NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 V 4.0133 8.0544 120.3965 62.6927 31.9896 175.9809 10 F 4.6176 8.6008 122.1825 53.3867 41.3513 173.8299 11 S 4.2284 8.2291 123.9349 58.0029 65.8219 173.9071 12 E 3.8190 8.6546 123.3590 59.7526 29.2781 179.1901 13 E 3.8786 7.9028 117.9022 59.2017 29.5114 179.3326 14 K 3.6007 7.5996 118.5004 59.0931 31.9802 178.7224 15 E 3.9294 7.9069 119.6997 59.5126 29.4361 178.7578 16 A 4.0144 7.9727 120.3911 55.2053 18.2617 179.6327 17 L 3.9290 7.7614 117.3019 57.9522 41.6292 179.9434 18 V 3.2259 7.8423 118.3774 65.7593 31.3727 178.1152 19 L 4.1570 8.5065 119.3646 57.7765 41.5549 179.6673 20 K 4.1831 8.4339 119.0690 59.6224 32.6046 179.5347 21 S 4.3307 8.1959 115.9130 61.3331 63.1533 176.3652 22 W 4.7537 9.0823 132.2845 59.9021 30.1781 177.7234 23 A 3.8112 8.0448 120.4466 54.9833 18.0270 179.4755 24 I 3.8265 7.4404 117.6142 64.9438 37.2917 178.6543 25 M 4.2659 8.2243 119.5131 58.1047 31.5860 178.5982 26 K 3.1410 7.3465 119.2414 58.9518 32.1214 178.2053 27 K 4.2485 7.2268 114.9779 57.4491 32.2615 176.9042 28 D 4.8185 8.3482 119.4325 53.0129 42.5196 177.1781 29 S 4.4347 8.4862 115.6407 61.1326 62.8776 174.9606 30 A 3.9559 8.1745 123.7719 55.2470 18.0027 178.6304 31 N 4.1506 8.0782 113.6645 56.9113 39.0518 177.1397 32 L 3.8425 7.9517 120.2369 57.4966 41.6250 179.7527 33 G 3.5843 8.1903 106.1080 47.6830 0.0000 175.5663 34 L 4.0302 7.8983 122.9571 57.8332 42.1322 179.0032 35 R 3.8918 8.2936 118.5358 59.3034 30.0205 178.6208 36 F 4.7578 8.3908 121.8662 61.0662 39.4260 177.2952 37 F 3.1035 8.1918 117.1796 60.0488 38.6520 177.7448 38 L 4.1410 8.3359 119.1537 57.6310 41.3684 179.5439 39 K 3.9859 8.1435 119.6662 59.3021 32.1121 178.7143 40 I 3.5268 7.3254 120.1506 64.7319 36.5183 178.4474 41 F 4.7479 7.8891 117.9775 60.0696 38.4528 177.5242 42 E 4.0002 8.5412 119.1234 59.5167 29.5398 178.7164 43 I 4.0589 7.7690 118.1301 63.0335 38.5812 176.5529 44 A 4.6798 8.1962 122.7399 48.3142 19.2522 174.0717 45 P 4.5048 0.0000 0.0000 64.6069 31.6999 177.9834 46 S 4.1228 8.2209 112.0962 61.1710 62.8018 176.1809 47 A 4.1763 8.2839 124.5204 55.0358 18.1548 179.5815 48 R 3.4147 8.1071 117.0665 59.3268 29.8435 178.4620 49 Q 4.2047 7.6544 114.7801 57.3577 28.8344 177.2857 50 M 4.2811 7.9319 119.3449 56.0732 32.5326 175.9092 51 F 4.2319 7.5990 118.1173 54.9159 39.8485 174.2013 52 P 4.2267 0.0000 0.0000 65.5780 31.3324 178.4240 53 F 4.5881 7.8382 110.2162 58.0821 38.1648 175.8235 54 L 4.2838 7.7132 122.4205 56.8217 42.3419 179.0261 55 R 3.8767 7.9012 115.8708 58.6498 30.0063 176.9737 56 D 4.7977 7.5817 113.3461 53.8568 41.7013 175.9924 57 S 4.7074 7.4759 114.0931 56.7990 63.7048 173.6957 58 D 4.5018 8.5306 125.2446 55.8450 39.8759 177.5851 59 V 3.9348 7.4505 111.4200 59.7631 32.6477 174.0625 60 P 4.4087 0.0000 0.0000 62.3916 31.7707 177.4719 61 L 3.9551 8.8133 122.1322 58.3053 41.6083 179.8853 62 E 4.1163 8.2838 115.7441 58.7668 29.5153 177.8874 63 T 4.2405 7.6819 107.2126 61.8791 70.2231 174.1786 64 N 4.0764 7.6670 119.5092 53.3077 39.3347 173.0072 65 P 4.2037 0.0000 0.0000 65.5789 31.5869 178.5096 66 K 3.6391 7.9906 117.9023 59.1367 31.9943 178.2792 67 L 3.9518 8.0856 120.5861 58.1174 42.0132 178.9921 68 K 3.8457 7.6698 118.3183 59.9692 31.8983 179.4577 69 T 3.8167 7.4709 115.8795 66.7882 68.3411 176.3832 70 H 4.0156 8.0919 119.9567 58.9316 29.7927 177.2014 71 A 3.1822 8.3164 123.0211 55.0254 18.1485 179.7683 72 V 3.7024 7.8827 116.8244 66.1849 31.5508 178.1722 73 S 4.1231 7.8629 113.0764 61.4391 62.1770 176.3933 74 V 3.7629 7.9460 121.0235 65.7774 31.2942 177.8112 75 F 4.2848 8.8308 120.7021 61.4223 39.3672 177.2691 76 V 3.4960 8.3318 118.2033 66.1370 31.3595 