NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.6482 8.4293 116.2034 55.1674 30.2985 173.2587 2 C 4.1131 7.6500 114.0327 56.9341 30.1620 172.0818 3 D 4.5609 8.3221 118.6100 55.1918 40.1006 175.5710 4 L 4.0677 8.0567 120.5653 56.9155 42.2740 175.6678 5 P 4.5701 0.0000 0.0000 62.2046 32.3888 175.3335 6 C 4.2610 8.4190 113.3130 57.8508 30.5916 174.9640 7 G 3.8914 8.2318 107.6031 45.4404 0.0000 172.8995 8 V 4.2902 7.1935 118.9648 60.9989 32.7629 174.3804 9 Y 4.6522 8.1369 123.7056 56.5426 41.9680 174.7896 10 D 3.8272 7.8640 120.3678 51.7653 43.4353 174.3645 11 P 4.1446 0.0000 0.0000 64.3561 31.1994 178.0697 12 A 4.0377 8.5085 120.7815 55.0212 18.0391 179.6523 13 Q 3.7787 7.9113 116.5416 59.0776 28.7294 178.9140 14 A 4.0436 7.7578 121.2207 55.0201 18.4376 179.4039 15 R 3.8373 8.0720 117.2379 59.7586 30.2092 178.7805 16 I 3.7115 8.1225 119.9291 64.4976 37.0620 178.3634 17 E 4.0041 8.0538 119.2873 59.3247 29.3612 179.2446 18 A 4.0678 8.2632 120.9172 55.1502 18.3598 179.5704 19 E 3.9870 8.5156 117.6314 59.5661 29.3943 179.7304 20 S 4.1298 7.8955 114.9891 61.3203 62.8642 176.6706 21 V 3.5661 7.7028 121.0420 66.0722 31.3114 178.0905 22 K 4.1485 8.0484 118.8946 59.4240 32.0769 178.5486 23 A 4.2125 8.2329 121.2121 55.3079 18.2340 179.7409 24 I 3.7431 8.1883 118.7033 64.6077 37.0429 178.6481 25 Q 4.0266 8.1089 118.9483 59.0222 28.3612 178.7939 26 E 4.0249 8.3587 119.6593 59.3630 29.5436 179.5612 27 K 4.1300 8.1087 118.5046 59.6478 31.8948 179.3454 28 M 4.4399 8.2772 118.1118 58.0063 31.9102 178.0305 29 A 4.2415 7.7566 119.4158 53.4340 18.8548 177.6703 30 A 4.4309 7.5676 118.3273 51.8901 19.7444 176.5996 31 N 4.6281 7.8039 115.2551 52.7583 40.4176 173.1045 32 D 4.8028 8.6318 124.8452 53.1279 40.1220 176.5979 33 D 4.4107 8.7016 120.8982 54.6324 42.4948 176.2432 34 L 3.9354 8.7091 128.4894 59.0636 42.1729 179.0803 35 H 4.1872 8.3309 115.2757 58.6109 28.6486 177.5338 36 F 4.2383 8.7054 122.7524 61.3692 39.2532 177.2098 37 Q 3.9002 8.4558 117.9306 58.8697 28.4144 179.0137 38 I 3.6180 7.8164 120.7021 64.4763 37.1277 178.6697 39 R 3.8220 7.9372 118.5806 59.2233 29.7967 179.0037 40 A 3.7239 7.9281 120.8601 55.2777 18.2274 179.9104 41 T 3.7284 7.7498 114.2438 66.6066 68.4995 177.0802 42 V 3.5265 7.8129 120.1995 66.2329 31.5286 178.2242 43 I 3.9894 7.8768 121.0240 63.6460 36.8595 178.3124 44 K 3.8870 8.2985 120.8762 59.3500 31.9802 178.4206 45 E 3.8930 8.1568 119.6498 59.3732 29.6456 178.9126 46 Q 3.9628 7.7870 117.6130 59.1612 28.8045 179.0278 47 R 4.0589 8.2485 118.9590 59.0378 30.0898 178.9759 48 A 4.0084 8.2790 120.9565 54.9783 18.3370 179.3064 49 E 3.8881 8.1657 117.9036 59.4270 29.7125 179.0749 50 L 3.9427 7.9773 118.8710 57.6392 41.6402 179.3082 51 A 4.0694 8.1981 120.7857 55.1404 18.2480 179.8494 52 K 3.9078 8.1786 116.9794 59.7153 32.0991 178.9445 53 H 4.1090 8.3137 118.4744 59.7463 29.9198 176.9163 54 H 4.1947 8.2161 117.8415 58.9908 28.5332 177.8627 55 L 4.0923 8.0216 120.7331 57.8782 41.4029 179.2123 56 D 4.5298 8.5373 119.3303 57.3739 40.6537 179.0826 57 V 3.7072 8.0338 118.8033 65.9477 31.4758 178.0852 58 L 3.8404 7.9099 118.3762 57.4476 41.2477 179.3041 59 W 4.5852 8.3733 127.2457 60.7841 30.8415 177.8121 60 S 4.0520 8.7584 113.0957 60.4823 62.8243 175.1826 61 D 4.6887 8.2672 121.1109 55.9932 41.7109 177.4042 62 Y 3.5555 7.4127 118.2215 60.0650 39.0331 175.5963 63 F 4.0621 7.7245 118.0833 57.2557 39.5290 174.8825 64 K 4.6938 8.1256 123.0319 53.1868 35.8030 175.1678 65 P 4.4329 0.0000 0.0000 65.9585 31.0162 176.9543 66 P 4.2232 0.0000 0.0000 65.9748 31.0447 178.4370 67 H 4.3300 8.0327 114.9375 58.9717 28.4395 177.9275 68 F 4.2539 7.7380 117.6926 60.1936 38.7996 177.2299 69 E 4.2005 8.3174 118.3565 59.5256 29.4613 179.0695 70 S 4.3334 8.2339 114.1216 59.8509 64.1879 174.1152 71 Y 4.4892 8.1476 120.6230 54.4931 37.4740 174.1298 72 P 4.4401 0.0000 0.0000 64.9890 31.7248 177.8289 73 E 4.5672 8.0977 117.0438 56.1647 30.2027 177.2621 74 L 3.9385 8.3624 123.0722 58.5368 42.0712 178.5268 75 H 4.4617 8.4586 115.6454 59.5190 28.6315 177.7550 76 T 3.8483 7.9536 116.8486 66.3138 68.3337 176.2679 77 L 3.8234 8.1601 122.6192 58.3005 42.1274 179.3177 78 V 3.5627 8.0085 118.2675 65.9427 31.4628 177.4777 