NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3740 8.2493 123.5842 51.3264 19.8561 177.0795 2 P 4.2521 0.0000 0.0000 62.8616 31.7258 171.4657 3 V 4.4984 7.5670 116.5270 59.3778 35.3753 175.6768 4 R 4.4862 8.5230 122.1219 55.9818 31.1550 175.1793 5 S 5.4293 8.7901 121.3362 56.9600 67.0821 173.3578 6 L 4.9883 8.8934 121.8009 53.1800 46.3935 175.1278 7 N 5.9810 9.1184 119.6142 51.7926 40.3304 173.9698 8 C 5.4260 8.7555 117.6974 57.2064 33.5504 174.1415 9 T 4.2438 8.7192 108.0477 61.3175 70.5170 171.4138 10 L 4.4785 8.1135 128.4309 53.4059 41.9820 173.9566 11 R 4.8149 8.2569 121.0851 54.1162 34.1510 175.0116 12 D 4.6671 8.7828 122.2395 52.5400 40.2987 177.0572 13 S 4.2050 7.8180 112.6084 60.4111 63.0284 174.8923 14 Q 4.2727 7.9968 118.7956 55.7506 28.6201 176.1649 15 Q 3.9090 7.9474 115.7253 55.7219 27.1523 173.5125 16 K 4.2118 8.2303 119.1178 56.3821 33.3513 177.2907 17 S 5.0320 8.9564 121.1571 57.7483 65.5005 172.7222 18 L 5.3194 8.3195 119.6303 53.5122 44.8923 176.3649 19 V 4.7929 9.0473 114.7785 59.9462 37.0498 173.5468 20 M 4.4456 8.4917 121.7450 54.7936 32.5668 176.7478 21 S 4.4802 8.3163 121.6852 56.7998 61.7423 170.9591 22 G 3.7216 7.1887 117.9200 45.0239 0.0000 169.6481 23 P 3.9504 0.0000 0.0000 63.5979 30.7383 175.6220 24 Y 4.6591 9.4940 120.4278 57.5492 35.9902 168.5778 25 E 4.8954 8.0262 119.6463 55.1408 33.6251 173.8094 26 L 5.5522 8.5896 123.9916 53.0411 46.3038 175.3125 27 K 5.1517 9.1586 118.8024 55.5959 36.4904 174.5411 28 A 5.8215 8.8869 123.2955 49.6500 21.6167 175.4975 29 L 4.5396 8.1647 120.6251 55.0015 44.2705 174.0857 30 H 4.7841 9.7782 118.3554 55.0108 29.5156 175.1856 31 L 4.6548 8.2442 124.0599 53.0704 43.3827 176.5413 32 Q 4.2086 8.4967 121.7178 55.3057 29.3775 177.6126 33 G 3.9248 8.6285 110.5923 47.6943 0.0000 173.8561 34 Q 4.3424 8.2869 117.3901 57.9729 29.9161 176.4747 35 D 4.7034 7.9026 116.1687 54.3873 40.5310 177.7742 36 M 4.0032 8.0325 121.1800 58.0813 31.9969 177.3788 37 E 4.4532 8.0088 116.0668 56.6279 29.7861 176.9144 38 Q 4.2153 8.1011 118.7341 56.8936 29.3009 176.4416 39 Q 4.8066 7.0972 115.7984 55.1651 29.3989 176.0542 40 V 3.6240 7.9643 114.2941 61.1381 32.4437 175.6325 41 V 4.0223 8.0440 125.5339 62.0075 33.0691 175.1042 42 F 5.0327 8.9521 126.6696 56.4299 41.5885 174.9309 43 S 5.0274 9.1893 115.8036 56.6842 63.7445 171.2641 44 M 4.7012 9.1693 126.0596 54.7632 32.9836 174.6330 45 S 5.1513 8.8291 123.1941 57.2944 65.5099 174.1609 46 F 4.9113 9.1637 123.7334 56.7517 38.3568 175.9264 47 V 4.3592 7.9655 116.7531 60.3111 33.2981 175.7525 48 Q 4.4696 9.0281 122.5623 54.5399 29.3849 175.3958 49 G 3.7703 8.3101 115.4360 45.5343 0.0000 176.1225 50 E 4.2498 8.5860 118.8665 54.8839 27.9048 174.6595 51 E 4.1445 8.1506 119.8155 56.6063 28.1133 176.5405 52 S 4.3962 8.3898 116.0808 57.7212 62.9544 173.6994 53 N 4.8474 8.4162 122.1104 54.6798 37.8539 174.5574 54 D 4.7596 7.8607 112.9073 53.5234 39.9803 175.6609 55 K 4.7799 7.5427 117.7412 55.2501 36.7638 176.1364 56 I 4.6712 8.2157 122.0795 58.9021 40.9915 172.9832 57 P 4.9264 0.0000 0.0000 63.4599 32.4316 175.8091 58 V 5.0511 9.4498 114.9246 59.9691 37.1807 173.5973 59 A 5.4563 8.9040 122.7631 49.2858 22.1284 175.1910 60 L 4.7824 9.0276 122.2855 52.9656 44.1061 175.7247 61 G 3.4098 8.1973 110.7483 43.3642 0.0000 171.1712 62 L 3.9314 8.8108 123.1728 57.3321 42.3563 177.7382 63 K 3.9934 8.4033 118.3996 55.3745 34.5672 176.7688 64 E 4.7587 8.7939 115.5166 56.0471 30.2894 176.1731 65 K 4.3761 7.6742 114.4703 55.0783 34.7375 176.5709 66 N 4.2506 8.1350 116.1887 54.1186 36.1557 173.3690 67 L 5.1862 7.0824 116.0933 53.3506 47.2316 176.9206 68 Y 4.8385 9.0900 119.8026 55.8903 42.0417 174.8017 69 L 4.8821 9.2972 125.3913 54.9949 42.9088 176.4115 