NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4608 8.3044 118.1942 55.1266 32.5691 174.3795 1 V 4.2625 7.9418 119.4590 60.7686 34.5940 173.4055 2 L 4.3803 8.2623 127.0860 53.8628 43.7769 176.7442 3 S 4.5913 8.3949 117.1739 57.4426 65.5703 175.1358 4 E 4.2723 8.7775 122.3289 59.4793 29.3029 178.8907 5 G 3.6666 8.1313 105.2887 47.8942 0.0000 175.3802 6 E 3.9200 8.0026 120.5849 58.9813 29.4965 179.4014 7 W 4.3954 8.0772 118.9825 59.9799 29.0332 178.5790 8 Q 4.2070 8.5689 118.1775 59.0170 27.9967 178.8742 9 L 4.0768 7.9071 119.7460 57.5817 41.6116 179.7913 10 V 3.7775 7.9550 118.2616 66.2547 31.6235 178.2787 11 L 4.2823 8.7069 118.9411 57.6895 41.1611 179.0797 12 H 4.2553 8.3939 118.3681 59.2895 30.3090 177.4354 13 V 3.7330 7.7892 121.0706 64.3376 31.4089 178.1609 14 W 3.9410 8.5175 128.9410 60.0555 30.2658 177.7484 15 A 4.0407 7.9196 120.2964 54.9982 18.0334 179.4571 16 K 3.9602 7.6906 116.7544 59.3804 32.1165 179.6718 17 V 2.8698 7.0990 118.0262 65.6945 31.0971 177.4097 18 E 3.9369 7.5506 115.9920 57.9993 29.3141 178.4783 19 A 4.2118 7.4769 120.6222 53.7852 19.9108 177.6754 20 D 4.6618 7.7927 116.5846 52.0995 42.7669 175.4969 21 V 3.4427 7.9427 123.1456 65.5412 32.0497 176.7099 22 A 4.0511 8.0151 120.1344 55.1082 18.3159 179.6785 23 G 3.7264 8.2636 105.4565 47.8837 0.0000 175.7429 24 H 4.2083 8.2782 119.0992 58.1932 28.6253 178.1337 25 G 3.6243 8.3061 107.8856 47.8273 0.0000 175.7856 26 Q 3.8808 7.9865 120.4948 58.7712 28.7947 178.3672 27 D 4.3156 7.8416 119.6896 57.5492 40.7936 179.2404 28 I 3.6570 7.7789 119.8814 64.4751 37.0925 178.5983 29 L 3.4755 7.6952 119.7681 57.6511 41.3597 179.7265 30 I 3.7918 7.8662 120.0192 64.1292 37.0005 178.4906 31 R 3.8059 8.0079 119.7254 59.1789 29.8498 178.2640 32 L 3.8955 7.8718 120.3101 58.3738 41.9622 179.1077 33 F 4.5698 8.0543 117.8538 60.3461 38.5433 177.7889 34 K 4.0770 7.9679 117.6256 59.1916 32.0885 179.1430 35 S 4.2674 7.9401 114.5862 60.2473 64.3036 174.5187 36 H 4.7662 8.2057 118.1351 51.8171 29.5041 171.6831 37 P 4.5404 0.0000 0.0000 64.9333 31.4100 177.6757 38 E 4.1221 8.2889 115.9243 59.4958 29.5592 179.1629 39 T 3.7529 8.2470 111.1007 64.3910 68.7842 176.2749 40 L 3.7689 8.0544 122.9277 57.8055 41.7548 178.6483 41 E 4.0843 7.8764 117.6907 58.8552 29.4028 178.8182 42 K 4.2623 7.9782 117.1206 57.2988 33.3866 177.6046 43 F 4.3065 7.7600 119.6995 55.0473 37.5110 175.5917 44 D 4.3848 8.2713 124.5063 57.3200 41.1571 178.7467 45 R 4.1864 7.8760 117.0596 58.7210 30.5126 177.0633 46 F 5.1438 7.4156 112.6756 56.2362 38.3321 176.9238 47 K 4.0046 8.3355 122.9063 60.3539 32.0403 178.0814 48 H 4.4506 8.2298 112.7830 56.7875 29.0674 175.7026 49 L 4.0257 7.3099 120.7600 55.4505 41.7656 177.0121 50 K 4.3336 9.4821 123.0494 57.2180 33.5378 176.9365 51 T 4.7354 7.4520 107.5860 58.9491 73.1576 174.3016 52 E 3.9326 8.6138 120.9260 59.1809 29.4809 178.5217 53 A 3.9694 7.9313 120.4721 55.3246 18.2893 179.3336 54 E 3.9185 7.8510 115.5339 59.7130 29.7186 179.2316 55 M 4.1069 8.0075 118.8387 58.3232 31.8143 178.9953 56 K 3.9815 8.3025 117.7247 58.7544 32.2758 178.3870 57 A 4.4507 7.4539 118.8469 51.4830 19.4354 177.0462 58 S 4.1859 7.3118 113.8817 57.3814 62.7135 174.6982 59 E 4.0107 8.7476 127.5286 59.4451 29.4906 178.7452 60 D 4.3601 7.9427 119.5087 57.0468 41.0044 178.2133 61 L 3.1482 7.3117 120.7159 57.6530 42.0005 178.8890 62 K 3.8564 7.7113 119.1369 59.4706 32.1070 178.8610 63 K 4.0072 8.2138 118.8083 59.7192 31.9030 179.1388 64 D 4.6253 8.3950 119.2627 57.0586 40.6685 179.1135 65 G 3.5715 8.0886 106.5972 47.7275 0.0000 176.0034 66 V 3.6255 7.8664 120.9328 66.0159 31.5901 178.2342 67 T 3.9421 8.1412 115.5176 66.6870 68.2790 176.8354 68 S 4.1856 