NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3511 0.0000 0.0000 61.8817 32.5517 175.8597 3 K 3.8082 8.8324 122.0528 55.9218 32.5606 175.0567 4 K 4.0047 9.1001 127.0862 56.9428 33.9831 175.3923 5 V 4.8555 8.3574 125.7069 61.5343 33.3051 174.3949 6 L 4.6988 8.6818 128.3858 53.2363 44.8192 175.6888 7 T 5.1108 8.1850 116.9933 62.0228 71.3320 173.6865 8 G 4.2061 8.8662 112.4498 45.6363 0.0000 171.4628 9 V 4.8887 8.2950 118.6794 59.8077 34.1684 175.2368 10 V 4.3783 8.4402 122.6735 62.5498 32.1825 176.5163 11 V 4.2771 8.1596 120.5119 61.2514 32.7274 175.9982 12 S 4.6191 7.4120 114.1525 57.0103 66.0709 174.6413 13 D 5.1257 8.4745 126.7907 53.3259 39.8277 176.4861 14 K 4.4879 7.8513 117.0986 57.6862 32.1167 176.7111 15 M 4.8025 7.4863 118.0141 53.1301 34.8481 175.1559 16 Q 4.2005 8.6439 121.8650 56.9909 29.2832 176.1922 17 K 4.7162 9.4730 120.8931 56.9942 30.2757 175.0012 18 T 5.1585 7.6952 114.5056 62.3714 72.8498 173.8313 19 V 4.7153 8.5747 118.7570 59.6948 35.7806 175.1055 20 T 4.4650 9.0047 122.8518 63.4282 69.8374 173.7085 21 V 4.6750 9.1068 126.7974 60.7795 33.9964 174.2815 22 L 4.5064 8.6801 131.7964 54.9183 43.4557 175.7882 23 V 4.5950 9.0854 125.7955 61.3432 34.2250 174.1319 24 E 5.1313 8.8795 127.6162 55.3799 31.1583 175.9493 25 R 4.9037 9.1713 118.5300 54.7091 33.1676 173.9491 26 Q 4.8930 8.6229 119.0630 54.2148 32.0506 174.0796 27 F 4.7522 7.6964 114.2023 55.8760 41.4793 171.3691 28 P 5.0650 0.0000 0.0000 62.2255 32.1706 176.0022 29 H 4.4132 8.9448 124.6666 55.0649 30.4532 174.1490 30 P 4.2324 0.0000 0.0000 65.2694 30.9511 176.4767 31 L 4.4194 7.9104 117.7034 55.4223 43.9120 176.0863 32 Y 4.7606 7.9731 113.0262 57.4465 38.2844 175.8001 33 G 4.2855 7.9909 114.5437 46.1607 0.0000 173.3505 34 K 4.1898 7.4745 119.9563 53.7174 33.6560 174.8118 35 V 4.1021 8.4558 128.0134 62.7932 31.7386 175.3287 36 I 4.1218 8.0628 123.3061 60.0127 40.4070 174.8855 37 K 4.2838 8.1390 123.3458 55.9889 33.6319 175.3547 38 R 4.8443 8.4672 127.1483 55.0245 33.1867 175.2133 39 S 5.1486 8.2910 113.3998 57.7770 66.1170 173.3299 40 K 4.6493 9.1418 120.7379 54.9951 35.8455 174.6694 41 K 4.9920 8.4911 125.1650 55.4362 33.6960 175.4577 42 Y 4.5704 8.9627 121.9253 56.2738 41.5051 175.2301 43 L 4.7968 8.6350 122.9772 53.5631 42.2145 175.3575 44 A 4.7566 8.5221 125.6832 51.2473 20.9851 175.5412 45 H 4.7148 9.5217 121.6216 55.9345 31.4372 173.9360 46 D 4.8164 8.9379 125.8330 51.1851 41.2034 173.7428 47 P 4.2206 0.0000 0.0000 64.9999 31.6582 177.8634 48 E 4.3293 8.3229 115.9429 55.2548 29.5796 176.1699 49 E 4.0162 8.4272 115.8653 56.9309 27.6009 175.1077 50 K 3.8182 7.9426 121.0333 59.6515 32.1549 177.0592 51 Y 4.3417 8.2665 114.7904 57.4114 38.6895 174.8030 52 K 4.6105 10.2743 121.4724 53.7114 35.6712 175.4241 53 L 4.0870 7.9806 121.0690 59.3890 41.5409 176.1732 54 G 3.8812 8.2348 114.5477 45.4802 0.0000 172.5506 55 D 4.8512 8.5434 121.7218 54.2656 42.4460 175.5971 56 V 4.6306 9.2465 123.2957 61.5630 33.4049 174.9884 57 V 4.8879 8.6015 120.7047 59.6214 35.8218 174.3917 58 E 4.9238 8.8608 121.0847 55.1578 31.8321 175.6122 59 I 4.9667 9.2671 123.7120 59.4759 41.3547 174.3520 60 I 5.2247 8.5390 125.2420 58.7974 41.3913 174.3084 61 E 3.6101 9.3931 128.0063 57.5674 29.8233 176.6809 62 S 4.6519 8.0652 118.2024 56.5126 67.7451 173.9546 63 R 3.8759 8.4981 121.8267 55.4183 30.3636 174.3807 64 P 4.2476 0.0000 0.0000 63.5650 31.6362 175.9227 65 I 4.0956 8.2938 124.0539 62.4707 38.2743 175.5343 66 S 4.4954 7.2627 112.5186 57.0361 64.8371 174.8666 67 K 4.0882 8.4208 122.3794 57.9296 32.2618 175.8929 68 R 4.2098 9.0089 125.3280 55.5592 29.7959 175.4525 69 K 4.7944 7.8988 116.5366 54.2497 33.0324 175.9415 70 R 4.8422 8.5146 122.5880 55.4334 32.5922 174.8406 71 F 5.3784 8.1922 116.1140 56.1675 43.9142 173.6121 72 R 5.1677 