NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6760 8.2649 122.4699 52.2375 19.8196 175.9255 2 T 4.6472 9.1275 119.0306 61.7340 73.4495 171.7232 3 K 5.3070 8.9970 124.0602 54.8902 37.2234 174.7137 4 A 5.3599 9.2853 124.4174 50.6862 23.4587 174.9197 5 V 5.0075 8.8916 117.3839 61.0365 35.4825 173.4910 6 C 4.9252 9.1080 121.6808 58.1705 35.4482 172.6075 7 V 4.5879 8.4826 126.1418 61.5388 33.0536 174.1592 8 L 4.8322 8.9414 129.4380 53.8140 43.0572 176.2086 9 K 4.8697 9.0702 122.3478 55.4897 37.1759 176.1825 10 G 4.2483 7.9593 107.6401 46.2530 0.0000 172.2582 11 D 4.5775 8.7870 117.9291 55.1077 41.8161 176.4587 12 G 4.3919 7.5645 108.6633 43.7060 0.0000 171.4067 13 P 4.4668 0.0000 0.0000 63.3123 31.9683 175.4666 14 V 4.9349 7.7760 120.3898 62.2968 32.1884 174.9809 15 Q 4.8042 8.2265 124.2833 55.4862 32.2266 173.5818 16 G 4.1780 8.2172 106.6569 46.3010 0.0000 171.7464 17 I 5.1914 8.0214 119.0906 59.4974 41.1641 175.0542 18 I 4.5774 8.8693 127.3955 59.4920 40.4739 174.4098 19 N 4.9745 8.4976 124.0204 51.5033 41.1114 173.9657 20 F 5.4474 8.9412 119.6212 55.8609 43.4899 173.6921 21 E 5.2354 9.7681 123.1574 54.7434 33.5005 173.6741 22 Q 4.9402 9.4126 127.7328 54.4322 31.3628 176.0209 23 K 4.1090 9.0316 127.0402 58.6981 32.7479 177.3673 24 E 4.8063 7.7790 116.3904 53.7561 33.4075 174.9958 25 S 4.3024 8.5444 116.1166 59.7803 63.3610 174.5742 26 N 4.2094 8.9764 119.5660 54.0109 38.0514 174.0600 27 G 3.9556 7.9323 106.3415 44.6884 0.0000 171.3942 28 P 4.6059 0.0000 0.0000 62.2627 32.2080 176.4182 29 V 4.6155 8.8927 123.6558 61.2552 33.6881 174.6740 30 K 4.9431 9.3880 128.3633 55.8216 33.8149 175.9877 31 V 4.8715 9.1333 124.8546 60.8964 34.3357 174.2272 32 W 5.8227 7.5198 123.3936 55.9036 32.0616 175.0293 33 G 3.9899 7.5124 106.9528 45.3204 0.0000 170.4747 34 S 5.1744 7.8624 113.1488 56.4163 65.7307 173.3075 35 I 5.0495 8.7546 127.2087 59.3325 40.4866 174.7265 36 K 4.8325 9.2295 125.2230 55.5320 36.3006 176.9323 37 G 3.7914 8.8075 105.3961 46.6649 0.0000 173.3228 38 L 4.5383 7.5820 119.8010 52.8217 43.2779 176.4331 39 T 4.3620 8.1411 111.1954 61.0948 69.5277 174.0877 40 E 4.1552 8.5413 124.6253 57.7306 30.5577 175.3451 41 G 3.8188 8.5997 110.0129 43.8992 0.0000 172.3671 42 L 4.7487 8.2196 118.9479 54.8813 42.8360 176.5506 43 H 4.9922 9.2557 119.5963 53.7022 32.7781 173.4824 44 G 4.0809 9.0934 110.9191 46.6402 0.0000 172.5715 45 F 5.3873 9.0044 124.4809 57.1868 42.5227 172.9527 46 H 5.1682 8.8735 122.6163 54.1619 33.8672 172.6272 47 V 4.4251 8.6254 121.3934 62.3936 32.8512 175.1548 48 H 5.0339 9.4016 125.5530 54.5130 30.6393 176.0441 49 E 3.6680 8.9873 122.2089 58.8876 29.8484 177.0423 50 F 4.9652 8.0292 118.3172 54.9233 41.4800 176.9039 51 G 4.4627 8.3782 112.3570 44.5999 0.0000 174.1253 52 D 4.8071 7.9808 117.9257 52.7146 42.7052 174.5081 53 N 5.2841 8.7868 123.6239 52.3701 39.2012 176.4012 54 T 3.9636 8.4388 111.6329 63.8507 69.0231 174.2195 55 A 4.6980 7.9554 125.4836 51.4428 19.6808 177.2036 56 G 3.8177 8.0016 111.0191 47.4578 0.0000 176.2697 57 C 4.4341 8.6187 115.3845 59.8719 35.4635 175.6875 58 T 3.8777 7.9496 117.7921 66.5161 67.8878 175.6873 59 S 4.4665 7.9320 112.3290 59.4812 63.5501 175.2069 60 A 4.6117 7.4914 126.0139 53.9215 18.3650 178.5410 61 G 4.2334 8.0950 106.0701 43.9947 0.0000 170.5644 62 P 4.7186 0.0000 0.0000 61.8569 34.0943 174.9710 63 H 4.5321 8.3655 116.3655 55.7669 29.5346 175.6439 64 F 4.2509 9.0303 125.4955 58.2348 40.1915 175.1846 65 N 5.1451 7.9454 125.2356 51.8469 39.2045 172.9223 66 P 4.1780 0.0000 0.0000 65.2336 32.1330 178.0329 67 L 4.2043 7.6498 116.4611 54.0048 42.1375 