NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.2949 8.3049 120.3456 53.9660 34.0593 175.0896 3 L 4.9551 7.8730 122.8944 55.0467 44.2255 171.5211 4 T 3.7572 8.0431 123.5755 63.5451 69.0339 175.9761 5 A 4.4904 8.5053 132.7677 52.1415 17.8534 177.5499 6 E 4.5054 9.2648 123.4251 58.5994 31.8315 177.3805 7 E 3.9560 7.9676 118.1630 58.8986 29.5101 178.9178 8 K 3.9295 7.8787 118.5841 59.7651 32.5568 178.3460 9 A 4.0246 8.0056 120.2048 55.1272 18.5604 179.3369 10 A 4.2329 8.1913 119.3647 54.9637 18.3670 180.1841 11 V 3.7464 8.1899 117.3846 66.5182 31.8427 178.4577 12 T 4.1738 8.1553 115.6339 66.6667 68.0939 176.6658 13 G 3.8945 8.4562 106.8289 47.9766 0.0000 175.2041 14 F 4.3301 8.4062 122.5477 60.9685 39.6183 176.9049 15 W 4.8764 9.3129 128.5883 60.9259 30.2197 177.4108 16 G 3.8945 8.0811 102.4152 45.4962 0.0000 173.8307 17 K 4.3321 7.4736 118.6097 56.0556 33.2055 176.0709 18 V 3.6538 7.0355 120.4941 62.4940 31.9826 178.0627 19 K 4.2690 8.2746 128.0547 55.4395 28.9340 177.5330 20 V 3.4342 7.7057 123.8394 64.6189 31.3335 178.1057 21 D 4.3811 7.9238 119.3429 56.0377 39.7610 178.3171 22 E 3.9333 8.0139 118.6751 59.0244 29.8374 179.1342 23 V 3.5008 8.0261 119.5196 65.4342 31.3109 178.3073 24 G 3.5570 8.1508 105.3732 47.8216 0.0000 175.6033 25 A 4.0109 8.2485 124.1925 54.5633 18.2889 179.4343 26 E 3.7785 8.1483 117.4948 59.2565 29.7008 178.5862 27 A 3.9441 7.7338 120.6366 55.2540 18.5434 179.4145 28 L 3.9123 7.8828 118.1865 58.1486 42.1554 179.0580 29 G 3.6275 7.9924 105.6772 47.9883 0.0000 175.7057 30 R 3.8694 8.6399 121.3288 58.7172 29.9764 178.7817 31 L 4.0240 8.0132 120.2267 58.4005 41.7298 179.1670 32 L 3.9066 7.7676 117.8606 56.8508 41.2017 179.5394 33 V 3.6401 6.9624 117.9265 65.6008 31.8908 177.9263 34 V 3.6846 7.6706 116.3403 63.9844 32.2595 175.4075 35 Y 4.1753 7.5779 116.3965 54.1040 38.5387 173.8053 36 P 4.4565 0.0000 0.0000 64.5590 31.7288 178.3345 37 W 3.8022 7.9666 116.1911 59.1994 27.9095 177.8358 38 T 4.3418 6.9489 110.6893 64.1531 68.2077 176.2684 39 Q 4.2158 8.9561 122.4870 58.6542 28.4014 178.2799 40 R 3.8275 7.6763 118.8816 58.9807 30.0601 177.5085 41 F 4.3974 7.6478 114.8693 57.7086 39.3307 176.1311 42 F 4.5960 8.0175 117.4296 57.1954 40.9355 175.8219 43 E 4.3541 8.3474 119.0833 57.8023 29.9047 177.4059 44 H 4.6961 8.2362 114.3259 57.0694 29.0855 176.0041 45 F 4.5231 8.0627 118.8809 58.3148 39.4718 174.6400 46 G 3.7901 7.5720 104.1676 43.6886 0.0000 172.1155 47 D 4.3760 8.7349 120.6510 55.2125 40.9584 177.2563 48 L 4.8710 8.1908 128.5560 54.5587 42.7559 178.6298 49 S 4.2821 8.0416 117.2764 61.1529 63.1660 174.6965 50 N 5.0290 7.7139 115.6241 49.9510 41.5394 174.6755 51 A 3.9622 8.6241 121.7706 55.6983 18.0759 179.6883 52 D 4.1820 8.0124 116.1411 57.6094 40.9432 178.3626 53 A 3.9444 8.0908 119.2877 55.5406 18.2765 179.4428 54 V 3.7290 7.6863 115.8407 66.3776 31.5017 178.3199 55 M 4.1124 7.7616 116.6624 57.6425 31.9487 176.8841 56 N 4.5878 8.1494 114.3748 53.3396 39.7139 175.1025 57 N 4.4041 7.7292 118.2837 52.7333 39.6431 173.1603 58 P 4.1956 0.0000 0.0000 65.7883 31.3219 178.7266 59 K 3.6844 7.8686 115.4551 59.8205 32.1219 178.5725 60 V 3.8043 8.2627 118.7697 64.8311 30.7626 178.0167 61 K 3.9683 8.3578 117.1677 59.6842 31.8492 178.7857 62 A 3.9945 8.4833 121.1097 55.4715 18.2538 179.1840 63 H 4.5785 8.7388 117.1816 59.2433 30.0349 177.7062 64 G 3.8147 8.1401 108.3037 46.9369 0.0000 175.3706 65 K 3.9994 7.8115 121.1589 59.4017 32.1383 179.1007 66 K 4.1032 7.5713 119.3186 59.1802 31.8165 179.5939 67 V 3.7236 7.8903 118.8395 65.8249 31.5232 177.7350 68 L 4.4593 8.3549 117.8895 56.5528 41.5515 179.0072 69 D 4.4877 8.0560 119.8765 57.4854 40.6535 178.6851 70 S 4.2193 7.9015 112.6690 60.8807 63.4877 175.9037 71 F 4.2732 8.3566 124.9655 61.1371 39.0420 176.7500 72 S 4.5187 8.4948 113.1801 61.7111 61.6385 175.6332 73 N 4.6980 8.6641 118.4115 54.4392 36.9395 176.9949 74 G 3.6668 7.8374 108.6139 47.8642 0.0000 175.8626 75 M 3.9876 7.8122 120.6348 58.0362 32.0613 178.2119 76 K 4.2911 7.3822 116.0825 57.1112 33.7913 176.9351 77 H 4.8849 7.4982 114.1839 54.1782 28.9786 173.1004 78 L 4.2132 7.7131 120.5319 56.7619 42.6190 178.5788 79 D 4.4448 7.9911 