NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.1527 8.2601 123.5696 51.3805 19.8925 177.2689 4 A 3.5189 7.7965 123.0374 51.8641 19.1643 176.5633 5 T 4.0416 8.1958 117.8157 61.4766 69.1818 172.9903 6 E 3.9096 8.9136 123.5476 59.5091 29.2176 178.8016 7 E 3.8855 8.3973 120.2315 58.9995 29.5708 177.7107 8 Q 4.3970 8.1870 116.5191 56.7423 29.1817 175.7156 9 I 4.3560 9.0043 116.8634 63.2954 38.9923 177.1659 10 A 4.0791 8.1242 120.9052 55.8696 17.9802 179.0804 11 E 4.2505 8.1307 115.8845 59.5160 29.4361 179.4242 12 F 3.9945 8.6782 117.5878 60.0435 39.2638 176.8965 13 K 4.7112 8.3299 117.1493 58.1350 33.0094 177.9045 14 E 3.9503 9.1616 120.2412 58.6959 27.8365 177.8943 15 A 4.3258 8.3438 119.2862 52.7053 20.0852 178.2414 16 F 4.2978 8.3693 118.7790 60.4291 39.1501 177.1122 17 S 4.0601 7.9188 114.2558 60.9679 63.1789 175.9594 18 L 4.1283 6.9566 121.1784 57.5181 41.7802 177.9724 19 F 4.7165 7.5430 114.8939 56.3553 41.2213 175.6887 20 D 4.5282 8.7235 120.7712 51.3229 39.8882 175.2300 21 K 3.6430 7.6719 123.3103 59.6066 33.1195 178.3538 22 D 4.4999 8.3168 119.3175 58.5620 39.1912 179.0612 23 G 3.5659 6.5503 106.4067 48.1137 0.0000 174.1920 24 D 4.5085 7.3049 117.3974 52.0971 41.3327 177.4153 25 G 4.5649 9.2559 114.5890 44.5130 0.0000 171.5487 26 T 5.1290 7.6883 108.3687 59.6867 71.4631 172.8575 27 I 4.8054 8.2155 116.2585 59.0296 41.0406 175.1515 28 T 3.7804 8.3054 114.2550 61.7772 69.5714 174.5174 29 T 3.9130 8.8894 118.0521 65.6062 68.0185 176.9471 30 K 4.0683 7.8068 119.5020 59.8279 32.4297 178.7706 31 E 3.9896 8.3363 118.6943 59.3394 29.4579 178.8688 32 L 4.0081 8.1349 120.6049 58.2527 42.0160 178.8854 33 G 3.8101 8.2035 104.8703 48.6511 0.0000 175.3557 34 T 3.8233 7.6505 118.5707 66.0203 68.2266 176.8513 35 V 3.1609 7.6019 119.5665 66.0690 31.8368 177.7617 36 M 4.1667 8.0611 118.4189 58.9651 31.8734 177.8996 37 R 4.5929 8.5913 119.0478 57.9482 29.7924 179.7012 38 S 3.9460 7.4988 115.7355 61.1676 63.9737 178.3278 39 L 4.2284 7.0105 122.0294 54.1576 41.6684 178.2651 40 G 4.0534 7.9769 112.5591 46.0446 0.0000 175.3531 41 Q 4.0614 7.3927 118.3749 55.8917 29.6967 176.8281 42 N 4.7315 8.3972 111.0311 51.5742 37.5359 171.9724 43 P 4.1534 0.0000 0.0000 62.7820 32.5363 175.8199 44 T 4.2911 8.1292 108.6951 60.7570 69.7238 175.5312 45 E 3.6545 8.7628 121.1829 58.6631 29.4737 177.8651 46 A 4.6201 7.8384 117.8756 51.6387 20.4444 175.7940 47 E 4.3203 7.9866 115.2079 56.0981 29.8453 176.3208 48 L 4.2405 7.3326 118.4734 57.0309 42.1935 177.1946 49 Q 4.3389 7.8815 116.7093 58.8789 29.6401 177.6413 50 D 4.6026 7.9880 116.5605 57.7625 41.3130 178.7951 51 M 4.1808 8.0702 117.6703 58.1133 32.6911 177.3661 52 I 3.9664 7.7822 118.0598 63.5876 38.5613 176.9433 53 N 4.2614 9.1059 118.0212 56.4660 38.6739 175.0671 54 E 4.2374 8.0640 116.5069 57.6786 30.1408 177.0737 55 V 4.4533 7.8353 111.2682 60.1959 32.6429 174.0917 56 D 4.6967 8.0810 122.6050 52.3638 39.8500 175.9782 57 A 4.6733 8.1119 120.7709 51.6261 20.3143 176.5007 58 D 5.2645 7.4824 118.5111 53.2184 43.3629 179.0590 59 G 3.8599 8.7470 110.7153 46.5733 0.0000 173.3139 60 N 4.0023 10.3162 115.3518 51.6715 37.0386 172.0857 61 G 3.3848 7.3243 106.8276 44.5918 0.0000 171.1740 62 T 4.7331 7.7060 114.8649 60.3787 70.5326 172.3357 63 I 4.4970 8.1937 128.7991 59.1527 39.9745 175.4995 64 D 5.3409 8.3880 131.0419 53.3440 40.8202 176.3736 65 F 3.7599 9.3743 115.0250 60.3696 39.1968 175.8003 66 P 4.3511 0.0000 0.0000 64.3534 30.9036 178.0179 67 E 4.1555 8.5595 117.9239 58.4939 30.0485 178.1799 68 F 4.2824 7.7250 120.2383 61.2942 39.3728 177.2988 69 L 3.8794 8.6367 119.0588 57.8099 41.8669 177.9568 70 T 4.3809 7.0490 113.2848 63.3694 68.5843 174.5949 71 M 4.5422 7.6031 119.0342 55.4615 32.8410 176.3254 72 M 4.4552 7.2506 117.6671 52.9155 31.5904 173.3050 73 A 4.6304 7.8038 123.6224 53.1077 26.3000 179.0920 74 R 3.8973 7.9568 113.9763 59.4010 30.1584 177.3049 75 K 4.4478 6.8449 115.5694 55.2164 34.4311 173.7846 76 M 4.1222 7.5297 130.1948 56.2203 35.5877 176.9181 77 K 4.0694 8.0365 120.4548 58.4795 32.6209 177.3727 78 D 4.3881 7.2882 116.7228 56.8637 41.5953 176.1027 79 T 3.9580 7.6868 115.6175 62.6585 67.3357 173.3414 80 D 4.9262 8.4385 128.7054 53.5334 42.6049 177.3052 81 