 29 V 5.2701 9.4291 125.2466 61.1686 34.9361 174.0372 30 K 4.4577 8.7681 127.1991 54.3403 35.7559 174.6295 31 K 4.7815 8.0010 125.0595 54.7971 34.2131 174.9794 32 Y 4.0163 9.1019 123.2945 56.0122 40.1231 174.6810 33 R 4.9774 8.2229 124.8783 54.8642 31.7819 175.1578 34 F 4.8836 8.8346 123.4129 55.9368 41.9763 175.4003 35 Q 4.2352 8.9148 118.8005 56.8259 29.6673 175.7278 36 D 4.8964 7.8344 117.4895 51.7479 43.9815 175.1201 37 Y 4.1235 8.9239 127.2980 61.1509 38.8441 178.4188 38 L 3.8378 8.0300 118.6738 57.3356 41.7236 179.3177 39 Q 4.0084 8.4037 118.9199 58.5828 28.6133 178.6330 40 G 2.2376 7.2761 106.3123 47.2583 0.0000 175.8730 41 I 3.4997 6.9399 121.6725 63.9756 37.0401 178.1260 42 E 3.8058 7.9448 120.2095 59.0018 29.3216 178.6390 43 F 4.1583 8.0337 120.7799 61.2798 39.4893 177.2142 44 V 3.1681 7.6044 117.8209 65.8268 31.3303 177.8430 45 R 3.7840 8.0321 118.5888 59.5020 30.0236 178.7839 46 R 3.8697 7.9492 118.0092 59.2114 30.1145 179.0957 47 I 3.7047 7.5508 112.5097 63.2953 37.3922 178.1666 48 A 3.8695 7.8596 122.9417 54.8812 18.1718 179.3495 49 A 3.9195 7.7623 118.8264 55.4305 18.5588 179.9076 50 I 3.6954 7.6441 117.8876 64.6715 37.1931 178.9207 51 S 4.2086 8.2568 116.0562 61.5636 62.7423 176.3330 52 E 3.9427 8.5282 122.4304 59.3370 29.1670 178.4335 53 N 4.3809 8.1131 115.9212 55.9761 39.1114 175.7909 54 A 4.3066 7.6455 119.1823 51.0844 19.5083 176.3776 55 N 4.0754 7.9005 113.7561 53.6944 36.8217 175.1103 56 H 4.5588 8.2213 117.6361 55.5874 31.6242 171.5252 57 H 4.9248 8.7646 124.7036 53.5344 30.2047 173.4875 58 P 5.0587 0.0000 0.0000 62.0617 33.3878 174.6645 59 F 4.8130 9.5518 123.0310 57.2720 40.9027 174.4394 60 I 5.2076 7.3960 125.5449 59.4278 40.5381 174.7752 61 S 4.6381 9.0925 120.3930 56.5082 66.5343 173.2512 62 I 4.6791 8.4621 122.3809 60.1000 39.1207 174.7734 63 D 4.8065 9.2541 128.9810 53.2594 41.5404 177.9281 64 Y 3.8860 8.1964 129.6186 58.7664 39.1838 171.0494 65 K 4.3381 8.7311 116.9141 56.1221 32.3014 174.6574 66 L 5.1628 8.2710 123.3622 53.4941 44.2493 174.9823 67 I 4.9509 8.9937 128.2398 60.1811 39.4005 174.7562 68 T 5.0606 8.9431 124.3132 61.7825 71.0362 173.6057 69 V 5.0174 8.9638 126.2976 61.0721 34.7001 174.2065 70 K 5.5440 9.7344 127.1270 54.8492 35.4275 175.1013 71 L 5.3124 9.1029 125.0205 53.3158 44.9707 175.4557 72 S 4.3477 7.8201 114.3599 57.9217 65.5486 175.5522 73 S 4.5843 8.1235 120.1002 56.1644 63.7489 175.2198 74 W 4.2487 8.8340 123.7156 59.3652 28.1964 179.0461 75 R 3.1768 6.8392 116.6356 58.0181 29.4803 177.0243 76 A 4.2475 7.6101 117.8820 51.2168 19.5092 176.6031 77 K 3.9043 7.4840 114.3654 55.5531 30.5305 176.2606 78 G 3.8310 6.6654 105.6870 46.2102 0.0000 172.0969 79 L 4.5854 7.6877 119.8627 54.2754 43.0151 175.8502 80 T 4.9297 8.6596 111.5437 58.7072 72.1293 174.7911 81 K 3.9742 8.5882 121.7495 59.6394 31.8901 178.1325 82 L 3.8139 7.3950 120.3873 58.1616 41.8827 178.7135 83 D 4.0567 7.7347 118.2275 57.4599 40.8859 178.9310 84 F 3.7625 7.8574 117.4510 60.1218 38.9205 177.5105 85 D 4.2961 8.1063 119.0153 57.3159 40.6370 178.7351 86 L 3.6067 8.0021 119.6728 57.2981 41.4670 179.3043 87 A 3.5786 7.3859 120.7552 55.0068 18.0564 179.9059 88 K 4.0955 7.7653 116.4941 59.6455 32.1869 179.6915 89 Q 4.0581 7.9366 118.4493 59.2143 28.6216 178.4574 90 Y 4.5292 8.4503 118.2423 61.2694 37.8599 178.0805 91 D 4.8653 8.7691 120.0227 57.5358 40.9863 178.4842 92 E 4.0372 8.6683 119.8869 59.2579 29.6844 179.0007 93 V 3.7119 7.9946 118.0719 66.2751 31.6425 177.2452 94 Y 4.0339 8.4710 119.1950 60.9952 38.3920 177.9859 95 N 4.3185 8.4945 116.3347 56.2815 38.6688 177.2242 96 Q 4.1523 8.0901 118.8762 59.2239 28.9037 178.2826 97 M 4.2017 7.9344 118.7349 58.0294 32.0923 176.9465 98 K 4.0512 7.7212 123.2366 56.5984 32.4742 176.2307 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 3 M 8.30 4.42 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 4 R 8.38 4.14 0.00 2.03 1.83 0.00 3.44 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 5 L 8.72 4.53 0.00 1.57 1.58 1.08 0.86 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 6 T 9.08 4.20 4.23 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 