NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4712 8.1233 123.5260 51.4816 20.3580 177.3910 2 L 4.0365 8.5207 121.0675 56.6674 41.3399 179.4991 3 F 4.3704 9.1202 115.5665 60.0915 38.3130 177.1454 4 Q 3.8681 7.1664 118.6013 58.1470 28.3352 178.3229 5 F 4.3528 7.9313 121.5046 61.3206 39.4566 176.8952 6 R 3.7746 7.8598 117.5784 59.8161 29.8215 179.2277 7 S 4.2132 7.8082 113.0237 61.5143 62.6865 176.4011 8 M 4.1525 7.9995 121.2210 58.4548 31.8321 178.3881 9 I 3.8023 7.6744 120.2211 64.1192 37.3605 178.3457 10 K 4.1115 7.8152 119.4659 59.6024 31.7790 178.5861 11 C 4.3054 8.1296 118.5905 59.5311 43.4261 175.2672 12 A 4.2545 7.5585 119.4166 53.3249 19.5759 177.7830 13 I 4.6104 8.0299 118.3517 58.2384 38.1641 173.5536 14 P 4.5570 0.0000 0.0000 64.7351 31.5993 177.6417 15 G 3.9425 8.0082 103.6850 45.4818 0.0000 173.5755 16 S 4.6831 7.9732 114.8709 58.0336 64.6116 174.0571 17 H 4.8271 9.3861 117.0257 54.2641 29.1227 172.9843 18 P 4.7120 0.0000 0.0000 65.5203 31.4353 178.9896 19 L 4.1162 8.1207 118.1907 58.9278 40.5716 178.8353 20 M 4.3004 7.8406 117.2526 57.0341 32.5855 177.2608 21 D 4.2917 8.8267 119.4274 56.3114 41.1349 177.4163 22 F 4.6976 8.0028 114.4809 57.1735 40.2339 175.4956 23 N 4.6279 7.6130 120.6934 54.1427 39.7477 174.1503 24 N 4.2660 9.1156 121.6740 55.0681 36.0714 173.4628 25 Y 4.7712 7.7333 118.1585 56.5473 41.9446 175.5592 26 G 4.0746 8.2861 116.5829 46.0286 0.0000 172.3083 27 C 4.4833 10.2070 115.6922 57.7836 41.2004 174.8236 28 Y 4.2470 8.2090 115.0031 58.1200 39.6135 175.1950 29 C 4.5384 8.0492 117.7690 60.0155 39.4099 172.0057 30 G 4.2118 8.9647 110.2173 42.7481 0.0000 171.7104 31 W 4.2710 8.7115 129.8849 58.9488 30.9377 176.2965 32 G 3.4315 8.0302 113.8023 45.0846 0.0000 171.1253 33 G 4.2334 7.2743 109.7589 45.0681 0.0000 172.0777 34 S 4.3461 6.8753 116.1881 58.1214 66.0535 176.0723 35 G 3.8778 8.7324 107.1517 45.7718 0.0000 172.5766 36 T 4.6363 8.2472 116.8458 59.0322 69.2646 172.8340 37 P 4.6855 0.0000 0.0000 63.1733 31.5734 177.0019 38 V 3.7489 8.7283 116.1292 63.3485 31.9805 174.8767 39 D 4.5036 7.5042 117.8048 51.3689 41.6302 175.8200 40 E 3.9013 9.1106 119.1265 59.4605 29.7050 177.9333 41 L 4.0576 8.0491 119.6515 58.4527 42.1760 178.0313 42 D 4.5506 9.2550 118.1335 57.7880 40.9716 178.5109 43 R 3.9027 8.0568 119.0406 59.3904 29.6842 177.8584 44 C 4.3760 8.2875 116.5651 60.1236 41.4082 175.4672 45 C 4.4703 8.2446 117.7007 60.0339 40.9964 175.4766 46 E 3.5336 8.0534 120.8948 59.5671 29.1782 179.0485 47 T 3.8047 7.6387 115.3195 66.6900 68.3486 176.2680 48 H 3.9559 7.9062 119.8085 59.1193 29.8384 176.7923 49 D 4.3026 8.0896 120.7811 57.7841 40.7965 178.7435 50 N 4.4618 8.2368 115.6777 55.3516 38.3153 176.8604 51 C 4.2916 7.5875 119.5291 59.7505 42.5729 174.6618 52 Y 4.4461 8.1372 118.5818 61.3165 37.0215 178.3307 53 R 3.9271 8.3018 119.6907 60.0486 30.1196 178.1580 54 D 4.3681 8.2439 117.6585 57.1083 40.8244 178.2428 55 A 3.3026 8.1943 121.4845 54.7382 17.9448 179.1120 56 K 4.0209 7.3121 114.4231 56.9657 31.6423 177.0889 57 N 4.6752 7.4500 115.9229 53.2569 40.1337 175.7554 58 L 4.1410 7.3469 117.5741 53.8935 42.4091 176.8230 59 S 4.1152 8.4523 118.8734 59.4467 63.2565 174.3986 60 G 3.9198 8.5708 113.2173 46.7456 0.0000 173.8672 61 C 4.2844 7.5333 120.5047 54.6778 40.0539 172.2659 *67 Y 4.6411 7.9691 124.6428 57.1401 37.6395 173.9730 68 P 3.9052 0.0000 0.0000 65.6909 31.7452 177.9900 69 Y 4.5883 7.7751 115.4057 60.5225 37.9331 177.2289 70 T 4.5259 7.9445 106.2423 61.0973 69.9979 173.4828 71 E 4.3020 8.0862 124.4716 55.3873 29.6071 175.7461 72 S 4.8998 8.8295 122.8060 57.3814 63.7959 173.1046 73 Y 4.8807 7.5233 121.7868 55.1051 40.9676 173.9169 74 S 5.0613 8.6469 114.0694 56.9747 64.3176 172.5003 75 Y 5.3319 8.5487 124.0369 56.6640 41.1046 173.3497 76 S 4.0804 9.2720 113.0263 57.2241 66.9403 172.5436 77 C 5.2948 8.5349 121.5942 54.4962 44.8313 173.4416 78 S 4.4557 9.0226 124.6156 58.7817 63.5360 172.8943 79 N 3.9734 8.4194 118.1653 54.7506 36.0102 171.5627 80 T 4.7281 8.5100 118.7382 62.8514 67.2797 171.9189 81 E 4.0984 7.9151 119.0807 56.2472 30.2010 175.0577 82 I 4.9816 8.2770 123.9069 59.9157 39.2887 175.0497 83 T 4.6105 8.9609 123.2982 61.9501 71.8547 172.2812 84 C 4.9270 8.8199 124.5131 