NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3507 8.2649 123.5841 52.4512 19.3709 176.3230 2 T 4.4092 8.4232 119.5145 65.2715 70.0393 173.6062 3 K 5.1846 8.2064 120.1849 54.5851 35.9892 175.2255 4 V 5.0492 9.0843 123.8583 61.3549 35.6540 174.2484 5 V 5.0629 9.0681 123.3558 60.5325 35.5286 173.4594 6 C 4.9166 9.1306 121.7611 57.9995 35.4574 172.5394 7 V 4.7009 8.4266 125.9588 61.3582 33.3383 174.1659 8 L 4.8541 8.7030 128.7435 54.0707 42.9988 176.1628 9 K 4.8536 9.1973 122.5294 55.4908 37.0380 176.3056 10 G 4.1291 7.9987 108.1957 46.2672 0.0000 172.2910 11 D 4.6226 8.8187 118.2056 55.0783 42.2036 177.3866 12 G 4.2107 7.6800 109.7793 44.6453 0.0000 172.2898 13 P 4.5233 0.0000 0.0000 62.6760 31.9377 175.2604 14 V 4.8808 7.8021 120.1303 62.3618 31.8101 174.9605 15 Q 4.7656 8.1756 125.0266 55.3987 32.4306 174.0524 16 G 4.0914 8.0873 105.2313 46.5727 0.0000 171.7129 17 I 5.1885 8.1390 119.6209 59.7499 41.5877 174.8041 18 I 4.7817 8.7094 127.0952 59.4991 40.6521 174.3822 19 N 5.0821 8.5605 123.9911 51.5518 41.2042 173.9611 20 F 5.4707 9.0129 119.6056 55.9506 43.4837 173.5951 21 E 5.3823 9.6205 123.1765 54.9103 33.4720 173.6044 22 Q 4.7955 9.4153 127.1503 54.6970 32.1280 175.5299 23 K 4.2960 9.0001 124.3674 56.9781 33.6313 176.2835 24 E 4.8620 7.7427 115.8945 53.9583 33.2742 175.9705 25 S 4.2552 8.7693 115.6820 61.5864 63.3304 175.0557 26 N 4.7454 7.9455 118.5117 53.2219 38.9025 174.2071 27 G 4.3082 7.6552 104.1981 42.3270 0.0000 170.8784 28 P 4.5621 0.0000 0.0000 63.0568 32.1577 175.5394 29 V 4.5799 8.9117 122.5619 61.3988 33.6771 174.5905 30 K 4.9352 9.2118 128.6360 55.7171 33.7393 176.1122 31 V 4.9099 9.3295 125.4368 59.6039 33.7719 174.7469 32 W 5.4113 9.2131 121.8500 54.2814 32.0885 175.5667 33 G 3.7101 7.2521 106.2035 46.0723 0.0000 170.9308 34 S 5.0561 7.9486 114.5469 56.7870 66.4024 174.4312 35 I 5.1862 8.7793 126.4043 59.3812 41.0739 174.4982 36 K 4.8415 9.1192 124.1412 55.7006 36.5732 176.8329 37 G 4.0161 8.7006 104.9851 46.6483 0.0000 173.5714 38 L 4.4206 7.5790 120.0444 53.2635 43.0412 176.4135 39 T 4.5003 8.0048 110.5524 60.4668 70.0911 174.1709 40 E 4.3058 8.3706 123.1534 57.4639 31.0311 176.5335 41 G 3.9394 8.7455 109.7161 44.0364 0.0000 172.2556 42 L 4.8500 8.1317 120.9098 54.8474 43.0585 176.5281 43 H 5.0530 9.0542 119.0168 53.7479 33.2116 173.3234 44 G 4.0415 8.9150 110.7971 46.8363 0.0000 172.5294 45 F 5.4244 8.9240 124.8964 56.9005 42.2095 172.8962 46 H 5.2752 8.7621 122.8501 53.8641 33.5562 172.8745 47 V 4.3268 8.4702 121.6898 62.5870 32.5652 175.2643 48 H 5.0647 9.4554 125.7056 54.5050 30.7124 176.0760 49 E 3.6425 8.8408 121.7542 58.8789 29.8290 176.9867 50 F 4.9475 7.7202 118.2874 54.8840 41.3659 177.0543 51 G 4.4370 8.2781 113.2557 44.1779 0.0000 174.0827 52 D 4.7621 7.8242 116.7776 52.6948 43.1674 174.2407 53 N 5.0949 8.5235 125.2834 53.4720 39.3582 176.4439 54 T 3.8441 9.3421 110.7176 63.5919 68.6271 174.7355 55 A 4.6386 8.1139 123.7765 51.3081 19.9596 177.1419 56 G 3.8554 7.7808 108.5816 46.7732 0.0000 174.4735 57 C 4.3652 8.6501 114.6426 59.7220 36.9406 175.7316 58 T 3.8720 7.9461 117.8803 66.5764 67.9079 175.7373 59 S 4.4223 7.6572 112.8087 59.5484 63.4352 175.3583 60 A 4.4655 7.5982 126.4859 54.0121 18.3530 178.7472 61 G 4.1585 8.2054 106.3105 44.7939 0.0000 170.5867 62 P 4.7520 0.0000 0.0000 61.7855 34.2425 175.0894 63 H 4.4402 8.2692 116.2168 55.5667 29.6511 175.6470 64 F 4.2755 9.1173 125.1301 58.2719 40.2124 175.1231 65 N 5.1625 8.0685 125.3094 51.4674 39.0218 172.8687 66 P 4.1629 0.0000 0.0000 65.0391 31.9573 177.9361 67 L 4.4097 7.6473 