NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 G 3.9159 8.3393 109.7355 45.7523 0.0000 173.1517 24 Q 4.1369 7.8857 122.5414 54.2406 30.3953 174.5399 25 D 4.5253 9.2252 120.5368 54.3217 42.6289 177.6445 26 R 4.6455 8.3130 126.0950 55.7048 31.1159 176.8640 27 S 4.3631 7.7993 113.3531 57.9534 64.9022 173.8692 28 E 3.9321 8.7560 123.0112 59.6930 29.4763 178.9979 29 A 4.0183 7.9989 120.1124 55.4678 18.3926 179.6510 30 T 3.7997 7.5992 112.9266 66.7203 68.4685 176.9873 31 L 3.6697 8.1673 121.1998 57.7052 41.7680 179.5704 32 I 4.0279 8.0327 119.7900 64.6815 36.9115 178.7186 33 K 4.0692 7.6978 117.2899 59.2123 31.9554 179.1947 34 R 3.7780 7.9205 119.2988 59.0058 30.0414 177.9109 35 F 4.7227 7.8573 116.0062 56.7836 39.6593 176.2117 36 K 4.8738 7.6718 118.8046 57.6084 34.2046 178.7507 37 G 3.9170 8.4639 109.1985 46.9945 0.0000 176.9540 38 E 4.0940 9.0450 123.8310 57.0454 30.1709 178.8752 39 G 3.9682 7.7083 106.3319 44.9664 0.0000 172.6371 40 V 4.1527 8.6287 122.0545 61.4010 33.3534 175.6440 41 R 5.1503 8.3108 127.8015 54.8476 32.1120 174.4656 42 Y 4.8883 9.2353 123.2617 55.9938 42.0753 174.6992 43 K 4.6426 8.8548 124.2322 56.6298 34.1611 175.6828 44 A 4.8310 8.4713 126.2335 51.8664 23.7271 174.7180 45 K 5.0295 8.5878 114.9833 54.7346 36.6525 175.9709 46 L 4.3654 8.5383 126.6672 54.9378 41.9940 176.6449 47 I 3.8859 8.7656 128.5579 62.5838 37.7585 176.6520 48 G 4.1156 6.8279 108.0461 46.1316 0.0000 170.7664 49 I 4.9604 7.7977 120.0225 59.2903 40.0466 174.9512 50 D 5.0308 9.1337 126.4980 52.3318 44.4828 174.4035 51 E 4.7948 8.7483 124.1800 56.0072 30.3593 176.2418 52 V 4.6955 8.5166 117.3577 59.4604 34.8552 176.2884 53 S 4.2700 8.8208 115.9938 59.6749 63.5426 173.3264 54 A 4.6105 7.4381 122.0083 50.2964 22.0710 175.3059 55 A 4.0388 8.1312 120.7593 53.2934 19.0843 177.0383 56 R 3.8398 7.0951 110.2858 54.8363 32.1148 172.5792 57 G 3.3073 6.6462 103.5142 43.9230 0.0000 174.1171 58 D 4.4340 9.0153 125.4266 57.4587 41.2905 178.2385 59 K 3.8700 7.9316 119.5214 59.3000 32.3949 178.0014 60 L 3.8032 7.8269 120.1014 58.6541 41.8278 178.7669 61 C 3.2557 7.9109 116.3521 62.3902 27.9876 175.8834 62 Q 3.9033 8.0758 121.2507 59.1868 28.6250 178.0018 63 D 4.2852 8.2499 120.2920 57.3057 40.7595 178.7147 64 S 4.0155 7.6912 113.3141 61.3359 62.2538 175.8381 65 M 4.1750 8.1449 121.3551 58.9882 32.0575 177.7821 66 M 3.9926 8.1550 118.3816 58.4481 32.3395 178.1426 67 K 3.9178 8.0141 119.6302 59.6013 32.5001 178.7932 68 L 4.0221 8.1165 119.3854 57.8853 41.5115 179.8036 69 K 4.1443 8.5699 118.8856 59.1845 31.9278 179.5880 70 G 3.6731 8.1500 106.2388 47.7924 0.0000 175.9337 71 V 3.5694 7.8545 120.6205 65.6534 31.4952 178.1784 72 V 3.5545 7.8955 117.7781 66.0881 31.3959 177.8174 73 A 4.0762 8.5361 120.9711 55.1922 16.8274 179.8953 74 G 3.5493 8.1844 104.0347 47.7282 0.0000 175.7840 75 A 4.2661 8.0122 123.0100 54.7113 18.4354 179.6912 76 R 4.2992 8.5671 119.2760 58.9122 29.9278 178.7556 77 S 4.2181 7.9634 112.9849 60.2321 62.9648 175.5349 78 K 4.5085 7.0925 118.4010 55.6985 32.1409 176.7525 79 G 3.8132 8.0823 107.0926 45.9567 0.0000 173.9975 80 E 4.3876 8.1256 119.6702 55.3954 30.7935 175.1332 81 H 5.0997 8.0795 116.0207 53.7227 32.7846 173.9251 82 K 4.1840 8.4579 121.0660 56.0990 32.8548 176.9210 83 Q 4.1561 8.4741 123.6838 56.2420 30.4753 175.0876 84 K 4.7698 8.7103 126.0943 56.1967 33.8062 176.0361 85 I 5.2362 9.1115 118.1493 59.4979 42.1164 173.6095 86 F 5.6477 8.7916 116.2488 55.2596 41.0922 173.6618 87 L 5.6443 9.4379 123.2484 54.2285 43.5502 175.3102 88 T 5.4194 9.2082 110.7283 60.1492 72.4089 172.7475 89 I 5.0377 8.8026 124.2974 59.8936 40.2746 174.9362 90 S 4.8424 8.7944 121.0834 57.3466 66.3482 174.9161 91 F 4.4571 