NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6400 8.1476 120.2829 54.9192 34.4378 174.1401 2 K 4.7781 8.3599 121.9282 56.0719 33.9263 170.9077 3 V 5.0370 8.5255 114.9717 59.7769 37.6461 175.3274 4 I 4.8219 8.5735 121.8396 59.1192 40.3727 174.0901 5 L 4.7944 8.2108 131.6425 54.3315 41.6614 177.7581 6 L 4.7678 7.8350 128.4692 54.0091 39.2997 176.5429 7 E 4.7106 7.6243 114.5209 55.4243 32.9369 173.8333 8 P 4.3843 0.0000 0.0000 63.6923 31.2002 174.5142 9 L 4.2503 8.7061 126.5364 53.3861 43.2143 176.3692 10 E 3.7820 9.4486 122.4464 60.8082 30.0868 177.8673 11 N 4.4031 8.1970 120.8410 56.8310 39.2258 176.1036 12 L 4.1105 7.5218 117.8807 54.0313 42.5162 180.1735 13 G 4.2475 7.0580 107.0071 46.2326 0.0000 171.4830 14 D 4.9308 7.8522 119.6738 52.8497 42.1656 175.8970 15 V 3.9072 7.9404 119.8318 64.5195 31.8195 176.1975 16 G 3.9906 8.8757 114.6385 45.4243 0.0000 173.8475 17 Q 4.2930 7.4192 117.4092 55.7182 30.4587 175.5186 18 V 4.8757 8.5250 120.0106 60.2226 33.7620 174.8837 19 V 4.5586 8.2305 127.1297 59.9086 35.2527 174.2300 20 D 5.3322 8.5970 122.9285 53.0674 42.1419 176.2049 21 V 4.8830 8.1807 116.7226 58.8917 34.7510 175.7263 22 K 4.1069 8.6055 120.5427 56.0570 32.2499 175.8744 23 P 4.2947 0.0000 0.0000 66.3504 31.2008 178.6497 24 G 3.8114 8.1180 103.1575 48.4827 0.0000 174.4333 25 Y 4.5027 7.9036 121.2240 59.9931 38.5714 177.6564 26 A 4.1837 7.8299 120.1992 53.3755 19.7992 178.6478 27 R 4.0092 7.9569 116.3431 58.0289 30.2929 176.6806 28 N 4.9739 8.3959 113.5325 52.9980 39.1353 173.8642 29 Y 4.7479 7.0224 118.4041 58.4200 42.4174 176.4527 30 L 3.5684 7.3884 118.2895 57.9331 42.9072 179.3868 31 L 4.3477 8.4810 120.7627 57.4005 42.0770 178.0594 32 P 4.2423 0.0000 0.0000 65.4872 31.4222 177.9695 33 R 4.2910 7.8590 114.0580 54.9487 31.2391 176.7876 34 G 3.8317 7.5691 106.3140 47.0588 0.0000 173.2122 35 L 4.5899 8.2132 119.5420 55.6261 45.3044 178.1036 36 A 5.2745 7.6504 117.8077 50.0831 23.5911 174.5718 37 V 4.4717 8.4362 117.5231 60.5771 35.2434 173.6856 38 L 4.0827 8.8763 128.7837 55.5646 42.2666 177.4815 39 A 4.5037 8.3579 130.3920 52.1077 15.8910 176.8001 40 T 4.2357 7.8290 113.2764 59.9382 70.4722 176.4265 41 E 3.9990 8.5957 121.0575 58.9277 29.1824 178.5914 42 S 3.9300 7.7885 113.6689 61.7212 62.6280 175.8806 43 N 4.4108 8.0688 118.5588 56.0384 38.1254 177.2622 44 L 4.0400 7.7851 119.9503 57.5317 41.8975 179.5739 45 K 4.0959 7.6445 118.0213 59.5075 32.0592 179.3601 46 A 4.0946 7.7632 120.5340 54.6230 18.1741 179.3142 47 L 3.9667 8.0110 119.3919 58.1220 42.1497 178.8041 48 E 4.0263 8.2409 118.4183 58.9114 29.2571 179.2450 49 A 3.9508 7.9019 120.6560 55.2872 18.0883 179.4376 50 R 3.9104 7.6971 116.6837 59.9020 30.0606 179.0974 51 I 3.8361 7.7776 119.4631 64.1342 37.2532 178.4021 52 R 3.9028 8.6030 118.7406 60.0778 30.0894 178.3047 53 A 3.9640 8.5472 120.6360 55.1264 17.9487 178.9675 54 Q 3.9411 8.2751 115.6350 59.5922 29.1712 178.6615 55 A 4.2038 8.2855 122.7984 54.4705 18.2995 178.7879 56 K 4.1582 8.5592 115.2805 58.0897 33.0802 179.3393 57 R 3.9041 8.1071 121.3197 59.3434 30.1715 177.6028 58 L 4.4333 7.6880 117.0804 56.0140 42.2701 178.5425 59 A 4.0961 8.2813 120.9438 53.9728 18.2553 178.3097 60 E 4.3625 7.8987 117.0211 57.4415 30.0641 178.0402 61 R 4.0049 7.5140 116.8823 58.7246 29.5414 178.1965 62 K 3.8302 8.2571 118.7720 58.2327 32.0289 178.2805 63 A 4.1568 7.3115 118.7911 54.1023 18.7208 178.4277 64 E 4.1670 7.9220 117.9199 58.4839 29.9769 177.4627 65 A 4.2834 7.7030 118.6819 53.0870 18.3551 178.2144 66 E 4.2112 7.5894 119.3699 58.0366 29.6248 178.3645 67 R 4.0143 7.7746 118.3390 58.8886 30.3506 178.5478 68 L 4.0716 7.8144 117.8732 56.9408 41.5090 179.1027 69 K 4.0298 7.4901 118.1067 59.3275 32.1839 178.2940 70 E 4.1426 7.6956 117.6716 58.4633 29.3517 178.0094 71 I 4.1300 7.4323 117.7514 62.6679 38.5762 176.9832 72 L 3.9780 7.8125 117.3277 55.9459 41.6395 177.6634 73 E 4.3844 8.0083 118.4123 56.7960 30.4567 175.4524 74 N 4.9984 7.4546 115.3605 52.1350 39.3148 174.4563 75 L 4.5735 7.6345 118.4390 53.8268 45.3112 174.3739 76 T 4.4461 8.3346 115.7249 60.5163 70.7698 174.3556 77 L 4.5962 8.1019 127.3824 53.7474 42.3662 175.0684 