70 S 5.2439 9.4709 117.6660 56.8542 67.2204 172.4273 71 C 5.4050 8.5410 118.0390 58.2562 30.4030 174.0282 72 V 4.7062 8.6498 115.8373 59.3801 36.3512 174.0817 73 L 4.3672 8.4387 123.9319 53.8657 42.8220 175.7405 74 K 4.2687 8.3158 127.2596 55.4806 33.6090 175.2923 75 D 4.1792 9.0266 127.0233 55.8264 37.6147 174.5102 76 D 4.4680 8.4394 114.4669 54.7355 38.5694 173.8390 77 K 4.2662 7.3293 118.3556 53.4658 35.2519 173.9305 78 P 3.8520 0.0000 0.0000 62.4269 31.6166 175.8938 79 T 4.7351 8.4478 113.9705 59.7984 72.4698 172.8880 80 L 5.0826 8.6833 125.6390 55.1370 43.3927 175.4978 81 Q 4.7420 8.8483 121.0263 55.3498 32.3814 172.6662 82 L 5.3270 8.5508 120.7757 53.2190 43.5929 175.7724 83 E 4.8499 9.0296 121.3298 54.4276 32.9963 175.3911 84 S 5.2827 8.7528 116.6042 57.9724 64.7078 173.1413 85 V 4.4839 7.8556 113.0070 59.8594 36.3312 173.8406 86 D 4.6670 8.6461 120.7502 53.1423 41.5990 175.4148 87 P 4.5986 0.0000 0.0000 65.1975 31.2847 178.2750 88 K 4.1161 7.7183 117.6055 59.5053 32.2689 178.3337 89 N 4.3942 8.2162 114.9575 54.3611 38.9355 174.6623 90 Y 4.5375 7.1441 116.7048 55.1507 40.4544 173.6596 91 P 4.6050 0.0000 0.0000 62.2296 32.6625 175.5993 92 K 4.5491 7.9126 118.8056 54.3947 34.9068 176.6951 93 K 4.1827 8.3816 119.4247 58.4789 33.2276 176.5858 94 K 4.5911 7.6217 119.6596 54.8454 31.0028 174.0034 95 M 4.4892 7.8793 121.2062 53.4581 34.1230 175.8014 96 E 4.1448 8.9302 124.8411 56.3205 30.5441 178.0266 97 K 3.7918 8.8909 122.5519 59.6949 32.6312 179.0513 98 R 3.6112 7.8489 114.6513 59.1381 29.2792 177.8522 99 F 5.1530 7.6896 114.1761 56.9292 39.3441 174.4913 100 V 4.5109 7.6068 123.0476 61.4710 33.0265 174.5907 101 F 5.2983 8.9605 126.1979 55.8568 42.8381 174.0267 102 N 5.1295 9.3108 121.2122 52.0773 40.1778 174.6111 103 K 3.9899 9.2123 127.5803 55.9993 33.0037 175.2431 104 I 4.2762 8.2301 129.5060 59.6161 39.1815 174.5867 105 E 4.4526 8.7409 128.2729 55.5403 30.4139 174.7185 106 I 3.8364 8.6103 130.3039 61.4733 37.5621 177.0587 107 N 4.7660 8.0283 119.7353 52.8607 38.4417 174.8424 108 N 4.6616 8.0163 110.8758 54.0271 38.4592 172.8183 109 K 4.5095 7.4816 118.0610 54.0951 34.2230 175.0410 110 L 4.7150 8.6160 128.8524 54.5224 43.0328 176.1807 111 E 5.3860 8.8052 121.9844 53.5835 34.0111 175.2460 112 F 5.1441 9.0297 120.5167 55.7612 41.6599 173.6839 113 E 4.2607 8.9485 125.1881 55.3890 31.1743 175.1335 114 S 4.4848 8.5098 120.9948 57.5755 62.5370 173.7717 115 A 3.9879 8.7762 130.4810 55.4581 18.2262 178.6655 116 Q 3.6199 8.0415 114.9875 58.8168 29.7619 176.9727 117 F 4.8637 7.3881 117.3907 54.0131 38.4339 173.0253 118 P 4.3721 0.0000 0.0000 64.5658 31.6694 176.9017 119 N 4.4794 9.2733 115.9542 53.4342 36.5997 173.5657 120 W 5.1455 7.6292 117.5127 55.3532 32.9925 174.0389 121 Y 5.5210 9.2146 121.9199 55.6698 41.7305 175.1621 122 I 4.2957 8.6425 122.2360 62.0269 38.1225 175.8211 123 S 5.5986 9.4736 122.4006 56.0336 67.6735 172.8371 124 T 5.0902 7.9245 109.4220 60.5817 71.1881 173.0995 125 S 5.0729 8.7270 118.0039 57.2098 64.8144 175.3580 126 Q 4.1220 8.8145 122.4214 58.8134 29.1478 177.0125 127 A 4.1486 7.1289 120.1940 51.9013 18.8817 176.5397 128 E 4.1771 8.6073 121.3066 56.7694 30.5360 175.9405 129 N 4.3451 8.1042 121.3495 54.8821 38.3685 173.7789 130 M 4.7424 7.2178 114.7672 52.5755 34.5230 174.2576 131 P 5.0104 0.0000 0.0000 63.0096 32.6650 175.8294 132 V 4.3449 8.5326 122.4918 62.7290 32.3575 175.0497 133 F 5.1500 8.6422 122.1340 55.3443 42.2070 172.5524 134 L 5.0660 8.9820 120.6929 53.7413 43.0720 175.6826 135 G 4.3760 9.4579 114.3677 44.6851 0.0000 174.0099 136 G 2.2844 8.0112 111.3070 45.2449 0.0000 174.7028 137 T 3.8814 7.4615 115.5420 63.2493 68.5850 174.1319 138 K 3.7208 7.5069 123.4712 56.2813 31.3958 175.5608 