55.4481 42.5222 173.2000 85 N 4.5236 8.9642 123.8268 54.0009 39.1076 175.7406 86 S 4.3456 8.9902 120.2099 59.9673 63.2681 174.7203 87 K 4.3297 9.1173 121.0959 56.7491 32.3957 176.8595 88 N 4.6344 7.9359 117.2513 53.0560 39.1756 175.0760 89 N 4.7095 9.0337 119.3131 51.8413 40.0164 176.0430 90 A 3.9773 8.5598 121.9074 55.9289 18.1744 180.4308 91 C 4.3092 8.2537 116.0664 59.5897 44.9608 175.4992 92 E 4.0192 8.9172 120.4280 59.2975 29.1125 178.9658 93 A 3.9186 8.4892 121.1508 55.1053 18.4425 179.2751 94 F 3.9821 8.0563 118.6291 61.7813 39.6260 177.5187 95 I 3.6240 7.6957 118.8685 64.1735 36.7679 177.7368 96 C 3.0385 7.8685 119.4937 59.2063 44.0403 175.3376 97 N 4.0665 7.8673 118.0008 56.4148 37.9768 176.4513 98 C 3.8743 7.5479 117.8011 60.1905 38.1481 176.1594 99 D 3.7364 7.5818 119.4631 57.3057 40.5760 178.8844 100 R 3.8326 8.0955 119.5415 59.5007 30.0133 178.3168 101 N 4.2750 8.3026 116.2847 55.8961 38.3550 177.3895 102 A 3.5873 7.5571 122.1698 54.7567 18.4445 179.4117 103 A 3.4898 7.6181 119.2686 55.2840 18.2095 179.9942 104 I 3.5869 7.1949 116.5228 64.4667 37.5494 177.4098 105 C 4.3128 8.0755 119.3096 59.9874 37.6507 175.5122 106 F 4.2526 8.5738 120.2307 60.7007 38.1983 177.6541 107 S 4.2349 7.8306 112.7553 61.4084 62.6952 176.0468 108 K 4.3518 7.7232 117.8044 54.9499 32.4898 176.1464 109 A 4.9513 7.2103 122.1283 49.2406 21.3246 175.0618 110 P 4.3865 0.0000 0.0000 62.8390 32.0328 175.2762 111 Y 4.4553 8.5755 122.9557 56.0660 39.7396 174.9169 112 N 4.8159 8.6910 125.9308 51.1458 38.4357 175.2213 113 K 3.7566 8.8919 126.0928 59.4507 32.3350 178.3906 114 E 4.0357 7.9401 116.3671 58.7072 29.8120 177.0818 115 H 4.2159 8.7729 116.1300 55.9738 29.0865 174.8397 116 K 4.1188 7.2163 121.9756 56.9092 32.9293 176.2960 117 N 4.1692 9.0098 123.8247 54.2255 36.4683 174.5927 118 L 3.8285 7.3659 118.0627 54.8368 43.2764 176.4736 119 D 4.5760 8.1219 124.4615 53.4904 39.9831 176.5476 120 T 3.8690 8.4352 122.4002 66.3399 68.7083 176.9817 121 K 3.9856 8.1168 118.2453 58.3822 32.1881 177.6422 122 K 4.5174 7.7710 115.9025 56.2815 34.3191 176.4387 123 Y 4.3154 8.4384 114.6825 57.9034 39.3558 175.1004 124 C 4.5538 8.3802 122.0278 56.9168 41.5762 173.4800 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 A 8.12 4.47 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 2 L 8.52 4.04 0.00 1.87 1.96 0.92 1.22 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 3 F 9.12 4.37 0.00 3.34 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 7.17 3.87 0.00 1.65 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.85 0.00 0.00 0.00 0.00 0.00 1.75 1.16 0.00 5 F 7.93 4.35 0.00 3.34 3.29 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 6 R 7.86 3.77 0.00 2.22 2.03 0.00 3.37 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 7 S 7.81 4.21 0.00 4.16 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 8 M 8.00 4.15 0.00 2.25 2.01 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.57 0.00 9 I 7.67 3.80 1.75 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 -0.00 1.04 0.00 0.00 10 K 7.82 4.11 0.00 1.98 1.89 0.00 1.65 0.00 0.00 1.57 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.56 1.59 7.81 11 C 8.13 4.31 0.00 3.03 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 7.56 4.25 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 13 I 8.03 4.61 1.99 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.91 1.00 0.00 0.00 14 P 0.00 4.56 0.00 2.04 2.16 0.00 3.74 0.00 0.00 5.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 15 G 8.01 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 0.00 0.00 0.00 16 S 7.97 4.68 0.00 4.16 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 17 H 9.39 4.83 0.00 3.07 3.22 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.71 0.00 2.23 2.21 0.00 3.60 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 19 L 8.12 4.12 0.00 1.87 1.98 0.96 0.68 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 20 M 7.84 4.30 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 21 D 8.83 4.29 0.00 1.88 1.60 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 22 F 8.00 4.70 0.00 2.92 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 23 N 7.61 4.63 0.00 2.99 2.95 0.00 0.00 7.20 7.67 