78 T 4.4451 8.2393 116.3351 60.3978 70.0800 174.1848 79 I 4.2562 8.7415 128.3998 58.8961 39.2552 173.5503 80 P 4.4994 0.0000 0.0000 61.9054 29.4159 175.8095 81 V 4.3925 8.2619 123.4043 60.8661 34.8251 173.9444 82 R 4.6041 8.2519 121.9168 55.1704 32.1231 174.4818 83 A 4.8389 8.1049 123.4612 51.8104 21.7505 175.5664 84 G 3.7527 9.0432 110.5387 46.6108 0.0000 174.4947 85 E 4.6185 8.5068 119.0787 56.4659 33.6372 176.4182 86 T 4.5264 7.9196 111.9614 64.9176 71.6335 174.6968 87 K 4.8273 7.9255 119.6686 55.3095 34.2934 176.1037 88 I 3.9515 7.7046 122.7450 62.3988 37.6711 175.1993 89 Y 3.9519 9.7214 123.6267 59.5624 38.8689 179.2323 90 G 3.8005 9.5636 109.7432 47.7115 0.0000 174.7149 91 S 5.4219 8.7257 121.0159 57.6925 65.0538 174.4514 92 V 5.1119 8.0988 127.7947 59.7035 32.8475 174.6909 93 T 4.8906 8.2592 118.0297 60.9869 70.3357 175.0089 94 A 4.2039 8.4705 119.6938 54.0808 18.6859 179.8599 95 K 3.9557 7.7018 117.0994 59.4945 32.4432 178.9262 96 D 4.4749 8.1483 117.7612 56.4392 40.6526 178.0073 97 I 4.0462 7.1117 120.5284 63.4780 37.5094 177.7456 98 A 4.0987 7.9175 120.6863 54.5081 18.0274 179.0084 99 E 3.9726 8.4206 118.5715 59.1374 29.9981 178.2716 100 A 4.1746 7.7035 119.3811 53.8485 18.2598 178.9469 101 L 4.0609 7.8664 119.4516 57.6554 42.3631 178.4504 102 S 4.5341 7.7853 113.3509 59.7852 62.2175 175.8760 103 R 4.0973 7.5663 120.6214 58.9062 30.2483 178.5480 104 Q 4.1046 7.8966 116.4282 58.8083 28.6696 176.8957 105 H 4.6348 8.4057 113.0937 58.0780 31.6127 173.0187 106 G 3.7946 7.4406 107.4529 45.6633 0.0000 173.3986 107 I 3.6668 7.6659 122.8442 60.9466 38.4462 174.8727 108 T 4.5881 8.3563 125.1928 62.1463 68.0941 173.9563 109 I 4.6893 7.8119 118.8193 58.9002 40.8506 174.3318 110 D 4.9370 8.9095 122.1566 52.1382 42.0330 176.0676 111 P 4.5718 0.0000 0.0000 64.5402 31.6782 177.6862 112 K 4.1603 8.0569 118.6588 59.5675 32.7446 178.6306 113 R 3.7098 7.8871 117.2521 58.4835 30.1492 176.1413 114 L 4.1511 7.5591 119.5333 54.9437 41.8629 177.5656 115 A 4.3097 8.5809 131.5507 51.2931 15.8297 174.8868 116 L 4.3935 7.6202 119.2673 53.9000 45.3779 174.3439 117 E 4.4300 8.7070 123.0894 56.7390 31.4589 176.1964 118 K 4.0105 7.8637 120.9847 55.4484 32.3770 175.1095 119 P 4.5217 0.0000 0.0000 61.5943 30.3975 174.1721 120 I 3.5262 8.0163 124.0100 60.9876 38.1101 175.8591 121 K 5.1093 8.5494 131.0302 55.7908 32.8099 174.9480 122 E 4.6772 8.2716 116.7640 54.0390 33.0714 173.8002 123 L 4.4261 9.0080 126.1468 54.5893 43.5328 175.5934 124 G 3.6332 7.7723 109.4389 43.6844 0.0000 172.0571 125 E 4.6862 7.9216 116.8695 54.7752 32.2057 174.7091 126 Y 4.8603 8.1395 117.6546 56.8150 43.4404 174.1099 127 V 4.5962 8.4258 119.7902 61.2626 32.4859 175.2715 128 L 4.4999 8.4201 128.4510 54.8739 44.0088 175.5968 129 T 4.8331 8.3306 114.7946 63.2048 72.9491 172.5268 130 Y 4.8886 9.5127 127.9441 55.8599 41.8190 174.5219 131 K 4.8413 7.2155 124.3170 54.2514 31.6126 174.2469 132 P 4.3814 0.0000 0.0000 64.5644 32.1998 176.5120 133 H 4.9463 7.8182 116.6454 53.2684 32.3887 172.4509 134 P 4.2179 0.0000 0.0000 64.8544 31.2515 176.9270 135 E 4.6402 8.1055 112.4182 55.9330 30.2513 176.6116 136 V 4.3595 7.3662 118.9556 60.7587 31.3784 172.6415 137 P 4.8131 0.0000 0.0000 61.9639 33.2111 175.8434 138 I 4.5460 8.6181 120.9486 59.9097 41.1513 175.0745 139 Q 4.7177 8.7356 127.3797 54.9484 29.0671 176.0966 140 L 4.3489 8.4727 128.2087 53.5464 43.0370 175.9239 141 K 4.2851 8.7276 126.6055 57.0442 33.1635 176.6145 142 V 4.3978 8.4519 124.0190 61.0672 34.5152 175.5948 143 S 4.5978 7.5624 112.2381 57.5908 62.9534 175.8376 144 V 3.8912 8.0542 121.7381 63.3126 32.6503 176.9478 145 V 3.9846 8.8902 128.2626 62.8614 31.5271 175.5034 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 8.15 4.64 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 2 K 8.36 4.78 0.00 1.92 2.21 0.00 1.61 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.53 7.81 3 V 8.53 5.