139 G 3.9829 7.4606 103.5945 45.1122 0.0000 175.1843 140 G 3.7356 7.3258 111.2281 47.2513 0.0000 173.7255 141 Q 4.6387 6.7440 125.7237 56.1647 29.2822 173.0741 142 D 4.6798 7.5368 118.4916 54.0347 41.9452 175.5786 143 I 4.0720 8.3900 124.3575 61.0612 38.0498 176.3032 144 T 5.0765 8.3232 114.7454 60.1862 70.8349 172.5001 145 D 5.3096 7.6717 122.0738 53.0841 44.0343 175.1850 146 F 5.5016 9.4057 120.2852 56.4927 44.4207 173.2750 147 T 5.0539 9.1307 114.8577 62.2491 72.6971 173.1877 148 M 5.0493 8.5409 122.3332 53.8500 35.5249 174.4559 149 Q 4.4561 8.2638 122.8816 54.0366 32.4745 174.4804 150 F 4.8756 8.6102 122.5467 57.0107 40.2934 176.7115 151 V 4.2976 8.8943 124.8665 61.7434 29.0389 175.5682 152 S 4.5934 8.0782 115.5110 57.7291 64.3963 175.2106 153 S 4.2866 7.7388 120.7724 59.2799 62.1039 175.2950 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 8.25 4.37 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 2 P 0.00 4.25 0.00 2.26 2.19 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 3 V 7.57 4.50 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 0.79 0.00 0.00 1.03 0.00 0.00 4 R 8.52 4.49 0.00 2.01 2.03 0.00 3.23 0.00 0.00 3.34 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 2.01 0.00 5 S 8.79 5.43 0.00 3.82 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 6 L 8.89 4.99 0.00 1.77 1.71 1.07 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 7 N 9.12 5.98 0.00 2.73 2.79 0.00 0.00 7.15 7.72 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 8 C 8.76 5.43 0.00 2.89 3.03 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 0.00 0.00 0.00 9 T 8.72 4.24 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 1.26 0.00 0.00 10 L 8.11 4.48 0.00 1.95 1.77 0.00 0.98 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 11 R 8.26 4.81 0.00 1.85 1.78 0.00 3.15 0.00 0.00 3.41 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 12 D 8.78 4.67 0.00 2.29 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 13 S 7.82 4.20 0.00 3.96 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 14 Q 8.00 4.27 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.95 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 15 Q 7.95 3.91 0.00 2.31 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.66 6.84 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 16 K 8.23 4.21 0.00 1.88 1.64 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.73 1.22 7.81 17 S 8.96 5.03 0.00 3.78 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 18 L 8.32 5.32 0.00 1.64 1.60 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 19 V 9.05 4.79 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 0.71 0.00 0.00 1.00 0.00 0.00 20 M 8.49 4.45 0.00 1.96 1.90 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 21 S 8.32 4.48 0.00 3.87 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 22 G 7.19 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 23 P 0.00 3.95 0.00 1.80 1.70 0.00 3.58 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.05 0.00 24 Y 9.49 4.66 0.00 3.03 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 25 E 8.03 4.90 0.00 2.13 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 2.27 2.36 0.00 26 L 8.59 5.55 0.00 1.70 1.56 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 27 K 9.16 5.15 0.00 1.92 1.89 0.00 1.50 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.42 7.81 28 A 8.89 5.82 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.16 4.54 0.00 1.80 1.80 0.99 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 30 H 9.78 4.78 0.00 3.10 3.27 0.00 5.83 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.24 4.65 0.00 1.64 1.59 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 8.50 4.21 