NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2199 8.1633 120.2938 54.6782 33.1316 174.2468 2 K 3.9041 8.5220 126.4247 56.2598 32.5179 175.7942 3 G 3.9445 8.5455 113.8612 44.9512 0.0000 171.7193 4 D 4.6509 8.4494 119.2916 54.1158 42.0136 177.2016 5 T 3.8554 8.8589 122.8062 66.8568 68.5317 176.6459 6 K 3.7911 8.1576 120.9086 59.2575 32.2273 178.7934 7 V 3.9070 8.5967 118.8188 66.1229 31.4875 178.0242 8 I 3.7433 7.8120 119.4743 64.5535 36.9337 178.0493 9 N 4.2621 8.3017 117.3217 56.4770 38.3016 176.9743 10 Y 4.0755 8.0302 117.9542 61.1350 38.0353 178.5459 11 L 3.8698 8.4686 120.0906 58.0902 41.7145 179.3738 12 N 4.2479 8.6516 116.4716 56.1336 38.2215 177.3734 13 K 3.8524 8.0314 120.2385 59.4304 32.6733 178.4288 14 L 3.9806 8.0855 119.6073 57.6775 41.4183 178.9762 15 L 3.9673 7.8782 120.5538 58.4618 41.7775 179.2104 16 G 3.6864 8.2796 105.5122 48.0006 0.0000 175.3544 17 N 4.3698 8.1016 118.4781 56.2792 38.6202 177.4210 18 E 4.1106 8.1856 119.7810 59.2642 29.6860 179.1414 19 L 4.3526 8.4077 120.1059 58.1839 40.4284 179.7332 20 V 3.6135 7.6812 120.7170 64.5993 31.4062 178.0808 21 A 3.7955 7.9756 121.5154 54.9258 18.3225 179.5928 22 I 3.7646 8.2760 118.5639 64.7164 37.1222 178.5083 23 N 4.4029 7.7684 116.5672 56.2974 38.4125 177.3453 24 Q 3.8311 8.3170 121.3088 59.4021 29.0720 178.0448 25 Y 4.3564 8.2773 118.1150 60.9114 37.9170 178.0724 26 F 3.8487 8.3137 121.3189 61.0857 39.5111 176.6687 27 L 3.9330 8.2557 120.1152 58.6707 41.8396 178.3474 28 H 3.7411 8.2450 115.8310 58.8921 28.6124 177.1969 29 A 4.1522 8.3388 122.5265 55.6872 18.1419 179.9543 30 R 3.7988 7.7537 115.5716 58.6947 30.1109 179.2966 31 M 3.4462 7.6935 119.2458 58.1460 31.8912 178.4809 32 F 4.5193 7.6514 118.2021 60.5057 39.1450 177.5591 33 K 3.8754 8.3392 119.4284 59.5959 31.7825 177.9054 34 N 4.2307 7.9172 115.9582 56.8456 38.9088 176.4275 35 W 4.7349 7.8540 117.3855 57.9648 29.2565 177.2674 36 G 4.0220 8.2046 107.4568 45.5880 0.0000 174.9927 37 L 4.4001 8.0660 121.9045 52.9716 38.2030 177.1282 38 K 3.8343 7.9318 122.9615 60.0721 32.4596 177.2944 39 R 3.9519 8.3554 118.8823 59.0885 29.9160 178.3943 40 L 4.1059 7.8828 118.9484 57.2636 41.6154 178.6728 41 N 4.5126 8.1949 116.6395 56.8244 38.9432 176.2582 42 D 4.2991 8.1197 120.1778 57.5218 40.8907 179.2316 43 V 3.3379 7.4686 118.2228 66.0655 31.4176 178.0065 44 E 3.6784 8.3619 118.4604 59.0985 29.3305 178.6664 45 Y 3.9013 8.0788 119.8150 61.1462 38.9062 178.0578 46 H 4.2132 8.1612 116.7271 58.5502 28.6096 177.6462 47 E 3.6899 7.9996 121.0171 58.7274 29.1326 178.9188 48 S 4.1495 8.0341 113.7437 61.5231 62.4164 176.3165 49 I 3.5486 7.2733 122.1032 64.2809 36.8977 177.5265 50 D 4.2479 7.8142 118.7908 57.8143 40.9490 178.5111 51 E 4.1713 8.4744 118.9018 59.6431 29.3641 179.4507 52 M 4.0712 8.0233 118.8858 58.2551 32.0116 178.7548 53 K 3.9083 8.1398 118.6949 59.7156 32.1975 178.9422 54 H 4.0575 8.0505 115.9243 58.8334 28.6275 177.3946 55 A 4.2318 8.1981 122.4696 55.5148 18.1389 178.8827 56 D 4.3291 8.2320 116.3406 57.8097 41.3164 178.9402 57 R 3.8492 7.8318 118.1867 59.4049 30.0161 178.5813 58 Y 4.3427 7.7360 116.4171 61.2669 37.9234 178.7392 59 I 3.7647 8.2464 120.9802 64.7423 37.2845 178.4407 60 E 4.1010 8.5921 119.3207 58.8451 29.2255 179.5207 61 R 4.0213 7.8798 118.7103 59.4747 30.3275 178.2305 62 I 3.7430 8.4532 119.9560 64.6830 37.1783 178.3415 63 L 4.0852 8.1105 119.5035 57.8245 41.2052 179.4536 64 F 4.4129 8.0799 119.6925 61.1668 39.6733 176.4394 65 L 4.2681 8.3449 117.7838 53.6553 41.1283 176.9614 66 E 3.5673 7.8386 117.4363 57.5068 27.1562 174.5623 67 G 3.9533 8.3705 107.6105 44.0168 0.0000 173.8328 68 L 4.5286 8.0079 118.9824 51.9813 42.1129 175.2357 69 P 4.3964 0.0000 0.0000 62.5384 31.7421 175.8769 70 N 4.7003 