NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4279 8.2649 122.4702 51.8340 19.7607 176.0506 3 T 4.0036 8.2967 118.8957 63.9716 69.7838 172.5949 4 K 5.3105 9.0853 125.5950 54.7604 37.1361 174.5733 5 A 5.3849 8.9718 123.7273 50.6715 23.4510 175.0757 6 V 4.9906 8.9794 117.5119 60.9785 35.5362 173.5844 7 C 4.8601 8.9406 121.9032 58.3258 35.3468 172.8060 8 V 4.4302 8.4824 126.7800 61.6014 32.4388 174.5211 9 L 4.5067 8.7522 129.8326 54.5364 42.7677 176.6536 10 K 4.8366 9.3326 122.4135 55.6768 37.3790 175.3071 11 G 4.1618 7.9584 107.0869 46.9305 0.0000 172.8716 12 D 4.5840 9.0906 119.1582 56.4771 41.2425 176.7566 13 G 4.3590 7.5702 108.7636 43.5953 0.0000 171.6801 14 P 4.1995 0.0000 0.0000 64.6602 31.8430 176.6114 15 V 4.0741 7.0370 120.8679 63.1240 31.7716 175.1471 16 Q 4.7362 8.3933 124.8950 55.2441 32.5465 173.4265 17 G 4.1856 7.8436 106.9140 46.4905 0.0000 171.7303 18 I 5.0780 7.6308 119.6798 59.3885 40.8313 175.1231 19 I 4.6919 8.7643 127.5311 59.5019 40.3035 174.4830 20 N 4.9114 8.8997 125.0179 51.5825 40.9710 174.0380 21 F 5.3043 8.9035 119.7579 56.0061 43.5015 174.4560 22 E 4.8940 9.4299 123.3439 55.7634 32.5973 173.7013 23 Q 4.9390 8.9602 130.4086 54.3156 30.1069 176.3117 24 K 4.1003 8.8904 127.3940 58.8166 32.6626 177.8518 25 E 4.7486 7.8183 117.1549 54.0848 33.3465 176.0755 26 S 3.9999 9.0702 118.2607 61.4727 62.7060 175.0913 27 N 4.5826 8.1697 114.7973 52.6496 37.7021 174.4386 28 G 4.1146 8.2703 109.5873 43.2696 0.0000 171.2841 29 P 4.7092 0.0000 0.0000 62.4099 33.0123 175.8879 30 V 4.5576 8.9073 121.1850 61.1368 33.5177 174.8799 31 K 4.6227 8.9773 128.7318 56.2581 33.4623 176.2540 32 V 4.8767 8.8232 124.9488 60.8035 33.9102 174.2963 33 W 5.5580 9.0185 124.2010 54.7759 32.2437 175.5322 34 G 3.8017 7.2618 106.2506 46.0367 0.0000 170.6507 35 S 4.7165 7.7717 115.0566 56.9909 65.5160 174.1645 36 I 4.7205 8.5291 128.7072 59.6146 39.5935 175.0565 37 K 4.7938 8.9546 124.5138 55.8226 36.6578 176.8311 38 G 3.6757 8.8409 105.9625 45.8779 0.0000 173.2437 39 L 4.4253 7.7109 119.9240 52.8787 42.8320 176.5571 40 T 4.2279 8.3406 113.0401 61.3057 69.2292 173.7384 41 E 3.9893 8.7254 126.0925 57.6645 30.5784 175.1061 42 G 3.8596 8.5619 110.3710 43.9639 0.0000 172.5567 43 L 4.7028 8.2568 119.7589 55.0383 42.7728 176.5510 44 H 5.0937 9.4118 119.3604 53.7029 33.1613 173.4167 45 G 4.0336 8.9990 110.3508 46.9074 0.0000 172.9339 46 F 5.2791 8.4014 125.2987 57.6418 41.7792 172.5206 47 H 5.2254 9.0073 122.5928 53.7650 33.7135 172.8272 48 V 4.4083 8.6852 121.7294 62.4265 32.7549 175.3219 49 H 5.0647 9.3659 125.8708 54.7502 30.5279 176.2342 50 E 3.7701 8.9301 121.6393 59.1395 29.4609 177.0113 51 F 5.0217 7.8775 118.5174 55.9575 40.6203 176.4292 52 G 4.0539 8.5054 113.1709 44.8787 0.0000 173.0536 53 D 4.7549 8.1288 119.2863 52.4318 42.7512 174.8478 54 N 5.2645 8.4280 122.5492 52.6868 39.3328 175.4942 55 T 3.7028 8.1775 112.9897 66.5986 69.1074 175.2872 56 A 4.5973 8.6107 125.4507 51.6347 19.8835 177.8888 57 G 3.9244 7.8860 111.1823 46.8624 0.0000 175.0100 58 C 4.3670 8.6653 115.5454 60.0247 34.5125 175.6514 59 T 3.7993 7.9465 117.2581 66.8030 67.7992 176.3898 60 S 4.2399 8.0963 115.2688 61.0792 63.1802 175.9223 61 A 4.4737 7.5435 124.9488 54.1943 18.1849 178.5787 62 G 4.1480 8.1300 105.4027 44.5034 0.0000 170.6478 63 P 4.7469 0.0000 0.0000 61.9306 34.0047 175.0946 64 H 4.2000 8.6374 116.4348 55.9915 29.3749 175.5332 65 F 4.3024 9.1193 125.8675 58.1920 40.0727 174.8280 66 N 4.9765 7.9387 125.6436 51.6971 38.9606 172.7298 67 P 4.1427 0.0000 0.0000 64.8378 32.4001 177.9783 68 L 4.3079 7.6625 116.9952 53.8646 41.6874 176.3368 69 S 3.5614 7.5048 116.0702 60.4241 60.7057 172.5455 70 R 