NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 S 4.3689 8.3231 115.4121 58.1071 64.3112 172.0188 30 G 3.7159 8.2909 109.5590 44.4172 0.0000 171.4525 31 I 3.6856 8.4196 120.1976 61.6115 38.2772 173.9511 32 S 4.7490 8.5800 119.4296 56.4940 64.2497 173.2398 33 L 4.3859 8.5858 126.4231 54.3479 43.2839 176.1064 34 D 4.3717 7.8852 116.3377 55.5008 38.0676 173.7037 35 N 4.6664 8.0645 114.0333 53.4573 39.7688 175.8526 36 S 4.7022 7.4654 111.9134 55.8675 65.9984 173.4999 37 Y 4.2151 8.3375 119.9137 57.9015 38.1931 176.1758 38 K 4.1720 8.8943 124.8625 57.1925 32.0597 176.1414 39 M 4.8750 8.7518 126.1486 55.2765 32.5266 175.8927 40 D 4.9295 7.9124 116.4600 53.2238 39.8949 175.8960 41 Y 4.1838 7.7085 116.9673 57.8422 38.5107 174.2665 42 P 4.4894 0.0000 0.0000 65.3070 32.0125 176.9022 43 E 4.6991 8.4478 117.7148 54.5807 32.7233 177.5994 44 M 3.8254 8.4681 122.7274 58.3693 33.4037 175.4415 45 G 4.2170 7.6214 102.2801 44.1412 0.0000 172.2346 46 L 4.8727 8.5206 118.6300 54.3419 43.8175 176.3596 47 C 4.4997 8.8109 121.2872 57.6402 33.9754 172.1709 48 I 4.5455 8.3420 128.0612 60.1033 38.5244 174.9179 49 I 4.6299 8.6593 128.8791 59.5921 39.5964 174.7994 50 I 4.5864 8.7490 129.3715 59.9208 38.9601 174.6159 51 N 4.9701 9.4050 128.4277 52.0322 39.9146 172.8530 52 N 4.8765 8.8834 124.1199 51.9243 38.9825 174.5437 53 K 4.3313 9.3798 125.9767 57.2127 33.6264 175.7950 54 N 5.2384 8.0084 114.5759 51.3438 40.4239 174.0067 55 F 4.8406 8.6025 120.7384 55.3269 42.1992 175.0738 56 H 4.3618 8.9031 120.7704 55.8104 29.3448 176.7838 57 K 3.8743 8.9845 124.9903 59.5612 32.1533 178.7458 58 S 4.2349 8.1952 112.4566 61.1095 62.8650 175.3364 59 T 4.0265 8.0872 110.5648 62.0113 69.0098 175.9994 60 G 3.8647 7.9460 109.0388 45.8266 0.0000 173.1457 61 M 4.0274 7.5707 119.4778 54.2416 32.7204 176.6035 62 T 4.2473 7.8799 113.1944 60.8044 70.0584 174.5874 63 S 4.7138 8.4510 117.3394 58.8458 64.1541 175.1276 64 R 4.4489 8.6902 123.5923 53.9849 28.5263 175.3976 65 S 4.2782 7.9467 114.3226 59.9379 63.7468 176.0335 66 G 3.9967 8.9268 111.6874 45.9522 0.0000 175.1870 67 T 3.9232 7.7959 113.7466 65.0939 67.1910 175.7856 68 D 4.3343 8.0749 120.6786 57.0627 40.8619 178.6022 69 V 3.6062 7.6653 118.7015 65.9174 31.4337 177.8540 70 D 4.3286 7.9822 117.9295 57.3572 40.8202 178.3480 71 A 3.9588 8.2706 121.2438 55.1929 18.3878 179.5954 72 A 3.9488 8.1728 119.2515 55.1904 18.3727 179.3273 73 N 4.2492 8.2626 115.5811 56.8999 38.9738 177.1009 74 L 4.0942 8.2130 120.5654 57.7148 41.6911 179.4133 75 R 3.9086 8.1248 118.6692 59.4768 30.1503 178.2508 76 E 3.9366 8.2725 119.0020 59.4822 29.2357 178.8080 77 T 3.7494 8.1433 116.0022 66.8676 68.5965 176.7223 78 F 3.8157 8.4572 119.2543 59.8316 38.8967 177.9244 79 R 4.0082 8.0983 119.0839 59.4772 29.7451 177.9220 80 N 4.5949 8.0141 113.7876 54.8224 38.6625 176.1716 81 L 4.4814 7.1700 118.9590 53.8073 42.1204 176.5805 82 K 3.9756 7.9228 117.3283 57.4656 29.7552 175.7010 83 Y 4.3126 8.0755 115.7415 57.4015 39.4615 175.8692 84 E 4.3261 9.1435 124.2986 55.3613 29.8303 174.7351 85 V 4.4766 8.1956 126.4915 62.2346 32.8249 175.1144 86 R 4.6143 8.9338 126.3892 54.5038 33.2482 173.8739 87 N 5.3817 8.8492 122.5848 51.9871 41.4416 174.0386 88 K 4.6963 8.8893 122.9188 54.8637 36.4943 174.9855 89 N 5.2147 8.8165 121.3032 52.1235 41.1776 174.5296 90 D 4.1648 8.1147 119.0823 55.3186 38.8011 173.2013 91 L 4.7151 8.6467 120.9075 53.3029 43.9361 177.5100 92 T 4.7841 9.0433 115.5614 60.4752 71.1869 176.0282 93 R 3.9896 9.5076 118.6166 59.4716 29.1898 178.9324 94 E 3.9959 8.1091 118.7652 59.3797 29.5183 179.0163 