NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.5213 8.2493 123.5821 52.2449 20.1932 175.8300 2 V 4.2080 8.0457 117.7625 60.5320 34.5114 173.9504 3 G 4.3653 9.3270 107.0142 45.4684 0.0000 172.7248 4 N 4.8628 8.5706 115.3202 51.3836 41.0296 175.1948 5 A 4.4298 9.1098 128.1935 53.8599 18.6160 177.5107 6 T 4.3523 8.8362 105.0023 61.5738 69.4847 175.0074 7 Q 4.5821 7.7113 122.1703 53.5278 29.2359 173.5997 8 P 4.8097 0.0000 0.0000 62.3834 33.2813 174.9296 9 L 5.1051 8.9622 124.9141 53.3641 44.5902 174.6845 10 L 4.8509 8.7004 129.2411 53.7578 43.8449 175.0314 11 V 4.5602 8.9839 127.3235 61.2988 33.8525 174.6177 12 V 4.5283 8.7670 129.9237 61.4452 32.1371 173.7653 13 E 4.8754 8.6668 128.5322 54.6432 31.9296 174.7093 14 D 4.4275 8.8694 125.8946 54.3539 40.6594 176.7929 15 S 4.3669 8.5850 116.3688 57.5193 63.0023 173.9758 16 D 4.4287 8.6990 129.9490 57.6118 40.6383 178.6027 17 E 4.0076 8.1392 118.5498 59.4084 29.5816 178.8909 18 D 4.3516 8.1478 118.9530 57.3940 40.9490 178.6911 19 F 4.1338 8.4633 121.2109 61.2602 39.3665 177.0724 20 S 3.9633 8.5605 113.1430 61.6901 62.3299 176.2276 21 T 3.8062 8.1259 118.6306 66.5016 68.1824 176.3721 22 F 4.0082 8.1735 122.4372 61.3123 39.4476 176.8372 23 Q 3.5209 8.1171 119.4188 59.2138 28.7423 178.5832 24 R 3.8504 7.9524 119.0244 59.1498 29.8064 179.0533 25 L 3.9159 7.6392 118.5871 57.7174 41.6024 179.5848 26 L 3.9362 7.4692 118.9537 57.7368 41.4660 179.5735 27 Q 3.9800 7.9009 118.1130 58.8880 28.3896 178.8873 28 R 4.0068 7.9570 118.2085 58.4161 30.1527 177.8267 29 E 4.4266 7.5235 114.9262 55.4281 30.2093 176.4667 30 G 3.8231 7.9299 107.8416 46.0996 0.0000 173.5325 31 V 4.2017 7.6036 119.8379 63.2073 31.3740 176.2515 32 V 4.2680 8.6916 119.9499 61.5186 33.4670 175.7350 33 N 4.8498 8.1523 119.8174 52.6463 39.7434 172.5556 34 P 4.7285 0.0000 0.0000 62.9136 32.9431 174.9379 35 I 5.0031 8.2486 124.0353 60.0423 38.9769 174.4004 36 Y 4.6715 9.0754 124.8378 56.0552 40.7010 174.6404 37 R 4.9618 8.6139 123.5285 54.6341 32.7543 174.4574 38 C 4.7618 8.6427 122.7020 58.2861 31.2259 174.9051 39 I 4.0695 9.1666 123.6834 62.4681 38.1780 176.8262 40 T 4.7507 7.5496 109.5727 59.7160 72.3976 175.5522 41 G 4.0938 8.0415 110.1071 47.4297 0.0000 175.9895 42 D 4.2482 7.8276 120.7212 57.2406 40.7728 178.7036 43 Q 3.9668 8.1052 118.4329 58.7147 28.6753 178.4156 44 A 3.9016 7.8248 121.7566 55.2600 18.3360 179.7521 45 L 4.0019 8.0636 117.4259 57.9550 41.7545 179.2029 46 D 4.4765 8.2784 118.0737 57.3105 40.6606 178.1029 47 F 3.9952 8.7901 121.5055 61.4348 39.2375 177.1913 48 L 4.1145 8.1016 117.3133 57.7375 41.5440 178.3478 49 Y 4.3869 8.2225 114.0362 57.4196 38.4428 175.2605 50 Q 3.4797 7.6548 117.0381 57.0943 27.1388 175.4849 51 T 3.8972 7.9790 115.8849 65.0931 68.7107 176.5830 52 G 4.3666 8.4104 106.9005 46.2121 0.0000 174.1104 53 S 4.2162 8.1605 116.3056 59.8842 63.1805 174.7549 54 Y 4.7601 8.3227 115.0521 57.9026 40.4668 175.5120 55 C 4.8302 8.7520 116.9690 57.4074 32.1906 172.8167 56 N 4.5634 8.7312 122.6302 52.7451 38.9756 173.9320 57 P 4.1380 0.0000 0.0000 65.6245 31.6300 178.2599 58 D 4.3871 8.5917 119.0705 56.2920 40.7391 176.9585 59 I 4.4638 7.3697 111.4442 60.4232 37.8625 176.0677 60 A 3.8092 7.1949 124.5036 49.6829 18.2327 175.0371 61 P 4.2692 0.0000 0.0000 61.4467 32.5686 177.3594 62 R 4.0025 8.2016 120.5553 55.5694 30.4744 174.7099 63 P 4.6093 0.0000 0.0000 62.5848 32.3400 175.9190 64 A 4.3658 8.7553 122.0896 54.1162 19.5640 178.0443 65 V 4.5292 7.6228 113.5594 61.4638 35.7510 173.7817 66 I 4.9270 8.4999 126.7082 59.3350 40.5498 174.0710 67 