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.99 0.00 0.00 4 I 8.57 4.82 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 1.28 1.36 0.98 0.00 0.00 5 L 8.21 4.79 0.00 1.70 1.78 1.02 0.42 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 6 L 7.84 4.77 0.00 1.64 1.74 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.62 4.71 0.00 1.89 1.77 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 2.05 2.23 0.00 8 P 0.00 4.38 0.00 2.12 2.11 0.00 3.79 0.00 0.00 3.65 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 9 L 8.71 4.25 0.00 1.67 1.69 0.93 0.75 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 10 E 9.45 3.78 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 11 N 8.20 4.40 0.00 2.67 2.88 0.00 0.00 6.97 7.78 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 12 L 7.52 4.11 0.00 1.74 1.60 1.11 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 13 G 7.06 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 0.00 0.00 0.00 0.00 14 D 7.85 4.93 0.00 2.73 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 15 V 7.94 3.91 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 0.78 0.00 0.00 0.93 0.00 0.00 16 G 8.88 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 17 Q 7.42 4.29 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 18 V 8.53 4.88 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 0.97 0.00 0.00 0.93 0.00 0.00 19 V 8.23 4.56 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 0.83 0.00 0.00 0.96 0.00 0.00 20 D 8.60 5.33 0.00 2.72 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 21 V 8.18 4.88 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 0.87 0.00 0.00 1.05 0.00 0.00 22 K 8.61 4.11 0.00 1.90 1.79 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.47 7.81 23 P 0.00 4.29 0.00 2.18 2.10 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 24 G 8.12 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 7.90 4.50 0.00 3.00 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 26 A 7.83 4.18 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 27 R 7.96 4.01 0.00 1.95 1.98 0.00 3.22 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 28 N 8.40 4.97 0.00 2.85 2.83 0.00 0.00 6.68 7.32 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 29 Y 7.02 4.75 0.00 2.86 2.80 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 30 L 7.39 3.57 0.00 1.56 1.42 0.73 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.48 4.35 0.00 1.75 1.73 0.99 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.24 0.00 2.03 2.08 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 1.95 2.27 0.00 33 R 7.86 4.29 0.00 1.47 1.78 0.00 3.29 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 34 G 7.57 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.21 4.59 0.00 1.41 1.55 0.50 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.65 5.27 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 37 V 8.44 4.47 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.90 0.00 0.00 38 L 8.88 4.08 0.00 1.66 1.63 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.36 4.50 1.24 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 0.00 0.00 40 T 7.83 4.24 4.24 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 1.28 0.00 0.00 41 E 8.60 4.00 0.00 2.05 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 2.37 0.00 42 S 7.79 3.93 0.00 3.87 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 43 N 8.07 4.41 0.00 2.77 2.84 0.00 0.00 7.01 6.74 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 44 L 7.79 4.04 0.00 1.63 1.74 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.64 4.10 0.00 1.81 1.84 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.62 1.59 7.81 46 A 7.76 4.09 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.01 3.97 0.00 1.95 1.86 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.24 4.03 0.00 2.18 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 2.60 2.47 0.00 49 A 7.90 3.95 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 50 R 7.70 3.91 0.00 2.00 2.01 0.00 3.28 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.89 0.00 51 I 7.78 3.84 2.00 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 1.76 0.85 0.91 0.00 0.00 52 R 8.60 3.90 0.00 1.92 1.99 0.00 3.27 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 53 A 8.55 3.96 1.38 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 0.00 0.00 54 Q 8.28 