79 N 4.0524 8.0290 116.8775 56.6262 38.6687 176.7869 80 E 3.7521 8.3192 120.2004 58.8914 29.4151 179.1871 81 A 3.8797 7.5710 120.8932 55.3369 18.5022 180.2081 82 V 3.5957 7.8188 110.9821 64.3708 31.5669 179.0556 83 K 3.9835 8.0810 118.2121 59.1739 31.8387 179.2682 84 A 4.0855 8.1649 121.5281 55.0982 18.2737 179.7118 85 L 4.0254 7.8710 117.5636 57.9542 41.2276 179.8533 86 S 4.1263 8.0931 115.1086 61.4764 62.5038 176.5818 87 A 4.0108 7.9017 122.5230 55.0015 18.5148 179.2486 88 A 4.1705 7.9761 120.7511 54.5727 18.1697 179.9507 89 K 3.9353 7.8995 116.2543 59.3332 32.1656 178.3703 90 A 4.5087 7.3012 117.6585 51.1826 18.9226 176.6249 91 S 4.6418 7.3058 112.5680 57.8600 65.6347 173.9683 92 T 4.3698 8.3178 113.0404 61.2494 69.6084 173.7798 93 D 4.5182 8.2209 124.2067 53.2500 41.4265 174.9614 94 P 4.5918 0.0000 0.0000 64.8575 31.2376 178.3268 95 A 4.0247 8.7158 120.4103 55.1322 17.9098 179.7536 96 T 3.9926 8.3173 108.9939 64.8755 68.9240 177.2495 97 G 3.6672 8.1276 108.1938 47.5770 0.0000 175.3392 98 Q 3.9973 8.3351 122.0904 58.6047 28.8845 178.0912 99 K 3.7691 8.1385 120.6594 59.3416 32.1485 178.6088 100 A 4.1734 7.8621 120.7892 55.3404 18.3273 179.5766 101 L 3.9649 7.9284 117.4624 58.0182 41.6717 179.4976 102 D 4.3018 8.3630 119.1841 57.5923 40.7247 178.5596 103 Y 4.3688 7.6338 117.1087 61.2084 37.8357 178.3356 104 I 3.7953 8.2064 120.7018 64.3717 37.2198 178.2601 105 A 4.0500 8.2919 121.6906 55.3475 18.2037 179.7785 106 Q 4.0319 7.8716 115.1546 59.1551 28.7887 178.9140 107 I 3.7971 7.9574 120.9600 64.3013 37.1389 177.9496 108 D 4.3846 8.5152 119.2222 57.3539 41.1153 178.5101 109 K 4.2023 8.1622 118.8537 59.5980 32.1020 179.4392 110 I 3.4940 7.9054 120.0469 64.1154 36.9919 177.9434 111 F 4.0289 8.6246 121.9173 61.4739 38.9196 177.4361 112 W 4.1553 7.9644 116.5577 59.4905 29.1550 178.1889 113 E 4.2338 8.2012 119.2808 59.5449 28.7213 179.3067 114 T 4.0714 7.7563 108.6065 64.3182 68.9520 176.5921 115 K 4.0146 7.3967 120.1608 58.0882 33.1495 178.1528 116 K 4.4154 7.7963 120.3347 53.5968 29.4089 176.5500 117 A 4.1206 7.6464 125.5318 52.9797 19.0754 176.9186 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 H 8.43 4.65 0.00 3.27 3.35 0.00 5.48 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.65 4.11 0.00 3.10 2.91 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 3 D 8.32 4.56 0.00 2.87 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 4 L 8.06 4.07 0.00 1.59 1.73 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.57 0.00 2.28 2.09 0.00 3.81 0.00 0.00 3.73 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 6 C 8.42 4.26 0.00 3.00 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 7 G 8.23 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 0.00 0.00 0.00 8 V 7.19 4.29 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 0.87 0.00 0.00 0.91 0.00 0.00 9 Y 8.14 4.65 0.00 2.74 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 0.00 0.00 0.00 0.00 10 D 7.86 3.83 0.00 2.62 2.39 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 11 P 0.00 4.14 0.00 2.30 1.90 0.00 3.21 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.10 0.00 12 A 8.51 4.04 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.91 3.78 0.00 1.80 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 14 A 7.76 4.04 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 15 R 8.07 3.84 0.00 1.92 2.09 0.00 3.21 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 16 I 8.12 3.71 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 1.52 1.01 0.91 0.00 0.00 17 E 8.05 4.00 0.00 1.99 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 0.00 2.56 2.56 0.00 18 A 8.26 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 19 E 8.52 3.99 0.00 2.19 2.02 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 2.34 2.61 0.00 20 S 7.90 4.13 0.00 4.08 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 21 V 7.70 3.57 2.28 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 1.00 0.00 0.00 0.96 0.00 0.00 22 K 8.05 4.15 0.00 1.91 1.80 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.19 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.62 7.81 23 A 8.23 4.21 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 