NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.8291 8.1976 109.7300 43.4603 0.0000 177.0647 1 M 2.5500 8.5911 123.8592 55.3251 31.3086 174.4847 2 K 4.5235 8.2159 114.2433 56.1861 33.3438 176.6985 3 M 4.2239 7.7883 127.5829 55.3291 36.6865 176.0808 4 L 3.9488 7.8116 118.5299 58.3927 41.3125 179.3078 5 E 4.5224 8.4188 119.6871 59.3017 29.3512 179.6179 6 Q 4.1946 8.5479 117.6557 58.1165 28.8733 178.0969 7 L 3.3119 8.0553 122.1673 57.7823 42.0685 178.7672 8 E 4.1608 7.9041 119.4377 58.8241 29.2326 179.1496 9 K 4.0233 7.4284 117.5336 59.1081 32.2913 178.9390 10 K 4.1079 7.6331 117.8107 59.4584 32.1463 178.6732 11 L 4.1045 7.8613 119.6229 56.2926 41.9055 178.0134 12 G 3.9652 9.0781 105.3935 45.5046 0.0000 172.1716 13 Y 4.8419 7.6103 119.5148 55.9819 41.7997 173.6452 14 T 4.5644 7.7432 123.4558 61.6438 70.1389 174.5870 15 F 4.2332 8.4021 125.1622 57.1401 39.7114 175.9976 16 K 4.0302 9.1951 123.8913 58.1348 32.4651 176.7431 17 D 4.8162 9.3915 120.3498 52.4573 41.9160 176.8980 18 K 3.9634 8.7249 127.5653 59.5329 32.2631 179.4176 19 S 4.6643 8.0380 114.7448 60.0740 62.6694 176.0998 20 L 3.9531 7.5396 123.9317 58.1791 41.6967 178.1895 21 L 3.6137 7.1110 119.7623 57.6677 41.6453 178.6450 22 E 3.8790 7.8483 118.3919 59.4122 29.3401 179.2177 23 K 3.9325 8.2132 119.2634 59.5577 31.9245 178.5688 24 A 4.1574 7.5809 119.1835 54.3649 18.5284 178.5828 25 L 4.4393 8.0571 116.0179 54.3038 41.9989 176.0635 26 T 4.6474 7.2348 117.9306 61.8184 69.6809 173.7840 27 H 4.5505 9.2205 127.8506 55.4270 30.6150 176.5121 28 V 3.7101 8.0606 127.0150 64.0953 30.6099 178.5938 29 S 4.2957 8.3728 113.5047 60.7869 62.9131 174.6532 30 Y 4.6229 8.1046 122.3594 58.0317 39.8088 175.1970 31 S 4.3904 7.7489 113.1664 57.0039 63.5251 174.2173 32 K 3.9686 8.6380 127.9660 59.2002 32.2741 179.0071 33 K 4.0355 8.1951 118.7720 58.8649 32.2345 176.9024 34 E 4.5554 8.4162 122.0788 54.3330 30.1207 174.5596 35 H 5.1919 7.9687 118.4202 52.6017 32.0339 174.4120 36 Y 4.4666 8.6128 118.0142 58.6722 37.3109 177.4996 37 E 3.9652 7.4741 121.4256 60.0245 30.0310 178.3664 38 T 4.2100 7.7779 114.9002 66.1565 68.7833 176.7565 39 L 4.0774 8.0098 120.5310 58.0298 41.8323 178.8600 40 E 4.1037 8.7855 119.4396 59.3327 29.2610 178.7166 41 F 4.1768 8.2335 120.3930 61.2647 39.4491 176.6698 42 L 4.0326 8.1911 119.4818 58.3320 41.9706 178.9164 43 G 3.6637 8.6474 105.9696 47.6519 0.0000 174.8416 44 D 4.5911 8.0258 119.7283 57.4569 41.2934 178.3090 45 A 3.8540 7.3418 120.6971 54.8296 18.4059 178.9766 46 L 3.4205 7.7917 118.9785 58.4554 42.1810 179.5792 47 V 2.7207 8.2040 118.8862 65.6272 31.4547 177.3408 48 N 4.3362 8.2565 116.9667 56.6351 38.6292 176.6194 49 F 4.2560 8.0041 121.8604 61.4578 39.6460 176.9619 50 F 3.9244 7.5529 117.2304 60.7667 38.5396 177.8727 51 I 4.0041 7.7104 118.7943 64.2616 36.9296 178.6385 52 V 3.5918 7.8625 119.2114 65.8204 31.3532 177.2210 53 D 4.4501 8.0866 118.0161 57.7316 40.9428 178.6948 54 L 4.0417 7.9025 118.8991 57.4492 41.5748 179.1501 55 L 3.9314 8.2385 120.7703 58.1961 41.8549 178.9414 56 V 3.6141 8.3514 117.7650 66.4173 31.4742 177.6253 57 Q 3.9258 7.8159 115.8637 58.7933 28.7192 177.7375 58 Y 4.4284 8.2455 114.8967 56.8167 38.6874 175.9010 59 S 4.4265 7.7252 116.4860 57.5267 62.9034 172.4979 60 P 4.3852 0.0000 0.0000 63.9569 31.4593 175.6472 61 N 4.7351 7.6155 116.5644 51.4835 40.8615 173.9937 62 K 4.3020 8.5409 124.2070 57.6318 33.1362 177.3634 63 R 3.9532 8.1448 119.1130 56.4761 30.5591 176.9709 64 E 3.9314 9.3028 122.2052 59.9565 28.9310 179.5918 65 G 3.7308 8.1767 104.6254 46.9396 0.0000 174.4342 66 