NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3056 8.1127 119.7064 55.8781 31.7847 176.7020 3 R 3.8013 8.1683 119.4832 57.1180 30.1018 174.5405 4 R 4.6583 8.1964 118.8249 54.5915 32.8030 176.6724 5 V 3.7050 8.2790 116.7426 63.5645 31.6845 177.2162 6 I 3.9783 7.2140 120.5676 61.5469 34.7380 175.7020 7 G 4.2078 8.1945 109.4201 44.6332 0.0000 170.2868 8 Q 4.5517 7.7047 117.5251 53.7787 32.8344 174.8092 9 R 3.9542 8.5396 121.1658 56.3149 30.6411 176.2949 10 K 4.3266 8.4790 124.1318 55.4869 33.2082 175.6710 11 I 4.6805 7.9853 117.9906 58.8031 40.6219 174.6292 12 L 4.5198 8.1096 121.5768 53.5328 42.0768 174.5023 13 P 4.5118 0.0000 0.0000 61.7959 32.4870 175.7526 14 D 4.4081 8.4044 119.0217 52.9003 39.4381 175.8362 15 P 4.3248 0.0000 0.0000 64.3675 31.3582 175.9052 16 K 3.9320 8.3529 116.2264 57.7220 33.9630 177.0430 17 F 4.5001 7.8299 113.6956 56.3726 39.2152 176.0781 18 G 3.9478 7.5164 107.6876 46.2536 0.0000 173.5710 19 S 4.7000 8.9194 114.8932 55.9097 64.6289 174.9540 20 E 4.0502 8.7589 125.0150 58.9058 29.3287 177.5178 21 L 3.6854 8.2993 117.8193 59.3109 41.8674 178.0483 22 L 3.8718 7.8426 119.7877 57.2793 42.0534 179.3671 23 A 4.1449 7.7975 120.3740 54.6597 19.0830 179.2140 24 K 3.9239 8.2619 118.1813 60.4494 32.0667 177.9155 25 F 3.6724 8.2928 115.9758 61.8251 39.6256 176.9884 26 V 3.9639 8.1577 116.9945 65.4749 31.3637 178.2443 27 N 4.5661 8.0067 114.3855 54.6322 38.3465 176.5282 28 I 4.0367 7.4348 121.1561 63.3505 37.7623 177.2949 29 L 4.0993 7.5872 119.9517 57.2566 42.2195 178.4341 30 M 4.1303 8.0450 117.0896 57.5322 31.1605 176.9309 31 V 3.3565 7.8926 106.9458 62.2817 30.2683 172.8086 32 D 4.5999 8.1821 114.6187 53.4759 47.3800 174.5639 33 G 3.7532 9.9036 108.1654 44.6638 0.0000 175.2141 34 K 4.2273 9.7710 115.2291 58.4929 32.8118 178.8493 35 K 4.2777 7.2709 121.5569 58.6544 33.0456 177.1666 36 S 4.6641 8.0219 115.2391 61.3039 62.9678 176.5605 37 T 3.9346 7.5954 116.6187 64.6289 67.2653 176.1089 38 A 4.0558 8.0898 122.3195 55.4721 18.2025 179.3272 39 E 4.0131 8.7400 117.2735 59.6288 29.5723 179.4917 40 S 4.3271 8.3538 113.2112 61.5440 62.4224 176.3562 41 I 3.8655 7.9714 122.7049 64.1187 36.6628 178.4921 42 V 3.7470 7.8856 118.9337 66.2342 29.9166 177.4534 43 Y 4.3247 8.3291 119.2804 60.8374 38.6281 178.0486 44 S 4.3235 8.1795 113.5159 60.7318 62.3688 175.8669 45 A 4.0345 8.1804 123.8387 55.3261 18.0133 179.6452 46 L 4.0594 7.5887 115.4516 57.2402 41.8377 179.1327 47 E 4.3348 7.7309 116.9575 58.9996 29.7651 178.5408 48 T 3.9034 7.6320 108.2917 64.7888 68.7012 175.4608 49 L 3.9985 8.3785 123.1841 58.5300 42.0437 178.9297 50 A 4.1144 7.9260 119.4580 54.2258 18.3307 178.6445 51 Q 3.9654 7.7007 117.3698 59.1241 29.0383 178.5402 52 R 4.2683 7.6650 117.7128 58.4490 30.3813 177.0152 53 S 4.5574 7.8297 108.3091 57.1881 67.1255 174.4044 54 G 3.9083 9.3653 109.2676 45.7494 0.0000 173.1964 55 K 4.4167 7.5101 118.2920 54.9747 34.9861 176.4519 56 S 4.4152 8.3956 109.1422 58.3062 58.9065 174.7039 57 E 4.1102 8.0628 125.4856 57.7820 30.1301 177.1107 58 L 4.1327 7.8505 119.2896 58.5098 40.0261 178.8314 59 E 4.0181 8.1867 120.0881 59.1401 29.6652 178.2821 60 A 4.0447 7.7937 119.4160 53.4577 18.3893 178.8951 61 F 3.8688 7.6960 119.3614 61.1745 39.2420 176.5338 62 E 4.0194 7.9547 118.3887 59.5019 29.4078 178.8263 63 V 3.8957 7.7565 115.9791 64.3308 31.6503 176.8776 64 A 4.3276 7.7803 119.6306 55.1721 19.6458 179.0999 65 L 4.0015 7.9144 117.3524 58.0588 41.3828 179.6042 66 E 4.0133 8.3513 118.2962 59.4993 29.4762 178.5746 67 N 4.5630 7.9028 114.3109 55.0187 38.8883 177.0905 68 V 4.0967 7.7063 118.7916 63.6441 32.1883 176.4937 69 R 4.2366 7.8242 115.2027 