NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6146 8.3649 120.5298 54.1129 41.9562 176.2403 2 C 4.3376 8.6455 121.9496 55.2769 42.3898 171.0498 3 P 4.4719 0.0000 0.0000 61.9802 32.4915 175.8441 4 S 4.3458 8.5004 114.7850 60.3190 62.4432 174.7044 5 G 3.9946 9.2534 116.0400 44.7547 0.0000 172.8778 6 W 4.9688 8.0921 118.9183 55.3923 31.2809 175.8406 7 S 5.1869 9.7559 119.0391 56.9645 65.3499 173.6073 8 S 5.4231 8.7543 117.8631 57.7473 65.3575 173.5088 9 Y 3.9749 9.2225 121.2555 57.8097 41.2616 174.1808 10 E 3.4512 9.2215 128.3024 57.4000 26.6329 175.8038 11 G 3.8847 7.8957 103.1428 45.8600 0.0000 171.1956 12 H 5.1830 8.0959 116.1835 54.0238 33.1184 171.7926 13 C 5.8388 9.0448 117.7825 55.7015 41.3889 172.8439 14 Y 5.6825 10.0867 119.9313 56.4999 42.2354 174.6658 15 K 4.4062 8.7875 123.3980 54.4414 35.5561 173.4109 16 P 4.8647 0.0000 0.0000 62.3112 33.1235 175.5403 17 F 4.2241 8.7011 119.9696 54.9609 42.3800 175.7598 18 K 4.1029 8.1013 129.2133 55.3949 31.0920 175.8355 19 L 4.8738 6.8801 120.2563 53.1670 45.7520 176.9938 20 Y 4.8445 9.0425 121.5405 57.0089 38.4675 174.8811 21 K 4.9650 8.9930 123.4543 54.3770 37.3235 176.5871 22 T 5.5375 8.3405 111.1874 60.4506 70.0121 175.4297 23 W 2.5484 8.2027 131.1629 60.2562 30.3401 177.6163 24 D 4.4169 8.0642 118.0950 57.7486 40.2576 178.5982 25 D 4.2228 7.8170 118.4635 56.9931 40.6691 178.7604 26 A 3.0100 7.8342 121.8118 54.6155 18.2423 179.2787 27 E 3.2540 7.3455 118.1088 59.1126 29.3397 178.9457 28 R 3.7355 7.4760 117.4501 59.2506 30.4331 177.7442 29 F 4.1248 8.2477 120.7402 61.6939 39.3895 176.4597 30 C 4.2913 8.2833 116.3498 60.1576 39.7737 176.1033 31 T 4.0104 7.5364 111.2566 63.2209 68.4170 175.3333 32 E 4.3236 7.5722 119.5864 56.7039 30.1472 177.0099 33 Q 4.2395 7.5723 117.5603 56.5870 29.6748 175.3320 34 A 4.3268 6.9302 120.1926 50.3430 21.8494 175.2009 35 K 3.8964 8.4836 121.8897 57.8628 32.3268 176.8887 36 G 3.8004 8.8698 114.1736 46.2648 0.0000 173.5286 37 G 3.8580 7.8398 106.7335 46.7001 0.0000 172.9301 38 H 5.2290 8.7838 117.0461 54.1762 34.0548 173.1698 39 L 4.6402 8.7933 120.5040 54.4426 42.3192 178.0690 40 V 4.1409 8.7311 121.7388 62.2427 32.5259 175.1847 41 S 4.8520 9.3272 118.1183 56.5694 64.6844 173.8112 42 I 4.5684 8.3452 125.8433 60.1874 36.9850 174.9359 43 E 4.7026 9.5551 124.8010 56.2061 30.2362 176.7035 44 S 4.7022 7.6476 113.0686 56.1027 66.9659 175.0706 45 A 4.1284 8.6631 124.3764 55.3154 18.1403 180.2186 46 G 3.6927 8.1584 103.8046 48.0411 0.0000 175.4178 47 E 3.5853 8.4037 121.1797 58.7023 29.6523 178.7086 48 A 4.1069 8.2416 121.1004 55.2717 18.4346 179.4002 49 D 4.2891 8.2463 117.4266 57.2799 40.8056 178.6665 50 F 3.8485 7.8963 121.1704 61.2828 39.2395 177.3851 51 V 3.2148 7.9330 117.7428 65.6766 31.2105 177.7128 52 A 3.9996 8.0528 120.5942 55.2672 18.2664 179.4588 53 Q 3.7646 8.0098 118.0048 59.0185 29.1587 177.9264 54 L 3.5893 7.5205 121.6431 58.0306 42.0117 179.1785 55 V 3.2055 7.6866 118.2636 66.2506 31.1818 177.9105 56 T 3.8872 7.5210 114.2112 66.7598 68.3991 175.8275 57 E 4.1762 7.9960 118.3530 57.6111 29.7823 177.0094 58 N 4.7581 7.6249 113.9177 52.9223 40.7771 174.8544 59 I 4.2023 7.7171 119.1738 59.0952 36.9590 174.7549 60 Q 4.4152 7.9808 123.2195 54.1505 31.4288 174.9878 61 N 4.1745 8.6318 113.9818 54.2833 36.0282 174.6571 62 T 4.6673 7.3904 109.1929 60.7881 70.9410 172.9740 63 K 4.3520 8.5276 125.4707 56.2502 32.7405 176.6975 64 S 4.2188 7.6526 115.8760 58.1125 63.5657 173.2531 65 Y 4.6778 7.9308 119.4089 57.5547 39.4764 175.3122 66 V 4.4252 8.5678 120.8390 60.6649 32.9080 174.9904 67 W 5.4123 9.0186 129.0395 57.4392 30.0366 175.4119 68 I 4.8698 8.5916 116.4733 58.7961 40.2099 175.6973 69 G 3.9581 9.3314 110.4410 46.1513 0.0000 173.1118 70 L 