116.9349 53.5849 41.9692 176.4149 68 S 3.5915 7.4590 113.3254 59.6376 60.7756 171.7710 69 R 4.4385 8.4870 118.2276 54.6839 32.3939 176.6072 70 K 4.4525 8.8384 118.9109 55.8092 33.7901 176.4789 71 H 4.2066 8.6228 122.1661 56.8655 30.5471 174.7775 72 G 4.2541 7.8185 109.9790 46.6961 0.0000 172.7572 73 G 4.1484 9.2367 109.3524 43.3712 0.0000 173.1773 74 P 4.2967 0.0000 0.0000 65.3914 31.2521 177.9424 75 K 4.3352 7.8315 113.8087 56.5847 32.5990 176.6728 76 D 4.5535 7.8558 120.0766 53.7228 41.4506 176.1843 77 E 3.8852 8.8793 123.9006 58.6248 29.5978 176.3596 78 E 4.4037 7.8229 121.6066 54.9322 29.6660 174.3400 79 R 4.9320 7.6403 120.0876 56.2081 32.0297 174.3844 80 H 4.3801 8.3938 115.9020 55.4477 29.4326 176.8661 81 V 3.4250 8.3219 122.5906 66.3840 31.3488 177.1607 82 G 3.8851 8.2345 104.5551 47.2061 0.0000 173.5440 83 D 4.9906 8.2341 121.2700 53.9283 39.9418 175.7134 84 L 4.4984 8.3632 120.3508 53.2533 42.5730 178.6415 85 G 3.9540 8.3850 108.0501 46.7572 0.0000 173.5486 86 N 5.6483 8.6775 121.2822 51.4749 41.9582 173.7799 87 V 4.4473 8.5616 113.1505 59.8943 35.8680 174.7533 88 T 5.1076 8.2563 118.1944 61.8848 71.2456 173.0629 89 A 4.9942 9.0984 129.0475 50.5703 21.5245 177.2337 90 D 5.0233 8.5338 121.3918 52.2850 41.6790 176.8464 91 K 4.1522 8.4851 116.7209 59.3918 32.9189 177.1054 92 D 4.4894 8.2599 118.0323 54.2380 41.3063 177.0674 93 G 4.0396 8.2350 108.3373 44.4854 0.0000 172.6482 94 V 4.7650 8.4901 120.5268 60.8513 33.8081 174.2644 95 A 5.2295 8.8590 130.1327 49.7709 20.9603 175.3270 96 D 4.9602 8.6282 123.5862 53.2217 41.6852 176.4178 97 V 3.8947 8.4734 125.0088 62.2699 33.2645 175.4258 98 S 4.7354 8.1977 121.0650 58.0462 64.1931 173.4176 99 I 4.8426 9.2994 128.3183 59.4569 41.7691 174.0831 100 E 5.2054 8.7892 124.8442 54.5644 32.3987 174.5164 101 D 4.8249 9.2674 125.6711 53.1610 44.8239 175.5447 102 S 4.7021 8.9545 120.0750 58.5313 64.0394 175.1240 103 V 3.9252 8.0214 120.7188 65.0596 31.7760 176.4630 104 I 4.1199 8.0652 111.7889 61.0995 38.2993 174.5406 105 S 4.6513 8.2519 113.9798 57.6092 65.1987 174.0146 106 L 4.5141 8.7773 122.4411 54.3215 41.6157 176.3181 107 S 4.5060 7.7679 112.8657 57.8465 66.5177 175.2308 108 G 3.9080 8.5414 108.7876 45.0322 0.0000 173.7142 109 D 4.4932 8.8116 117.4209 57.1405 40.9061 177.0159 110 H 5.0946 8.0393 114.0086 55.4070 29.1671 174.0081 111 C 4.7857 8.2334 119.8942 59.3213 31.8383 173.5387 112 I 3.9764 7.9884 117.3878 60.2260 38.4930 175.4941 113 I 3.6446 7.4083 122.7291 63.1937 37.2898 176.3129 114 G 3.8317 9.2218 113.7751 45.1903 0.0000 173.1007 115 R 4.8208 7.5076 119.0575 55.0596 33.5152 174.6331 116 T 4.9933 7.8968 115.7388 62.1082 71.4551 173.4727 117 L 4.8034 8.7749 128.8354 53.8139 43.9258 175.2986 118 V 5.0077 8.7023 126.0543 60.9258 35.1772 174.2215 119 V 5.0059 8.5785 126.0843 60.4275 33.7321 174.6856 120 H 5.3209 9.3558 122.0353 54.3093 30.3232 174.9467 121 E 4.2390 8.9375 121.7004 58.6517 30.3216 176.1810 122 K 4.7965 8.7468 117.5968 53.7237 36.2995 175.5437 123 A 4.4946 8.3273 121.9494 52.2186 19.6699 176.3060 124 D 4.9768 9.5893 121.9636 53.5064 41.9270 175.7595 125 D 4.6677 9.0943 125.3626 52.8666 39.8181 176.7372 126 L 3.7654 9.9428 118.0401 56.0634 39.8288 175.3920 127 G 4.1026 8.7277 104.5287 46.4074 0.0000 174.4860 128 K 4.6361 8.0660 116.7786 55.8074 32.8204 177.7987 129 G 3.8924 8.1837 109.1523 45.3385 0.0000 176.5406 130 G 4.0416 8.3608 107.3647 45.3849 0.0000 172.8702 131 N 5.1014 7.2441 115.5169 50.4446 40.5602 174.4316 132 E 4.0240 8.9122 120.0973 59.9778 30.0417 179.3558 133 E 3.8551 8.4193 118.3868 59.5219 