NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4201 8.1585 120.3617 55.6476 34.3817 177.4968 2 A 3.9097 8.0245 120.3783 54.0213 18.5530 177.5948 3 L 3.5179 8.1988 118.7429 58.0397 42.4139 177.5062 4 K 3.8767 7.8750 118.9816 59.3574 32.3294 178.4744 5 R 3.8149 7.6412 118.5432 59.6053 30.0240 178.3387 6 I 3.0832 7.6099 119.6560 64.1963 36.8849 178.1033 7 Q 3.9652 7.7096 119.7342 59.0253 28.9642 178.0540 8 K 3.8299 8.2112 120.8332 59.8925 32.2853 178.3496 9 E 4.2792 8.1929 119.8370 58.9079 29.1515 179.2586 10 L 4.1832 7.9709 119.4366 58.0980 42.5658 178.9123 11 S 4.2811 8.4294 115.5394 61.6163 62.5082 176.2660 12 D 4.4002 8.0467 121.3125 57.4970 40.4363 178.8785 13 L 4.1869 7.7542 117.2577 56.9850 41.6189 178.5566 14 Q 4.1537 7.6560 118.4501 57.8065 29.1751 177.2439 15 R 4.3584 7.6930 118.6914 57.5171 31.2574 175.8657 16 D 4.6510 8.5100 120.2689 51.1057 41.8535 171.6582 17 P 4.4383 0.0000 0.0000 61.6100 32.1878 177.0717 18 P 4.4465 0.0000 0.0000 62.4349 30.7404 178.4202 19 A 3.9933 8.3917 126.2695 52.9480 18.4690 179.2996 20 H 5.0242 8.2414 106.9479 55.1078 31.4571 173.1407 21 C 5.9793 8.4141 116.5528 57.2117 31.1726 173.4755 22 S 4.7632 8.3108 114.8968 56.6989 66.0430 172.7809 23 A 4.9955 8.4751 123.3502 50.0722 22.5240 175.0892 24 G 3.0205 7.3791 106.8555 45.1362 0.0000 170.9390 25 P 4.8028 0.0000 0.0000 62.0081 31.7056 176.7292 26 V 3.9390 8.3723 121.4817 62.4125 32.3597 175.5966 27 G 4.0640 8.4468 118.1331 47.0786 0.0000 173.4019 28 D 4.6404 8.6892 124.0024 52.9127 39.9462 175.9331 29 D 4.6801 7.6121 119.7727 53.7404 41.0801 176.2143 30 L 4.4927 8.5883 127.2791 57.3390 42.3627 178.3763 31 F 4.3681 8.5788 117.3962 59.6234 40.4906 174.7518 32 H 5.4239 9.0439 119.5831 54.3349 31.5445 173.9956 33 W 5.5284 9.5044 125.4499 54.8545 33.3656 174.2231 34 Q 5.0528 9.3028 120.2989 54.5888 31.0722 174.3240 35 A 5.2813 8.6200 122.1377 50.8421 23.3975 174.9580 36 T 4.9160 9.0823 109.5179 59.7916 72.6650 172.9583 37 I 4.7965 8.4485 124.0969 59.6155 39.9901 174.9807 38 M 4.5551 9.4721 128.6305 54.9075 32.5307 176.9163 39 G 4.4521 9.3544 111.7748 45.5296 0.0000 171.6049 40 P 4.6584 0.0000 0.0000 61.5324 32.5921 174.5574 41 P 4.4104 0.0000 0.0000 64.1365 31.8210 176.1387 42 D 4.5701 9.6339 120.5369 54.7191 39.2617 173.9048 43 S 4.8572 7.5168 113.7704 55.8896 65.4814 175.0813 44 A 3.8615 8.4869 124.3218 54.9921 18.4403 178.0414 45 Y 5.3245 7.2864 110.8495 56.9849 38.1708 175.2630 46 Q 4.4580 7.9139 121.8093 57.9515 29.5544 175.8325 47 G 4.3563 9.1636 114.1176 45.6046 0.0000 174.4621 48 G 3.6925 7.8348 105.6902 46.0287 0.0000 172.7320 49 V 4.8364 7.4742 120.7610 60.6813 34.1764 174.9088 50 F 5.0182 8.9270 125.4771 55.7846 42.2575 174.1715 51 F 4.8396 9.9614 123.8482 56.9414 40.3791 175.0971 52 L 5.2041 9.3788 122.2701 53.0883 46.4438 175.1268 53 T 4.8287 9.1862 114.2519 60.4384 70.7467 172.6671 54 V 4.6779 8.8367 128.4358 60.2111 34.2032 174.0365 55 H 5.1671 8.8322 123.0249 53.7728 31.0905 173.6413 56 F 4.7430 8.5169 123.0040 55.6788 39.8790 174.4051 57 P 4.5199 0.0000 0.0000 62.5069 31.9752 177.4742 58 T 3.9572 8.5313 110.5064 64.4501 68.9480 174.0280 59 D 5.0109 7.9957 121.0787 53.2995 40.1870 175.5473 60 Y 4.4484 7.9787 120.8758 58.1937 39.1282 173.3140 61 P 2.9700 0.0000 0.0000 62.3330 31.6522 177.8250 62 F 4.5050 7.7211 119.6992 60.0646 39.0919 176.0736 63 K 4.6239 7.9075 118.5845 53.8415 33.5842 174.5914 64 P 2.9700 0.0000 0.0000 61.0583 31.9288 174.3341 65 P 4.3163 0.0000 0.0000 62.8088 32.4943 175.9572 66 K 4.3055 8.8094 121.8774 55.3858 33.2910 