9.5402 122.5609 52.4746 38.6706 173.8520 71 L 4.6460 8.3648 124.7707 54.6036 42.2333 177.3715 72 Q 4.2082 8.5302 122.5960 57.5271 29.6005 175.7983 73 D 4.6895 8.0380 117.2696 52.7514 41.9583 175.2247 74 L 4.5744 8.2851 125.4714 52.7131 44.0609 176.3627 75 G 3.7739 8.4735 115.2576 44.7634 0.0000 171.9617 76 K 4.0962 8.3069 120.6609 55.5244 32.1662 176.5445 77 L 4.0115 8.4163 127.1988 54.6520 42.1174 176.2097 78 N 4.8409 8.7352 121.5192 52.0109 40.2934 174.0400 79 I 3.9015 8.5931 126.9088 63.6659 37.7944 178.1451 80 G 4.1781 8.2441 101.9280 45.9386 0.0000 172.5991 81 E 4.7564 8.7359 116.4601 55.7502 31.7418 176.2888 82 D 5.0594 7.6909 117.7793 50.3223 44.0049 176.0996 83 V 4.0353 8.5458 119.0704 66.8138 31.3526 177.3782 84 E 3.8458 8.2558 117.9078 59.4423 29.5000 177.9158 85 E 3.9742 8.6435 119.2666 59.7981 29.6378 179.0252 86 M 4.1033 8.4678 116.9940 58.2224 31.5467 178.3811 87 L 4.1475 8.6958 120.5446 57.7277 41.8515 179.5835 88 R 3.9128 8.5722 118.9047 59.2468 30.0259 178.5548 89 S 4.1026 8.1851 113.1024 61.5513 62.4833 175.7418 90 D 4.3075 8.1367 121.5296 57.3313 40.4743 178.7780 91 L 4.0246 8.2843 120.5548 58.1999 42.2013 178.7986 92 A 3.9850 8.1192 120.6992 54.9897 18.1958 179.4913 93 L 3.9090 7.8221 118.4342 58.3784 42.2769 178.8950 94 E 4.0737 8.2705 118.5431 59.4764 29.4955 179.3727 95 L 4.0610 8.2619 119.1849 58.0232 41.8043 179.3792 96 D 4.5316 8.2774 118.9791 57.1535 40.7093 178.9751 97 G 3.6942 8.4236 106.0319 47.2098 0.0000 175.8483 98 A 4.0311 8.0524 123.3426 54.7710 18.4524 179.3083 99 K 3.7877 7.8925 117.7672 60.0086 32.2223 178.6167 100 N 4.3698 8.0626 116.1252 56.3176 38.3733 177.3302 101 L 3.9768 8.1101 120.3487 57.8851 41.7338 179.7628 102 R 3.8890 8.3811 118.3068 59.1665 30.1455 178.7073 103 E 3.8312 8.0794 118.5931 59.2126 29.6151 178.5910 104 A 2.7897 7.6678 120.6686 54.8711 18.3621 179.4253 105 I 3.6845 7.9452 118.6993 64.6401 37.3201 178.7640 106 G 3.6350 7.8201 105.8519 47.9468 0.0000 175.1450 107 Y 3.9564 7.7834 121.2924 60.2184 38.9437 177.1248 108 A 3.7961 8.0861 122.1322 55.5300 18.4505 179.0455 109 D 4.0348 7.8907 116.3014 57.4756 41.0453 178.5884 110 S 4.1043 7.4201 113.1192 60.4732 63.2028 175.7362 111 V 3.9016 6.8180 114.1935 60.8323 31.3968 176.1038 112 H 2.9712 7.0228 113.9532 56.5609 27.0786 176.4076 113 D 4.5392 7.3071 121.4891 53.4953 37.8629 176.2101 114 Y 4.2844 7.5647 121.4040 60.2791 38.3646 177.8936 115 V 3.7814 7.8341 119.9562 64.4855 31.8907 178.3026 116 S 4.1557 8.5208 115.8617 61.4420 62.6243 176.5978 117 R 3.8773 8.1111 121.1585 59.5114 29.8908 177.9224 118 D 4.3281 8.2971 117.8966 57.6775 41.2201 177.9185 119 M 4.0060 8.3375 118.8420 58.9093 32.1304 178.0454 120 M 4.1117 8.3946 119.1175 58.4270 32.1199 178.7843 121 I 3.7032 8.1059 120.2279 64.4878 37.4079 178.2933 122 E 3.9647 8.0911 119.1983 59.3758 29.1679 179.4704 123 I 3.5177 7.6716 119.7740 64.3781 37.2039 178.1958 124 L 3.9314 8.1938 121.3662 58.0713 41.8827 178.8894 125 R 3.9004 8.1504 118.7234 59.6012 29.9970 178.2404 126 D 4.3343 7.9329 118.3418 57.3126 40.8116 178.6639 127 E 3.9264 8.3564 119.3243 59.4328 29.4813 178.8177 128 E 4.1079 8.7175 119.8967 59.2676 29.5954 179.0260 129 G 3.7053 7.9443 105.4492 48.3676 0.0000 175.3353 130 H 4.4399 8.0925 119.1559 58.4296 28.6314 177.8497 131 I 3.8154 8.4780 122.0061 64.5684 36.9924 177.5370 132 D 4.4252 8.5292 119.1518 57.3896 40.9451 178.5026 133 W 4.1202 8.2375 128.3130 60.4818 30.7979 177.7461 134 L 3.7735 8.3431 118.9303 58.0035 41.1401 179.4098 135 E 3.9274 8.5042 118.5975 59.7529 29.3756 179.6747 136 T 3.8097 7.9643 115.6811 66.5516 68.4835 176.6521 137 E 3.7931 7.7108 120.3996 59.3880 29.4887 179.3560 138 L 3.7667 7.7451 118.9328 57.9348 41.6231 179.4002 139 D 4.3664 8.1778 118.7258 