NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 S 4.4279 8.3344 115.4187 57.8600 64.3500 173.0629 0 H 4.0219 8.7707 122.2221 55.7885 30.1505 172.5706 1 M 4.7686 9.0448 127.7437 53.9916 35.0560 173.9742 2 D 5.0054 8.9605 125.1349 52.5444 44.6111 175.0885 3 I 4.7579 8.3697 123.3084 60.2599 38.4937 175.1162 4 R 4.6364 8.7542 127.4681 53.9626 32.2497 175.8628 5 Q 3.9093 8.7516 125.7162 56.1427 29.7704 175.3673 6 M 4.2056 8.3499 127.6832 55.5223 33.0581 174.8979 7 N 5.0125 8.4701 122.3411 49.9301 40.9238 174.2708 8 K 3.7355 8.7329 117.6180 60.4456 31.5934 178.4323 9 T 3.9193 7.8820 108.2173 63.9932 68.9278 175.2630 10 H 4.8401 7.9386 117.7442 55.4902 29.0136 176.3364 11 L 4.0778 7.5758 123.8391 58.1245 41.4893 179.3291 12 E 3.9740 8.1153 117.9222 59.5104 29.3205 178.7688 13 H 4.2379 8.1451 115.8694 58.6971 28.7896 177.3858 14 W 3.9201 8.4114 129.8242 60.6383 30.7446 178.0868 15 R 3.3722 8.3818 118.3120 59.0910 29.2333 179.2714 16 G 3.5421 7.8107 104.4381 47.6872 0.0000 175.4449 17 L 4.0821 7.4460 121.0747 57.3512 41.7436 179.3213 18 R 3.3740 7.2462 118.9433 59.1306 29.6655 178.5725 19 K 3.9040 7.4609 117.1341 58.6030 31.7279 178.9458 20 Q 3.8849 7.3547 117.7439 57.7442 28.9029 177.5961 21 L 3.5876 6.9123 120.2776 56.2351 43.3525 177.0949 22 W 4.9194 7.7053 119.5450 53.7953 29.0155 172.3840 23 P 4.5416 0.0000 0.0000 63.0273 31.6760 177.5209 24 G 3.8699 8.8898 110.1082 45.5633 0.0000 172.6123 25 H 3.9493 7.7578 118.9742 55.7343 29.9575 172.7614 26 P 4.2000 0.0000 0.0000 62.5099 30.6310 176.9724 27 D 4.4170 8.8386 120.8519 57.5314 41.5115 178.0713 28 D 4.5785 8.0490 117.8459 56.2048 40.9115 178.5008 29 A 3.9168 7.7893 121.4055 55.5869 18.4785 178.9918 30 H 4.0514 8.2157 114.1925 59.1630 28.8265 177.5167 31 L 4.0070 7.5366 121.0656 58.2432 42.0416 178.9372 32 A 4.0538 7.8747 120.3569 55.1626 18.3141 179.2348 33 D 4.5085 8.7974 118.0492 57.4861 41.0552 179.0043 34 G 3.6427 8.5648 106.1188 48.1365 0.0000 175.4128 35 E 3.9383 7.8385 119.9110 58.6560 29.7985 178.7461 36 E 4.0637 8.2463 119.2353 59.5050 29.6322 178.8411 37 I 3.6041 7.6765 119.5599 64.5495 36.9441 178.4858 38 L 3.9166 7.5030 117.8707 57.1866 41.4332 178.7214 39 Q 4.2966 7.7129 116.0348 55.7389 29.5703 176.1582 40 A 4.2611 7.0433 122.6554 52.1610 18.8977 176.9300 41 D 4.9346 8.6876 118.2573 53.8032 40.7684 176.5684 42 H 5.0687 8.3532 116.2784 55.5888 30.3628 173.4114 43 L 5.5309 8.1434 117.5842 53.1063 45.1104 175.7393 44 A 4.1677 8.2603 123.0736 50.4965 22.8809 175.2849 45 S 5.0924 7.7168 115.4806 56.6369 67.4480 173.0630 46 F 5.1198 9.2360 119.8011 55.8512 43.1774 173.8280 47 I 5.0345 9.0725 123.7875 59.3964 40.1072 174.5192 48 A 4.7014 9.1394 130.1639 51.7458 19.7106 175.8812 49 M 5.1940 9.3324 122.6267 53.5550 35.4882 175.0245 50 A 4.8128 8.5668 123.6514 51.2329 23.2440 175.8583 51 D 4.0612 9.9324 119.6119 55.2876 38.6061 175.0784 52 G 3.9518 8.5247 105.0749 45.5000 0.0000 174.2777 53 V 4.2607 7.5589 112.5584 59.1560 34.2327 174.5179 54 A 4.8936 8.2122 125.2771 51.0701 19.7438 177.0979 55 I 4.0621 8.1568 116.5918 60.5886 39.5364 175.2655 56 G 4.5570 7.7070 109.1441 46.3968 0.0000 171.8634 57 F 5.7623 8.7983 114.2418 55.7033 41.9778 173.1149 58 A 4.9967 9.4136 120.4767 50.4154 22.6500 174.6952 59 D 5.4377 9.2719 121.5608 52.9405 43.4106 175.6558 60 A 5.6188 9.2872 123.9163 50.4439 23.3330 174.8168 61 S 5.4903 9.4862 113.1148 56.9845 67.4762 172.9538 62 I 4.8399 8.9255 121.9889 60.0183 38.2678 175.5130 63 R 4.6239 9.4272 127.7754 55.1199 31.3336 177.3927 64 H 4.4584 8.9835 120.4874 57.0151 29.7148 175.6902 65 D 4.5637 7.9373 118.4481 53.7608 41.3569 175.3552 66 Y 4.0748 8.6709 121.9351 58.4208 39.3008 175.3876 67 V 4.0299 7.5051 125.9406 60.3937 33.2753 174.3920 68 N 4.5511 8.0020 123.6978 54.5458 38.6620 175.3851 69 G 4.0723 9.1032 110.3439 46.6062 0.0000 172.7627 70 C 4.8482 7.5877 116.7933 58.5104 29.8418 173.3309 71 D 4.8667 8.9737 120.9092 54.1247 41.9971 176.0955 72 S 4.8783 8.3393 112.7668 56.4459 65.8967 173.0129 73 S 4.5335 8.0786 113.3611 56.2898 64.8588 171.6762 74 P 4.7470 0.0000 0.0000 62.2771 33.0090 175.0260 75 V 4.6776 8.5945 119.4354 60.8569 34.8379 174.6230 76 V 4.4474 8.4275 127.5468 61.3657 32.8529 174.5640 77 F 5.0093 