29.5080 178.3560 134 S 3.8557 8.4721 113.0876 61.8870 62.3538 175.5484 135 T 4.1939 7.8962 113.5805 63.2059 66.8475 175.3452 136 K 4.3865 8.7068 119.1246 58.1632 34.1782 176.9706 137 T 4.2482 7.2491 104.9131 59.7312 70.2839 174.6486 138 G 3.7192 8.0227 110.5635 46.2921 0.0000 173.6160 139 N 4.2925 7.9429 113.5315 53.8492 36.8560 176.0257 140 A 4.3154 7.0177 118.8011 52.1748 19.4439 179.9580 141 G 3.9099 7.3875 103.1996 45.4210 0.0000 173.5069 142 S 4.3935 8.4319 118.5268 59.0358 64.6174 173.9062 143 R 4.4198 8.3322 120.0648 54.9079 30.1922 176.6533 144 L 4.2800 8.9091 125.8353 57.5461 42.9935 177.0907 145 A 4.6979 7.7628 117.2860 51.8109 22.5288 173.9546 146 C 5.6299 8.2574 113.6713 56.0031 45.2492 172.6001 147 G 4.7848 8.0347 103.9014 46.2761 0.0000 172.6284 148 V 4.4118 8.2970 120.6936 62.3255 32.7128 175.3491 149 I 4.2007 8.7694 129.2628 60.6089 38.2984 175.2341 150 G 4.4776 8.9342 114.0297 43.8793 0.0000 171.7349 151 I 4.3370 8.3563 121.4248 61.1036 37.6038 175.5723 152 A 4.7940 8.5536 128.2966 49.6686 22.0898 176.2719 153 Q 4.0686 8.4784 118.6761 56.4652 29.2192 175.9004 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 4.35 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 2 T 8.42 4.41 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 1.32 0.00 0.00 3 K 8.21 5.18 0.00 1.72 1.74 0.00 1.68 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.47 7.81 4 V 9.08 5.05 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 0.96 0.00 0.00 0.92 0.00 0.00 5 V 9.07 5.06 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 0.74 0.00 0.00 0.91 0.00 0.00 6 C 9.13 4.92 0.00 3.06 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 7 V 8.43 4.70 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 8.70 4.85 0.00 1.71 1.59 1.02 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.20 4.85 0.00 1.61 1.62 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.38 7.81 10 G 8.00 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 11 D 8.82 4.62 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 7.68 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 13 P 0.00 4.52 0.00 2.22 2.28 0.00 3.69 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.94 0.00 14 V 7.80 4.88 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 0.82 0.00 0.00 0.95 0.00 0.00 15 Q 8.18 4.77 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.50 0.00 0.00 0.00 0.00 0.00 2.49 2.36 0.00 16 G 8.09 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.14 5.19 1.82 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 0.89 0.83 0.00 0.00 18 I 8.71 4.78 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.26 0.46 0.00 0.00 19 N 8.56 5.08 0.00 1.44 1.58 0.00 0.00 6.45 8.47 0.00 0.00 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 9.01 5.47 0.00 2.85 2.90 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 21 E 9.62 5.38 0.00 2.34 2.15 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 2.32 2.38 0.00 22 Q 9.42 4.80 0.00 2.19 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.37 0.00 0.00 0.00 0.00 0.00 2.43 2.64 0.00 23 K 9.00 4.30 0.00 1.80 1.85 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.46 7.81 24 E 7.74 4.86 0.00 1.89 1.81 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 2.20 2.32 0.00 25 S 8.77 4.26 0.00 3.98 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 26 N 7.95 4.75 0.00 2.71 2.84 0.00 0.00 6.66 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 7.66 4.31 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 28 P 0.00 4.56 0.00 2.12 2.11 