175.5430 67 I 4.9397 8.2433 125.9955 59.3313 39.4720 175.1681 68 A 5.0437 8.8823 128.1390 49.9113 22.9592 174.7110 69 F 4.6211 9.3961 119.4881 57.5641 39.6825 176.8411 70 T 4.3344 9.2441 114.1040 62.9687 69.8259 175.1854 71 T 4.6647 8.2148 118.7090 61.8464 70.1037 174.5181 72 K 4.3447 8.5467 125.1182 56.3895 32.8399 176.5232 73 I 4.9672 8.2397 122.0378 59.9131 40.8413 174.4859 74 Y 3.7147 8.9991 129.1762 56.4290 36.9702 173.0721 75 H 4.9139 7.6106 123.7674 53.3794 33.5041 172.6594 76 P 4.2318 0.0000 0.0000 64.7965 31.6169 177.4071 77 N 4.7858 8.0483 113.6066 52.8000 39.3798 173.9218 78 I 5.0618 7.5588 118.2612 58.3503 39.3905 175.3407 79 N 4.7779 8.4240 123.5530 51.1404 39.1612 175.9096 80 S 4.1210 8.5211 112.0961 61.5526 62.9329 174.9068 81 N 4.5181 8.2830 115.5555 53.1883 38.5332 175.5111 82 G 4.1725 8.4745 106.6091 46.1919 0.0000 173.9595 83 S 4.5057 8.5918 116.7996 58.2394 63.3763 173.0941 84 I 4.6113 8.1896 124.9949 59.8941 38.7354 175.5108 85 C 4.4583 8.6667 129.2541 58.1852 30.6797 171.6342 86 L 4.8208 7.9848 125.8407 52.9678 45.0198 176.7612 87 D 4.4529 8.9492 125.4859 57.1157 41.1738 178.3338 88 I 3.9959 7.8234 110.8675 62.6590 37.8721 176.3428 89 L 4.5087 7.6402 120.0547 54.8021 43.1123 176.6504 90 R 4.2641 8.1613 115.8383 56.0471 31.3380 176.4214 91 S 4.5454 9.0670 120.1168 60.3578 64.9460 175.8792 92 Q 4.3819 8.2324 118.0497 55.3712 28.6614 175.8171 93 W 4.4584 8.0119 128.4127 57.6024 31.4913 175.0747 94 S 4.1988 6.6900 117.5545 55.6024 64.7102 172.7623 95 P 4.1219 0.0000 0.0000 63.5008 30.9486 176.8876 96 A 3.9928 7.0927 121.9104 54.1755 18.7443 178.2206 97 L 4.1084 7.1227 116.1199 54.5873 42.5276 176.7485 98 T 5.0030 8.0353 111.4709 59.9183 72.7869 175.3839 99 V 3.8137 9.6674 120.0842 65.7888 31.5025 177.5427 100 S 4.1788 8.3483 112.7563 61.6460 62.0267 176.2684 101 K 4.0247 8.0479 120.5033 59.4211 31.7261 179.6135 102 V 3.6716 7.9063 118.2075 66.0925 31.5455 177.8729 103 L 3.9729 8.2722 119.0593 58.0690 41.4370 179.6315 104 L 4.0665 7.9389 118.3007 57.9855 41.5020 179.8219 105 S 4.2601 7.9264 115.1263 61.5397 62.8258 176.7781 106 I 3.7695 8.1129 122.8875 64.1919 36.8219 178.0958 107 C 4.0773 8.0454 119.8483 62.5233 31.4254 175.4506 108 S 4.1193 8.4868 115.2166 61.3827 61.6595 175.9116 109 L 4.0419 7.8425 122.3337 58.0620 41.8581 178.6601 110 L 4.0520 7.4410 117.8133 57.8846 41.5569 178.9559 111 C 4.6251 7.8221 115.9066 61.5109 29.0281 173.6151 112 D 4.6934 8.3298 119.8998 51.3506 41.2615 172.3612 113 P 4.3020 0.0000 0.0000 61.9098 32.3833 176.6042 114 N 4.6298 8.6893 120.0678 52.0478 37.5577 174.2528 115 P 4.5754 0.0000 0.0000 63.9782 32.0637 176.6979 116 D 4.7933 7.9674 117.2686 54.3388 41.8557 175.9741 117 D 4.7414 7.5091 116.9548 51.5856 40.8909 172.1673 118 P 4.7852 0.0000 0.0000 60.9813 32.9129 176.7204 119 L 4.0385 8.7182 124.0842 57.0608 41.9379 177.7486 120 V 4.2067 7.4981 121.0705 59.6326 31.1528 173.5318 121 P 4.2501 0.0000 0.0000 65.2135 30.8137 177.2775 122 D 4.3917 8.1449 117.1846 57.8055 40.8412 179.0775 123 I 3.6625 7.6382 119.6778 64.1503 36.5838 178.4095 124 A 4.0615 7.7940 121.2866 54.9721 18.1737 179.2655 125 Q 3.9391 8.5530 118.7761 59.4214 29.1024 178.6106 126 I 3.7840 7.5875 120.3001 64.5005 37.0061 177.5937 127 Y 4.1449 7.8579 118.4179 59.2633 38.5097 177.1620 128 K 4.0954 7.3527 117.7768 58.8899 33.1992 178.5776 129 S 4.3649 8.1674 113.3630 60.3600 64.7488 174.3030 130 D 4.7435 8.4270 121.7240 50.9935 41.8992 174.9478 131 K 3.8110 8.2218 123.0375 59.5684 32.4754 178.2510 132 E 4.1059 8.0947 117.9560 