NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4967 8.1693 120.6409 55.0319 43.1156 175.6641 8 H 4.8559 8.5213 115.3321 53.2466 31.6209 171.1829 9 K 4.5752 9.2264 121.7697 55.7799 34.2009 177.1781 10 E 4.9536 9.0842 123.8765 53.7371 32.9423 173.9264 11 P 4.9811 0.0000 0.0000 63.1129 32.6453 174.7319 12 A 4.9394 8.5090 121.9622 51.3595 23.2247 175.4312 13 T 4.6333 8.4785 114.2338 61.3212 72.2797 174.0513 14 L 4.1489 8.7943 128.0580 56.3214 42.1988 175.5879 15 I 4.3898 8.6057 126.0751 62.3020 39.0928 176.0355 16 K 4.5472 7.5919 120.5325 55.2655 35.5265 174.1656 17 A 4.5479 8.7312 130.5603 52.0610 19.2374 177.0079 18 I 4.2851 8.0208 122.3129 62.1315 39.0926 174.8068 19 D 4.4181 7.4655 117.4639 53.4870 43.7978 176.0281 20 G 3.7060 8.9581 109.2357 47.8510 0.0000 173.9951 21 D 4.8991 8.0568 116.5161 52.9983 40.3161 175.2002 22 T 5.1896 7.8437 116.5799 62.4353 72.8499 173.2747 23 V 4.7255 8.7642 118.9627 59.3824 36.1693 174.3933 24 K 4.9885 9.2160 126.3500 55.4554 33.6655 175.3685 25 L 5.3000 9.2995 126.5953 53.1368 46.7694 175.1358 26 M 4.8360 9.3354 122.1120 55.0062 33.6086 174.3251 27 Y 4.9713 9.1301 127.7993 56.1309 42.1226 175.5120 28 K 3.6787 9.2421 127.3787 57.5760 29.6872 175.4736 29 G 3.9163 8.0957 102.1796 45.9131 0.0000 172.7084 30 Q 4.7136 7.8481 120.9582 52.8303 31.3797 172.8316 31 P 4.9586 0.0000 0.0000 63.3594 32.2144 175.2459 32 M 4.8366 9.2280 122.4261 54.3814 36.2971 173.5385 33 T 4.6935 8.4875 122.0673 62.9553 70.5602 173.4062 34 F 4.9685 9.3753 125.1834 55.6557 42.0881 174.4081 35 R 4.9536 9.0194 124.1500 54.7263 31.9603 175.1431 36 L 4.6305 8.7140 127.3812 54.1339 42.4661 177.2322 37 L 3.8618 8.5577 125.0255 56.1558 42.1700 178.0275 38 L 3.7878 8.8149 120.4111 55.1264 39.2772 173.9746 39 V 4.9914 7.3275 110.1047 59.6030 35.0529 174.7188 40 D 5.0492 9.1827 124.5695 52.8611 42.8594 175.5898 41 T 4.5765 8.3322 113.5048 58.9261 71.2450 172.7405 42 P 4.3835 0.0000 0.0000 62.7872 32.2326 175.5732 43 E 4.7440 10.0892 121.8244 54.9657 32.3203 176.9323 44 T 4.2852 8.6060 109.5820 61.9795 69.9786 175.0302 45 K 4.3478 7.8080 121.4500 56.6049 34.6997 173.2715 46 H 4.0949 8.5586 123.2578 55.8945 30.1043 174.0390 47 P 4.6363 0.0000 0.0000 63.0739 32.1484 176.8881 48 K 4.3675 7.7361 117.1400 57.6675 32.3604 176.9622 49 K 4.5362 7.7540 114.6898 56.9023 39.2632 179.0140 50 G 4.1409 8.9134 107.3456 44.8442 0.0000 174.9260 51 V 4.4663 8.9040 119.8078 61.2942 34.3004 174.6266 52 E 4.5626 8.8045 128.3160 54.3553 32.7201 174.7604 53 K 4.0449 8.2926 122.1382 58.1270 32.3808 176.7313 54 Y 4.2843 8.1612 124.0368 59.4574 35.6566 171.2084 55 G 3.6201 8.0160 107.5252 47.3500 0.0000 174.0984 56 P 4.2874 0.0000 0.0000 65.0909 31.3127 178.5728 57 E 4.0157 8.2021 116.4931 59.4929 29.4899 179.1748 58 A 4.0393 8.4606 121.2071 55.0069 18.4151 179.6581 59 S 4.0343 8.5627 111.9854 61.5217 62.4940 176.2536 60 A 4.0347 8.4618 123.9361 55.0094 18.1266 179.3207 61 F 3.9153 8.4088 119.1213 61.7505 39.4133 177.4590 62 T 3.9464 8.0969 115.2927 66.4925 68.2011 176.3707 63 K 3.8677 8.0891 121.3753 59.7077 32.2883 178.9470 64 K 3.9110 8.3997 119.0193 59.5551 31.6676 179.1328 65 M 3.8799 7.6979 117.7303 58.5776 32.3325 178.3291 66 V 3.8370 8.0489 112.6652 64.0260 31.6424 178.4389 67 E 4.0547 8.3918 118.0352 58.6550 29.3208 177.9835 68 N 4.7076 7.7048 113.7217 52.1278 39.2024 175.0641 69 A 4.5348 6.9614 123.7673 51.5698 19.5762 178.3587 70 K 4.1836 9.0735 120.2822 58.4865 32.6376 178.2838 71 K 4.6552 8.7560 118.1452 54.5787 35.9668 175.5993 72 I 4.9662 8.4210 125.1709 59.6684 39.8714 174.4794 73 E 5.2030 9.2572 124.9190 54.6679 33.8304 175.1229 74 V 4.6816 8.8726 115.1863 59.5351 35.4471 174.7537 75 E 5.0025 8.8973 123.9506 54.4426 32.1774 174.9884 76 F 4.6103 8.8681 125.8425 57.6183 40.0926 175.8403 77 D 4.9594 8.4873 120.7618 53.5483 43.2179 175.7393 78 K 4.3391 8.9964 117.0670 57.6896 33.0470 177.9644 