8.6688 119.1725 54.1961 34.1687 175.4955 73 V 3.8141 8.0809 121.9649 62.7322 30.8035 175.5667 74 L 4.2516 8.5463 131.4604 57.2216 42.3478 176.7673 75 R 4.5907 7.4463 112.2581 55.8080 32.4390 172.1472 76 L 4.7455 8.7369 121.6122 54.2376 42.3841 176.0334 77 V 4.1469 8.9295 127.0502 64.7228 32.6738 175.2407 78 E 4.9986 7.5730 116.0901 56.3522 32.1541 175.2155 79 S 4.5934 8.2320 114.0832 57.3478 66.4855 173.0493 80 G 3.9128 8.6073 105.4223 47.5436 0.0000 175.2957 81 R 4.7247 7.5721 116.2889 53.6171 29.3874 177.4670 82 M 4.1827 7.9006 120.6091 57.5925 32.0353 177.5840 83 D 4.6214 8.2364 119.5871 56.7357 39.1447 178.9082 84 L 4.0047 7.7439 119.9799 57.2324 41.6370 179.4535 85 V 3.6307 7.8366 117.5874 66.5022 31.3425 177.0365 86 E 3.9201 9.5999 118.0056 59.8633 29.3080 179.4086 87 K 3.9077 8.1253 117.2525 60.0011 32.3029 177.9512 88 Y 4.1151 7.9353 118.8130 61.0835 38.6111 178.3509 89 L 3.7180 8.3047 119.7131 57.9800 41.7271 179.7855 90 I 3.7536 7.9739 119.6787 64.3999 36.8806 178.2311 91 R 3.7079 8.1511 119.9187 59.6478 29.5340 178.4874 92 R 2.9530 7.1108 117.0899 58.7927 30.3896 177.7768 93 Q 4.0095 8.0427 119.8734 59.2129 29.0230 177.5828 94 N 4.2929 8.7281 118.5284 57.4411 38.8450 175.7168 95 Y 4.3137 7.8891 117.3602 61.5677 37.9446 178.7803 96 E 4.1827 8.0374 114.1340 57.5681 29.2053 178.2165 97 S 4.8174 8.5484 112.5231 57.8856 63.3581 174.3043 98 L 4.1337 7.8920 121.1357 55.0938 42.1979 178.7875 99 S 4.1550 8.2342 116.4013 58.2539 63.6241 175.9705 100 K 3.9536 8.5872 118.4750 58.6943 31.7039 177.8351 101 R 4.4626 7.3572 115.8280 55.5850 30.4048 177.0533 102 G 4.4064 8.2057 108.7655 47.1464 0.0000 171.6394 103 G 3.9108 7.9382 112.5016 45.8044 0.0000 173.6222 104 K 4.3538 7.8887 120.6083 53.9628 33.6482 176.9363 105 A 4.1633 8.4739 124.1881 52.5821 18.2842 177.3920 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 P 0.00 4.35 0.00 2.20 2.14 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 3 K 8.83 3.81 0.00 1.75 1.96 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.49 7.81 4 K 9.10 4.00 0.00 1.94 1.89 0.00 1.47 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.44 7.81 5 V 8.36 4.86 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 0.89 0.00 0.00 0.98 0.00 0.00 6 L 8.68 4.70 0.00 1.00 1.18 0.16 0.24 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 7 T 8.18 5.11 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 8 G 8.87 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 9 V 8.29 4.89 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 0.68 0.00 0.00 0.95 0.00 0.00 10 V 8.44 4.38 2.22 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 0.99 0.00 0.00 0.94 0.00 0.00 11 V 8.16 4.28 1.54 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 0.22 0.00 0.00 0.36 0.00 0.00 12 S 7.41 4.62 0.00 3.88 3.63 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 13 D 8.47 5.13 0.00 2.91 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 7.85 4.49 0.00 1.77 1.89 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.57 7.81 15 M 7.49 4.80 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.48 0.00 16 Q 8.64 4.20 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 17 K 9.47 4.72 0.00 2.05 1.92 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.38 7.81 18 T 7.70 5.16 4.27 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 1.31 0.00 0.00 19 V 8.57 4.72 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 0.92 0.00 0.00 0.88 0.00 0.00 20 T 9.00 4.47 4.17 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 0.00 0.00 1.11 0.00 0.00 21 V 9.11 4.68 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 0.91 0.00 0.00 0.83 0.00 0.00 22 L 8.68 4.51 0.00 1.51 1.38 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 23 V 9.09 4.60 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 0.98 0.00 0.00 0.90 0.00 0.00 24 E 8.88 5.13 0.00 1.91 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 2.29 2.31 0.00 25 R 9.17 4.90 0.00 1.91 2.02 0.00 2.76 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 26 Q 8.62 4.89 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.07 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 27 F 7.70 4.75 0.00 3.23 3.20 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 28 P 0.00 5.07 0.00 2.07 2.10 0.00 3.