NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.3586 8.1593 110.9406 60.8847 69.8124 175.2735 13 N 4.2544 8.9811 123.2421 52.0111 39.2231 173.1777 14 L 4.2280 8.9883 119.8824 55.4547 43.1043 178.4267 15 L 4.4055 8.3859 122.2606 54.4581 42.7070 176.2237 16 Y 4.3860 8.5071 122.5740 58.0884 39.5629 174.7689 17 T 3.9649 6.9317 117.7475 60.8131 70.1391 173.6473 18 R 3.8184 8.0958 125.6354 57.1183 30.1254 176.0969 19 N 4.1785 7.5945 117.4499 53.8429 38.5963 173.7274 20 D 4.3102 9.1128 125.4764 58.1399 41.5853 176.6453 21 V 3.2011 6.8662 115.5571 59.7210 32.6477 176.2715 22 S 4.2782 8.6519 122.5723 58.5649 64.8319 175.1702 23 D 4.4131 8.7204 123.6687 57.0725 40.4322 178.9115 24 S 4.0530 7.9484 113.9316 61.6008 62.5918 175.8041 25 E 4.0531 8.1664 120.7108 59.0661 29.2168 179.1082 26 K 3.8922 8.3899 119.2970 59.6275 32.0045 179.1573 27 K 3.9597 8.1011 117.6200 59.4584 32.0637 179.3758 28 A 3.9739 7.7984 120.6325 55.4646 18.3617 179.7899 29 T 3.7462 8.4412 114.4068 66.9682 68.6626 176.8490 30 V 3.6221 8.2605 120.3807 66.2611 31.2703 177.7529 31 E 3.9075 7.9966 118.8254 58.9035 29.3951 178.2283 32 L 3.9158 7.8071 120.3521 58.2081 42.1622 178.9325 33 L 3.9697 8.2516 119.0024 58.1004 41.8010 179.2635 34 N 4.5337 8.0531 116.0376 56.2800 38.3918 177.5133 35 R 3.9237 7.7347 119.9137 59.3734 30.0692 178.5636 36 Q 4.0802 7.7349 117.8659 58.9315 28.6758 178.5038 37 V 3.5453 8.1540 119.6761 66.2478 31.4589 177.9413 38 I 3.6938 7.5980 118.6605 64.4839 37.0000 177.9836 39 Q 3.9493 8.0259 120.0313 59.3694 28.8732 178.5739 40 F 3.8241 9.1431 118.9090 60.6628 39.0346 177.4939 41 I 3.7404 8.1937 119.7943 64.7826 36.8791 177.9901 42 D 4.3470 8.2009 118.6208 57.1508 41.0572 178.0265 43 L 3.8424 7.8467 121.2468 57.7443 41.9900 179.1432 44 S 4.1400 8.1030 114.6598 61.2961 63.0260 176.5417 45 L 3.9242 7.7534 122.2022 57.5319 41.3800 179.4239 46 I 3.4575 7.8426 119.8281 64.5575 36.8813 178.6097 47 T 3.7875 7.7949 116.4522 66.6710 68.3477 176.9509 48 K 3.3129 7.5367 119.5767 58.7360 31.6533 179.5558 49 Q 3.9282 7.4014 118.4771 58.8040 28.4135 178.6343 50 A 3.7406 7.4566 121.6695 55.1819 18.1773 178.6856 51 H 3.9229 7.8243 115.9645 59.6968 29.8388 177.0114 52 W 4.6091 7.7683 118.9331 59.2321 29.0285 177.4757 53 N 4.9883 7.8628 113.4885 52.3413 38.6131 174.9959 54 M 4.8681 7.2143 118.4380 55.0468 33.0170 175.5910 55 R 4.3642 8.9661 117.4286 55.9070 34.4958 173.8457 56 G 4.0417 8.7247 103.8381 43.9890 0.0000 172.7595 57 A 4.0504 8.5156 122.0525 53.6272 18.7926 177.0854 58 N 4.1742 8.9796 119.1442 54.7104 37.0646 175.9975 59 F 4.1811 7.4668 117.5429 60.2408 39.2445 175.6283 60 I 3.0132 7.8267 116.8633 64.1995 37.8047 177.8007 61 A 3.7899 7.7510 120.5832 55.1787 18.2507 179.6558 62 V 3.3039 7.3601 116.6263 65.9517 31.3479 177.5336 63 H 3.8120 8.0786 117.5600 59.4789 29.9313 176.7853 64 E 3.9023 8.0292 120.2046 59.3184 29.2545 178.7578 65 M 3.5695 7.8884 118.4706 58.5944 32.0249 178.3294 66 L 3.5338 7.4919 118.9063 57.6148 41.8411 179.1850 67 D 4.2239 7.7283 118.4863 56.8691 40.4611 179.1473 68 G 3.3928 7.3690 106.0774 47.6647 0.0000 175.8080 69 F 4.0420 7.3297 120.1277 60.1510 38.9135 177.3500 70 R 3.9848 8.2186 118.4652 59.8727 29.8468 178.4817 71 T 3.8594 7.8370 114.5866 66.7661 68.5404 176.3894 72 A 4.1017 7.9814 122.4785 54.9918 18.4259 179.1398 73 L 4.2134 8.7391 119.2922 58.9007 42.1931 179.5691 74 I 3.8344 8.1702 119.4465 64.1347 36.9393 178.3725 75 D 4.3223 8.0150 119.9971 57.6367 40.6922 178.3953 76 H 4.1174 8.2387 116.6882 58.6321 28.6340 177.4043 77 L 3.6800 7.9732 122.1684 58.3762 41.8531 178.6567 78 D 4.2794 8.1945 117.7183 57.6502 41.2546 178.3291 79 T 3.8539 7.8415 116.3501 66.6627 68.3709 176.7587 80 M 3.9448 8.1311 120.4770 58.1257 32.1302 178.3973 