NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 4.5460 8.1132 109.1382 45.8744 0.0000 175.8711 4 L 4.1324 7.7842 119.4848 53.6828 41.6443 176.9942 5 D 4.4047 8.4115 120.1549 56.7476 39.1355 178.3431 6 K 3.8024 7.2406 119.4453 58.9420 32.1315 177.6989 7 Y 4.6064 7.5402 115.0940 58.3945 40.2057 175.7318 8 L 4.7396 7.8184 119.0895 51.2958 41.9541 172.7127 9 P 4.3486 0.0000 0.0000 63.0958 31.8307 176.8273 10 G 3.8987 8.8242 110.4469 45.9651 0.0000 172.5453 11 I 4.2216 7.5687 120.6357 60.4158 38.0420 175.4238 12 E 4.6741 8.8074 123.6135 56.4142 32.0045 175.8025 13 K 5.2493 8.0697 116.6528 54.5191 36.2745 175.6557 14 L 5.0066 8.8534 121.4348 52.8800 46.2782 176.3560 15 R 4.8280 9.0780 121.1834 56.5054 31.9368 176.0972 16 R 4.8971 9.1415 123.0606 55.0280 33.4743 176.0498 17 G 3.8212 9.0497 117.1685 47.1649 0.0000 174.9891 18 D 4.8391 9.1669 124.5545 54.1700 42.5850 176.7456 19 G 4.5028 7.9360 108.4481 45.7442 0.0000 171.3312 20 E 5.5594 8.7614 122.2748 55.3908 33.5051 175.1882 21 V 4.6675 8.5887 111.0239 59.8175 36.6672 175.0140 22 E 4.5249 8.8284 123.0866 56.1300 30.3543 178.5404 23 V 3.7182 8.8457 122.3403 65.9762 31.3712 178.5454 24 K 3.9842 8.3217 118.2213 59.4186 31.6207 178.4205 25 S 4.3991 7.9256 112.5599 59.9660 63.3500 175.3116 26 L 4.3603 7.9439 122.2085 53.8423 41.6907 176.1275 27 A 4.2844 7.0737 122.7568 54.1847 18.5704 178.2928 28 G 4.0322 9.3698 111.5890 45.0060 0.0000 173.7471 29 K 4.7950 7.7884 119.1311 55.2501 34.4502 175.5931 30 L 4.6061 8.4702 124.2722 54.6210 43.7019 175.5169 31 V 4.6229 8.7363 126.1125 61.0977 34.2708 173.9315 32 F 4.9476 9.1301 127.4909 55.9723 40.9333 174.9095 33 F 4.8210 9.1963 124.1300 56.8283 40.3736 174.2520 34 Y 5.1366 8.9672 126.6436 56.1384 40.3709 174.4382 35 F 4.8940 8.8646 127.5302 55.7135 40.4269 175.3290 36 S 4.5343 8.2317 116.9744 57.5248 66.4755 172.1001 37 A 5.0759 7.9625 122.0132 50.3587 21.5654 177.5811 38 S 3.2318 8.6519 116.2085 60.6196 62.8828 175.8794 39 W 4.4097 6.8265 113.9998 57.3116 28.5006 175.7112 40 C 4.3471 7.2245 121.2663 58.1391 31.4308 171.8522 41 P 4.3919 0.0000 0.0000 65.3099 30.6762 176.8705 42 P 4.4424 0.0000 0.0000 65.4628 31.2092 177.9909 43 C 4.4088 7.7643 115.8022 62.7560 27.6958 176.0324 44 R 4.0986 7.8891 119.3971 59.2405 29.7547 178.9158 45 G 3.7951 8.0528 103.6754 46.9767 0.0000 175.1286 46 F 4.4037 7.9013 121.7724 61.0877 39.4573 177.3013 47 T 3.8844 8.3404 115.8694 66.6563 68.2976 174.5846 48 P 4.1556 0.0000 0.0000 65.4597 31.3186 178.7917 49 Q 3.8715 7.7123 116.6345 58.7580 28.6521 178.2246 50 L 3.7640 7.2399 121.3014 58.0148 41.9134 179.1016 51 I 3.9538 8.0577 120.0863 64.2472 37.1142 177.8553 52 E 3.8894 8.3764 120.3297 59.3829 29.4833 178.6116 53 F 4.0947 8.3450 120.5294 61.4178 39.3996 176.3398 54 Y 4.3451 8.8473 119.4986 61.1458 38.5103 177.8699 55 D 4.3075 8.3810 118.6168 57.3414 40.9446 178.7297 56 K 3.7273 7.4889 117.9526 58.3334 32.2267 177.8006 57 F 4.8628 7.6623 114.4716 56.6153 41.2628 176.3944 58 H 2.5800 7.8314 117.3468 57.8693 28.3904 177.7778 59 E 3.6900 7.4950 119.3566 58.9843 29.6511 179.0892 60 S 4.0656 7.7990 111.5190 60.5734 63.3237 174.8487 61 K 4.1580 8.4373 118.0420 55.1421 33.0052 175.6357 62 N 4.1203 7.6926 118.0455 54.4360 37.1722 171.4076 63 F 5.7822 7.9534 113.1974 55.4366 42.4779 174.9292 64 E 5.1633 9.7568 118.8416 54.6094 33.7501 173.9165 65 V 4.8747 8.7277 122.4645 60.9879 34.8336 174.3333 66 V 4.6641 8.8592 127.4323 60.7719 34.0339 174.2764 67 F 4.9913 9.8471 132.5688 58.8299 40.5052 173.6971 68 C 4.7706 8.9607 125.0882 57.9591 29.3020 173.0908 69 T 4.0654 7.8278 118.3744 61.4517 67.8566 173.8672 70 W 5.0686 8.9443 126.2469 56.7119 30.1384 175.9141 71 D 5.1214 8.7020 120.8495 54.5858 40.8453 176.2609 72 E 4.7429 9.1008 120.8512 56.2263 30.6171 175.5057 73 E 4.6019 8.1434 120.1022 54.5463 31.3856 175.9708 74 E 2.5400 8.6933 125.1970 59.0142 29.5931 177.8826 75 D 4.6254 7.8913 114.2820 54.7090 42.4680 177.6112 76 G 3.6320 8.4110 106.1487 46.5250 0.0000 177.9653 77 F 3.8183 8.4081 120.6121 59.7916 42.6298 176.4733 78 A 4.1390 8.0758 118.3243 55.2256 18.1348 179.9139 