NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 M 4.4429 8.2893 120.3290 55.0309 34.2109 175.3937 25 Q 4.2667 7.8584 116.0907 54.3250 30.5294 173.4186 26 L 4.4783 9.0968 123.3978 54.1695 43.4750 176.9425 27 R 4.9269 8.5589 125.0989 54.7159 32.9452 175.1093 28 F 5.4517 8.1911 115.1837 55.6895 41.4179 173.1194 29 A 4.5113 9.0336 120.3301 50.0674 22.7735 175.4118 30 R 4.7199 8.5379 119.4544 56.1035 30.4974 176.8209 31 L 4.5411 9.4525 124.3191 55.9278 42.6548 176.5570 32 S 4.6181 7.6539 112.2048 56.9426 65.6720 174.6571 33 E 4.1679 8.4797 119.3769 58.4999 29.1386 177.9412 34 H 4.3607 8.1146 116.0257 57.0273 29.1326 175.4641 35 A 4.2893 7.4834 122.2169 52.0127 18.9216 176.7946 36 T 4.4226 7.9944 115.9050 60.9462 71.3227 174.3712 37 A 3.6841 8.4701 128.6325 51.6655 18.9089 175.6044 38 P 5.0820 0.0000 0.0000 62.5182 32.2265 175.8322 39 T 4.9715 8.7817 111.6893 60.2133 72.8428 173.1537 40 R 4.2682 8.4431 122.6289 54.8881 31.3715 174.6971 41 G 3.6860 8.8747 116.5128 48.0305 0.0000 172.3621 42 S 4.5557 7.6665 114.4921 55.9930 63.6315 174.6677 43 A 4.0597 8.6165 129.8765 54.5300 18.3233 178.2890 44 R 4.5204 7.5885 113.1224 55.7494 30.7117 176.0530 45 A 4.0886 7.5695 120.6973 51.8761 18.8484 178.8786 46 A 4.1153 8.5216 124.0317 54.3331 18.8715 178.1685 47 G 4.3100 7.4241 100.4079 44.5615 0.0000 172.2543 48 Y 4.3413 8.6777 119.2551 57.1545 39.4950 175.0329 49 D 4.8200 9.4992 123.8606 54.3828 42.3422 175.1695 50 L 4.7991 8.6121 122.5321 53.2049 44.3597 174.9405 51 Y 5.1066 8.5626 120.6618 55.9815 40.3474 175.6473 52 S 4.4852 9.0190 118.4960 58.6479 63.4582 174.3380 53 A 4.4134 8.8787 126.9640 52.3996 18.9576 176.2860 54 Y 4.6030 7.8813 111.7015 56.3787 42.6643 174.3479 55 D 4.9210 8.4423 120.3698 54.4125 42.1388 175.8539 56 Y 4.8830 9.0839 118.7602 56.7637 42.9950 174.1515 57 T 5.0521 8.7191 118.2624 61.9646 71.4234 173.4531 58 I 4.4519 8.7290 128.2106 58.8170 39.1916 173.9397 59 P 4.8274 0.0000 0.0000 61.3792 32.3359 174.6582 60 P 4.2753 0.0000 0.0000 63.9239 31.9030 176.3822 61 M 3.2167 8.5425 121.7849 56.6292 30.2841 176.2195 62 E 4.9470 7.8261 115.2415 54.3924 34.4870 174.7516 63 K 5.2722 8.7674 119.2632 55.5098 35.9454 175.2954 64 A 4.6361 8.8340 121.1062 50.6499 23.1477 175.5720 65 V 4.2667 8.2157 120.6918 61.5397 32.6882 175.3908 66 V 3.3413 8.5052 129.9638 61.4851 32.7982 175.0890 67 K 4.8085 9.3378 128.6420 56.5472 32.8744 177.8251 68 T 4.4093 8.8012 114.0348 60.7557 70.3541 174.5232 69 D 4.6405 8.5729 121.9876 55.4590 39.3186 172.7346 70 I 5.3066 7.7025 110.1018 59.1375 41.2136 174.1441 71 Q 5.3408 9.2181 121.4681 53.7354 31.2879 174.3709 72 I 5.1621 8.3977 113.2155 59.1810 41.4396 174.8306 73 A 4.6284 8.9823 124.9476 50.0824 21.1192 175.6199 74 L 4.4684 8.5464 121.1160 54.5024 42.4989 175.7641 75 P 4.3945 0.0000 0.0000 62.7978 32.5414 176.0020 76 S 4.2384 8.5555 117.2679 59.9090 63.1932 174.3614 77 G 4.1841 10.2629 114.6665 45.1819 0.0000 172.0935 78 C 5.4031 7.5974 112.8686 56.9651 33.3976 172.4280 79 Y 4.8713 8.6189 117.4992 55.2379 41.3368 174.5951 80 G 4.1431 8.9599 107.3897 44.8477 0.0000 172.7035 81 R 5.0852 8.5921 127.7260 54.8895 31.8853 175.2680 82 V 4.4337 8.6769 127.6463 62.3726 31.9929 174.8984 83 A 4.8929 9.0832 129.5745 49.2392 22.6536 173.3260 84 P 4.6381 0.0000 0.0000 62.1709 32.1623 176.9912 85 R 4.1305 8.3903 121.8121 56.0878 31.2219 178.1413 86 S 4.2203 8.8033 118.6952 61.7149 62.9399 177.2853 87 G 3.6106 7.9968 107.9608 47.7932 0.0000 175.5540 88 L 4.1431 7.9576 120.6765 57.3299 41.6560 179.4046 89 A 4.4666 7.9727 121.4062 54.8558 18.2488 