NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3415 8.2493 123.5825 52.6338 20.0435 176.1379 2 T 4.5238 8.0979 107.7737 60.8007 70.8052 172.7567 3 K 5.3240 8.3063 123.1253 54.9205 37.2633 176.1770 4 A 5.4017 9.2452 124.5499 51.0626 23.5040 175.0081 5 V 5.0884 8.7331 116.7817 60.8536 35.2840 173.2089 6 A 4.9463 9.1196 123.9563 50.4985 22.5892 175.0254 7 V 4.4318 8.4200 122.9113 61.5081 33.4847 174.5575 8 L 4.7262 8.9380 129.4556 54.1007 43.0040 176.2685 9 K 4.8463 9.1889 122.5015 55.3230 37.0114 176.4118 10 G 4.5100 8.0129 108.5470 45.4736 0.0000 171.9238 11 D 4.5178 8.7706 117.7606 55.4451 41.6330 176.5441 12 G 4.2135 7.5451 108.1036 43.5577 0.0000 171.2492 13 P 4.3683 0.0000 0.0000 64.1748 31.9073 176.4742 14 V 4.5422 7.8447 120.4066 62.7986 31.9224 174.9179 15 Q 4.7716 8.0862 123.9739 55.7388 32.0188 173.2717 16 G 4.1606 8.0134 106.3635 46.3723 0.0000 171.8167 17 I 5.1753 8.1462 119.5997 59.4881 41.0716 175.0477 18 I 4.7015 8.7924 127.4598 59.5082 40.3719 174.4959 19 N 4.9662 8.3706 124.2049 51.5336 41.1260 173.9972 20 F 5.2852 8.9077 119.5554 55.8990 43.4434 173.7307 21 E 5.3043 9.3906 122.8179 54.9998 33.8928 173.7283 22 Q 4.8503 9.6472 127.5834 54.8061 31.7101 175.6719 23 K 4.0969 9.0993 126.6968 59.2356 32.6921 177.4810 24 E 4.5429 7.9021 117.8760 54.7416 30.7918 176.7233 25 S 4.0649 8.4926 119.4164 61.7410 63.0407 175.6772 26 N 4.8286 7.9957 114.5073 52.5226 37.4005 175.1664 27 G 3.9714 7.8689 109.5963 44.3009 0.0000 172.0168 28 P 4.6909 0.0000 0.0000 62.8146 32.3277 175.9051 29 V 4.7319 9.0694 121.2315 61.2515 34.3180 174.3336 30 K 5.0323 9.3364 127.6647 55.1536 34.3329 175.6297 31 V 4.7100 9.6282 125.6046 60.8217 34.2022 174.2476 32 W 5.3951 8.5199 124.2098 54.6184 31.9361 175.6509 33 G 3.7449 7.6226 106.7425 46.4175 0.0000 171.0405 34 S 5.1664 7.6257 113.6882 57.1349 66.7037 174.4272 35 I 5.2746 8.5192 123.9771 59.6045 41.7726 174.3405 36 K 4.8486 9.2755 124.6147 55.7213 36.5075 176.9148 37 G 3.7390 8.9631 106.7467 45.6900 0.0000 173.3672 38 L 4.5430 7.5548 119.6026 52.9566 43.3315 176.1593 39 T 4.4314 8.1289 110.9844 60.6804 69.8148 174.3082 40 E 4.0007 8.6652 124.6980 57.7134 30.3333 175.1043 41 G 3.7561 8.4096 110.1997 43.9125 0.0000 172.7476 42 L 4.8073 8.1804 118.6534 55.0819 42.9462 176.6765 43 H 5.0116 8.9962 118.5043 53.9314 33.4748 173.3687 44 G 4.1914 9.2635 111.0745 47.0568 0.0000 172.4785 45 F 5.4732 8.9331 124.6509 57.0446 42.3231 172.9428 46 H 5.1368 8.8461 122.5364 54.2820 34.0689 172.5901 47 V 4.5587 8.6017 120.5814 62.0385 33.0110 174.7922 48 H 5.0374 9.4383 126.0275 54.4618 30.4731 175.7066 49 E 3.6982 8.8838 122.9917 58.9964 29.9900 177.2966 50 F 5.0454 8.6251 118.3904 54.8475 41.9065 176.6546 51 G 4.3360 8.4598 112.6075 44.5177 0.0000 174.0229 52 D 4.7153 7.9829 118.5693 52.6609 42.4090 174.3860 53 N 5.1624 8.7645 123.8169 52.6171 39.4150 175.9064 54 T 3.8262 8.4925 109.4153 64.2313 68.4705 174.9277 55 A 4.6203 7.9680 123.7652 51.2991 19.7552 177.4019 56 G 3.8342 8.0364 110.0958 46.8205 0.0000 174.2824 57 C 4.3533 8.5968 114.4633 59.8819 38.3768 175.8123 58 T 3.8267 7.9758 117.6945 66.3639 67.7996 175.4322 59 S 4.5742 7.8569 112.4906 59.0636 63.5712 175.3278 60 A 4.8651 7.6247 127.0347 54.1385 18.2748 178.5619 61 G 3.7888 7.9476 103.9561 43.8438 0.0000 170.5091 62 P 4.6578 0.0000 0.0000 62.0255 33.8130 175.0752 63 H 4.5370 8.3522 116.5008 55.5555 29.5533 175.6140 64 F 4.2202 9.0999 125.4197 58.5282 40.3399 174.8168 65 N 4.9286 7.9881 125.1401 51.4520 38.7631 172.8675 66 P 4.1699 0.0000 0.0000 64.8698 32.1259 178.0403 67 L 4.1766 7.5962 116.6843 54.0990 42.5535 176.1399 68 S 3.6001 7.4619 114.0013 60.0331 60.3526 170.0921 69 R 4.6856 8.2115 117.8562 53.9886 33.8737 176.0407 70 K 4.4506 8.8486 118.2742 55.9820 33.6993 176.6203 71 H 4.1811 8.8093 122.6418 56.8444 30.5850 174.7201 72 G 3.9876 7.7490 109.1286 45.7512 0.0000 172.7857 73 G 4.0873 8.9957 109.3583 43.6720 0.0000 173.3030 74 P 4.3223 0.0000 0.0000 65.1941 31.1961 177.6975 75 K 4.2204 7.8834 116.6040 57.7392 32.5996 176.9553 76 D 4.5522 7.5994 118.9124 53.9244 41.3970 176.2298 77 E 3.9008 8.7194 123.4242 58.8531 29.8837 176.4969 78 E 4.2257 7.8865 120.9528 55.4436 28.6876 174.6845 79 R 5.0049 7.5823 120.2354 56.5826 32.0785 174.0517 80 H 4.7864 9.4236 116.2802 