4.5555 7.5927 123.7056 53.6693 43.4131 175.4870 71 R 4.5665 7.9444 121.1625 54.7419 32.5116 174.4750 72 V 3.4986 7.8372 120.5520 62.3787 31.6566 177.3665 73 Q 4.1061 8.3108 129.7421 52.8586 26.9681 174.3694 74 G 4.2686 6.5490 107.5880 45.8554 0.0000 170.9655 75 K 4.3313 8.2785 116.3977 55.5844 32.7458 177.0660 76 E 4.0589 7.6890 118.0340 56.3458 29.9891 178.1254 77 K 3.6334 8.5875 119.5030 58.2008 32.4692 176.8231 78 Q 4.4101 7.2656 113.6917 55.6124 31.0581 173.4834 79 C 4.7163 8.3336 112.8826 59.0282 29.7236 174.2236 80 S 4.3785 7.9037 115.7402 57.6123 63.3838 174.1902 81 S 4.3314 8.5758 119.7360 59.3444 62.7889 173.0900 82 E 5.1353 7.5996 117.5247 54.2775 33.3463 175.1676 83 W 4.4375 8.9697 122.1250 55.9842 29.8999 177.9438 84 S 4.2778 8.8641 114.5558 60.9145 62.4777 174.7447 85 D 4.5777 8.2674 119.1382 53.4416 39.4664 177.1599 86 G 4.0290 8.4085 109.6111 45.4049 0.0000 174.3077 87 S 4.5495 8.5738 115.0233 57.5696 64.1404 174.0277 88 S 4.7443 8.4145 117.9668 58.3760 63.3698 174.1849 89 V 4.1175 8.1126 124.2944 62.5860 31.2076 174.1285 90 S 4.5754 8.2027 119.9995 59.6961 65.1224 172.7451 91 Y 4.3780 7.9839 122.5040 57.6940 39.5512 175.3796 92 E 4.4381 7.7955 124.5920 55.0516 34.1599 175.0829 93 N 4.8661 7.6852 117.7871 52.2241 39.1033 174.6531 94 W 4.2864 7.8671 118.1940 56.6837 30.5633 176.4613 95 I 4.2630 8.3352 122.0861 60.2607 38.0608 176.3484 96 E 3.7817 9.1259 125.2682 59.6695 29.2904 179.4060 97 A 3.0592 7.3783 118.2726 53.8572 18.4605 177.9234 98 E 4.1680 8.0501 114.6784 57.4913 30.0764 176.7236 99 S 3.8663 7.8580 114.5180 57.0366 61.3498 172.5877 100 K 4.7127 8.1027 129.0522 55.0940 30.9756 176.0310 101 T 4.4803 7.9086 109.9792 61.2027 70.4888 174.6146 102 C 5.1347 8.2364 119.0833 55.4204 38.9645 172.6928 103 L 6.0041 7.6896 119.1379 52.4391 45.2026 176.1300 104 G 4.5331 8.4447 107.0834 45.0634 0.0000 171.4708 105 L 5.5389 9.1511 121.1715 53.6084 43.9578 175.8117 106 E 5.0000 8.6126 118.4403 54.3771 33.0110 176.3589 107 K 2.4800 8.4723 122.9915 59.2586 32.3628 178.7450 108 E 3.9539 8.0081 116.6268 58.7426 29.6197 177.5370 109 T 4.4222 7.5755 108.7776 61.1083 69.2193 174.8531 110 G 3.5807 8.3885 107.4995 47.0228 0.0000 174.3245 111 F 4.1194 7.8046 114.7350 58.4295 36.9335 176.3525 112 R 4.6754 8.0965 117.8269 55.7640 31.5036 176.0771 113 K 4.5798 7.9178 116.8553 54.1535 35.0165 175.7398 114 W 5.0192 8.5647 123.9301 56.0898 30.0035 175.7567 115 V 4.3180 8.8867 126.3422 61.2140 32.9746 174.7177 116 N 5.1319 8.7635 125.8768 53.3471 39.1286 174.3883 117 I 4.7107 9.0068 116.9605 58.8900 42.0592 173.8115 118 Y 4.7804 8.7310 124.8574 58.1620 39.2777 177.6546 119 C 4.1717 9.2120 124.6673 59.6087 40.4812 175.4072 120 G 3.0782 5.4432 106.0612 45.9983 0.0000 173.8763 121 Q 4.3670 8.0702 120.1605 56.1021 30.2221 175.4653 122 Q 5.1182 8.7969 121.5049 54.8964 29.9751 174.6094 123 N 5.0221 9.3210 121.3383 50.3183 43.7161 172.5667 124 P 5.4140 0.0000 0.0000 62.6148 33.6717 174.1488 125 F 5.2055 7.6051 113.6338 56.5119 41.7845 172.7529 126 V 4.9346 8.2754 118.2285 61.5651 34.5345 173.9300 127 C 5.5265 9.4817 125.0961 55.8134 43.3972 172.2916 128 E 5.4229 9.4317 121.1797 54.8500 33.4294 175.0292 129 A 4.2010 8.8472 126.6559 52.3005 19.6242 175.8677 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 D 8.36 4.61 0.00 2.66 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 2 C 8.65 4.34 0.00 3.18 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 3 P 0.00 4.47 0.00 1.82 1.85 0.00 3.06 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.79 0.00 4 S 8.50 4.35 0.00 3.88 3.88 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 5 G 9.25 3.99 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 0.00 0.00 0.00 6 W 8.09 4.97 0.00 