3.94 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 55 A 8.29 4.20 1.38 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 0.00 0.00 56 K 8.56 4.16 0.00 2.01 2.07 0.00 1.31 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.77 1.44 7.81 57 R 8.11 3.90 0.00 2.07 2.03 0.00 3.08 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 58 L 7.69 4.43 0.00 1.75 1.74 0.93 0.64 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 59 A 8.28 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 60 E 7.90 4.36 0.00 2.14 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 2.24 2.33 0.00 61 R 7.51 4.00 0.00 2.16 2.01 0.00 3.19 0.00 0.00 3.12 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 62 K 8.26 3.83 0.00 1.53 1.71 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.26 0.98 7.81 63 A 7.31 4.16 1.39 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 0.00 0.00 64 E 7.92 4.17 0.00 2.19 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 2.28 2.37 0.00 65 A 7.70 4.28 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 66 E 7.59 4.21 0.00 2.42 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 0.00 2.26 2.38 0.00 67 R 7.77 4.01 0.00 2.16 1.94 0.00 3.38 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 68 L 7.81 4.07 0.00 1.71 1.69 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.49 4.03 0.00 1.90 1.95 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.53 7.81 70 E 7.70 4.14 0.00 2.23 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 2.57 2.45 0.00 71 I 7.43 4.13 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.38 0.99 0.00 0.00 72 L 7.81 3.98 0.00 1.91 1.67 0.82 0.78 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 E 8.01 4.38 0.00 2.17 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 2.23 2.45 0.00 74 N 7.45 5.00 0.00 2.69 2.79 0.00 0.00 6.72 7.73 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 75 L 7.63 4.57 0.00 1.55 1.49 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 76 T 8.33 4.45 4.24 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 1.21 0.00 0.00 77 L 8.10 4.60 0.00 1.75 1.69 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.24 4.45 4.24 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 1.21 0.00 0.00 79 I 8.74 4.26 1.90 0.00 0.00 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 1.42 1.00 0.93 0.00 0.00 80 P 0.00 4.50 0.00 1.93 2.01 0.00 3.63 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 81 V 8.26 4.39 2.22 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 0.78 0.00 0.00 1.02 0.00 0.00 82 R 8.25 4.60 0.00 1.70 1.49 0.00 2.21 0.00 0.00 2.51 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.14 0.00 83 A 8.10 4.84 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 84 G 9.04 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.51 4.62 0.00 1.93 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 2.22 2.25 0.00 86 T 7.92 4.53 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 87 K 7.93 4.83 0.00 1.71 1.81 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.65 1.48 7.81 88 I 7.70 3.95 1.93 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 1.35 0.81 1.05 0.00 0.00 89 Y 9.72 3.95 0.00 2.95 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 90 G 9.56 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 91 S 8.73 5.42 0.00 3.97 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 92 V 8.10 5.11 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 0.60 0.00 0.00 0.96 0.00 0.00 93 T 8.26 4.89 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 94 A 8.47 4.20 1.38 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 0.00 0.00 95 K 7.70 3.96 0.00 1.85 1.87 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.49 7.81 96 D 8.15 4.47 0.00 2.70 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 97 I 7.11 4.05 2.05 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 1.72 1.04 0.93 0.00 0.00 98 A 7.92 4.10 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.42 3.97 0.00 2.25 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 100 A 7.70 4.17 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.87 4.06 0.00 1.99 1.63 