L 4.8709 8.9357 129.6758 53.2506 44.0026 174.6270 68 L 4.8585 8.6689 129.0364 53.1383 45.0409 174.6178 69 D 5.1398 8.2235 125.4795 52.7083 42.4066 177.2075 70 L 3.9864 8.4737 124.8447 57.2321 43.1626 176.0937 71 N 4.9461 8.4437 116.7887 52.0686 38.8404 174.9812 72 L 4.8859 8.1331 122.8355 52.1280 46.1504 174.8176 73 P 4.3952 0.0000 0.0000 63.6216 33.1006 177.1773 74 G 3.8980 8.3280 107.0398 46.5841 0.0000 174.9877 75 T 3.9195 8.6345 121.2678 63.2784 68.9613 174.1271 76 D 5.0155 8.4997 126.5276 52.4746 42.0491 177.5794 77 G 3.8415 8.3944 108.0914 47.2631 0.0000 176.3095 78 R 3.8766 7.9231 119.8081 59.3635 30.1740 178.8017 79 E 3.9543 8.7083 118.5678 59.0420 29.3580 179.5368 80 V 3.5062 7.6421 118.4822 65.8288 31.6159 177.7312 81 L 3.7989 7.9814 120.2336 58.3482 41.6764 178.9309 82 Q 3.2959 7.3757 116.1414 58.7474 28.9247 178.5080 83 E 4.1305 8.0944 119.5128 59.4104 29.6553 179.2945 84 I 3.6275 7.8022 119.8782 64.3999 37.0532 178.1188 85 K 4.3174 7.8006 115.5406 57.6601 31.9925 178.1067 86 Q 4.4769 7.7426 117.6814 54.9808 29.9053 174.7331 87 D 4.7696 7.5287 121.0582 52.7262 42.2183 176.6234 88 E 3.9660 8.9749 127.0054 59.0076 29.6789 178.6401 89 V 3.9321 7.8156 117.3866 65.4743 32.1710 177.9135 90 L 4.0123 8.4111 118.9830 57.2608 41.1628 179.4266 91 K 4.1100 7.9871 117.8862 59.2492 32.4835 178.6818 92 K 4.2970 7.6536 118.4632 57.1737 32.2688 176.8816 93 I 3.9774 7.1770 121.1118 60.1176 37.6912 174.4836 94 P 4.2585 0.0000 0.0000 63.0767 32.4764 175.2271 95 V 4.5344 8.3743 124.0152 60.9753 34.2297 173.9704 96 V 4.6468 8.6753 128.4864 61.1284 33.7384 174.4374 97 I 4.2964 8.3881 129.7655 60.9872 38.5046 174.8149 98 M 5.4153 8.5949 126.0392 53.2716 35.1158 173.6530 99 T 4.7912 7.9570 119.8335 61.0207 71.2688 174.0824 100 T 4.2613 8.4874 112.9715 62.8299 69.5238 175.1451 101 S 4.2525 7.8844 118.4396 58.4905 62.5828 173.5373 102 S 4.7409 8.5423 120.6340 57.6163 63.6004 173.8993 103 N 4.3212 7.8429 120.0433 53.7553 39.6008 173.5892 104 P 4.2029 0.0000 0.0000 65.6478 31.3951 178.5904 105 K 3.9368 8.1826 117.8613 59.5854 32.1420 178.4649 106 D 4.4170 8.0585 118.6633 57.3833 40.8523 178.6231 107 I 3.3101 7.5643 120.1645 64.2646 37.0794 178.2363 108 E 4.0423 8.3572 119.4225 59.6087 29.1391 179.5020 109 I 3.7378 7.7308 118.2313 64.6027 37.5071 177.8875 110 C 4.3891 8.4395 117.6771 63.4123 27.9297 176.0668 111 Y 4.2630 8.1611 117.7352 60.9612 37.1486 178.7268 112 S 4.3107 8.0256 115.5441 60.9100 62.8748 175.0683 113 Y 4.4529 7.6777 117.3684 56.6257 38.5719 175.4678 114 S 3.8534 8.2583 115.0891 59.4189 60.8138 172.2394 115 I 3.9913 7.5589 111.8870 60.9314 38.3841 176.3832 116 S 4.6557 8.9576 118.3551 61.6495 63.2287 174.8464 117 S 4.9666 7.4560 110.8033 58.5177 65.5986 174.5430 118 Y 4.9150 9.0452 121.9424 55.8985 41.0412 174.6387 119 I 4.7320 8.8017 127.0849 59.5170 40.8214 174.5319 120 V 4.5789 8.5876 127.2571 61.5982 32.5251 175.5190 121 K 4.1626 8.8602 128.8792 56.1022 32.2319 175.1798 122 P 4.5884 0.0000 0.0000 62.0507 32.5872 176.4691 123 L 4.1236 8.5182 121.1987 57.7810 42.0830 178.6158 124 E 4.0746 8.0596 118.5289 56.2932 30.6738 177.9102 125 I 3.7041 8.4087 124.7422 64.4950 37.2945 178.0677 126 D 4.2970 8.0290 118.3499 57.4148 41.1294 178.1651 127 R 3.9241 7.9213 118.7621 59.2672 30.0801 178.0593 128 L 3.9927 8.3685 120.6916 58.2925 41.9801 179.1110 129 T 3.8508 8.2556 116.1076 66.6280 68.4450 176.2309 130 E 3.9504 8.2095 121.2064 59.4946 29.6103 178.9407 131 T 3.9209 8.1178 115.7927 66.8166 68.5524 176.8479 132 V 3.7769 8.1818 120.3795 66.1447 31.5693 178.0338 133 Q 