NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 H 4.7060 8.4293 120.3864 55.9663 30.7086 172.2595 13 Q 4.1572 8.0353 124.7091 53.2065 30.7293 173.8855 14 A 4.2694 8.5335 125.6211 51.3915 20.1399 177.8479 15 I 3.7202 7.9325 119.9797 61.2468 38.6644 176.7309 16 S 4.4369 8.3763 121.4989 57.3893 65.2349 173.3680 17 P 4.2156 0.0000 0.0000 66.3262 31.0557 179.1898 18 R 3.9675 7.9166 116.1107 59.3855 30.0994 178.9733 19 T 3.9005 7.6397 114.7701 66.5992 68.3410 176.7095 20 L 4.1372 8.2303 121.1417 57.6670 41.6138 178.9192 21 N 4.2742 8.5671 117.1503 56.8387 38.8487 176.7389 22 A 4.0280 8.0443 122.0414 54.9440 18.4014 179.4204 23 W 4.3683 8.5165 126.9824 60.5247 30.6889 178.3551 24 V 3.2869 8.2408 118.6428 65.9331 30.9042 178.0983 25 K 3.8379 8.1342 118.1759 59.3660 31.9613 179.4912 26 V 3.5650 7.7864 118.5317 66.0871 31.2916 178.3905 27 V 3.0402 7.0711 116.6013 65.4635 31.2327 177.1830 28 E 3.8770 7.9207 118.7435 58.6652 29.8093 177.6936 29 E 4.2646 7.5902 117.1103 57.8947 30.2568 177.2573 30 K 4.2914 7.5375 116.1856 56.0213 32.8062 177.4039 31 A 3.4471 7.3756 120.7205 53.5186 17.1368 180.7901 32 F 4.8692 8.4662 106.1221 57.1144 39.2968 174.5195 33 S 4.7224 8.2407 118.1249 56.3340 65.2633 174.2939 34 P 4.3253 0.0000 0.0000 66.1419 30.4370 178.4795 35 E 4.1874 7.8350 116.7821 58.7459 29.2020 179.4833 36 V 3.8782 7.9864 112.9107 63.9068 31.4439 178.6000 37 I 3.8721 7.8703 120.0608 64.1303 37.1007 176.6386 38 P 4.3093 0.0000 0.0000 65.7579 31.1712 178.6615 39 M 4.1586 7.9732 117.1136 58.2823 31.9883 178.5172 40 F 3.8930 8.8025 121.1646 61.4390 39.3668 177.3357 41 S 3.8908 8.2543 113.4779 61.4669 62.4371 176.2958 42 A 4.2160 8.0607 123.4696 55.0831 17.9258 179.5195 43 L 4.0996 7.7904 116.3055 56.4528 41.9677 178.5114 44 S 4.4605 7.0519 113.5445 56.8003 63.2990 173.3631 45 E 4.0390 7.1120 121.6982 58.1541 29.3220 177.2431 46 G 3.8085 8.8928 111.0145 45.8992 0.0000 173.3387 47 A 4.2205 7.6660 123.0081 51.9233 19.1121 178.3332 48 T 4.2981 8.4526 111.8427 60.2785 71.5106 174.2386 49 P 4.4647 0.0000 0.0000 66.2089 31.1955 178.4966 50 Q 4.0324 8.6135 118.0477 59.3209 28.8495 178.1694 51 D 4.7392 8.2357 121.2109 56.8419 40.8048 178.6788 52 L 3.9052 7.8368 119.2724 58.1162 41.6539 179.4967 53 N 4.4674 8.4517 116.4614 56.4345 38.5624 177.6270 54 T 3.9809 8.1949 111.5875 65.0311 68.5028 176.5957 55 M 4.1569 8.2960 121.7255 58.2302 32.0897 178.7578 56 L 4.3593 8.3409 119.3585 57.9901 41.5441 179.3542 57 N 4.4844 8.6221 116.0941 56.5643 38.4967 177.2729 58 T 4.2551 7.5966 115.1753 65.1004 68.5313 174.5981 59 V 3.6526 7.6004 120.7398 62.6550 31.3365 175.4399 60 G 4.0512 8.5230 116.6125 44.9552 0.0000 174.8169 61 G 3.6129 8.4883 108.3039 45.6373 0.0000 173.9449 62 H 4.0636 8.6752 112.2084 55.9304 27.0656 176.5331 63 Q 3.9672 8.4250 120.6267 59.6488 28.7739 177.2680 64 A 4.0500 8.0744 120.7912 55.0030 18.5225 179.3378 65 A 3.9203 7.9831 118.8499 55.6247 18.5461 179.4816 66 M 4.0243 8.3097 117.4362 58.7140 31.9699 178.8578 67 Q 3.9979 8.1851 119.6298 59.3375 29.3120 178.0635 68 M 4.0406 8.0093 119.9096 58.2038 31.9103 178.5069 69 L 3.9220 7.9812 120.4238 58.0962 42.2486 179.0978 70 K 3.9970 8.1983 118.4603 59.5955 32.0027 179.1113 71 E 3.9771 8.3958 118.8361 59.6777 29.3267 179.5931 72 T 3.8323 7.8360 115.4506 66.6429 68.4620 176.6018 73 I 3.8058 7.9515 121.7829 64.6833 37.3077 178.2334 74 N 4.2811 8.5041 117.4601 56.3244 38.3520 177.3845 75 E 3.8825 8.1334 119.9211 59.5055 29.4746 179.3547 76 E 3.5360 8.2538 118.7396 58.7826 29.2333 179.3242 77 A 3.3696 7.5502 120.9330 54.8718 18.4753 179.6019 78 A 3.9534 7.7431 119.0549 54.9057 18.4565 179.5186 79 E 3.7813 8.0247 118.0561 59.1301 29.8687 178.4380 80 W 4.2670 8.2481 128.5925 60.9729 30.4763 177.3073 81 D 4.5008 8.2285 117.1688 57.7083 40.4120 178.7477 82 R 3.9670 7.8118 117.6957 59.1279 30.1774 177.8386 83 L 4.2002 7.4797 116.0048 55.0687 43.3045 176.7154 84 H 4.6342 