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 24 N 9.12 4.27 0.00 3.02 2.93 0.00 0.00 6.15 7.04 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 25 Y 7.73 4.77 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 26 G 8.29 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 27 C 10.21 4.48 0.00 2.99 3.04 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 28 Y 8.21 4.25 0.00 3.14 3.03 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 29 C 8.05 4.54 0.00 3.35 3.27 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 30 G 8.96 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 0.00 0.00 0.00 31 W 8.71 4.27 0.00 3.21 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 32 G 8.03 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 33 G 7.27 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 0.00 0.00 0.00 0.00 34 S 6.88 4.35 0.00 3.86 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 35 G 8.73 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 36 T 8.25 4.64 4.29 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 1.25 0.00 0.00 37 P 0.00 4.69 0.00 2.26 2.13 0.00 3.86 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.86 0.00 38 V 8.73 3.75 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.70 0.00 0.00 39 D 7.50 4.50 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 40 E 9.11 3.90 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 41 L 8.05 4.06 0.00 1.74 1.62 -0.16 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 42 D 9.25 4.55 0.00 3.01 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 43 R 8.06 3.90 0.00 2.17 1.96 0.00 3.15 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 44 C 8.29 4.38 0.00 3.48 3.39 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 45 C 8.24 4.47 0.00 3.30 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.05 3.53 0.00 1.25 1.62 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 1.90 1.47 0.00 47 T 7.64 3.80 4.34 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 1.14 0.00 0.00 48 H 7.91 3.96 0.00 3.01 3.33 0.00 5.61 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 49 D 8.09 4.30 0.00 3.03 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 50 N 8.24 4.46 0.00 2.74 2.85 0.00 0.00 6.73 7.19 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 51 C 7.59 4.29 0.00 3.03 3.04 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 52 Y 8.14 4.45 0.00 3.14 2.88 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 53 R 8.30 3.93 0.00 1.91 2.09 0.00 3.10 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 1.66 1.71 0.00 54 D 8.24 4.37 0.00 3.31 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 55 A 8.19 3.30 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.31 4.02 0.00 1.61 1.68 0.00 1.43 0.00 0.00 1.51 0.00 0.00 2.95 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.27 1.14 7.81 57 N 7.45 4.68 0.00 2.63 2.68 0.00 0.00 6.90 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 58 L 7.35 4.14 0.00 1.57 1.43 0.54 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.45 4.12 0.00 3.82 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 60 G 8.57 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 61 C 7.53 4.28 0.00 2.80 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 *67 Y 7.97 4.64 0.00 3.07 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 68 P 0.00 3.91 0.00 0.67 0.96 0.00 3.35 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 69 Y 7.78 4.59 0.00 3.09 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 70 T 7.94 4.53 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 1.33 0.00 0.00 71 E 8.09 4.30 0.00 2.10 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 72 S 8.83 4.90 0.00 3.94 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 73 Y 7.52 4.88 0.00 3.00 2.98 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 74 S 8.65 5.06 0.00 4.00 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 75 Y 8.55 5.33 0.00 3.20 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 76 S 9.27 4.08 0.00 3.70 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 C 8.53 5.29 0.00 3.12 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 78 S 9.02 4.46 0.00 3.97 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 