4.0642 8.5046 118.1898 59.3360 28.4383 179.0179 134 T 3.9995 8.1746 116.8533 66.3985 68.4552 176.5645 135 F 4.3366 8.6371 122.7536 61.4729 39.4410 177.2301 136 I 3.8682 8.3717 119.3569 64.5072 36.9947 178.5594 137 K 3.9806 8.0636 119.1962 59.5770 31.8036 178.7998 138 Y 3.7225 8.2619 119.9247 60.5759 38.5633 177.9849 139 W 4.0400 7.8667 118.5746 58.8621 29.5026 177.4366 140 L 4.4713 8.0987 117.0804 55.1640 42.0516 177.2138 141 D 4.5328 7.9349 115.4374 55.8608 43.2240 176.7883 142 I 3.7636 7.6360 118.2084 63.9897 37.3853 176.9520 143 V 3.2904 7.0083 119.3788 62.7742 31.7458 175.4836 144 V 4.1093 7.9734 125.2029 61.3014 31.9081 175.3956 145 L 4.5795 8.2250 127.6106 52.7430 42.9022 175.1161 146 P 4.4325 0.0000 0.0000 62.4860 32.1378 175.6458 147 E 4.0927 8.4732 121.7965 57.1847 27.7808 177.6826 148 M 3.2304 8.4561 118.7049 54.5925 31.2161 177.3339 149 G 4.0190 7.5953 112.1925 45.5986 0.0000 173.2271 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 8.25 4.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 V 8.05 4.21 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 0.80 0.00 0.00 0.94 0.00 0.00 3 G 9.33 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 N 8.57 4.86 0.00 2.70 2.77 0.00 0.00 6.80 8.21 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 5 A 9.11 4.43 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 6 T 8.84 4.35 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 1.24 0.00 0.00 7 Q 7.71 4.58 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 8 P 0.00 4.81 0.00 2.17 2.28 0.00 3.60 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 9 L 8.96 5.11 0.00 1.91 1.66 1.11 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.70 4.85 0.00 1.66 1.40 0.23 0.12 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 11 V 8.98 4.56 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 0.81 0.00 0.00 1.07 0.00 0.00 12 V 8.77 4.53 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 0.74 0.00 0.00 0.76 0.00 0.00 13 E 8.67 4.88 0.00 1.87 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 0.00 2.27 2.48 0.00 14 D 8.87 4.43 0.00 2.76 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.59 4.37 0.00 3.88 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 16 D 8.70 4.43 0.00 2.75 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 17 E 8.14 4.01 0.00 1.99 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 2.41 2.35 0.00 18 D 8.15 4.35 0.00 2.87 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 19 F 8.46 4.13 0.00 3.12 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 20 S 8.56 3.96 0.00 4.04 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 21 T 8.13 3.81 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 1.21 0.00 0.00 22 F 8.17 4.01 0.00 3.05 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 23 Q 8.12 3.52 0.00 1.31 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.30 2.20 0.00 24 R 7.95 3.85 0.00 1.95 1.89 0.00 3.14 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 25 L 7.64 3.92 0.00 1.67 1.58 0.90 0.46 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 26 L 7.47 3.94 0.00 1.51 1.53 -0.08 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 7.90 3.98 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 28 R 7.96 4.01 0.00 1.89 1.96 0.00 3.28 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 29 E 7.52 4.43 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 30 G 7.93 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 31 V 7.60 4.20 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 0.85 