95 E 4.0020 8.2397 118.5743 59.1692 29.4332 179.5831 96 I 3.7258 7.8723 120.1034 64.3869 37.1396 178.6052 97 V 3.7380 7.7084 118.6696 65.9694 31.2925 177.6213 98 E 3.8170 8.3731 119.1913 59.0270 29.3901 178.5050 99 L 3.8981 8.1210 120.4936 58.5407 42.1794 178.8819 100 M 4.1769 8.1094 118.5601 58.2830 31.6775 178.7230 101 R 2.5100 7.2738 117.8677 59.0138 30.5851 177.8788 102 D 4.3820 7.9522 118.7613 57.4878 40.9493 179.0993 103 V 3.8054 7.9217 118.9806 66.0310 31.3356 178.1570 104 S 3.9065 7.8006 112.7834 60.3833 62.8055 175.5487 105 K 4.2589 7.2270 119.5648 55.6430 32.3461 176.6279 106 E 4.0669 7.1125 119.2155 55.7428 30.1043 176.2102 107 D 4.5272 8.3038 120.5115 54.1473 40.8234 175.2093 108 H 4.7716 8.5768 123.4106 55.7289 29.0945 177.2938 109 S 4.0451 8.5689 119.0614 61.6696 62.8787 175.7231 110 K 4.5745 8.0130 116.7933 56.2252 32.0935 175.3575 111 R 5.0658 7.4953 118.6743 54.6355 31.2778 176.9362 112 S 4.2175 9.0893 120.3500 61.5488 63.8933 173.7803 113 S 4.6468 8.0414 112.6365 57.7503 66.6425 173.0265 114 F 5.0934 8.7640 120.7778 56.8346 42.9359 173.8770 115 V 4.0952 7.5156 124.7641 60.8176 34.9098 173.6051 116 C 4.6725 8.0180 127.0996 57.3378 34.8745 172.4092 117 V 4.7152 8.8797 126.2228 60.9914 33.9130 173.9285 118 L 4.9498 9.0730 128.1641 52.9893 44.3768 175.3844 119 L 4.9840 8.4077 124.7176 53.9608 44.1234 175.6409 120 S 5.0081 8.1144 117.6450 58.2475 66.7726 175.1441 121 H 4.5991 8.7315 117.3521 56.0336 30.0131 174.7653 122 G 4.5891 8.2249 105.9859 46.6686 0.0000 171.3212 123 E 4.9837 8.4204 118.1547 54.2985 34.8681 174.7195 124 E 3.9196 8.8459 121.1825 58.1665 29.7239 176.9434 125 G 3.9549 9.0773 113.4375 45.7255 0.0000 172.1438 126 I 4.9786 7.9429 120.0334 59.1943 41.5367 174.1939 127 I 4.8127 8.3814 124.8281 59.2595 41.2364 173.9619 128 F 4.9391 9.1739 128.3224 56.5149 39.7480 176.5218 129 G 4.0614 9.5610 114.1391 44.5378 0.0000 174.3235 130 T 4.0645 8.6148 108.9892 63.3545 68.7731 175.4630 131 N 5.0336 9.2029 117.4456 50.9447 38.2396 173.8923 132 G 4.3503 7.1398 108.7057 44.6078 0.0000 170.1879 133 P 4.4823 0.0000 0.0000 62.3114 32.6963 175.9935 134 V 4.3834 8.3166 120.4071 61.0158 35.0826 174.3365 135 D 4.7426 8.6821 127.9643 54.2307 41.3619 177.4541 136 L 3.9459 8.8722 124.0638 57.8001 41.5774 179.7164 137 K 3.8552 7.8894 120.4120 58.7591 31.8756 178.5723 138 K 3.7260 7.5618 118.7687 59.2265 32.4835 178.7734 139 I 4.2031 7.5079 119.9588 64.7701 37.0252 178.4054 140 T 4.0417 8.0593 110.6666 64.6120 68.5355 176.2576 141 N 4.3270 8.2198 119.6169 56.2151 38.2225 177.1268 142 F 4.2383 7.3766 117.0163 59.5855 38.8887 176.0119 143 F 4.6696 7.8248 115.0383 56.8776 39.3961 176.2028 144 R 4.1224 7.8013 121.3400 56.2019 30.4012 177.9782 145 G 3.7823 8.7820 109.4198 48.2403 0.0000 174.0645 146 D 4.6969 8.0109 116.6399 53.4896 40.2822 176.9426 147 R 4.4468 7.8470 117.7261 56.5345 31.8061 176.0140 148 C 4.6882 7.5107 117.4621 56.7272 31.9020 173.8758 149 R 4.4745 8.4481 123.4690 58.1165 30.1445 178.6757 150 S 4.4378 8.0356 109.7609 59.3974 63.4095 174.2519 151 L 4.6033 7.8465 120.4370 54.5066 43.0164 176.4032 152 T 4.0273 7.5867 117.3486 65.0586 68.6609 175.3837 153 G 4.1229 9.0707 113.7492 45.4056 0.0000 173.0875 154 K 4.5386 7.7350 118.8728 53.3137 34.6490 174.2232 155 P 4.1205 0.0000 0.0000 62.7431 32.4592 175.1102 156 K 4.6231 8.6864 123.0757 54.7872 34.2690 175.1586 157 L 4.6561 8.7007 126.4680 52.8685 43.9077 175.7886 158 F 4.8647 8.8770 122.2034 55.7405 41.6021 174.6349 159 I 4.3906 8.7249 126.0643 59.6895 39.0024 174.9327 160 I 4.8484 8.4442 128.0957 59.6124 39.8636 