NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4449 8.3349 115.4138 57.7484 64.3583 173.0734 2 L 4.1697 8.2609 122.2181 52.8395 42.3601 176.6087 3 S 4.5940 10.0279 120.7532 57.4531 67.1429 174.6187 4 D 4.3405 8.4244 120.2732 57.3053 40.5004 178.6277 5 K 3.8911 7.9986 119.7328 59.6209 32.2385 178.2126 6 D 4.7022 8.0028 120.3442 56.7719 40.7742 179.1058 7 K 3.8480 7.9908 118.4996 59.3019 32.1023 179.2327 8 A 3.9253 8.4164 121.1278 55.2979 18.3211 178.9759 9 A 3.8519 7.9934 119.0671 55.8038 18.3371 179.8624 10 V 3.4362 8.3675 115.8715 66.1219 31.5630 178.7186 11 R 3.8692 8.0586 117.4446 59.0515 29.6866 178.8871 12 A 3.9583 8.2427 119.7245 55.0085 18.6467 178.9824 13 L 3.9694 7.9614 118.8328 58.2789 42.1145 178.8369 14 W 3.9789 8.3594 128.1822 60.5966 30.3063 177.5317 15 S 4.0415 7.9762 112.0196 61.5206 61.7886 176.0576 16 K 4.0595 8.0189 120.3657 58.1902 32.3504 178.3768 17 I 3.7224 6.9777 111.3019 60.9800 38.4544 177.4959 18 G 2.6488 7.1872 108.3586 47.6342 0.0000 175.6329 19 K 4.0058 7.6580 118.7194 58.3935 32.1968 178.3039 20 S 4.7074 8.0461 114.6919 58.2010 63.1888 175.5788 21 A 4.0190 7.4854 127.3042 55.8570 18.0139 180.4440 22 D 4.3042 8.1050 116.3111 57.2325 40.8799 178.8179 23 A 3.9327 7.8970 120.8128 55.2582 18.5886 179.2709 24 I 3.7719 8.1266 118.9120 64.6419 37.2334 178.6987 25 G 3.6946 8.3679 106.4666 47.8938 0.0000 175.1919 26 N 4.2970 8.1531 119.8967 56.3235 38.9574 175.9843 27 D 4.3020 8.4742 119.5806 57.5122 41.2104 177.8734 28 A 4.0237 8.4715 121.1650 55.6187 18.4368 179.6515 29 L 4.0026 8.0879 116.9491 57.9942 41.7279 180.0477 30 S 4.1500 8.3547 115.3159 61.6897 62.7840 176.9762 31 R 3.9778 8.4219 121.1609 59.4274 29.9066 178.6702 32 M 4.3645 8.3597 118.0982 59.0097 32.0013 178.3188 33 I 3.9970 8.0133 119.6645 63.5886 37.0547 178.4854 34 V 3.7419 7.4690 118.2089 65.8699 31.7355 178.1522 35 V 3.6265 8.2504 116.5548 64.5957 32.8400 175.6341 36 Y 4.8584 7.8563 115.6697 54.4252 38.5532 173.9257 37 P 4.5551 0.0000 0.0000 65.1121 31.5690 178.5168 38 Q 4.1488 8.2393 117.2279 59.0104 28.4768 177.6373 39 T 4.3556 8.3271 110.6564 63.2127 68.7578 175.9575 40 K 4.4368 8.2704 122.2215 58.9764 31.9102 178.7168 41 T 3.8343 7.6832 109.4767 64.8573 68.4136 174.8799 42 Y 3.8860 7.3516 117.5336 59.0577 38.1635 175.8972 43 F 4.3391 8.1384 120.2406 56.8844 39.5674 177.1675 44 S 4.4295 8.0095 115.4770 60.0191 63.2608 174.5186 45 H 4.4217 8.0549 116.1397 57.0228 28.8842 175.1989 46 W 4.9746 7.3290 120.1816 54.5802 30.3950 174.6426 47 P 4.5165 0.0000 0.0000 64.2432 32.0127 176.1328 48 D 4.9965 7.8008 117.9392 52.1926 38.8184 178.5253 49 V 4.1638 7.4482 119.9955 62.2963 30.7603 174.0213 50 T 4.6405 7.6339 112.5320 58.4104 71.9135 172.0562 51 P 4.2081 0.0000 0.0000 64.5463 31.3489 176.1220 52 G 3.8451 8.5176 112.0538 46.5028 0.0000 173.9701 53 S 4.3647 7.9859 115.2450 56.8261 65.1343 172.8732 54 P 3.8783 0.0000 0.0000 66.4320 30.6747 178.3978 55 H 3.5472 7.6532 114.5715 58.4158 28.3540 177.8042 56 I 3.6929 7.1977 121.3947 64.0742 36.7989 178.4887 57 K 3.8621 8.6845 119.7797 59.5119 31.8709 179.2039 58 A 3.9674 7.8072 120.7800 55.4971 18.2412 179.1913 59 H 4.4296 8.4237 116.9499 59.3365 29.9605 177.5993 60 G 3.6805 8.5116 108.2687 47.6951 0.0000 175.6046 61 K 4.2015 7.7233 119.9358 59.0617 32.9597 179.3233 62 K 4.1602 7.8368 119.9877 59.3257 32.0699 179.3766 63 V 3.5805 7.9802 118.6935 66.4081 31.5324 178.0568 64 M 4.3887 8.2592 118.0832 57.8522 31.6559 178.9685 65 G 3.7852 7.9858 106.6799 47.5846 0.0000 176.1000 66 G 3.5829 8.0276 107.7603 47.3583 0.0000 175.9632 67 I 3.6957 7.5750 121.4382 63.7908 37.0991 178.1173 68 A 3.3897 7.8368 121.9321 54.6924 18.2614 179.1723 69 L 3.7901 8.0152 118.7860 58.4995 41.9445 179.0363 70 A 3.9769 7.6516 118.9853 55.2722 18.3819 179.4335 71 V 3.5031 7.6651 116.9698 65.9794 31.2926 178.2951 72 S 4.2393 7.6099 112.4869 60.0427 63.2771 175.5295 73 K 4.4817 7.6445 121.2779 56.0258 32.1277 177.6844 74 I 3.9408 7.1681 122.3573 64.0097 37.8672 176.4948 75 D 4.6157 7.9770 117.7496 55.9970 41.4361 176.6110 76 D 4.7628 8.2312 118.9542 51.8353 