179.6664 90 A 3.8792 7.9170 117.8488 54.7043 18.5217 179.2425 91 K 4.2406 8.3041 115.8881 57.6159 32.7809 177.2629 92 H 4.9137 7.5678 112.3644 54.2601 30.7396 172.7930 93 F 4.1273 8.0796 120.9379 59.4552 38.4773 174.1706 94 I 4.7601 7.5660 118.7536 59.6919 39.3853 174.9998 95 D 5.3345 8.9957 125.2328 52.4647 45.5558 173.8392 96 V 4.3308 8.2370 120.2807 60.9461 33.5962 175.2595 97 G 3.3765 7.9257 115.5399 43.5558 0.0000 175.5255 98 A 3.4992 9.8791 124.4079 52.7353 17.6632 179.8924 99 G 3.8734 9.0100 108.9207 47.3519 0.0000 172.4931 100 V 4.4948 7.4004 119.4518 61.8222 31.9150 174.9314 101 I 4.2920 8.8371 130.6792 59.5994 38.5317 175.6361 102 D 4.8057 8.6912 127.3857 54.0928 41.4886 177.3366 103 E 3.9660 9.3025 122.5983 59.0862 29.7177 177.3541 104 D 4.7728 8.0242 115.2901 52.9477 39.6079 175.2707 105 Y 4.3470 8.2785 123.0965 57.9281 39.1919 175.7541 106 R 4.3634 7.8597 123.9595 55.6067 31.5077 175.9281 107 G 3.6094 5.3800 107.9231 43.5656 0.0000 172.0029 108 N 4.7695 8.4912 118.2932 53.4086 39.7526 175.0307 109 V 4.0563 9.1736 127.5138 62.7931 32.7207 174.7451 110 G 4.4330 8.7698 114.9623 44.3873 0.0000 172.3161 111 V 4.2572 8.7226 124.5358 60.8840 33.7274 174.9373 112 V 4.3061 8.2068 128.9582 62.2737 32.2065 174.3137 113 L 4.8059 8.5875 128.9914 53.2591 43.9757 175.7360 114 F 5.1358 8.6417 121.7334 55.7327 41.7794 174.1613 115 N 4.7444 8.8827 123.4650 52.1142 39.5513 174.5908 116 F 4.5138 8.3990 124.4751 57.6855 39.5284 176.4769 117 G 4.0685 8.1320 107.1479 45.7273 0.0000 174.2578 118 K 4.4231 8.7910 117.6543 56.9378 32.6841 176.8585 119 E 4.9853 7.7661 117.9961 53.6895 32.2209 176.0408 120 K 4.3818 8.7434 121.2541 57.4047 33.6867 175.6029 121 F 4.9337 9.2360 123.8334 56.5618 42.1015 173.5027 122 E 4.7728 8.0646 125.3539 54.8412 31.0996 175.3159 123 V 4.2641 8.7365 124.7239 61.0761 33.9719 174.5777 124 K 5.0755 9.1972 127.0722 53.9082 35.2764 175.7612 125 K 4.0008 8.8302 124.2659 58.6070 32.3620 177.3700 126 G 4.0625 9.1905 114.5081 45.3139 0.0000 173.3852 127 D 4.6392 8.1614 120.6844 53.7275 41.5896 175.9298 128 R 4.1670 8.4056 122.9619 56.0462 30.5199 176.3992 129 I 4.4625 8.1697 114.0874 59.6926 38.9325 174.1146 130 A 4.4365 6.9628 122.0481 52.0267 22.5487 174.7509 131 Q 4.9293 8.7189 115.8122 54.5407 32.8362 174.0996 132 L 5.1359 9.0269 122.5529 53.4932 44.7097 174.9718 133 I 4.6912 8.7064 127.4715 59.8563 40.0991 175.1571 134 C 4.7238 8.6124 124.5966 58.8801 27.4286 171.1904 135 E 4.1769 8.3391 122.6898 55.1438 30.4110 175.9793 136 R 4.7046 8.4731 124.7837 56.1244 30.8350 175.9829 137 I 4.4786 8.1105 115.8001 59.4196 41.0891 174.5112 138 F 4.9443 8.2845 121.0027 56.8354 40.4543 176.0686 139 Y 4.5901 8.3442 121.0046 55.6323 37.3947 173.7910 140 P 4.5543 0.0000 0.0000 62.0611 32.8338 177.1722 141 E 4.3311 8.4544 119.3055 56.0079 30.4360 175.8530 142 I 4.5224 8.0143 120.1575 59.1260 40.3946 174.4954 143 E 4.5912 8.4256 126.0347 54.2873 32.3433 174.1544 144 E 4.4250 8.7350 126.7254 55.0848 30.8143 175.1610 145 V 4.5628 7.8914 117.5826 59.2084 35.5462 175.5195 146 Q 4.0737 8.6703 121.2910 58.9732 29.1286 175.8709 147 A 4.6018 7.3313 116.9325 50.8943 22.0221 175.7609 148 L 4.1947 8.4458 119.8827 55.1025 41.7908 177.1841 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 24 M 8.29 4.44 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 25 Q 7.86 4.27 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 26 L 9.10 4.48 0.00 1.59 1.45 0.89 0.38 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 27 R 8.56 4.93 0.00 1.82 1.75 0.00 3.12 0.00 0.00 3.19 