116.8089 54.7399 40.0484 175.7535 80 D 4.8288 7.5395 118.4030 52.9728 43.0418 173.6814 81 L 4.4570 8.5178 129.3899 56.5398 49.0241 176.9995 82 K 4.0459 7.7716 118.1189 59.2141 32.2408 178.5494 83 G 3.7690 7.7298 106.1096 47.3405 0.0000 175.2257 84 T 3.7428 7.7721 115.8089 65.7949 68.6784 175.0223 85 F 4.5416 8.3558 118.7645 58.2021 40.1963 178.5846 86 A 3.8927 7.6343 124.4960 54.6980 18.4324 179.1795 87 Q 4.2794 7.9977 113.0959 57.6869 29.2887 177.4304 88 L 4.1974 8.1800 121.0705 56.7697 41.7442 179.0885 89 S 4.1370 8.1043 113.4211 61.4353 62.6578 175.1489 90 E 3.8699 7.7802 121.9564 59.7258 29.2867 178.5457 91 L 3.9688 7.7099 120.1701 58.3593 42.1122 178.4899 92 H 4.2044 8.5727 115.6802 59.0357 28.7446 177.0423 93 C 4.7723 8.5701 115.0210 60.3032 28.3764 173.7235 94 D 4.8961 8.2209 117.7746 53.9187 43.1795 176.2038 95 K 4.3444 8.4318 117.0846 58.0199 33.1791 177.6350 96 L 4.1713 7.8940 116.3257 55.5968 42.6444 176.1383 97 H 4.0744 8.7678 113.5007 56.3502 25.4294 175.0409 98 V 4.0395 7.2752 117.7928 61.0541 33.3026 174.6335 99 D 4.3392 8.4426 126.7904 53.1259 41.9099 174.9452 100 P 3.3791 0.0000 0.0000 65.9737 30.8043 177.9288 101 E 3.8892 8.1257 118.5970 59.2458 29.3254 178.2103 102 N 4.4933 7.8573 115.7443 55.2187 38.7033 177.3983 103 F 4.4853 7.5170 120.0084 60.5000 38.8975 177.5676 104 R 3.9996 8.0005 118.0055 59.2794 30.0460 178.4097 105 L 3.8699 7.7728 118.8181 57.7121 41.6156 179.2803 106 L 4.1247 8.4300 120.8514 58.0459 42.1538 179.2125 107 G 3.7710 8.3319 105.8111 47.9199 0.0000 175.4203 108 N 4.5361 8.5891 118.7817 55.5690 38.5455 177.9200 109 V 3.5837 7.7509 119.9794 65.7759 31.6381 177.3778 110 L 3.8135 8.3223 120.6119 58.4544 41.7841 179.1410 111 V 3.4305 7.6078 117.2550 66.1470 31.4892 178.1751 112 V 3.5189 7.5067 117.9398 65.7434 31.2005 178.2332 113 V 3.4423 7.7773 118.1557 65.7080 31.3206 177.7296 114 L 3.6884 7.6852 118.6115 57.8642 41.4662 179.4092 115 A 3.6815 7.0282 120.2049 55.0723 18.0303 179.6232 116 R 3.8085 7.5311 116.0361 59.7540 30.1966 178.3105 117 H 4.1992 8.1980 115.0629 58.8128 29.0139 176.9437 118 H 4.9475 8.3747 116.4641 54.3793 29.4168 176.4918 119 G 3.8865 8.3699 112.6406 46.8282 0.0000 175.7580 120 N 4.7059 8.8440 122.6040 53.8206 38.4864 175.6271 121 E 4.1972 8.3324 119.7881 59.4697 29.9212 178.1389 122 F 4.3017 8.0265 121.9217 57.6195 37.4337 175.1852 123 T 4.2342 7.3942 115.2710 60.0250 71.3078 173.5606 124 P 4.1199 0.0000 0.0000 66.7029 31.6344 178.2241 125 V 3.4818 7.8628 115.9817 65.7735 31.2765 177.1330 126 L 3.7576 7.6617 119.4303 58.3247 41.9555 179.5487 127 Q 3.5458 7.6936 119.1082 58.9076 29.0936 177.8721 128 A 3.9922 7.8495 121.7500 55.3628 17.9910 179.1520 129 D 4.2917 8.0507 116.6361 57.8603 41.0056 179.1803 130 F 3.8650 8.3217 117.8741 60.3319 38.8364 177.8944 131 Q 4.1227 8.8196 118.4340 58.9693 28.5409 178.5475 132 K 3.9276 7.9078 119.0338 59.5718 32.0222 179.4666 133 V 3.3983 7.3501 117.6814 66.0574 31.5347 178.5055 134 V 3.7948 7.9865 111.8367 64.5062 31.3907 178.1462 135 A 4.1596 8.5761 121.0471 55.4965 18.0861 180.0311 136 G 3.4296 7.9874 103.8895 47.8203 0.0000 176.2200 137 V 3.0052 8.0489 121.0153 65.2477 31.5306 177.9230 138 A 3.9459 8.3591 120.8065 55.4573 18.0953 179.3949 139 N 4.3444 8.2276 113.5466 56.4408 38.6471 177.2420 140 A 4.1936 7.7429 121.3322 54.5709 18.5375 179.5848 141 L 3.8703 7.5029 116.8570 57.4289 43.0765 178.6772 142 A 4.6312 7.6606 120.3855 52.3809 16.6743 175.9028 143 H 4.5953 8.0514 124.5001 57.2490 31.6433 176.8349 144 K 3.8698 8.2264 117.5323 58.6744 32.5669 176.2441 145 Y 4.3339 7.6149 112.0034 58.8580 40.1409 175.3207 146 H 4.5300 8.8528 124.2151 56.6728 28.8320 175.4830 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 2 M 8.30 4.29 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 3 L 7.87 4.96 0.00 1.76 1.59 0.88 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.04 3.76 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 1.24 0.00 0.00 5 A 8.51 4.49 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 6 E 9.26 4.51 0.00 1.81 1.88 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 2.19 2.24 0.00 7 E 7.97 3.96 0.00 2.14 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 