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 29 V 8.91 4.58 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 1.10 0.00 0.00 30 K 9.21 4.94 0.00 1.90 1.85 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.42 7.81 31 V 9.33 4.91 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 1.03 0.00 0.00 0.77 0.00 0.00 32 W 9.21 5.41 0.00 3.48 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 7.25 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.95 5.06 0.00 3.86 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.78 5.19 1.82 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 0.58 0.90 0.00 0.00 36 K 9.12 4.84 0.00 1.71 1.86 0.00 1.36 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.35 7.81 37 G 8.70 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 38 L 7.58 4.42 0.00 1.85 1.51 0.77 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.00 4.50 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 1.25 0.00 0.00 40 E 8.37 4.31 0.00 1.96 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 2.30 2.47 0.00 41 G 8.75 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 42 L 8.13 4.85 0.00 1.50 1.77 0.92 0.92 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 43 H 9.05 5.05 0.00 3.05 3.33 0.00 5.63 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 8.91 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 0.00 0.00 0.00 45 F 8.92 5.42 0.00 3.00 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 8.76 5.28 0.00 3.07 2.96 0.00 5.85 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.47 4.33 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 0.86 0.00 0.00 0.88 0.00 0.00 48 H 9.46 5.06 0.00 3.03 3.40 0.00 5.67 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.84 3.64 0.00 1.58 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 1.61 2.20 0.00 50 F 7.72 4.95 0.00 3.20 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 51 G 8.28 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 7.82 4.76 0.00 2.62 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 53 N 8.52 5.09 0.00 2.77 2.71 0.00 0.00 6.89 7.22 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 54 T 9.34 3.84 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 1.21 0.00 0.00 55 A 8.11 4.64 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 56 G 7.78 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 57 C 8.65 4.37 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 3.87 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 59 S 7.66 4.42 0.00 4.04 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 60 A 7.60 4.47 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 61 G 8.21 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.75 0.00 2.10 2.17 0.00 3.26 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 63 H 8.27 4.44 0.00 2.82 3.18 0.00 5.73 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.12 4.28 0.00 2.96 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 65 N 8.07 5.16 0.00 2.58 2.47 0.00 0.00 6.93 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 4.16 0.00 2.03 1.91 0.00 2.90 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 1.45 1.09 0.00 67 L 7.65 4.41 0.00 1.57 1.67 0.90 0.94 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 68 S 7.46 3.59 0.00 3.95 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 69 R 8.49 4.44 0.00 1.80 2.03 0.00 3.29 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 70 K 8.84 4.45 0.00 1.66 1.71 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.53 7.81 71 H 8.62 4.21 0.00 3.23 3.29 0.00 5.99 