F 4.5523 9.0388 122.8085 60.3052 40.0480 177.4550 67 L 4.0137 7.8680 118.2878 57.7258 41.5863 179.1061 68 S 4.0479 8.0210 114.9812 62.0498 63.0060 174.6941 69 P 4.1338 0.0000 0.0000 65.5883 30.9318 178.0100 70 L 3.9002 7.6012 117.5208 59.2105 40.1417 179.2993 71 K 3.7612 7.9399 119.8224 59.3343 31.9237 178.3821 72 A 3.9449 8.0042 119.9203 55.3538 18.1890 178.8342 73 Y 4.2445 7.7808 117.3502 60.9674 38.8062 177.6467 74 L 2.9956 8.0808 118.8842 56.8289 41.6945 178.5893 75 I 3.9135 7.3236 110.5290 59.6218 38.3978 176.5645 76 S 4.1477 8.0991 117.8677 58.6797 64.5305 174.7321 77 E 3.9347 8.5052 122.5517 58.4750 29.5977 178.9675 78 E 4.0200 8.0214 118.6232 59.7824 29.7375 178.7650 79 F 4.1462 8.7352 120.9231 61.1270 39.2539 177.2317 80 F 3.9493 8.3791 117.6767 60.4278 38.5859 177.3857 81 N 4.1934 7.9968 115.8117 55.8825 38.0619 177.2107 82 L 4.3627 7.0270 120.5627 57.3093 42.0925 179.4356 83 L 3.6704 6.9721 118.2417 57.3014 41.2390 179.3927 84 A 3.9923 7.4987 121.0960 55.0664 18.1215 179.4556 85 Q 3.9589 8.0510 116.6498 59.2601 28.5123 179.4443 86 K 4.2309 7.8778 118.2495 58.2680 32.0278 177.6639 87 L 4.6471 7.8661 117.6493 53.6594 42.3835 177.1179 88 E 3.7933 8.0709 114.3160 57.7031 28.5433 175.5370 89 L 4.2875 7.6873 127.2825 58.6140 42.9457 178.3728 90 H 4.3009 8.2778 113.9680 58.0160 28.5408 177.0907 91 K 3.5484 7.3293 119.5433 57.9509 32.0005 177.0370 92 F 4.7007 7.6957 114.7491 57.1188 40.6349 175.6578 93 I 4.1016 7.2452 122.1932 61.3458 37.7705 175.7655 94 R 4.1983 9.2924 126.9331 54.7910 31.3168 175.3624 95 I 4.9167 8.0560 123.5519 58.7909 41.0130 174.1932 96 K 4.6600 9.0843 133.4080 55.7448 30.4874 178.1133 97 R 3.9492 8.6298 112.9313 54.8912 29.1872 174.7743 98 G 4.3451 7.6689 106.9768 42.8830 0.0000 170.4252 99 K 4.6069 7.8326 119.5379 54.1682 34.2324 176.9611 100 I 3.9395 8.0707 121.8037 61.6089 37.8130 175.6431 101 N 5.1757 8.2908 119.5342 50.7781 43.7293 175.6853 102 E 4.2283 8.4651 121.5373 59.2864 29.4303 179.6921 103 T 4.1212 7.8082 116.6930 66.3294 68.6180 176.5565 104 I 3.8588 7.8035 121.0747 64.4344 37.1906 178.4651 105 I 3.8688 7.9497 121.0059 64.2586 36.8967 178.7575 106 G 3.7868 8.5038 107.1098 47.9503 0.0000 175.6311 107 D 4.5213 8.4402 121.4673 56.9631 40.7221 178.9077 108 V 3.2649 7.6078 118.9187 65.1276 31.0802 177.8163 109 F 4.1217 8.1868 120.6199 61.3229 39.2732 176.7210 110 E 3.9926 8.3383 117.8540 59.7106 29.3815 179.4675 111 A 4.0082 7.8753 120.2958 54.7599 18.3192 179.4374 112 L 3.7114 8.1270 119.4420 58.2174 42.1234 179.2222 113 W 4.3291 7.4550 118.0793 59.8272 28.8919 178.4213 114 A 4.2177 8.2085 120.4255 55.1242 17.8000 179.5885 115 A 4.0825 8.1158 119.5048 55.0497 18.5649 179.9085 116 V 3.1730 8.3865 117.3291 66.2593 31.6168 177.3878 117 Y 4.5556 8.3887 120.8355 60.3730 38.5960 178.4617 118 I 3.3923 7.9914 120.5961 64.3130 37.0520 177.9677 119 D 4.4778 8.4978 117.9224 56.4200 41.1300 177.3173 120 S 4.4747 7.6561 112.7131 58.4070 63.4760 174.4815 121 G 3.7446 7.5343 110.8570 45.9118 0.0000 174.0330 122 R 2.8410 7.2985 114.0366 56.8425 27.8675 179.0173 123 D 4.8641 7.5395 117.0417 52.2306 40.5172 174.8191 124 A 4.1775 8.5380 126.6980 54.8380 18.6756 178.8991 125 N 4.2301 8.2692 114.3501 56.3483 38.6915 177.1525 126 F 4.0627 8.3891 121.7326 61.6781 39.3820 177.1328 127 T 3.7678 8.0003 115.2496 66.6983 68.3465 176.3973 128 R 2.0000 7.6932 120.6982 58.6923 29.7991 178.4354 129 E 3.6572 7.5781 118.1336 59.2200 29.5325 179.1743 130 L 3.7939 7.5227 119.2657 57.7903 41.6286 179.4472 131 F 3.6692 7.7199 120.4217 60.8661 39.0459 176.8239 132 Y 4.4180 