177.5399 77 M 3.9863 8.0926 117.8953 58.9761 32.0922 178.3839 78 T 3.8112 8.0647 115.9856 66.9270 68.6225 176.6307 79 C 4.0434 7.4801 118.5800 62.4751 27.8287 176.0360 80 E 3.6889 8.0473 120.3720 59.1285 28.8049 178.9296 81 A 3.9372 7.6554 119.5374 55.3041 18.4913 179.3360 82 A 3.6637 7.6100 118.2438 55.0667 18.2722 179.7787 83 A 3.9248 7.9527 118.2154 54.3375 18.7326 178.7216 84 Q 4.4099 7.6588 114.9001 55.6223 29.7698 177.2239 85 L 3.8938 7.1584 122.7618 58.2858 41.7526 178.9651 86 R 3.8933 7.8407 116.2259 59.2332 30.3126 177.5546 87 K 3.9803 8.0740 117.3682 59.8149 32.2559 178.0773 88 A 4.1901 8.3863 119.2865 52.7599 18.4327 178.5764 89 G 3.8211 8.7905 104.5926 45.1478 0.0000 172.7258 90 K 4.1718 7.0875 116.7058 56.1298 34.6313 174.1099 91 I 3.9591 8.2131 120.5094 60.8378 37.6017 175.8167 92 T 4.6643 8.1878 114.6568 59.7401 71.4302 173.8806 93 V 4.3415 7.8830 115.0627 59.3877 34.7974 175.4749 94 R 4.0536 8.5876 124.5879 57.4441 30.3622 176.7985 95 E 3.9395 9.3308 120.1100 57.1809 27.6233 174.3807 96 T 4.5327 7.4640 114.5984 62.2833 71.8900 173.4592 97 T 4.7466 8.1777 117.3508 61.8435 73.8961 174.6561 98 L 4.0283 8.5117 123.9404 57.7328 41.6794 179.8604 99 K 4.1704 7.8824 120.5414 58.9572 32.1359 178.9635 100 R 3.9349 7.9202 117.7672 59.2594 30.0507 178.6264 101 L 4.2011 8.0043 118.9116 57.9185 41.5961 179.8055 102 G 3.8391 8.4802 105.7838 47.8724 0.0000 175.7988 103 G 3.6948 8.2744 108.6032 47.7814 0.0000 175.8074 104 T 3.9984 8.2630 118.7630 66.8373 68.5236 176.5302 105 H 4.3400 8.7705 118.3343 58.2648 28.8746 177.4991 106 L 3.9956 8.3835 122.7979 58.3528 41.7205 179.2220 107 K 3.9198 8.0839 116.9096 59.3790 32.0482 177.9923 108 Y 4.3335 7.8268 113.7274 57.2393 38.0021 175.8593 109 G 3.8557 7.8098 107.5577 46.2413 0.0000 174.2073 110 V 3.5724 7.8737 119.5944 62.2530 32.1197 175.2246 111 A 4.9608 8.5768 128.7397 49.8755 22.1801 176.3064 112 D 4.8409 9.0518 119.4040 58.0746 40.7658 180.0138 113 G 3.6796 8.1036 105.3214 45.7625 0.0000 175.4197 114 H 4.2191 8.0232 118.4575 58.9160 28.7364 177.8532 115 F 4.4997 8.0537 119.0360 60.5525 38.8288 177.4960 116 E 4.0958 8.4309 118.2327 59.5187 29.2971 179.3194 117 V 3.7480 7.7591 118.1450 66.6276 31.4598 178.2517 118 T 3.8890 8.1143 115.3201 66.3167 68.1873 176.6316 119 R 2.8031 8.2115 120.8274 59.2050 29.9907 178.3059 120 F 3.9628 8.2074 119.9060 61.1928 39.3934 176.8338 121 A 4.0075 8.4365 120.5944 55.0029 18.1017 179.2025 122 L 3.2611 8.2735 119.0697 58.2761 42.0662 179.1636 123 L 3.8950 7.8229 118.8646 57.9514 41.5480 179.5423 124 E 3.5890 7.9595 118.5053 59.3350 29.2820 179.6061 125 T 3.6876 7.6182 115.8721 66.5042 68.5081 176.8927 126 I 3.4260 7.5796 121.7757 64.0924 36.9728 178.0348 127 K 2.4800 7.1991 120.6060 59.3369 31.5002 177.9850 128 E 3.9738 7.5417 115.0541 57.5467 29.5797 177.8211 129 A 4.3467 7.5175 119.7856 51.3379 19.7739 176.7546 130 L 4.8250 6.7002 116.7611 51.5608 45.0485 174.8703 131 P 4.3083 0.0000 0.0000 62.5788 31.9464 177.4540 132 A 4.0460 8.7711 124.4571 55.3463 18.4780 179.4712 133 D 4.3873 8.1398 114.3419 57.4133 41.4193 176.8224 134 M 4.3227 8.2046 116.8246 55.7617 32.4102 175.8044 135 W 4.8126 8.9959 128.9485 55.0810 32.8165 175.0498 136 G 4.1122 6.4376 109.4488 42.8014 0.0000 171.9586 137 P 4.0464 0.0000 0.0000 65.6639 30.8851 178.4355 138 E 3.8659 7.8827 116.9945 59.1469 29.6886 178.5859 139 M 3.9034 7.6172 118.6424 58.3973 32.3114 177.8227 140 R 3.6774 7.0715 118.6961 59.6318 30.0173 178.2099 141 N 4.3587 8.1203 115.9005 55.8731 38.5258 177.2841 142 A 3.9625 8.2551 122.6468 55.1437 18.4318 179.8063 143 W 4.3053 8.3435 117.5748 59.8391 29.0828 179.0732 144 G 3.7575 8.6338 106.0003 48.0037 0.0000 