175.2136 161 Q 4.5130 8.7285 130.0459 55.1890 29.8225 173.9794 162 A 4.8142 7.9495 125.6143 51.2699 21.8573 175.3750 163 C 4.3910 8.9072 116.9747 59.7588 29.1127 174.0356 164 R 4.5866 9.4836 117.6572 54.2987 31.5309 176.3403 165 G 3.9269 6.9867 105.3867 46.0383 0.0000 173.3026 166 T 4.5465 7.9888 112.0151 61.3041 69.1123 173.8185 167 E 4.3278 8.0479 120.7697 56.2574 30.4132 175.8535 168 L 4.6623 8.2099 120.9864 52.9231 44.5554 175.7545 169 D 4.7024 8.4829 122.3718 52.9204 41.2398 176.0066 170 C 4.1434 8.6953 124.7336 60.0765 28.5244 175.0523 171 G 3.9762 8.5901 110.0627 44.6419 0.0000 172.6665 172 I 4.5751 7.7700 117.1666 58.8344 40.8868 174.3461 173 E 4.0876 8.8705 127.4794 56.7668 29.9919 177.0449 174 T 4.1853 8.3987 112.1341 61.7665 69.0272 174.1675 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 29 S 8.32 4.37 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 30 G 8.29 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 0.00 0.00 0.00 31 I 8.42 3.69 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 1.30 0.57 0.91 0.00 0.00 32 S 8.58 4.75 0.00 3.79 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 33 L 8.59 4.39 0.00 1.65 1.67 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.89 4.37 0.00 2.76 2.69 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 0.00 0.00 0.00 35 N 8.06 4.67 0.00 2.68 2.82 0.00 0.00 6.96 7.57 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 36 S 7.47 4.70 0.00 3.95 3.78 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 37 Y 8.34 4.22 0.00 3.08 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 38 K 8.89 4.17 0.00 1.79 1.97 0.00 1.57 0.00 0.00 1.40 0.00 0.00 2.38 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.42 7.81 39 M 8.75 4.87 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.78 0.00 40 D 7.91 4.93 0.00 2.72 2.70 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 0.00 0.00 0.00 0.00 41 Y 7.71 4.18 0.00 3.17 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 42 P 0.00 4.49 0.00 1.98 2.16 0.00 4.01 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 43 E 8.45 4.70 0.00 2.01 1.76 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 2.20 2.25 0.00 44 M 8.47 3.83 0.00 0.67 1.67 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.31 0.00 45 G 7.62 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 0.00 0.00 0.00 0.00 46 L 8.52 4.87 0.00 1.84 1.68 1.16 0.74 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 47 C 8.81 4.50 0.00 2.46 2.58 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 0.00 48 I 8.34 4.55 1.76 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 1.24 1.15 0.93 0.00 0.00 49 I 8.66 4.63 1.92 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.55 0.91 0.00 0.00 50 I 8.75 4.59 1.89 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 1.13 0.68 0.93 0.00 0.00 51 N 9.40 4.97 0.00 2.75 2.96 0.00 0.00 6.75 6.64 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 52 N 8.88 4.88 0.00 2.82 2.32 0.00 0.00 6.79 7.23 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 53 K 9.38 4.33 0.00 1.73 1.73 0.00 1.61 0.00 0.00 1.90 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.59 7.81 54 N 8.01 5.24 0.00 2.82 2.71 0.00 0.00 6.72 7.45 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 55 F 8.60 4.84 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 H 8.90 4.36 0.00 3.32 3.26 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.98 3.87 0.00 1.81 1.85 0.00 1.74 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.47 7.81 58 S 8.20 4.23 0.00 4.06 4.04 