79 G 4.2211 8.2737 111.0233 44.3326 0.0000 173.4123 80 Q 4.0936 8.6275 120.0810 56.7713 29.2701 176.4350 81 R 4.7799 8.4716 117.8204 56.4052 31.5064 175.5260 82 T 5.2161 7.6707 108.6275 60.0366 72.4037 173.4618 83 D 4.9660 8.6385 123.4663 51.8793 42.2570 176.8221 84 K 4.0208 8.6998 116.3145 59.0164 32.6518 176.8541 85 Y 4.3589 8.4828 117.1447 57.7388 37.8897 176.6291 86 G 3.9482 8.3537 108.3955 45.1962 0.0000 174.1369 87 R 4.2837 7.9588 119.5267 55.2346 31.6863 176.3530 88 G 3.5221 8.4207 111.2640 46.3447 0.0000 172.3745 89 L 5.3372 8.8208 123.8487 53.1988 43.2411 175.6096 90 A 4.3937 8.4547 124.1585 51.1134 23.5988 173.9932 91 Y 4.8018 8.8022 117.4998 57.1626 39.7863 175.2348 92 I 4.8071 8.7118 124.5321 59.6198 40.5153 174.0308 93 Y 5.0415 9.0645 123.9087 56.1109 40.8701 174.4043 94 A 4.8278 9.1185 126.9428 50.3172 21.0423 176.6316 95 D 4.4011 9.8801 125.4190 55.7386 39.1263 175.2729 96 G 4.0328 8.5829 106.6779 44.9128 0.0000 173.5959 97 K 4.5489 7.9391 119.9481 54.7642 33.8915 175.2249 98 M 3.9598 8.4275 123.1832 54.8135 33.1937 177.0496 99 V 3.6049 8.7154 127.1572 66.2788 31.5687 177.7969 100 N 4.3746 7.9673 115.7641 56.1807 38.4218 176.8963 101 E 3.9050 8.0541 120.1212 59.0298 29.9025 178.2227 102 A 4.0666 8.1916 121.0314 55.4781 18.3549 179.6395 103 L 3.5170 7.9940 117.2193 57.7914 41.6716 180.0193 104 V 3.7232 7.5196 118.2069 65.9431 31.2777 178.1207 105 R 3.9517 8.2648 117.9293 59.0096 29.9431 177.5016 106 Q 4.3455 7.6885 115.4618 55.0064 29.0410 176.0454 107 G 3.9078 7.9991 108.5169 46.6451 0.0000 174.7808 108 L 4.3856 7.7319 116.4973 53.7830 42.3630 175.9193 109 A 4.6183 7.4495 118.8305 51.1072 22.1218 176.0241 110 K 4.9018 8.8618 118.6832 54.2420 35.9457 176.0844 111 V 4.1926 8.9141 123.3877 62.9499 31.9375 176.1387 112 A 4.6691 8.5933 130.6668 50.6281 19.8075 176.0745 113 Y 3.8402 8.4201 119.7378 57.6840 39.3147 175.1170 114 V 3.8678 7.1555 126.2736 61.4542 32.9974 174.5532 115 Y 4.8834 8.0609 124.2052 55.9407 38.9716 175.4519 116 K 4.4227 8.7157 125.1314 56.0627 32.7496 175.2491 117 P 4.8644 0.0000 0.0000 62.9928 31.9965 176.5711 118 N 4.9506 8.1903 118.5041 52.4604 37.0799 175.2970 119 N 5.1493 7.6813 114.6800 52.7264 38.6597 177.7689 120 T 3.8439 8.5691 118.3911 67.7537 68.7810 175.0709 121 H 4.8575 7.8494 116.8867 55.7352 29.3014 176.6251 122 E 3.9291 8.2417 122.2228 59.5878 29.2570 178.1969 123 Q 3.8911 8.1408 118.8439 59.7472 28.7465 177.6253 124 H 4.0451 8.3509 118.3467 59.6875 29.6730 176.8710 125 L 3.9984 7.9846 120.3368 57.7534 41.5021 179.6511 126 R 3.9107 8.5255 118.4944 59.0862 29.9372 179.2576 127 K 3.9493 8.3704 118.5053 59.2793 31.8995 179.2681 128 A 3.9699 7.5863 120.9992 54.9708 18.1831 179.3320 129 E 3.8771 8.3421 117.9234 59.0772 29.6227 178.9231 130 A 3.7063 7.8418 120.9713 54.9988 18.3894 179.2244 131 Q 3.7945 7.7615 117.3917 59.4827 29.0832 178.6141 132 A 4.0006 8.2349 121.8263 54.8658 18.2513 179.9029 133 K 3.3067 7.7678 117.3506 59.4162 31.8328 179.5978 134 K 3.8287 7.9364 117.7617 59.2610 32.0500 178.2912 135 E 4.2536 8.3295 116.0566 55.2628 30.2369 176.2032 136 K 4.1772 7.8259 117.3407 56.0375 30.5314 175.3009 137 L 4.4077 7.8533 117.5147 55.3706 44.1284 177.4267 138 N 3.8092 8.8693 120.0942 53.9219 38.0065 176.6451 139 I 3.0200 5.6443 126.9139 64.6253 36.8148 176.3286 140 W 4.8774 8.1025 118.3681 56.2725 29.1905 176.5325 141 S 4.4819 9.0190 120.5517 58.4124 62.5675 173.8640 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 7 L 8.17 4.50 0.00 1.75 1.81 1.01 0.86 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 8 H 8.52 4.86 0.00 3.30 3.23 0.00 5.53 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.23 4.58 0.00 1.54 1.63 0.00 1.40 0.00 0.00 1.40 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 1.24 7.81 10 E 9.08 4.95 0.00 2.13 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 2.29 2.10 0.00 11 P 0.00 4.98 0.00 2.09 2.05 