NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5913 8.3649 120.5469 53.9494 42.2313 175.8715 2 C 4.3097 8.6222 119.4716 55.9690 38.0131 171.9338 3 P 4.5904 0.0000 0.0000 61.5710 33.7588 175.1270 4 S 4.3437 8.4555 115.1965 60.8439 63.1008 173.3799 5 D 5.0477 9.1438 124.2051 53.9540 39.1414 175.1413 6 W 4.5857 7.8672 117.8919 56.4398 30.0027 176.2506 7 S 5.0786 9.3916 121.1839 57.0827 64.5888 173.4328 8 S 5.2200 8.7843 119.0495 57.7400 64.7301 173.5256 9 Y 4.1320 9.1908 123.7362 57.5293 41.1830 174.5207 10 E 3.6340 9.1421 129.4905 57.5525 27.0969 174.7118 11 G 3.9712 7.8997 99.2356 46.7670 0.0000 172.3174 12 H 5.0816 7.9962 114.6541 53.8868 33.7231 171.9289 13 C 5.3974 8.5897 118.9941 55.4903 40.6995 172.6224 14 Y 5.8172 9.2383 119.7454 55.3484 42.3190 174.6606 15 K 4.2881 7.9627 122.8401 54.6968 35.4592 172.8271 16 P 5.0333 0.0000 0.0000 62.1515 32.0040 175.5138 17 F 4.7579 8.9115 122.5696 55.6057 41.9517 176.2534 18 S 3.8191 8.2417 114.9525 57.5700 63.4831 173.6225 19 E 4.1944 7.6546 120.3544 55.0348 29.9794 174.7034 20 P 4.6027 0.0000 0.0000 62.5558 31.9310 176.0945 21 K 4.8125 9.0365 122.8395 54.4997 37.3184 175.9146 22 N 5.8180 8.4804 118.9383 51.1652 39.1484 175.9247 23 W 2.7713 8.5924 127.2012 60.1429 30.5256 177.3940 24 A 4.0275 8.0061 120.0108 55.5947 17.7738 179.2639 25 D 4.1795 8.2799 116.9266 57.1128 40.8191 178.9147 26 A 2.9360 7.5735 121.3708 54.6629 18.2663 179.1909 27 E 3.4100 7.2114 117.7260 59.3204 29.4364 178.6074 28 N 4.5456 7.6568 117.9873 56.0731 38.7632 176.5740 29 F 3.9937 7.9815 121.2975 61.4265 39.5850 176.1830 30 C 4.6123 8.3785 116.4951 60.2356 34.3078 176.1784 31 T 4.2636 8.1723 112.9665 63.1891 67.9649 175.2183 32 Q 4.7430 7.4227 119.5225 56.0190 30.1101 175.7864 33 Q 4.3837 7.6753 120.6156 56.2111 30.8776 174.6877 34 H 4.2118 7.3515 118.8619 55.8896 32.0556 173.1685 35 A 4.1019 7.9629 128.5224 53.4965 18.6204 178.1293 36 G 3.9548 8.9061 109.9880 45.4384 0.0000 173.7311 37 G 4.0090 7.9691 108.1720 46.7942 0.0000 173.2777 38 H 5.3038 9.1865 119.8154 54.6224 33.8347 171.9609 39 L 4.7743 8.2786 121.4044 54.5340 42.9154 177.4992 40 V 4.1919 8.8696 125.5152 62.5509 32.2935 175.1185 41 S 4.8370 9.3619 119.2106 56.3190 64.7402 173.4091 42 F 5.1390 8.5687 124.2069 56.8830 39.6184 175.4422 43 Q 4.7930 8.8205 123.4629 54.4934 29.9151 175.5859 44 S 4.6790 7.4917 112.0836 56.9460 66.1156 177.3433 45 S 4.0838 8.1076 118.0868 61.4676 62.9003 176.1654 46 E 3.9134 8.0936 122.5387 58.8192 29.4689 178.1974 47 E 3.4000 7.7499 119.3770 58.9571 29.7331 178.6904 48 A 2.5800 7.2684 120.6480 54.5639 18.2129 179.1286 49 D 4.0590 8.0183 117.8059 57.4888 40.9267 178.6773 50 F 3.7972 7.8314 120.9149 61.3422 39.2463 177.1757 51 V 2.9914 7.2749 117.4046 65.7457 31.1783 178.1837 52 V 3.3261 7.6295 118.1428 65.7511 31.3773 177.8473 53 K 3.7919 7.9614 119.6630 59.2750 31.9008 178.3640 54 L 3.5649 7.7973 120.6262 58.0550 41.8553 178.8049 55 A 3.6833 8.0836 120.9906 55.0072 18.1561 179.4528 56 F 4.1303 8.3512 120.7128 60.8587 39.2829 177.4878 57 Q 4.0112 8.4202 116.9952 59.1649 28.5392 178.8497 58 T 3.6910 7.7647 115.8439 65.8106 68.6999 175.8382 59 F 4.8210 7.6443 115.3616 56.4110 40.4423 177.8565 60 G 2.7876 7.8899 110.0390 46.0634 0.0000 174.7946 61 H 4.8119 8.3200 121.2898 55.7842 28.8142 174.1958 62 S 4.6657 9.1335 121.1473 56.9803 66.4529 171.4071 63 I 4.9707 7.7871 112.1720 59.1783 40.1566 174.5687 64 F 4.9746 8.8532 123.6785 55.0699 42.6540 174.7208 65 W 5.2309 9.2584 123.6092 57.4753 29.8066 175.3054 66 M 4.9147 9.4482 121.0446 