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 33 G 8.63 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 34 Q 8.29 4.34 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.19 0.00 0.00 0.00 0.00 0.00 2.27 2.44 0.00 35 D 7.90 4.70 0.00 2.73 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 36 M 8.03 4.00 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.53 0.00 37 E 8.01 4.45 0.00 1.92 1.95 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 2.27 2.37 0.00 38 Q 8.10 4.22 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 39 Q 7.10 4.81 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.56 2.24 0.00 40 V 7.96 3.62 1.43 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 0.47 0.00 0.00 0.61 0.00 0.00 41 V 8.04 4.02 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 1.08 0.00 0.00 0.86 0.00 0.00 42 F 8.95 5.03 0.00 2.96 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 43 S 9.19 5.03 0.00 3.81 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 44 M 9.17 4.70 0.00 2.06 1.89 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.16 0.00 45 S 8.83 5.15 0.00 3.91 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 46 F 9.16 4.91 0.00 2.97 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 47 V 7.97 4.36 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 0.77 0.00 0.00 1.05 0.00 0.00 48 Q 9.03 4.47 0.00 1.90 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.61 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 49 G 8.31 3.77 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 0.00 50 E 8.59 4.25 0.00 1.97 1.93 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 2.27 2.25 0.00 51 E 8.15 4.14 0.00 1.98 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 2.36 2.34 0.00 52 S 8.39 4.40 0.00 3.84 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 53 N 8.42 4.85 0.00 2.92 2.99 0.00 0.00 7.11 8.48 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 54 D 7.86 4.76 0.00 2.82 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.54 4.78 0.00 1.62 1.72 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.48 7.81 56 I 8.22 4.67 1.99 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 1.36 0.76 1.18 0.00 0.00 57 P 0.00 4.93 0.00 2.27 2.24 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.07 0.00 58 V 9.45 5.05 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 0.78 0.00 0.00 1.24 0.00 0.00 59 A 8.90 5.46 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 60 L 9.03 4.78 0.00 1.20 1.03 -0.32 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.20 3.41 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 0.00 62 L 8.81 3.93 0.00 1.44 1.45 0.52 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.40 3.99 0.00 1.89 1.46 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.46 7.81 64 E 8.79 4.76 0.00 1.93 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 2.20 2.27 0.00 65 K 7.67 4.38 0.00 1.55 1.70 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.27 1.28 7.81 66 N 8.13 4.25 0.00 2.87 2.85 0.00 0.00 6.88 6.76 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 67 L 7.08 5.19 0.00 1.47 1.50 0.90 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 9.09 4.84 0.00 2.65 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 69 L 9.30 4.88 0.00 1.81 1.75 1.05 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 70 S 9.47 5.24 0.00 3.44 3.70 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 71 C 8.54 5.40 0.00 2.92 3.06 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 72 V 8.65 4.71 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 0.64 0.00 0.00 0.93 0.00 0.00 73 L 8.44 4.37 0.00 1.68 1.53 0.52 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.32 