55.2531 29.3506 174.8951 70 P 4.8406 0.0000 0.0000 62.3997 33.2635 174.9271 71 T 4.5400 8.5217 110.4849 62.3682 69.3262 174.1179 72 V 5.0580 7.8244 112.4458 59.5873 35.5595 174.6452 73 E 4.7949 8.4681 121.7680 54.7884 32.9674 174.9044 74 V 4.2854 8.5112 119.3173 59.8194 32.9639 175.3823 75 K 4.5913 8.2321 122.8471 53.7293 35.7442 174.7530 76 S 4.1839 8.6019 114.8532 59.1670 61.7994 174.0240 77 R 4.6897 7.9967 127.1771 54.6150 30.4976 175.9675 78 R 4.4712 8.0679 113.2088 56.3613 30.3552 179.5376 79 V 3.3426 7.8586 118.8903 66.7237 31.2739 178.7834 80 G 3.5396 7.8274 108.0683 45.7191 0.0000 175.4283 81 G 4.0319 8.8971 108.8334 45.3612 0.0000 174.3308 82 S 4.5671 7.8269 110.8766 57.7792 65.7637 174.3978 83 T 3.8967 7.5556 119.8138 63.8109 66.3043 172.0285 84 Y 4.6341 8.7735 128.1983 54.9774 38.3100 172.9106 85 Q 4.3465 8.0608 119.9457 54.2626 30.5099 176.2929 86 V 3.1474 8.2285 116.1867 63.5454 29.0887 171.0379 87 P 4.3569 0.0000 0.0000 63.3633 32.3395 175.3369 88 V 3.0998 7.9576 122.2914 61.7334 32.0258 171.4718 89 E 4.5586 8.6679 123.3867 57.2190 30.1572 176.4222 90 V 4.2049 8.3772 114.7999 60.1044 32.8734 176.6446 91 R 3.9690 8.7271 123.8277 56.0450 30.4470 175.8060 92 P 4.1631 0.0000 0.0000 66.1402 31.4223 178.7100 93 V 3.8258 7.8726 108.0042 63.1517 31.7580 177.0961 94 R 4.5125 8.0800 118.5298 56.4119 31.4313 178.1778 95 R 3.9318 7.6624 117.3437 58.9678 30.0635 178.0956 96 N 4.5908 8.0642 114.4908 54.6297 38.8764 177.2569 97 A 3.9853 7.8237 122.2627 54.9832 18.4244 179.2274 98 L 3.6046 7.8555 118.4389 57.6763 41.9688 179.0359 99 A 4.1843 7.8172 120.6567 55.4016 18.4345 179.1332 100 M 3.8736 8.0208 117.1812 58.6604 31.9764 179.1903 101 R 3.7938 7.4097 117.6513 59.0019 30.3329 178.9446 102 W 4.6231 7.7819 116.8376 59.1193 29.2331 178.7867 103 I 3.7288 8.0716 120.3969 64.2017 36.4026 178.3747 104 V 3.6564 7.7436 119.0895 65.4293 31.2780 177.9418 105 E 4.0937 8.1409 116.3852 59.3028 29.4210 178.7383 106 A 4.1021 7.8435 120.5432 54.8886 18.2251 179.1803 107 A 4.0659 7.9532 118.8968 54.8378 18.1131 179.7705 108 R 3.8033 7.3840 115.9413 59.4658 30.1303 177.5756 109 K 4.4055 7.8358 112.9211 56.0328 32.7173 177.3886 110 R 3.8922 7.3891 120.5555 59.7393 29.9624 176.9321 111 G 4.1266 8.4284 103.5210 45.6572 0.0000 173.7850 112 D 4.4632 8.3161 119.1487 54.5189 41.1528 177.2088 113 K 4.0504 7.9314 121.3706 58.9452 32.7109 177.2936 114 S 4.8385 7.6210 111.8341 56.5801 67.3010 174.4507 115 M 4.1023 8.4465 120.4156 58.2034 31.9993 177.7120 116 A 4.0682 8.1371 120.8835 55.4859 18.4136 179.4260 117 L 4.0859 8.0862 117.0338 57.5922 41.5981 179.7694 118 R 4.1900 8.0065 119.6493 58.6264 29.8838 179.1062 119 L 4.1342 7.9963 118.2761 57.8427 41.9242 179.3949 120 A 4.0447 8.2058 120.6482 54.8542 18.1829 179.5577 121 N 4.2657 8.4413 115.4823 56.6280 38.7124 177.2867 122 E 3.9012 7.8363 119.2659 58.9466 29.7589 178.4660 123 L 3.8677 8.2130 120.8418 58.0588 42.0514 178.6405 124 S 4.0559 7.8421 112.5452 61.8128 62.2836 175.8383 125 D 4.3592 8.3348 121.2112 57.4994 40.4452 178.8754 126 A 3.9736 8.1106 120.8730 55.0929 18.1462 179.5518 127 A 4.2945 7.5936 119.4409 54.6986 18.7831 179.0551 128 E 4.0558 8.0130 114.3935 56.5831 29.2747 178.1162 129 N 4.1481 7.8708 113.5545 54.0536 38.1390 175.1044 130 K 3.8947 8.0345 118.4607 58.9883 32.5848 177.2828 131 G 3.9864 7.8231 107.0289 46.3596 0.0000 174.3989 132 T 3.9922 8.7429 117.7752 65.8389 68.3567 177.4451 133 A 4.0914 8.8854 123.4013 55.2376 18.4865 179.8479 134 V 3.5556 7.6857 116.3386 65.7395 31.5371 177.7507 135 K 3.7083 8.2068 119.8705 59.5867 31.7826 178.5025 136 K 3.3634 7.1268 117.0794 59.4185 32.1161 178.8865 