8.7163 117.7217 59.9765 38.2394 176.6621 92 G 4.0082 8.4253 109.5053 45.4706 0.0000 173.7047 93 G 4.3788 8.7306 106.8455 44.7216 0.0000 172.9238 94 I 5.0116 8.5336 123.1850 59.5090 39.5283 175.0471 95 K 4.9941 8.9643 125.9735 54.5374 35.8212 175.0602 96 I 4.6905 8.6403 125.1840 59.5577 39.8121 174.5881 97 F 4.9759 8.7212 125.9190 55.1781 42.1517 174.4395 98 D 4.6555 8.8324 123.0776 54.1664 41.5979 176.7501 99 E 4.2685 8.9905 127.7385 59.4526 29.9768 178.1581 100 K 4.1765 8.2830 116.8177 58.8568 32.2056 177.6564 101 T 4.3651 8.1753 106.6249 60.6234 70.1889 175.5829 102 G 4.1126 8.7950 109.7462 45.3867 0.0000 173.3324 103 A 4.3732 7.7185 122.1038 51.2235 19.7758 177.0943 104 L 3.6232 8.6009 124.2821 55.2757 42.0692 176.4101 105 Q 4.4798 8.8912 124.7655 56.5516 31.5850 175.7910 106 H 4.8592 7.5978 114.5663 54.3255 33.5943 172.2962 107 H 5.1358 8.5520 121.3514 55.1059 32.7254 172.0297 108 H 5.0938 9.3406 123.8575 53.6775 31.2411 173.9539 109 A 4.6355 8.7002 126.4667 51.1258 19.4049 178.1584 110 V 3.6227 8.7057 120.1004 66.4402 31.4555 178.1339 111 H 4.3757 8.1436 112.4007 57.4181 28.6785 175.4842 112 E 4.2967 8.0497 119.4876 56.5871 30.0926 175.4050 113 I 4.6527 7.3491 120.7025 60.3074 37.8073 175.4125 114 S 4.6903 8.9276 120.7247 59.4227 64.8448 174.0270 115 Y 4.9718 7.9246 120.0076 56.4239 42.1055 173.1762 116 I 5.0082 7.9974 126.0909 59.5370 39.9684 174.8601 117 A 4.6459 9.1524 127.3412 50.1871 22.3698 175.3748 118 K 4.6082 8.7871 123.5535 55.6081 34.0956 176.0731 119 D 4.8411 8.6150 124.9124 52.9026 40.5750 177.2482 120 I 3.8790 8.5928 121.2440 62.8634 37.6316 176.6147 121 T 4.3755 7.9684 110.2085 61.5110 69.4711 174.1021 122 D 4.5314 8.2652 123.5826 53.3265 43.2574 174.9991 123 H 4.6067 9.1149 122.1509 57.0884 29.0545 176.1186 124 R 4.9641 8.8129 120.1439 55.6077 31.5701 174.9361 125 A 5.3959 8.0592 119.8258 51.0361 23.3065 176.0124 126 F 5.2612 8.9539 114.3426 56.6681 42.1599 172.5910 127 G 3.8136 9.3898 106.0023 45.6546 0.0000 171.2987 128 Y 5.5758 7.6281 116.5970 55.5816 41.9050 174.0083 129 V 5.0267 9.1761 121.9456 61.8190 33.5405 174.4738 130 C 5.3933 9.4989 122.1170 56.8289 33.5729 173.2563 131 G 4.2281 8.7710 105.7307 45.5177 0.0000 173.6667 132 K 4.3485 8.2136 118.8642 54.2722 33.7587 175.9140 133 E 3.9423 8.4849 120.2971 58.3438 29.4952 177.2765 134 G 4.0158 9.0975 113.3843 45.6138 0.0000 172.4920 135 N 5.0813 7.8545 118.9110 53.4207 39.8215 173.5377 136 H 4.9121 8.2234 114.4637 55.5671 30.4316 175.1766 137 R 5.0256 9.1100 121.0594 54.4077 34.6977 173.8095 138 F 5.0997 9.6360 126.4321 56.7022 41.4691 174.3403 139 V 4.1101 7.6141 126.9766 61.0471 33.0353 174.0430 140 A 4.5791 8.3046 130.3091 50.0494 21.3505 175.2865 141 I 4.5784 8.3563 123.3108 59.1675 40.9931 174.8310 142 K 4.9351 8.9148 128.8460 54.7248 33.0546 175.4191 143 T 4.4217 8.5714 118.0300 61.5807 69.1801 174.8371 144 A 4.1290 8.7993 126.2456 55.2553 18.8670 177.5081 145 Q 4.6044 7.6995 112.4895 54.1562 31.4363 175.1117 146 A 4.2097 8.4168 120.7986 53.0901 19.1326 178.5994 147 A 4.0444 8.8213 122.9981 54.3305 18.4257 179.8965 148 E 3.7518 8.2582 118.3297 59.2872 29.5277 177.3181 149 P 4.2347 0.0000 0.0000 65.8174 31.1302 178.5170 150 V 2.9561 7.1112 117.3967 65.6226 31.4230 177.9000 151 I 3.2794 7.1348 119.4717 64.2803 36.8088 178.5070 152 L 3.9285 8.1327 120.1466 57.6599 41.3442 179.3179 153 D 4.4858 7.9548 119.1281 57.2535 40.7143 178.7401 154 L 3.2391 7.5885 119.5094 57.3112 41.5342 179.4201 155 R 3.7350 7.7350 118.5930 59.6345 30.0037 178.3267 156 D 4.3962 8.1837 118.7537 57.0829 40.7408 178.4980 157 L 3.2799 7.7873 121.1663 57.9490 41.9287 178.9923 158 F 4.4929 7.7460 117.6648 60.8769 38.8136 177.5237 159 Q 4.1130 