176.3355 68 S 3.5955 7.4136 114.3028 59.8156 60.6856 171.2818 69 R 4.6017 8.3492 117.8636 54.3511 32.7864 176.5155 70 K 4.4437 9.2433 118.6108 55.7734 33.7439 176.5523 71 H 4.0679 8.7275 123.0524 56.9265 30.5211 174.7868 72 G 4.1504 7.4492 109.6402 45.6798 0.0000 172.1950 73 G 4.1337 9.1413 109.5443 43.3616 0.0000 173.3453 74 P 4.3801 0.0000 0.0000 65.2276 31.2328 177.5647 75 K 4.2469 7.8970 116.0682 57.0986 32.5448 176.5963 76 D 4.6490 7.6438 119.4380 53.5037 41.6680 176.3443 77 E 3.9024 8.6774 123.4322 58.9695 29.6145 176.5058 78 E 4.1717 8.0135 121.4617 55.8271 28.7888 174.9775 79 R 4.7557 7.5923 119.9559 56.2291 32.1344 174.4621 80 H 4.5472 9.1698 116.5865 55.2369 29.5629 176.8317 81 V 3.4430 8.2141 122.1553 66.1439 31.7270 177.0435 82 G 3.9240 8.4119 105.3932 46.9610 0.0000 173.5874 83 D 4.8913 8.1021 121.5005 53.5942 39.8455 175.6615 84 L 4.5056 8.4226 120.2769 53.1607 42.5329 178.4161 85 G 3.9776 8.4387 108.7810 46.8736 0.0000 174.0067 86 N 5.6228 8.7158 121.1738 51.4100 41.6286 173.7016 87 V 4.4485 8.7405 113.8681 59.8768 35.6425 174.7109 88 T 5.0075 8.2714 118.7042 61.8529 71.1859 173.0229 89 A 4.8130 8.9193 129.0644 50.6573 21.2675 177.2373 90 D 4.8952 8.8163 122.3349 51.9670 41.4113 177.1526 91 K 4.1552 8.5320 117.1984 59.7387 32.4975 177.1423 92 D 4.5910 8.3441 117.8049 54.0548 41.1143 176.8728 93 G 4.3538 8.5099 108.1028 44.5189 0.0000 172.6982 94 V 4.8047 8.1336 119.7522 60.7708 33.9021 174.4208 95 A 5.1442 8.9182 130.2887 49.8812 20.4820 175.4283 96 D 4.9263 8.5492 123.0284 53.8248 40.2605 175.9109 97 V 3.5988 8.6011 123.4970 62.8392 33.0712 174.9838 98 S 4.5695 8.3869 122.6035 57.6810 63.9463 172.7476 99 I 4.8395 9.1610 127.8247 59.3136 41.5879 174.1391 100 E 5.2211 8.8183 125.2758 54.5664 32.5094 174.3290 101 D 4.8139 9.2199 125.3694 52.9006 44.6510 175.5119 102 S 4.7179 8.8566 119.6315 58.5054 63.8245 175.8522 103 V 3.8210 8.0434 121.4227 65.0222 31.7911 176.5667 104 I 4.1308 7.9678 111.5877 61.0748 38.3101 174.6032 105 S 4.6455 8.4899 113.7682 57.5714 65.3362 174.2372 106 L 4.4528 8.8804 123.5585 54.3710 41.6297 176.1479 107 S 4.5017 7.8581 112.6376 57.7926 66.5679 174.9885 108 G 3.8859 8.5243 107.7495 45.3059 0.0000 173.5680 109 D 4.4091 8.9690 117.9376 57.8366 41.0703 177.3356 110 H 5.0697 8.0411 114.4139 55.6778 29.1431 174.2419 111 C 4.6123 7.9023 120.6197 59.8272 31.8634 173.3435 112 I 3.9703 8.1613 118.9651 60.2980 37.9528 175.5278 113 I 3.7126 7.2334 122.9039 62.8311 37.5370 176.4018 114 G 3.8243 9.4248 113.2949 45.3369 0.0000 173.0021 115 R 4.7623 7.3460 119.1172 54.7698 33.6789 174.5147 116 T 5.0023 7.9989 114.9682 62.1543 71.7314 173.4336 117 L 4.7521 8.5608 128.3079 53.9185 44.1004 175.2993 118 V 4.9335 8.6108 125.6243 60.9687 34.9907 174.2277 119 V 5.0559 8.5748 126.9149 60.4930 33.8520 174.7708 120 H 5.2487 8.9179 120.8826 53.9920 30.9688 174.5241 121 E 4.2089 9.1958 121.2068 58.9752 30.0187 176.3854 122 K 4.8091 8.4549 116.9714 53.7242 36.3684 175.7543 123 A 4.3520 8.3605 123.3562 52.3323 18.8596 176.1758 124 D 5.0358 9.2834 122.3249 53.6012 41.4265 176.1707 125 D 4.5861 9.2338 125.6788 53.1768 39.9626 176.6201 126 L 3.4587 9.7951 119.5713 56.1990 39.6782 175.9500 127 G 4.2105 8.7092 104.3727 45.9595 0.0000 174.8392 128 K 4.5092 8.1208 116.8261 55.9999 32.1996 177.5079 129 G 3.7287 7.7967 108.1599 45.0941 0.0000 175.5127 130 G 3.8861 8.4220 107.5154 45.7320 0.0000 172.3669 131 N 5.0974 7.6362 115.1342 50.2101 41.0742 173.9808 132 E 4.0348 8.7444 118.4588 59.2724 30.0629 178.3172 133 E 3.9534 8.2428 118.7227 59.2917 29.5233 178.5244 134 S 4.1694 8.6112 113.7804 