4.27 0.00 1.67 1.54 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.47 7.81 75 D 9.03 4.18 0.00 2.81 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.44 4.47 0.00 2.78 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 77 K 7.33 4.27 0.00 1.72 1.44 0.00 1.61 0.00 0.00 1.81 0.00 0.00 3.30 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.28 1.49 7.81 78 P 0.00 3.85 0.00 0.49 0.49 0.00 2.20 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.71 0.00 79 T 8.45 4.74 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 1.15 0.00 0.00 80 L 8.68 5.08 0.00 1.86 1.73 1.13 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.85 4.74 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.50 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 82 L 8.55 5.33 0.00 1.84 1.85 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 83 E 9.03 4.85 0.00 2.02 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 2.50 2.42 0.00 84 S 8.75 5.28 0.00 3.99 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 85 V 7.86 4.48 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.61 0.00 0.00 86 D 8.65 4.67 0.00 2.80 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 87 P 0.00 4.60 0.00 2.31 2.38 0.00 3.48 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.92 0.00 88 K 7.72 4.12 0.00 1.85 2.02 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.48 7.81 89 N 8.22 4.39 0.00 2.72 2.62 0.00 0.00 6.79 7.50 0.00 0.00 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 Y 7.14 4.54 0.00 3.09 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 91 P 0.00 4.60 0.00 2.22 2.24 0.00 3.79 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 92 K 7.91 4.55 0.00 1.48 1.55 0.00 1.46 0.00 0.00 1.37 0.00 0.00 2.76 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.04 0.47 7.81 93 K 8.38 4.18 0.00 1.96 2.08 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.45 7.81 94 K 7.62 4.59 0.00 1.71 1.78 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.32 7.81 95 M 7.88 4.49 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 96 E 8.93 4.14 0.00 2.34 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 2.50 2.47 0.00 97 K 8.89 3.79 0.00 1.74 1.87 0.00 1.51 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.39 7.81 98 R 7.85 3.61 0.00 1.75 1.91 0.00 2.50 0.00 0.00 3.03 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 99 F 7.69 5.15 0.00 3.19 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.61 4.51 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 1.01 0.00 0.00 1.07 0.00 0.00 101 F 8.96 5.30 0.00 3.25 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 0.00 102 N 9.31 5.13 0.00 2.66 2.80 0.00 0.00 6.49 6.75 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 0.00 103 K 9.21 3.99 0.00 1.77 1.83 0.00 1.62 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.22 0.76 7.81 104 I 8.23 4.28 1.88 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.82 0.93 0.00 0.00 105 E 8.74 4.45 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 106 I 8.61 3.84 1.85 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 1.28 0.92 0.90 0.00 0.00 107 N 8.03 4.77 0.00 2.79 2.73 0.00 0.00 6.47 6.92 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 0.00 108 N 8.02 4.66 0.00 2.85 2.88 0.00 0.00 7.10 6.78 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 0.00 109 K 7.48 4.51 0.00 1.86 1.63 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.18 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.30 1.40 7.81 110 L 8.62 4.71 0.00 1.88 1.30 0.97 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.81 5.39 0.00 1.92 1.93 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 2.34 2.10 0.00 112 F 9.03 5.14 0.00 2.89 