56.9759 40.6645 178.7853 140 L 4.0138 7.8921 119.8053 57.7760 41.5349 179.3422 141 I 3.4075 7.5296 119.7821 64.5055 36.6887 178.4667 142 Q 3.9933 7.2525 117.1844 58.6147 28.6708 178.4277 143 K 4.1431 7.8849 119.0410 58.9735 32.3273 178.4697 144 M 4.3963 8.2453 114.3164 53.7882 32.3991 177.0035 145 G 4.1228 7.4459 105.6226 45.9362 0.0000 174.6010 146 L 3.8903 8.3904 120.9656 58.1215 42.1809 179.0245 147 Q 4.0042 8.1646 117.4942 59.4855 28.8061 179.0367 148 N 4.3689 8.1550 116.5408 56.2694 38.3740 176.6865 149 Y 3.9457 7.8092 120.1141 60.7018 39.2561 177.7179 150 L 4.1224 8.4444 120.2813 58.0827 41.8667 179.3984 151 Q 3.9549 8.1298 119.0434 59.0388 28.7880 177.8031 152 A 4.1359 7.5995 119.5910 53.7140 18.6062 178.2773 153 Q 4.2949 7.6277 115.7431 55.6694 29.0983 177.6131 154 I 3.8675 7.5236 121.6583 63.6618 37.4108 176.6557 155 R 4.6139 7.5470 117.3012 54.1397 32.0579 175.9608 156 E 4.1424 8.5451 117.0892 56.7148 29.8490 176.6031 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 4.22 0.00 1.53 1.66 0.00 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 2 K 8.52 3.90 0.00 1.71 1.72 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.47 7.81 3 G 8.55 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.45 4.65 0.00 2.77 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.86 3.86 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 6 K 8.16 3.79 0.00 1.72 1.96 0.00 1.47 0.00 0.00 1.12 0.00 0.00 2.55 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.71 1.03 7.81 7 V 8.60 3.91 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 1.08 0.00 0.00 1.21 0.00 0.00 8 I 7.81 3.74 2.04 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 1.55 0.57 0.92 0.00 0.00 9 N 8.30 4.26 0.00 2.62 2.66 0.00 0.00 7.08 7.44 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 10 Y 8.03 4.08 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 11 L 8.47 3.87 0.00 2.02 1.78 1.08 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.65 4.25 0.00 2.85 2.83 0.00 0.00 6.72 7.58 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 13 K 8.03 3.85 0.00 1.70 2.03 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.46 7.81 14 L 8.09 3.98 0.00 1.07 1.21 0.90 0.42 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 15 L 7.88 3.97 0.00 1.67 1.85 1.06 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.28 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 17 N 8.10 4.37 0.00 2.99 2.90 0.00 0.00 7.00 7.01 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 18 E 8.19 4.11 0.00 2.24 2.28 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 2.77 2.72 0.00 19 L 8.41 4.35 0.00 1.86 1.95 0.94 1.04 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 20 V 7.68 3.61 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 0.98 0.00 0.00 0.89 0.00 0.00 21 A 7.98 3.80 1.46 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 0.00 0.00 22 I 8.28 3.76 1.89 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 1.61 1.35 0.90 0.00 0.00 23 N 7.77 4.40 0.00 3.01 2.85 0.00 0.00 6.70 7.98 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 24 Q 8.32 3.83 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.25 2.09 0.00 25 Y 8.28 4.36 0.00 3.17 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 26 F 8.31 3.85 0.00 3.41 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 27 L 8.26 3.93 0.00 1.94 1.59 0.88 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.24 3.74 0.00 3.48 3.26 0.00 5.71 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 29 A 8.34 4.15 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 30 R 7.75 3.80 0.00 1.72 1.87 0.00 3.24 0.00 0.00 3.05 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.63 0.00 31 M 7.69 3.45 0.00 0.95 1.62 