S 4.5252 8.1710 115.6823 59.6888 63.1593 174.8626 82 E 3.9378 8.2364 122.9885 59.7354 29.6000 178.1623 83 E 4.1344 8.2825 117.5464 59.5256 29.6186 178.8031 84 E 3.9754 8.3046 118.1327 59.9784 29.3422 179.7441 85 I 3.8799 7.3760 117.9913 64.2912 37.0020 177.9828 86 R 4.1676 8.2514 118.3218 57.9834 29.9690 177.5984 87 E 4.0980 8.0279 117.1161 58.5757 30.0413 177.2285 88 A 4.3890 8.0002 117.1209 53.3420 18.3833 177.7751 89 F 3.9400 8.3078 119.8456 60.1024 40.2836 177.7297 90 R 3.8311 7.8247 119.1190 59.1317 30.0947 179.1080 91 V 3.7177 7.7280 116.9147 66.0177 31.7988 177.6112 92 F 4.0841 8.2079 115.5193 59.8609 40.2781 175.3191 93 D 4.4463 7.3549 119.4566 54.4694 38.9872 176.2321 94 K 4.1468 8.3792 120.5596 57.5118 32.6283 177.6551 95 D 4.6913 8.3442 116.4853 52.6959 41.0801 177.1185 96 G 3.9859 8.3291 107.9632 45.5573 0.0000 173.5577 97 N 4.6265 8.2285 115.4715 51.7980 37.7113 176.5719 98 G 4.1884 8.6833 106.5088 46.3993 0.0000 173.1292 99 Y 4.8740 7.8228 115.7979 56.1780 40.0472 175.5785 100 I 4.5242 8.8874 124.2464 60.7412 39.9880 174.6402 101 S 4.7728 8.4931 115.5487 56.3877 65.8670 176.1582 102 A 3.9480 9.0020 124.6512 55.5218 18.0999 179.6508 103 A 3.9178 8.1038 118.9473 55.6445 18.4658 179.5701 104 E 3.9864 8.0828 115.1523 59.6025 29.9752 177.8140 105 L 4.0774 8.4754 121.7098 57.8256 41.7924 178.4785 106 R 3.9334 8.1675 119.9438 60.7770 30.4316 177.3953 107 H 3.9497 8.3080 116.7588 58.7218 29.4053 176.5686 108 V 3.3702 8.0810 121.4130 66.2995 31.2667 178.4359 109 M 4.0110 8.3298 119.0580 58.4657 31.7818 178.6951 110 T 4.4231 7.8959 111.1992 64.6110 68.7297 175.9546 111 N 4.2192 8.0425 117.9444 55.9564 38.5466 176.5189 112 L 4.3140 7.3489 116.3653 54.3230 42.6803 177.0155 113 G 3.6597 9.1061 105.7845 45.3027 0.0000 174.5149 114 E 4.4744 7.7100 118.2285 54.8217 33.3980 173.7903 115 K 4.5252 8.6753 126.3185 55.5092 32.3636 175.9508 116 L 4.6953 8.1992 124.0850 52.9162 43.9103 176.1670 117 T 4.1709 8.2357 117.0992 61.2154 67.9381 174.9635 118 D 4.4009 8.8402 128.5232 56.5522 41.6338 177.0661 119 E 4.3493 8.6897 118.3417 59.5269 30.1134 178.6387 120 E 4.7472 7.4093 116.0806 56.8654 29.8926 177.9751 121 V 4.2898 7.7834 116.9680 64.9222 34.0846 176.3830 122 D 4.5803 7.6637 115.0642 55.4027 40.7376 176.8471 123 E 4.4227 8.3234 120.5156 59.1458 30.3354 176.9199 124 M 4.0921 8.4776 116.7964 57.7524 32.1759 179.3505 125 I 3.7308 7.0080 118.8730 64.7403 38.0137 177.0167 126 R 3.8396 8.3521 118.9178 59.8673 29.5088 177.0014 127 E 4.0188 8.2378 120.6643 58.1470 30.0821 178.0026 128 A 4.5093 7.6672 118.7727 52.8522 20.4547 176.8301 129 D 4.6799 8.1500 117.7024 54.1724 41.9099 175.7843 130 I 4.2643 9.4300 127.4936 62.2557 38.4855 176.1428 131 D 4.6835 8.2864 118.2463 52.3982 39.7645 176.9582 132 G 4.0875 8.1823 105.8953 46.9444 0.0000 174.0823 133 D 4.7306 7.9017 117.4270 53.1726 39.3708 179.6517 134 G 4.2037 8.1529 110.6419 46.8480 0.0000 174.4691 135 Q 4.8453 8.2477 116.5680 54.3304 31.7449 175.6918 136 V 4.3629 8.0009 112.9913 60.5012 33.2556 175.8702 137 N 4.7847 8.5284 122.5705 51.6316 39.6588 175.4837 138 Y 3.1100 8.4148 118.7539 60.9539 38.5355 177.6251 139 E 3.5121 7.9507 118.5794 59.7478 29.5907 179.5240 140 E 3.9493 8.7084 117.2984 59.0356 29.8672 178.6108 141 F 4.1533 8.2310 121.9095 61.5841 39.3405 176.6748 142 V 3.3000 8.1978 117.7601 66.8156 31.0733 177.3289 143 Q 3.7253 8.1529 115.6334 59.5389 28.4346 179.6097 144 M 3.6754 8.1481 120.4380 59.2065 32.7873 178.3902 145 M 3.9682 7.3592 117.0554 58.5291 32.4844 177.9822 146 T 3.8615 7.9661 109.6645 63.8923 69.6424 174.6264 147 A 3.8339 7.3971 124.0726 51.9730 18.9252 177.2922 148 K 4.1197 8.4973 121.5117 56.4406 32.3260 175.9481 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 3 A 8.26 4.15 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 4 A 7.80 3.52 1.02 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 5 T 8.20 4.04 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 1.21 0.00 0.00 6 E 8.91 3.91 0.00 2.19 2.20 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 2.36 2.32 0.00 7 E 8.40 3.89 0.00 2.04 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 2.43 2.36 0.00 8 Q 8.19 4.40 0.00 1.92 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.50 