42.6313 175.1244 77 L 3.9295 8.1261 123.9323 57.0300 41.8069 178.0322 78 K 3.7726 8.0531 118.1807 60.2811 32.3777 178.3907 79 T 4.1125 8.0314 115.0570 66.4850 68.3402 176.7162 80 G 3.8129 8.0179 106.7159 47.5343 0.0000 174.7565 81 L 4.5680 7.7149 119.5325 54.3990 42.1279 178.2070 82 M 3.9195 7.7219 120.2453 59.1958 32.1798 178.0504 83 E 3.9745 8.1964 117.8880 59.4333 29.6100 179.1239 84 L 3.9994 7.7961 119.9226 57.8987 42.2444 178.7111 85 S 4.3094 7.8428 114.5664 60.8718 62.3512 176.0110 86 E 2.9932 7.9983 121.1572 59.0525 29.1902 179.0010 87 Q 3.8796 7.7082 118.9966 59.6733 29.1038 178.3490 88 H 4.1244 8.1901 116.8022 58.5736 28.5258 177.7825 89 A 2.5800 7.6575 121.7319 54.6740 18.1912 178.7162 90 Y 4.4487 7.4452 113.5624 60.1344 38.6170 177.3280 91 K 4.1319 7.7778 118.7342 59.1255 32.8392 177.7201 92 L 4.0747 8.3144 117.5702 55.8316 41.8998 177.6125 93 R 3.7685 8.1848 115.6261 57.0833 27.6354 176.8564 94 V 3.4283 7.8743 117.5605 62.0057 32.1631 174.7850 95 D 4.2875 8.7855 128.0347 53.7789 41.4877 175.3096 96 P 2.9700 0.0000 0.0000 64.3237 31.5929 178.0468 97 A 3.8736 8.0768 121.8038 55.3367 18.1738 179.1957 98 N 4.2452 7.8205 114.6729 56.0801 38.4195 177.6001 99 F 4.5486 7.6175 119.7451 60.5023 39.0738 177.7577 100 K 4.0192 7.9300 118.0602 59.2638 31.5489 179.3737 101 I 3.3474 7.5740 119.6475 64.3509 37.0049 178.0942 102 L 3.9809 7.8099 120.8197 58.0749 41.9299 178.4287 103 N 4.3025 8.3294 116.6227 56.7970 38.5778 176.7306 104 H 4.2154 8.1522 119.0339 59.5598 29.9532 177.1388 105 C 4.1841 7.8891 118.3617 62.8523 27.9008 176.1541 106 I 3.7545 8.1221 121.8899 64.3107 36.6559 178.5182 107 L 3.7617 7.8948 119.9002 57.5387 41.3633 179.6722 108 V 3.4931 7.5953 118.1061 65.8652 31.3946 178.2539 109 V 3.5235 7.8023 117.8479 66.2229 31.4371 178.0006 110 I 3.8096 7.7373 119.5726 64.3908 36.6005 178.4612 111 S 3.9877 7.4865 113.4110 61.4589 62.3215 176.0285 112 T 3.9982 7.8533 111.7622 65.1669 68.6411 176.2102 113 M 3.9284 8.1359 120.9582 56.6946 33.4368 176.9901 114 F 4.9241 8.6077 117.0395 55.1135 40.0121 173.4662 115 P 4.3884 0.0000 0.0000 65.9365 31.7940 178.8521 116 K 4.2072 8.1378 117.1493 59.1951 32.2718 178.1948 117 E 4.1137 8.2911 117.1094 59.2493 30.1684 177.6797 118 F 4.6091 8.4342 122.4697 57.5505 37.9558 174.4416 119 T 4.1412 7.2724 114.9388 60.7960 71.4284 173.2564 120 P 4.0860 0.0000 0.0000 65.7112 30.9560 178.8414 121 E 3.9655 7.9938 116.7914 59.1420 29.4606 178.9112 122 A 4.0770 8.1007 120.9830 54.9196 18.2969 179.2392 123 H 3.7482 7.9370 117.2449 59.3005 29.8556 177.2956 124 V 3.5576 7.6561 119.9318 66.4567 31.3927 178.1102 125 S 4.1307 7.6830 113.0879 61.6389 62.6240 176.6264 126 L 4.1729 8.3635 123.2620 57.9601 41.8840 178.6049 127 D 4.3994 8.5498 118.4492 57.1853 41.3447 178.1728 128 K 3.9316 8.3010 119.2106 59.5482 32.0710 178.9630 129 F 4.2538 8.4376 120.7129 61.5251 39.2821 177.1740 130 L 3.6875 8.3938 118.8220 57.6992 41.3551 179.6410 131 S 4.1992 8.0958 115.2170 61.3611 62.7390 176.8609 132 G 3.5571 7.7640 108.1550 47.8734 0.0000 175.9145 133 V 3.2682 7.6156 121.2651 65.2861 31.4960 177.8874 134 A 3.5747 7.9954 120.9545 55.0537 17.9990 179.4282 135 L 3.8878 7.7507 117.5105 58.0713 42.5020 178.7360 136 A 4.0777 7.8605 120.9270 55.0571 17.8548 179.6498 137 L 3.8861 7.9776 117.4672 57.5652 41.6213 179.0586 138 A 4.0603 7.9026 119.1932 53.2751 18.1374 178.7257 139 E 3.9005 7.6178 117.6641 59.3310 29.7302 177.9032 140 R 4.4386 7.8999 114.1429 56.5812 30.3686 177.1814 141 Y 4.2053 8.2460 118.2307 60.8019 38.1363 176.1351 142 R 4.2608 7.8474 119.4278 56.6685 29.0804 174.4457 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 1 S 8.33 4.44 0.00 4.00 3.94 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 2 L 8.26 4.17 0.00 1.77 1.67 1.09 0.70 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 3 S 10.03 4.59 0.00 4.00 4.02 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 4 D 8.42 4.34 0.00 2.70 2.74 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 5 K 8.00 3.89 0.00 1.81 1.80 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.53 7.81 