61.3058 62.4336 175.5097 135 T 4.2976 7.8911 109.9995 62.5355 68.6217 175.6895 136 K 4.2861 7.6962 119.8831 57.8076 33.7568 176.7515 137 T 4.0892 8.0059 106.3462 60.1998 70.0150 175.2505 138 G 4.0731 8.1551 110.1829 45.4933 0.0000 173.4640 139 N 4.2950 7.8232 114.7615 54.2063 36.6311 175.3211 140 A 4.5340 7.0464 118.1176 51.0634 19.5994 179.9089 141 G 3.9559 7.4207 104.8347 45.6428 0.0000 173.8022 142 S 4.4337 8.7664 116.1089 58.4974 64.8895 174.2251 143 R 4.4231 8.3311 119.7332 55.1010 29.9475 176.5193 144 L 4.3248 8.8593 125.8011 57.3826 43.0876 177.1507 145 A 5.0264 7.7531 117.8414 51.3559 22.8097 174.0218 146 C 5.0821 9.1726 114.0237 55.0988 46.5417 172.5879 147 G 4.6360 8.4530 104.4370 46.3016 0.0000 172.5785 148 V 4.5698 8.2228 120.4878 61.9540 32.9670 175.5163 149 I 4.1072 8.7980 129.3578 61.0659 37.8897 175.2732 150 G 4.4205 8.9669 114.8552 43.8921 0.0000 172.1639 151 I 4.3476 8.3165 121.8559 61.1411 37.7168 175.3387 152 A 4.8293 8.4994 127.1588 49.6808 22.4455 176.0271 153 Q 4.0702 8.5492 118.6795 56.4422 29.2202 175.9545 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 A 8.26 4.68 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 2 T 9.13 4.65 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 1.22 0.00 0.00 3 K 9.00 5.31 0.00 1.85 1.71 0.00 1.70 0.00 0.00 2.00 0.00 0.00 3.05 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.56 1.50 7.81 4 A 9.29 5.36 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 0.00 0.00 0.00 0.00 0.00 5 V 8.89 5.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 6 C 9.11 4.93 0.00 3.14 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 7 V 8.48 4.59 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 8.94 4.83 0.00 1.71 1.59 1.04 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.07 4.87 0.00 1.64 1.62 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 7.96 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 0.00 0.00 0.00 0.00 11 D 8.79 4.58 0.00 2.68 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 12 G 7.56 4.39 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 0.00 13 P 0.00 4.47 0.00 2.22 2.29 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.94 0.00 14 V 7.78 4.93 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 0.57 0.00 0.00 0.91 0.00 0.00 15 Q 8.23 4.80 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.48 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 16 G 8.22 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 0.00 0.00 0.00 0.00 17 I 8.02 5.19 1.81 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 1.20 1.51 0.82 0.00 0.00 18 I 8.87 4.58 1.83 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 1.26 1.21 0.43 0.00 0.00 19 N 8.50 4.97 0.00 1.44 1.42 0.00 0.00 6.44 8.77 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 20 F 8.94 5.45 0.00 2.92 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 21 E 9.77 5.24 0.00 2.45 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 0.00 2.31 2.39 0.00 22 Q 9.41 4.94 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.59 0.00 0.00 0.00 0.00 0.00 2.43 2.54 0.00 23 K 9.03 4.11 0.00 1.81 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.49 7.81 24 E 7.78 4.81 0.00 1.98 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 2.30 2.28 0.00 25 S 8.54 4.30 0.00 3.98 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 26 N 8.98 4.21 0.00 2.88 2.98 0.00 0.00 7.05 7.98 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 27 G 7.93 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.61 0.00 1.99 2.15 0.00 3.72 