8.2873 119.1155 59.0521 28.7598 178.0384 160 L 4.0657 8.2821 121.5323 58.2821 42.1162 179.0460 161 I 3.8918 8.1826 119.9439 64.4691 37.0354 177.7171 162 Y 4.1334 8.3746 120.4747 60.8828 38.7076 178.1324 163 E 3.7625 8.5730 119.5935 59.3853 29.5048 179.4327 164 L 4.0173 8.3571 119.4309 57.6730 41.6718 179.7278 165 K 3.8798 8.3783 118.9207 59.3569 31.7381 179.1326 166 Q 3.8145 7.6941 118.9548 59.0351 29.0595 177.9225 167 R 4.1203 7.6648 115.6906 55.5136 30.9497 175.8609 168 E 3.8072 8.0988 117.3576 58.1464 27.0384 174.6380 169 E 4.6496 8.7462 114.4362 55.4373 31.6767 178.0564 170 L 3.8914 8.1392 122.5232 58.4760 41.5899 178.5574 171 E 3.8343 8.1141 118.4728 59.1862 29.3705 178.1893 172 K 3.9763 7.6140 115.7889 57.6548 32.2329 177.5544 173 K 4.3489 7.2300 116.7251 56.3134 34.5949 176.0169 174 A 3.5152 7.7704 125.8724 51.9589 18.4951 176.8144 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 23 G 8.34 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 24 Q 7.89 4.14 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 25 D 9.23 4.53 0.00 2.62 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 26 R 8.31 4.65 0.00 1.81 1.90 0.00 3.27 0.00 0.00 3.64 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.74 0.00 27 S 7.80 4.36 0.00 4.01 4.08 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 0.00 0.00 0.00 28 E 8.76 3.93 0.00 2.10 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 2.45 2.46 0.00 29 A 8.00 4.02 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 T 7.60 3.80 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 1.13 0.00 0.00 31 L 8.17 3.67 0.00 1.90 1.86 1.09 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 32 I 8.03 4.03 2.12 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.51 1.07 0.00 0.00 33 K 7.70 4.07 0.00 1.84 1.84 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.57 7.81 34 R 7.92 3.78 0.00 1.63 1.22 0.00 2.76 0.00 0.00 2.45 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.33 0.00 35 F 7.86 4.72 0.00 2.35 2.34 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 36 K 7.67 4.87 0.00 2.16 2.37 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.72 1.47 7.81 37 G 8.46 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 38 E 9.04 4.09 0.00 1.97 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 2.34 2.33 0.00 39 G 7.71 3.97 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 0.00 0.00 0.00 40 V 8.63 4.15 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 0.62 0.00 0.00 0.94 0.00 0.00 41 R 8.31 5.15 0.00 1.76 1.61 0.00 2.58 0.00 0.00 2.84 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.68 0.00 42 Y 9.24 4.89 0.00 3.04 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 43 K 8.85 4.64 0.00 1.91 1.75 0.00 1.78 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.54 7.81 44 A 8.47 4.83 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 45 K 8.59 5.03 0.00 1.68 1.66 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.39 7.81 46 L 8.54 4.37 0.00 1.63 1.56 0.84 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.77 3.89 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.64 0.89 0.00 0.00 48 G 6.83 4.12 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 0.00 0.00 0.00 49 I 7.80 4.96 1.79 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.56 0.83 0.00 0.00 50 D 9.13 5.03 0.00 2.74 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 51 E 8.75 4.79 0.00 1.89 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 2.29 2.33 0.00 52 V 8.52 4.70 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 0.69 0.00 0.00 1.05 0.00 0.00 53 S 8.82 4.27 0.00 3.96 3.97 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 54 A 7.44 4.61 