0.00 0.00 0.00 0.00 0.00 1.85 2.07 0.00 9 I 9.00 4.36 2.03 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 1.72 0.78 0.96 0.00 0.00 10 A 8.12 4.08 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 11 E 8.13 4.25 0.00 2.33 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 0.00 2.41 2.65 0.00 12 F 8.68 3.99 0.00 3.31 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.33 4.71 0.00 2.16 2.00 0.00 1.89 0.00 0.00 1.80 0.00 0.00 3.29 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.79 7.81 14 E 9.16 3.95 0.00 2.25 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 2.38 2.55 0.00 15 A 8.34 4.33 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 16 F 8.37 4.30 0.00 2.85 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 17 S 7.92 4.06 0.00 3.93 3.84 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 18 L 6.96 4.13 0.00 1.80 2.12 1.06 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 19 F 7.54 4.72 0.00 2.84 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 20 D 8.72 4.53 0.00 2.35 2.35 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 21 K 7.67 3.64 0.00 1.67 1.64 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.35 1.33 7.81 22 D 8.32 4.50 0.00 2.82 2.83 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 23 G 6.55 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 24 D 7.30 4.51 0.00 2.79 2.63 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 25 G 9.26 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.69 5.13 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 1.16 0.00 0.00 27 I 8.22 4.81 1.88 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.04 0.56 0.00 0.00 28 T 8.31 3.78 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 1.18 0.00 0.00 29 T 8.89 3.91 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 1.22 0.00 0.00 30 K 7.81 4.07 0.00 1.84 1.88 0.00 1.56 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.65 7.81 31 E 8.34 3.99 0.00 2.27 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 2.34 2.30 0.00 32 L 8.13 4.01 0.00 1.81 1.86 1.12 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.20 3.81 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 0.00 34 T 7.65 3.82 4.40 0.00 0.00 0.00 0.00 0.00 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 35 V 7.60 3.16 2.02 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 0.68 0.00 0.00 0.92 0.00 0.00 36 M 8.06 4.17 0.00 2.11 2.19 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 2.84 2.73 0.00 37 R 8.59 4.59 0.00 1.77 1.80 0.00 3.13 0.00 0.00 3.29 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 38 S 7.50 3.95 0.00 3.87 3.50 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 39 L 7.01 4.23 0.00 1.83 1.53 0.59 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 40 G 7.98 4.05 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 0.00 0.00 0.00 41 Q 7.39 4.06 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 7.05 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 42 N 8.40 4.73 0.00 2.73 2.75 0.00 0.00 5.99 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.15 0.00 2.20 2.14 0.00 3.74 0.00 0.00 3.69 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 44 T 8.13 4.29 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 45 E 8.76 3.65 0.00 1.98 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 2.31 2.31 0.00 46 A 7.84 4.62 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 47 E 7.99 4.32 0.00 1.97 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 2.27 2.23 0.00 48 L 7.33 4.24 0.00 1.79 1.67 0.94 0.72 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 49 Q 7.88 4.34 0.00 2.35 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.46 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 50 D 7.99 4.60 0.00 2.64 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 51 M 8.07 4.18 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.52 0.00 52 I 7.78 3.97 1.91 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 1.32 1.62 1.00 0.00 0.00 53 N 9.11 4.26 0.00 2.68 3.01 0.00 0.00 7.27 7.53 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 54 E 8.06 4.24 0.00 2.25 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 