9.6954 128.5786 55.9375 42.0851 174.0056 78 L 4.6320 8.3609 129.2838 54.9731 40.9819 175.9934 79 E 4.6447 9.5313 127.6144 58.6956 30.4600 177.5172 80 G 4.3116 8.0546 103.1034 45.6507 0.0000 172.4544 81 I 4.7289 7.9522 121.9334 59.3632 41.3555 173.7590 82 F 4.6669 8.3498 129.9195 56.9545 43.1850 172.7979 83 V 4.4962 7.2120 124.9186 60.3771 34.2719 174.9612 84 L 3.8181 8.4668 127.3925 54.7091 42.2922 176.3726 85 P 4.1102 0.0000 0.0000 66.0894 31.3901 178.7193 86 S 4.0331 8.0060 111.2743 60.3670 62.8767 174.8293 87 F 4.6764 7.9433 117.6228 57.0130 39.0662 176.0712 88 R 4.1118 7.4603 120.3730 56.8589 30.4348 175.7795 89 Q 3.5545 8.5520 115.8615 57.7761 25.9652 174.5728 90 R 4.4518 8.2793 112.9358 55.7175 31.9573 176.6927 91 G 3.9178 8.2444 106.6582 45.7047 0.0000 175.7323 92 V 3.4650 7.8235 119.5163 65.8611 31.5956 177.7428 93 A 3.8793 7.8876 119.9401 54.9043 18.1629 178.9303 94 K 3.7191 8.0978 117.6444 60.1930 32.1182 178.7508 95 Q 3.9513 7.9877 117.7343 58.6759 28.6075 178.5185 96 L 3.9213 8.1397 120.3868 58.1098 41.6806 179.7976 97 I 3.7280 8.2585 119.6844 64.1242 36.9371 178.2517 98 A 3.9350 8.2243 121.6984 55.0917 18.0730 179.5995 99 A 3.7012 7.8290 119.1627 55.0405 18.3218 179.8691 100 V 3.2211 7.2437 116.6945 66.1192 31.6019 177.7761 101 Q 3.9250 8.2926 119.5353 59.2609 28.7522 178.3410 102 R 3.8231 8.0390 119.5171 59.2170 30.2544 178.0093 103 W 4.4373 8.4426 128.3124 60.7501 30.6852 178.1884 104 G 3.3420 8.5548 105.8183 47.8508 0.0000 175.7990 105 T 3.8217 8.4244 118.3962 66.6144 68.2953 176.5514 106 N 4.4421 8.1762 116.9597 55.5083 38.5430 176.5877 107 K 4.2487 7.3086 117.9194 55.6437 32.1166 177.0688 108 G 3.8251 7.7105 106.9284 46.4854 0.0000 173.7284 109 C 4.3501 8.0784 117.5497 59.0130 28.7708 174.3757 110 R 4.2685 8.4431 122.2515 57.4130 30.8224 176.3722 111 E 4.7742 7.8296 116.2488 54.5275 33.9315 174.0893 112 M 5.2167 8.6246 121.8525 53.8910 34.7538 174.3763 113 A 4.9957 8.8485 126.2126 50.7918 23.5385 174.1529 114 S 3.7717 7.9083 111.8370 57.6620 65.2337 173.3217 115 D 4.8693 8.4744 121.3091 52.2870 42.3547 174.1099 116 T 4.6013 7.8801 112.5623 60.5265 70.5081 173.1549 117 S 4.3158 8.4734 119.6569 57.5745 62.9688 173.5326 118 P 4.3973 0.0000 0.0000 65.2366 31.2974 177.5985 119 E 4.1160 8.1554 117.1198 58.2589 29.9751 176.8178 120 N 4.6858 7.8099 119.1360 52.3890 37.6786 175.1273 121 T 3.9894 8.0569 114.9991 64.1130 69.2337 176.6594 122 I 3.6694 7.6892 122.2656 64.2231 37.1413 177.9860 123 S 4.0673 8.5537 114.0715 61.4437 62.2036 176.1567 124 Q 3.9726 7.9403 120.2037 59.0079 28.4320 178.9716 125 K 3.9244 8.0907 119.3071 59.4539 32.2071 179.3736 126 V 3.5406 8.1113 118.6809 66.4547 31.4584 177.6381 127 H 3.9698 8.4499 116.0991 59.1783 28.4719 177.9209 128 Q 4.5265 8.5564 120.7678 58.3526 28.2832 178.5779 129 A 4.1105 8.2205 121.4568 54.5265 18.3929 178.5693 130 L 4.5460 7.6574 115.0354 54.5518 41.9290 177.5924 131 G 3.8971 7.9028 106.3949 45.4341 0.0000 174.0276 132 F 4.3946 8.3938 118.7646 56.5997 39.8370 174.5563 133 E 4.8050 8.4210 123.2213 53.9773 31.8388 175.7364 134 E 4.0804 8.8191 123.7286 56.8812 30.2369 175.7554 135 T 4.4741 8.5195 114.8454 62.6756 70.6125 173.8012 136 E 4.6515 7.6653 116.2895 54.9227 31.9017 174.1819 137 R 4.7407 8.4031 118.6654 54.6547 32.6372 175.9429 138 V 4.4915 8.0337 113.3411 59.8077 35.7924 174.5196 139 I 4.3447 8.0234 122.0236 59.6280 38.6861 175.7180 140 F 4.4882 8.5535 124.0510 56.6137 40.1660 174.6749 141 Y 4.9091 8.4112 120.4538 56.3106 41.3357 175.1901 142 R 4.8286 8.3457 116.7178 54.6742 32.5952 174.3884 143 K 4.5786 8.2868 119.5374 54.4351 35.2810 175.9188 144 R 4.0849 8.5304 126.1973 56.4347 30.8372 175.8993 145 C 4.3101 8.5611 120.9219 60.1091 28.2748 173.5183 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 S 8.33 4.43 0.00 4.02 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 0 H 8.77 4.02 0.00 3.19 3.29 0.00 5.90 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 9.04 4.77 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 2 D 8.96 5.01 0.00 2.56 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 3 I 8.37 4.76 1.90 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 1.33 0.94 1.01 0.00 0.00 4 R 8.75 4.64 0.00 1.47 1.72 0.00 