NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2953 8.3049 118.1956 55.7030 31.3934 176.1091 2 R 3.5602 8.5520 126.8312 56.6837 29.5838 174.3126 3 K 3.9254 8.5558 113.5326 57.9702 29.5833 173.7737 4 I 4.3837 8.4850 121.3014 59.1439 41.3187 175.1651 5 D 5.3057 8.5028 125.8765 54.0976 38.7942 176.2110 6 L 4.3484 8.8536 122.8306 56.2754 42.0969 177.2603 7 C 4.4725 8.3406 117.4636 59.4711 32.3010 173.0461 8 L 4.6540 7.5052 118.8965 54.2965 42.8080 177.4530 9 S 4.8108 8.6654 114.7012 60.4680 62.5739 176.7063 10 S 4.1417 8.1411 115.3497 61.0151 62.6526 174.5772 11 E 4.4340 8.1654 117.3671 55.8106 29.4833 175.9351 12 G 3.8239 8.4124 107.1436 46.4842 0.0000 173.7043 13 S 5.3894 8.1352 115.9138 55.7988 65.5840 173.8428 14 E 4.6084 8.7331 123.8440 54.7953 32.9311 174.9080 15 V 4.9201 8.1374 112.9694 60.0976 34.3083 175.3303 16 I 4.4766 8.6732 122.9474 59.9180 42.4597 174.4401 17 L 3.6213 8.7008 123.4526 55.7066 40.1351 173.5611 18 A 4.2206 8.0131 119.5984 51.8856 17.9133 178.3809 19 T 3.9265 8.6320 119.7366 67.1034 68.6209 175.3092 20 S 4.6180 8.2530 118.7836 56.5456 62.6228 172.8456 21 S 4.8620 8.5821 122.3839 56.4329 64.3210 172.6789 22 D 4.8399 8.6987 127.0978 53.2662 42.3406 176.4990 23 E 4.2597 8.6488 123.3969 57.3421 30.2935 177.3195 24 K 4.3230 8.2528 115.8803 56.7441 33.6166 176.4698 25 H 4.7104 8.6668 117.3767 53.2279 27.8882 170.8983 26 P 4.8288 0.0000 0.0000 60.8741 32.5544 176.7778 27 P 4.2120 0.0000 0.0000 65.0033 30.6396 178.2127 28 E 4.0358 8.2310 117.4524 58.9961 29.3995 178.6072 29 N 4.4608 8.3987 117.5906 55.7769 37.0619 177.3589 30 I 3.8200 7.6240 122.0254 63.6094 37.3584 177.2950 31 I 4.3114 7.3472 111.0132 60.8048 37.4640 175.9908 32 D 4.4411 7.9572 118.7096 56.6865 42.2879 178.4493 33 G 4.0219 8.5171 105.9646 45.7182 0.0000 172.5381 34 N 4.8574 7.8882 116.2760 50.6539 39.6310 174.8457 35 P 4.4741 0.0000 0.0000 65.6788 31.6167 177.6761 36 E 4.2504 8.3188 116.3473 58.0622 29.7073 176.6769 37 T 4.6476 7.7768 108.8469 59.7476 71.0924 173.1227 38 F 5.6059 7.6149 116.5840 56.1389 41.2906 172.7962 39 W 4.7532 9.0934 130.2851 56.3016 31.9057 174.7969 40 T 4.8647 7.8089 121.3569 59.9962 69.9418 173.3272 41 T 3.8126 7.7757 117.7691 61.5283 69.5580 174.6424 42 T 4.3258 8.5029 113.6635 61.6698 69.3604 174.7991 43 G 4.1578 7.8366 111.6279 47.1718 0.0000 175.0270 44 M 4.4573 7.8244 120.3019 53.2300 32.3328 174.9139 45 F 4.7101 8.4058 121.8100 54.8827 41.0140 174.5982 46 P 5.0688 0.0000 0.0000 62.2820 32.7971 175.5794 47 Q 4.8207 9.0943 119.8845 54.6195 30.6889 174.4162 48 E 5.8983 8.9751 122.2094 53.6934 33.3210 174.7425 49 F 5.3353 7.7779 113.4691 56.9015 41.3326 172.4972 50 I 4.9659 9.0423 121.2823 59.7248 40.4725 174.6268 51 I 4.7377 8.7497 127.2422 59.8778 39.4957 174.5904 52 C 4.4113 8.8803 126.6124 58.5010 28.1403 174.7909 53 F 4.0823 8.5977 124.5330 57.8406 39.6004 177.3287 54 H 4.3745 8.4172 112.6992 55.8115 25.8667 173.7243 55 K 4.5348 7.2446 117.5981 56.2452 36.5305 174.6644 56 H 4.4831 8.5670 117.6776 55.2439 29.4746 174.9726 57 V 4.6266 7.9029 117.2793 59.2985 35.1649 175.4057 58 R 4.4627 8.7948 124.8665 55.0240 31.3307 174.9178 59 I 4.4577 8.6868 129.1192 60.6774 38.4496 176.5471 60 E 4.5353 9.5149 126.2376 57.0808 32.3370 176.1219 61 R 5.0429 7.8243 116.1152 54.5160 35.4266 174.2173 62 L 5.0873 9.0226 121.6486 53.2025 44.5833 176.0390 63 V 4.5792 9.0013 126.2143 61.7065 32.7987 174.6434 64 I 4.7330 8.5111 129.8637 59.5310 40.1796 174.7366 65 Q 4.9932 9.1644 129.7576 53.7846 30.6585 174.2760 66 S 4.8889 8.0426 121.2738 57.1314 68.3091 172.3457 67 Y 4.6171 8.3978 117.1862 56.4311 40.9441 177.8357 68 F 4.4250 8.8411 119.6352 58.3055 38.3010 175.8456 69 V 3.9660 7.8593 119.7094 63.8094 31.4396 173.5405 70 Q 4.4974 8.4383 125.5378 56.4184 31.5458 174.3527 71 T 4.7091 8.5184 114.5170 60.0981 70.9110 172.8403 72 L 4.4481 8.8251 130.8087 53.2359 43.7417 175.4072 73 K 4.5736 9.2099 130.5297 55.3930 32.8861 175.1129 74 I 4.6013 8.3601 129.2731 60.0938 38.6051 174.6571 75 E 5.3077 9.0261 128.7212 54.1111 32.6326 174.7301 76 K 5.2051 9.4183 124.6552 55.2908 36.4342 174.7833 77 S 4.5908 9.0974 115.4228 56.6223 66.0516 174.2666 