2.28 2.39 0.00 55 V 7.84 4.45 2.35 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 0.76 0.00 0.00 1.11 0.00 0.00 56 D 8.08 4.70 0.00 2.66 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 57 A 8.11 4.67 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 58 D 7.48 5.26 0.00 2.84 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 G 8.75 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 60 N 10.32 4.00 0.00 2.79 2.79 0.00 0.00 7.10 7.86 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 61 G 7.32 3.38 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 62 T 7.71 4.73 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 1.23 0.00 0.00 63 I 8.19 4.50 1.93 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.38 1.00 0.00 0.00 64 D 8.39 5.34 0.00 3.07 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 F 9.37 3.76 0.00 2.95 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 66 P 0.00 4.35 0.00 2.30 2.12 0.00 4.22 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 67 E 8.56 4.16 0.00 2.28 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 2.69 0.00 68 F 7.73 4.28 0.00 2.89 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 8.64 3.88 0.00 1.71 1.81 0.74 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.05 4.38 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 71 M 7.60 4.54 0.00 1.92 2.11 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.57 0.00 72 M 7.25 4.46 0.00 1.95 1.68 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 1.90 0.00 73 A 7.80 4.63 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 74 R 7.96 3.90 0.00 1.77 2.02 0.00 3.39 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 75 K 6.84 4.45 0.00 1.65 1.70 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.35 7.81 76 M 7.53 4.12 0.00 2.09 1.92 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 2.33 2.27 0.00 77 K 8.04 4.07 0.00 1.69 1.78 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.39 7.81 78 D 7.29 4.39 0.00 2.73 2.62 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 79 T 7.69 3.96 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 1.27 0.00 0.00 80 D 8.44 4.93 0.00 2.64 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.17 4.53 0.00 4.06 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 82 E 8.24 3.94 0.00 2.01 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 2.40 2.53 0.00 83 E 8.28 4.13 0.00 2.12 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 2.41 2.48 0.00 84 E 8.30 3.98 0.00 2.29 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 0.00 2.44 2.54 0.00 85 I 7.38 3.88 2.21 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.49 1.05 0.00 0.00 86 R 8.25 4.17 0.00 1.79 2.02 0.00 2.98 0.00 0.00 2.97 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.22 0.00 87 E 8.03 4.10 0.00 2.25 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 2.36 2.67 0.00 88 A 8.00 4.39 1.57 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 89 F 8.31 3.94 0.00 3.19 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 90 R 7.82 3.83 0.00 1.72 2.01 0.00 3.23 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 91 V 7.73 3.72 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 0.86 0.00 0.00 1.04 0.00 0.00 92 F 8.21 4.08 0.00 2.62 2.95 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 93 D 7.35 4.45 0.00 1.78 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 0.00 0.00 0.00 0.00 94 K 8.38 4.15 0.00 1.87 1.78 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.63 1.46 7.81 95 D 8.34 4.69 0.00 2.73 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 96 G 8.33 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 97 N 8.23 4.63 0.00 2.85 3.15 0.00 0.00 6.89 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 98 G 8.68 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 99 Y 7.82 4.87 0.00 2.80 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 0.00 100 I 8.89 4.52 2.10 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.30 0.97 0.00 0.00 101 S 8.49 4.77 0.00 4.05 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 0.00 102 A 9.00 3.95 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 0.00 103 A 8.10 3.92 