3.34 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 7 S 9.76 5.19 0.00 4.03 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.75 5.42 0.00 3.93 3.96 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 9 Y 9.22 3.97 0.00 1.43 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 0.00 0.00 0.00 10 E 9.22 3.45 0.00 1.57 1.60 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 1.69 1.47 0.00 11 G 7.90 3.88 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 0.00 0.00 0.00 12 H 8.10 5.18 0.00 3.37 2.87 0.00 5.59 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 13 C 9.04 5.84 0.00 2.72 3.17 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 14 Y 10.09 5.68 0.00 3.13 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 15 K 8.79 4.41 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.91 0.00 0.00 2.13 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.30 0.69 7.81 16 P 0.00 4.86 0.00 1.83 1.79 0.00 3.37 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 17 F 8.70 4.22 0.00 1.53 2.33 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 18 K 8.10 4.10 0.00 1.57 1.68 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.35 7.81 19 L 6.88 4.87 0.00 1.44 1.46 0.65 0.86 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 20 Y 9.04 4.84 0.00 2.81 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 21 K 8.99 4.96 0.00 1.59 1.55 0.00 1.25 0.00 0.00 1.48 0.00 0.00 2.41 0.00 0.00 2.16 0.00 0.00 0.00 0.00 1.32 1.41 7.81 22 T 8.34 5.54 4.34 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 1.25 0.00 0.00 23 W 8.20 2.55 0.00 1.94 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.06 4.42 0.00 2.70 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 25 D 7.82 4.22 0.00 2.67 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 26 A 7.83 3.01 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 7.35 3.25 0.00 1.16 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 2.01 2.10 0.00 28 R 7.48 3.74 0.00 1.81 1.99 0.00 3.29 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 29 F 8.25 4.12 0.00 3.04 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 30 C 8.28 4.29 0.00 3.05 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 31 T 7.54 4.01 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 1.22 0.00 0.00 32 E 7.57 4.32 0.00 1.81 1.86 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 2.17 2.46 0.00 33 Q 7.57 4.24 0.00 2.31 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.63 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 34 A 6.93 4.33 0.88 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 0.00 0.00 35 K 8.48 3.90 0.00 1.64 1.65 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.74 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.39 7.81 36 G 8.87 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 7.84 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 38 H 8.78 5.23 0.00 3.05 3.10 0.00 5.62 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.79 4.64 0.00 1.38 1.60 -0.34 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.73 4.14 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 0.90 0.00 0.00 1.30 0.00 0.00 41 S 9.33 4.85 0.00 4.00 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 42 I 8.35 4.57 2.23 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.75 1.22 0.00 0.00 43 E 9.56 4.70 0.00 2.05 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 0.00 2.37 2.35 0.00 44 S 7.65 4.70 0.00 4.10 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 45 A 8.66 4.13 1.37 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 46 G 8.16 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 47 E 8.40 3.59 0.00 2.42 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 