7.4172 116.4843 60.5200 37.6399 177.6588 133 K 3.7935 8.2890 118.8339 59.6056 32.2655 178.9859 134 L 3.8285 7.1242 116.8505 56.7657 41.9974 177.9878 135 F 4.9525 7.3255 114.0729 56.5759 40.6044 177.0926 136 K 3.9378 8.2235 123.1016 59.2909 31.8191 178.2367 137 E 3.9068 8.0304 119.4206 59.1217 29.7908 178.1765 138 D 4.6266 7.9818 119.7675 56.4004 40.9963 178.5775 139 I 3.8949 7.7839 120.1492 63.9484 37.0688 178.4697 140 L 3.9148 7.8923 120.3448 57.7536 41.5366 179.6015 141 S 4.2413 8.1613 113.8899 61.1187 62.7362 176.4506 142 A 4.0690 7.8958 124.1661 55.2211 18.0051 179.2883 143 I 3.6392 7.7662 117.6156 64.1572 37.5747 177.4410 144 K 4.2924 7.6145 116.2307 57.4359 32.8041 176.0361 145 E 3.6724 8.1877 114.8260 58.4928 28.0612 175.9621 146 G 3.8067 8.2242 106.7327 45.8565 0.0000 174.1330 147 R 3.8165 7.6774 123.3944 56.9789 31.0494 175.5433 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 0 G 8.20 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 1 M 8.59 2.55 0.00 2.34 2.18 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.62 0.00 2 K 8.22 4.52 0.00 1.76 1.84 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.40 7.81 3 M 7.79 4.22 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 4 L 7.81 3.95 0.00 2.01 1.68 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.42 4.52 0.00 1.99 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 6 Q 8.55 4.19 0.00 2.42 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 7 L 8.06 3.31 0.00 0.31 1.40 0.36 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.90 4.16 0.00 2.22 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 2.42 2.33 0.00 9 K 7.43 4.02 0.00 1.77 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.53 7.81 10 K 7.63 4.11 0.00 1.96 1.83 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.47 7.81 11 L 7.86 4.10 0.00 1.76 1.87 0.58 1.11 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 12 G 9.08 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 0.00 0.00 0.00 0.00 13 Y 7.61 4.84 0.00 3.04 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 14 T 7.74 4.56 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 1.18 0.00 0.00 15 F 8.40 4.23 0.00 2.86 3.22 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 16 K 9.20 4.03 0.00 1.74 1.85 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.33 7.81 17 D 9.39 4.82 0.00 2.68 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 18 K 8.72 3.96 0.00 1.88 1.81 0.00 1.62 0.00 0.00 1.87 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.55 7.81 19 S 8.04 4.66 0.00 4.05 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 0.00 20 L 7.54 3.95 0.00 1.86 2.12 1.00 1.64 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 21 L 7.11 3.61 0.00 0.27 0.92 0.52 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 22 E 7.85 3.88 0.00 2.19 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 2.29 2.24 0.00 23 K 8.21 3.93 0.00 1.85 1.84 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.50 7.81 24 A 7.58 4.16 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 25 L 8.06 4.44 0.00 1.77 1.84 0.84 0.84 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 26 T 7.23 4.65 4.46 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 1.40 0.00 0.00 27 H 9.22 4.55 0.00 3.33 3.36 0.00 5.60 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.06 3.71 1.09 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 0.53 0.00 0.00 0.69 0.00 0.00 29 S 8.37 4.30 0.00 4.10 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 30 Y 8.10 4.62 0.00 3.01 