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.17 0.00 32 F 7.65 4.52 0.00 3.28 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.34 3.88 0.00 1.95 1.88 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.43 7.81 34 N 7.92 4.23 0.00 2.69 2.72 0.00 0.00 7.36 8.81 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 35 W 7.85 4.73 0.00 3.75 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.20 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 37 L 8.07 4.40 0.00 2.16 1.68 1.04 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.93 3.83 0.00 1.98 1.84 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.61 1.59 7.81 39 R 8.36 3.95 0.00 2.01 2.02 0.00 3.35 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 40 L 7.88 4.11 0.00 1.67 0.93 1.05 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.19 4.51 0.00 3.13 3.01 0.00 0.00 7.21 8.49 0.00 0.00 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 D 8.12 4.30 0.00 2.96 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 43 V 7.47 3.34 1.71 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 -0.49 0.00 0.00 0.77 0.00 0.00 44 E 8.36 3.68 0.00 2.20 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 0.00 2.53 3.06 0.00 45 Y 8.08 3.90 0.00 2.94 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 46 H 8.16 4.21 0.00 3.25 3.22 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.00 3.69 0.00 1.30 1.12 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 1.70 1.90 0.00 48 S 8.03 4.15 0.00 4.04 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 49 I 7.27 3.55 1.87 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.52 0.85 0.00 0.00 50 D 7.81 4.25 0.00 2.93 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.47 4.17 0.00 2.09 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 2.73 2.81 0.00 52 M 8.02 4.07 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.55 0.00 53 K 8.14 3.91 0.00 1.86 1.83 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.62 7.81 54 H 8.05 4.06 0.00 3.57 3.36 0.00 5.65 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 55 A 8.20 4.23 1.46 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 0.00 0.00 56 D 8.23 4.33 0.00 2.89 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.83 3.85 0.00 1.80 1.76 0.00 3.14 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 1.58 1.74 0.00 58 Y 7.74 4.34 0.00 3.23 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 59 I 8.25 3.76 2.06 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 1.58 1.03 0.95 0.00 0.00 60 E 8.59 4.10 0.00 2.02 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 2.35 2.57 0.00 61 R 7.88 4.02 0.00 2.18 2.22 0.00 3.39 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 62 I 8.45 3.74 1.94 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 1.60 0.73 0.99 0.00 0.00 63 L 8.11 4.09 0.00 2.08 1.80 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.08 4.41 0.00 3.03 3.35 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 0.00 0.00 0.00 0.00 65 L 8.34 4.27 0.00 1.67 1.60 0.98 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.84 3.57 0.00 2.08 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 2.17 2.36 0.00 67 G 8.37 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.01 4.53 0.00 1.62 1.63 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.40 0.00 2.06 2.03 0.00 3.67 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 2.06 2.11 0.00 70 N 9.54 4.70 0.00 2.60 2.82 0.00 0.00 7.11 7.79 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 71 L 8.36 4.65 0.00 1.63 1.63 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.53 4.21 0.00 1.97 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.24 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 