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 29 H 8.94 4.41 0.00 3.29 3.31 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.23 0.00 2.13 2.18 0.00 3.31 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 31 L 7.91 4.42 0.00 1.33 1.04 0.86 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.97 4.76 0.00 2.81 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 33 G 7.99 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 0.00 0.00 0.00 0.00 34 K 7.47 4.19 0.00 1.88 1.71 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.49 7.81 35 V 8.46 4.10 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 0.80 0.00 0.00 0.94 0.00 0.00 36 I 8.06 4.12 1.69 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 -0.36 0.93 0.00 0.00 37 K 8.14 4.28 0.00 1.68 1.67 0.00 1.76 0.00 0.00 2.21 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.47 7.81 38 R 8.47 4.84 0.00 2.07 1.96 0.00 3.27 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 39 S 8.29 5.15 0.00 3.98 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 40 K 9.14 4.65 0.00 1.78 1.67 0.00 0.61 0.00 0.00 0.85 0.00 0.00 2.70 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.92 1.21 7.81 41 K 8.49 4.99 0.00 1.62 1.64 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.23 1.44 7.81 42 Y 8.96 4.57 0.00 2.73 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 43 L 8.64 4.80 0.00 1.84 1.67 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.52 4.76 1.22 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 0.00 0.00 0.00 45 H 9.52 4.71 0.00 3.26 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.94 4.82 0.00 2.77 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 47 P 0.00 4.22 0.00 2.24 2.21 0.00 3.81 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 48 E 8.32 4.33 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 2.34 2.33 0.00 49 E 8.43 4.02 0.00 2.09 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 0.00 2.23 2.23 0.00 50 K 7.94 3.82 0.00 1.50 1.53 0.00 1.01 0.00 0.00 1.32 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.68 1.12 7.81 51 Y 8.27 4.34 0.00 2.98 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 52 K 10.27 4.61 0.00 1.95 1.68 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.38 7.81 53 L 7.98 4.09 0.00 1.84 1.64 1.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.23 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 8.54 4.85 0.00 2.79 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 56 V 9.25 4.63 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 0.95 0.00 0.00 0.92 0.00 0.00 57 V 8.60 4.89 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 0.66 0.00 0.00 0.76 0.00 0.00 58 E 8.86 4.92 0.00 1.86 1.79 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 2.21 2.25 0.00 59 I 9.27 4.97 1.52 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.82 0.47 0.00 0.00 60 I 8.54 5.22 1.90 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 1.26 1.69 0.98 0.00 0.00 61 E 9.39 3.61 0.00 1.78 1.79 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 2.12 2.44 0.00 62 S 8.07 4.65 0.00 3.61 3.66 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 63 R 8.50 3.88 0.00 1.73 1.80 0.00 3.25 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 64 P 0.00 4.25 0.00 2.04 2.00 0.00 