NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 N 4.6538 8.4244 119.2085 53.2692 40.1173 173.7800 23 H 4.0479 8.7799 120.5968 57.8609 29.6561 174.7881 24 D 4.6110 8.5923 122.7485 51.8324 42.8760 171.0793 25 P 3.9936 0.0000 0.0000 62.5978 32.0693 175.3820 26 Q 4.4854 8.0397 123.0973 54.1045 30.6756 174.5852 27 F 4.8287 8.3931 123.0544 55.3694 42.6259 174.1373 28 E 4.2829 9.1923 123.2125 55.6316 29.9320 174.1877 29 P 4.0868 0.0000 0.0000 61.4429 32.2376 176.1699 30 I 4.0726 8.2896 122.8273 63.0369 37.7190 176.0231 31 V 4.4527 7.3991 110.8374 59.6063 35.5452 174.5745 32 S 4.4773 8.5093 114.8600 56.6812 63.1101 172.9193 33 L 4.6672 8.2013 128.0173 51.9044 43.1275 175.2336 34 P 4.3387 0.0000 0.0000 62.0946 31.9383 176.0932 35 E 4.0825 8.5129 122.2229 56.9417 30.1077 175.8930 36 Q 4.4713 8.1339 122.8477 54.7366 32.1294 173.9199 37 E 4.3844 8.6597 123.7575 54.8609 29.7228 175.6612 38 I 4.1934 8.1140 118.5133 59.2775 38.6407 176.1589 39 K 4.3829 8.4358 124.9118 56.1197 32.8011 176.5847 40 T 4.4020 8.7058 114.7165 62.6104 69.9913 175.6632 41 L 4.2400 8.1099 119.6673 55.7763 39.6305 174.3597 42 E 4.6995 7.6889 115.1064 55.8682 30.5490 176.3878 43 E 4.1819 8.2823 118.6102 59.2785 29.4630 176.9940 44 D 4.9703 7.9258 117.8079 54.2760 42.2590 177.8038 45 E 4.6565 7.8678 117.6857 55.2735 28.6235 178.5150 46 E 5.8671 9.7599 123.5631 57.4727 28.3542 176.0398 47 E 3.8900 7.8200 118.3137 57.0204 27.2755 173.5771 48 L 4.2618 8.7113 122.5686 57.2112 42.6648 178.2364 49 F 5.1137 8.2449 120.2197 56.3444 42.9079 173.7258 50 K 5.2288 7.1448 125.1569 55.6577 34.9069 174.5953 51 M 4.6431 8.1960 124.9897 54.3983 35.5706 173.6015 52 R 4.7317 8.7330 122.0048 56.3439 31.0719 175.1096 53 A 4.2874 9.0441 121.5821 51.3062 23.5747 174.7006 54 K 4.7228 8.2306 121.0562 55.0798 33.9075 175.0119 55 L 5.1529 9.1913 130.1854 53.5576 44.6432 174.9768 56 F 5.3118 9.4608 123.6733 55.7776 42.9750 174.2311 57 R 5.0393 9.6817 122.0313 54.7857 33.2686 174.3046 58 F 3.6437 8.0448 124.8728 58.5336 40.7830 179.5227 59 A 2.8453 9.1617 128.5194 49.0685 21.9784 179.2303 60 S 4.4834 7.4655 112.8805 56.6142 62.7536 172.5514 61 E 4.3575 8.4014 113.9113 55.1779 27.9246 175.5415 62 N 4.8049 7.4349 115.3787 51.9890 40.9775 176.8845 63 D 4.3590 8.1999 115.1332 54.8176 39.5945 173.8490 64 L 4.4623 7.5473 119.1990 51.7024 41.2192 173.0218 65 P 4.0250 0.0000 0.0000 62.4723 30.0101 175.4245 66 E 4.5750 7.3686 120.8481 53.8299 34.0742 174.6354 67 W 4.9290 8.6108 121.4445 55.4671 30.3865 175.8137 68 K 4.5753 8.6371 125.4486 54.6672 33.2942 176.6211 69 E 3.6305 8.8438 124.2932 56.9158 29.5504 176.5984 70 R 4.3571 8.5422 122.3803 56.4962 32.6986 175.9930 71 G 3.9383 6.9048 106.6495 45.5115 0.0000 171.6242 72 T 4.6554 7.2954 115.8257 62.5147 72.1078 173.3662 73 G 4.6498 8.0572 113.5409 46.2355 0.0000 170.4080 74 D 5.1116 8.2875 120.4985 53.9922 42.1381 176.2224 75 V 4.3915 9.0721 124.5319 62.2250 33.4021 174.9151 76 K 5.3092 8.8513 124.3499 54.8269 37.0448 175.0184 77 L 5.2836 8.9731 123.5653 53.1201 44.2625 175.4422 78 L 5.1851 9.1552 124.0062 52.7194 45.1195 175.5276 79 K 5.0243 8.7268 123.6421 54.8840 35.0685 174.4196 80 H 4.9129 8.8623 126.2812 55.0645 30.1154 174.7203 81 K 3.9476 8.5610 125.4030 59.8813 31.5022 177.8593 82 E 3.8094 7.3253 115.8093 60.0244 30.7526 181.1769 83 K 4.6602 7.0668 130.0138 56.6324 31.4855 178.9285 84 G 3.8524 8.4271 110.1300 48.3780 0.0000 172.0329 85 A 3.6871 6.7236 119.8027 47.3840 20.1871 176.4512 86 I 5.7124 8.7689 122.4124 58.6018 41.1816 174.7603 87 R 5.2020 8.6133 121.2201 54.5304 33.9907 173.0604 