175.6738 145 E 4.1385 8.8083 121.2360 58.8767 29.4374 179.2982 146 A 3.6085 8.1707 120.9660 55.1293 18.3675 178.8479 147 Y 3.9836 8.4210 118.4188 61.1433 38.7755 178.1111 148 D 4.3838 8.7290 120.0228 57.6100 40.8657 178.9422 149 Q 3.8671 8.1567 118.4148 58.6563 28.6685 178.5463 150 L 3.7326 7.8072 121.3334 58.1218 42.0887 179.0819 151 V 3.0175 7.4976 118.1493 65.8192 31.3213 177.7171 152 A 3.8217 7.9882 120.3134 55.0478 17.9408 179.4383 153 A 3.8554 7.8036 118.3466 55.3095 18.7939 179.6912 154 I 3.7668 7.6811 118.2455 64.5361 37.1354 178.8721 155 K 3.9588 8.1700 119.6151 59.4260 31.7209 179.2077 156 Q 3.9919 7.9948 118.4909 58.7143 28.7181 177.9462 157 E 4.3516 8.0548 117.0570 56.7643 29.5966 177.0993 158 M 4.7025 8.0820 117.6619 54.9049 32.8456 175.6583 159 K 4.7452 7.2919 117.4389 53.2843 35.8498 174.4502 160 P 4.4197 0.0000 0.0000 63.2587 31.1552 176.2705 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 9 V 8.05 4.01 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 0.99 0.00 0.00 0.94 0.00 0.00 10 F 8.60 4.62 0.00 2.85 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 11 S 8.23 4.23 0.00 3.96 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 12 E 8.65 3.82 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 13 E 7.90 3.88 0.00 1.95 1.87 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 2.32 2.39 0.00 14 K 7.60 3.60 0.00 0.79 0.74 0.00 1.18 0.00 0.00 1.13 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.11 1.07 7.81 15 E 7.91 3.93 0.00 2.05 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 2.33 2.40 0.00 16 A 7.97 4.01 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 L 7.76 3.93 0.00 1.79 1.70 0.85 0.81 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 18 V 7.84 3.23 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 0.44 0.00 0.00 0.18 0.00 0.00 19 L 8.51 4.16 0.00 1.84 1.78 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.43 4.18 0.00 2.05 2.12 0.00 1.37 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.80 1.55 7.81 21 S 8.20 4.33 0.00 4.39 4.52 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 22 W 9.08 4.75 0.00 3.78 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.04 3.81 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 24 I 7.44 3.83 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.15 0.93 0.00 0.00 25 M 8.22 4.27 0.00 2.49 2.54 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.64 0.00 26 K 7.35 3.14 0.00 0.79 1.10 0.00 1.64 0.00 0.00 1.10 0.00 0.00 2.74 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.07 0.78 7.81 27 K 7.23 4.25 0.00 1.84 1.79 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.56 7.81 28 D 8.35 4.82 0.00 2.63 2.51 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 0.00 29 S 8.49 4.43 0.00 4.60 4.53 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 0.00 0.00 0.00 30 A 8.17 3.96 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 31 N 8.08 4.15 0.00 2.81 3.21 0.00 0.00 7.02 6.66 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 32 L 7.95 3.84 0.00 1.21 0.79 1.05 0.54 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 33 G 8.19 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 4.03 0.00 1.79 1.81 0.95 1.02 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 35 R 8.29 3.89 0.00 1.89 1.91 0.00 3.09 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 36 F 8.39 4.76 0.00 2.87 3.33 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 37 F 8.19 3.10 0.00 3.03 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 38 L 8.34 4.14 0.00 1.82 1.76 0.95 0.84 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 39 K 8.14 3.99 0.00 1.95 1.97 0.00 1.62 