6 D 8.00 4.70 0.00 2.96 2.72 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 7 K 7.99 3.85 0.00 1.93 1.81 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.72 7.81 8 A 8.42 3.93 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 9 A 7.99 3.85 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 10 V 8.37 3.44 1.74 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 0.13 0.00 0.00 0.78 0.00 0.00 11 R 8.06 3.87 0.00 2.16 1.94 0.00 3.15 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 12 A 8.24 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 13 L 7.96 3.97 0.00 1.79 1.72 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.36 3.98 0.00 3.48 3.20 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 15 S 7.98 4.04 0.00 4.11 4.12 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 0.00 0.00 0.00 16 K 8.02 4.06 0.00 1.73 1.69 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.38 7.81 17 I 6.98 3.72 0.77 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.10 -0.32 0.00 0.00 18 G 7.19 2.65 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 0.00 0.00 0.00 19 K 7.66 4.01 0.00 1.67 1.84 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.42 7.81 20 S 8.05 4.71 0.00 3.94 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 21 A 7.49 4.02 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 0.00 0.00 22 D 8.11 4.30 0.00 2.71 2.74 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 23 A 7.90 3.93 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 24 I 8.13 3.77 2.10 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.83 0.99 0.00 0.00 25 G 8.37 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 26 N 8.15 4.30 0.00 2.79 2.97 0.00 0.00 6.90 8.63 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 27 D 8.47 4.30 0.00 2.92 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 28 A 8.47 4.02 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 29 L 8.09 4.00 0.00 1.85 1.75 1.06 0.86 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 30 S 8.35 4.15 0.00 4.07 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 31 R 8.42 3.98 0.00 2.04 2.05 0.00 3.15 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 32 M 8.36 4.36 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.76 0.00 33 I 8.01 4.00 2.10 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.96 0.95 0.00 0.00 34 V 7.47 3.74 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.98 0.00 0.00 35 V 8.25 3.63 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 0.16 0.00 0.00 0.88 0.00 0.00 36 Y 7.86 4.86 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 37 P 0.00 4.56 0.00 2.30 2.37 0.00 3.96 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.91 0.00 38 Q 8.24 4.15 0.00 2.31 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.02 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 39 T 8.33 4.36 4.51 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 1.37 0.00 0.00 40 K 8.27 4.44 0.00 2.11 2.00 0.00 1.95 0.00 0.00 2.01 0.00 0.00 3.06 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.57 1.59 7.81 41 T 7.68 3.83 3.85 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 1.15 0.00 0.00 42 Y 7.35 3.89 0.00 2.27 2.39 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 43 F 8.14 4.34 0.00 3.00 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 44 S 8.01 4.43 0.00 3.96 3.96 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 45 H 8.05 4.42 0.00 3.30 3.37 0.00 5.51 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 W 7.33 4.97 0.00 3.46 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 47 P 0.00 4.52 0.00 2.22 2.23 0.00 3.72 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 48 D 7.80 5.00 0.00 2.77 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 49 V 7.45 4.16 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 0.96 0.00 0.00 1.18 0.00 0.00 50 T 7.63 4.64 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 1.24 0.00 0.00 51 P 0.00 4.21 0.00 2.06 2.10 0.00 3.75 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 2.13 0.00 52 G 8.52 