81 A 3.9251 7.9938 120.9949 55.5414 18.6303 179.7056 82 E 3.9910 8.3294 116.5300 59.0894 29.1977 179.6096 83 R 3.8824 7.5512 117.9950 58.9782 30.4097 178.0953 84 A 4.0732 7.9492 120.6987 55.3051 18.4927 179.6116 85 V 3.8004 7.5410 117.7946 65.7190 31.2204 178.1927 86 Q 4.0282 7.8392 116.8577 58.6213 28.5991 177.8177 87 L 4.3884 7.4527 117.1707 54.7032 42.0271 177.8272 88 G 3.9500 8.2580 109.7235 45.0918 0.0000 174.8884 89 G 4.2029 7.5967 108.2968 44.7697 0.0000 171.8633 90 V 4.1299 8.0310 118.5289 60.5563 33.7207 175.8709 91 A 4.1406 8.7100 130.8807 52.1344 18.7469 176.1823 92 L 4.6556 9.5178 124.1864 53.2900 42.7241 176.9476 93 G 4.2096 8.4074 111.4984 44.7044 0.0000 172.6195 94 T 4.1928 7.8239 110.5091 61.1256 71.0511 174.8486 95 T 3.8922 8.4944 116.0285 65.5443 67.2112 176.1396 96 Q 3.9719 8.0219 119.6797 58.9456 28.9029 178.3523 97 V 3.6020 7.5507 117.8276 66.2770 31.3739 178.3370 98 I 3.6791 7.8369 119.3283 64.5160 36.8734 177.9174 99 N 4.2666 8.1056 116.5655 56.7278 38.7532 176.4895 100 S 4.3428 8.1463 114.0696 60.1356 62.5934 174.6183 101 K 4.5533 7.6308 117.0508 55.8321 33.2077 176.0745 102 T 4.0095 8.1276 115.2859 61.6357 67.6285 172.0559 103 P 4.6686 0.0000 0.0000 62.5933 31.6967 175.0075 104 L 4.5761 7.9190 120.0667 52.8630 42.8330 176.5659 105 K 3.9954 8.8685 123.7498 56.8308 32.3703 176.3469 106 S 3.9299 8.4223 117.4208 57.7346 63.2893 172.9254 107 Y 4.1994 8.7132 128.8403 55.9053 39.3442 172.6534 108 P 4.2563 0.0000 0.0000 63.6223 31.3629 175.6097 109 L 4.6961 8.5870 122.8220 54.6137 41.5313 176.7939 110 D 4.8306 7.7939 116.7162 52.4164 40.7914 175.9617 111 I 3.9861 7.4943 113.1018 61.3021 38.6660 175.1021 112 H 4.9836 8.5016 115.4376 56.6193 32.5116 173.8250 113 N 4.8218 8.1209 116.3539 53.5834 40.6332 175.4263 114 V 3.6603 8.2857 125.7956 66.5549 31.7753 178.5476 115 Q 4.1740 8.2155 117.1291 59.1226 28.4889 178.7102 116 D 4.2873 7.9582 119.2688 57.7799 40.9785 178.1924 117 H 4.4721 8.0908 117.7196 58.2888 28.6960 177.5871 118 L 4.0327 8.4858 121.0707 58.0609 41.5678 179.8779 119 K 3.9686 8.0632 117.9392 59.5312 32.1240 179.2669 120 E 3.9565 8.2805 118.7593 59.3514 29.3505 179.4739 121 L 4.2226 8.8854 119.0384 57.9995 41.7491 179.1086 122 A 4.0508 8.7380 121.1287 55.6025 18.1667 179.5132 123 D 4.3007 8.1828 116.8349 57.7276 41.1492 179.1277 124 R 3.9789 8.0031 118.1612 59.6076 30.0371 178.8560 125 Y 3.7197 8.9587 116.5725 60.8376 37.8758 178.2321 126 A 3.9927 8.3221 121.8171 55.2504 18.3873 179.6334 127 I 3.5688 7.7641 118.1112 64.6575 37.1702 178.8161 128 V 3.4202 7.5664 118.2891 65.7449 31.2944 177.8087 129 A 3.8644 8.5179 120.8050 55.4416 17.8449 179.3758 130 N 4.2769 8.5883 115.1923 56.3259 38.5694 177.2948 131 D 4.3005 8.3117 119.7922 57.4165 41.2580 178.6725 132 V 4.1122 7.7543 119.9013 64.3399 31.5050 177.8839 133 R 3.9916 8.1253 119.3317 59.1623 29.4711 178.6111 134 K 4.1317 7.8032 117.4740 58.9455 31.7755 179.1013 135 A 3.7764 8.0470 120.9728 54.5958 18.2178 179.6310 136 I 3.7663 7.3982 117.6785 64.6753 37.0917 178.6161 137 G 3.7463 7.4366 103.8208 46.5441 0.0000 174.3489 138 E 4.2776 7.6240 119.4388 55.8899 29.9826 175.4967 139 A 4.4955 7.1230 122.0378 51.3014 19.9447 177.3354 140 K 4.0099 8.7583 123.4057 59.4457 32.5825 177.9468 141 D 4.3373 7.9909 119.4192 54.1951 41.8965 175.7906 142 D 4.3642 8.8186 127.5308 57.7962 40.9226 178.4274 143 D 4.3640 8.2019 118.3668 58.0563 40.9352 179.1370 144 T 3.8238 7.7485 114.4282 66.4818 68.2542 176.6417 145 A 3.9827 8.2645 123.1218 54.8831 18.3148 178.9773 146 D 4.2220 8.1389 116.5466 57.6231 41.3406 178.2469 147 I 3.6536 7.7872 120.1867 64.7934 37.1853 178.3435 148 L 3.9656 7.9203 119.2357 57.9996 41.3160 179.8440 149 T 3.7842 8.1605 115.8390 66.4198 68.4063 176.3772 