7.2201 114.9285 52.7319 28.8810 171.3065 85 P 4.3254 0.0000 0.0000 62.0864 32.2854 177.5242 86 V 3.6191 8.2362 120.6482 62.6763 31.9597 175.8247 87 A 4.1822 8.4284 130.0258 51.8689 18.9843 176.8559 88 M 3.9442 8.6452 120.1574 56.1162 32.4267 177.2253 89 G 4.0295 8.3270 112.3152 43.3384 0.0000 171.1116 90 P 4.4930 0.0000 0.0000 61.7840 32.1525 176.0317 91 I 3.7621 8.1568 120.5459 60.6524 38.7989 175.6679 92 A 4.1723 8.4900 130.4112 51.3886 18.9676 175.2505 93 P 4.5169 0.0000 0.0000 63.7885 32.1421 176.8523 94 G 3.9028 8.8748 107.5481 46.0182 0.0000 172.6752 95 Q 4.7440 7.9158 117.1303 54.0253 32.6068 174.0083 96 M 4.7866 8.2575 117.9349 53.0839 34.7534 175.3798 97 R 4.1220 8.6751 120.4350 56.4321 29.9349 176.4099 98 E 4.1618 8.6753 120.1649 55.7052 30.1652 175.2375 99 P 3.9449 0.0000 0.0000 62.5368 32.1558 176.4520 100 R 4.8165 8.7442 119.8528 54.2718 33.7008 177.8260 101 G 3.7672 9.9077 106.5506 48.6122 0.0000 176.0733 102 S 4.1983 8.1957 117.1944 61.2376 62.6073 176.4307 103 D 4.4220 7.7739 121.1027 57.0299 40.6390 178.6582 104 I 3.2625 7.2723 119.1483 63.8736 37.0521 176.8743 105 A 2.5800 7.5727 120.6693 51.6512 18.6080 178.0670 106 G 4.1594 7.5662 104.4610 45.4694 0.0000 174.7296 107 T 4.2693 7.8542 110.6513 62.6393 69.4677 175.7116 108 T 4.6421 7.9117 109.4848 60.7233 69.8607 173.0524 109 S 4.8464 7.8524 116.1012 56.7104 66.2129 172.6156 110 T 4.9300 7.6930 111.1675 59.4953 72.3552 175.2273 111 L 3.8799 8.1113 121.6629 58.2964 42.2177 178.6028 112 Q 3.7508 7.8836 116.8836 58.6111 27.3613 177.7992 113 E 3.4231 7.3714 121.5497 59.2855 29.4456 178.8098 114 Q 4.4511 8.0481 116.8528 59.0535 28.6643 178.5467 115 I 3.9219 8.4370 121.5826 64.1290 37.1001 178.1724 116 G 3.8408 7.8526 106.4825 48.0646 0.0000 175.2530 117 W 4.5914 7.3565 121.7150 59.8335 28.9864 178.5542 118 M 3.7916 7.8940 116.4081 57.4088 31.2769 177.7804 119 T 4.4334 8.3019 109.2712 61.7907 69.4676 174.4431 120 H 4.3265 8.0256 119.2621 55.6969 29.6503 173.5951 121 N 4.8015 8.3397 117.3843 50.9908 39.1400 173.0651 122 P 4.5685 0.0000 0.0000 61.3346 32.4202 174.3216 123 P 4.8617 0.0000 0.0000 61.4008 32.5584 175.5710 124 I 4.3314 8.9123 121.8713 59.3211 37.8498 175.3537 125 P 4.5987 0.0000 0.0000 61.3464 29.4531 176.4158 126 V 3.3962 7.8828 120.4117 64.9640 31.7488 177.8289 127 G 3.7116 7.8548 106.2839 47.4233 0.0000 175.5059 128 E 3.8981 8.0076 120.8145 58.8388 29.4892 179.5164 129 I 3.4422 7.4519 119.9766 64.4091 37.1638 177.7803 130 Y 3.4320 7.4044 120.2755 60.2722 38.4521 177.7753 131 K 3.8343 8.1393 120.8053 59.7181 32.1994 178.9209 132 R 3.9849 7.8484 118.0243 59.0495 29.9445 179.0102 133 W 4.5020 7.9565 118.6987 59.9532 29.0801 178.6300 134 I 3.6413 7.9512 119.6984 64.4730 36.4431 178.5734 135 I 3.7490 8.1729 121.0247 64.3026 36.9479 178.5509 136 L 4.1218 8.1618 120.1056 57.6748 41.4676 179.7436 137 G 3.6052 8.3563 105.8716 47.7181 0.0000 175.7247 138 L 3.8932 8.4342 121.6925 57.6619 41.5512 179.2172 139 N 4.3510 8.3774 116.5091 56.2234 38.4836 177.2498 140 K 3.8914 7.9194 120.4364 59.5046 32.2409 178.9697 141 I 3.6857 7.6874 119.9302 64.4661 36.9742 178.5987 142 V 3.8620 8.1493 119.7494 66.0682 31.1292 178.2495 143 R 3.9479 8.1404 115.1603 59.1334 29.3194 178.4235 144 M 4.0034 7.7775 118.2286 58.8142 32.4202 177.3811 145 Y 4.2088 8.1360 115.0420 58.9555 38.4353 175.7887 146 S 4.3946 8.2949 118.8351 58.2999 63.2351 173.6532 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 H 8.43 4.71 0.00 3.13 3.28 0.00 5.64 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.04 4.16 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.89 0.00 0.00 0.00 0.00 0.00 2.13 2.32 0.00 14 A 8.53 4.27 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 15 I 7.93 3.72 1.83 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 1.33 0.80 0.90 0.00 0.00 16 S 8.38 4.44 0.00 4.18 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 17 P 0.00 4.22 0.00 