3.85 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 0.00 0.00 0.00 53 S 7.99 4.36 0.00 4.14 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 54 P 0.00 3.88 0.00 2.16 2.25 0.00 3.57 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 1.96 2.11 0.00 55 H 7.65 3.55 0.00 2.80 1.31 0.00 5.81 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 56 I 7.20 3.69 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.10 0.90 0.00 0.00 57 K 8.68 3.86 0.00 1.82 1.81 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.43 7.81 58 A 7.81 3.97 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 59 H 8.42 4.43 0.00 3.65 3.52 0.00 5.80 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 60 G 8.51 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 61 K 7.72 4.20 0.00 2.15 1.98 0.00 1.62 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.71 1.50 7.81 62 K 7.84 4.16 0.00 2.03 1.97 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.35 0.00 0.00 0.00 0.00 1.52 1.51 7.81 63 V 7.98 3.58 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 1.04 0.00 0.00 0.86 0.00 0.00 64 M 8.26 4.39 0.00 2.28 2.20 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 3.00 2.87 0.00 65 G 7.99 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 66 G 8.03 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 67 I 7.57 3.70 1.94 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.80 0.65 0.00 0.00 68 A 7.84 3.39 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 L 8.02 3.79 0.00 1.74 1.83 0.90 1.02 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 70 A 7.65 3.98 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 71 V 7.67 3.50 1.61 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 0.79 0.00 0.00 0.10 0.00 0.00 72 S 7.61 4.24 0.00 4.02 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 73 K 7.64 4.48 0.00 1.77 1.81 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.51 1.54 7.81 74 I 7.17 3.94 2.01 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.92 0.91 0.00 0.00 75 D 7.98 4.62 0.00 2.70 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 76 D 8.23 4.76 0.00 2.65 2.47 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 77 L 8.13 3.93 0.00 1.68 1.61 0.89 0.77 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 78 K 8.05 3.77 0.00 1.72 1.99 0.00 2.03 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.54 7.81 79 T 8.03 4.11 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 1.21 0.00 0.00 80 G 8.02 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 81 L 7.71 4.57 0.00 1.62 1.57 0.73 0.59 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 82 M 7.72 3.92 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 83 E 8.20 3.97 0.00 2.04 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 2.40 2.37 0.00 84 L 7.80 4.00 0.00 1.72 1.60 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.84 4.31 0.00 4.03 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 86 E 8.00 2.99 0.00 2.13 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 2.19 2.45 0.00 87 Q 7.71 3.88 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 88 H 8.19 4.12 0.00 3.36 3.57 0.00 5.87 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 89 A 7.66 2.58 0.42 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 90 Y 7.45 4.45 0.00 2.88 2.82 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 91 K 7.78 4.13 0.00 1.73 1.96 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.44 7.81 92 L 8.31 4.07 0.00 1.53 1.61 0.70 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.18 3.77 0.00 1.96 2.09 0.00 3.35 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 94 V 7.87 3.43 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.67 0.00 0.00 95 D 8.79 4.29 0.00 2.77 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 96 P 0.00 2.97 0.00 2.01 1.81 0.00 3.50 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.50 0.00 97 A 8.08 3.87 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 98 N 7.82 4.25 0.00 2.57 2.73 0.00 0.00 6.96 8.26 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 