58.9944 29.5846 178.8573 133 K 4.1731 8.0444 118.9050 59.3970 32.1314 178.1993 134 Y 4.0554 8.1024 119.8885 60.9097 38.8779 177.5823 135 N 4.3607 8.4448 117.2423 56.3103 38.0969 177.5501 136 R 3.8757 8.4954 120.3100 59.8753 30.4270 178.3758 137 H 4.0709 8.3954 117.2626 58.0042 28.4819 177.7510 138 A 3.8101 7.8188 123.0826 54.8797 18.0703 179.9366 139 R 3.9291 7.3868 115.2670 59.3550 29.6777 178.9377 140 E 3.8843 7.7058 117.5430 59.4654 29.6340 179.6885 141 W 2.9690 8.1772 117.9538 59.2945 29.0061 178.7792 142 T 4.2974 8.0279 116.2294 66.4901 67.4938 177.0016 143 Q 3.9830 7.9666 119.9385 58.7596 28.6501 178.7126 144 K 4.1656 7.9172 118.8837 59.0827 32.1417 178.2361 145 Y 4.7007 7.0489 114.1139 58.5113 38.5473 176.3592 146 A 4.4810 7.9650 121.1175 52.4684 21.0414 176.3897 147 M 4.2236 7.3651 120.2718 55.7195 31.9174 176.1561 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 M 8.16 4.42 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.59 0.00 2 A 8.02 3.91 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.20 3.52 0.00 1.82 1.68 0.99 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 4 K 7.88 3.88 0.00 1.85 1.93 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.48 7.81 5 R 7.64 3.81 0.00 1.89 2.05 0.00 3.20 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.88 0.00 6 I 7.61 3.08 1.26 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.19 0.08 0.00 0.00 7 Q 7.71 3.97 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 8 K 8.21 3.83 0.00 1.92 1.98 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.50 7.81 9 E 8.19 4.28 0.00 2.26 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 2.41 2.37 0.00 10 L 7.97 4.18 0.00 2.22 2.07 0.41 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.43 4.28 0.00 4.10 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 12 D 8.05 4.40 0.00 2.95 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 13 L 7.75 4.19 0.00 1.65 1.71 1.07 0.92 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 14 Q 7.66 4.15 0.00 2.05 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 15 R 7.69 4.36 0.00 1.97 2.05 0.00 3.23 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 16 D 8.51 4.65 0.00 2.56 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 17 P 0.00 4.44 0.00 2.23 2.27 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 18 P 0.00 4.45 0.00 2.18 2.10 0.00 3.85 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 19 A 8.39 3.99 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 20 H 8.24 5.02 0.00 3.21 3.52 0.00 5.40 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 C 8.41 5.98 0.00 2.87 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 22 S 8.31 4.76 0.00 3.74 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 23 A 8.48 5.00 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 24 G 7.38 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 0.00 0.00 0.00 25 P 0.00 4.80 0.00 2.17 2.25 0.00 3.38 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.92 0.00 26 V 8.37 3.94 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 0.96 0.00 0.00 0.73 0.00 0.00 27 G 8.45 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 0.00 0.00 0.00 28 D 8.69 4.64 0.00 2.79 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 29 D 7.61 4.68 0.00 2.80 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 30 L 8.59 4.49 0.00 1.65 1.52 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.58 4.37 0.00 3.23 3.14 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 32 H 9.04 5.42 0.00 3.27 