52.7297 35.9521 177.0327 67 G 4.2510 8.8529 108.6970 45.8288 0.0000 173.4930 68 L 4.6248 8.6086 122.3230 52.6634 44.2875 175.4296 69 S 4.1656 7.6233 118.8168 56.3196 65.9531 172.5804 70 N 4.2725 7.9865 113.7654 52.3144 35.9279 176.5228 71 V 3.2544 7.1157 118.7397 65.3310 31.8965 176.4128 72 W 5.0288 7.6121 115.3146 56.2454 30.7074 176.7516 73 N 4.2605 8.1160 117.8357 56.1113 38.0278 176.3314 74 Q 4.5401 7.9426 113.3473 56.1297 28.9033 175.3201 75 C 4.4222 7.9999 116.7216 59.9052 28.8389 173.9478 76 N 4.6387 8.0303 120.6943 52.1769 36.9044 172.3410 77 W 4.3062 8.3832 120.8791 55.6936 29.8363 175.9999 78 Q 4.6787 8.3038 121.8624 53.5291 32.1615 175.4530 79 W 4.5757 8.5177 121.1891 56.4160 29.9152 177.8146 80 S 4.3048 9.0116 116.2052 60.7292 62.2374 174.6290 81 N 4.6327 8.4025 117.0315 51.8927 37.3618 174.9337 82 A 3.6694 7.9359 119.1707 53.3906 16.6707 178.2802 83 A 4.2122 7.3268 117.9636 53.5166 19.0280 178.0232 84 M 4.2567 8.3881 119.9600 54.8594 32.8073 175.8361 85 L 4.6895 8.7036 128.6539 54.8660 42.0648 175.1515 86 R 4.5156 8.7622 122.9414 57.8779 32.6684 175.5508 87 Y 4.4110 8.1107 117.4972 56.6995 39.5940 174.5741 88 K 4.3164 7.5967 124.6790 55.4100 35.9768 176.1253 89 A 4.6286 7.7049 124.9529 50.7504 19.1061 176.4492 90 W 4.0800 7.9238 121.1574 56.7315 30.1278 177.5359 91 A 4.2111 8.7550 125.6604 54.0145 18.3303 177.1973 92 E 4.6369 8.0444 115.6508 54.1026 32.5087 174.6200 93 E 3.9484 8.9695 127.4580 59.0066 30.2078 176.3694 94 S 4.7277 7.3556 112.0260 57.4479 68.1929 172.0712 95 Y 4.9559 8.3838 117.7417 56.5325 41.4080 175.6853 96 C 4.9537 9.6685 121.2803 54.9741 45.2422 172.9340 97 V 5.0281 8.3545 121.1316 62.4011 32.7606 174.4659 98 Y 5.6915 9.3996 124.8982 55.5913 42.0991 173.5703 99 F 5.3166 9.4407 114.9649 54.9762 41.9642 173.4629 100 K 5.1894 8.7277 120.8661 54.4454 34.1067 176.7078 101 S 4.7566 9.0893 121.2180 60.6151 62.5459 175.4674 102 T 4.1085 8.4919 118.6691 66.1678 68.5947 173.8692 103 N 4.7869 7.8287 116.1056 52.4584 39.7025 173.2080 104 N 4.9277 8.4790 112.9650 52.6469 37.7121 175.1718 105 K 4.4152 8.2730 118.1303 56.6914 32.9157 176.7785 106 W 4.8963 8.7181 122.2479 56.5557 30.3121 175.9092 107 R 4.9071 8.9558 121.7044 54.4914 34.1662 174.2541 108 S 5.5959 8.7282 115.3174 57.3590 65.7605 173.1948 109 R 5.0292 9.3129 119.6250 55.0445 34.2552 173.7845 110 A 3.7577 8.6824 126.8443 52.3419 18.7486 179.0260 111 C 3.9610 8.6396 121.3450 60.0962 40.4632 176.0443 112 R 4.0749 7.7456 113.0041 57.0363 29.8655 176.3344 113 M 4.4702 8.4611 119.8871 55.3179 33.4717 175.7043 114 M 4.6310 8.5029 120.2090 55.6555 33.2423 175.6490 115 A 3.8514 7.9311 120.6291 51.2966 23.4102 176.4167 116 Q 4.4923 7.4763 120.0325 55.6011 31.2670 174.3090 117 F 5.3631 7.7799 113.0481 56.7050 42.0058 173.1541 118 V 5.0104 8.7035 117.7397 61.6413 34.6615 175.2786 119 C 5.6152 9.4398 125.2528 56.4501 44.0025 172.1417 120 E 5.9800 9.8257 120.6028 55.3503 33.2644 173.7895 121 F 5.4982 8.1399 119.0778 55.5894 41.5890 172.9831 122 Q 4.2712 8.8965 121.1075 55.8143 30.5719 175.3607 123 A 4.0215 8.3353 126.1686 52.7732 19.2754 177.6541 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 D 8.36 4.59 0.00 2.69 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 8.62 4.31 0.00 3.12 3.37 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 3 P 0.00 4.59 0.00 2.32 2.09 0.00 3.52 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.19 0.00 4 S 8.46 4.34 0.00 3.97 3.89 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 5 D 9.14 5.05 0.00 2.92 2.94 