99 F 7.62 4.55 0.00 3.09 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 0.00 100 K 7.93 4.02 0.00 1.71 1.84 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.65 7.81 101 I 7.57 3.35 1.87 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.54 0.23 0.00 0.00 102 L 7.81 3.98 0.00 1.84 1.72 0.98 0.77 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 0.00 103 N 8.33 4.30 0.00 3.02 2.90 0.00 0.00 6.65 7.72 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 0.00 104 H 8.15 4.22 0.00 3.32 3.50 0.00 5.78 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 0.00 105 C 7.89 4.18 0.00 3.19 3.11 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 0.00 106 I 8.12 3.75 2.07 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 1.56 0.85 0.98 0.00 0.00 107 L 7.89 3.76 0.00 1.84 1.67 1.12 1.00 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 0.00 108 V 7.60 3.49 2.18 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 1.05 0.00 0.00 0.87 0.00 0.00 109 V 7.80 3.52 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 1.19 0.00 0.00 1.02 0.00 0.00 110 I 7.74 3.81 1.50 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.49 0.63 0.00 0.00 111 S 7.49 3.99 0.00 3.72 3.98 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 0.00 0.00 0.00 112 T 7.85 4.00 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 1.21 0.00 0.00 113 M 8.14 3.93 0.00 1.07 2.12 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.37 0.00 114 F 8.61 4.92 0.00 3.14 3.13 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 0.00 115 P 0.00 4.39 0.00 2.22 2.23 0.00 3.82 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 116 K 8.14 4.21 0.00 1.83 1.96 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.49 7.81 117 E 8.29 4.11 0.00 2.06 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 2.34 2.41 0.00 118 F 8.43 4.61 0.00 3.07 3.12 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 0.00 0.00 0.00 119 T 7.27 4.14 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 1.25 0.00 0.00 120 P 0.00 4.09 0.00 2.13 2.09 0.00 3.54 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 121 E 7.99 3.97 0.00 2.01 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 2.37 2.40 0.00 122 A 8.10 4.08 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 0.00 123 H 7.94 3.75 0.00 2.40 3.12 0.00 5.63 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 0.00 124 V 7.66 3.56 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 1.03 0.00 0.00 1.00 0.00 0.00 125 S 7.68 4.13 0.00 3.95 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 0.00 126 L 8.36 4.17 0.00 1.95 1.96 1.10 1.68 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 0.00 127 D 8.55 4.40 0.00 3.10 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 0.00 128 K 8.30 3.93 0.00 2.02 1.89 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.72 7.81 129 F 8.44 4.25 0.00 3.01 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 0.00 130 L 8.39 3.69 0.00 1.73 1.78 1.00 0.97 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 0.00 131 S 8.10 4.20 0.00 4.13 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 0.00 132 G 7.76 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 0.00 133 V 7.62 3.27 1.74 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 0.71 0.00 0.00 -0.05 0.00 0.00 134 A 8.00 3.57 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 0.00 135 L 7.75 3.89 0.00 1.71 1.65 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 136 A 7.86 4.08 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 0.00 137 L 7.98 3.89 0.00 1.31 1.34 0.04 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.90 4.06 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.62 3.90 0.00 2.10 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 2.44 0.00 140 R 7.90 4.44 0.00 1.53 1.81 0.00 3.40 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 141 Y 8.25 4.21 0.00 3.01 3.05 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 0.00 142 R 7.85 4.26 0.00 1.93 1.93 0.00 3.09 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00