3.40 0.00 5.54 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.50 5.53 0.00 3.21 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 34 Q 9.30 5.05 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.70 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 35 A 8.62 5.28 1.22 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 36 T 9.08 4.92 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 0.53 0.00 0.00 37 I 8.45 4.80 1.95 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.90 0.96 0.00 0.00 38 M 9.47 4.56 0.00 1.93 2.19 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.51 0.00 39 G 9.35 4.45 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 0.00 40 P 0.00 4.66 0.00 2.16 2.01 0.00 3.79 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.15 0.00 41 P 0.00 4.41 0.00 2.07 2.02 0.00 3.83 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 2.07 2.16 0.00 42 D 9.63 4.57 0.00 2.82 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 43 S 7.52 4.86 0.00 4.06 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 44 A 8.49 3.86 0.94 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 45 Y 7.29 5.32 0.00 3.23 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 46 Q 7.91 4.46 0.00 2.30 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.64 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 47 G 9.16 4.36 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 0.00 0.00 0.00 0.00 48 G 7.83 3.69 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 0.00 0.00 0.00 49 V 7.47 4.84 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 0.54 0.00 0.00 0.88 0.00 0.00 50 F 8.93 5.02 0.00 3.16 3.37 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 51 F 9.96 4.84 0.00 3.01 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 52 L 9.38 5.20 0.00 1.48 1.43 0.72 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 53 T 9.19 4.83 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 54 V 8.84 4.68 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 0.80 0.00 0.00 0.11 0.00 0.00 55 H 8.83 5.17 0.00 3.02 3.20 0.00 5.80 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.52 4.74 0.00 2.92 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 57 P 0.00 4.52 0.00 2.54 2.21 0.00 3.88 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.22 0.00 58 T 8.53 3.96 4.20 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 0.84 0.00 0.00 59 D 8.00 5.01 0.00 3.11 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 7.98 4.45 0.00 3.22 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 61 P 0.00 2.97 0.00 1.70 1.38 0.00 2.87 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.50 0.00 62 F 7.72 4.51 0.00 3.33 3.15 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 63 K 7.91 4.62 0.00 1.91 1.73 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.26 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.60 7.81 64 P 0.00 2.97 0.00 1.60 0.96 0.00 3.64 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 65 P 0.00 4.32 0.00 1.66 1.57 0.00 2.57 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.87 0.00 66 K 8.81 4.31 0.00 1.59 1.72 0.00 1.55 0.00 0.00 1.57 0.00 0.00 2.74 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.31 7.81 67 I 8.24 4.94 1.79 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 1.12 0.42 0.80 0.00 0.00 68 A 8.88 5.04 1.26 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 0.00 0.00 69 F 9.40 4.62 0.00 2.96 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 9.24 4.33 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 