4.5510 8.1468 117.7749 54.4715 31.8675 177.6808 71 K 4.5542 7.9140 114.5394 57.0698 33.2744 177.1398 72 H 3.9194 8.8637 122.8555 56.9596 30.5965 174.5157 73 G 3.9137 7.6797 109.0446 45.8081 0.0000 172.8792 74 G 4.0587 8.6445 109.1873 43.8703 0.0000 173.3687 75 P 4.2670 0.0000 0.0000 65.4874 31.5192 178.2333 76 K 4.1209 8.0014 117.3650 58.8076 32.2954 177.4395 77 D 4.4240 7.5068 118.5375 54.4592 41.3251 176.2283 78 E 3.9530 8.8288 124.9485 59.3720 29.8332 177.6944 79 E 4.1982 7.8586 122.4079 55.6834 27.7251 175.1794 80 R 4.6999 7.6231 119.5290 53.9731 33.2764 175.0665 81 H 4.5085 8.7482 115.5586 55.1721 29.4270 177.1162 82 V 3.4375 8.3037 122.5962 66.0407 31.4193 177.2012 83 G 3.8979 8.2873 106.5345 46.0300 0.0000 173.1370 84 D 4.8146 7.7764 120.7379 54.0027 39.1525 175.8269 85 L 4.4955 8.2068 121.6090 54.0956 43.3354 178.5978 86 G 4.0909 7.8477 109.3698 46.5542 0.0000 174.7714 87 N 5.6659 8.7487 120.6829 51.2447 41.8279 173.1298 88 V 4.4389 9.0930 114.0961 59.9106 35.5647 174.7386 89 T 4.9813 8.3826 119.9904 61.9292 70.8710 173.0573 90 A 4.9801 9.2119 129.1946 50.3137 21.2228 176.0002 91 D 4.6939 9.6662 122.8926 53.2202 41.3695 179.1607 92 K 4.7782 7.9934 117.1381 59.3033 32.8673 176.5432 93 D 4.5875 7.8727 116.1632 53.6698 39.5229 177.2854 94 G 4.3758 9.3024 109.2896 44.6699 0.0000 173.2171 95 V 4.5256 7.8570 120.4396 61.6302 33.4003 174.6116 96 A 5.0761 9.2620 129.8275 49.4850 21.0684 174.9056 97 D 5.0147 8.5965 122.5095 53.9412 40.6624 176.0573 98 V 3.6138 8.3791 124.1598 62.9030 32.8754 175.2484 99 S 5.0047 8.5439 121.9895 57.5752 63.4399 172.7544 100 I 4.6570 9.0320 126.3335 59.1079 40.5248 173.9029 101 E 5.1740 8.5711 123.8487 54.7935 32.3792 174.0149 102 D 5.0175 9.1675 125.5399 52.9081 44.7752 175.8179 103 S 4.8511 8.8396 117.7832 58.7341 65.1711 176.0021 104 V 3.8144 8.1333 119.8074 65.4529 31.5737 176.4957 105 I 4.0742 7.6362 111.5091 61.1918 38.1766 174.8438 106 S 4.6572 8.1959 113.9185 57.5395 65.0816 173.9154 107 L 4.7767 8.2196 125.1078 54.1266 41.4430 176.7987 108 S 4.5084 7.8732 110.2862 58.7720 66.5813 176.0454 109 G 3.8849 8.6471 109.0507 44.4814 0.0000 173.6844 110 D 4.3428 8.8288 118.3311 57.9530 41.2025 177.9169 111 H 4.7740 8.1531 112.2181 55.8084 28.8706 174.5691 112 C 4.3138 7.9094 121.6059 59.9176 31.4947 173.4796 113 I 3.7418 8.5071 120.7429 61.3684 38.0423 175.9950 114 I 3.6962 7.2491 123.0366 62.7403 37.3409 176.2567 115 G 3.8340 9.0743 113.1528 45.1615 0.0000 172.6658 116 R 4.7426 7.4728 118.3052 54.5198 34.0292 174.7164 117 T 4.7963 7.7900 115.7859 62.4451 70.3462 174.5930 118 L 4.6951 8.6237 128.5279 54.5972 44.3218 175.7026 119 V 4.9555 8.4529 124.2004 61.6835 35.1121 173.7591 120 V 5.0778 8.8482 127.8941 60.9185 33.6735 174.7341 121 H 5.1248 8.6254 119.2783 53.9503 31.5213 173.5248 122 E 4.0455 9.3316 121.3413 59.0785 29.3848 178.2936 123 K 4.5832 8.8093 118.0848 54.6946 35.3028 175.1169 124 A 4.4980 8.2762 122.9091 51.7096 19.1319 176.2751 125 D 4.8261 9.5723 121.9873 53.9694 41.7843 176.6525 126 D 4.6958 9.2276 125.6340 53.1587 39.5611 176.4902 127 L 3.4527 8.6832 117.2095 56.1121 39.6465 175.9680 128 G 4.3089 9.0067 106.3292 45.8626 0.0000 174.8109 129 K 4.4786 7.7437 118.2093 56.5219 32.1506 178.3086 130 G 3.7034 7.3206 110.5375 45.8811 0.0000 175.0508 131 G 4.0735 8.4149 107.5385 45.2663 0.0000 173.3180 132 N 4.6980 7.5522 115.6666 51.5157 39.0235 175.3421 133 E 4.0392 8.7572 117.9639 59.6175 29.6166 178.2803 134 E 3.9784 8.1610 118.6156 59.0797 29.8689 178.4049 135 S 4.1242 9.2218 113.8236 61.2334 62.3754 175.6563 136 T 4.1864 7.8811 117.1615 65.1064 67.9820 174.8689 137 K 4.3540 7.9298 118.0497 57.2559 34.4325 177.2479 138 T 