3.67 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 2.00 2.09 0.00 65 I 8.29 4.10 1.83 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 1.14 0.27 0.77 0.00 0.00 66 S 7.26 4.50 0.00 3.94 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 67 K 8.42 4.09 0.00 1.74 1.76 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.43 7.81 68 R 9.01 4.21 0.00 1.93 2.25 0.00 3.30 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.69 0.00 69 K 7.90 4.79 0.00 1.93 1.75 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.63 1.37 7.81 70 R 8.51 4.84 0.00 1.66 1.47 0.00 3.12 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 71 F 8.19 5.38 0.00 2.98 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 8.67 5.17 0.00 1.80 1.81 0.00 3.19 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 73 V 8.08 3.81 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 -0.52 0.00 0.00 0.62 0.00 0.00 74 L 8.55 4.25 0.00 1.69 1.67 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.45 4.59 0.00 1.93 2.03 0.00 3.02 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.54 0.00 76 L 8.74 4.75 0.00 1.85 1.68 1.20 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.93 4.15 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 0.83 0.00 0.00 0.92 0.00 0.00 78 E 7.57 5.00 0.00 2.03 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 2.13 2.16 0.00 79 S 8.23 4.59 0.00 3.95 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 80 G 8.61 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 81 R 7.57 4.72 0.00 1.85 2.04 0.00 3.37 0.00 0.00 3.30 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 82 M 7.90 4.18 0.00 2.04 2.13 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 2.70 2.55 0.00 83 D 8.24 4.62 0.00 2.87 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.74 4.00 0.00 1.88 1.76 0.92 0.82 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 85 V 7.84 3.63 2.23 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 1.21 0.00 0.00 0.99 0.00 0.00 86 E 9.60 3.92 0.00 2.30 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 2.49 2.54 0.00 87 K 8.13 3.91 0.00 2.08 1.92 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.72 7.81 88 Y 7.94 4.12 0.00 3.03 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 89 L 8.30 3.72 0.00 1.88 1.67 0.95 0.73 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 90 I 7.97 3.75 1.94 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 1.38 1.10 0.88 0.00 0.00 91 R 8.15 3.71 0.00 1.81 1.87 0.00 2.93 0.00 0.00 2.72 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 92 R 7.11 2.95 0.00 1.16 1.62 0.00 3.07 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.37 0.00 93 Q 8.04 4.01 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.46 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 94 N 8.73 4.29 0.00 3.10 3.07 0.00 0.00 7.25 7.55 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 95 Y 7.89 4.31 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 E 8.04 4.18 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 97 S 8.55 4.82 0.00 4.03 3.93 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 98 L 7.89 4.13 0.00 1.60 1.48 0.73 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 99 S 8.23 4.15 0.00 3.98 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.59 3.95 0.00 1.76 1.92 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.48 7.81 101 R 7.36 4.46 0.00 1.87 1.93 0.00 3.34 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 102 G 8.21 4.41 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 0.00 103 G 7.94 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 0.00 104 K 7.89 4.35 0.00 1.75 1.74 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.36 7.81 105 A 8.47 4.16 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