2.65 2.35 0.00 8 K 7.88 3.93 0.00 1.79 1.81 0.00 1.69 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.52 7.81 9 A 8.01 4.02 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 10 A 8.19 4.23 1.43 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 11 V 8.19 3.75 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 0.58 0.00 0.00 0.89 0.00 0.00 12 T 8.16 4.17 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 1.32 0.00 0.00 13 G 8.46 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 14 F 8.41 4.33 0.00 3.52 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.31 4.88 0.00 3.81 3.42 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 16 G 8.08 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 17 K 7.47 4.33 0.00 1.67 1.71 0.00 1.30 0.00 0.00 1.44 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.94 0.77 7.81 18 V 7.04 3.65 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 0.37 0.00 0.00 0.72 0.00 0.00 19 K 8.27 4.27 0.00 1.80 1.69 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.44 7.81 20 V 7.71 3.43 1.86 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 0.91 0.00 0.00 0.81 0.00 0.00 21 D 7.92 4.38 0.00 2.96 2.95 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 22 E 8.01 3.93 0.00 2.24 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 2.33 2.34 0.00 23 V 8.03 3.50 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 0.91 0.00 0.00 0.72 0.00 0.00 24 G 8.15 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.25 4.01 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 26 E 8.15 3.78 0.00 2.17 1.89 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 2.26 2.30 0.00 27 A 7.73 3.94 1.36 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 28 L 7.88 3.91 0.00 1.82 1.64 0.72 0.85 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 29 G 7.99 3.63 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 0.00 0.00 0.00 30 R 8.64 3.87 0.00 2.02 1.94 0.00 3.09 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 31 L 8.01 4.02 0.00 1.76 1.80 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.77 3.91 0.00 1.81 1.65 0.70 0.43 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 33 V 6.96 3.64 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 0.71 0.00 0.00 0.94 0.00 0.00 34 V 7.67 3.68 1.54 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 0.21 0.00 0.00 0.75 0.00 0.00 35 Y 7.58 4.18 0.00 2.56 1.43 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 36 P 0.00 4.46 0.00 2.31 2.29 0.00 3.85 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.92 0.00 37 W 7.97 3.80 0.00 3.67 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 38 T 6.95 4.34 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 0.91 0.00 0.00 39 Q 8.96 4.22 0.00 2.34 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 40 R 7.68 3.83 0.00 1.69 1.68 0.00 3.08 0.00 0.00 2.81 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.45 0.00 41 F 7.65 4.40 0.00 2.34 2.32 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 42 F 8.02 4.60 0.00 2.90 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.35 4.35 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.30 0.00 44 H 8.24 4.70 0.00 3.40 3.49 0.00 5.54 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 45 F 8.06 4.52 0.00 3.29 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 46 G 7.57 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 0.00 0.00 0.00 47 D 8.73 4.38 0.00 2.65 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 48 L 8.19 4.87 0.00 1.67 1.64 1.08 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.04 4.28 0.00 3.90 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 50 N 7.71 5.03 0.00 2.84 2.87 0.00 0.00 6.10 7.88 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 51 A 8.62 3.96 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 52 D 8.01 4.18 0.00 2.69 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 53 A 8.09 3.94 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.69 3.73 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.93 0.00 0.00 55 M 7.76 4.11 0.00 2.00 2.09 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 