8.4517 117.2033 61.8361 62.9774 176.8759 69 L 4.2666 8.2078 121.6334 58.0906 41.3068 179.7917 70 T 4.0475 8.3071 115.7392 66.4947 68.3693 176.6654 71 A 3.9966 8.0751 122.7672 55.0736 18.3549 179.4714 72 L 3.7346 8.1746 119.0905 58.0340 42.1309 179.3611 73 G 3.2999 8.6658 105.9284 47.6997 0.0000 175.5080 74 A 4.0097 7.7582 122.1922 54.7654 18.6356 179.6283 75 I 3.7695 7.4512 117.8736 64.5689 37.2451 178.5464 76 L 3.9567 7.7729 119.9996 57.7847 41.2149 179.6281 77 K 3.9899 7.7460 116.4546 58.2607 32.3138 178.6355 78 K 3.9767 7.8364 118.3628 55.8411 32.5647 176.5813 79 K 2.0000 8.2358 118.1525 56.4159 29.8920 175.1375 80 G 4.0203 7.9963 105.9549 45.9477 0.0000 174.3434 81 H 4.6469 7.3379 118.7739 55.0390 27.4668 174.8247 82 H 5.3695 7.5927 111.4647 54.5083 29.5070 176.7330 83 E 3.9738 8.6219 120.5080 60.4850 28.7656 178.8145 84 A 4.0175 7.9442 120.1513 54.6424 17.7139 179.0009 85 E 4.1085 8.1579 116.6036 59.3995 29.6399 179.3080 86 L 4.2846 8.1716 119.1646 57.2657 41.6339 179.2161 87 K 3.9040 7.8299 118.8868 59.2644 32.0951 177.4742 88 P 4.3223 0.0000 0.0000 65.6893 31.2708 178.1847 89 L 4.0046 7.5397 117.0175 57.9993 42.0687 178.8184 90 A 4.2553 8.6126 121.2339 55.1510 18.2230 179.4545 91 Q 3.8910 8.2113 118.4347 59.3052 29.1297 178.6082 92 S 3.9937 8.0755 115.3449 61.8868 63.0971 176.1594 93 H 4.2764 8.5575 119.4857 57.6585 28.2071 177.5736 94 A 3.0343 7.6485 122.0618 54.5374 18.7782 179.0600 95 T 3.8535 7.5693 112.5868 65.0663 69.0209 176.2299 96 K 4.0620 7.4274 120.0325 58.8371 32.8518 177.3190 97 H 4.2431 8.0036 114.8402 56.3079 29.4151 175.5398 98 K 3.3338 7.5287 117.2539 57.0531 28.4950 175.4309 99 I 4.3455 8.4689 118.9634 58.6673 38.3454 174.9308 100 P 4.4591 0.0000 0.0000 62.1550 32.1538 177.3798 101 I 3.5457 8.0359 121.0928 64.6352 36.8936 178.5199 102 K 3.6071 7.8756 119.8135 59.7975 31.8776 178.1479 103 Y 4.2478 7.9546 116.6046 60.5765 37.7946 177.9536 104 L 4.2663 7.9225 120.2644 57.4394 41.7056 179.2159 105 E 4.0453 7.9123 118.4522 59.3173 29.5590 179.0234 106 F 4.5622 7.9377 117.8876 60.8301 38.9323 177.6107 107 I 3.9017 8.1401 118.1595 63.9448 37.7954 178.0960 108 S 4.2130 8.1686 116.4499 61.4764 62.6493 176.1911 109 E 4.0312 8.4200 121.9507 59.2057 29.4229 178.7593 110 A 4.0576 8.0388 120.8562 55.0512 18.4261 179.6818 111 I 3.7001 8.0846 118.5086 64.7030 37.2283 178.7458 112 I 3.8527 7.8212 120.5482 64.5601 36.9316 177.9553 113 H 4.1350 8.3921 119.1011 59.3172 29.6371 177.5555 114 V 3.5066 7.8792 119.9364 65.9862 31.3081 177.9789 115 L 3.7567 7.7980 118.7551 57.8531 41.0378 178.9665 116 H 4.3590 7.8916 117.3132 59.4162 29.8842 177.3144 117 S 4.1645 7.6471 115.8923 61.5635 62.8327 176.3984 118 R 4.1006 7.9607 119.0625 57.3351 31.1604 176.3569 119 H 5.0353 8.2497 116.1137 53.5978 29.6567 172.9717 120 P 4.2983 0.0000 0.0000 66.0647 31.3527 179.1382 121 G 3.6292 8.1454 106.1933 47.3843 0.0000 173.6568 122 N 5.0262 8.2056 115.1814 52.9448 39.6119 174.7250 123 F 4.9168 7.8193 119.0292 56.4244 39.4700 174.1198 124 G 3.9217 7.6277 109.3810 43.5749 0.0000 171.9572 125 A 3.9054 8.4665 120.7718 55.5525 18.1797 179.6125 126 D 4.1959 7.9842 116.3152 57.4491 40.9687 178.7821 127 A 3.9276 7.7477 120.7650 55.1435 18.3621 179.3257 128 Q 3.1104 7.9209 118.5819 58.7700 29.0172 178.6381 129 G 3.4762 8.0925 106.7662 47.6280 0.0000 175.6064 130 A 3.8744 7.9265 123.2492 54.9775 18.3428 179.4192 131 M 4.0031 8.1228 116.7784 58.7774 32.2885 177.9039 132 N 4.3093 8.4307 117.4976 56.5882 39.1118 176.6987 133 K 3.8395 8.1030 120.7694 59.4743 32.2880 178.6871 134 A 3.8573 7.9911 121.0587 55.0427 18.1717 179.6570 135 L 4.1337 8.2260 117.7230 57.8702 41.6097 179.5157 136 E 3.9952 8.6103 119.1336 59.1293 