150 A 3.9380 8.1615 122.6059 55.2569 18.3675 179.5900 151 A 3.3288 7.8487 119.0769 54.9914 18.3831 179.6401 152 S 3.9328 8.4767 111.9791 61.6338 62.1719 176.0560 153 R 3.7902 8.4745 121.6465 59.8784 29.6023 178.0948 154 D 3.9890 7.7053 117.7215 57.1179 40.7812 178.7132 155 L 3.6275 7.6480 119.5168 57.8344 41.5998 179.3738 156 D 4.4226 8.1062 118.8561 57.0404 40.6639 178.8225 157 K 4.0528 7.5884 119.9576 59.4992 32.2014 179.0176 158 F 3.9156 8.2316 118.5086 60.2545 38.6590 177.1745 159 L 3.8873 8.4451 120.3642 58.1514 41.7475 178.8663 160 W 4.3778 8.2814 128.0027 60.5538 30.3718 177.9756 161 F 4.0688 7.7819 116.7440 60.5121 38.6899 177.3381 162 I 3.8666 8.1720 119.7710 64.6517 36.9827 178.2298 163 E 4.0205 8.5435 119.5553 59.7000 29.1553 179.4746 164 S 4.3707 8.2697 113.3283 60.3049 62.9473 175.1639 165 N 4.7845 7.7565 117.7764 52.0698 39.0546 174.8452 166 I 4.1545 7.0519 122.8578 60.4352 37.7293 175.8733 167 E 4.1445 9.4332 124.9662 56.8162 29.1936 176.8659 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 12 T 8.16 4.36 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 13 N 8.98 4.25 0.00 2.87 2.92 0.00 0.00 5.90 6.90 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 14 L 8.99 4.23 0.00 1.57 1.68 0.97 0.98 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 15 L 8.39 4.41 0.00 1.52 1.63 0.97 0.74 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 16 Y 8.51 4.39 0.00 2.97 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 17 T 6.93 3.96 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 1.05 0.00 0.00 18 R 8.10 3.82 0.00 1.75 1.92 0.00 3.26 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 19 N 7.59 4.18 0.00 2.62 2.67 0.00 0.00 7.01 7.91 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 20 D 9.11 4.31 0.00 2.65 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 21 V 6.87 3.20 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 0.85 0.00 0.00 0.93 0.00 0.00 22 S 8.65 4.28 0.00 4.08 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 23 D 8.72 4.41 0.00 2.79 2.77 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 24 S 7.95 4.05 0.00 3.88 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 25 E 8.17 4.05 0.00 2.04 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 2.32 2.34 0.00 26 K 8.39 3.89 0.00 1.92 1.82 0.00 1.66 0.00 0.00 1.88 0.00 0.00 2.89 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.44 1.79 7.81 27 K 8.10 3.96 0.00 1.79 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.66 7.81 28 A 7.80 3.97 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 29 T 8.44 3.75 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 1.19 0.00 0.00 30 V 8.26 3.62 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 0.98 0.00 0.00 0.99 0.00 0.00 31 E 8.00 3.91 0.00 2.19 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 2.30 2.45 0.00 32 L 7.81 3.92 0.00 1.80 1.80 0.97 0.46 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 33 L 8.25 3.97 0.00 1.65 1.65 0.93 0.56 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 34 N 8.05 4.53 0.00 2.94 2.89 0.00 0.00 6.76 7.63 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 35 R 7.73 3.92 0.00 2.02 2.06 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 36 Q 7.73 4.08 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.51 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 37 V 8.15 3.55 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 1.16 0.00 0.00 0.92 0.00 0.00 38 I 7.60 3.69 2.06 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 1.42 0.66 0.93 0.00 0.00 39 Q 8.03 3.95 0.00 2.30 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 40 F 9.14 3.82 0.00 3.13 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 41 I 