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 55 A 8.13 4.04 1.16 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 56 R 7.10 3.84 0.00 0.95 1.64 0.00 2.93 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.33 0.00 57 G 6.65 3.31 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 0.00 58 D 9.02 4.43 0.00 2.92 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 59 K 7.93 3.87 0.00 1.87 1.73 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.47 1.66 7.81 60 L 7.83 3.80 0.00 1.66 1.71 0.83 0.89 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 61 C 7.91 3.26 0.00 3.10 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 62 Q 8.08 3.90 0.00 2.26 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 63 D 8.25 4.29 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.69 4.02 0.00 3.77 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 65 M 8.14 4.18 0.00 2.30 2.26 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.81 0.00 66 M 8.15 3.99 0.00 2.24 2.04 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 2.60 2.55 0.00 67 K 8.01 3.92 0.00 1.87 1.96 0.00 1.68 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.47 7.81 68 L 8.12 4.02 0.00 1.89 1.71 1.01 0.89 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 69 K 8.57 4.14 0.00 1.99 1.86 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.61 7.81 70 G 8.15 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 71 V 7.85 3.57 2.24 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 0.98 0.00 0.00 1.00 0.00 0.00 72 V 7.90 3.55 2.24 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 1.04 0.00 0.00 0.97 0.00 0.00 73 A 8.54 4.08 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 74 G 8.18 3.55 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 0.00 75 A 8.01 4.27 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 76 R 8.57 4.30 0.00 2.00 2.08 0.00 3.26 0.00 0.00 3.34 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 77 S 7.96 4.22 0.00 4.09 3.98 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 78 K 7.09 4.51 0.00 1.85 1.84 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.38 1.55 7.81 79 G 8.08 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 80 E 8.13 4.39 0.00 1.98 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 2.26 2.33 0.00 81 H 8.08 5.10 0.00 3.10 3.13 0.00 5.70 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.46 4.18 0.00 1.76 1.91 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.44 7.81 83 Q 8.47 4.16 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.11 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 84 K 8.71 4.77 0.00 1.80 1.90 0.00 1.69 0.00 0.00 2.10 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.55 1.46 7.81 85 I 9.11 5.24 1.97 0.00 0.00 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 1.41 1.08 0.96 0.00 0.00 86 F 8.79 5.65 0.00 3.20 3.18 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 0.00 87 L 9.44 5.64 0.00 2.01 1.96 1.19 0.91 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 88 T 9.21 5.42 4.58 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 89 I 8.80 5.04 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.98 0.66 0.00 0.00 90 S 8.79 4.84 0.00 4.21 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.72 4.46 0.00 3.17 3.17 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 92 G 8.43 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.73 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 0.00 0.00 0.00 0.00 94 I 8.53 5.01 1.67 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.59 0.91 0.00 0.00 95 K 8.96 4.99 0.00 1.85 1.20 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.41 