NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 P 4.4021 0.0000 0.0000 62.5002 33.2877 177.3266 8 E 4.1786 7.9926 113.9140 55.0980 30.1893 175.7573 9 T 4.1095 8.4207 111.8581 61.1690 71.8835 174.5909 10 L 3.9658 8.4743 122.7564 58.2343 41.7190 179.4988 11 E 3.9723 8.3311 117.4855 59.7029 29.5863 179.2107 12 A 4.0485 8.1134 120.3894 55.1924 18.3253 179.9782 13 R 3.8995 8.3255 116.6912 59.5766 30.2888 179.1881 14 I 3.4014 8.4911 118.7001 63.8762 37.6154 177.6650 15 N 4.2940 7.9713 116.9693 56.1670 38.5220 177.0398 16 R 3.9796 7.9018 119.4217 59.3456 30.0369 178.4415 17 A 3.9533 8.1939 119.8843 54.0639 18.5753 178.0938 18 T 4.0860 7.4959 105.9283 60.8837 69.5157 173.1943 19 N 4.0859 7.6951 121.8796 53.8826 39.0639 174.0845 20 P 4.4294 0.0000 0.0000 65.0187 31.5855 177.0355 21 L 4.4092 8.6269 116.8843 54.9825 41.9817 176.7565 22 N 4.5601 8.0839 118.0395 53.2874 38.8184 175.4166 23 K 4.1815 8.8929 123.6050 58.7683 32.4961 176.6045 24 E 4.9238 7.8132 113.6371 53.8562 32.8003 174.6747 25 L 3.7392 8.7350 118.9631 55.7779 41.9766 178.4962 26 D 4.6297 8.0612 123.3841 52.5306 39.5620 176.3776 27 W 4.2191 8.2736 124.5712 59.1826 29.4894 177.3581 28 A 4.0661 8.1731 120.3185 55.3199 17.9522 179.7529 29 S 4.1505 8.3783 113.6470 61.5202 63.0796 176.7734 30 I 3.6308 8.0485 122.9528 64.6937 36.8118 178.3016 31 N 4.5901 9.0173 117.6971 56.2682 38.1419 177.8267 32 G 3.6041 8.1041 106.3653 47.3829 0.0000 175.4583 33 F 4.1855 8.1882 122.7870 61.5255 39.6502 176.5554 34 C 4.0721 8.1571 115.7790 60.2048 39.7886 176.0965 35 E 3.7826 8.3232 119.0146 58.5111 29.3553 178.1755 36 Q 4.2313 7.5501 118.5534 56.9808 29.5435 177.2843 37 L 3.8237 7.1249 120.2467 58.0050 39.5735 177.8590 38 N 4.5391 7.5608 115.6124 52.4892 37.5243 176.2123 39 E 4.0356 7.8988 120.9368 58.4550 29.9874 176.0896 40 D 5.0489 7.3457 117.9697 52.0623 44.8594 176.4904 41 F 4.0666 9.0459 123.1607 61.5171 39.6935 175.8967 42 E 4.1761 8.4178 116.6551 56.3830 29.8274 178.2679 43 G 3.9530 7.5870 109.0929 47.3049 0.0000 174.2675 44 P 4.3228 0.0000 0.0000 64.8045 31.4443 177.0699 45 P 4.3344 0.0000 0.0000 64.4404 31.1984 178.4888 46 L 3.9413 7.8181 118.9062 57.9868 42.0289 178.6691 47 A 4.2724 8.5761 121.3819 55.6922 17.8609 179.7885 48 T 3.7965 7.9796 108.0848 64.8018 68.6655 177.1562 49 R 4.0529 8.0261 120.9460 59.1014 30.1385 178.9551 50 L 4.0888 8.3835 119.1069 57.8799 41.5663 179.6644 51 L 4.0110 8.3169 118.6999 57.6905 41.4537 179.2579 52 A 4.0228 8.5132 120.8515 55.5029 18.0694 179.2263 53 H 4.1503 7.8593 115.6441 59.4638 30.3073 177.3642 54 K 4.0212 7.9072 119.8577 59.5498 31.6253 179.4734 55 I 3.8111 7.9320 119.3721 63.8191 36.9832 177.4038 56 Q 4.4075 7.2614 116.9727 54.6827 29.0299 175.7368 57 S 4.1803 7.2761 116.1147 57.5468 62.8377 172.8611 58 P 4.2534 0.0000 0.0000 65.0554 31.6578 176.9193 59 Q 4.3034 8.1406 118.2288 54.5513 28.9369 175.6770 60 E 3.9632 8.8865 126.9951 59.4522 29.6067 178.5915 61 W 4.6487 8.2207 127.4970 60.2655 30.7948 177.5326 62 E 3.8554 8.4238 120.2916 58.3495 29.1574 178.4155 63 A 4.0673 7.8266 120.4291 55.3465 18.5616 179.6320 64 I 3.6688 8.1218 118.6972 64.7280 37.1208 178.7773 65 Q 3.5552 7.6270 118.5735 58.5612 28.3339 178.6099 66 A 3.8120 7.7610 121.8442 55.1603 18.3754 179.7232 67 L 4.0568 8.0440 117.4528 58.1789 41.5457 179.9531 68 T 3.9573 7.7311 115.8379 66.3511 68.2559 176.9351 69 V 3.4706 7.8794 120.6142 65.8381 31.6606 177.6044 70 L 4.1192 8.5512 120.3865 58.3817 41.8272 178.5369 71 E 4.2851 8.7879 119.4215 59.7473 29.6317 178.8612 72 T 4.0045 8.3029 115.8403 67.1406 68.5469 176.1203 73 C 4.2449 8.5352 118.3584 60.0274 39.8304 176.1196 74 M 4.1779 7.9800 119.6565 58.2254 31.5934 178.4845 75 K 4.2334 7.9366 117.6937 58.8807 32.4031 178.8791 76 S 4.4571 8.0872 114.2051 59.0564 63.3795 174.2189 77 C 4.4785 7.7167 118.7914 58.3539 30.2651 173.1481 78 G 4.1169 7.7684 109.5735 44.6708 0.0000 174.2028 79 K 3.8384 8.6248 118.6572 59.6022 32.0320 179.8776 80 R 3.8144 7.9466 117.8527 59.4992 30.0360 178.6331 81 F 4.0065 7.9917 119.5842 61.3368 39.4113 176.8364 82 H 3.9474 8.0911 115.9336 