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 28 F 8.19 5.45 0.00 3.12 2.94 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 0.00 0.00 0.00 29 A 9.03 4.51 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.54 4.72 0.00 1.74 2.11 0.00 3.40 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.79 0.00 31 L 9.45 4.54 0.00 1.65 1.76 0.97 1.05 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 32 S 7.65 4.62 0.00 3.95 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 E 8.48 4.17 0.00 1.88 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 2.28 2.23 0.00 34 H 8.11 4.36 0.00 2.97 3.04 0.00 5.61 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 35 A 7.48 4.29 1.40 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 0.00 0.00 36 T 7.99 4.42 3.73 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 0.19 0.00 0.00 37 A 8.47 3.68 1.40 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 0.00 0.00 38 P 0.00 5.08 0.00 1.69 2.12 0.00 2.20 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 1.46 1.70 0.00 39 T 8.78 4.97 4.35 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 1.39 0.00 0.00 40 R 8.44 4.27 0.00 0.67 1.02 0.00 3.19 0.00 0.00 2.61 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.39 0.00 41 G 8.87 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 42 S 7.67 4.56 0.00 3.82 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 43 A 8.62 4.06 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 44 R 7.59 4.52 0.00 1.78 1.88 0.00 3.31 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 45 A 7.57 4.09 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.52 4.12 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 47 G 7.42 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 48 Y 8.68 4.34 0.00 2.97 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 9.50 4.82 0.00 2.39 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.61 4.80 0.00 1.53 1.55 0.91 0.63 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 51 Y 8.56 5.11 0.00 2.81 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 52 S 9.02 4.49 0.00 4.07 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 53 A 8.88 4.41 1.07 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 0.00 0.00 54 Y 7.88 4.60 0.00 2.56 2.45 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 55 D 8.44 4.92 0.00 2.46 2.53 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 56 Y 9.08 4.88 0.00 2.83 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 57 T 8.72 5.05 4.28 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 1.33 0.00 0.00 58 I 8.73 4.45 2.03 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.99 0.93 0.00 0.00 59 P 0.00 4.83 0.00 1.94 2.01 0.00 3.72 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 60 P 0.00 4.28 0.00 1.94 2.15 0.00 3.84 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 61 M 8.54 3.22 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.62 0.00 62 E 7.83 4.95 0.00 1.98 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 2.26 2.21 0.00 63 K 8.77 5.27 0.00 1.91 1.82 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.38 7.81 64 A 8.83 4.64 1.11 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 65 V 8.22 4.27 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 0.77 0.00 0.00 0.91 0.00 0.00 66 V 8.51 3.34 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 0.95 0.00 0.00 0.51 0.00 0.00 67 K 9.34 4.81 0.00 2.11 1.95 0.00 1.82 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.61 7.81 68 T 8.80 4.41 4.32 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 