29.3614 179.0901 137 L 3.9409 8.1160 120.4732 58.0346 42.2088 178.6480 138 F 4.1877 8.3384 120.5381 61.6682 39.3250 177.3822 139 R 3.4549 8.3525 117.8710 58.7890 29.8911 179.0550 140 K 3.8413 8.2423 119.8176 59.6087 32.3384 178.7464 141 D 4.3268 8.1334 119.2535 57.2046 40.6570 178.6048 142 I 3.4625 7.5260 119.0632 63.7238 37.9107 177.7889 143 A 3.5729 7.7973 121.5484 54.8965 18.2110 179.4570 144 A 3.9244 7.7728 118.9501 55.3115 18.3814 180.0824 145 K 4.0167 7.9851 116.7416 59.5903 32.0324 179.0959 146 Y 4.3603 8.3140 117.3076 61.1838 37.8619 178.8812 147 K 3.9566 8.0672 119.0197 59.7801 32.0101 179.2740 148 E 4.0473 7.9368 117.0410 59.1858 29.4642 178.6948 149 L 4.3433 8.0151 116.7561 55.0113 41.9323 177.7988 150 G 3.8751 8.0244 107.4167 45.7924 0.0000 173.4034 151 Y 4.3360 7.8653 119.1960 57.0688 39.8975 176.2394 152 Q 2.9761 7.8256 122.7363 57.3897 27.1454 174.2831 153 G 3.4189 7.7063 112.2399 46.0415 0.0000 170.8769 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 0 M 8.30 4.46 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 1 V 7.94 4.26 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 0.89 0.00 0.00 0.95 0.00 0.00 2 L 8.26 4.38 0.00 0.93 0.75 0.58 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.39 4.59 0.00 4.08 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 4 E 8.78 4.27 0.00 2.19 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 2.43 2.51 0.00 5 G 8.13 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.00 3.92 0.00 1.90 1.72 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 2.21 2.26 0.00 7 W 8.08 4.40 0.00 3.56 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 8 Q 8.57 4.21 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 9 L 7.91 4.08 0.00 1.87 1.75 0.89 1.22 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 10 V 7.95 3.78 2.47 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 1.19 0.00 0.00 0.95 0.00 0.00 11 L 8.71 4.28 0.00 1.81 1.82 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.39 4.26 0.00 3.27 3.60 0.00 5.95 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.79 3.73 2.42 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 1.04 0.00 0.00 0.90 0.00 0.00 14 W 8.52 3.94 0.00 3.67 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 15 A 7.92 4.04 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 16 K 7.69 3.96 0.00 1.56 1.68 0.00 1.64 0.00 0.00 1.49 0.00 0.00 2.73 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.45 7.81 17 V 7.10 2.87 0.98 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 0.01 0.00 0.00 0.41 0.00 0.00 18 E 7.55 3.94 0.00 2.02 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 2.26 2.10 0.00 19 A 7.48 4.21 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 20 D 7.79 4.66 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 21 V 7.94 3.44 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 1.06 0.00 0.00 0.85 0.00 0.00 22 A 8.02 4.05 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 23 G 8.26 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 24 H 8.28 4.21 0.00 3.11 3.24 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.31 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 0.00 0.00 0.00 26 Q 7.99 3.88 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 27 D 7.84 4.32 0.00 2.78 2.66 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 0.00 0.00 0.00 0.00 28 I 7.78 3.66 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.75 0.91 0.00 0.00 29 L 7.70 3.48 0.00 1.51 1.21 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.87 3.79 1.91 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.79 0.91 0.00 0.00 31 R 8.01 3.81 0.00 1.97 2.08 0.00 3.03 