58.8942 28.2509 177.4585 83 D 4.2136 8.2298 119.9434 57.3573 40.5473 178.4724 84 E 3.9316 7.6333 119.1382 59.2040 29.2722 179.4286 85 V 3.1831 6.9831 117.1514 64.8222 31.5109 177.3271 86 G 3.7242 7.5218 103.3907 44.0045 0.0000 173.5275 87 K 4.2851 6.9919 120.8987 54.8498 33.7707 177.9073 88 F 4.4571 8.3097 120.8139 60.8345 38.5532 177.7389 89 R 4.0986 8.2143 117.2304 59.0267 29.9264 177.2756 90 F 4.5452 7.9371 118.9596 60.1759 40.1661 177.2416 91 L 4.0302 8.2323 118.8241 58.1410 41.3967 179.1716 92 N 4.2169 8.7248 116.4662 56.6303 38.2919 177.2599 93 E 3.8055 7.6052 117.9621 59.1122 29.8126 179.1720 94 L 4.0456 7.3374 118.6844 57.5846 41.9397 178.9681 95 I 3.6755 7.7894 119.8120 64.4793 36.9734 178.4925 96 K 3.7158 8.0905 119.3423 59.4254 31.8097 179.5464 97 V 3.6017 7.6227 118.2408 65.6825 31.2452 178.0645 98 V 3.9000 7.6196 109.9091 62.3890 32.4136 175.9336 99 S 4.5071 8.0931 116.0783 56.5731 62.7932 173.0437 100 P 4.4191 0.0000 0.0000 65.5241 31.2942 178.3286 101 K 4.0303 7.8754 117.8596 58.0923 33.7548 176.6926 102 Y 4.2549 7.8664 112.9374 58.1715 38.5722 176.0584 103 L 4.5568 5.7015 132.5599 55.1719 43.9374 178.6045 104 G 4.0416 8.6220 109.4866 49.3260 0.0000 175.2281 105 S 4.4224 8.0092 110.9645 59.1888 62.4622 174.0179 106 R 4.6145 8.1655 116.0070 56.5447 31.6217 175.0574 107 T 4.5970 7.5100 115.1898 61.4201 70.6222 175.4331 108 S 4.3449 8.3420 120.2935 58.2616 65.1141 175.1743 109 E 3.9214 8.6303 123.2409 59.1540 29.5950 178.6606 110 K 3.8244 8.1208 119.3150 59.8139 32.3100 178.6068 111 V 3.6277 7.4854 117.4993 66.0150 31.4787 178.1619 112 K 4.0281 7.9676 117.8089 59.5768 31.8993 179.1896 113 N 4.4099 8.3327 116.8417 55.7579 38.3211 177.3405 114 K 3.8444 7.9105 120.7905 59.6858 32.2467 178.7041 115 I 3.6337 7.5551 119.4115 64.4524 37.0328 178.4128 116 L 4.0547 7.9450 119.5675 57.7927 41.4217 179.3091 117 E 3.9854 8.6351 118.7616 59.5127 29.4842 179.3661 118 L 3.4135 7.9069 119.0387 57.5341 41.3522 179.5947 119 L 3.5944 7.3967 117.6409 57.7961 41.8461 178.6926 120 Y 3.4951 8.0326 120.7849 59.9361 38.7003 177.9983 121 S 3.7031 7.8269 115.1827 61.5082 62.7865 176.6270 122 W 4.5122 7.7083 122.2258 59.3140 28.8846 178.7027 123 T 3.9526 7.8066 110.4123 64.7518 67.9882 177.0896 124 V 3.7773 7.2427 113.9136 63.4106 31.8722 178.0049 125 G 3.8611 8.2791 104.6106 45.5841 0.0000 173.7373 126 L 5.5881 8.5626 120.6247 51.7099 42.3493 176.1497 127 P 4.4454 0.0000 0.0000 65.2145 31.8921 177.5345 128 E 3.9372 8.2813 118.9932 59.4484 29.4068 176.4990 129 E 4.4636 8.5846 122.2064 55.3713 28.9703 177.9126 130 V 3.6414 8.3447 125.4705 64.8144 31.2469 178.1960 131 K 3.9914 7.9444 119.0064 59.0943 31.6723 178.9292 132 I 3.9567 7.3401 119.7739 64.5536 36.9950 178.3367 133 A 4.1189 8.0070 120.9668 55.0325 18.2932 178.8010 134 E 3.9966 8.7799 118.0618 59.6764 29.8896 178.8180 135 A 4.0963 9.5547 121.3298 55.6214 18.2872 179.0160 136 Y 4.1022 8.3207 117.0771 60.7466 39.0572 177.4455 137 Q 4.0783 8.8358 121.0989 59.6221 29.1058 177.9047 138 M 3.9245 8.3673 118.9991 58.9937 32.1909 178.3943 139 L 3.9209 7.7240 118.5868 57.3533 41.5486 179.4096 140 K 3.7745 7.9318 119.9427 59.1317 31.9180 178.8928 141 K 3.9193 7.7849 118.2608 59.6072 32.4233 178.2506 142 Q 4.1297 8.0964 118.1091 57.4455 28.9220 176.7848 143 G 3.9356 7.5122 107.4830 45.8613 0.0000 174.4001 144 I 3.9388 7.5986 121.8798 63.6819 37.6364 177.9138 145 V 3.4831 7.7311 118.6683 64.9480 31.6240 175.7018 146 K 4.1492 7.8874 121.8245 56.9168 31.9770 175.1537 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 7 P 0.00 4.40 0.00 2.06 2.18 0.00 3.64 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.12 0.00 8 E 7.99 4.18 0.00 2.01 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 2.27 2.42 0.00 9 T 8.42 4.11 4.40 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 1.22 0.00 0.00 10 L 8.47 3.97 0.00 1.75 1.87 0.48 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.33 3.97 0.00 2.08 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 0.00 2.43 2.50 0.00 12 A 8.11 4.05 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.33 