8.19 3.74 2.10 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 1.45 1.25 0.94 0.00 0.00 42 D 8.20 4.35 0.00 2.92 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 7.85 3.84 0.00 1.62 1.51 0.46 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.10 4.14 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 45 L 7.75 3.92 0.00 1.86 1.76 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.84 3.46 1.94 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 1.51 0.79 0.64 0.00 0.00 47 T 7.79 3.79 4.35 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 1.28 0.00 0.00 48 K 7.54 3.31 0.00 1.30 0.74 0.00 1.17 0.00 0.00 1.05 0.00 0.00 2.74 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.15 1.39 7.81 49 Q 7.40 3.93 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 50 A 7.46 3.74 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 51 H 7.82 3.92 0.00 2.86 2.91 0.00 5.95 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 52 W 7.77 4.61 0.00 3.55 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 53 N 7.86 4.99 0.00 2.82 3.03 0.00 0.00 7.06 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 54 M 7.21 4.87 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.81 0.00 55 R 8.97 4.36 0.00 1.84 1.68 0.00 3.02 0.00 0.00 3.05 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.58 0.00 56 G 8.72 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 0.00 0.00 0.00 57 A 8.52 4.05 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 58 N 8.98 4.17 0.00 2.92 2.85 0.00 0.00 6.84 7.71 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 59 F 7.47 4.18 0.00 3.25 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 60 I 7.83 3.01 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.17 0.86 0.00 0.00 61 A 7.75 3.79 1.19 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 0.00 0.00 62 V 7.36 3.30 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.88 0.00 0.00 63 H 8.08 3.81 0.00 2.01 2.81 0.00 6.00 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 64 E 8.03 3.90 0.00 1.86 1.82 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 2.25 2.36 0.00 65 M 7.89 3.57 0.00 1.78 1.77 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.30 0.00 66 L 7.49 3.53 0.00 1.67 1.52 0.87 0.95 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 67 D 7.73 4.22 0.00 2.68 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.37 3.39 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 0.00 69 F 7.33 4.04 0.00 3.11 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 70 R 8.22 3.98 0.00 1.82 2.02 0.00 2.99 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 71 T 7.84 3.86 4.43 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 1.29 0.00 0.00 72 A 7.98 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.74 4.21 0.00 2.15 1.87 1.02 1.14 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 74 I 8.17 3.83 1.91 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 1.57 0.74 0.93 0.00 0.00 75 D 8.02 4.32 0.00 2.79 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 76 H 8.24 4.12 0.00 3.32 3.09 0.00 5.63 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.97 3.68 0.00 1.89 1.83 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.19 4.28 0.00 2.84 2.77 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 79 T 7.84 3.85 4.33 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 1.18 0.00 0.00 80 M 8.13 3.94 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.39 0.00 81 A 7.99 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 82 E 8.33 3.99 0.00 2.06 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 2.31 2.41 0.00 83 R 7.55 3.88 0.00 1.92 2.10 0.00 3.28 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 84 A 7.95 