79 G 3.6016 7.9696 103.1602 47.9073 0.0000 175.1382 80 Y 4.3740 7.9803 121.3884 60.6679 38.9367 177.5706 81 F 3.8579 8.8474 121.8197 60.8091 39.1917 176.7634 82 A 3.5679 7.6153 119.8397 54.6710 18.1032 178.7716 83 K 3.9432 7.0638 113.8102 56.2016 32.7203 176.5562 84 M 3.7595 6.5733 119.6008 52.4791 34.0739 174.1648 85 P 4.2536 0.0000 0.0000 62.7320 32.8643 176.2967 86 W 4.9645 7.6295 117.6826 56.3431 30.8557 174.9337 87 L 5.3668 9.0004 119.0045 53.8934 44.4500 175.4307 88 A 5.2159 8.7783 120.6961 50.1410 22.8037 176.0097 89 V 3.9242 8.3680 122.0531 62.3310 32.1482 174.5141 90 P 4.3820 0.0000 0.0000 62.3658 32.2529 176.8740 91 F 3.2637 8.4647 123.6431 61.1615 39.1996 177.2548 92 A 4.1073 8.0066 121.6178 54.5536 18.4436 177.4736 93 Q 4.5527 7.8976 115.0815 56.0320 29.3788 178.0865 94 S 3.9294 7.6034 117.8134 61.6056 62.6093 175.9748 95 E 3.8440 8.1645 120.5935 59.6438 29.1386 179.1390 96 A 3.9716 7.7130 119.9865 55.1559 18.3826 179.8546 97 V 3.5995 7.5739 116.1225 66.2512 31.7047 177.9894 98 Q 3.9631 8.4071 118.1740 59.0147 28.5232 179.2081 99 K 3.9405 8.1680 119.3492 59.2866 32.1148 178.9840 100 L 4.0150 8.2799 120.9793 58.5301 41.9131 179.2334 101 S 3.9672 8.7368 115.3248 61.4509 62.7994 176.7246 102 K 3.9068 8.0401 122.3423 59.6274 31.7488 178.1011 103 H 3.9655 8.3038 117.9080 59.2295 29.7521 176.2043 104 F 4.5790 7.9599 115.7645 56.0828 39.6730 175.0245 105 N 4.0231 7.9540 116.3358 54.3919 37.6039 175.1141 106 V 3.7954 7.9780 117.2928 62.7035 31.7490 174.8918 107 E 4.7606 8.8045 126.7137 56.6124 31.0996 176.1196 108 S 4.8776 7.7815 111.3875 56.3795 66.1867 172.9451 109 I 4.3012 7.7535 114.2122 57.9665 39.9107 173.4243 110 P 4.5982 0.0000 0.0000 63.2017 32.3466 175.5668 111 T 4.6547 8.5334 117.2030 61.8871 73.5001 172.7750 112 L 5.3411 8.4475 125.6693 53.6744 45.6538 174.7816 113 I 4.5929 9.1811 127.2959 59.4337 40.5175 174.6317 114 G 3.7228 9.2129 114.7316 44.3072 0.0000 172.8225 115 V 4.9606 8.4060 117.3051 59.1036 36.3419 174.3583 116 D 4.6849 9.0083 123.6463 54.0228 41.6734 176.8016 117 A 4.0336 9.0231 128.8225 55.5388 19.0903 179.5200 118 D 4.3184 8.3910 115.2329 57.0300 41.2181 178.3633 119 S 4.4319 8.5770 111.9478 58.0604 63.8669 175.4763 120 G 4.1682 8.5291 108.7698 45.1706 0.0000 173.4079 121 D 4.6627 8.0589 120.4758 54.2472 42.1143 175.8377 122 V 4.0460 8.5099 122.6511 63.2952 32.0197 175.4240 123 V 4.0618 9.0218 128.4826 64.8591 33.0762 175.4686 124 T 5.2296 7.5580 114.0362 60.9106 70.5803 173.7283 125 T 4.4811 9.4277 117.2652 61.6358 69.8791 174.7376 126 R 4.5376 7.6307 121.1463 55.8047 31.1188 177.6226 127 A 4.1522 7.6879 123.1300 54.2951 17.8592 180.3529 128 R 3.3971 7.7405 117.0734 59.3930 29.8840 178.4079 129 A 4.0412 7.5222 119.2059 55.0879 18.7482 179.2166 130 T 3.6676 7.4913 108.3857 64.4312 68.8577 176.7216 131 L 2.9889 7.1197 123.3653 57.7612 41.7407 179.4877 132 V 3.6840 6.9353 111.4442 63.7631 31.5531 177.8988 133 K 4.2982 7.4405 116.3813 56.7817 33.7226 176.3670 134 D 4.9429 7.7779 118.8181 51.8169 41.1095 174.0476 135 P 4.4859 0.0000 0.0000 65.7192 31.8343 177.6953 136 E 4.7230 8.5314 115.9075 55.5002 29.8017 175.8216 137 G 4.2195 8.7777 107.7069 46.7066 0.0000 176.4816 138 E 3.9822 9.4786 121.6638 58.5125 29.8544 178.3871 139 Q 4.4960 9.2560 116.1730 55.1533 29.2516 175.1064 140 F 2.6160 7.2650 120.8049 57.6983 39.5425 172.8958 141 P 2.9700 0.0000 0.0000 61.8417 31.8208 175.3230 142 W 3.6026 7.2864 114.7874 58.0436 26.8677 175.3207 143 K 4.1632 7.9863 115.6899 57.2371 32.2165 178.1817 144 D 4.6474 8.7534 123.9249 53.7958 41.8798 176.3976 145 A 4.2416 8.4495 121.0608 52.4498 18.0562 177.6127 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 3 G 8.11 4.55 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 0.00 4 L 7.78 4.13 0.00 1.91 1.93 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 5 D 8.41 4.40 0.00 2.83 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 6 K 7.24 3.80 0.00 1.39 0.86 0.00 0.73 0.00 0.00 1.34 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.09 1.21 7.81 7 Y 7.54 4.61 0.00 3.19 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 