3.8400 7.6472 108.4562 61.2545 70.0129 175.9422 139 G 4.2769 7.8337 109.4078 45.8918 0.0000 173.2292 140 N 4.3338 7.8447 113.4248 54.0166 36.8507 174.9229 141 A 4.6135 7.3939 118.5356 51.6252 19.4810 179.7776 142 G 3.6622 7.9853 103.9333 44.5831 0.0000 173.0985 143 S 4.4044 8.5529 114.8791 58.5212 64.9115 173.8853 144 R 4.4408 8.2513 119.2676 55.0504 29.6547 176.8623 145 L 4.2587 8.5956 124.8557 57.2393 42.7240 177.2654 146 A 4.9873 7.7619 119.1163 50.8297 23.0239 173.4644 147 C 5.1733 9.4447 114.7070 54.8858 47.2086 172.7228 148 G 4.6010 8.4074 103.4258 46.1225 0.0000 172.8891 149 V 4.3950 8.3264 121.8623 62.2806 32.7557 175.5555 150 I 4.0100 9.1627 129.7155 61.0065 38.1731 175.2967 151 G 4.5000 9.1574 114.0445 43.9533 0.0000 171.9876 152 I 4.3631 8.3561 121.9962 61.0478 37.6351 175.4337 153 A 4.8209 8.3245 128.0812 49.6446 22.1423 176.1662 154 Q 4.0699 8.5049 118.7337 56.4478 29.2154 175.9787 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 A 8.26 4.43 1.31 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 3 T 8.30 4.00 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 1.22 0.00 0.00 4 K 9.09 5.31 0.00 1.71 1.73 0.00 1.87 0.00 0.00 1.98 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.66 7.81 5 A 8.97 5.38 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 6 V 8.98 4.99 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 0.72 0.00 0.00 0.91 0.00 0.00 7 C 8.94 4.86 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 8 V 8.48 4.43 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 0.93 0.00 0.00 0.92 0.00 0.00 9 L 8.75 4.51 0.00 1.79 1.60 1.04 0.60 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 10 K 9.33 4.84 0.00 1.60 1.63 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.39 7.81 11 G 7.96 4.16 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 0.00 12 D 9.09 4.58 0.00 2.68 2.75 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 13 G 7.57 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 0.00 0.00 0.00 0.00 14 P 0.00 4.20 0.00 2.18 2.19 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 15 V 7.04 4.07 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 0.79 0.00 0.00 0.97 0.00 0.00 16 Q 8.39 4.74 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.55 0.00 0.00 0.00 0.00 0.00 2.44 2.30 0.00 17 G 7.84 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 0.00 0.00 0.00 0.00 18 I 7.63 5.08 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.18 0.79 0.00 0.00 19 I 8.76 4.69 1.88 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 1.24 1.47 0.60 0.00 0.00 20 N 8.90 4.91 0.00 1.44 1.42 0.00 0.00 6.41 8.01 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 21 F 8.90 5.30 0.00 2.95 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 22 E 9.43 4.89 0.00 2.46 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 0.00 2.32 2.40 0.00 23 Q 8.96 4.94 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 24 K 8.89 4.10 0.00 1.81 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.47 1.48 7.81 25 E 7.82 4.75 0.00 1.97 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 2.30 2.29 0.00 26 S 9.07 4.00 0.00 3.98 4.04 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 27 N 8.17 4.58 0.00 2.85 2.97 0.00 0.00 5.85 7.00 0.00 0.00 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 G 8.27 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 29 P 0.00 4.71 0.00 2.13 2.09 0.00 3.76 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 30 V 8.91 4.56 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 1.24 0.00 0.00 1.09 0.00 0.00 31 K 8.98 4.62 0.00 1.90 1.81 0.00 1.55 0.00 0.00 1.47 0.00 0.00 2.77 