4.07 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 85 V 7.54 3.80 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 1.15 0.00 0.00 0.94 0.00 0.00 86 Q 7.84 4.03 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 87 L 7.45 4.39 0.00 1.74 1.66 0.95 1.00 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 88 G 8.26 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 89 G 7.60 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 0.00 0.00 0.00 0.00 90 V 8.03 4.13 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 0.85 0.00 0.00 0.93 0.00 0.00 91 A 8.71 4.14 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 92 L 9.52 4.66 0.00 1.68 1.61 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.41 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 94 T 7.82 4.19 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 95 T 8.49 3.89 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 96 Q 8.02 3.97 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.61 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 97 V 7.55 3.60 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 0.94 0.00 0.00 98 I 7.84 3.68 2.02 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 1.75 0.80 0.96 0.00 0.00 99 N 8.11 4.27 0.00 2.74 2.96 0.00 0.00 7.31 7.22 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 0.00 100 S 8.15 4.34 0.00 3.93 4.11 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 0.00 0.00 0.00 0.00 101 K 7.63 4.55 0.00 1.76 1.77 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.42 7.81 102 T 8.13 4.01 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 1.29 0.00 0.00 103 P 0.00 4.67 0.00 2.21 2.12 0.00 3.80 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 104 L 7.92 4.58 0.00 1.80 1.66 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.87 4.00 0.00 1.76 1.78 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.44 7.81 106 S 8.42 3.93 0.00 3.87 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 Y 8.71 4.20 0.00 3.04 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 0.00 108 P 0.00 4.26 0.00 2.05 1.92 0.00 2.87 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.60 0.00 109 L 8.59 4.70 0.00 1.71 1.80 0.98 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.79 4.83 0.00 2.73 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 0.00 111 I 7.49 3.99 1.70 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.24 0.78 0.00 0.00 112 H 8.50 4.98 0.00 3.18 3.32 0.00 5.63 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.12 4.82 0.00 2.86 2.91 0.00 0.00 6.82 7.71 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 0.00 114 V 8.29 3.66 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 0.93 0.00 0.00 1.12 0.00 0.00 115 Q 8.22 4.17 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.69 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 116 D 7.96 4.29 0.00 2.93 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 0.00 117 H 8.09 4.47 0.00 3.46 3.49 0.00 5.65 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 0.00 118 L 8.49 4.03 0.00 2.01 1.76 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.06 3.97 0.00 1.97 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.64 7.81 120 E 8.28 3.96 0.00 2.17 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 2.40 2.09 0.00 121 L 8.89 4.22 0.00 1.95 1.72 0.