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 59 T 8.09 4.03 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 1.38 0.00 0.00 60 G 7.95 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 0.00 0.00 0.00 61 M 7.57 4.03 0.00 1.20 1.62 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 2.25 1.89 0.00 62 T 7.88 4.25 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 1.16 0.00 0.00 63 S 8.45 4.71 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 64 R 8.69 4.45 0.00 1.97 1.94 0.00 2.90 0.00 0.00 3.68 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.67 0.00 65 S 7.95 4.28 0.00 3.98 3.91 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 66 G 8.93 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 0.00 0.00 0.00 67 T 7.80 3.92 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 1.30 0.00 0.00 68 D 8.07 4.33 0.00 2.73 2.70 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 0.00 0.00 0.00 0.00 69 V 7.67 3.61 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 1.03 0.00 0.00 0.94 0.00 0.00 70 D 7.98 4.33 0.00 2.95 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 71 A 8.27 3.96 1.35 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 72 A 8.17 3.95 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 73 N 8.26 4.25 0.00 2.96 2.96 0.00 0.00 7.25 6.01 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 74 L 8.21 4.09 0.00 1.92 1.80 0.96 1.20 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 75 R 8.12 3.91 0.00 2.01 2.12 0.00 3.10 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 76 E 8.27 3.94 0.00 2.14 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 0.00 2.30 2.38 0.00 77 T 8.14 3.75 4.10 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 0.85 0.00 0.00 78 F 8.46 3.82 0.00 3.15 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 79 R 8.10 4.01 0.00 2.09 2.17 0.00 3.11 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 80 N 8.01 4.59 0.00 2.89 2.85 0.00 0.00 7.04 7.48 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 81 L 7.17 4.48 0.00 2.00 1.94 0.63 0.86 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 82 K 7.92 3.98 0.00 1.87 1.93 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.52 7.81 83 Y 8.08 4.31 0.00 3.17 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 84 E 9.14 4.33 0.00 2.06 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 2.27 0.00 85 V 8.20 4.48 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 0.82 0.00 0.00 1.11 0.00 0.00 86 R 8.93 4.61 0.00 1.75 1.78 0.00 3.18 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 87 N 8.85 5.38 0.00 2.68 2.67 0.00 0.00 6.99 6.68 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 88 K 8.89 4.70 0.00 1.65 1.61 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.55 7.81 89 N 8.82 5.21 0.00 2.55 2.66 0.00 0.00 7.32 8.06 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 90 D 8.11 4.16 0.00 2.67 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.65 4.72 0.00 1.65 1.56 0.93 0.65 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 92 T 9.04 4.78 4.53 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 1.22 0.00 0.00 93 R 9.51 3.99 0.00 2.03 2.45 0.00 2.82 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.70 0.00 94 E 8.11 4.00 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 95 E 8.24 4.00 0.00 2.24 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 2.33 2.36 0.00 96 I 7.87 3.73 2.08 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 1.45 0.95 0.99 0.00 0.00 97 V 7.71 3.74 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 1.32 0.00 0.00 1.10 