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 31 S 7.75 4.39 0.00 4.03 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 32 K 8.64 3.97 0.00 1.78 1.85 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.71 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.43 7.81 33 K 8.20 4.04 0.00 1.73 1.85 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.46 7.81 34 E 8.42 4.56 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 35 H 7.97 5.19 0.00 3.34 3.49 0.00 5.46 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 8.61 4.47 0.00 3.23 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 37 E 7.47 3.97 0.00 1.87 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 2.38 0.00 38 T 7.78 4.21 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 1.24 0.00 0.00 39 L 8.01 4.08 0.00 1.96 1.97 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.79 4.10 0.00 2.42 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.72 0.00 41 F 8.23 4.18 0.00 3.20 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 42 L 8.19 4.03 0.00 1.88 1.82 1.17 1.07 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 43 G 8.65 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 44 D 8.03 4.59 0.00 2.92 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 45 A 7.34 3.85 1.20 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 0.00 0.00 46 L 7.79 3.42 0.00 1.70 1.45 0.59 0.03 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 47 V 8.20 2.72 2.11 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 0.80 0.00 0.00 0.64 0.00 0.00 48 N 8.26 4.34 0.00 2.98 2.97 0.00 0.00 6.87 7.27 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 49 F 8.00 4.26 0.00 3.02 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 50 F 7.55 3.92 0.00 2.59 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 51 I 7.71 4.00 2.15 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.09 0.99 0.00 0.00 52 V 7.86 3.59 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 1.04 0.00 0.00 0.99 0.00 0.00 53 D 8.09 4.45 0.00 2.36 2.68 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 54 L 7.90 4.04 0.00 1.99 1.72 0.86 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.24 3.93 0.00 1.94 1.85 0.90 0.76 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 56 V 8.35 3.61 2.30 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 0.89 0.00 0.00 0.96 0.00 0.00 57 Q 7.82 3.93 0.00 2.21 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.21 2.42 0.00 58 Y 8.25 4.43 0.00 2.88 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 59 S 7.73 4.43 0.00 4.03 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 0.00 60 P 0.00 4.39 0.00 1.99 2.06 0.00 3.81 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 61 N 7.62 4.74 0.00 1.77 1.42 0.00 0.00 7.12 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 62 K 8.54 4.30 0.00 1.77 1.85 0.00 1.87 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.37 1.38 7.81 63 R 8.14 3.95 0.00 2.13 1.95 0.00 3.17 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 64 E 9.30 3.93 0.00 2.25 2.27 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 2.39 2.50 0.00 65 G 8.18 3.73 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 0.00 0.00 0.00 66 F 9.04 4.55 0.00 2.82 3.35 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 67 L 7.87 4.01 0.00 1.91 1.70 1.02 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.02 4.05 0.00 3.85 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 69 P 0.00 4.13 0.00 1.94 1.93 0.00 3.62 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 70 L 7.60 3.90 