1.25 0.00 0.00 7 E 8.97 3.91 0.00 2.06 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 2.39 2.44 0.00 8 E 8.11 3.98 0.00 2.07 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 2.39 2.45 0.00 9 E 8.07 3.92 0.00 2.21 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 0.00 2.28 2.28 0.00 10 V 8.07 3.50 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 1.26 0.00 0.00 1.09 0.00 0.00 11 Q 8.14 4.01 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 12 A 7.67 3.94 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.62 3.78 0.00 0.69 0.13 0.37 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.14 4.24 0.00 1.85 1.83 1.09 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.01 4.08 0.00 2.12 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 2.33 2.37 0.00 16 K 7.59 4.60 0.00 1.70 1.81 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.40 7.81 17 A 7.72 4.80 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.27 4.63 0.00 2.75 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 19 G 9.02 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 W 7.69 4.75 0.00 3.48 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 21 K 9.21 4.82 0.00 1.66 1.71 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.48 7.81 22 L 8.73 4.82 0.00 1.76 1.66 1.06 1.02 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 23 A 9.53 4.70 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 24 D 9.68 4.27 0.00 2.85 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 25 E 8.80 4.11 0.00 2.22 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 0.00 2.26 2.34 0.00 26 R 8.67 4.79 0.00 1.78 1.97 0.00 3.11 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 1.87 1.52 0.00 27 W 8.66 5.23 0.00 3.48 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.69 5.19 2.06 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.11 0.81 0.00 0.00 29 V 9.43 5.27 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 1.09 0.00 0.00 1.09 0.00 0.00 30 K 8.77 4.46 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.30 0.46 7.81 31 K 8.00 4.78 0.00 1.43 1.57 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.71 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.27 1.30 7.81 32 Y 9.10 4.02 0.00 2.66 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.22 4.98 0.00 1.74 1.71 0.00 3.14 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00 34 F 8.83 4.88 0.00 2.93 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 35 Q 8.91 4.24 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 36 D 7.83 4.90 0.00 2.65 2.50 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 37 Y 8.92 4.12 0.00 3.03 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 38 L 8.03 3.84 0.00 1.85 1.64 0.96 0.97 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 39 Q 8.40 4.01 0.00 2.25 2.15 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 2.50 2.55 0.00 40 G 7.28 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 0.00 0.00 0.00 0.00 0.00 0.00 41 I 6.94 3.50 1.77 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.42 0.75 0.00 0.00 42 E 7.94 3.81 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 43 F 8.03 4.16 0.00 2.99 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 V 7.60 3.17 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 0.79 0.00 0.00 0.92 0.00 0.00 45 R 8.03 3.78 0.00 1.90 2.01 0.00 3.11 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 46 R 7.95 3.87 0.00 1.93 1.91 0.00 3.22 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 47 I 7.55 3.70 0.78 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 0.91 0.20 -0.00 0.00 0.00 48 A 7.86 3.87 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 49 A 7.76 3.92 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 50 I 7.64 3.70 2.16 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.09 1.02 0.00 0.00 51 S 8.26 4.21 0.00 4.05 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.53 3.94 0.00 2.17 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 2.34 2.39 0.00 53 N 8.11 4.38 0.00 2.77 2.98 0.00 0.00 7.19 8.10 