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.49 1.42 7.81 32 V 8.82 4.88 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 0.70 0.00 0.00 1.05 0.00 0.00 33 W 9.02 5.56 0.00 3.50 3.16 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 34 G 7.26 3.80 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 0.00 0.00 0.00 35 S 7.77 4.72 0.00 3.88 3.65 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 36 I 8.53 4.72 1.77 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.66 0.86 0.00 0.00 37 K 8.95 4.79 0.00 1.70 1.84 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.28 1.40 7.81 38 G 8.84 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 39 L 7.71 4.43 0.00 1.91 1.52 0.81 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.34 4.23 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 1.27 0.00 0.00 41 E 8.73 3.99 0.00 1.95 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 2.30 2.46 0.00 42 G 8.56 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 43 L 8.26 4.70 0.00 1.50 1.59 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 44 H 9.41 5.09 0.00 3.07 3.16 0.00 5.62 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 45 G 9.00 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 0.00 0.00 0.00 46 F 8.40 5.28 0.00 3.02 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 47 H 9.01 5.23 0.00 3.00 3.03 0.00 5.85 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.69 4.41 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 0.95 0.00 0.00 0.90 0.00 0.00 49 H 9.37 5.06 0.00 3.05 3.43 0.00 5.69 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.93 3.77 0.00 1.63 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 1.47 2.09 0.00 51 F 7.88 5.02 0.00 3.28 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 52 G 8.51 4.05 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 0.00 53 D 8.13 4.75 0.00 2.62 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 54 N 8.43 5.26 0.00 2.79 2.69 0.00 0.00 7.65 7.22 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 55 T 8.18 3.70 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 1.19 0.00 0.00 56 A 8.61 4.60 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 57 G 7.89 3.92 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 0.00 0.00 0.00 58 C 8.67 4.37 0.00 2.96 3.10 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 0.00 0.00 0.00 0.00 59 T 7.95 3.80 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 1.23 0.00 0.00 60 S 8.10 4.24 0.00 4.02 4.04 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 61 A 7.54 4.47 1.41 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 0.00 0.00 62 G 8.13 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 0.00 0.00 0.00 63 P 0.00 4.75 0.00 2.07 2.23 0.00 3.62 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 1.97 1.99 0.00 64 H 8.64 4.20 0.00 2.85 3.22 0.00 5.72 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 65 F 9.12 4.30 0.00 2.85 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 66 N 7.94 4.98 0.00 2.56 2.42 0.00 0.00 6.94 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 67 P 0.00 4.14 0.00 2.07 1.94 0.00 3.14 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 1.57 1.17 0.00 68 L 7.66 4.31 0.00 1.56 1.67 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.50 3.56 0.00 3.93 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 70 R 8.15 4.55 0.00 1.81 1.73 0.00 3.26 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.44 0.00 71 K 7.91 4.55 0.00 1.57 1.73 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.51 7.81 72 H 8.86 3.92 0.00 3.08 3.12 0.00 5.98 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 73 G 