2.18 2.18 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 18 R 7.92 3.97 0.00 1.82 1.98 0.00 3.29 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 19 T 7.64 3.90 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 1.16 0.00 0.00 20 L 8.23 4.14 0.00 1.90 1.81 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.57 4.27 0.00 2.79 3.04 0.00 0.00 7.11 8.02 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 22 A 8.04 4.03 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 23 W 8.52 4.37 0.00 3.34 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 24 V 8.24 3.29 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 0.96 0.00 0.00 25 K 8.13 3.84 0.00 1.94 1.81 0.00 1.70 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.69 1.59 7.81 26 V 7.79 3.57 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 0.95 0.00 0.00 1.10 0.00 0.00 27 V 7.07 3.04 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 0.25 0.00 0.00 -0.57 0.00 0.00 28 E 7.92 3.88 0.00 1.87 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 2.25 2.23 0.00 29 E 7.59 4.26 0.00 2.09 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 2.20 2.32 0.00 30 K 7.54 4.29 0.00 1.94 1.73 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.32 7.81 31 A 7.38 3.45 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 32 F 8.47 4.87 0.00 2.85 2.82 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 0.00 0.00 0.00 33 S 8.24 4.72 0.00 4.21 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 34 P 0.00 4.33 0.00 2.21 2.21 0.00 3.64 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 35 E 7.83 4.19 0.00 2.14 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 2.35 2.43 0.00 36 V 7.99 3.88 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 0.87 0.00 0.00 1.19 0.00 0.00 37 I 7.87 3.87 2.05 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 1.60 0.73 0.99 0.00 0.00 38 P 0.00 4.31 0.00 2.21 2.14 0.00 3.84 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 39 M 7.97 4.16 0.00 2.27 2.51 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.87 0.00 40 F 8.80 3.89 0.00 3.18 3.29 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 41 S 8.25 3.89 0.00 4.02 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 42 A 8.06 4.22 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 43 L 7.79 4.10 0.00 1.35 1.60 1.15 0.72 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 44 S 7.05 4.46 0.00 3.58 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 45 E 7.11 4.04 0.00 2.02 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 2.27 2.34 0.00 46 G 8.89 3.81 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 0.00 0.00 0.00 47 A 7.67 4.22 1.17 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 0.00 0.00 0.00 48 T 8.45 4.30 4.45 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 1.21 0.00 0.00 49 P 0.00 4.46 0.00 2.30 2.30 0.00 3.82 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 2.11 2.19 0.00 50 Q 8.61 4.03 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 51 D 8.24 4.74 0.00 2.93 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 52 L 7.84 3.91 0.00 1.94 1.50 0.88 0.58 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 53 N 8.45 4.47 0.00 2.98 2.96 0.00 0.00 6.83 6.34 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 54 T 8.19 3.98 4.28 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 1.35 0.00 0.00 55 M 8.30 4.16 0.00 1.52 2.15 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.36 0.00 56 L 8.34 4.36 0.00 1.78 1.84 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.62 4.48 0.00 2.93 2.95 0.00 0.00 7.07 7.39 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 58 T 7.60 4.26 4.76 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 1.49 0.00 0.00 59 V 7.60 3.65 2.32 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 0.78 0.00 0.00 1.00 0.00 0.00 60 G 8.52 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 