137 R 3.2236 6.7087 116.8952 59.3103 30.0648 178.2593 138 E 3.8515 7.8582 118.2631 59.5344 29.3946 178.9602 139 D 4.2956 8.1773 119.1606 57.7143 40.8879 179.3988 140 V 3.6432 7.5370 118.1678 65.7948 31.5707 177.9746 141 H 4.1612 8.0758 115.8003 58.9820 28.6417 177.4646 142 R 3.8907 7.7584 118.4313 60.1775 30.2975 177.2119 143 M 4.0462 8.5444 117.8466 56.3625 31.5172 177.1350 144 A 4.2817 8.2102 122.2400 54.0342 19.8733 179.2452 145 E 3.9039 8.1165 116.8692 59.0828 30.1108 178.0271 146 A 4.1523 7.8239 120.5321 55.6458 18.3620 178.9736 147 N 4.5401 7.9508 110.6786 53.9414 38.1484 176.8371 148 K 3.7601 7.4629 121.6199 59.5530 32.2534 177.2875 149 A 4.4318 7.7735 117.5619 52.3871 19.1193 177.1285 150 F 4.6617 8.1627 118.4060 58.2005 41.7069 175.0001 151 A 3.5101 8.0694 126.8331 52.4486 17.9841 176.8860 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 2 R 8.11 4.31 0.00 1.89 2.00 0.00 3.10 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 3 R 8.17 3.80 0.00 1.85 1.96 0.00 3.20 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 4 R 8.20 4.66 0.00 1.92 1.73 0.00 3.20 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 5 V 8.28 3.70 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 0.76 0.00 0.00 0.93 0.00 0.00 6 I 7.21 3.98 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 1.23 0.46 0.91 0.00 0.00 7 G 8.19 4.21 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 0.00 8 Q 7.70 4.55 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 9 R 8.54 3.95 0.00 1.79 1.88 0.00 3.19 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 10 K 8.48 4.33 0.00 1.69 1.69 0.00 1.60 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.48 7.81 11 I 7.99 4.68 1.87 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 1.47 0.85 0.91 0.00 0.00 12 L 8.11 4.52 0.00 1.76 1.69 0.91 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 13 P 0.00 4.51 0.00 2.11 2.08 0.00 3.76 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 1.95 1.93 0.00 14 D 8.40 4.41 0.00 2.79 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 15 P 0.00 4.32 0.00 2.09 2.14 0.00 3.57 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 16 K 8.35 3.93 0.00 0.86 0.74 0.00 1.45 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.75 0.52 7.81 17 F 7.83 4.50 0.00 3.09 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 18 G 7.52 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 19 S 8.92 4.70 0.00 3.87 4.04 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 20 E 8.76 4.05 0.00 2.03 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 2.39 2.35 0.00 21 L 8.30 3.69 0.00 1.71 1.42 1.01 0.53 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 22 L 7.84 3.87 0.00 1.63 1.62 -0.10 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.80 4.14 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 24 K 8.26 3.92 0.00 1.88 1.88 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 25 F 8.29 3.67 0.00 3.25 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 26 V 8.16 3.96 2.27 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 0.89 0.00 0.00 1.05 0.00 0.00 27 N 8.01 4.57 0.00 3.06 2.94 0.00 0.00 7.10 7.39 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 28 I 7.43 4.04 1.85 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 1.58 0.71 0.86 0.00 0.00 29 L 7.59 4.10 0.00 1.49 1.88 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 30 M 8.04 4.13 0.00 2.30 2.51 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.72 0.00 31 V 7.89 3.36 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 0.64 0.00 0.00 0.93 0.00 0.00 32 D 8.18 4.60 0.00 2.61 2.61 