0.00 0.00 2.94 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 32 L 7.87 3.90 0.00 1.65 1.44 1.05 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.05 4.57 0.00 3.09 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 34 K 7.97 4.08 0.00 1.72 1.84 0.00 1.69 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.76 7.81 35 S 7.94 4.27 0.00 3.62 3.57 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 36 H 8.21 4.77 0.00 3.08 2.92 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.54 0.00 2.17 2.15 0.00 3.86 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 38 E 8.29 4.12 0.00 2.31 2.31 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 2.35 2.59 0.00 39 T 8.25 3.75 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 0.74 0.00 0.00 40 L 8.05 3.77 0.00 1.50 1.77 0.18 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.88 4.08 0.00 2.14 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 2.37 2.39 0.00 42 K 7.98 4.26 0.00 1.79 1.64 0.00 1.87 0.00 0.00 1.74 0.00 0.00 3.18 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.70 1.88 7.81 43 F 7.76 4.31 0.00 2.66 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 44 D 8.27 4.38 0.00 2.60 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 45 R 7.88 4.19 0.00 1.72 2.24 0.00 3.32 0.00 0.00 3.61 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 46 F 7.42 5.14 0.00 3.02 3.15 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 47 K 8.34 4.00 0.00 1.77 1.90 0.00 1.78 0.00 0.00 1.93 0.00 0.00 2.84 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.55 1.41 7.81 48 H 8.23 4.45 0.00 3.29 3.43 0.00 5.55 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 49 L 7.31 4.03 0.00 1.62 1.60 0.79 0.50 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 50 K 9.48 4.33 0.00 1.67 1.84 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.53 7.81 51 T 7.45 4.74 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 1.20 0.00 0.00 52 E 8.61 3.93 0.00 2.05 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 2.36 2.37 0.00 53 A 7.93 3.97 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 54 E 7.85 3.92 0.00 2.12 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 2.33 2.33 0.00 55 M 8.01 4.11 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.54 0.00 56 K 8.30 3.98 0.00 1.81 1.83 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.17 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.62 7.81 57 A 7.45 4.45 1.24 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 0.00 0.00 0.00 58 S 7.31 4.19 0.00 3.80 3.64 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 59 E 8.75 4.01 0.00 2.22 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 0.00 2.35 2.40 0.00 60 D 7.94 4.36 0.00 2.80 3.02 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 61 L 7.31 3.15 0.00 0.77 1.42 0.79 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.71 3.86 0.00 1.83 1.90 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.45 7.81 63 K 8.21 4.01 0.00 2.03 1.89 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.77 7.81 64 D 8.40 4.63 0.00 3.02 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 65 G 8.09 3.57 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 0.00 0.00 0.00 66 V 7.87 3.63 2.25 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 1.05 0.00 0.00 0.97 0.00 0.00 67 T 8.14 3.94 4.47 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 0.00 0.00 0.00 1.30 0.00 0.00 68 S 8.45 4.19 0.00 4.12 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 69 L 8.21 4.27 0.00 1.78 1.90 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.31 4.05 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 71 A 8.08 