3.33 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 5 Q 8.75 3.91 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.93 0.00 0.00 0.00 0.00 0.00 1.87 1.36 0.00 6 M 8.35 4.21 0.00 1.52 1.64 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.17 0.00 7 N 8.47 5.01 0.00 2.87 2.84 0.00 0.00 5.86 7.13 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 8 K 8.73 3.74 0.00 1.83 1.83 0.00 1.56 0.00 0.00 1.83 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.56 7.81 9 T 7.88 3.92 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 1.15 0.00 0.00 10 H 7.94 4.84 0.00 3.23 3.39 0.00 5.82 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.58 4.08 0.00 1.74 1.78 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.12 3.97 0.00 1.98 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 2.38 2.45 0.00 13 H 8.15 4.24 0.00 3.44 3.37 0.00 5.62 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 14 W 8.41 3.92 0.00 3.29 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 15 R 8.38 3.37 0.00 1.81 1.79 0.00 3.19 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.07 0.00 16 G 7.81 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 0.00 0.00 0.00 17 L 7.45 4.08 0.00 1.51 1.88 1.09 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 18 R 7.25 3.37 0.00 0.67 1.08 0.00 2.21 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.50 0.00 19 K 7.46 3.90 0.00 1.65 1.70 0.00 1.62 0.00 0.00 1.50 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.21 0.95 7.81 20 Q 7.35 3.88 0.00 1.48 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.96 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 21 L 6.91 3.59 0.00 0.95 1.16 0.67 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 22 W 7.71 4.92 0.00 3.45 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 23 P 0.00 4.54 0.00 2.06 1.97 0.00 3.84 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 24 G 8.89 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 0.00 0.00 0.00 25 H 7.76 3.95 0.00 3.33 3.31 0.00 5.80 0.00 0.00 0.00 0.00 6.71 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 4.20 0.00 2.16 1.97 0.00 3.47 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 27 D 8.84 4.42 0.00 2.75 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 28 D 8.05 4.58 0.00 2.72 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 29 A 7.79 3.92 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 30 H 8.22 4.05 0.00 3.13 3.23 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.54 4.01 0.00 1.88 1.87 0.95 1.30 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 32 A 7.87 4.05 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.80 4.51 0.00 3.09 3.05 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 34 G 8.56 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 35 E 7.84 3.94 0.00 1.99 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 2.58 2.47 0.00 36 E 8.25 4.06 0.00 2.17 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 0.00 2.32 2.37 0.00 37 I 7.68 3.60 1.60 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.24 0.56 0.00 0.00 38 L 7.50 3.92 0.00 1.70 1.65 0.83 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 7.71 4.30 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.31 2.60 0.00 40 A 7.04 4.26 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 41 D 8.69 4.93 0.00 2.82 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 42 H 8.35 5.07 0.00 3.24 3.62 0.00 5.75 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.14 5.53 0.00 1.49 1.51 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.26 4.17 -0.46 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 45 S 7.72 5.09 0.00 3.13 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 46 F 9.24 5.12 0.00 3.00 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 47 I 9.07 5.03 1.82 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.14 0.96 0.00 0.00 48 A 9.14 4.70 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 49 M 9.33 5.19 0.00 1.82 1.91 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.71 0.00 50 A 8.57 4.81 1.14 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 0.00 0.00 51 D 9.93 4.06 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.52 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 53 V 7.56 4.26 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 0.81 0.00 0.00 0.85 0.00 0.00 54 A 8.21 4.89 1.14 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 0.00 0.00 55 I 8.16 4.06 1.01 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.54 -0.18 0.00 0.00 56 G 7.71 4.56 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 0.00 0.00 0.00 57 F 8.80 5.76 0.00 3.47 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 58 A 9.41 5.00 1.25 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 59 D 9.27 5.44 0.00 3.