8 L 7.82 4.74 0.00 1.79 1.62 1.23 1.13 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 9 P 0.00 4.35 0.00 2.02 2.01 0.00 3.84 0.00 0.00 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 10 G 8.82 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 11 I 7.57 4.22 1.92 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 1.31 0.62 0.98 0.00 0.00 12 E 8.81 4.67 0.00 1.93 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 2.33 2.33 0.00 13 K 8.07 5.25 0.00 1.62 1.71 0.00 1.87 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.37 1.41 7.81 14 L 8.85 5.01 0.00 1.63 1.71 1.04 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 R 9.08 4.83 0.00 1.69 2.08 0.00 3.35 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 16 R 9.14 4.90 0.00 1.99 1.85 0.00 3.32 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 17 G 9.05 3.82 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 0.00 0.00 0.00 18 D 9.17 4.84 0.00 2.70 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 19 G 7.94 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 20 E 8.76 5.56 0.00 1.98 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 0.00 2.24 2.38 0.00 21 V 8.59 4.67 2.15 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 0.76 0.00 0.00 1.09 0.00 0.00 22 E 8.83 4.52 0.00 2.04 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 2.44 2.27 0.00 23 V 8.85 3.72 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 1.12 0.00 0.00 1.07 0.00 0.00 24 K 8.32 3.98 0.00 1.84 1.90 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.59 7.81 25 S 7.93 4.40 0.00 4.09 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 26 L 7.94 4.36 0.00 1.90 1.78 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.07 4.28 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 28 G 9.37 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 29 K 7.79 4.79 0.00 1.97 1.81 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.52 7.81 30 L 8.47 4.61 0.00 1.82 1.69 0.59 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.74 4.62 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 0.21 0.00 0.00 0.90 0.00 0.00 32 F 9.13 4.95 0.00 3.15 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 33 F 9.20 4.82 0.00 2.98 2.42 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 34 Y 8.97 5.14 0.00 2.76 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 35 F 8.86 4.89 0.00 2.75 2.38 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 36 S 8.23 4.53 0.00 2.74 3.46 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 0.00 0.00 0.00 0.00 37 A 7.96 5.08 0.41 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 38 S 8.65 3.23 0.00 3.73 3.32 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 39 W 6.83 4.41 0.00 3.50 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 40 C 7.22 4.35 0.00 1.98 2.56 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 41 P 0.00 4.39 0.00 2.26 2.14 0.00 3.79 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 42 P 0.00 4.44 0.00 2.25 2.32 0.00 3.73 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 2.18 2.06 0.00 43 C 7.76 4.41 0.00 3.18 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 44 R 7.89 4.10 0.00 1.98 2.04 0.00 3.19 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 45 G 8.05 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 46 F 7.90 4.40 0.00 3.21 3.19 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 47 T 8.34 3.88 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 1.24 0.00 0.00 48 P 0.00 4.16 0.00 2.10 2.04 0.00 3.57 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 49 Q 7.71 3.87 0.00 1.84 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 50 L 7.24 3.76 0.00 0.78 1.40 0.63 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.06 3.95 1.93 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.57 0.81 0.00 0.00 52 E 8.38 3.89 0.00 2.11 2.12 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 2.29 2.29 0.00 53 F 8.34 4.09 0.00 3.41 3.32 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 54 Y 8.85 4.35 0.00 3.56 