1.32 0.00 0.00 69 D 8.57 4.64 0.00 3.04 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 70 I 7.70 5.31 2.07 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.16 0.99 0.00 0.00 71 Q 9.22 5.34 0.00 2.13 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.13 0.00 72 I 8.40 5.16 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.85 0.98 0.00 0.00 73 A 8.98 4.63 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.55 4.47 0.00 1.61 1.65 1.04 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.39 0.00 2.09 2.01 0.00 3.61 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 2.13 2.12 0.00 76 S 8.56 4.24 0.00 3.84 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 G 10.26 4.18 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 0.00 0.00 0.00 78 C 7.60 5.40 0.00 2.95 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 79 Y 8.62 4.87 0.00 3.41 3.17 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 80 G 8.96 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 0.00 0.00 0.00 81 R 8.59 5.09 0.00 1.63 1.68 0.00 3.17 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.82 0.00 82 V 8.68 4.43 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.91 0.00 0.00 83 A 9.08 4.89 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 84 P 0.00 4.64 0.00 1.93 1.96 0.00 3.66 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 2.02 2.17 0.00 85 R 8.39 4.13 0.00 1.84 1.81 0.00 3.03 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 86 S 8.80 4.22 0.00 3.84 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 G 8.00 3.61 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 0.00 0.00 0.00 88 L 7.96 4.14 0.00 1.65 1.60 0.96 1.26 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 89 A 7.97 4.47 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 90 A 7.92 3.88 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 91 K 8.30 4.24 0.00 1.64 1.64 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.57 7.81 92 H 7.57 4.91 0.00 3.24 3.28 0.00 5.81 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 93 F 8.08 4.13 0.00 3.28 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 94 I 7.57 4.76 1.71 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 -0.24 0.61 0.00 0.00 95 D 9.00 5.33 0.00 3.05 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 96 V 8.24 4.33 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 0.74 0.00 0.00 0.81 0.00 0.00 97 G 7.93 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 0.00 0.00 0.00 98 A 9.88 3.50 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 9.01 3.87 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 0.00 0.00 0.00 100 V 7.40 4.49 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 0.47 0.00 0.00 0.82 0.00 0.00 101 I 8.84 4.29 2.09 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.55 1.01 0.00 0.00 102 D 8.69 4.81 0.00 2.72 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 E 9.30 3.97 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 104 D 8.02 4.77 0.00 2.84 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 0.00 105 Y 8.28 4.35 0.00 3.11 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.86 4.36 0.00 1.62 1.74 0.00 3.37 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.46 0.00 107 G 5.38 3.61 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 0.00 0.00 0.00 108 N 8.49 4.77 0.00 2.84 2.87 0.00 0.00 6.83 7.71 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 0.00 109 V 9.17 4.06 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 0.91 0.00 