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 6 W 7.87 4.59 0.00 3.19 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 7 S 9.39 5.08 0.00 4.07 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 8 S 8.78 5.22 0.00 3.90 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 9 Y 9.19 4.13 0.00 1.58 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 10 E 9.14 3.63 0.00 1.86 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 1.47 1.58 0.00 11 G 7.90 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 0.00 0.00 0.00 12 H 8.00 5.08 0.00 3.26 2.67 0.00 5.78 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 C 8.59 5.40 0.00 1.23 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 14 Y 9.24 5.82 0.00 3.06 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 15 K 7.96 4.29 0.00 0.79 0.74 0.00 0.79 0.00 0.00 0.98 0.00 0.00 2.23 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.78 7.81 16 P 0.00 5.03 0.00 2.21 2.01 0.00 3.40 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.97 0.00 17 F 8.91 4.76 0.00 1.51 2.33 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 18 S 8.24 3.82 0.00 3.44 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 19 E 7.65 4.19 0.00 1.90 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 2.22 2.20 0.00 20 P 0.00 4.60 0.00 1.87 1.89 0.00 3.53 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.92 0.00 21 K 9.04 4.81 0.00 1.41 1.45 0.00 1.03 0.00 0.00 1.45 0.00 0.00 2.40 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.22 1.46 7.81 22 N 8.48 5.82 0.00 3.08 3.02 0.00 0.00 6.36 8.88 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 23 W 8.59 2.77 0.00 2.03 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.01 4.03 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 25 D 8.28 4.18 0.00 2.74 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 26 A 7.57 2.94 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.21 3.41 0.00 1.16 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 1.99 2.11 0.00 28 N 7.66 4.55 0.00 2.81 2.82 0.00 0.00 6.39 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 29 F 7.98 3.99 0.00 2.96 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 30 C 8.38 4.61 0.00 3.24 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 31 T 8.17 4.26 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 1.12 0.00 0.00 32 Q 7.42 4.74 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.07 0.00 33 Q 7.68 4.38 0.00 1.99 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.67 2.67 0.00 34 H 7.35 4.21 0.00 2.88 2.42 0.00 5.73 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.96 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.91 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 37 G 7.97 4.01 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 0.00 0.00 0.00 38 H 9.19 5.30 0.00 3.15 3.25 0.00 5.61 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.28 4.77 0.00 1.71 1.64 0.95 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.87 4.19 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.30 0.00 0.00 41 S 9.36 4.84 0.00 4.03 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 42 F 8.57 5.14 0.00 3.20 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 43 Q 8.82 4.79 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 44 S 7.49 4.68 0.00 4.03 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 45 S 8.11 4.08 0.00 4.02 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 46 E 8.09 3.91 0.00 2.06 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 