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 9.29 5.62 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 61 S 9.49 5.49 0.00 4.12 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 8.93 4.84 1.87 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.39 0.79 0.00 0.00 63 R 9.43 4.62 0.00 1.78 1.85 0.00 2.93 0.00 0.00 3.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 64 H 8.98 4.46 0.00 3.16 3.37 0.00 5.71 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 7.94 4.56 0.00 2.68 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 66 Y 8.67 4.07 0.00 3.10 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 67 V 7.51 4.03 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 1.17 0.00 0.00 0.99 0.00 0.00 68 N 8.00 4.55 0.00 2.85 3.08 0.00 0.00 7.39 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 9.10 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 0.00 0.00 0.00 70 C 7.59 4.85 0.00 3.03 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 71 D 8.97 4.87 0.00 2.68 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 72 S 8.34 4.88 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 73 S 8.08 4.53 0.00 3.84 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.75 0.00 1.96 1.64 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.85 0.00 75 V 8.59 4.68 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 1.13 0.00 0.00 0.94 0.00 0.00 76 V 8.43 4.45 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 0.83 0.00 0.00 1.24 0.00 0.00 77 F 9.70 5.01 0.00 3.15 3.05 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 78 L 8.36 4.63 0.00 1.60 1.39 0.94 0.83 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 79 E 9.53 4.64 0.00 2.29 2.25 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 2.84 2.63 0.00 80 G 8.05 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.95 4.73 1.73 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.77 0.76 0.00 0.00 82 F 8.35 4.67 0.00 2.81 2.44 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 83 V 7.21 4.50 1.84 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 0.84 0.00 0.00 0.79 0.00 0.00 84 L 8.47 3.82 0.00 1.90 1.79 1.08 1.07 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 85 P 0.00 4.11 0.00 2.16 2.12 0.00 3.68 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 2.19 2.17 0.00 86 S 8.01 4.03 0.00 3.44 3.46 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 87 F 7.94 4.68 0.00 2.95 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 88 R 7.46 4.11 0.00 1.83 1.79 0.00 3.21 0.00 0.00 3.11 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 89 Q 8.55 3.55 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.94 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 90 R 8.28 4.45 0.00 1.87 1.91 0.00 3.30 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.74 0.00 91 G 8.24 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 V 7.82 3.46 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 1.08 0.00 0.00 0.93 0.00 0.00 93 A 7.89 3.88 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 94 K 8.10 3.72 0.00 1.81 2.04 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.55 7.81 95 Q 7.99 3.95 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 96 L 8.14 3.92 0.00 1.79 1.69 0.92 1.20 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 97 I 8.26 3.73 1.97 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 1.48 0.68 1.07 0.00 0.00 98 A 8.22 3.93 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 99 A 7.83 3.70 0.95 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 0.00 100 V 7.24 3.22 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 