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.13 1.39 7.81 96 I 8.64 4.69 1.87 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 1.30 0.76 0.90 0.00 0.00 97 F 8.72 4.98 0.00 1.51 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 98 D 8.83 4.66 0.00 2.69 2.55 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 99 E 8.99 4.27 0.00 2.16 2.12 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 2.43 2.48 0.00 100 K 8.28 4.18 0.00 1.98 1.90 0.00 1.78 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.47 7.81 101 T 8.18 4.37 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 1.24 0.00 0.00 102 G 8.80 4.11 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 0.00 103 A 7.72 4.37 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 0.00 104 L 8.60 3.62 0.00 1.43 1.47 0.13 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 8.89 4.48 0.00 1.70 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.37 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 106 H 7.60 4.86 0.00 2.94 3.00 0.00 5.57 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 H 8.55 5.14 0.00 2.91 3.06 0.00 5.86 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 H 9.34 5.09 0.00 3.12 3.25 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 0.00 109 A 8.70 4.64 1.18 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 0.00 0.00 0.00 110 V 8.71 3.62 2.16 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 1.00 0.00 0.00 1.13 0.00 0.00 111 H 8.14 4.38 0.00 3.30 3.42 0.00 5.57 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 E 8.05 4.30 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 2.15 1.88 0.00 113 I 7.35 4.65 1.76 0.00 0.00 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 1.60 0.82 1.13 0.00 0.00 114 S 8.93 4.69 0.00 3.88 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 Y 7.92 4.97 0.00 3.17 2.88 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 0.00 116 I 8.00 5.01 1.81 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.08 0.95 0.00 0.00 117 A 9.15 4.65 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 0.00 118 K 8.79 4.61 0.00 1.81 1.75 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.72 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.50 7.81 119 D 8.61 4.84 0.00 2.82 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 0.00 120 I 8.59 3.88 1.89 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 1.49 0.73 0.94 0.00 0.00 121 T 7.97 4.38 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 1.23 0.00 0.00 122 D 8.27 4.53 0.00 2.67 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 0.00 123 H 9.11 4.61 0.00 3.37 3.52 0.00 5.45 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 R 8.81 4.96 0.00 1.77 2.03 0.00 3.06 0.00 0.00 3.10 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.11 0.00 125 A 8.06 5.40 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 0.00 126 F 8.95 5.26 0.00 3.32 3.11 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 0.00 127 G 9.39 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 0.00 128 Y 7.63 5.58 0.00 3.27 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 0.00 129 V 9.18 5.03 2.38 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 1.18 0.00 0.00 1.24 0.00 0.00 130 C 9.50 5.39 0.00 3.07 3.16 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 0.00 131 G 8.77 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 8.21 4.35 0.00 1.86 1.75 0.00 1.60 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.49 7.81 133 E 8.48 3.94 0.00 1.94 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 2.37 0.00 134 G 9.10 4.02 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 0.00 135 N 7.85 5.08 0.00 2.71 2.73 0.00 0.00 7.12 