0.00 0.00 98 E 8.37 3.82 0.00 2.15 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 0.00 2.40 2.28 0.00 99 L 8.12 3.90 0.00 1.88 1.91 0.94 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 100 M 8.11 4.18 0.00 2.38 2.18 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 3.01 0.00 101 R 7.27 2.51 0.00 0.93 1.71 0.00 3.16 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.32 0.00 102 D 7.95 4.38 0.00 2.87 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 0.00 103 V 7.92 3.81 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 1.27 0.00 0.00 1.04 0.00 0.00 104 S 7.80 3.91 0.00 3.41 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 0.00 105 K 7.23 4.26 0.00 1.81 1.81 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.49 7.81 106 E 7.11 4.07 0.00 2.01 1.73 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 2.29 2.38 0.00 107 D 8.30 4.53 0.00 2.60 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 0.00 108 H 8.58 4.77 0.00 3.31 3.24 0.00 5.70 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 0.00 109 S 8.57 4.05 0.00 3.88 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 0.00 110 K 8.01 4.57 0.00 1.83 1.87 0.00 1.66 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.54 1.48 7.81 111 R 7.50 5.07 0.00 1.77 1.82 0.00 3.20 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 112 S 9.09 4.22 0.00 3.86 4.04 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 0.00 113 S 8.04 4.65 0.00 4.01 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 0.00 114 F 8.76 5.09 0.00 2.98 2.69 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 0.00 0.00 0.00 115 V 7.52 4.10 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 -0.08 0.00 0.00 0.32 0.00 0.00 116 C 8.02 4.67 0.00 2.26 1.77 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 0.00 117 V 8.88 4.72 1.92 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 0.96 0.00 0.00 0.58 0.00 0.00 118 L 9.07 4.95 0.00 1.63 1.60 1.04 0.41 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 0.00 119 L 8.41 4.98 0.00 1.58 1.60 0.97 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 120 S 8.11 5.01 0.00 4.01 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 0.00 121 H 8.73 4.60 0.00 2.85 2.89 0.00 5.71 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 0.00 122 G 8.22 4.59 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 0.00 0.00 0.00 123 E 8.42 4.98 0.00 1.93 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 2.39 2.62 0.00 124 E 8.85 3.92 0.00 2.10 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 2.30 2.38 0.00 125 G 9.08 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 0.00 0.00 0.00 126 I 7.94 4.98 1.73 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 1.11 1.04 0.39 0.00 0.00 127 I 8.38 4.81 1.89 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.73 1.00 0.00 0.00 128 F 9.17 4.94 0.00 3.23 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 0.00 129 G 9.56 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 0.00 0.00 0.00 130 T 8.61 4.06 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 0.97 0.00 0.00 131 N 9.20 5.03 0.00 2.83 2.72 0.00 0.00 5.94 7.00 0.00 0.00 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 G 7.14 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 0.00 133 P 0.00 4.48 0.00 1.71 1.17 0.00 3.77 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 1.90 1.91 0.00 134 V 8.32 4.38 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 0.99 0.00 0.00 0.95 0.00 0.00 135 D 8.68 4.74 0.00 2.62 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 