88 L 5.2482 9.1231 121.4493 53.3408 44.6072 174.8474 89 L 5.1894 9.2479 127.8155 53.8393 45.2306 174.4263 90 M 5.2450 9.4545 126.6538 53.8520 35.7620 174.4970 91 R 5.1605 8.1110 122.3061 54.4353 34.5271 175.2628 92 R 4.6139 8.7634 121.7246 55.6895 31.7134 176.0635 93 D 4.4526 8.5352 121.1744 55.6391 41.7428 176.1160 94 K 4.0180 8.9927 122.1596 58.3284 31.1322 177.4176 95 T 3.8466 7.5068 111.9765 63.2583 67.6200 175.9429 96 L 3.7606 8.0061 117.9689 54.8379 40.2021 174.6937 97 K 4.2267 7.3071 118.1175 56.2687 33.3301 176.4020 98 I 4.4219 8.3111 124.6608 61.5388 37.4145 175.5536 99 C 4.7709 8.5675 121.2291 57.3030 30.7768 173.5882 100 A 4.3002 7.6012 117.5618 51.9658 22.2754 175.5970 101 N 5.8273 9.7239 120.1267 54.1846 41.6086 172.6683 102 H 5.2739 7.9922 119.2123 53.6080 32.8085 172.4265 103 Y 5.0079 8.6173 116.6098 58.0284 39.1265 174.9963 104 I 4.5092 8.7726 123.5133 60.3843 38.2453 176.1149 105 T 4.5016 8.3992 117.1755 59.1530 71.1325 173.1580 106 P 4.3279 0.0000 0.0000 66.1760 31.5599 178.2812 107 M 4.4336 7.6958 118.1514 53.4646 30.2999 174.9822 108 M 4.7992 6.9734 118.2966 54.3982 35.7464 173.0357 109 E 4.8822 8.1872 119.9742 55.9415 31.5358 175.1024 110 L 4.6993 8.2270 119.7591 53.5176 43.2314 176.3472 111 K 4.7364 8.6010 122.3487 53.8374 34.9498 173.8260 112 P 4.5308 0.0000 0.0000 62.4633 31.9036 176.8729 113 N 4.5537 7.9198 122.8424 53.3981 38.8760 176.2571 114 A 3.6299 8.4634 124.6009 53.2055 18.3004 179.9597 115 G 3.6709 9.0210 102.7147 45.1007 0.0000 171.2498 116 S 3.8952 8.5041 119.4122 57.4868 63.2712 170.5266 117 D 4.5186 8.0258 121.9856 52.8866 40.5720 176.7535 118 R 4.3476 7.4909 117.1977 57.0956 30.9021 175.7373 119 A 4.9362 7.1645 119.5721 50.0126 22.9940 175.3565 120 W 5.4054 9.0047 118.5725 55.2335 33.6425 174.8924 121 V 5.2260 8.3988 114.8757 59.2315 34.9992 174.3541 122 W 4.2419 7.6616 118.1514 56.8096 31.3174 172.9600 123 N 5.0642 9.1388 118.9685 52.3663 40.9501 174.0003 124 T 4.6746 8.3291 119.2516 62.1873 71.8877 174.9732 125 H 4.2327 9.2106 124.1271 58.5233 29.0399 175.6548 126 A 4.4469 7.7475 120.2160 51.7440 20.5032 174.9687 127 D 5.0673 9.0743 123.0393 53.9548 43.0196 175.9704 128 F 5.0268 8.7087 122.5662 57.8381 40.2048 176.8905 129 A 4.0359 8.6702 124.2515 54.2664 18.0918 178.9646 130 D 4.6924 7.9339 113.9810 53.6448 41.1485 176.3086 131 E 2.5400 7.2528 116.2369 56.1531 27.5786 174.3742 132 C 4.5507 7.0035 117.3964 57.0113 34.1501 170.8355 133 P 4.7488 0.0000 0.0000 63.4723 31.6227 175.7922 134 K 4.6865 9.0339 123.8315 53.7248 36.4821 174.4891 135 P 4.9117 0.0000 0.0000 62.8470 31.3998 174.9398 136 E 4.5967 8.6482 125.2362 54.1987 32.3365 174.5948 137 L 4.6617 8.4444 128.4605 53.6426 43.2595 175.4485 138 L 5.0831 7.7661 126.8150 53.9601 44.9225 174.8039 139 A 4.5478 7.1811 116.5701 52.1626 22.0506 175.5721 140 I 4.9673 8.7472 123.5672 59.2329 41.5744 174.1994 141 R 4.9697 8.6161 127.4453 54.5639 33.0729 174.3238 142 F 4.9555 9.1449 124.3677 55.4692 41.5148 175.7213 143 L 4.1067 9.0476 121.9528 57.9546 42.0508 176.7920 144 N 5.0682 7.9402 114.7829 50.7134 41.3607 175.3397 145 A 3.9862 8.7604 123.8021 55.4810 18.2929 179.8719 146 E 4.0611 8.1774 115.1520 59.2155 29.9515 178.9057 147 N 4.3874 8.5134 118.1989 56.0480 38.4878 177.1082 148 A 4.0560 7.9209 121.8784 55.1581 18.4650 179.6258 149 Q 4.0308 7.9864 116.4186 59.2661 28.3848 178.9420 150 K 3.2831 8.1757 119.3587 59.1567 31.8760 179.0349 151 F 3.1359 7.7034 120.7789 60.4813 39.3768 177.1971 152 K 2.9663 8.2520 119.7697 59.4625 31.6767 178.2759 153 T 3.8044 8.2736 114.1586 65.2833 67.0565 