7.42 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 0.00 136 H 8.22 4.91 0.00 3.38 3.25 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 R 9.11 5.03 0.00 1.63 1.69 0.00 3.07 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 138 F 9.64 5.10 0.00 2.97 2.88 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 0.00 139 V 7.61 4.11 0.67 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 0.46 0.00 0.00 0.41 0.00 0.00 140 A 8.30 4.58 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 0.00 141 I 8.36 4.58 1.05 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.01 0.94 0.00 0.00 142 K 8.91 4.94 0.00 1.83 1.70 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.35 1.41 7.81 143 T 8.57 4.42 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 1.34 0.00 0.00 144 A 8.80 4.13 1.38 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 0.00 0.00 0.00 145 Q 7.70 4.60 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 146 A 8.42 4.21 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 0.00 147 A 8.82 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 0.00 148 E 8.26 3.75 0.00 2.01 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 2.35 2.35 0.00 149 P 0.00 4.23 0.00 2.43 2.34 0.00 3.59 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 2.02 2.06 0.00 150 V 7.11 2.96 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 0.45 0.00 0.00 -0.26 0.00 0.00 151 I 7.13 3.28 1.78 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 1.11 0.00 0.77 0.00 0.00 152 L 8.13 3.93 0.00 1.60 1.68 0.89 0.88 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 0.00 153 D 7.95 4.49 0.00 2.96 2.88 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 0.00 154 L 7.59 3.24 0.00 1.48 0.96 0.71 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 155 R 7.73 3.74 0.00 1.77 2.01 0.00 3.09 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 156 D 8.18 4.40 0.00 3.03 2.88 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 0.00 157 L 7.79 3.28 0.00 0.27 1.04 -0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 158 F 7.75 4.49 0.00 3.05 2.94 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 0.00 159 Q 8.29 4.11 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.67 0.00 160 L 8.28 4.07 0.00 2.02 2.01 1.07 1.18 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 0.00 161 I 8.18 3.89 2.17 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.95 1.04 0.00 0.00 162 Y 8.37 4.13 0.00 3.11 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 0.00 163 E 8.57 3.76 0.00 2.26 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 2.45 2.78 0.00 164 L 8.36 4.02 0.00 1.70 1.80 1.04 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 165 K 8.38 3.88 0.00 1.94 1.81 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.57 7.81 166 Q 7.69 3.81 0.00 1.65 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.92 0.00 0.00 0.00 0.00 0.00 2.16 2.32 0.00 167 R 7.66 4.12 0.00 1.82 2.03 0.00 3.35 0.00 0.00 3.21 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.85 0.00 168 E 8.10 3.81 0.00 2.10 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 2.21 2.23 0.00 169 E 8.75 4.65 0.00 1.92 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 2.19 2.38 0.00 170 L 8.14 3.89 0.00 1.73 1.63 0.88 0.86 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 0.00 171 E 8.11 3.83 0.00 2.03 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 2.34 2.37 0.00 172 K 7.61 3.98 0.00 1.86 1.82 0.00 1.55 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.50 7.81 173 K 7.23 4.35 0.00 1.49 1.77 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.49 7.81 174 A 7.77 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00