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.74 4.05 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 0.00 123 D 8.18 4.30 0.00 3.00 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 0.00 124 R 8.00 3.98 0.00 2.01 2.02 0.00 3.38 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 125 Y 8.96 3.72 0.00 3.11 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 0.00 126 A 8.32 3.99 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.76 3.57 2.01 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 1.40 0.76 0.88 0.00 0.00 128 V 7.57 3.42 1.69 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 0.51 0.00 0.00 0.73 0.00 0.00 129 A 8.52 3.86 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 0.00 130 N 8.59 4.28 0.00 2.89 2.87 0.00 0.00 6.76 8.12 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 0.00 131 D 8.31 4.30 0.00 2.78 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 0.00 132 V 7.75 4.11 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 1.21 0.00 0.00 1.04 0.00 0.00 133 R 8.13 3.99 0.00 1.99 2.09 0.00 3.05 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 134 K 7.80 4.13 0.00 2.00 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.67 7.81 135 A 8.05 3.78 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 0.00 136 I 7.40 3.77 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.28 0.89 0.00 0.00 137 G 7.44 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 0.00 138 E 7.62 4.28 0.00 2.06 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 2.29 2.31 0.00 139 A 7.12 4.50 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 0.00 140 K 8.76 4.01 0.00 1.79 1.96 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.41 7.81 141 D 7.99 4.34 0.00 2.72 2.54 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 0.00 142 D 8.82 4.36 0.00 2.71 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.20 4.36 0.00 2.85 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 7.75 3.82 4.33 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 1.18 0.00 0.00 145 A 8.26 3.98 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 0.00 146 D 8.14 4.22 0.00 2.90 2.85 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 0.00 147 I 7.79 3.65 1.99 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 1.49 0.77 0.84 0.00 0.00 148 L 7.92 3.97 0.00 1.82 1.69 0.95 0.48 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 0.00 149 T 8.16 3.78 4.34 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 1.18 0.00 0.00 150 A 8.16 3.94 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 0.00 151 A 7.85 3.33 1.23 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 0.00 0.00 0.00 152 S 8.48 3.93 0.00 3.87 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 0.00 153 R 8.47 3.79 0.00 1.99 2.01 0.00 3.11 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 154 D 7.71 3.99 0.00 2.62 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 0.00 0.00 0.00 155 L 7.65 3.63 0.00 1.63 1.56 0.55 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.11 4.42 0.00 2.64 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 0.00 157 K 7.59 4.05 0.00 1.86 1.89 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.10 1.48 7.81 158 F 8.23 3.92 0.00 2.84 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 0.00 0.00 0.00 159 L 8.45 3.89 0.00 1.85 1.96 1.06 0.97 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 0.00 160 W 8.28 4.38 0.00 3.38 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 F 7.78 4.07 0.00 3.23 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 0.00 162 I 8.17 3.87 1.93 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.79 0.88 0.00 0.00 163 E 8.54 4.02 0.00 2.30 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 2.38 2.53 0.00 164 S 8.27 4.37 0.00 3.76 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 0.00 165 N 7.76 4.78 0.00 2.77 2.80 0.00 0.00 7.00 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 0.00 166 I 7.05 4.15 2.04 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 1.32 0.67 0.93 0.00 0.00 167 E 9.43 4.14 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00