78 T 4.9526 8.1113 121.1796 62.4375 69.2854 174.4028 79 S 4.5084 7.5363 117.6098 57.4246 64.0756 173.0766 80 K 4.5256 8.4970 117.3451 56.9762 33.4975 175.5449 81 E 4.6819 7.3183 117.1342 53.5947 32.7025 174.7131 82 P 4.1326 0.0000 0.0000 62.0603 30.2748 175.8609 83 V 4.5147 6.5856 110.0288 60.6489 35.9730 174.2932 84 D 4.2404 8.6421 119.6887 54.7708 38.1387 172.1518 85 F 5.0127 8.2349 120.5831 55.0069 42.7341 174.5339 86 E 4.9086 9.2271 120.9454 54.3622 33.6987 175.2746 87 Q 4.1282 8.9531 122.5953 56.7952 28.6147 174.9649 88 W 4.9020 9.3562 135.0000 58.2763 31.2782 176.7327 89 I 4.3512 7.4453 121.0379 59.4772 39.2498 172.4336 90 E 4.6245 8.7237 130.0431 55.4403 29.7165 174.7764 91 K 4.8296 8.9802 128.9489 54.3279 35.7065 174.6346 92 D 5.1823 8.6896 125.0797 52.7421 40.8242 175.1405 93 L 4.8517 8.7703 123.1271 53.2413 44.6191 175.9865 94 V 3.7944 8.3134 124.5160 62.1021 32.2144 174.7419 95 H 3.8212 8.2105 126.7657 56.8062 28.9406 174.5209 96 T 4.1596 8.4075 118.6215 60.2321 68.2908 173.9971 97 E 4.3626 8.4608 127.7881 55.2573 29.3880 176.1949 98 G 3.7415 8.7437 111.5474 45.9759 0.0000 171.5899 99 Q 4.3844 7.3630 114.9249 53.4377 30.8656 175.9369 100 L 3.8283 8.4481 123.7499 54.4090 40.5313 176.3513 101 Q 4.1211 8.0118 125.9310 54.4742 28.4853 174.3620 102 N 4.6779 8.4194 124.0536 52.6300 39.4540 175.0956 103 E 4.2348 9.0438 125.9750 55.1464 30.7705 175.8100 104 E 4.5691 8.7562 127.4323 55.3735 29.5595 174.8436 105 I 4.0799 8.5865 127.9388 59.8478 38.5407 175.7097 106 V 4.2493 8.3589 121.9180 60.0620 30.4991 174.0332 107 A 4.5672 8.1067 123.9074 50.0277 21.3751 174.9036 108 H 5.1358 8.9604 120.4339 54.8815 30.3638 174.1472 109 G 3.9763 9.1398 109.2087 45.6438 0.0000 171.3177 110 S 5.2627 8.4090 116.5425 56.8482 64.5095 173.6501 111 A 4.6673 8.2846 124.1970 50.8893 22.7055 176.4067 112 T 4.4383 9.0891 108.4826 61.1592 71.7972 173.7604 113 Y 5.3365 7.7467 118.0206 56.0646 42.7384 174.3189 114 L 5.1773 8.7328 121.7181 52.9560 45.9065 175.4232 115 R 4.7281 9.1223 124.7369 54.6067 32.0329 174.9863 116 F 4.7376 8.2713 127.3999 56.7868 40.0932 175.5281 117 I 4.5477 8.8665 127.3835 59.7945 38.1739 175.1798 118 I 4.5220 8.9113 129.8857 60.3984 36.6711 177.1944 119 V 3.7321 8.5275 127.2715 65.6697 31.8368 175.9586 120 S 5.0198 8.5943 114.3303 57.2364 67.8169 172.4552 121 A 5.1209 8.0580 121.4098 50.3044 22.5065 177.0487 122 F 4.1820 9.1346 117.5831 59.4871 39.0237 176.0378 123 D 4.9663 7.7705 115.5478 52.4697 43.5184 176.0231 124 H 4.4505 8.2213 115.8855 55.8805 28.5549 174.7626 125 F 4.9971 7.6161 117.4981 56.0193 42.0749 173.9910 126 A 5.3132 8.9054 125.8078 50.0843 22.0947 174.9856 127 S 5.8559 9.3279 115.9312 55.5909 66.5797 173.0669 128 V 4.6589 8.9250 123.9223 60.2099 32.8119 175.6419 129 H 4.8663 8.9904 123.8309 57.7460 31.7983 174.8869 130 S 4.7453 8.0929 111.8794 57.2564 66.0940 173.7301 131 V 5.0793 8.3822 119.2594 59.9526 35.6262 174.6863 132 S 4.8129 9.2367 117.5762 56.9644 66.6287 172.2122 133 A 5.2047 8.7949 127.0330 50.4512 21.4378 175.4998 134 E 4.2645 9.1343 123.9087 55.9505 30.4595 174.6243 135 G 4.7208 7.9110 115.6861 47.2958 0.0000 171.3326 136 T 5.1029 7.9014 117.9295 61.9295 73.6171 173.6873 137 V 3.9360 8.3296 117.4376 61.7829 31.7048 176.1236 138 V 4.0840 8.8095 125.7513 64.2028 32.5468 176.3710 139 S 4.6922 7.6842 115.7976 56.5852 66.2673 173.5540 140 N 4.6537 8.7480 122.3929 52.5641 39.4353 175.7812 141 L 3.9359 8.7132 125.4318 58.2799 42.2983 177.8897 142 S 4.6529 7.9212 109.2366 58.2203 63.4596 174.0414 143 S 4.1490 7.6052 122.5079 59.3678 63.8754 173.7865 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 8.30 4.30 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 2 R 8.55 3.56 0.00 2.07 2.03 0.00 3.36 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 3 K 8.56 3.93 0.00 1.88 1.84 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.41 7.81 4 I 8.48 4.38 1.89 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 1.26 1.45 1.00 0.00 0.00 5 D 8.50 5.31 0.00 2.65 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 6 L 8.85 4.35 0.00 1.78 1.84 0.87 0.88 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 7 C 