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 33 G 9.90 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 34 K 9.77 4.23 0.00 2.04 2.42 0.00 1.55 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.45 7.81 35 K 7.27 4.28 0.00 1.92 1.71 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.33 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.59 1.53 7.81 36 S 8.02 4.66 0.00 4.11 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 0.00 37 T 7.60 3.93 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 1.30 0.00 0.00 38 A 8.09 4.06 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 39 E 8.74 4.01 0.00 2.27 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 0.00 2.37 2.53 0.00 40 S 8.35 4.33 0.00 4.06 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.97 3.87 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 1.44 0.93 0.97 0.00 0.00 42 V 7.89 3.75 2.21 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 1.04 0.00 0.00 1.26 0.00 0.00 43 Y 8.33 4.32 0.00 3.04 3.09 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 0.00 0.00 0.00 0.00 44 S 8.18 4.32 0.00 4.11 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 45 A 8.18 4.03 1.48 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 0.00 0.00 46 L 7.59 4.06 0.00 1.90 1.85 0.88 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.73 4.33 0.00 2.09 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 2.51 2.40 0.00 48 T 7.63 3.90 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 49 L 8.38 4.00 0.00 1.89 1.73 0.95 0.89 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 50 A 7.93 4.11 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 7.70 3.97 0.00 2.03 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 52 R 7.67 4.27 0.00 1.88 1.97 0.00 3.34 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 53 S 7.83 4.56 0.00 3.92 3.91 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 54 G 9.37 3.91 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 0.00 0.00 0.00 55 K 7.51 4.42 0.00 1.80 1.80 0.00 1.54 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.69 7.81 56 S 8.40 4.42 0.00 3.90 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 57 E 8.06 4.11 0.00 2.12 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 2.38 2.43 0.00 58 L 7.85 4.13 0.00 1.57 1.71 0.43 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.19 4.02 0.00 2.19 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 2.27 2.24 0.00 60 A 7.79 4.04 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 61 F 7.70 3.87 0.00 3.22 2.99 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 62 E 7.95 4.02 0.00 2.27 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 2.34 2.41 0.00 63 V 7.76 3.90 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 1.00 0.00 0.00 0.94 0.00 0.00 64 A 7.78 4.33 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 65 L 7.91 4.00 0.00 2.08 1.84 0.87 1.11 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 66 E 8.35 4.01 0.00 1.93 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 2.38 2.56 0.00 67 N 7.90 4.56 0.00 2.83 2.99 0.00 0.00 6.97 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 68 V 7.71 4.10 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 1.12 0.00 0.00 1.02 0.00 0.00 69 R 7.82 4.24 0.00 2.11 2.01 0.00 3.15 0.00 0.00 3.17 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.59 0.00 70 P 0.00 4.84 0.00 2.44 2.55 0.00 3.98 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 71 T 8.52 4.54 4.28 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 1.18 0.00 0.00 72 V 7.82 5.