0.00 1.13 0.00 0.00 110 G 8.77 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.72 4.26 2.02 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 0.81 0.00 0.00 0.91 0.00 0.00 112 V 8.21 4.31 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 0.84 0.00 0.00 0.86 0.00 0.00 113 L 8.59 4.81 0.00 1.53 1.42 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 114 F 8.64 5.14 0.00 2.28 1.47 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 0.00 115 N 8.88 4.74 0.00 2.75 2.76 0.00 0.00 6.82 7.25 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 0.00 116 F 8.40 4.51 0.00 2.03 1.65 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 0.00 117 G 8.13 4.07 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 0.00 0.00 0.00 118 K 8.79 4.42 0.00 1.82 1.90 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.50 7.81 119 E 7.77 4.99 0.00 1.91 1.90 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 0.00 2.25 2.32 0.00 120 K 8.74 4.38 0.00 1.80 1.86 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 121 F 9.24 4.93 0.00 3.11 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 0.00 122 E 8.06 4.77 0.00 1.60 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 2.12 2.14 0.00 123 V 8.74 4.26 2.48 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 1.24 0.00 0.00 1.10 0.00 0.00 124 K 9.20 5.08 0.00 1.81 1.65 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.45 7.81 125 K 8.83 4.00 0.00 1.57 1.67 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.42 7.81 126 G 9.19 4.06 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 0.00 0.00 0.00 127 D 8.16 4.64 0.00 2.86 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 0.00 128 R 8.41 4.17 0.00 1.66 1.59 0.00 2.99 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.31 0.00 129 I 8.17 4.46 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.72 1.05 0.00 0.00 130 A 6.96 4.44 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 0.00 131 Q 8.72 4.93 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.23 0.00 132 L 9.03 5.14 0.00 1.73 1.60 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 133 I 8.71 4.69 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 1.34 0.46 0.88 0.00 0.00 134 C 8.61 4.72 0.00 2.85 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 0.00 135 E 8.34 4.18 0.00 1.16 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.86 0.00 136 R 8.47 4.70 0.00 1.58 1.74 0.00 3.14 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 137 I 8.11 4.48 1.63 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.18 nan 0.00 0.00 138 F 8.28 4.94 0.00 3.06 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 Y 8.34 4.59 0.00 3.02 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 0.00 140 P 0.00 4.55 0.00 2.20 2.06 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 141 E 8.45 4.33 0.00 1.99 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 2.33 2.25 0.00 142 I 8.01 4.52 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.88 0.92 0.00 0.00 143 E 8.43 4.59 0.00 1.90 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 2.17 2.26 0.00 144 E 8.73 4.42 0.00 1.96 1.82 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 2.24 2.32 0.00 145 V 7.89 4.56 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 0.77 0.00 0.00 0.97 0.00 0.00 146 Q 8.67 4.07 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 147 A 7.33 4.60 1.20 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 0.00 0.00 0.00 148 L 8.45 4.19 0.00 1.65 1.59 0.92 0.83 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