1.28 0.00 0.00 71 T 8.21 4.66 4.76 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 1.40 0.00 0.00 72 K 8.55 4.34 0.00 1.49 1.33 0.00 1.52 0.00 0.00 1.15 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.42 7.81 73 I 8.24 4.97 1.69 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.64 0.37 0.00 0.00 74 Y 9.00 3.71 0.00 2.15 2.54 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 75 H 7.61 4.91 0.00 2.92 2.84 0.00 5.73 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.23 0.00 2.06 2.07 0.00 2.98 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 1.77 2.10 0.00 77 N 8.05 4.79 0.00 2.91 2.84 0.00 0.00 6.94 7.38 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 78 I 7.56 5.06 1.59 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.62 0.71 0.00 0.00 79 N 8.42 4.78 0.00 2.86 2.96 0.00 0.00 5.97 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.52 4.12 0.00 4.03 4.10 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 81 N 8.28 4.52 0.00 2.75 2.91 0.00 0.00 6.91 7.65 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 82 G 8.47 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 83 S 8.59 4.51 0.00 4.00 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 84 I 8.19 4.61 1.92 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 1.53 0.92 0.98 0.00 0.00 85 C 8.67 4.46 0.00 3.01 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.98 4.82 0.00 1.78 1.46 0.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.95 4.45 0.00 2.86 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 88 I 7.82 4.00 2.01 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.73 0.97 0.00 0.00 89 L 7.64 4.51 0.00 1.80 1.71 0.92 0.75 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 90 R 8.16 4.26 0.00 1.92 1.70 0.00 3.36 0.00 0.00 3.29 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 91 S 9.07 4.55 0.00 4.01 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 92 Q 8.23 4.38 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.90 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 93 W 8.01 4.46 0.00 3.60 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 94 S 6.69 4.20 0.00 3.61 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 95 P 0.00 4.12 0.00 1.90 1.93 0.00 3.23 0.00 0.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.05 0.00 96 A 7.09 3.99 1.13 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 0.00 0.00 97 L 7.12 4.11 0.00 0.87 1.52 0.85 0.98 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 98 T 8.04 5.00 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 99 V 9.67 3.81 2.35 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 1.20 0.00 0.00 1.16 0.00 0.00 100 S 8.35 4.18 0.00 4.02 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 0.00 101 K 8.05 4.02 0.00 2.12 1.89 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.49 7.81 102 V 7.91 3.67 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 1.17 0.00 0.00 1.29 0.00 0.00 103 L 8.27 3.97 0.00 1.99 1.75 1.04 0.70 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 0.00 104 L 7.94 4.07 0.00 1.96 1.76 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 105 S 7.93 4.26 0.00 4.02 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 0.00 106 I 8.11 3.77 2.00 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 1.44 1.10 0.98 0.00 0.00 107 C 8.05 4.08 0.00 3.09 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 0.00 108 S 8.49 4.12 0.00 3.91 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 0.00 109 L 