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 7.82 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 73 G 9.24 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 74 P 0.00 4.30 0.00 2.08 2.19 0.00 3.69 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 2.07 2.26 0.00 75 K 7.83 4.34 0.00 1.75 1.85 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.40 7.81 76 D 7.86 4.55 0.00 2.93 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 77 E 8.88 3.89 0.00 1.90 1.97 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 2.28 2.35 0.00 78 E 7.82 4.40 0.00 2.05 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 2.27 2.29 0.00 79 R 7.64 4.93 0.00 1.98 1.76 0.00 2.71 0.00 0.00 3.85 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 80 H 8.39 4.38 0.00 3.56 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.32 3.43 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.39 0.00 0.00 82 G 8.23 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 83 D 8.23 4.99 0.00 2.63 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.36 4.50 0.00 1.97 1.92 1.00 1.00 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 8.38 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 86 N 8.68 5.65 0.00 2.60 2.72 0.00 0.00 6.54 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 8.56 4.45 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 -0.16 0.00 0.00 0.82 0.00 0.00 88 T 8.26 5.11 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 9.10 4.99 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.53 5.02 0.00 2.92 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 91 K 8.49 4.15 0.00 1.87 1.98 0.00 1.45 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.52 7.81 92 D 8.26 4.49 0.00 3.04 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 93 G 8.24 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 0.00 0.00 0.00 94 V 8.49 4.77 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 0.92 0.00 0.00 0.92 0.00 0.00 95 A 8.86 5.23 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 8.63 4.96 0.00 2.53 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 8.47 3.89 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 0.57 0.00 0.00 0.56 0.00 0.00 98 S 8.20 4.74 0.00 3.92 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 9.30 4.84 1.94 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 1.14 0.50 1.01 0.00 0.00 100 E 8.79 5.21 0.00 1.95 1.81 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 2.21 2.30 0.00 101 D 9.27 4.82 0.00 2.87 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 8.95 4.70 0.00 3.91 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 0.00 103 V 8.02 3.93 2.26 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 0.84 0.00 0.00 0.96 0.00 0.00 104 I 8.07 4.12 1.97 0.00 0.00 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 1.46 0.84 1.11 0.00 0.00 105 S 8.25 4.65 0.00 3.88 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 0.00 106 L 8.78 4.51 0.00 1.90 1.68 1.09 0.61 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 7.77 4.51 0.00 3.88 3.80 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 0.00 108 G 8.54 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 0.00 0.00 0.00 109 D 8.81 4.49 0.00 2.69 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 0.00 110 H 8.04 5.09 0.00 3.15 3.38 0.00 5.73 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 0.00 111 C 8.23 4.79 0.00 3.02 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 0.00 112 I 7.99 3.98 1.60 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.36 0.97 0.00 0.00 113 I 7.41 3.64 1.78 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.74 0.84 0.00 0.00 114 G 9.22 3.83 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 0.00 0.00 0.00 115 R 7.51 4.82 0.00 1.55 1.81 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.31 0.00 116 T 7.90 4.99 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 1.17 0.00 0.00 117 L 8.77 4.80 0.00 1.72 1.51 0.38 0.88 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 8.70 5.