175.9847 154 K 3.7177 7.0094 118.8110 59.0084 32.5362 178.2271 155 F 3.6989 8.1004 122.1760 60.5425 39.0579 176.9554 156 E 3.8392 8.7197 120.3901 59.1341 29.7438 178.4956 157 E 3.5257 8.2074 117.6358 58.9761 29.1483 177.8871 158 C 4.1273 7.0101 117.1184 60.7222 31.9395 174.6397 159 R 3.8665 8.0838 120.0474 57.9415 29.8897 177.8853 160 K 4.0109 7.6248 119.1931 59.2139 32.3757 177.9846 161 E 3.8073 7.5752 117.5024 58.8001 29.6934 177.8649 162 I 4.1666 7.3918 117.9940 62.7034 38.2724 177.0736 163 E 4.2592 8.0155 119.1872 58.0087 29.6638 177.4997 164 E 4.1183 7.9751 116.7819 58.1046 30.0412 177.3923 165 R 3.7187 7.3610 119.6432 57.2141 29.5180 175.5933 166 E 3.7356 8.7578 120.5734 57.0771 30.0495 178.2147 167 K 4.1124 8.6787 122.0766 56.8422 32.3740 175.1377 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 22 N 8.42 4.65 0.00 2.70 2.81 0.00 0.00 6.93 7.01 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 23 H 8.78 4.05 0.00 3.08 3.34 0.00 6.02 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.59 4.61 0.00 2.54 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 3.99 0.00 2.27 1.98 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 26 Q 8.04 4.49 0.00 1.82 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.70 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 27 F 8.39 4.83 0.00 3.02 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 28 E 9.19 4.28 0.00 2.10 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 2.32 2.37 0.00 29 P 0.00 4.09 0.00 2.09 2.02 0.00 3.70 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.20 0.00 30 I 8.29 4.07 1.86 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 1.41 0.48 0.90 0.00 0.00 31 V 7.40 4.45 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 0.70 0.00 0.00 0.93 0.00 0.00 32 S 8.51 4.48 0.00 3.78 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 33 L 8.20 4.67 0.00 1.64 1.56 0.92 1.10 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 34 P 0.00 4.34 0.00 2.04 1.99 0.00 3.70 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 2.03 2.08 0.00 35 E 8.51 4.08 0.00 1.90 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 2.30 2.38 0.00 36 Q 8.13 4.47 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.66 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 37 E 8.66 4.38 0.00 1.99 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 2.25 2.28 0.00 38 I 8.11 4.19 1.87 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 1.41 0.45 0.91 0.00 0.00 39 K 8.44 4.38 0.00 1.78 1.94 0.00 1.88 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.41 7.81 40 T 8.71 4.40 4.34 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 0.00 0.00 0.00 1.29 0.00 0.00 41 L 8.11 4.24 0.00 1.82 1.76 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 42 E 7.69 4.70 0.00 1.82 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 2.22 2.26 0.00 43 E 8.28 4.18 0.00 2.00 2.01 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 2.32 2.40 0.00 44 D 7.93 4.97 0.00 2.75 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 45 E 7.87 4.66 0.00 2.10 1.65 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 2.54 2.38 0.00 46 E 9.76 5.87 0.00 2.33 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 0.00 2.15 2.03 0.00 47 E 7.82 3.89 0.00 2.12 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 2.21 2.34 0.00 48 L 8.71 4.26 0.00 1.69 1.76 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.24 5.11 0.00 3.13 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 50 K 7.14 5.23 0.00 1.67 1.47 0.00 1.65 0.00 0.00 2.23 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.21 1.22 7.81 51 M 8.20 4.64 0.00 2.14 1.45 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.83 0.00 52 R 8.73 4.73 0.00 1.94 2.15 0.00 3.14 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 53 A 9.04 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.23 4.72 0.00 1.84 1.78 0.00 1.73 0.00 0.00 1.41 0.00 0.00 2.74 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.96 1.25 7.81 55 L 9.19 5.15 0.00 1.78 1.46 1.