8.34 4.47 0.00 3.19 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 8 L 7.51 4.65 0.00 1.84 1.66 0.98 0.85 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 9 S 8.67 4.81 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 10 S 8.14 4.14 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 11 E 8.17 4.43 0.00 2.18 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 2.28 2.46 0.00 12 G 8.41 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.14 5.39 0.00 3.88 3.54 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 14 E 8.73 4.61 0.00 2.02 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 2.33 2.38 0.00 15 V 8.14 4.92 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 0.61 0.00 0.00 0.84 0.00 0.00 16 I 8.67 4.48 1.91 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 1.13 1.30 0.99 0.00 0.00 17 L 8.70 3.62 0.00 1.95 1.73 0.91 0.96 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 18 A 8.01 4.22 1.20 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 0.00 0.00 19 T 8.63 3.93 4.38 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 1.27 0.00 0.00 20 S 8.25 4.62 0.00 3.87 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 21 S 8.58 4.86 0.00 3.91 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 22 D 8.70 4.84 0.00 2.72 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 23 E 8.65 4.26 0.00 1.99 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 2.33 0.00 24 K 8.25 4.32 0.00 1.69 1.69 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.38 7.81 25 H 8.67 4.71 0.00 2.94 3.04 0.00 5.85 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.83 0.00 2.40 2.18 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 27 P 0.00 4.21 0.00 2.00 1.64 0.00 3.63 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.30 0.00 28 E 8.23 4.04 0.00 2.05 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 2.42 0.00 29 N 8.40 4.46 0.00 3.02 3.20 0.00 0.00 7.27 8.63 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 30 I 7.62 3.82 1.86 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.60 0.89 0.00 0.00 31 I 7.35 4.31 2.00 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 1.49 0.66 1.03 0.00 0.00 32 D 7.96 4.44 0.00 2.76 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.52 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 0.00 0.00 0.00 34 N 7.89 4.86 0.00 2.99 2.80 0.00 0.00 7.59 7.94 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 35 P 0.00 4.47 0.00 2.10 2.17 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 36 E 8.32 4.25 0.00 2.00 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 2.36 2.27 0.00 37 T 7.78 4.65 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 1.18 0.00 0.00 38 F 7.61 5.61 0.00 3.23 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 39 W 9.09 4.75 0.00 3.39 3.12 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 40 T 7.81 4.86 4.42 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 0.91 0.00 0.00 41 T 7.78 3.81 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 0.87 0.00 0.00 42 T 8.50 4.33 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 43 G 7.84 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 0.00 0.00 0.00 0.00 44 M 7.82 4.46 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.61 0.00 45 F 8.41 4.71 0.00 3.00 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 46 P 0.00 5.07 0.00 1.99 2.07 0.00 3.67 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 2.06 2.15 0.00 47 Q 9.09 4.82 0.00 2.46 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.92 6.22 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 48 E 8.98 5.90 0.00 1.90 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 2.20 2.06 0.00 49 F 7.78 5.34 0.00 3.04 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 50 I 9.04 4.97 1.93 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 1.19 0.63 1.11 0.00 0.00 51 I 8.75 4.74 1.61 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.40 0.65 0.00 0.00 52 C 8.88 4.41 0.00 2.68 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 53 F 8.60 4.08 0.00 3.00 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 54 H 8.42 