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.57 7.81 40 I 7.33 3.53 1.09 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 1.10 -0.08 0.55 0.00 0.00 41 F 7.89 4.75 0.00 3.08 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 42 E 8.54 4.00 0.00 2.06 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 2.36 2.39 0.00 43 I 7.77 4.06 2.02 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.77 0.88 0.00 0.00 44 A 8.20 4.68 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 45 P 0.00 4.50 0.00 2.18 2.14 0.00 3.92 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 46 S 8.22 4.12 0.00 4.07 4.15 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 47 A 8.28 4.18 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 0.00 0.00 0.00 0.00 0.00 48 R 8.11 3.41 0.00 1.77 1.66 0.00 2.79 0.00 0.00 2.67 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.32 0.00 49 Q 7.65 4.20 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.02 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 50 M 7.93 4.28 0.00 1.32 2.06 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.32 0.00 51 F 7.60 4.23 0.00 2.65 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 0.00 0.00 0.00 0.00 52 P 0.00 4.23 0.00 2.28 2.19 0.00 3.54 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.23 0.00 53 F 7.84 4.59 0.00 3.11 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 54 L 7.71 4.28 0.00 1.70 1.46 0.35 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.90 3.88 0.00 1.89 1.98 0.00 3.14 0.00 0.00 3.36 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 56 D 7.58 4.80 0.00 2.80 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 57 S 7.48 4.71 0.00 4.05 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 58 D 8.53 4.50 0.00 2.82 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 59 V 7.45 3.93 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 0.73 0.00 0.00 0.94 0.00 0.00 60 P 0.00 4.41 0.00 2.17 1.96 0.00 3.63 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 61 L 8.81 3.96 0.00 1.71 1.80 0.94 0.73 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 62 E 8.28 4.12 0.00 1.94 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 2.33 2.39 0.00 63 T 7.68 4.24 4.24 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 1.21 0.00 0.00 64 N 7.67 4.08 0.00 2.85 2.87 0.00 0.00 7.03 7.59 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 65 P 0.00 4.20 0.00 2.16 2.05 0.00 3.65 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 2.10 2.13 0.00 66 K 7.99 3.64 0.00 1.77 1.20 0.00 1.49 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.89 1.12 7.81 67 L 8.09 3.95 0.00 2.01 1.88 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.67 3.85 0.00 1.86 1.82 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.64 7.81 69 T 7.47 3.82 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 1.15 0.00 0.00 70 H 8.09 4.02 0.00 2.92 3.19 0.00 5.78 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 71 A 8.32 3.18 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 72 V 7.88 3.70 2.14 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 1.26 0.00 0.00 1.04 0.00 0.00 73 S 7.86 4.12 0.00 3.95 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 74 V 7.95 3.76 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 1.45 0.00 0.00 0.95 0.00 0.00 75 F 8.83 4.28 0.00 3.57 3.30 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 76 V 8.33 3.50 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 1.03 0.00 0.00 1.32 0.00 0.00 77 M 8.09 3.99 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.59 0.00 78 T 8.06 3.81 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 1.29 0.00 0.00 79 C 