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 56 F 9.46 5.31 0.00 2.82 3.14 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 57 R 9.68 5.04 0.00 1.99 1.81 0.00 3.25 0.00 0.00 3.45 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 58 F 8.04 3.64 0.00 2.59 2.59 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 59 A 9.16 2.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 7.47 4.48 0.00 3.82 4.06 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 61 E 8.40 4.36 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 62 N 7.43 4.80 0.00 2.71 2.69 0.00 0.00 6.99 8.08 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 63 D 8.20 4.36 0.00 2.78 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 64 L 7.55 4.46 0.00 1.48 1.52 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 4.03 0.00 2.05 2.25 0.00 3.58 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 2.06 2.15 0.00 66 E 7.37 4.57 0.00 1.66 1.69 0.00 0.00 0.00 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 2.35 0.00 67 W 8.61 4.93 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 68 K 8.64 4.58 0.00 1.75 1.71 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.33 7.81 69 E 8.84 3.63 0.00 1.67 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 1.48 2.02 0.00 70 R 8.54 4.36 0.00 1.71 1.91 0.00 3.37 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 71 G 6.90 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 0.00 0.00 0.00 72 T 7.30 4.66 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 1.16 0.00 0.00 73 G 8.06 4.65 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 0.00 0.00 0.00 74 D 8.29 5.11 0.00 2.65 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 75 V 9.07 4.39 2.27 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 1.14 0.00 0.00 0.96 0.00 0.00 76 K 8.85 5.31 0.00 1.91 1.68 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.43 7.81 77 L 8.97 5.28 0.00 1.88 1.64 1.08 0.43 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 78 L 9.16 5.19 0.00 1.59 1.56 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.73 5.02 0.00 1.74 1.67 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.71 7.81 80 H 8.86 4.91 0.00 3.21 3.20 0.00 5.85 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 81 K 8.56 3.95 0.00 1.84 1.87 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.67 1.79 7.81 82 E 7.33 3.81 0.00 1.49 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 2.23 2.27 0.00 83 K 7.07 4.66 0.00 1.77 1.38 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.42 1.41 7.81 84 G 8.43 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 6.72 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.77 5.71 1.83 0.00 0.00 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 1.03 1.29 0.94 0.00 0.00 87 R 8.61 5.20 0.00 1.93 2.04 0.00 3.01 0.00 0.00 3.02 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 88 L 9.12 5.25 0.00 1.92 1.59 1.33 0.82 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 89 L 9.25 5.19 0.00 1.76 1.50 0.99 0.79 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 90 M 