2.49 2.47 0.00 48 A 8.24 4.11 1.52 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 0.00 0.00 49 D 8.25 4.29 0.00 2.87 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 50 F 7.90 3.85 0.00 2.29 2.47 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 51 V 7.93 3.21 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 1.05 0.00 0.00 1.08 0.00 0.00 52 A 8.05 4.00 1.52 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 0.00 0.00 53 Q 8.01 3.76 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.72 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 54 L 7.52 3.59 0.00 1.04 1.38 0.69 1.01 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 55 V 7.69 3.21 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 -0.26 0.00 0.00 0.75 0.00 0.00 56 T 7.52 3.89 4.34 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 1.26 0.00 0.00 57 E 8.00 4.18 0.00 1.82 1.92 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 2.26 2.52 0.00 58 N 7.62 4.76 0.00 2.58 2.62 0.00 0.00 6.77 7.87 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 59 I 7.72 4.20 1.58 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.36 0.74 0.00 0.00 60 Q 7.98 4.42 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.29 0.00 61 N 8.63 4.17 0.00 2.80 2.82 0.00 0.00 6.58 7.54 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 62 T 7.39 4.67 4.29 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 1.23 0.00 0.00 63 K 8.53 4.35 0.00 1.70 1.70 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.73 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.40 7.81 64 S 7.65 4.22 0.00 3.85 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 65 Y 7.93 4.68 0.00 2.56 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 66 V 8.57 4.43 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.81 0.00 0.00 67 W 9.02 5.41 0.00 3.36 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 68 I 8.59 4.87 1.79 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 1.30 0.69 0.98 0.00 0.00 69 G 9.33 3.96 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 0.00 0.00 0.00 70 L 7.59 4.56 0.00 1.46 1.20 0.86 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 71 R 7.94 4.57 0.00 1.27 1.06 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.99 0.00 72 V 7.84 3.50 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 0.62 0.00 0.00 0.85 0.00 0.00 73 Q 8.31 4.11 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 74 G 6.55 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 0.00 0.00 0.00 0.00 75 K 8.28 4.33 0.00 1.68 1.77 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.32 7.81 76 E 7.69 4.06 0.00 2.13 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 2.23 2.18 0.00 77 K 8.59 3.63 0.00 1.63 0.81 0.00 1.44 0.00 0.00 0.61 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.31 1.26 7.81 78 Q 7.27 4.41 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.98 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 79 C 8.33 4.72 0.00 2.88 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 80 S 7.90 4.38 0.00 3.90 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 81 S 8.58 4.33 0.00 3.86 3.87 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 82 E 7.60 5.14 0.00 1.95 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 2.37 2.32 0.00 83 W 8.97 4.44 0.00 3.58 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 84 S 8.86 4.28 0.00 4.04 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 85 D 8.27 4.58 0.00 2.80 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 86 G 8.41 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.57 4.55 0.00 4.10 4.05 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 88 S 8.41 4.74 0.00 3.96 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 89 V 8.11 4.