3.90 0.00 2.23 2.17 0.00 3.13 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 14 I 8.49 3.40 1.65 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.96 1.03 0.00 0.00 15 N 7.97 4.29 0.00 2.91 2.85 0.00 0.00 6.97 7.34 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 16 R 7.90 3.98 0.00 2.06 1.89 0.00 3.10 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 17 A 8.19 3.95 1.15 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 0.00 0.00 18 T 7.50 4.09 4.14 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 1.00 0.00 0.00 19 N 7.70 4.09 0.00 2.79 2.91 0.00 0.00 7.22 7.56 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 20 P 0.00 4.43 0.00 2.13 2.17 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.19 0.00 21 L 8.63 4.41 0.00 1.75 1.75 0.94 1.06 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 22 N 8.08 4.56 0.00 2.98 3.16 0.00 0.00 6.97 7.09 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 23 K 8.89 4.18 0.00 1.79 1.88 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.40 7.81 24 E 7.81 4.92 0.00 2.12 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 2.23 2.40 0.00 25 L 8.74 3.74 0.00 1.60 0.84 1.04 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.06 4.63 0.00 2.68 2.43 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 27 W 8.27 4.22 0.00 3.52 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 28 A 8.17 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.38 4.15 0.00 4.12 3.89 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 30 I 8.05 3.63 1.98 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.95 0.92 0.00 0.00 31 N 9.02 4.59 0.00 2.90 2.93 0.00 0.00 6.99 8.24 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 32 G 8.10 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 33 F 8.19 4.19 0.00 3.09 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 34 C 8.16 4.07 0.00 3.19 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 35 E 8.32 3.78 0.00 2.08 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 2.41 2.44 0.00 36 Q 7.55 4.23 0.00 2.23 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 37 L 7.12 3.82 0.00 1.78 1.30 0.76 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 38 N 7.56 4.54 0.00 2.82 2.99 0.00 0.00 5.93 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 39 E 7.90 4.04 0.00 1.93 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 0.00 2.30 2.39 0.00 40 D 7.35 5.05 0.00 2.86 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 41 F 9.05 4.07 0.00 2.98 3.06 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 42 E 8.42 4.18 0.00 2.19 2.32 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 2.40 2.32 0.00 43 G 7.59 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.32 0.00 2.06 2.15 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 2.02 2.14 0.00 45 P 0.00 4.33 0.00 2.09 2.11 0.00 3.84 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 46 L 7.82 3.94 0.00 1.87 1.89 0.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.58 4.27 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 48 T 7.98 3.80 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 49 R 8.03 4.05 0.00 2.17 2.08 0.00 3.16 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 50 L 8.38 4.09 0.00 2.00 1.80 1.10 0.68 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 51 L 8.32 4.01 0.00 2.13 1.95 1.21 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.51 4.02 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 H 7.86 4.15 0.00 3.12 3.53 0.00 5.77 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 54 K 7.91 4.02 0.00 1.88 1.75 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.64 1.52 7.81 55 I 7.93 3.81 2.06 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.65 0.91 0.00 0.00 56 Q 7.26 4.41 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 57 S 7.28 4.18 0.00 3.83 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.25 0.00 2.08 2.11 0.00 3.70 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 59 Q 8.14 4.30 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 