2.39 2.38 0.00 47 E 7.75 3.40 0.00 2.24 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 2.51 0.00 48 A 7.27 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.02 4.06 0.00 2.69 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 50 F 7.83 3.80 0.00 2.36 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 51 V 7.27 2.99 1.75 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 0.86 0.00 0.00 0.71 0.00 0.00 52 V 7.63 3.33 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 1.09 0.00 0.00 0.57 0.00 0.00 53 K 7.96 3.79 0.00 1.78 1.70 0.00 1.61 0.00 0.00 1.48 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.36 7.81 54 L 7.80 3.56 0.00 0.97 1.29 0.68 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.08 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.35 4.13 0.00 3.24 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 57 Q 8.42 4.01 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.75 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 58 T 7.76 3.69 3.67 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 -0.05 0.00 0.00 59 F 7.64 4.82 0.00 3.26 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 60 G 7.89 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 0.00 0.00 0.00 61 H 8.32 4.81 0.00 3.27 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 9.13 4.67 0.00 3.81 3.30 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 63 I 7.79 4.97 1.55 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.01 0.90 0.00 0.00 64 F 8.85 4.97 0.00 1.51 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 65 W 9.26 5.23 0.00 3.26 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 66 M 9.45 4.91 0.00 1.53 1.92 0.00 0.00 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.06 0.00 67 G 8.85 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 0.00 0.00 0.00 0.00 68 L 8.61 4.62 0.00 1.54 1.34 0.90 1.11 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 69 S 7.62 4.17 0.00 2.72 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 70 N 7.99 4.27 0.00 2.69 2.74 0.00 0.00 7.21 7.68 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 71 V 7.12 3.25 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 0.00 0.00 -0.27 0.00 0.00 0.57 0.00 0.00 72 W 7.61 5.03 0.00 3.81 3.27 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 73 N 8.12 4.26 0.00 2.78 2.75 0.00 0.00 6.69 7.18 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 74 Q 7.94 4.54 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.06 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 75 C 8.00 4.42 0.00 3.05 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 76 N 8.03 4.64 0.00 2.66 2.68 0.00 0.00 7.03 7.95 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 77 W 8.38 4.31 0.00 3.38 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 78 Q 8.30 4.68 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.00 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 79 W 8.52 4.58 0.00 3.52 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 80 S 9.01 4.30 0.00 4.04 4.09 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 81 N 8.40 4.63 0.00 2.88 3.08 0.00 0.00 6.17 7.46 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 82 A 7.94 3.67 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 83 A 7.33 4.21 1.05 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 0.00 0.00 84 M 8.39 4.26 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.65 0.00 85 L 8.70 4.69 0.00 1.80 1.73 1.08 1.06 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 