4.37 0.00 3.33 3.40 0.00 5.73 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.24 4.53 0.00 1.85 1.88 0.00 1.32 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.42 7.81 56 H 8.57 4.48 0.00 3.06 3.22 0.00 5.56 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.90 4.63 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 0.62 0.00 0.00 -0.02 0.00 0.00 58 R 8.79 4.46 0.00 1.76 1.78 0.00 3.25 0.00 0.00 3.18 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 59 I 8.69 4.46 2.23 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 1.15 0.26 1.23 0.00 0.00 60 E 9.51 4.54 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 2.28 2.28 0.00 61 R 7.82 5.04 0.00 1.71 1.74 0.00 3.38 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 62 L 9.02 5.09 0.00 1.51 1.63 0.62 0.92 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 63 V 9.00 4.58 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 1.03 0.00 0.00 0.98 0.00 0.00 64 I 8.51 4.73 1.81 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.61 0.78 0.00 0.00 65 Q 9.16 4.99 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.52 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 66 S 8.04 4.89 0.00 3.71 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 8.40 4.62 0.00 1.95 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 0.00 0.00 0.00 0.00 68 F 8.84 4.43 0.00 3.47 3.31 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 0.00 69 V 7.86 3.97 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 0.81 0.00 0.00 1.15 0.00 0.00 70 Q 8.44 4.50 0.00 1.19 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.38 0.00 0.00 0.00 0.00 0.00 1.97 1.27 0.00 71 T 8.52 4.71 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 1.17 0.00 0.00 72 L 8.83 4.45 0.00 1.82 1.82 1.02 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 73 K 9.21 4.57 0.00 1.88 1.86 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.63 7.81 74 I 8.36 4.60 2.05 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 1.61 0.79 0.89 0.00 0.00 75 E 9.03 5.31 0.00 2.01 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 2.39 2.42 0.00 76 K 9.42 5.21 0.00 1.43 1.71 0.00 0.61 0.00 0.00 0.83 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.29 1.07 7.81 77 S 9.10 4.59 0.00 2.72 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 78 T 8.11 4.95 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 1.05 0.00 0.00 79 S 7.54 4.51 0.00 3.70 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 80 K 8.50 4.53 0.00 1.95 1.94 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.45 7.81 81 E 7.32 4.68 0.00 1.89 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 2.21 2.22 0.00 82 P 0.00 4.13 0.00 1.97 1.91 0.00 3.52 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.88 0.00 83 V 6.59 4.51 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 0.64 0.00 0.00 0.86 0.00 0.00 84 D 8.64 4.24 0.00 2.70 2.51 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 0.00 85 F 8.23 5.01 0.00 2.97 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 86 E 9.23 4.91 0.00 1.80 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 2.22 2.21 0.00 87 Q 8.95 4.13 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 88 W 9.36 4.90 0.00 3.29 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 89 I 7.45 4.35 1.69 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 0.41 0.25 0.62 0.00 0.00 90 E 8.72 4.62 0.00 2.03 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 2.33 0.00 91 K 8.98 4.83 0.00 1.81 1.58 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.34 7.81 92 D 8.69 5.18 0.00 2.78 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 93 L 8.77 4.85 0.00 1.67 1.93 0.92 1.06 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 94 V 8.31 3.79 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 0.84 0.00 0.00 0.95 0.00 0.00 95 H 8.21 3.82 0.00 1.40 2.65 0.00 5.79 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.41 4.16 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 97 E 8.46 4.36 0.00 1.95 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 2.23 1.93 0.00 98 G 8.74 3.74 