1.25 0.00 0.00 0.86 0.00 0.00 101 Q 8.29 3.92 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.56 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 102 R 8.04 3.82 0.00 2.03 2.10 0.00 3.20 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 1.68 1.66 0.00 103 W 8.44 4.44 0.00 3.62 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 0.00 104 G 8.55 3.34 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 0.00 105 T 8.42 3.82 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 1.18 0.00 0.00 106 N 8.18 4.44 0.00 2.87 2.87 0.00 0.00 7.11 8.30 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 0.00 107 K 7.31 4.25 0.00 1.47 1.47 0.00 1.46 0.00 0.00 1.21 0.00 0.00 3.18 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.85 1.21 7.81 108 G 7.71 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 0.00 109 C 8.08 4.35 0.00 2.94 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 0.00 110 R 8.44 4.27 0.00 1.78 1.96 0.00 3.14 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 111 E 7.83 4.77 0.00 1.86 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 2.27 2.26 0.00 112 M 8.62 5.22 0.00 1.81 1.86 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.69 0.00 113 A 8.85 5.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 7.91 3.77 0.00 3.40 3.16 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 0.00 115 D 8.47 4.87 0.00 2.86 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 0.00 116 T 7.88 4.60 4.14 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 1.17 0.00 0.00 117 S 8.47 4.32 0.00 3.93 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 0.00 118 P 0.00 4.40 0.00 2.09 2.12 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 119 E 8.16 4.12 0.00 1.99 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 2.25 0.00 120 N 7.81 4.69 0.00 2.76 2.72 0.00 0.00 6.79 7.33 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 0.00 121 T 8.06 3.99 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 0.00 122 I 7.69 3.67 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.59 0.87 0.00 0.00 123 S 8.55 4.07 0.00 3.91 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.94 3.97 0.00 2.33 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 125 K 8.09 3.92 0.00 1.96 1.86 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.54 7.81 126 V 8.11 3.54 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 0.92 0.00 0.00 0.91 0.00 0.00 127 H 8.45 3.97 0.00 3.27 3.17 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 8.56 4.53 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.56 2.38 0.00 129 A 8.22 4.11 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 0.00 130 L 7.66 4.55 0.00 1.86 1.79 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 131 G 7.90 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 0.00 0.00 0.00 132 F 8.39 4.39 0.00 3.25 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 0.00 133 E 8.42 4.80 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 2.24 2.27 0.00 134 E 8.82 4.08 0.00 1.95 1.89 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 2.32 2.33 0.00 135 T 8.52 4.47 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 1.31 0.00 0.00 136 E 7.67 4.65 0.00 2.08 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 2.23 2.37 0.00 137 R 8.40 4.74 0.00 1.81 1.87 0.00 3.17 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 138 V 8.03 4.49 1.78 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 0.69 0.00 0.00 0.78 0.00 0.00 139 I 8.02 4.34 1.81 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 1.38 0.55 0.54 0.00 0.00 140 F 8.55 4.49 0.00 2.96 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 0.00 141 Y 8.41 4.91 0.00 2.98 2.86 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 0.00 142 R 8.35 4.83 0.00 1.88 1.90 0.00 3.05 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.72 0.00 143 K 8.29 4.58 0.00 1.70 1.68 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.73 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.42 7.81 144 R 8.53 4.08 0.00 1.82 1.82 0.00 3.28 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 145 C 8.56 4.31 0.00 3.00 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