7.48 4.04 0.00 1.23 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.05 3.69 0.00 1.90 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 2.46 2.58 0.00 81 A 7.66 3.94 1.28 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 0.00 0.00 82 A 7.61 3.66 0.97 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 83 A 7.95 3.92 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 84 Q 7.66 4.41 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 85 L 7.16 3.89 0.00 1.46 1.25 0.79 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 86 R 7.84 3.89 0.00 2.07 2.16 0.00 3.52 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 87 K 8.07 3.98 0.00 1.79 1.96 0.00 1.84 0.00 0.00 1.90 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.53 7.81 88 A 8.39 4.19 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 89 G 8.79 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 90 K 7.09 4.17 0.00 1.76 1.73 0.00 1.55 0.00 0.00 1.68 0.00 0.00 2.80 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.18 1.32 7.81 91 I 8.21 3.96 1.78 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.84 0.82 0.00 0.00 92 T 8.19 4.66 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 1.18 0.00 0.00 93 V 7.88 4.34 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.93 0.00 0.00 94 R 8.59 4.05 0.00 1.81 1.90 0.00 3.36 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 95 E 9.33 3.94 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 96 T 7.46 4.53 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 1.25 0.00 0.00 97 T 8.18 4.75 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 1.28 0.00 0.00 98 L 8.51 4.03 0.00 1.67 1.70 0.88 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.88 4.17 0.00 1.83 1.81 0.00 1.77 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.56 7.81 100 R 7.92 3.93 0.00 2.08 2.00 0.00 3.22 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 101 L 8.00 4.20 0.00 1.89 1.83 0.96 1.07 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 0.00 102 G 8.48 3.84 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 0.00 0.00 0.00 103 G 8.27 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 0.00 104 T 8.26 4.00 4.53 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 0.00 0.00 1.26 0.00 0.00 105 H 8.77 4.34 0.00 3.46 3.53 0.00 5.83 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.38 4.00 0.00 1.95 1.89 0.99 0.45 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 0.00 107 K 8.08 3.92 0.00 1.84 1.62 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.66 7.81 108 Y 7.83 4.33 0.00 2.91 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 0.00 109 G 7.81 3.86 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 0.00 0.00 0.00 110 V 7.87 3.57 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 0.20 0.00 0.00 0.87 0.00 0.00 111 A 8.58 4.96 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 0.00 112 D 9.05 4.84 0.00 2.77 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 0.00 113 G 8.10 3.68 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 0.00 114 H 8.02 4.22 0.00 3.10 3.16 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 F 8.05 4.50 0.00 3.35 3.24 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 0.00 116 E 8.43 4.10 0.00 2.27 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 2.44 2.67 0.00 117 V 7.76 3.75 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 1.12 0.00 0.00 0.98 0.00 0.00 118 T 8.11 3.89 4.52 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 1.42 0.00 0.00 119 R 8.21 2.80 0.00 1.90 2.14 0.00 3.29 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.30 0.00 120 F 8.21 3.96 0.00 3.19 3.21 