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.95 0.00 29 V 8.89 4.62 2.33 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 1.30 0.00 0.00 1.09 0.00 0.00 30 K 9.39 4.94 0.00 1.85 1.77 0.00 1.57 0.00 0.00 1.37 0.00 0.00 2.79 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.42 7.81 31 V 9.13 4.87 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 0.82 0.00 0.00 1.09 0.00 0.00 32 W 7.52 5.82 0.00 3.52 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 33 G 7.51 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 0.00 0.00 0.00 34 S 7.86 5.17 0.00 3.87 3.65 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 35 I 8.75 5.05 1.81 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 1.29 0.46 0.89 0.00 0.00 36 K 9.23 4.83 0.00 1.72 1.88 0.00 1.33 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.34 7.81 37 G 8.81 3.79 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 0.00 38 L 7.58 4.54 0.00 1.80 1.41 0.81 0.41 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 39 T 8.14 4.36 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 40 E 8.54 4.16 0.00 1.96 1.91 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 2.30 2.48 0.00 41 G 8.60 3.82 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 0.00 0.00 0.00 42 L 8.22 4.75 0.00 1.51 1.59 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.26 4.99 0.00 3.02 3.32 0.00 5.62 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 44 G 9.09 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 0.00 0.00 0.00 45 F 9.00 5.39 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 46 H 8.87 5.17 0.00 3.13 2.89 0.00 5.67 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 47 V 8.63 4.43 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 0.97 0.00 0.00 0.91 0.00 0.00 48 H 9.40 5.03 0.00 3.07 3.43 0.00 5.69 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.99 3.67 0.00 1.60 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 1.47 2.01 0.00 50 F 8.03 4.97 0.00 3.19 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 51 G 8.38 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.98 4.81 0.00 2.63 2.81 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 53 N 8.79 5.28 0.00 2.71 2.77 0.00 0.00 7.30 7.54 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 54 T 8.44 3.96 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 1.24 0.00 0.00 55 A 7.96 4.70 1.23 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 56 G 8.00 3.82 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 0.00 0.00 0.00 57 C 8.62 4.43 0.00 2.96 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.95 3.88 4.42 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 1.23 0.00 0.00 59 S 7.93 4.47 0.00 4.14 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 60 A 7.49 4.61 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 61 G 8.09 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 62 P 0.00 4.72 0.00 2.03 2.21 0.00 3.61 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 63 H 8.37 4.53 0.00 2.82 3.19 0.00 5.73 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 64 F 9.03 4.25 0.00 2.88 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 65 N 7.95 5.15 0.00 2.61 2.45 0.00 0.00 6.94 7.71 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 66 P 0.00 4.18 0.00 2.07 1.98 0.00 2.98 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 1.49 1.11 0.00 67 L 7.65 4.20 0.00 1.56 1.69 0.91 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 68 S 7.41 3.60 0.00 3.96 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.35 4.60 0.00 1.85 1.92 0.00 3.12 