54.8493 29.5756 177.2864 81 V 3.5114 8.1794 121.7997 65.8012 31.5513 177.1087 82 G 3.8919 8.1443 107.0510 45.6011 0.0000 172.9004 83 D 4.8529 7.8737 120.6176 54.3211 39.8302 175.6630 84 L 4.7467 8.3500 124.0488 54.0580 43.2944 178.4655 85 G 3.9699 7.8753 110.8231 47.0157 0.0000 175.2981 86 N 5.7085 8.7405 120.4740 51.2661 42.4267 172.7700 87 V 4.4314 8.4982 113.0033 59.8622 35.6943 174.8185 88 T 5.0664 8.2626 118.3924 61.8348 71.4960 172.7845 89 A 4.8595 8.9138 129.2494 50.3568 21.1599 177.0790 90 D 5.0140 9.0496 123.1887 51.9911 40.8706 177.1734 91 K 3.8189 8.5835 117.5796 60.0597 31.9800 177.1286 92 D 4.6045 8.6651 118.6294 53.8791 40.8311 177.6889 93 G 4.5491 8.4039 107.4310 45.0695 0.0000 173.2126 94 V 4.7169 7.4712 119.7237 60.9498 33.9055 174.5467 95 A 5.2137 9.1193 129.3586 49.2118 21.1584 174.8232 96 D 4.8607 8.6810 122.1857 54.7203 42.0358 176.4020 97 V 4.2868 8.8540 123.3423 61.2982 34.5251 174.8771 98 S 4.9877 8.2943 121.2083 58.0862 63.7648 173.2562 99 I 4.8511 9.6201 128.9795 59.3731 41.6843 174.2793 100 E 5.2916 8.7530 124.2588 54.6727 32.4157 174.1737 101 D 4.9887 9.4356 126.0258 52.9318 44.6356 175.9822 102 S 4.7625 8.9023 119.2721 59.0753 64.1731 175.8613 103 V 3.8125 8.2598 120.5935 65.3895 31.4910 176.5699 104 I 4.0771 7.7865 110.9478 61.1705 38.3034 174.4282 105 S 4.6602 8.2491 113.8018 57.5685 65.1699 173.9378 106 L 4.7258 8.9486 122.8749 54.3520 41.6965 176.6593 107 S 4.5205 7.8351 113.4842 58.0178 67.2473 176.0074 108 G 3.9548 8.5192 111.7759 44.6704 0.0000 173.2818 109 D 4.4061 8.8469 117.0264 56.7730 38.9348 177.1740 110 H 5.1098 8.0455 113.7011 55.3053 28.9296 174.8877 111 S 4.8726 8.4885 115.1453 58.2205 62.6902 174.0675 112 I 3.8637 7.9695 118.5993 60.2572 38.1669 175.3519 113 I 3.7098 7.0828 123.1227 62.9699 37.2028 176.5510 114 G 3.8320 9.4743 113.9740 45.1867 0.0000 172.9383 115 R 4.6525 7.5471 119.1630 54.8892 33.4894 174.6863 116 T 4.9645 8.0231 114.8703 62.1530 71.7061 173.3801 117 L 4.8322 8.7027 127.8985 53.5274 44.2280 175.2424 118 V 4.9384 8.7357 126.0678 60.9205 35.1297 174.1855 119 V 4.9630 8.5824 126.9495 60.4556 33.4252 175.2640 120 H 5.0362 9.2016 123.3730 54.7507 29.7660 175.3994 121 E 4.1864 9.2509 121.5381 58.9756 30.0548 176.3342 122 K 4.8139 8.6065 117.4708 53.8505 36.1009 175.3737 123 A 4.5798 8.3535 121.9628 52.2141 19.7075 176.1172 124 D 4.9895 9.4681 121.6831 53.2632 42.0540 175.9756 125 D 4.6522 9.3320 125.2412 52.8283 39.3187 176.6268 126 L 3.6090 9.9609 118.8206 56.1457 39.7621 175.8763 127 G 4.0819 8.8264 104.3004 46.0352 0.0000 174.8268 128 K 4.5224 8.0393 116.5855 55.8829 31.9758 177.8894 129 G 3.7076 8.0136 111.0069 46.0891 0.0000 176.3925 130 G 3.8224 8.3822 106.9289 45.2890 0.0000 172.4099 131 N 5.0472 7.1492 115.5943 50.1888 40.2274 174.2726 132 E 4.0258 8.7532 119.0731 59.4455 29.9876 178.5218 133 E 3.9148 8.2600 118.6073 59.3250 29.4690 178.3693 134 S 4.1334 8.5618 113.5606 61.4445 62.2996 175.4012 135 T 4.4225 7.6989 110.0349 61.9392 68.5228 175.4936 136 K 4.2873 7.6935 119.5893 58.0076 34.2640 176.9215 137 T 4.0799 7.9832 105.6693 60.0883 69.9499 175.2026 138 G 3.8594 8.2213 110.1894 45.5987 0.0000 173.6327 139 N 4.3384 7.9887 114.6451 54.0674 36.6587 176.2058 140 A 4.1815 7.0315 121.6020 52.7958 19.2695 179.7635 141 G 3.7632 7.3605 103.4699 44.8259 0.0000 173.0692 142 S 4.4491 8.6580 115.9353 58.4387 65.0544 174.2682 143 R 4.4822 8.3222 119.4830 54.8440 29.5850 176.5283 144 L 4.2739 8.5603 125.8933 57.5308 42.8918 177.3329 145 A 4.9229 7.7661 117.8416 51.2776 22.7069 174.0986 146 C 5.7079 8.4274 113.9224 55.2298 45.7587 172.7957 147 G 4.6320 8.0270 102.8610 45.9779 0.0000 172.9488 148 V 4.2152 8.3707 123.0431 62.5199 32.7879 175.7206 149 I 4.0824 9.1353 129.4917 61.0152 37.6410 175.2860 150 G 4.3677 8.7928 115.0813 43.9108 0.0000 171.9037 151 I 4.2440 8.2905 121.5999 61.1987 37.5908 175.4980 152 A 4.8306 8.5108 127.9096 49.6437 22.1225 176.1667 153 Q 4.0700 8.5286 118.8658 56.4366 29.2077 176.0502 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 4.34 1.27 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 0.00 0.00 2 T 8.10 4.52 4.37 0.00 0.00 0.00 0.00 0.00 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 3 K 8.31 5.32 0.00 1.73 1.75 0.00 1.81 0.00 0.00 1.94 0.00 0.00 3.08 