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 0.00 121 A 8.44 4.01 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 0.00 0.00 122 L 8.27 3.26 0.00 1.44 1.49 0.15 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.82 3.89 0.00 1.55 1.79 0.96 1.29 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 0.00 124 E 7.96 3.59 0.00 1.73 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 1.56 1.87 0.00 125 T 7.62 3.69 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 1.02 0.00 0.00 126 I 7.58 3.43 1.55 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 0.99 0.51 0.56 0.00 0.00 127 K 7.20 2.48 0.00 0.79 1.22 0.00 1.18 0.00 0.00 1.25 0.00 0.00 2.71 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.69 0.21 7.81 128 E 7.54 3.97 0.00 1.90 1.84 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 2.18 2.07 0.00 129 A 7.52 4.35 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 0.00 130 L 6.70 4.82 0.00 1.57 1.65 1.23 1.29 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 0.00 131 P 0.00 4.31 0.00 2.22 2.00 0.00 3.68 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 2.15 2.11 0.00 132 A 8.77 4.05 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 0.00 133 D 8.14 4.39 0.00 2.67 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 0.00 134 M 8.20 4.32 0.00 2.21 2.34 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.55 0.00 135 W 9.00 4.81 0.00 3.27 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 0.00 136 G 6.44 4.11 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 0.00 0.00 0.00 137 P 0.00 4.05 0.00 2.19 2.24 0.00 3.58 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 1.99 1.96 0.00 138 E 7.88 3.87 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 139 M 7.62 3.90 0.00 1.78 2.10 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 3.05 0.00 140 R 7.07 3.68 0.00 1.10 1.69 0.00 3.16 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 1.62 1.77 0.00 141 N 8.12 4.36 0.00 2.78 2.82 0.00 0.00 6.91 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 0.00 142 A 8.26 3.96 1.19 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 0.00 0.00 143 W 8.34 4.31 0.00 3.52 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 0.00 144 G 8.63 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 0.00 145 E 8.81 4.14 0.00 2.28 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 2.40 2.52 0.00 146 A 8.17 3.61 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Y 8.42 3.98 0.00 3.11 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 0.00 148 D 8.73 4.38 0.00 2.92 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Q 8.16 3.87 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 150 L 7.81 3.73 0.00 1.58 1.58 0.82 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 151 V 7.50 3.02 1.67 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 0.15 0.00 0.00 0.08 0.00 0.00 152 A 7.99 3.82 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 0.00 153 A 7.80 3.86 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 0.00 154 I 7.68 3.77 1.76 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 1.49 0.98 0.94 0.00 0.00 155 K 8.17 3.96 0.00 1.82 1.79 0.00 1.50 0.00 0.00 1.58 0.00 0.00 3.09 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.38 1.11 7.81 156 Q 7.99 3.99 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 157 E 8.05 4.35 0.00 2.17 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 158 M 8.08 4.70 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.82 0.00 159 K 7.29 4.75 0.00 1.83 1.67 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.54 7.81 160 P 0.00 4.42 0.00 2.18 2.04 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00