2.61 2.83 0.00 56 N 8.15 4.59 0.00 2.68 2.84 0.00 0.00 6.94 8.24 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 57 N 7.73 4.40 0.00 2.95 2.85 0.00 0.00 7.07 8.24 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 58 P 0.00 4.20 0.00 2.12 2.04 0.00 3.61 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 2.08 2.15 0.00 59 K 7.87 3.68 0.00 1.33 0.74 0.00 1.65 0.00 0.00 1.51 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.10 1.27 7.81 60 V 8.26 3.80 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.18 0.00 0.00 61 K 8.36 3.97 0.00 1.99 1.85 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.49 7.81 62 A 8.48 3.99 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 63 H 8.74 4.58 0.00 3.55 3.73 0.00 5.79 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 64 G 8.14 3.81 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 0.00 0.00 0.00 65 K 7.81 4.00 0.00 1.88 2.02 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.49 7.81 66 K 7.57 4.10 0.00 2.15 1.87 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.62 7.81 67 V 7.89 3.72 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 1.14 0.00 0.00 1.01 0.00 0.00 68 L 8.35 4.46 0.00 1.95 1.92 0.95 1.62 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 69 D 8.06 4.49 0.00 3.07 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 70 S 7.90 4.22 0.00 4.11 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 71 F 8.36 4.27 0.00 3.43 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 72 S 8.49 4.52 0.00 4.58 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 0.00 73 N 8.66 4.70 0.00 3.02 3.08 0.00 0.00 7.01 8.46 0.00 0.00 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 G 7.84 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 0.00 0.00 0.00 75 M 7.81 3.99 0.00 1.75 2.13 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 2.46 0.00 76 K 7.38 4.29 0.00 1.95 1.76 0.00 1.65 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.53 7.81 77 H 7.50 4.88 0.00 2.99 3.13 0.00 5.65 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 78 L 7.71 4.21 0.00 1.57 1.65 0.81 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.99 4.44 0.00 2.74 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 80 D 7.54 4.83 0.00 2.61 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.52 4.46 0.00 1.70 1.56 1.01 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 82 K 7.77 4.05 0.00 1.81 1.72 0.00 1.69 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.48 7.81 83 G 7.73 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 84 T 7.77 3.74 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 0.49 0.00 0.00 85 F 8.36 4.54 0.00 3.11 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 86 A 7.63 3.89 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 87 Q 8.00 4.28 0.00 2.25 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.88 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 88 L 8.18 4.20 0.00 2.02 1.88 1.07 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.10 4.14 0.00 3.96 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 90 E 7.78 3.87 0.00 2.13 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 2.33 2.43 0.00 91 L 7.71 3.97 0.00 1.85 1.71 0.92 1.20 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 92 H 8.57 4.20 0.00 3.47 3.62 0.00 5.85 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 93 C 8.57 4.77 0.00 3.34 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 94 D 8.22 4.90 0.00 2.84 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 95 K 8.43 4.34 0.00 1.94 1.83 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.54 7.81 96 L 7.89 4.17 0.00 1.78 1.69 0.83 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.77 4.07 0.00 3.32 3.50 0.00 5.84 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.28 4.04 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 0.36 0.00 0.00 0.36 0.00 0.00 99 D 8.44 4.34 0.00 2.66 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 0.00 100 P 0.00 3.38 0.00 2.28 2.38 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 101 E 8.13 3.89 0.00 2.16 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 2.27 2.39 0.00 102 N 7.86 4.49 0.00 2.59 2.82 0.00 0.00 6.91 8.27 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 0.00 103 F 7.52 4.49 0.00 3.14 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 0.00 104 R 8.00 4.00 0.00 1.92 2.09 0.00 3.20 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 105 L 7.77 3.87 0.00 1.81 1.36 0.35 0.30 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 0.00 106 L 8.43 4.12 0.00 1.79 1.84 0.