0.00 0.00 0.00 61 G 8.49 3.61 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 0.00 0.00 0.00 62 H 8.68 4.06 0.00 3.38 3.50 0.00 5.65 0.00 0.00 0.00 0.00 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.42 3.97 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 64 A 8.07 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 65 A 7.98 3.92 1.11 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 0.00 0.00 66 M 8.31 4.02 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.94 0.00 67 Q 8.19 4.00 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 68 M 8.01 4.04 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.55 0.00 69 L 7.98 3.92 0.00 1.70 1.84 0.87 0.51 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 70 K 8.20 4.00 0.00 2.02 1.88 0.00 1.91 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.69 7.81 71 E 8.40 3.98 0.00 2.14 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 2.33 2.48 0.00 72 T 7.84 3.83 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 1.27 0.00 0.00 73 I 7.95 3.81 2.14 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.88 1.22 0.00 0.00 74 N 8.50 4.28 0.00 2.84 2.83 0.00 0.00 7.08 7.20 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 75 E 8.13 3.88 0.00 2.05 1.90 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 2.27 2.39 0.00 76 E 8.25 3.54 0.00 1.16 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 2.29 2.22 0.00 77 A 7.55 3.37 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 78 A 7.74 3.95 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 79 E 8.02 3.78 0.00 2.14 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 2.28 2.35 0.00 80 W 8.25 4.27 0.00 3.74 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 81 D 8.23 4.50 0.00 2.90 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 R 7.81 3.97 0.00 1.89 2.06 0.00 3.21 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 83 L 7.48 4.20 0.00 1.28 1.28 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 84 H 7.22 4.63 0.00 2.68 2.89 0.00 5.66 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.33 0.00 2.14 2.01 0.00 3.63 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 1.93 1.89 0.00 86 V 8.24 3.62 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 0.82 0.00 0.00 0.97 0.00 0.00 87 A 8.43 4.18 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 88 M 8.65 3.94 0.00 2.02 2.05 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 2.62 2.51 0.00 89 G 8.33 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 90 P 0.00 4.49 0.00 2.20 2.07 0.00 3.78 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 1.99 1.96 0.00 91 I 8.16 3.76 1.91 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 1.39 0.72 0.94 0.00 0.00 92 A 8.49 4.17 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 93 P 0.00 4.52 0.00 2.20 2.07 0.00 3.86 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 94 G 8.87 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 0.00 0.00 0.00 95 Q 7.92 4.74 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 96 M 8.26 4.79 0.00 2.13 1.85 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.19 0.00 97 R 8.68 4.12 0.00 2.09 2.07 0.00 3.24 0.00 0.00 3.35 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 98 E 8.68 4.16 0.00 2.02 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 2.37 2.28 0.00 99 P 0.00 3.94 0.00 1.33 0.49 0.00 3.55 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.11 0.00 100 R 8.74 4.82 0.00 1.90 1.96 0.00 3.38 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 101 G 9.91 3.77 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 0.00 0.00 0.00 102 S 8.20 4.20 0.00 3.89 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 0.00 103 D 7.77 4.42 0.00 2.65 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 7.27 3.26 1.56 0.00 0.00 -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 0.43 -0.14 -0.24 0.00 0.00 105 A 7.57 2.58 1.02 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 0.00 0.00 106 G 7.57 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 0.00 0.00 0.00 0.00 107 T 7.85 4.27 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 1.25 0.00 0.00 108 T 7.91 4.64 4.28 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 1.23 0.00 0.00 109 S 7.85 4.85 0.00 4.13 4.30 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 0.00 110 T 7.69 4.93 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 1.20 0.00 0.00 111 L 8.11 3.88 0.00 1.88 1.63 0.81 0.60 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 0.00 112 Q 7.88 3.75 0.00 2.21 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 113 E 7.37 3.42 0.00 1.75 1.87 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 1.63 1.85 0.00 114 Q 8.05 4.45 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.51 2.62 0.00 115 I 8.44 3.92 1.77 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.86 0.87 0.00 0.00 116 G 7.85 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 0.00 0.00 0.00 117 W 7.36 4.59 0.00 3.72 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 0.00 118 M 7.89 3.79 0.00 2.02 2.41 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 2.69 2.56 0.00 119 T 8.30 4.43 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 1.24 0.00 0.00 120 H 8.03 4.33 0.00 3.26 3.47 0.00 5.56 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 8.34 4.80 0.00 2.69 2.77 0.00 0.00 6.89 8.02 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 0.00 122 P 0.00 4.57 0.00 2.07 2.05 0.00 3.71 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 123 P 0.00 4.86 0.00 2.21 2.08 0.00 3.36 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 124 I 8.91 4.33 1.85 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 1.27 0.53 0.73 0.00 0.00 125 P 0.00 4.60 0.00 2.29 2.19 0.00 3.40 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 126 V 7.88 3.40 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 0.62 0.00 0.00 1.03 0.00 0.00 127 G 7.85 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 0.00 128 E 8.01 3.90 0.00 2.06 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 2.35 2.31 0.00 129 I 7.45 3.44 1.37 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.82 0.18 0.00 0.00 130 Y 7.40 3.43 0.00 2.72 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 0.00 131 K 8.14 3.83 0.00 1.79 1.92 0.00 1.62 0.00 0.00 1.49 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.60 7.81 132 R 7.85 3.98 0.00 2.07 2.09 0.00 3.27 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 133 W 7.96 4.50 0.00 3.64 3.21 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 0.00 134 I 7.95 3.64 1.84 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.37 0.24 0.00 0.00 135 I 8.17 3.75 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.77 0.96 0.00 0.00 136 L 8.16 4.12 0.00 1.95 1.75 1.02 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.36 3.61 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 0.00 0.00 0.00 138 L 8.43 3.89 0.00 1.73 1.72 0.53 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.38 4.35 0.00 2.90 2.89 0.00 0.00 6.67 7.99 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 0.00 140 K 7.92 3.89 0.00 1.82 1.95 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.47 7.81 141 I 7.69 3.69 1.63 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.38 0.08 0.00 0.00 142 V 8.15 3.86 2.13 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 1.22 0.00 0.00 1.13 0.00 0.00 143 R 8.14 3.95 0.00 2.00 2.06 0.00 3.12 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.62 0.00 144 M 7.78 4.00 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.09 0.00 145 Y 8.14 4.21 0.00 3.10 3.12 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 0.00 0.00 0.00 146 S 8.29 4.39 0.00 3.99 3.99 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