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 102 S 7.79 4.53 0.00 4.09 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 R 7.57 4.10 0.00 1.84 1.92 0.00 3.19 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.82 0.00 104 Q 7.90 4.10 0.00 2.15 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 105 H 8.41 4.63 0.00 3.08 3.26 0.00 5.84 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.44 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 7.67 3.67 1.82 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 1.30 1.10 0.91 0.00 0.00 108 T 8.36 4.59 4.24 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 1.22 0.00 0.00 109 I 7.81 4.69 1.26 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 1.34 0.66 0.56 0.00 0.00 110 D 8.91 4.94 0.00 2.86 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.57 0.00 2.21 2.34 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 112 K 8.06 4.16 0.00 1.77 1.89 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.41 7.81 113 R 7.89 3.71 0.00 0.68 1.69 0.00 3.22 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.62 0.00 114 L 7.56 4.15 0.00 2.03 1.73 1.01 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.58 4.31 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 0.00 116 L 7.62 4.39 0.00 1.56 1.52 0.88 0.99 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 0.00 117 E 8.71 4.43 0.00 2.07 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 2.16 2.24 0.00 118 K 7.86 4.01 0.00 1.69 1.71 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.42 7.81 119 P 0.00 4.52 0.00 1.97 2.01 0.00 3.75 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 2.01 2.10 0.00 120 I 8.02 3.53 1.97 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 1.02 0.93 0.93 0.00 0.00 121 K 8.55 5.11 0.00 1.92 1.68 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.40 7.81 122 E 8.27 4.68 0.00 1.96 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 123 L 9.01 4.43 0.00 1.66 1.72 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.77 3.63 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 0.00 0.00 0.00 125 E 7.92 4.69 0.00 2.09 1.79 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 2.03 2.16 0.00 126 Y 8.14 4.86 0.00 2.97 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 V 8.43 4.60 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 0.86 0.00 0.00 0.97 0.00 0.00 128 L 8.42 4.50 0.00 1.98 1.68 0.97 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.33 4.83 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 130 Y 9.51 4.89 0.00 3.01 2.80 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 0.00 131 K 7.22 4.84 0.00 1.56 1.56 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.26 7.81 132 P 0.00 4.38 0.00 2.16 2.34 0.00 3.82 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 2.21 2.66 0.00 133 H 7.82 4.95 0.00 3.18 3.12 0.00 5.88 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 0.00 134 P 0.00 4.22 0.00 1.98 2.04 0.00 3.09 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 1.88 1.98 0.00 135 E 8.11 4.64 0.00 2.06 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 2.32 2.35 0.00 136 V 7.37 4.36 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 0.84 0.00 0.00 0.94 0.00 0.00 137 P 0.00 4.81 0.00 2.00 1.99 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 138 I 8.62 4.55 1.99 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 1.28 0.98 1.02 0.00 0.00 139 Q 8.74 4.72 0.00 1.91 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.92 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 140 L 8.47 4.35 0.00 1.80 1.61 0.89 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 141 K 8.73 4.29 0.00 1.94 1.73 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.54 1.46 7.81 142 V 8.45 4.40 2.36 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 0.85 0.00 0.00 1.09 0.00 0.00 143 S 7.56 4.60 0.00 3.87 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 0.00 144 V 8.05 3.89 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 1.00 0.00 0.00 1.05 0.00 0.00 145 V 8.89 3.98 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 0.84 0.00 0.00 1.01 0.00 0.00