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 0.00 0.00 0.00 99 Q 7.36 4.38 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.08 7.05 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 100 L 8.45 3.83 0.00 1.58 1.56 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 8.01 4.12 0.00 2.02 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.41 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 102 N 8.42 4.68 0.00 2.58 2.72 0.00 0.00 7.10 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 0.00 103 E 9.04 4.23 0.00 1.98 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 2.23 2.36 0.00 104 E 8.76 4.57 0.00 1.96 1.87 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 2.25 2.32 0.00 105 I 8.59 4.08 1.89 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 1.17 0.46 0.71 0.00 0.00 106 V 8.36 4.25 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.92 0.00 0.00 107 A 8.11 4.57 0.54 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 0.00 108 H 8.96 5.14 0.00 3.10 3.34 0.00 5.94 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 0.00 109 G 9.14 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 0.00 0.00 0.00 110 S 8.41 5.26 0.00 3.63 3.68 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 A 8.28 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 T 9.09 4.44 3.56 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 0.00 0.00 0.00 0.87 0.00 0.00 113 Y 7.75 5.34 0.00 2.74 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 0.00 114 L 8.73 5.18 0.00 1.45 1.16 1.25 0.63 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 R 9.12 4.73 0.00 1.56 1.52 0.00 2.86 0.00 0.00 3.15 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.27 0.00 116 F 8.27 4.74 0.00 1.69 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 I 8.87 4.55 1.95 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.63 0.92 0.00 0.00 118 I 8.91 4.52 2.04 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.87 1.08 0.00 0.00 119 V 8.53 3.73 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.01 0.00 0.00 120 S 8.59 5.02 0.00 3.74 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 0.00 121 A 8.06 5.12 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 0.00 122 F 9.13 4.18 0.00 2.64 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 0.00 123 D 7.77 4.97 0.00 2.73 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 0.00 0.00 0.00 0.00 124 H 8.22 4.45 0.00 2.94 3.12 0.00 5.47 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 7.62 5.00 0.00 2.63 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.91 5.31 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 0.00 127 S 9.33 5.86 0.00 4.06 4.15 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 0.00 128 V 8.93 4.66 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 1.19 0.00 0.00 1.00 0.00 0.00 129 H 8.99 4.87 0.00 3.36 3.41 0.00 5.77 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.09 4.75 0.00 3.96 3.74 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 0.00 131 V 8.38 5.08 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 0.64 0.00 0.00 1.03 0.00 0.00 132 S 9.24 4.81 0.00 3.91 3.68 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 0.00 133 A 8.79 5.20 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 0.00 134 E 9.13 4.26 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 135 G 7.91 4.72 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 0.00 136 T 7.90 5.10 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 1.21 0.00 0.00 137 V 8.33 3.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.93 0.00 0.00 138 V 8.81 4.08 2.16 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 0.67 0.00 0.00 0.91 0.00 0.00 139 S 7.68 4.69 0.00 3.73 3.64 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 0.00 140 N 8.75 4.65 0.00 3.07 2.73 0.00 0.00 6.77 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 0.00 141 L 8.71 3.94 0.00 1.82 1.71 0.99 1.02 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 0.00 142 S 7.92 4.65 0.00 4.01 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 0.00 143 S 7.61 4.15 0.00 3.84 3.73 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