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.17 3.73 0.00 1.70 1.78 0.25 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.67 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 0.00 0.00 0.00 74 A 7.76 4.01 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 75 I 7.45 3.77 1.84 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 0.90 0.00 0.00 76 L 7.77 3.96 0.00 1.34 1.53 -0.13 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.75 3.99 0.00 1.65 1.79 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.45 1.54 7.81 78 K 7.84 3.98 0.00 1.83 1.81 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.65 1.74 7.81 79 K 8.24 2.00 0.00 1.25 0.74 0.00 1.45 0.00 0.00 1.42 0.00 0.00 2.76 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.37 0.81 7.81 80 G 8.00 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 81 H 7.34 4.65 0.00 3.07 3.36 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.59 5.37 0.00 3.30 3.47 0.00 5.66 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.62 3.97 0.00 2.21 2.31 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 2.39 2.36 0.00 84 A 7.94 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.16 4.11 0.00 2.26 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 2.40 2.47 0.00 86 L 8.17 4.28 0.00 2.05 1.73 1.00 0.66 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 87 K 7.83 3.90 0.00 1.81 1.89 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.70 7.81 88 P 0.00 4.32 0.00 2.30 2.34 0.00 3.83 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.05 0.00 89 L 7.54 4.00 0.00 1.84 1.94 0.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.61 4.26 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.21 3.89 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 92 S 8.08 3.99 0.00 4.04 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 93 H 8.56 4.28 0.00 3.60 3.63 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.65 3.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.57 3.85 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 1.09 0.00 0.00 96 K 7.43 4.06 0.00 1.53 1.64 0.00 1.68 0.00 0.00 1.55 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.21 1.34 7.81 97 H 8.00 4.24 0.00 3.01 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.53 3.33 0.00 1.76 1.74 0.00 1.40 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.19 1.13 7.81 99 I 8.47 4.35 2.14 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.96 1.16 0.00 0.00 100 P 0.00 4.46 0.00 1.93 1.98 0.00 3.26 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 0.91 1.23 0.00 101 I 8.04 3.55 1.74 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.61 0.81 0.00 0.00 102 K 7.88 3.61 0.00 1.67 1.56 0.00 1.53 0.00 0.00 1.83 0.00 0.00 2.75 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 0.52 7.81 103 Y 7.95 4.25 0.00 3.17 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 0.00 104 L 7.92 4.27 0.00 1.83 1.78 0.69 1.11 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 0.00 105 E 7.91 4.05 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 106 F 7.94 4.56 0.00 3.25 2.92 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 0.00 107 I 8.14 3.90 2.02 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 1.10 0.00 0.00 108 S 8.17 4.21 0.00 4.24 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 0.00 109 E 8.42 4.03 0.00 2.19 2.30 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 2.37 2.40 0.00 110 A 8.04 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.08 3.70 2.14 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 1.62 1.05 1.06 0.00 0.00 112 I 7.82 3.85 2.13 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.91 1.15 0.00 0.00 113 