9.45 5.25 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.60 0.00 91 R 8.11 5.16 0.00 1.61 1.74 0.00 3.18 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 92 R 8.76 4.61 0.00 1.74 1.80 0.00 3.09 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 93 D 8.54 4.45 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.99 4.02 0.00 1.87 1.88 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.46 7.81 95 T 7.51 3.85 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 1.27 0.00 0.00 96 L 8.01 3.76 0.00 1.84 1.78 1.01 0.96 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 97 K 7.31 4.23 0.00 1.77 1.70 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.54 7.81 98 I 8.31 4.42 1.86 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 1.41 0.47 0.99 0.00 0.00 99 C 8.57 4.77 0.00 3.01 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 0.00 100 A 7.60 4.30 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 101 N 9.72 5.83 0.00 2.81 2.74 0.00 0.00 6.56 7.76 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 0.00 102 H 7.99 5.27 0.00 3.43 3.55 0.00 5.70 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 8.62 5.01 0.00 2.99 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.77 4.51 1.76 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.73 0.57 0.00 0.00 105 T 8.40 4.50 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 1.31 0.00 0.00 106 P 0.00 4.33 0.00 2.06 2.14 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 107 M 7.70 4.43 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.62 0.00 108 M 6.97 4.80 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.75 0.00 109 E 8.19 4.88 0.00 2.04 1.89 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 2.07 2.14 0.00 110 L 8.23 4.70 0.00 0.85 1.22 -0.30 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 111 K 8.60 4.74 0.00 1.84 1.80 0.00 1.96 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.49 7.81 112 P 0.00 4.53 0.00 2.01 2.01 0.00 3.87 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.76 0.00 113 N 7.92 4.55 0.00 2.44 2.55 0.00 0.00 7.23 7.83 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 0.00 114 A 8.46 3.63 1.25 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 0.00 115 G 9.02 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 0.00 116 S 8.50 3.90 0.00 3.90 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.03 4.52 0.00 2.64 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 0.00 118 R 7.49 4.35 0.00 1.73 2.14 0.00 3.00 0.00 0.00 3.07 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.50 0.00 119 A 7.16 4.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 W 9.00 5.41 0.00 3.47 3.14 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 0.00 121 V 8.40 5.23 2.37 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 0.93 0.00 0.00 1.15 0.00 0.00 122 W 7.66 4.24 0.00 3.42 3.34 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 0.00 0.00 0.00 0.00 123 N 9.14 5.06 0.00 2.77 2.76 0.00 0.00 6.76 7.70 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 0.00 124 T 8.33 4.67 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 0.00 125 H 9.21 4.23 0.00 3.23 3.40 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 A 7.75 4.45 1.30 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 0.00 0.00 127 D 9.07 5.07 0.00 2.86 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.71 5.03 0.00 2.99 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 0.00 129 A 8.67 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 130 D 7.93 4.69 0.00 2.62 