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 12 A 8.51 4.94 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 13 T 8.48 4.63 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 1.23 0.00 0.00 14 L 8.79 4.15 0.00 1.63 1.59 0.92 1.02 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 15 I 8.61 4.39 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.88 0.94 0.00 0.00 16 K 7.59 4.55 0.00 1.81 1.62 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.44 7.81 17 A 8.73 4.55 1.26 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 0.00 0.00 18 I 8.02 4.29 2.01 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 1.19 0.72 0.91 0.00 0.00 19 D 7.47 4.42 0.00 2.68 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 0.00 0.00 0.00 0.00 20 G 8.96 3.71 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 0.00 21 D 8.06 4.90 0.00 2.84 2.87 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 22 T 7.84 5.19 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 23 V 8.76 4.73 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 0.72 0.00 0.00 0.96 0.00 0.00 24 K 9.22 4.99 0.00 1.83 1.82 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.46 7.81 25 L 9.30 5.30 0.00 1.77 1.55 0.45 0.52 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 26 M 9.34 4.84 0.00 2.15 2.00 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 2.61 2.56 0.00 27 Y 9.13 4.97 0.00 3.25 3.03 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 28 K 9.24 3.68 0.00 1.63 1.61 0.00 1.76 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.72 0.21 7.81 29 G 8.10 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.85 4.71 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 31 P 0.00 4.96 0.00 2.16 2.09 0.00 3.83 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 32 M 9.23 4.84 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.25 0.00 33 T 8.49 4.69 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 1.21 0.00 0.00 34 F 9.38 4.97 0.00 3.05 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 35 R 9.02 4.95 0.00 1.89 1.80 0.00 3.35 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 36 L 8.71 4.63 0.00 1.56 1.60 1.00 1.06 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 37 L 8.56 3.86 0.00 1.27 1.19 0.34 0.40 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 38 L 8.81 3.79 0.00 2.01 1.87 1.13 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.33 4.99 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 0.81 0.00 0.00 0.94 0.00 0.00 40 D 9.18 5.05 0.00 2.55 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.33 4.58 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 1.19 0.00 0.00 42 P 0.00 4.38 0.00 2.32 2.09 0.00 3.56 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.09 0.00 43 E 10.09 4.74 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.37 0.00 44 T 8.61 4.29 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 45 K 7.81 4.35 0.00 1.72 1.80 0.00 1.89 0.00 0.00 1.61 0.00 0.00 3.20 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.46 7.81 46 H 8.56 4.09 0.00 3.32 3.20 0.00 5.85 0.00 0.00 0.00 0.00 6.57 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 4.64 0.00 2.20 2.23 0.00 3.28 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 1.88 1.89 0.00 48 K 7.74 4.37 0.00 1.74 1.85 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.15 1.35 7.81 49 K 7.75 4.54 0.00 1.73 1.76 0.00 1.95 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.37 7.81 50 G 8.91 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 0.00 0.00 0.00 51 V 8.90 4.47 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 0.83 0.00 0.00 0.93 0.00 0.00 52 E 8.80 4.56 0.00 1.94 1.86 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 2.24 2.44 0.00 53 K 8.29 4.04 0.00 1.63 1.68 0.00 1.42 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.29 0.79 7.81 54 Y 8.16 4.28 0.00 3.17 