7.68 3.91 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 0.00 0.00 0.00 74 G 8.64 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 75 P 0.00 4.27 0.00 2.22 2.34 0.00 3.79 0.00 0.00 3.69 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 76 K 8.00 4.12 0.00 1.77 1.92 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 77 D 7.51 4.42 0.00 2.81 2.58 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 78 E 8.83 3.95 0.00 1.92 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 2.27 2.28 0.00 79 E 7.86 4.20 0.00 1.92 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 2.26 2.31 0.00 80 R 7.62 4.70 0.00 1.82 1.89 0.00 3.35 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.59 0.00 81 H 8.75 4.51 0.00 3.54 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.30 3.44 1.48 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 0.66 0.00 0.00 0.52 0.00 0.00 83 G 8.29 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 84 D 7.78 4.81 0.00 2.84 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 85 L 8.21 4.50 0.00 1.87 1.79 0.87 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.85 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 0.00 0.00 0.00 0.00 87 N 8.75 5.67 0.00 2.61 2.72 0.00 0.00 6.54 7.68 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 88 V 9.09 4.44 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 -0.18 0.00 0.00 0.80 0.00 0.00 89 T 8.38 4.98 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 1.20 0.00 0.00 90 A 9.21 4.98 1.31 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 91 D 9.67 4.69 0.00 2.72 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 92 K 7.99 4.78 0.00 1.79 1.84 0.00 1.76 0.00 0.00 1.91 0.00 0.00 3.05 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.43 1.43 7.81 93 D 7.87 4.59 0.00 2.76 2.75 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 94 G 9.30 4.38 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 95 V 7.86 4.53 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 0.92 0.00 0.00 0.92 0.00 0.00 96 A 9.26 5.08 1.14 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 97 D 8.60 5.01 0.00 2.56 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 98 V 8.38 3.61 1.98 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 0.77 0.00 0.00 0.66 0.00 0.00 99 S 8.54 5.00 0.00 3.92 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 0.00 100 I 9.03 4.66 1.99 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 1.18 0.93 1.00 0.00 0.00 101 E 8.57 5.17 0.00 1.94 1.80 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 2.21 2.33 0.00 102 D 9.17 5.02 0.00 2.88 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 0.00 103 S 8.84 4.85 0.00 3.89 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 0.00 104 V 8.13 3.81 2.20 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 0.77 0.00 0.00 0.94 0.00 0.00 105 I 7.64 4.07 1.96 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 0.82 1.03 0.00 0.00 106 S 8.20 4.66 0.00 3.89 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.22 4.78 0.00 1.81 1.64 1.03 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.87 4.51 0.00 3.96 3.78 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 0.00 109 G 8.65 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 0.00 0.00 0.00 110 D 8.83 4.34 0.00 2.66 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 0.00 111 H 8.15 4.77 0.00 3.21 3.38 0.00 5.78 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 0.00 112 C 7.91 4.31 0.00 3.22 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 I 8.51 3.74 1.64 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.19 1.00 0.00 0.00 114 I 7.25 3.70 