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 70 K 9.24 4.44 0.00 1.60 1.69 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.52 7.81 71 H 8.73 4.07 0.00 3.19 3.26 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.45 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 9.14 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.38 0.00 2.23 2.37 0.00 3.79 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 2.05 0.00 75 K 7.90 4.25 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.64 4.65 0.00 2.83 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.68 3.90 0.00 1.90 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 2.28 2.34 0.00 78 E 8.01 4.17 0.00 2.06 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 2.34 2.31 0.00 79 R 7.59 4.76 0.00 1.95 1.86 0.00 2.85 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.53 0.00 80 H 9.17 4.55 0.00 3.47 3.37 0.00 5.65 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 V 8.21 3.44 1.45 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 0.76 0.00 0.00 0.40 0.00 0.00 82 G 8.41 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 83 D 8.10 4.89 0.00 2.68 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 84 L 8.42 4.51 0.00 1.94 1.94 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.44 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 0.00 0.00 0.00 86 N 8.72 5.62 0.00 2.60 2.72 0.00 0.00 6.55 7.68 0.00 0.00 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 V 8.74 4.45 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.75 0.00 0.00 88 T 8.27 5.01 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 1.20 0.00 0.00 89 A 8.92 4.81 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 90 D 8.82 4.90 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 91 K 8.53 4.16 0.00 1.88 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 8.34 4.59 0.00 2.79 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 93 G 8.51 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.13 4.80 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 0.93 0.00 0.00 0.92 0.00 0.00 95 A 8.92 5.14 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.55 4.93 0.00 2.56 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 97 V 8.60 3.60 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.65 0.00 0.00 98 S 8.39 4.57 0.00 3.89 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 99 I 9.16 4.84 1.98 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 1.16 0.53 1.03 0.00 0.00 100 E 8.82 5.22 0.00 1.95 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 101 D 9.22 4.81 0.00 2.89 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.86 4.72 0.00 3.93 3.86 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 0.00 0.00 0.00 103 V 8.04 3.82 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 0.82 0.00 0.00 0.95 0.00 0.00 104 I 7.97 4.13 1.96 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 0.82 1.05 0.00 0.00 105 S 8.49 4.65 0.00 3.87 3.82 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 0.00 106 L 8.88 4.45 0.00 1.79 1.64 1.06 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.86 4.50 0.00 3.97 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 0.00 108 G 8.52 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 0.00 109 D 8.97 4.41 0.00 2.63 2.80 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 0.00 110 H 8.04 5.07 0.00 3.23 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.90 4.61 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 0.00 112 I 8.16 3.97 1.63 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.13 0.97 0.00 0.00 113 I 7.23 3.71 1.78 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.73 0.83 0.00 0.00 114 G 9.42 3.82 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 0.00 0.00 0.00 115 R 7.35 4.76 0.00 1.62 1.81 0.00 2.21 0.00 0.00 2.