60 E 8.89 3.96 0.00 2.07 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 2.48 2.44 0.00 61 W 8.22 4.65 0.00 3.29 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 62 E 8.42 3.86 0.00 2.01 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 0.00 2.28 2.24 0.00 63 A 7.83 4.07 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 64 I 8.12 3.67 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.33 1.08 0.00 0.00 65 Q 7.63 3.56 0.00 1.66 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 66 A 7.76 3.81 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 67 L 8.04 4.06 0.00 1.87 1.77 0.94 0.69 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 68 T 7.73 3.96 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 1.01 0.00 0.00 69 V 7.88 3.47 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.68 0.00 0.00 70 L 8.55 4.12 0.00 1.97 2.12 1.09 1.65 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 71 E 8.79 4.29 0.00 2.21 2.29 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 2.48 2.54 0.00 72 T 8.30 4.00 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 1.44 0.00 0.00 73 C 8.54 4.24 0.00 2.69 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 0.00 0.00 0.00 74 M 7.98 4.18 0.00 1.90 2.46 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.95 0.00 75 K 7.94 4.23 0.00 1.78 1.92 0.00 1.80 0.00 0.00 1.98 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.59 7.81 76 S 8.09 4.46 0.00 3.80 3.89 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 77 C 7.72 4.48 0.00 2.92 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 G 7.77 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.62 3.84 0.00 1.79 1.77 0.00 1.71 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.75 1.50 7.81 80 R 7.95 3.81 0.00 1.80 1.92 0.00 3.22 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 81 F 7.99 4.01 0.00 2.90 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 82 H 8.09 3.95 0.00 3.10 3.14 0.00 5.68 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 83 D 8.23 4.21 0.00 2.70 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 84 E 7.63 3.93 0.00 1.50 1.69 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 2.35 2.27 0.00 85 V 6.98 3.18 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 -0.47 0.00 0.00 86 G 7.52 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 87 K 6.99 4.29 0.00 1.95 1.69 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.49 7.81 88 F 8.31 4.46 0.00 3.08 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 89 R 8.21 4.10 0.00 1.85 2.04 0.00 3.25 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 90 F 7.94 4.55 0.00 3.12 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 91 L 8.23 4.03 0.00 1.96 1.92 1.07 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.72 4.22 0.00 2.75 2.77 0.00 0.00 7.06 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 93 E 7.61 3.81 0.00 1.71 1.83 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 2.44 2.44 0.00 94 L 7.34 4.05 0.00 1.80 1.67 1.23 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.79 3.68 1.93 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 1.52 1.05 0.80 0.00 0.00 96 K 8.09 3.72 0.00 1.81 1.79 0.00 1.70 0.00 0.00 1.49 0.00 0.00 2.69 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.75 1.31 7.81 97 V 7.62 3.60 2.19 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 1.03 0.00 0.00 0.96 0.00 0.00 98 V 7.62 3.90 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 0.73 0.00 0.00 0.98 0.00 0.00 99 S 8.09 4.51 0.00 3.93 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 0.00 100 P 0.00 4.42 0.00 2.21 2.09 0.00 3.68 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 2.12 2.09 0.00 101 K 7.88 4.03 0.00 1.62 1.76 0.00 1.51 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.11 1.05 7.81 102 Y 7.87 4.25 0.00 3.18 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 0.00 103 L 5.70 4.56 0.00 1.84 1.71 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 104 G 8.62 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 0.00 0.00 0.00 105 