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.57 1.51 7.81 4 A 9.25 5.40 1.13 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 5 V 8.73 5.09 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 0.67 0.00 0.00 0.95 0.00 0.00 6 A 9.12 4.95 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 7 V 8.42 4.43 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 8.94 4.73 0.00 1.69 1.59 1.05 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.19 4.85 0.00 1.63 1.62 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.37 7.81 10 G 8.01 4.51 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 0.00 11 D 8.77 4.52 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 7.55 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 4.37 0.00 2.19 2.18 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.94 0.00 14 V 7.84 4.54 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 0.65 0.00 0.00 0.95 0.00 0.00 15 Q 8.09 4.77 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.53 0.00 0.00 0.00 0.00 0.00 2.45 2.34 0.00 16 G 8.01 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 17 I 8.15 5.18 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.15 0.84 0.00 0.00 18 I 8.79 4.70 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.29 0.46 0.00 0.00 19 N 8.37 4.97 0.00 1.44 1.57 0.00 0.00 6.38 8.05 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 20 F 8.91 5.29 0.00 2.79 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 9.39 5.30 0.00 2.49 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 0.00 2.33 2.56 0.00 22 Q 9.65 4.85 0.00 2.15 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.60 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 23 K 9.10 4.10 0.00 1.81 1.87 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.47 1.49 7.81 24 E 7.90 4.54 0.00 2.07 1.86 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 2.36 2.27 0.00 25 S 8.49 4.06 0.00 3.86 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.00 4.83 0.00 2.82 2.89 0.00 0.00 5.98 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 27 G 7.87 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 0.00 0.00 0.00 28 P 0.00 4.69 0.00 2.13 2.10 0.00 3.75 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 2.02 1.99 0.00 29 V 9.07 4.73 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 1.33 0.00 0.00 1.09 0.00 0.00 30 K 9.34 5.03 0.00 1.92 1.83 0.00 1.59 0.00 0.00 1.49 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.44 7.81 31 V 9.63 4.71 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 0.64 0.00 0.00 1.00 0.00 0.00 32 W 8.52 5.40 0.00 3.51 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 33 G 7.62 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 34 S 7.63 5.17 0.00 3.89 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 35 I 8.52 5.27 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 1.29 0.66 0.96 0.00 0.00 36 K 9.28 4.85 0.00 1.71 1.85 0.00 1.33 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.35 7.81 37 G 8.96 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 38 L 7.55 4.54 0.00 1.85 1.49 0.86 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.13 4.43 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 8.67 4.00 0.00 1.95 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 2.48 0.00 41 G 8.41 3.76 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 0.00 0.00 0.00 42 L 8.18 4.81 0.00 1.51 1.59 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.00 5.01 0.00 3.06 3.29 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 9.26 4.19 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 0.00 0.00 0.00 45 F 8.93 5.47 0.00 2.98 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.85 5.14 0.00 3.07 3.11 0.00 5.85 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 47 V 8.60 4.56 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 0.90 0.00 0.00 0.90 0.00 0.00 48 H 9.44 5.04 0.00 3.05 3.38 0.00 5.71 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.88 3.70 0.00 1.66 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.10 0.00 50 F 8.63 5.05 0.00 3.19 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 51 G 8.46 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 7.98 4.72 0.00 2.61 2.82 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 