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.30 0.00 116 T 8.00 5.00 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 0.00 117 L 8.56 4.75 0.00 1.79 1.51 0.35 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.61 4.93 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 0.69 0.00 0.00 0.70 0.00 0.00 119 V 8.57 5.06 2.33 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 0.82 0.00 0.00 1.01 0.00 0.00 120 H 8.92 5.25 0.00 3.31 3.56 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.20 4.21 0.00 2.12 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 0.00 2.36 2.34 0.00 122 K 8.45 4.81 0.00 1.77 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.36 1.48 7.81 123 A 8.36 4.35 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 0.00 124 D 9.28 5.04 0.00 2.71 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 0.00 125 D 9.23 4.59 0.00 2.92 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 0.00 126 L 9.80 3.46 0.00 1.86 1.77 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.71 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 0.00 0.00 0.00 128 K 8.12 4.51 0.00 1.87 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.52 7.81 129 G 7.80 3.73 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 0.00 0.00 0.00 130 G 8.42 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 0.00 131 N 7.64 5.10 0.00 2.76 2.77 0.00 0.00 6.14 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.74 4.03 0.00 2.02 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 2.37 2.30 0.00 133 E 8.24 3.95 0.00 2.11 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 0.00 2.46 2.42 0.00 134 S 8.61 4.17 0.00 4.08 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.89 4.30 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 1.26 0.00 0.00 136 K 7.70 4.29 0.00 1.67 1.81 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.33 1.63 7.81 137 T 8.01 4.09 4.17 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 1.15 0.00 0.00 138 G 8.16 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 7.82 4.30 0.00 3.07 2.89 0.00 0.00 6.88 6.81 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 0.00 140 A 7.05 4.53 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 7.42 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 142 S 8.77 4.43 0.00 3.94 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 0.00 143 R 8.33 4.42 0.00 1.68 1.84 0.00 3.19 0.00 0.00 3.14 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.65 0.00 144 L 8.86 4.32 0.00 1.73 1.70 0.94 0.50 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 0.00 145 A 7.75 5.03 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 C 9.17 5.08 0.00 3.00 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 0.00 147 G 8.45 4.64 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 0.00 0.00 0.00 148 V 8.22 4.57 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 0.82 0.00 0.00 0.96 0.00 0.00 149 I 8.80 4.11 1.78 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.38 0.35 0.00 0.00 150 G 8.97 4.42 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 0.00 151 I 8.32 4.35 1.85 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 1.25 0.54 0.91 0.00 0.00 152 A 8.50 4.83 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 0.00 153 Q 8.55 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00