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 55 G 8.02 3.62 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 0.00 0.00 0.00 56 P 0.00 4.29 0.00 2.16 2.12 0.00 3.58 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 57 E 8.20 4.02 0.00 2.37 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 2.53 2.51 0.00 58 A 8.46 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.56 4.03 0.00 3.97 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 60 A 8.46 4.03 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 61 F 8.41 3.92 0.00 3.30 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 62 T 8.10 3.95 4.44 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 1.24 0.00 0.00 63 K 8.09 3.87 0.00 1.85 2.04 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.61 7.81 64 K 8.40 3.91 0.00 1.80 1.72 0.00 1.89 0.00 0.00 1.56 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.45 7.81 65 M 7.70 3.88 0.00 2.02 1.74 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 66 V 8.05 3.84 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 0.98 0.00 0.00 1.02 0.00 0.00 67 E 8.39 4.05 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 68 N 7.70 4.71 0.00 2.79 2.80 0.00 0.00 6.98 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 6.96 4.53 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 70 K 9.07 4.18 0.00 1.88 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.40 7.81 71 K 8.76 4.66 0.00 1.64 1.65 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.42 4.97 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.79 0.86 0.00 0.00 73 E 9.26 5.20 0.00 1.85 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 74 V 8.87 4.68 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 0.02 0.00 0.00 0.63 0.00 0.00 75 E 8.90 5.00 0.00 2.14 2.31 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 2.53 2.41 0.00 76 F 8.87 4.61 0.00 3.05 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.49 4.96 0.00 2.69 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 9.00 4.34 0.00 1.79 1.89 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.45 7.81 79 G 8.27 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 0.00 0.00 0.00 0.00 80 Q 8.63 4.09 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 81 R 8.47 4.78 0.00 1.47 1.49 0.00 2.21 0.00 0.00 2.91 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.42 0.00 82 T 7.67 5.22 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 1.15 0.00 0.00 83 D 8.64 4.97 0.00 2.87 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 84 K 8.70 4.02 0.00 1.61 1.80 0.00 1.03 0.00 0.00 1.43 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.18 0.53 7.81 85 Y 8.48 4.36 0.00 3.04 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.35 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 87 R 7.96 4.28 0.00 2.08 1.81 0.00 3.12 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 88 G 8.42 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.82 5.34 0.00 1.58 1.63 0.97 0.61 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 90 A 8.45 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.80 4.80 0.00 3.01 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 92 I 8.71 4.81 1.77 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.51 0.82 0.00 0.00 93 Y 9.06 5.04 0.00 2.80 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 94 A 9.12 4.83 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 9.88 4.40 0.00 2.76 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 96 G 8.58 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 97 K 7.94 4.55 0.00 1.84 1.76 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.54 1.49 7.81 98 M 8.43 3.96 0.00 1.88 1.47 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.49 0.00 99 V 8.72 3.60 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.94 0.00 0.00 100 N 7.97 4.37 0.00 2.90 2.90 0.00 