0.00 1.79 1.81 0.77 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 71 K 7.94 3.76 0.00 1.90 2.04 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.43 1.61 7.81 72 A 8.00 3.94 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 73 Y 7.78 4.24 0.00 2.96 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 74 L 8.08 3.00 0.00 1.64 1.65 0.84 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.32 3.91 1.64 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.62 0.95 0.00 0.00 76 S 8.10 4.15 0.00 4.06 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 0.00 77 E 8.51 3.93 0.00 2.04 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 2.38 2.42 0.00 78 E 8.02 4.02 0.00 2.22 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 2.47 2.48 0.00 79 F 8.74 4.15 0.00 2.23 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 80 F 8.38 3.95 0.00 3.01 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 81 N 8.00 4.19 0.00 2.99 2.80 0.00 0.00 6.93 6.37 0.00 0.00 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 L 7.03 4.36 0.00 1.25 1.46 1.12 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 83 L 6.97 3.67 0.00 0.35 0.20 0.36 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 84 A 7.50 3.99 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 85 Q 8.05 3.96 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 86 K 7.88 4.23 0.00 2.27 2.09 0.00 1.70 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.63 1.61 7.81 87 L 7.87 4.65 0.00 1.63 1.62 1.20 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.07 3.79 0.00 2.22 2.30 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 2.43 2.43 0.00 89 L 7.69 4.29 0.00 1.80 1.79 1.05 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 90 H 8.28 4.30 0.00 3.36 3.58 0.00 5.51 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 91 K 7.33 3.55 0.00 1.38 1.52 0.00 1.21 0.00 0.00 1.40 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.52 1.04 7.81 92 F 7.70 4.70 0.00 2.97 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 93 I 7.25 4.10 1.90 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 1.24 0.76 1.02 0.00 0.00 94 R 9.29 4.20 0.00 1.28 0.66 0.00 2.21 0.00 0.00 2.81 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.31 0.00 95 I 8.06 4.92 1.90 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 1.20 0.61 0.93 0.00 0.00 96 K 9.08 4.66 0.00 1.92 1.34 0.00 1.81 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.39 1.46 7.81 97 R 8.63 3.95 0.00 1.82 1.94 0.00 3.31 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 98 G 7.67 4.35 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 0.00 99 K 7.83 4.61 0.00 1.73 1.73 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.50 7.81 100 I 8.07 3.94 1.89 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 1.43 0.77 0.95 0.00 0.00 101 N 8.29 5.18 0.00 2.72 2.71 0.00 0.00 7.05 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 0.00 102 E 8.47 4.23 0.00 2.18 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 2.40 2.26 0.00 103 T 7.81 4.12 4.30 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 1.29 0.00 0.00 104 I 7.80 3.86 2.03 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.69 1.05 0.00 0.00 105 I 7.95 3.87 2.04 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 1.51 1.06 0.98 0.00 0.00 106 G 8.50 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 0.00 107 D 8.44 4.52 0.00 2.83 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 0.00 108 V 7.61 3.26 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 1.00 0.00 0.00 0.46 0.00 