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.92 0.00 0.00 73 E 8.47 4.79 0.00 2.01 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 74 V 8.51 4.29 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 0.82 0.00 0.00 0.98 0.00 0.00 75 K 8.23 4.59 0.00 1.69 1.70 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.33 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.45 7.81 76 S 8.60 4.18 0.00 3.84 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 77 R 8.00 4.69 0.00 1.90 1.85 0.00 3.35 0.00 0.00 3.45 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 78 R 8.07 4.47 0.00 2.02 2.18 0.00 3.02 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 79 V 7.86 3.34 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 0.75 0.00 0.00 0.95 0.00 0.00 80 G 7.83 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 81 G 8.90 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.83 4.57 0.00 4.05 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 83 T 7.56 3.90 4.32 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 0.00 0.00 0.00 1.27 0.00 0.00 84 Y 8.77 4.63 0.00 2.91 2.78 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 0.00 0.00 0.00 0.00 85 Q 8.06 4.35 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.10 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 86 V 8.23 3.15 2.27 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 0.82 0.00 0.00 0.91 0.00 0.00 87 P 0.00 4.36 0.00 2.24 2.18 0.00 3.97 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 88 V 7.96 3.10 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 0.98 0.00 0.00 0.95 0.00 0.00 89 E 8.67 4.56 0.00 2.12 1.97 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 2.29 2.37 0.00 90 V 8.38 4.20 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 0.67 0.00 0.00 0.93 0.00 0.00 91 R 8.73 3.97 0.00 1.81 1.86 0.00 3.22 0.00 0.00 3.34 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 92 P 0.00 4.16 0.00 2.17 2.15 0.00 3.61 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 2.13 2.16 0.00 93 V 7.87 3.83 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 0.70 0.00 0.00 0.93 0.00 0.00 94 R 8.08 4.51 0.00 1.94 1.89 0.00 3.25 0.00 0.00 3.12 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.75 0.00 95 R 7.66 3.93 0.00 1.96 2.01 0.00 3.17 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.95 0.00 96 N 8.06 4.59 0.00 2.77 2.93 0.00 0.00 7.02 7.84 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 97 A 7.82 3.99 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.86 3.60 0.00 1.79 1.31 0.82 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.82 4.18 1.48 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 0.00 0.00 100 M 8.02 3.87 0.00 1.98 2.24 0.00 0.00 0.00 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.74 0.00 101 R 7.41 3.79 0.00 1.50 1.70 0.00 3.17 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 102 W 7.78 4.62 0.00 3.56 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.07 3.73 1.85 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 1.41 1.09 0.76 0.00 0.00 104 V 7.74 3.66 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 1.00 0.00 0.00 0.73 0.00 0.00 105 E 8.14 4.09 0.00 2.22 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 2.64 2.43 0.00 106 A 7.84 4.10 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 0.00 107 A 7.95 4.07 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 0.00 108 R 7.38 3.80 0.00 1.96 1.98 0.00 3.29 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 109 K 7.84 4.41 0.00 1.78 1.81 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.35 7.81 110 R 7.39 3.89 0.00 1.89 2.16 0.00 3.37 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 111 G 