L 8.87 3.95 0.00 1.62 1.64 0.88 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 137 K 7.89 3.86 0.00 1.79 1.72 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.33 7.81 138 K 7.56 3.73 0.00 1.75 1.93 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.30 7.81 139 I 7.51 4.20 2.08 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.77 1.23 0.00 0.00 140 T 8.06 4.04 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 0.29 0.00 0.00 141 N 8.22 4.33 0.00 2.45 2.66 0.00 0.00 6.88 7.75 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 0.00 142 F 7.38 4.24 0.00 2.79 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 0.00 143 F 7.82 4.67 0.00 3.34 3.13 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 0.00 144 R 7.80 4.12 0.00 1.97 2.04 0.00 3.18 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 145 G 8.78 3.78 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 0.00 0.00 0.00 146 D 8.01 4.70 0.00 2.79 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 R 7.85 4.45 0.00 1.79 1.97 0.00 3.24 0.00 0.00 3.09 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 148 C 7.51 4.69 0.00 2.95 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 0.00 149 R 8.45 4.47 0.00 1.88 1.98 0.00 3.77 0.00 0.00 3.35 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.53 0.00 150 S 8.04 4.44 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 0.00 151 L 7.85 4.60 0.00 1.85 1.69 0.73 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 152 T 7.59 4.03 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 1.25 0.00 0.00 153 G 9.07 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 0.00 154 K 7.73 4.54 0.00 1.83 1.73 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.13 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.30 1.31 7.81 155 P 0.00 4.12 0.00 1.85 1.24 0.00 3.49 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.51 0.00 156 K 8.69 4.62 0.00 1.79 2.00 0.00 1.97 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.41 1.65 7.81 157 L 8.70 4.66 0.00 1.23 1.45 0.88 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 158 F 8.88 4.86 0.00 2.84 2.96 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 0.00 159 I 8.72 4.39 1.77 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 1.21 0.56 0.92 0.00 0.00 160 I 8.44 4.85 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.69 0.95 0.00 0.00 161 Q 8.73 4.51 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 162 A 7.95 4.81 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 0.00 163 C 8.91 4.39 0.00 3.19 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 0.00 164 R 9.48 4.59 0.00 1.75 2.06 0.00 3.36 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 165 G 6.99 3.93 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 0.00 166 T 7.99 4.55 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 1.21 0.00 0.00 167 E 8.05 4.33 0.00 1.99 1.92 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 2.30 2.33 0.00 168 L 8.21 4.66 0.00 1.58 1.53 0.92 1.00 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 0.00 169 D 8.48 4.70 0.00 2.63 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 0.00 170 C 8.70 4.14 0.00 3.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 G 8.59 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 0.00 172 I 7.77 4.58 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 0.77 0.91 0.00 0.00 173 E 8.87 4.09 0.00 2.00 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 2.31 2.30 0.00 174 T 8.40 4.19 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 1.21 0.00 0.00