1.77 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 1.19 0.37 0.83 0.00 0.00 115 G 9.07 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 0.00 116 R 7.47 4.74 0.00 1.60 1.84 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.30 0.00 117 T 7.79 4.80 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 1.20 0.00 0.00 118 L 8.62 4.70 0.00 1.83 1.56 0.56 0.73 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 0.00 119 V 8.45 4.96 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 0.87 0.00 0.00 0.76 0.00 0.00 120 V 8.85 5.08 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 0.77 0.00 0.00 1.01 0.00 0.00 121 H 8.63 5.12 0.00 3.23 3.54 0.00 5.66 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 0.00 122 E 9.33 4.05 0.00 2.07 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 2.37 2.34 0.00 123 K 8.81 4.58 0.00 1.75 1.76 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.42 7.81 124 A 8.28 4.50 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 0.00 125 D 9.57 4.83 0.00 2.85 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 0.00 126 D 9.23 4.70 0.00 2.95 2.90 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 0.00 0.00 0.00 127 L 8.68 3.45 0.00 1.85 1.78 0.94 0.96 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 0.00 128 G 9.01 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 0.00 129 K 7.74 4.48 0.00 1.80 1.83 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.51 7.81 130 G 7.32 3.70 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 0.00 131 G 8.41 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 0.00 132 N 7.55 4.70 0.00 2.84 2.86 0.00 0.00 5.96 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 0.00 133 E 8.76 4.04 0.00 2.10 1.98 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 2.37 2.43 0.00 134 E 8.16 3.98 0.00 2.11 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 2.37 2.40 0.00 135 S 9.22 4.12 0.00 4.17 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 0.00 136 T 7.88 4.19 4.45 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 1.20 0.00 0.00 137 K 7.93 4.35 0.00 1.81 1.71 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.32 7.81 138 T 7.65 3.84 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 1.23 0.00 0.00 139 G 7.83 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 0.00 0.00 0.00 0.00 140 N 7.84 4.33 0.00 3.06 2.90 0.00 0.00 6.85 6.62 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 0.00 141 A 7.39 4.61 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 0.00 142 G 7.99 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 0.00 0.00 0.00 143 S 8.55 4.40 0.00 3.94 4.05 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 0.00 144 R 8.25 4.44 0.00 1.67 1.86 0.00 3.18 0.00 0.00 3.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.59 0.00 145 L 8.60 4.26 0.00 1.57 1.69 0.97 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.76 4.99 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 0.00 147 C 9.44 5.17 0.00 3.08 3.14 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 0.00 148 G 8.41 4.60 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 0.00 0.00 0.00 149 V 8.33 4.40 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 0.77 0.00 0.00 0.95 0.00 0.00 150 I 9.16 4.01 1.73 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.62 0.48 0.00 0.00 151 G 9.16 4.50 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 0.00 152 I 8.36 4.36 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.91 0.00 0.00 153 A 8.32 4.82 1.21 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 0.00 0.00 154 Q 8.50 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00