0.00 0.00 0.98 0.00 0.00 32 V 8.69 4.27 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 0.90 0.00 0.00 1.00 0.00 0.00 33 N 8.15 4.85 0.00 2.80 2.99 0.00 0.00 6.89 8.03 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 34 P 0.00 4.73 0.00 2.19 2.23 0.00 3.77 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.16 0.00 35 I 8.25 5.00 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.81 1.16 0.00 0.00 36 Y 9.08 4.67 0.00 2.90 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 37 R 8.61 4.96 0.00 1.14 1.35 0.00 2.21 0.00 0.00 2.55 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.91 0.00 38 C 8.64 4.76 0.00 2.66 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 39 I 9.17 4.07 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.38 0.84 0.00 0.00 40 T 7.55 4.75 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 1.12 0.00 0.00 41 G 8.04 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 D 7.83 4.25 0.00 2.21 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 0.00 0.00 0.00 43 Q 8.11 3.97 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.23 0.00 44 A 7.82 3.90 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 45 L 8.06 4.00 0.00 1.79 1.94 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.28 4.48 0.00 3.23 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 F 8.79 4.00 0.00 3.21 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.10 4.11 0.00 1.50 1.47 0.80 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.22 4.39 0.00 3.15 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 50 Q 7.65 3.48 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 51 T 7.98 3.90 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 1.21 0.00 0.00 52 G 8.41 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.16 4.22 0.00 3.71 3.41 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 54 Y 8.32 4.76 0.00 2.98 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 55 C 8.75 4.83 0.00 2.97 2.83 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 56 N 8.73 4.56 0.00 2.72 2.70 0.00 0.00 6.94 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.14 0.00 2.17 2.22 0.00 3.71 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 58 D 8.59 4.39 0.00 2.83 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 59 I 7.37 4.46 1.97 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 1.29 0.73 0.94 0.00 0.00 60 A 7.19 3.81 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.27 0.00 2.10 1.97 0.00 2.90 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.77 0.00 62 R 8.20 4.00 0.00 1.75 1.86 0.00 3.22 0.00 0.00 3.51 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.60 0.00 63 P 0.00 4.61 0.00 2.41 2.05 0.00 3.84 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 64 A 8.76 4.37 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 65 V 7.62 4.53 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 0.54 0.00 0.00 0.92 0.00 0.00 66 I 8.50 4.93 1.74 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.50 0.78 0.00 0.00 67 L 8.94 4.87 0.00 1.55 1.30 0.66 -0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.67 4.86 0.00 1.59 1.30 0.80 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.22 5.14 0.00 2.63 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 70 L 8.47 3.99 0.00 1.60 1.67 1.01 0.63 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 71 N 8.44 4.95 0.00 2.56 2.75 0.00 0.00 6.78 7.37 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 72 L 8.13 4.89 0.00 1.39 1.42 0.86 1.12 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 