79 N 8.42 3.97 0.00 2.89 2.94 0.00 0.00 7.37 7.70 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 80 T 8.51 4.73 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 1.22 0.00 0.00 81 E 7.92 4.10 0.00 2.20 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 2.52 2.34 0.00 82 I 8.28 4.98 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.67 1.02 0.00 0.00 83 T 8.96 4.61 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 1.23 0.00 0.00 84 C 8.82 4.93 0.00 2.80 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 85 N 8.96 4.52 0.00 2.90 2.84 0.00 0.00 6.51 6.95 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 86 S 8.99 4.35 0.00 4.02 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 87 K 9.12 4.33 0.00 1.92 1.91 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.41 7.81 88 N 7.94 4.63 0.00 2.80 2.86 0.00 0.00 6.97 7.43 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 89 N 9.03 4.71 0.00 3.02 2.99 0.00 0.00 7.01 6.87 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 90 A 8.56 3.98 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 91 C 8.25 4.31 0.00 2.98 3.23 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 92 E 8.92 4.02 0.00 2.34 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 0.00 2.61 2.58 0.00 93 A 8.49 3.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 F 8.06 3.98 0.00 3.06 3.04 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 95 I 7.70 3.62 1.93 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 1.35 1.09 0.94 0.00 0.00 96 C 7.87 3.04 0.00 2.34 2.81 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 97 N 7.87 4.07 0.00 2.71 2.65 0.00 0.00 7.06 7.23 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 98 C 7.55 3.87 0.00 3.01 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 D 7.58 3.74 0.00 2.80 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 R 8.10 3.83 0.00 1.72 1.86 0.00 3.03 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 101 N 8.30 4.27 0.00 2.64 2.73 0.00 0.00 6.89 7.41 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 0.00 102 A 7.56 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.62 3.49 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 0.00 104 I 7.19 3.59 1.93 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 1.37 0.71 0.88 0.00 0.00 105 C 8.08 4.31 0.00 3.11 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 0.00 106 F 8.57 4.25 0.00 2.85 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.83 4.23 0.00 4.08 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 0.00 108 K 7.72 4.35 0.00 1.79 1.90 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.61 7.81 109 A 7.21 4.95 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 0.00 110 P 0.00 4.39 0.00 2.13 2.06 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 111 Y 8.58 4.46 0.00 2.94 2.78 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 0.00 112 N 8.69 4.82 0.00 2.63 2.87 0.00 0.00 6.16 6.99 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 0.00 113 K 8.89 3.76 0.00 1.92 1.91 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.75 1.66 7.81 114 E 7.94 4.04 0.00 1.78 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 2.25 2.32 0.00 115 H 8.77 4.22 0.00 2.34 2.45 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 7.22 4.12 0.00 1.87 1.72 0.00 2.06 0.00 0.00 1.75 0.00 0.00 3.29 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.66 1.85 7.81 117 N 9.01 4.17 0.00 2.79 2.81 0.00 0.00 6.98 7.74 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 0.00 118 L 7.37 3.83 0.00 1.49 1.52 0.34 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 119 D 8.12 4.58 0.00 2.79 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 0.00 120 T 8.44 3.87 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 121 K 8.12 3.99 0.00 1.84 1.89 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.46 7.81 122 K 7.77 4.52 0.00 1.91 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.67 7.81 123 Y 8.44 4.32 0.00 3.07 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 0.00 124 C 8.38 4.55 0.00 2.97 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 * Residues marked with a * may have inaccurate shift predictions.