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 0.00 131 E 7.25 2.54 0.00 1.78 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.96 0.00 132 C 7.00 4.55 0.00 2.80 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.75 0.00 2.08 2.14 0.00 3.83 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.37 0.00 134 K 9.03 4.69 0.00 1.72 1.68 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.66 7.81 135 P 0.00 4.91 0.00 1.97 2.09 0.00 3.67 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 2.06 2.13 0.00 136 E 8.65 4.60 0.00 2.17 1.78 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 2.24 2.28 0.00 137 L 8.44 4.66 0.00 1.69 1.50 0.60 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 138 L 7.77 5.08 0.00 0.27 0.92 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 139 A 7.18 4.55 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 0.00 140 I 8.75 4.97 2.15 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 1.31 1.40 0.00 0.00 141 R 8.62 4.97 0.00 1.61 1.60 0.00 3.07 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.00 142 F 9.14 4.96 0.00 2.95 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 0.00 143 L 9.05 4.11 0.00 1.65 1.80 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 144 N 7.94 5.07 0.00 3.05 2.66 0.00 0.00 6.86 7.79 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 0.00 145 A 8.76 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.18 4.06 0.00 2.29 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 0.00 2.38 2.48 0.00 147 N 8.51 4.39 0.00 3.08 2.85 0.00 0.00 6.72 8.13 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 0.00 148 A 7.92 4.06 1.65 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 0.00 0.00 149 Q 7.99 4.03 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.72 2.64 0.00 150 K 8.18 3.28 0.00 2.04 1.98 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.80 7.81 151 F 7.70 3.14 0.00 2.62 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 0.00 152 K 8.25 2.97 0.00 0.79 1.25 0.00 0.68 0.00 0.00 1.15 0.00 0.00 2.60 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.93 0.53 7.81 153 T 8.27 3.80 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 1.07 0.00 0.00 154 K 7.01 3.72 0.00 1.53 1.26 0.00 1.79 0.00 0.00 1.58 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.41 7.81 155 F 8.10 3.70 0.00 2.00 2.43 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 0.00 156 E 8.72 3.84 0.00 1.97 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 157 E 8.21 3.53 0.00 2.12 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 2.44 2.20 0.00 158 C 7.01 4.13 0.00 3.18 2.66 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 0.00 159 R 8.08 3.87 0.00 1.48 2.00 0.00 3.69 0.00 0.00 3.06 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.96 0.00 160 K 7.62 4.01 0.00 1.77 1.68 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.55 1.43 7.81 161 E 7.58 3.81 0.00 2.19 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 2.28 2.33 0.00 162 I 7.39 4.17 1.90 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 1.45 0.61 0.84 0.00 0.00 163 E 8.02 4.26 0.00 1.87 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 2.29 2.21 0.00 164 E 7.98 4.12 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 2.27 2.46 0.00 165 R 7.36 3.72 0.00 1.81 1.75 0.00 3.22 0.00 0.00 3.21 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.53 0.00 166 E 8.76 3.74 0.00 2.12 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 0.00 2.35 2.29 0.00 167 K 8.68 4.11 0.00 1.84 1.77 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.45 7.81