24 I 8.19 3.74 2.02 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 1.53 0.74 0.88 0.00 0.00 25 Q 8.11 4.03 0.00 2.29 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 26 E 8.36 4.02 0.00 2.21 2.02 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 2.34 2.57 0.00 27 K 8.11 4.13 0.00 2.19 2.17 0.00 1.80 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.76 7.81 28 M 8.28 4.44 0.00 2.03 2.32 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.43 0.00 29 A 7.76 4.24 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 30 A 7.57 4.43 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 31 N 7.80 4.63 0.00 2.32 2.33 0.00 0.00 7.03 8.47 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 32 D 8.63 4.80 0.00 2.83 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 33 D 8.70 4.41 0.00 2.85 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 34 L 8.71 3.94 0.00 1.79 1.66 0.89 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 35 H 8.33 4.19 0.00 3.48 3.40 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.71 4.24 0.00 3.16 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 37 Q 8.46 3.90 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.68 2.59 0.00 38 I 7.82 3.62 1.97 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.74 0.88 0.00 0.00 39 R 7.94 3.82 0.00 1.85 1.91 0.00 3.17 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 1.64 1.87 0.00 40 A 7.93 3.72 0.79 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 41 T 7.75 3.73 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 1.17 0.00 0.00 42 V 7.81 3.53 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 1.01 0.00 0.00 0.97 0.00 0.00 43 I 7.88 3.99 1.87 0.00 0.00 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 1.36 0.91 0.89 0.00 0.00 44 K 8.30 3.89 0.00 1.81 1.97 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.16 3.89 0.00 2.30 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 0.00 2.29 2.38 0.00 46 Q 7.79 3.96 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.61 0.00 47 R 8.25 4.06 0.00 1.82 2.10 0.00 3.29 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.79 0.00 48 A 8.28 4.01 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 49 E 8.17 3.89 0.00 2.20 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 0.00 2.29 2.38 0.00 50 L 7.98 3.94 0.00 1.93 1.69 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.20 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 3.91 0.00 1.99 1.86 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.67 7.81 53 H 8.31 4.11 0.00 3.22 3.42 0.00 5.79 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 54 H 8.22 4.19 0.00 3.37 3.28 0.00 5.67 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 55 L 8.02 4.09 0.00 1.87 1.76 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.54 4.53 0.00 2.88 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 57 V 8.03 3.71 2.29 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 1.35 0.00 0.00 0.86 0.00 0.00 58 L 7.91 3.84 0.00 2.05 1.61 0.75 0.03 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 59 W 8.37 4.59 0.00 3.51 3.60 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 60 S 8.76 4.05 0.00 4.09 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 0.00 61 D 8.27 4.69 0.00 3.00 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 Y 7.41 3.56 0.00 1.43 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 0.00 0.00 0.00 63 F 7.72 4.06 0.00 2.87 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 64 K 8.13 4.69 0.00 1.50 1.57 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.38 7.81 65 P 0.00 4.43 0.00 2.15 2.17 0.00 3.58 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.25 0.00 66 P 0.00 4.22 0.00 1.96 2.05 0.00 3.37 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 67 H 8.03 4.33 0.00 2.89 3.07 0.00 5.64 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 68 F 7.74 4.25 0.00 3.15 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 69 E 8.32 4.20 0.00 2.11 2.02 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 2.38 2.62 0.00 70 S 8.23 4.33 0.00 3.90 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 0.00 71 Y 8.15 4.49 0.00 3.05 