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.36 0.00 0.00 90 S 8.20 4.58 0.00 3.92 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 91 Y 7.98 4.38 0.00 2.99 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 92 E 7.80 4.44 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 2.19 2.28 0.00 93 N 7.69 4.87 0.00 2.21 2.52 0.00 0.00 7.07 7.95 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 94 W 7.87 4.29 0.00 3.25 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 95 I 8.34 4.26 1.93 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.75 0.89 0.00 0.00 96 E 9.13 3.78 0.00 1.78 1.76 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 2.41 2.31 0.00 97 A 7.38 3.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.05 4.17 0.00 2.45 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 99 S 7.86 3.87 0.00 3.19 3.65 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 0.00 100 K 8.10 4.71 0.00 1.77 1.80 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.42 1.57 7.81 101 T 7.91 4.48 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 1.02 0.00 0.00 102 C 8.24 5.13 0.00 3.10 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 0.00 103 L 7.69 6.00 0.00 1.56 1.58 0.99 0.90 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 0.00 104 G 8.44 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 0.00 0.00 0.00 0.00 105 L 9.15 5.54 0.00 1.87 1.99 1.09 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.61 5.00 0.00 2.06 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 2.25 2.30 0.00 107 K 8.47 2.48 0.00 1.53 1.61 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.27 1.30 7.81 108 E 8.01 3.95 0.00 1.91 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 2.27 2.31 0.00 109 T 7.58 4.42 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 1.23 0.00 0.00 110 G 8.39 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 F 7.80 4.12 0.00 3.24 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 R 8.10 4.68 0.00 1.95 1.95 0.00 3.12 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.83 0.00 113 K 7.92 4.58 0.00 1.63 1.69 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.34 7.81 114 W 8.56 5.02 0.00 3.31 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 0.00 115 V 8.89 4.32 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 0.79 0.00 0.00 1.05 0.00 0.00 116 N 8.76 5.13 0.00 2.64 2.88 0.00 0.00 6.81 7.45 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 0.00 117 I 9.01 4.71 1.77 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.95 0.08 0.00 0.00 118 Y 8.73 4.78 0.00 3.24 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 0.00 119 C 9.21 4.17 0.00 2.75 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 0.00 120 G 5.44 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 0.00 0.00 0.00 121 Q 8.07 4.37 0.00 2.40 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.72 0.00 0.00 0.00 0.00 0.00 2.58 2.65 0.00 122 Q 8.80 5.12 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 123 N 9.32 5.02 0.00 1.44 2.40 0.00 0.00 6.39 7.68 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 0.00 124 P 0.00 5.41 0.00 1.78 1.60 0.00 3.66 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.43 0.00 125 F 7.61 5.21 0.00 3.20 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 V 8.28 4.93 2.20 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 1.17 0.00 0.00 0.88 0.00 0.00 127 C 9.48 5.53 0.00 3.05 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 0.00 128 E 9.43 5.42 0.00 1.95 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 1.82 1.47 0.00 129 A 8.85 4.20 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00