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.95 4.26 0.00 1.89 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 2.12 1.63 0.00 114 S 8.51 4.48 0.00 4.03 4.03 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 0.00 0.00 0.00 115 A 8.78 3.99 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 0.00 116 Q 8.04 3.62 0.00 1.78 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 1.50 1.16 0.00 117 F 7.39 4.86 0.00 3.02 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 0.00 118 P 0.00 4.37 0.00 2.21 2.08 0.00 3.92 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 2.05 2.02 0.00 119 N 9.27 4.48 0.00 3.17 3.05 0.00 0.00 6.91 7.72 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 0.00 120 W 7.63 5.15 0.00 3.72 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 9.21 5.52 0.00 2.93 3.08 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 0.00 122 I 8.64 4.30 1.69 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.03 0.53 0.00 0.00 123 S 9.47 5.60 0.00 2.72 3.28 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 0.00 124 T 7.92 5.09 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 0.00 125 S 8.73 5.07 0.00 3.87 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 0.00 126 Q 8.81 4.12 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 127 A 7.13 4.15 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 0.00 128 E 8.61 4.18 0.00 2.09 1.83 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 2.40 2.38 0.00 129 N 8.10 4.35 0.00 2.83 2.84 0.00 0.00 7.13 7.47 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 0.00 130 M 7.22 4.74 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.79 0.00 131 P 0.00 5.01 0.00 2.19 2.31 0.00 3.78 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 132 V 8.53 4.34 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 0.77 0.00 0.00 1.01 0.00 0.00 133 F 8.64 5.15 0.00 3.24 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 0.00 134 L 8.98 5.07 0.00 1.95 1.95 1.23 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 135 G 9.46 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 0.00 136 G 8.01 2.28 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 0.00 137 T 7.46 3.88 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 138 K 7.51 3.72 0.00 1.79 1.71 0.00 1.46 0.00 0.00 1.17 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.05 0.86 7.81 139 G 7.46 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 0.00 140 G 7.33 3.74 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 0.00 0.00 0.00 141 Q 6.74 4.64 0.00 2.15 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.82 0.00 0.00 0.00 0.00 0.00 2.16 2.06 0.00 142 D 7.54 4.68 0.00 2.80 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 0.00 143 I 8.39 4.07 1.77 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 1.17 0.52 0.54 0.00 0.00 144 T 8.32 5.08 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 1.14 0.00 0.00 145 D 7.67 5.31 0.00 2.44 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.41 5.50 0.00 3.05 3.05 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 0.00 147 T 9.13 5.05 4.27 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 1.21 0.00 0.00 148 M 8.54 5.05 0.00 1.70 1.81 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 2.28 1.80 0.00 149 Q 8.26 4.46 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 150 F 8.61 4.88 0.00 3.03 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 0.00 151 V 8.89 4.30 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 0.80 0.00 0.00 1.01 0.00 0.00 152 S 8.08 4.59 0.00 4.04 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 0.00 153 S 7.74 4.29 0.00 3.81 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