S 8.01 4.42 0.00 3.84 3.89 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 0.00 106 R 8.17 4.61 0.00 1.91 1.89 0.00 3.19 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 1.55 1.56 0.00 107 T 7.51 4.60 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 0.00 108 S 8.34 4.34 0.00 4.06 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 0.00 109 E 8.63 3.92 0.00 2.10 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 2.38 2.43 0.00 110 K 8.12 3.82 0.00 1.88 1.95 0.00 1.80 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.55 7.81 111 V 7.49 3.63 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 0.99 0.00 0.00 0.96 0.00 0.00 112 K 7.97 4.03 0.00 1.88 1.84 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.25 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.56 1.65 7.81 113 N 8.33 4.41 0.00 2.76 2.87 0.00 0.00 6.64 7.05 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 0.00 114 K 7.91 3.84 0.00 2.13 1.86 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.67 7.81 115 I 7.56 3.63 2.01 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.56 0.91 0.00 0.00 116 L 7.95 4.05 0.00 1.87 1.79 0.92 0.90 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 0.00 117 E 8.64 3.99 0.00 2.11 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 2.35 2.53 0.00 118 L 7.91 3.41 0.00 1.31 0.33 1.00 0.58 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 0.00 119 L 7.40 3.59 0.00 1.85 1.88 1.04 1.22 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 0.00 120 Y 8.03 3.50 0.00 2.71 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 0.00 121 S 7.83 3.70 0.00 3.97 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 0.00 122 W 7.71 4.51 0.00 3.57 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 0.00 123 T 7.81 3.95 4.16 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 0.00 0.00 1.01 0.00 0.00 124 V 7.24 3.78 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 0.08 0.00 0.00 0.69 0.00 0.00 125 G 8.28 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 0.00 0.00 0.00 126 L 8.56 5.59 0.00 1.71 1.48 0.53 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.45 0.00 2.16 2.20 0.00 3.83 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 128 E 8.28 3.94 0.00 2.05 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 2.38 2.38 0.00 129 E 8.58 4.46 0.00 1.90 1.83 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 2.22 2.23 0.00 130 V 8.34 3.64 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 0.91 0.00 0.00 0.96 0.00 0.00 131 K 7.94 3.99 0.00 1.61 0.89 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.10 1.25 7.81 132 I 7.34 3.96 2.07 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 1.54 0.62 1.17 0.00 0.00 133 A 8.01 4.12 1.45 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 0.00 0.00 134 E 8.78 4.00 0.00 2.30 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 2.45 2.47 0.00 135 A 9.55 4.10 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 0.00 136 Y 8.32 4.10 0.00 3.14 3.25 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 0.00 137 Q 8.84 4.08 0.00 2.45 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.49 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 138 M 8.37 3.92 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 139 L 7.72 3.92 0.00 1.76 1.51 0.94 0.46 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 0.00 140 K 7.93 3.77 0.00 1.55 1.85 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.32 7.81 141 K 7.78 3.92 0.00 1.77 1.93 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.48 7.81 142 Q 8.10 4.13 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.63 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 143 G 7.51 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 0.00 144 I 7.60 3.94 1.82 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 1.17 0.57 0.88 0.00 0.00 145 V 7.73 3.48 1.78 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 0.61 0.00 0.00 0.47 0.00 0.00 146 K 7.89 4.15 0.00 1.90 1.73 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.31 1.45 7.81