53 N 8.76 5.16 0.00 2.76 2.71 0.00 0.00 7.40 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 8.49 3.83 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 1.24 0.00 0.00 55 A 7.97 4.62 1.27 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 0.00 0.00 56 G 8.04 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 57 C 8.60 4.35 0.00 2.96 3.09 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 58 T 7.98 3.83 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 1.24 0.00 0.00 59 S 7.86 4.57 0.00 4.15 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.62 4.87 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 61 G 7.95 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.66 0.00 2.02 2.19 0.00 3.68 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 63 H 8.35 4.54 0.00 2.85 3.21 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.10 4.22 0.00 2.95 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 65 N 7.99 4.93 0.00 2.62 2.43 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 4.17 0.00 2.07 1.84 0.00 2.96 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 1.11 0.00 67 L 7.60 4.18 0.00 1.56 1.69 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.46 3.60 0.00 4.00 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 69 R 8.21 4.69 0.00 1.89 1.96 0.00 3.12 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 70 K 8.85 4.45 0.00 1.69 1.70 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.52 7.81 71 H 8.81 4.18 0.00 3.10 3.28 0.00 5.98 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 7.75 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 9.00 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 74 P 0.00 4.32 0.00 2.23 2.40 0.00 3.78 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.05 0.00 75 K 7.88 4.22 0.00 1.77 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.60 4.55 0.00 2.80 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 77 E 8.72 3.90 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 78 E 7.89 4.23 0.00 1.92 1.86 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 2.23 2.31 0.00 79 R 7.58 5.00 0.00 1.96 1.78 0.00 2.71 0.00 0.00 3.86 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 80 H 9.42 4.79 0.00 3.48 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.18 3.51 1.58 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 0.81 0.00 0.00 0.50 0.00 0.00 82 G 8.14 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 7.87 4.85 0.00 2.78 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 84 L 8.35 4.75 0.00 1.98 1.91 1.01 1.00 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 85 G 7.88 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 0.00 0.00 0.00 86 N 8.74 5.71 0.00 2.58 2.69 0.00 0.00 6.55 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.50 4.43 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 -0.23 0.00 0.00 0.85 0.00 0.00 88 T 8.26 5.07 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 89 A 8.91 4.86 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 90 D 9.05 5.01 0.00 2.81 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.58 3.82 0.00 1.88 2.01 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.48 7.81 92 D 8.67 4.60 0.00 2.89 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 93 G 8.40 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.47 4.72 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 0.77 0.00 0.00 0.92 0.00 0.00 95 A 9.12 5.21 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.68 4.86 0.00 2.56 2.61 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 0.00 0.00 0.00 0.00 97 V 8.85 4.29 1.94 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 0.66 0.00 0.00 0.60 0.00 0.00 98 S 8.29 4.99 0.00 3.92 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 99 I 9.62 4.85 1.96 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 1.13 0.80 1.00 0.00 0.00 100 E 8.75 5.29 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 2.33 0.00 101 D 9.44 4.99 0.00 2.78 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 8.90 4.76 0.00 3.92 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 0.00 103 V 8.26 3.81 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 0.76 0.00 0.00 0.95 0.00 0.00 104 I 7.79 