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.33 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 0.00 108 N 8.59 4.54 0.00 2.90 2.94 0.00 0.00 6.63 8.24 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 0.00 109 V 7.75 3.58 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 1.03 0.00 0.00 1.14 0.00 0.00 110 L 8.32 3.81 0.00 1.74 1.81 0.85 0.33 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 0.00 111 V 7.61 3.43 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 1.06 0.00 0.00 1.13 0.00 0.00 112 V 7.51 3.52 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 0.89 0.00 0.00 0.99 0.00 0.00 113 V 7.78 3.44 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 0.88 0.00 0.00 0.85 0.00 0.00 114 L 7.69 3.69 0.00 1.01 1.01 0.42 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.03 3.68 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 0.00 0.00 116 R 7.53 3.81 0.00 1.90 2.05 0.00 3.24 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 1.61 1.64 0.00 117 H 8.20 4.20 0.00 3.09 2.96 0.00 5.71 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 H 8.37 4.95 0.00 3.49 3.51 0.00 5.75 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 0.00 119 G 8.37 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 0.00 120 N 8.84 4.71 0.00 2.77 2.91 0.00 0.00 6.79 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.33 4.20 0.00 2.47 2.36 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 2.49 2.34 0.00 122 F 8.03 4.30 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.39 4.23 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 1.31 0.00 0.00 124 P 0.00 4.12 0.00 2.01 2.18 0.00 3.67 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 125 V 7.86 3.48 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 1.00 0.00 0.00 0.90 0.00 0.00 126 L 7.66 3.76 0.00 1.49 1.34 0.94 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.69 3.55 0.00 1.73 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.54 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 128 A 7.85 3.99 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 0.00 129 D 8.05 4.29 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 0.00 130 F 8.32 3.87 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 0.00 131 Q 8.82 4.12 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.69 2.61 0.00 132 K 7.91 3.93 0.00 1.91 1.85 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.46 1.72 7.81 133 V 7.35 3.40 1.89 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 0.86 0.00 0.00 0.65 0.00 0.00 134 V 7.99 3.79 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 1.00 0.00 0.00 1.13 0.00 0.00 135 A 8.58 4.16 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 0.00 136 G 7.99 3.43 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 0.00 137 V 8.05 3.01 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 0.16 0.00 0.00 0.16 0.00 0.00 138 A 8.36 3.95 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 0.00 139 N 8.23 4.34 0.00 2.71 2.92 0.00 0.00 7.11 7.58 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 0.00 140 A 7.74 4.19 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 0.00 141 L 7.50 3.87 0.00 1.10 0.64 0.22 -0.35 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 0.00 142 A 7.66 4.63 1.51 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 0.00 0.00 143 H 8.05 4.60 0.00 3.44 3.31 0.00 5.90 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.23 3.87 0.00 1.78 1.85 0.00 1.65 0.00 0.00 1.86 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.40 7.81 145 Y 7.61 4.33 0.00 2.88 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 0.00 146 H 8.85 4.53 0.00 3.19 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00