73 P 0.00 4.40 0.00 2.17 2.13 0.00 3.84 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.90 0.00 74 G 8.33 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 75 T 8.63 3.92 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 1.23 0.00 0.00 76 D 8.50 5.02 0.00 2.94 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 77 G 8.39 3.84 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 0.00 0.00 0.00 78 R 7.92 3.88 0.00 2.08 1.98 0.00 3.26 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 79 E 8.71 3.95 0.00 2.20 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 2.30 2.29 0.00 80 V 7.64 3.51 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 0.92 0.00 0.00 0.89 0.00 0.00 81 L 7.98 3.80 0.00 1.66 1.65 0.84 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 7.38 3.30 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.73 0.00 0.00 0.00 0.00 0.00 1.20 2.12 0.00 83 E 8.09 4.13 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 84 I 7.80 3.63 1.93 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.31 0.82 0.00 0.00 85 K 7.80 4.32 0.00 1.73 1.97 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.58 1.82 7.81 86 Q 7.74 4.48 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.71 0.00 0.00 0.00 0.00 0.00 2.69 2.53 0.00 87 D 7.53 4.77 0.00 2.87 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 88 E 8.97 3.97 0.00 2.01 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 2.32 2.46 0.00 89 V 7.82 3.93 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.95 0.00 0.00 90 L 8.41 4.01 0.00 1.73 1.55 0.10 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.99 4.11 0.00 1.95 2.17 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.68 1.51 7.81 92 K 7.65 4.30 0.00 1.86 1.92 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.49 7.81 93 I 7.18 3.98 1.89 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 1.34 0.53 0.90 0.00 0.00 94 P 0.00 4.26 0.00 1.79 1.95 0.00 3.74 0.00 0.00 3.90 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 95 V 8.37 4.53 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 0.93 0.00 0.00 0.92 0.00 0.00 96 V 8.68 4.65 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 1.14 0.00 0.00 0.46 0.00 0.00 97 I 8.39 4.30 1.26 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.49 0.26 0.00 0.00 98 M 8.59 5.42 0.00 1.78 1.65 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.12 0.00 99 T 7.96 4.79 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 0.99 0.00 0.00 100 T 8.49 4.26 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 1.20 0.00 0.00 101 S 7.88 4.25 0.00 3.94 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 0.00 102 S 8.54 4.74 0.00 3.99 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 0.00 103 N 7.84 4.32 0.00 2.89 2.78 0.00 0.00 7.20 7.59 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 0.00 104 P 0.00 4.20 0.00 2.18 2.08 0.00 3.65 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 105 K 8.18 3.94 0.00 1.87 1.92 0.00 1.64 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.62 7.81 106 D 8.06 4.42 0.00 2.97 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 0.00 107 I 7.56 3.31 1.85 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.43 0.90 0.00 0.00 108 E 8.36 4.04 0.00 2.20 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 0.00 2.40 2.40 0.00 109 I 7.73 3.74 1.98 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.68 1.14 0.00 0.00 110 C 8.44 4.39 0.00 3.23 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 0.00 111 Y 8.16 4.26 0.00 3.18 3.01 