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.38 4.31 0.00 2.68 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 56 K 7.49 3.73 0.00 0.80 0.74 0.00 1.25 0.00 0.00 1.14 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.03 1.27 7.81 57 F 7.66 4.86 0.00 2.73 2.60 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 58 H 7.83 2.58 0.00 2.35 2.13 0.00 5.26 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.49 3.69 0.00 1.80 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.54 0.00 60 S 7.80 4.07 0.00 3.94 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 61 K 8.44 4.16 0.00 1.75 1.35 0.00 0.72 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.09 1.04 7.81 62 N 7.69 4.12 0.00 2.85 2.85 0.00 0.00 6.64 7.92 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 63 F 7.95 5.78 0.00 3.53 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 9.76 5.16 0.00 2.20 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 2.34 2.44 0.00 65 V 8.73 4.87 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 -0.48 0.00 0.00 0.86 0.00 0.00 66 V 8.86 4.66 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 1.12 0.00 0.00 0.97 0.00 0.00 67 F 9.85 4.99 0.00 3.55 3.21 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 68 C 8.96 4.77 0.00 2.11 2.63 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 69 T 7.83 4.07 3.97 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 1.26 0.00 0.00 70 W 8.94 5.07 0.00 3.21 3.52 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 71 D 8.70 5.12 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.10 4.74 0.00 2.03 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 0.00 2.26 2.43 0.00 73 E 8.14 4.60 0.00 2.11 1.91 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 2.41 2.41 0.00 74 E 8.69 2.54 0.00 1.61 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.47 0.00 75 D 7.89 4.63 0.00 2.65 2.67 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 76 G 8.41 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 77 F 8.41 3.82 0.00 3.61 3.50 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 78 A 8.08 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 79 G 7.97 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 0.00 0.00 0.00 80 Y 7.98 4.37 0.00 3.05 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 81 F 8.85 3.86 0.00 2.68 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 82 A 7.62 3.57 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 83 K 7.06 3.94 0.00 1.59 1.63 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.32 1.46 7.81 84 M 6.57 3.76 0.00 0.51 1.30 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.78 0.00 85 P 0.00 4.25 0.00 2.09 1.89 0.00 2.20 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.57 0.00 86 W 7.63 4.96 0.00 3.45 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 87 L 9.00 5.37 0.00 1.83 1.89 1.06 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 88 A 8.78 5.22 0.43 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 89 V 8.37 3.92 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.97 0.00 0.00 90 P 0.00 4.38 0.00 2.20 1.99 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 91 F 8.46 3.26 0.00 1.85 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 92 A 8.01 4.11 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 93 Q 7.90 4.55 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.70 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 94 S 7.60 3.93 0.00 3.49 3.62 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 95 E 8.16 3.84 0.00 1.94 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 2.34 2.32 0.00 96 A 7.71 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 97 V 7.57 3.60 2.21 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 1.36 0.00 0.00 0.87 0.00 0.00 98 Q 8.41 3.96 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.21 2.48 0.00 99 K 8.17 3.94 0.00 1.79 1.83 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.54 7.81 100 L 8.28 4.02 0.00 1.93 2.05 1.03 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.74 3.97 0.00 4.13 