7.84 4.04 0.00 1.84 1.85 0.94 0.90 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 0.00 110 L 7.44 4.05 0.00 1.81 1.66 0.28 0.28 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 0.00 111 C 7.82 4.63 0.00 3.20 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 0.00 112 D 8.33 4.69 0.00 2.56 2.55 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 0.00 113 P 0.00 4.30 0.00 1.21 1.47 0.00 3.33 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.96 0.00 114 N 8.69 4.63 0.00 2.79 2.79 0.00 0.00 6.75 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.58 0.00 2.23 2.38 0.00 3.77 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 116 D 7.97 4.79 0.00 2.68 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 0.00 117 D 7.51 4.74 0.00 2.62 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 0.00 118 P 0.00 4.79 0.00 2.18 2.02 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 119 L 8.72 4.04 0.00 1.76 1.75 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.50 4.21 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 0.91 0.00 0.00 0.87 0.00 0.00 121 P 0.00 4.25 0.00 2.18 2.09 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 122 D 8.14 4.39 0.00 2.71 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 0.00 123 I 7.64 3.66 1.72 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.77 0.44 0.00 0.00 124 A 7.79 4.06 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 0.00 125 Q 8.55 3.94 0.00 2.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 126 I 7.59 3.78 2.24 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 1.73 0.78 1.12 0.00 0.00 127 Y 7.86 4.14 0.00 2.36 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 0.00 128 K 7.35 4.10 0.00 1.73 1.76 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.29 1.39 7.81 129 S 8.17 4.36 0.00 3.99 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 D 8.43 4.74 0.00 2.62 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.22 3.81 0.00 1.77 1.80 0.00 1.54 0.00 0.00 1.55 0.00 0.00 2.52 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.38 1.39 7.81 132 E 8.09 4.11 0.00 1.99 2.00 0.00 0.00 0.00 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 2.31 0.00 133 K 8.04 4.17 0.00 2.11 2.01 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.50 7.81 134 Y 8.10 4.06 0.00 3.23 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 0.00 135 N 8.44 4.36 0.00 3.01 2.88 0.00 0.00 6.78 7.61 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 0.00 136 R 8.50 3.88 0.00 1.85 2.04 0.00 3.05 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 1.50 1.59 0.00 137 H 8.40 4.07 0.00 2.70 1.33 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.82 3.81 0.70 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 0.00 0.00 139 R 7.39 3.93 0.00 2.00 2.07 0.00 3.09 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.77 0.00 140 E 7.71 3.88 0.00 2.27 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 2.26 2.41 0.00 141 W 8.18 2.97 0.00 3.54 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 0.00 142 T 8.03 4.30 4.45 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 1.54 0.00 0.00 143 Q 7.97 3.98 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 144 K 7.92 4.17 0.00 1.20 1.91 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.43 1.36 7.81 145 Y 7.05 4.70 0.00 3.31 2.93 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 0.00 146 A 7.97 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 M 7.37 4.22 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00