8.43 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 0.00 0.00 0.00 112 D 8.32 4.46 0.00 2.73 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 7.93 4.05 0.00 1.75 1.84 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.49 7.81 114 S 7.62 4.84 0.00 4.02 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 M 8.45 4.10 0.00 2.10 2.12 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 2.69 2.58 0.00 116 A 8.14 4.07 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 0.00 117 L 8.09 4.09 0.00 1.91 1.74 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.01 4.19 0.00 2.04 2.00 0.00 3.14 0.00 0.00 3.39 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.72 0.00 119 L 8.00 4.13 0.00 1.84 1.96 0.83 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.21 4.04 1.50 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 0.00 0.00 121 N 8.44 4.27 0.00 2.84 2.88 0.00 0.00 6.56 8.28 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 0.00 122 E 7.84 3.90 0.00 2.13 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 2.31 2.36 0.00 123 L 8.21 3.87 0.00 1.89 1.58 0.63 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 124 S 7.84 4.06 0.00 3.95 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 0.00 125 D 8.33 4.36 0.00 2.89 2.79 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 0.00 126 A 8.11 3.97 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 0.00 127 A 7.59 4.29 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 0.00 128 E 8.01 4.06 0.00 2.09 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 2.32 2.34 0.00 129 N 7.87 4.15 0.00 2.79 2.88 0.00 0.00 6.84 8.94 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 0.00 130 K 8.03 3.89 0.00 1.70 1.97 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.39 7.81 131 G 7.82 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 0.00 132 T 8.74 3.99 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 133 A 8.89 4.09 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 V 7.69 3.56 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 1.06 0.00 0.00 0.96 0.00 0.00 135 K 8.21 3.71 0.00 1.91 1.82 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.40 7.81 136 K 7.13 3.36 0.00 1.00 0.79 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.25 1.34 7.81 137 R 6.71 3.22 0.00 1.88 1.92 0.00 3.33 0.00 0.00 2.86 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.19 0.00 138 E 7.86 3.85 0.00 2.13 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 2.32 2.42 0.00 139 D 8.18 4.30 0.00 2.70 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 7.54 3.64 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 1.20 0.00 0.00 1.04 0.00 0.00 141 H 8.08 4.16 0.00 3.33 3.33 0.00 5.73 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 0.00 142 R 7.76 3.89 0.00 2.00 2.01 0.00 3.11 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 143 M 8.54 4.05 0.00 2.08 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 2.55 2.53 0.00 144 A 8.21 4.28 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.12 3.90 0.00 1.85 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 2.11 2.51 0.00 146 A 7.82 4.15 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 0.00 147 N 7.95 4.54 0.00 2.78 3.04 0.00 0.00 6.72 7.82 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 0.00 148 K 7.46 3.76 0.00 1.87 1.94 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.50 7.81 149 A 7.77 4.43 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 0.00 150 F 8.16 4.66 0.00 2.80 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 0.00 151 A 8.07 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00