0.00 109 F 8.19 4.12 0.00 3.27 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 0.00 110 E 8.34 3.99 0.00 2.35 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 0.00 2.60 2.84 0.00 111 A 7.88 4.01 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 0.00 112 L 8.13 3.71 0.00 1.67 1.35 0.73 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 113 W 7.46 4.33 0.00 3.38 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 0.00 114 A 8.21 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.12 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.39 3.17 2.37 0.00 0.00 0.00 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 0.71 0.00 0.00 117 Y 8.39 4.56 0.00 3.15 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 0.00 118 I 7.99 3.39 1.89 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 1.26 0.65 0.87 0.00 0.00 119 D 8.50 4.48 0.00 2.79 2.52 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 0.00 120 S 7.66 4.47 0.00 3.95 3.75 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 0.00 121 G 7.53 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 0.00 0.00 0.00 122 R 7.30 2.84 0.00 1.78 1.75 0.00 3.02 0.00 0.00 3.02 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.24 0.00 123 D 7.54 4.86 0.00 2.98 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 0.00 124 A 8.54 4.18 1.40 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 0.00 0.00 125 N 8.27 4.23 0.00 2.92 2.90 0.00 0.00 6.77 8.13 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 0.00 126 F 8.39 4.06 0.00 3.21 3.18 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 0.00 127 T 8.00 3.77 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 1.70 0.00 0.00 128 R 7.69 2.00 0.00 1.06 1.40 0.00 2.99 0.00 0.00 2.90 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 129 E 7.58 3.66 0.00 1.89 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 2.42 2.44 0.00 130 L 7.52 3.79 0.00 1.41 1.86 1.02 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 131 F 7.72 3.67 0.00 2.43 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.42 4.42 0.00 3.04 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 0.00 133 K 8.29 3.79 0.00 1.74 1.79 0.00 1.67 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.55 7.81 134 L 7.12 3.83 0.00 0.27 0.13 1.08 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 135 F 7.33 4.95 0.00 2.65 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 0.00 136 K 8.22 3.94 0.00 1.68 1.84 0.00 1.15 0.00 0.00 1.37 0.00 0.00 2.60 0.00 0.00 2.33 0.00 0.00 0.00 0.00 1.16 1.07 7.81 137 E 8.03 3.91 0.00 2.03 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 2.36 2.35 0.00 138 D 7.98 4.63 0.00 2.85 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 0.00 139 I 7.78 3.89 1.98 0.00 0.00 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 1.83 1.10 0.92 0.00 0.00 140 L 7.89 3.91 0.00 1.78 1.57 0.37 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 141 S 8.16 4.24 0.00 4.08 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 0.00 142 A 7.90 4.07 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 0.00 143 I 7.77 3.64 1.89 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 1.56 0.86 0.99 0.00 0.00 144 K 7.61 4.29 0.00 1.94 1.93 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.45 1.56 7.81 145 E 8.19 3.67 0.00 2.08 2.01 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 2.17 2.29 0.00 146 G 8.22 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 0.00 147 R 7.68 3.82 0.00 1.83 2.12 0.00 3.27 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00