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 0.00 112 S 8.03 4.31 0.00 3.94 3.71 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 0.00 113 Y 7.68 4.45 0.00 3.17 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 8.26 3.85 0.00 4.11 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 0.00 115 I 7.56 3.99 1.77 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.22 0.92 0.00 0.00 116 S 8.96 4.66 0.00 3.98 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 0.00 117 S 7.46 4.97 0.00 4.07 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 0.00 118 Y 9.05 4.92 0.00 2.73 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 0.00 119 I 8.80 4.73 1.95 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.71 0.96 0.00 0.00 120 V 8.59 4.58 2.17 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 0.84 0.00 0.00 1.19 0.00 0.00 121 K 8.86 4.16 0.00 1.62 1.74 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.38 7.81 122 P 0.00 4.59 0.00 2.19 2.06 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 123 L 8.52 4.12 0.00 1.67 1.77 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 124 E 8.06 4.07 0.00 2.06 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 2.41 2.47 0.00 125 I 8.41 3.70 1.87 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 1.53 0.99 0.91 0.00 0.00 126 D 8.03 4.30 0.00 2.71 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 0.00 127 R 7.92 3.92 0.00 1.98 2.06 0.00 3.31 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 128 L 8.37 3.99 0.00 1.86 1.80 0.95 0.74 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 0.00 129 T 8.26 3.85 4.41 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 1.21 0.00 0.00 130 E 8.21 3.95 0.00 2.21 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 2.33 2.43 0.00 131 T 8.12 3.92 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 1.29 0.00 0.00 132 V 8.18 3.78 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 0.97 0.00 0.00 1.12 0.00 0.00 133 Q 8.50 4.06 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 134 T 8.17 4.00 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 1.24 0.00 0.00 135 F 8.64 4.34 0.00 3.36 3.42 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 0.00 136 I 8.37 3.87 2.16 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 1.71 1.14 0.97 0.00 0.00 137 K 8.06 3.98 0.00 2.00 1.88 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.64 7.81 138 Y 8.26 3.72 0.00 2.96 2.61 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 0.00 139 W 7.87 4.04 0.00 2.84 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 0.00 140 L 8.10 4.47 0.00 1.89 1.74 1.13 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 141 D 7.93 4.53 0.00 2.57 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 0.00 142 I 7.64 3.76 1.65 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.69 0.68 0.00 0.00 143 V 7.01 3.29 1.73 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 0.59 0.00 0.00 -0.39 0.00 0.00 144 V 7.97 4.11 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 0.87 0.00 0.00 0.89 0.00 0.00 145 L 8.23 4.58 0.00 1.72 1.63 1.05 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 146 P 0.00 4.43 0.00 2.19 2.08 0.00 3.85 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.18 0.00 147 E 8.47 4.09 0.00 2.03 1.93 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 2.39 2.36 0.00 148 M 8.46 3.23 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 149 G 7.60 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 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