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 0.00 102 K 8.04 3.91 0.00 1.81 1.97 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.42 7.81 103 H 8.30 3.97 0.00 3.08 3.35 0.00 5.99 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 0.00 104 F 7.96 4.58 0.00 2.99 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 0.00 105 N 7.95 4.02 0.00 2.79 2.84 0.00 0.00 7.06 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 0.00 106 V 7.98 3.80 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.19 0.00 0.00 107 E 8.80 4.76 0.00 2.03 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 2.27 2.46 0.00 108 S 7.78 4.88 0.00 3.92 3.82 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 0.00 109 I 7.75 4.30 1.47 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 1.01 0.40 -0.51 0.00 0.00 110 P 0.00 4.60 0.00 1.99 2.18 0.00 3.57 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 1.59 1.97 0.00 111 T 8.53 4.65 4.13 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 1.14 0.00 0.00 112 L 8.45 5.34 0.00 1.82 1.54 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 113 I 9.18 4.59 1.80 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.67 -0.03 0.00 0.00 114 G 9.21 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 0.00 0.00 0.00 115 V 8.41 4.96 2.21 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 0.64 0.00 0.00 0.93 0.00 0.00 116 D 9.01 4.68 0.00 2.78 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 0.00 117 A 9.02 4.03 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 0.00 118 D 8.39 4.32 0.00 2.88 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 0.00 119 S 8.58 4.43 0.00 4.00 4.01 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 0.00 0.00 0.00 0.00 120 G 8.53 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.06 4.66 0.00 2.68 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 0.00 122 V 8.51 4.05 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 0.81 0.00 0.00 1.33 0.00 0.00 123 V 9.02 4.06 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 0.68 0.00 0.00 0.87 0.00 0.00 124 T 7.56 5.23 4.47 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 1.43 0.00 0.00 125 T 9.43 4.48 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 1.23 0.00 0.00 126 R 7.63 4.54 0.00 1.81 1.83 0.00 3.12 0.00 0.00 3.40 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 127 A 7.69 4.15 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 0.00 128 R 7.74 3.40 0.00 1.45 1.60 0.00 2.98 0.00 0.00 2.86 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.13 0.00 129 A 7.52 4.04 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 0.00 130 T 7.49 3.67 3.36 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 1.10 0.00 0.00 131 L 7.12 2.99 0.00 0.88 1.44 0.29 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 132 V 6.94 3.68 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 1.01 0.00 0.00 0.95 0.00 0.00 133 K 7.44 4.30 0.00 1.71 1.82 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.51 7.81 134 D 7.78 4.94 0.00 2.84 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 0.00 135 P 0.00 4.49 0.00 2.36 2.29 0.00 3.97 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 2.09 2.07 0.00 136 E 8.53 4.72 0.00 2.11 2.16 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 2.39 2.35 0.00 137 G 8.78 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 0.00 0.00 0.00 0.00 138 E 9.48 3.98 0.00 2.13 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 2.37 2.34 0.00 139 Q 9.26 4.50 0.00 2.50 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 140 F 7.26 2.62 0.00 2.21 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 0.00 141 P 0.00 2.97 0.00 1.53 0.49 0.00 3.65 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 142 W 7.29 3.60 0.00 3.55 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 0.00 143 K 7.99 4.16 0.00 1.61 1.74 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.39 7.81 144 D 8.75 4.65 0.00 2.58 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 0.00 145 A 8.45 4.24 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