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 72 P 0.00 4.44 0.00 2.20 2.23 0.00 3.75 0.00 0.00 3.63 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 73 E 8.10 4.57 0.00 2.08 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 2.37 2.26 0.00 74 L 8.36 3.94 0.00 1.81 1.81 0.52 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.46 4.46 0.00 3.28 3.36 0.00 5.68 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 76 T 7.95 3.85 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 1.19 0.00 0.00 77 L 8.16 3.82 0.00 1.88 1.87 1.09 0.96 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 78 V 8.01 3.56 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 0.95 0.00 0.00 1.19 0.00 0.00 79 N 8.03 4.05 0.00 2.74 2.65 0.00 0.00 7.23 7.80 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 80 E 8.32 3.75 0.00 1.44 1.12 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 2.15 2.30 0.00 81 A 7.57 3.88 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 82 V 7.82 3.60 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 0.74 0.00 0.00 0.83 0.00 0.00 83 K 8.08 3.98 0.00 1.92 1.80 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.46 7.81 84 A 8.16 4.09 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 85 L 7.87 4.03 0.00 1.90 1.73 0.96 0.96 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 86 S 8.09 4.13 0.00 4.04 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 87 A 7.90 4.01 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 88 A 7.98 4.17 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 89 K 7.90 3.94 0.00 1.95 2.03 0.00 1.69 0.00 0.00 1.93 0.00 0.00 3.21 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.66 7.81 90 A 7.30 4.51 1.28 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 0.00 0.00 91 S 7.31 4.64 0.00 3.82 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 92 T 8.32 4.37 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 1.21 0.00 0.00 93 D 8.22 4.52 0.00 2.71 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 94 P 0.00 4.59 0.00 2.20 2.11 0.00 3.94 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.93 0.00 95 A 8.72 4.02 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 96 T 8.32 3.99 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 1.22 0.00 0.00 97 G 8.13 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 0.00 0.00 0.00 0.00 98 Q 8.34 4.00 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 99 K 8.14 3.77 0.00 1.96 1.99 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.29 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.56 1.38 7.81 100 A 7.86 4.17 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 0.00 101 L 7.93 3.96 0.00 1.89 1.74 0.93 1.09 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 0.00 102 D 8.36 4.30 0.00 2.52 2.48 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 0.00 103 Y 7.63 4.37 0.00 3.15 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 0.00 104 I 8.21 3.80 2.05 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 1.51 0.95 0.95 0.00 0.00 105 A 8.29 4.05 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 0.00 106 Q 7.87 4.03 0.00 2.47 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 107 I 7.96 3.80 2.10 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.84 1.08 0.00 0.00 108 D 8.52 4.38 0.00 2.84 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 0.00 109 K 8.16 4.20 0.00 2.07 1.94 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.70 7.81 110 I 7.91 3.49 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.04 0.06 0.00 0.00 111 F 8.62 4.03 0.00 2.99 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 0.00 112 W 7.96 4.16 0.00 3.40 3.23 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 0.00 113 E 8.20 4.23 0.00 2.26 2.15 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 2.44 2.63 0.00 114 T 7.76 4.07 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 1.22 0.00 0.00 115 K 7.40 4.01 0.00 1.98 1.96 0.00 1.17 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.44 0.49 7.81 116 K 7.80 4.42 0.00 1.96 1.82 0.00 1.94 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.69 7.81 117 A 7.65 4.12 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