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.08 3.99 0.00 2.31 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 2.47 2.46 0.00 105 L 8.48 4.08 0.00 1.91 1.88 1.23 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.17 3.93 0.00 1.89 2.10 0.00 3.34 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 107 H 8.31 3.95 0.00 3.43 3.22 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.08 3.37 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 0.45 0.00 0.00 0.78 0.00 0.00 109 M 8.33 4.01 0.00 2.02 2.25 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.88 0.00 110 T 7.90 4.42 4.20 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 1.25 0.00 0.00 111 N 8.04 4.22 0.00 2.57 2.86 0.00 0.00 6.93 7.85 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 0.00 112 L 7.35 4.31 0.00 1.51 1.68 0.89 1.30 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 0.00 113 G 9.11 3.66 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 0.00 0.00 0.00 114 E 7.71 4.47 0.00 2.01 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 2.23 2.34 0.00 115 K 8.68 4.53 0.00 1.78 1.75 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.39 7.81 116 L 8.20 4.70 0.00 1.63 1.59 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.24 4.17 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 0.00 118 D 8.84 4.40 0.00 2.68 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 0.00 119 E 8.69 4.35 0.00 2.02 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 0.00 2.29 2.42 0.00 120 E 7.41 4.75 0.00 2.11 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 2.36 2.25 0.00 121 V 7.78 4.29 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 1.11 0.00 0.00 1.02 0.00 0.00 122 D 7.66 4.58 0.00 2.63 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 0.00 123 E 8.32 4.42 0.00 2.28 1.84 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 2.24 2.48 0.00 124 M 8.48 4.09 0.00 2.08 2.08 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 2.87 2.68 0.00 125 I 7.01 3.73 1.99 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 1.70 0.94 0.99 0.00 0.00 126 R 8.35 3.84 0.00 2.10 1.86 0.00 3.21 0.00 0.00 3.28 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 127 E 8.24 4.02 0.00 1.97 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 2.33 2.35 0.00 128 A 7.67 4.51 1.42 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 0.00 129 D 8.15 4.68 0.00 2.78 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 0.00 130 I 9.43 4.26 1.94 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 1.35 0.93 0.91 0.00 0.00 131 D 8.29 4.68 0.00 2.85 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 0.00 132 G 8.18 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 0.00 133 D 7.90 4.73 0.00 2.89 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 8.15 4.20 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 0.00 135 Q 8.25 4.85 0.00 2.32 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.67 0.00 0.00 0.00 0.00 0.00 2.41 2.76 0.00 136 V 8.00 4.36 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 0.80 0.00 0.00 1.07 0.00 0.00 137 N 8.53 4.78 0.00 2.51 2.49 0.00 0.00 6.14 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 Y 8.41 3.11 0.00 2.05 2.64 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 0.00 139 E 7.95 3.51 0.00 2.21 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 140 E 8.71 3.95 0.00 2.32 2.19 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 2.46 2.52 0.00 141 F 8.23 4.15 0.00 3.34 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 0.00 142 V 8.20 3.30 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 0.85 0.00 0.00 -0.11 0.00 0.00 143 Q 8.15 3.73 0.00 2.23 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.33 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 144 M 8.15 3.68 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.67 0.00 145 M 7.36 3.97 0.00 1.86 1.63 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 146 T 7.97 3.86 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 1.15 0.00 0.00 147 A 7.40 3.83 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 0.00 148 K 8.50 4.12 0.00 1.68 1.65 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.38 7.81