0.00 6.78 7.66 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 0.00 101 E 8.05 3.90 0.00 2.01 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 2.34 2.29 0.00 102 A 8.19 4.07 1.59 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 0.00 103 L 7.99 3.52 0.00 1.81 1.61 0.98 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.52 3.72 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 1.09 0.00 0.00 0.96 0.00 0.00 105 R 8.26 3.95 0.00 1.75 2.07 0.00 3.33 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 106 Q 7.69 4.35 0.00 1.80 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.31 0.00 0.00 0.00 0.00 0.00 2.36 1.98 0.00 107 G 8.00 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 0.00 108 L 7.73 4.39 0.00 1.30 1.47 0.51 0.85 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 0.00 109 A 7.45 4.62 1.15 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 0.00 0.00 110 K 8.86 4.90 0.00 1.65 1.76 0.00 1.89 0.00 0.00 1.48 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.94 1.19 7.81 111 V 8.91 4.19 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 0.75 0.00 0.00 0.95 0.00 0.00 112 A 8.59 4.67 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 0.00 113 Y 8.42 3.84 0.00 2.83 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 0.00 114 V 7.16 3.87 1.80 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 0.82 0.00 0.00 0.93 0.00 0.00 115 Y 8.06 4.88 0.00 3.14 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.72 4.42 0.00 1.80 1.79 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.45 7.81 117 P 0.00 4.86 0.00 2.21 2.15 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.00 0.00 118 N 8.19 4.95 0.00 2.94 2.88 0.00 0.00 6.62 8.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 N 7.68 5.15 0.00 2.83 2.97 0.00 0.00 6.10 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 0.00 120 T 8.57 3.84 4.16 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 1.10 0.00 0.00 121 H 7.85 4.86 0.00 2.85 3.11 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.24 3.93 0.00 2.17 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 123 Q 8.14 3.89 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.59 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 124 H 8.35 4.05 0.00 3.25 3.46 0.00 5.92 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 0.00 125 L 7.98 4.00 0.00 1.92 1.70 1.02 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.53 3.91 0.00 1.98 1.94 0.00 3.10 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 127 K 8.37 3.95 0.00 1.87 1.80 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.42 7.81 128 A 7.59 3.97 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.34 3.88 0.00 2.16 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 2.54 0.00 130 A 7.84 3.71 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 0.00 131 Q 7.76 3.79 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 132 A 8.23 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.77 3.31 0.00 1.48 1.29 0.00 0.91 0.00 0.00 0.61 0.00 0.00 2.54 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.30 0.22 7.81 134 K 7.94 3.83 0.00 1.82 1.83 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.41 1.46 7.81 135 E 8.33 4.25 0.00 1.91 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 2.30 2.49 0.00 136 K 7.83 4.18 0.00 1.88 1.90 0.00 1.66 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.55 7.81 137 L 7.85 4.41 0.00 1.73 1.64 0.92 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 138 N 8.87 3.81 0.00 2.55 1.42 0.00 0.00 7.11 7.32 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 0.00 139 I 5.64 3.02 1.31 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 0.88 -0.10 -0.83 0.00 0.00 140 W 8.10 4.88 0.00 3.36 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 0.00 141 S 9.02 4.48 0.00 3.82 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