86 R 8.76 4.52 0.00 1.88 2.00 0.00 3.38 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 87 Y 8.11 4.41 0.00 2.96 2.94 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 88 K 7.60 4.32 0.00 1.89 1.73 0.00 1.72 0.00 0.00 1.90 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.25 1.55 7.81 89 A 7.70 4.63 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 90 W 7.92 4.08 0.00 3.22 3.30 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 91 A 8.76 4.21 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 92 E 8.04 4.64 0.00 1.98 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 1.78 2.03 0.00 93 E 8.97 3.95 0.00 1.89 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 0.00 2.17 2.24 0.00 94 S 7.36 4.73 0.00 3.55 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 8.38 4.96 0.00 2.71 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 96 C 9.67 4.95 0.00 2.41 2.40 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 97 V 8.35 5.03 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 0.77 0.00 0.00 0.89 0.00 0.00 98 Y 9.40 5.69 0.00 2.91 3.06 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 99 F 9.44 5.32 0.00 3.25 3.28 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 0.00 100 K 8.73 5.19 0.00 2.01 1.86 0.00 1.89 0.00 0.00 1.99 0.00 0.00 3.06 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.56 1.67 7.81 101 S 9.09 4.76 0.00 4.29 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 0.00 102 T 8.49 4.11 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 1.23 0.00 0.00 103 N 7.83 4.79 0.00 2.79 2.78 0.00 0.00 5.95 8.04 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 0.00 104 N 8.48 4.93 0.00 2.70 2.78 0.00 0.00 6.03 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 0.00 105 K 8.27 4.42 0.00 2.04 1.87 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.59 7.81 106 W 8.72 4.90 0.00 3.18 3.13 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 0.00 107 R 8.96 4.91 0.00 0.67 1.44 0.00 2.79 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.46 0.00 108 S 8.73 5.60 0.00 4.17 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 0.00 109 R 9.31 5.03 0.00 2.08 2.11 0.00 2.21 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.52 0.00 110 A 8.68 3.76 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.64 3.96 0.00 2.82 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 0.00 112 R 7.75 4.07 0.00 1.90 2.00 0.00 3.01 0.00 0.00 3.19 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 113 M 8.46 4.47 0.00 1.88 2.21 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 2.63 2.75 0.00 114 M 8.50 4.63 0.00 1.80 1.89 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 115 A 7.93 3.85 -0.41 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 0.00 116 Q 7.48 4.49 0.00 0.93 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.44 0.00 0.00 0.00 0.00 0.00 1.90 1.80 0.00 117 F 7.78 5.36 0.00 3.32 3.36 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 0.00 118 V 8.70 5.01 2.38 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 1.25 0.00 0.00 1.08 0.00 0.00 119 C 9.44 5.62 0.00 3.48 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 9.83 5.98 0.00 2.22 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 2.19 1.47 0.00 121 F 8.14 5.50 0.00 3.01 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 0.00 122 Q 8.90 4.27 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.12 0.00 0.00 0.00 0.00 0.00 2.22 2.20 0.00 123 A 8.34 4.02 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