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 54 A 7.65 4.31 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 55 N 7.90 4.08 0.00 2.91 2.94 0.00 0.00 6.62 8.08 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 56 H 8.22 4.56 0.00 3.22 3.15 0.00 5.73 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.76 4.92 0.00 3.23 3.30 0.00 5.94 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 58 P 0.00 5.06 0.00 2.34 2.41 0.00 3.86 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 59 F 9.55 4.81 0.00 3.26 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 60 I 7.40 5.21 1.68 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.73 0.83 0.00 0.00 61 S 9.09 4.64 0.00 3.90 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 62 I 8.46 4.68 1.94 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.66 1.01 0.00 0.00 63 D 9.25 4.81 0.00 2.73 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 64 Y 8.20 3.89 0.00 2.98 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 0.00 0.00 0.00 0.00 65 K 8.73 4.34 0.00 1.66 1.96 0.00 1.31 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.22 0.21 7.81 66 L 8.27 5.16 0.00 1.79 1.74 0.96 1.13 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 67 I 8.99 4.95 2.27 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.00 1.18 0.00 0.00 68 T 8.94 5.06 4.36 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 1.29 0.00 0.00 69 V 8.96 5.02 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 1.19 0.00 0.00 70 K 9.73 5.54 0.00 2.01 1.99 0.00 1.34 0.00 0.00 1.40 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.66 7.81 71 L 9.10 5.31 0.00 1.51 1.61 0.58 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.82 4.35 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.12 4.58 0.00 3.82 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 74 W 8.83 4.25 0.00 3.58 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 75 R 6.84 3.18 0.00 1.25 1.53 0.00 2.75 0.00 0.00 2.81 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 76 A 7.61 4.25 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 77 K 7.48 3.90 0.00 1.85 1.93 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.34 7.81 78 G 6.67 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 0.00 0.00 0.00 0.00 79 L 7.69 4.59 0.00 1.78 1.63 1.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 80 T 8.66 4.93 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 81 K 8.59 3.97 0.00 1.87 1.83 0.00 1.61 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.48 1.76 7.81 82 L 7.39 3.81 0.00 1.53 1.46 0.79 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 83 D 7.73 4.06 0.00 2.57 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 0.00 0.00 0.00 84 F 7.86 3.76 0.00 3.10 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.11 4.30 0.00 2.73 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 86 L 8.00 3.61 0.00 1.37 0.85 0.82 0.58 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 87 A 7.39 3.58 0.02 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 0.00 0.00 88 K 7.77 4.10 0.00 2.00 1.91 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.65 7.81 89 Q 7.94 4.06 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 90 Y 8.45 4.53 0.00 3.53 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 91 D 8.77 4.87 0.00 3.17 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 92 E 8.67 4.04 0.00 2.28 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 0.00 2.38 2.45 0.00 93 V 7.99 3.71 2.56 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 1.15 0.00 0.00 1.13 0.00 0.00 94 Y 8.47 4.03 0.00 2.81 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 95 N 8.49 4.32 0.00 2.94 2.92 0.00 0.00 7.13 8.55 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 96 Q 8.09 4.15 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.97 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 97 M 7.93 4.20 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.61 0.00 98 K 7.72 4.05 0.00 1.15 1.38 0.00 1.72 0.00 0.00 1.43 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.24 7.81