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.74 0.00 0.00 119 V 8.58 5.01 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 0.77 0.00 0.00 1.01 0.00 0.00 120 H 9.36 5.32 0.00 3.33 3.59 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.94 4.24 0.00 2.07 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 2.36 2.34 0.00 122 K 8.75 4.80 0.00 1.74 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.33 4.49 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 0.00 124 D 9.59 4.98 0.00 2.81 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 0.00 125 D 9.09 4.67 0.00 2.96 2.87 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 0.00 126 L 9.94 3.77 0.00 1.84 1.76 0.94 1.00 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 0.00 127 G 8.73 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 0.00 0.00 0.00 0.00 128 K 8.07 4.64 0.00 1.87 1.77 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.34 7.81 129 G 8.18 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 0.00 130 G 8.36 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 0.00 0.00 0.00 131 N 7.24 5.10 0.00 2.59 2.75 0.00 0.00 6.86 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 0.00 132 E 8.91 4.02 0.00 2.04 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 2.41 2.35 0.00 133 E 8.42 3.86 0.00 2.06 2.04 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 2.47 2.40 0.00 134 S 8.47 3.86 0.00 4.09 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 0.00 135 T 7.90 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 1.38 0.00 0.00 136 K 8.71 4.39 0.00 1.74 1.73 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.46 7.81 137 T 7.25 4.25 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 1.12 0.00 0.00 138 G 8.02 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 0.00 139 N 7.94 4.29 0.00 3.03 2.88 0.00 0.00 6.94 7.35 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 0.00 140 A 7.02 4.32 1.31 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 0.00 141 G 7.39 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 0.00 0.00 0.00 142 S 8.43 4.39 0.00 3.81 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 0.00 143 R 8.33 4.42 0.00 1.67 1.82 0.00 3.27 0.00 0.00 3.10 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 144 L 8.91 4.28 0.00 1.76 1.71 0.94 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.76 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 0.00 146 C 8.26 5.63 0.00 2.98 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.03 4.78 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 0.00 148 V 8.30 4.41 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 0.76 0.00 0.00 0.91 0.00 0.00 149 I 8.77 4.20 1.78 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.55 0.45 0.00 0.00 150 G 8.93 4.48 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 0.00 151 I 8.36 4.34 1.86 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 1.26 0.54 0.91 0.00 0.00 152 A 8.55 4.79 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 0.00 153 Q 8.48 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00