73 D 8.04 4.69 0.00 2.68 2.56 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 0.00 74 L 8.29 4.57 0.00 1.52 1.50 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.47 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 0.00 0.00 0.00 76 K 8.31 4.10 0.00 1.72 1.74 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.45 7.81 77 L 8.42 4.01 0.00 1.64 1.57 0.89 0.97 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 78 N 8.74 4.84 0.00 2.63 2.69 0.00 0.00 7.22 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 I 8.59 3.90 1.89 0.00 0.00 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 1.34 0.93 0.93 0.00 0.00 80 G 8.24 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.74 4.76 0.00 2.00 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 0.00 2.27 2.31 0.00 82 D 7.69 5.06 0.00 2.81 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 83 V 8.55 4.04 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 1.19 0.00 0.00 1.23 0.00 0.00 84 E 8.26 3.85 0.00 2.03 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 2.32 2.26 0.00 85 E 8.64 3.97 0.00 2.42 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 86 M 8.47 4.10 0.00 2.33 1.77 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.93 0.00 87 L 8.70 4.15 0.00 1.99 1.78 1.24 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 88 R 8.57 3.91 0.00 2.06 1.94 0.00 3.10 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 89 S 8.19 4.10 0.00 4.09 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 90 D 8.14 4.31 0.00 3.18 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.28 4.02 0.00 1.84 1.86 0.98 0.89 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 92 A 8.12 3.99 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 93 L 7.82 3.91 0.00 1.92 1.82 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.27 4.07 0.00 2.28 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 0.00 2.57 2.74 0.00 95 L 8.26 4.06 0.00 2.03 1.74 0.96 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.28 4.53 0.00 2.83 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 97 G 8.42 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 98 A 8.05 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.89 3.79 0.00 2.03 2.03 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 100 N 8.06 4.37 0.00 3.01 2.90 0.00 0.00 7.11 6.30 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 0.00 101 L 8.11 3.98 0.00 2.00 1.74 0.98 0.87 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 0.00 102 R 8.38 3.89 0.00 1.96 1.98 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.96 0.00 103 E 8.08 3.83 0.00 2.06 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 2.40 2.39 0.00 104 A 7.67 2.79 0.97 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 0.00 0.00 105 I 7.95 3.68 2.05 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 1.46 0.66 0.91 0.00 0.00 106 G 7.82 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 0.00 0.00 0.00 107 Y 7.78 3.96 0.00 3.20 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 0.00 108 A 8.09 3.80 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 0.00 109 D 7.89 4.03 0.00 2.74 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 0.00 110 S 7.42 4.10 0.00 3.99 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 0.00 111 V 6.82 3.90 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 0.51 0.00 0.00 0.64 0.00 0.00 112 H 7.02 2.97 0.00 3.19 3.34 0.00 5.84 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.31 4.54 0.00 2.64 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 0.00 114 Y 7.56 4.28 0.00 3.12 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 0.00 115 V 7.83 3.78 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.99 