4.08 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.82 1.07 0.00 0.00 105 S 8.25 4.66 0.00 3.89 3.75 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 0.00 106 L 8.95 4.73 0.00 1.89 1.65 1.03 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.84 4.52 0.00 3.86 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 0.00 108 G 8.52 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 0.00 109 D 8.85 4.41 0.00 2.82 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 0.00 110 H 8.05 5.11 0.00 3.20 3.44 0.00 5.73 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 S 8.49 4.87 0.00 3.76 3.76 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 0.00 112 I 7.97 3.86 1.58 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.31 0.92 0.00 0.00 113 I 7.08 3.71 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.74 0.83 0.00 0.00 114 G 9.47 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 7.55 4.65 0.00 1.60 1.85 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 1.36 1.23 0.00 116 T 8.02 4.96 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 1.16 0.00 0.00 117 L 8.70 4.83 0.00 1.74 1.50 0.30 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.74 4.94 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 0.71 0.00 0.00 0.72 0.00 0.00 119 V 8.58 4.96 2.29 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 0.82 0.00 0.00 1.01 0.00 0.00 120 H 9.20 5.04 0.00 3.21 3.56 0.00 5.66 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 0.00 121 E 9.25 4.19 0.00 2.02 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 0.00 2.37 2.34 0.00 122 K 8.61 4.81 0.00 1.74 1.70 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.39 7.81 123 A 8.35 4.58 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 0.00 124 D 9.47 4.99 0.00 2.78 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.33 4.65 0.00 2.87 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 9.96 3.61 0.00 1.83 1.76 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.83 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.04 4.52 0.00 1.85 1.81 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.52 7.81 129 G 8.01 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 0.00 130 G 8.38 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 7.15 5.05 0.00 2.68 2.79 0.00 0.00 6.83 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 8.75 4.03 0.00 2.02 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 2.37 2.31 0.00 133 E 8.26 3.91 0.00 2.10 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 2.43 2.40 0.00 134 S 8.56 4.13 0.00 4.11 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 0.00 135 T 7.70 4.42 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 0.00 136 K 7.69 4.29 0.00 1.75 1.78 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.31 1.54 7.81 137 T 7.98 4.08 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 1.18 0.00 0.00 138 G 8.22 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 0.00 139 N 7.99 4.34 0.00 2.96 2.91 0.00 0.00 6.89 6.96 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 0.00 140 A 7.03 4.18 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 0.00 141 G 7.36 3.76 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 0.00 0.00 0.00 142 S 8.66 4.45 0.00 3.96 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 0.00 143 R 8.32 4.48 0.00 1.68 1.86 0.00 3.26 0.00 0.00 3.13 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 144 L 8.56 4.27 0.00 1.67 1.70 0.96 0.87 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 0.00 145 A 7.77 4.92 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 0.00 0.00 0.00 0.00 0.00 0.00 146 C 8.43 5.71 0.00 2.99 3.09 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 0.00 147 G 8.03 4.63 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 0.00 148 V 8.37 4.22 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 0.97 0.00 0.00 149 I 9.14 4.08 1.79 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.34 0.38 0.00 0.00 150 G 8.79 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.29 4.24 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.54 0.91 0.00 0.00 152 A 8.51 4.83 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 8.53 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00