H 8.39 4.14 0.00 3.37 3.50 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.88 3.51 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 0.99 0.00 0.00 0.99 0.00 0.00 115 L 7.80 3.76 0.00 1.08 0.13 0.88 0.73 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 0.00 116 H 7.89 4.36 0.00 3.46 3.61 0.00 5.95 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 0.00 117 S 7.65 4.16 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 0.00 118 R 7.96 4.10 0.00 1.47 1.63 0.00 3.10 0.00 0.00 2.98 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 119 H 8.25 5.04 0.00 3.18 3.20 0.00 5.64 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 0.00 120 P 0.00 4.30 0.00 2.21 2.29 0.00 3.75 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 2.08 1.96 0.00 121 G 8.15 3.63 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 0.00 0.00 0.00 122 N 8.21 5.03 0.00 2.78 2.91 0.00 0.00 6.67 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 0.00 123 F 7.82 4.92 0.00 2.98 3.01 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 0.00 124 G 7.63 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 0.00 125 A 8.47 3.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.98 4.20 0.00 2.68 2.68 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 0.00 0.00 0.00 0.00 127 A 7.75 3.93 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.92 3.11 0.00 1.27 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 129 G 8.09 3.48 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 0.00 130 A 7.93 3.87 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 0.00 131 M 8.12 4.00 0.00 2.50 2.38 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.94 0.00 132 N 8.43 4.31 0.00 2.93 2.94 0.00 0.00 6.88 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.10 3.84 0.00 1.93 1.75 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.37 7.81 134 A 7.99 3.86 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 0.00 135 L 8.23 4.13 0.00 1.90 1.84 1.01 0.74 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 0.00 136 E 8.61 4.00 0.00 2.15 1.99 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 2.34 2.57 0.00 137 L 8.12 3.94 0.00 1.86 1.96 1.02 0.99 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 0.00 138 F 8.34 4.19 0.00 3.05 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 8.35 3.45 0.00 1.93 1.82 0.00 3.14 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.96 0.00 140 K 8.24 3.84 0.00 1.84 1.91 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.43 7.81 141 D 8.13 4.33 0.00 2.68 2.68 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 0.00 0.00 0.00 0.00 142 I 7.53 3.46 1.19 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.94 0.30 0.00 0.00 143 A 7.80 3.57 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 0.00 144 A 7.77 3.92 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 0.00 145 K 7.99 4.02 0.00 2.10 1.95 0.00 1.58 0.00 0.00 1.98 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.55 7.81 146 Y 8.31 4.36 0.00 3.13 3.07 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 0.00 147 K 8.07 3.96 0.00 2.01 1.87 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.81 7.81 148 E 7.94 4.05 0.00 2.16 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 2.36 2.58 0.00 149 L 8.02 4.34 0.00 1.81 1.70 0.99 1.18 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 0.00 150 G 8.02 3.88 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 0.00 0.00 0.00 151 Y 7.87 4.34 0.00 2.54 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 0.00 152 Q 7.83 2.98 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 153 G 7.71 3.42 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