0.00 0.00 116 S 8.52 4.16 0.00 4.13 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 0.00 117 R 8.11 3.88 0.00 1.89 2.21 0.00 3.32 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 118 D 8.30 4.33 0.00 3.04 2.81 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 0.00 119 M 8.34 4.01 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 120 M 8.39 4.11 0.00 2.14 2.28 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.81 0.00 121 I 8.11 3.70 2.01 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 1.53 0.76 0.92 0.00 0.00 122 E 8.09 3.96 0.00 1.98 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 2.45 2.49 0.00 123 I 7.67 3.52 1.97 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.65 0.73 0.00 0.00 124 L 8.19 3.93 0.00 1.75 1.85 0.99 1.01 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 0.00 125 R 8.15 3.90 0.00 1.92 2.11 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 126 D 7.93 4.33 0.00 2.99 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 0.00 127 E 8.36 3.93 0.00 2.14 2.17 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 2.58 2.53 0.00 128 E 8.72 4.11 0.00 2.30 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 0.00 2.34 2.42 0.00 129 G 7.94 3.71 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 0.00 0.00 0.00 130 H 8.09 4.44 0.00 3.53 3.54 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.48 3.82 2.13 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 1.50 0.84 0.97 0.00 0.00 132 D 8.53 4.43 0.00 2.94 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 0.00 133 W 8.24 4.12 0.00 3.55 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.34 3.77 0.00 2.03 1.76 1.30 1.18 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 0.00 135 E 8.50 3.93 0.00 2.14 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 2.33 2.38 0.00 136 T 7.96 3.81 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 1.18 0.00 0.00 137 E 7.71 3.79 0.00 1.57 1.68 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 1.47 1.47 0.00 138 L 7.75 3.77 0.00 1.79 1.62 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 139 D 8.18 4.37 0.00 2.76 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 0.00 140 L 7.89 4.01 0.00 1.91 1.85 1.01 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.53 3.41 1.69 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 -0.26 0.38 0.69 0.00 0.00 142 Q 7.25 3.99 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.97 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 143 K 7.88 4.14 0.00 1.74 1.86 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.63 7.81 144 M 8.25 4.40 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.87 0.00 145 G 7.45 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.39 3.89 0.00 1.73 1.66 0.93 0.68 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 0.00 147 Q 8.16 4.00 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 148 N 8.15 4.37 0.00 2.99 2.89 0.00 0.00 6.66 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 7.81 3.95 0.00 3.05 3.19 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 0.00 0.00 0.00 0.00 150 L 8.44 4.12 0.00 2.02 1.73 1.09 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.13 3.95 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 152 A 7.60 4.14 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 7.63 4.29 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.76 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 154 I 7.52 3.87 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 1.31 0.46 0.91 0.00 0.00 155 R 7.55 4.61 0.00 1.77 1.82 0.00 3.19 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 156 E 8.55 4.14 0.00 2.10 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 2.26 2.28 0.00