NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3670 0.0000 0.0000 62.2715 33.0614 176.3750 3 K 4.0536 8.5146 117.1087 58.6876 30.8433 175.9757 4 K 4.3558 7.0454 117.6543 53.0208 34.2375 174.2674 5 V 4.5441 8.1753 126.3617 61.8539 33.5506 174.3784 6 L 5.0806 8.2389 124.9178 53.3317 46.1586 175.0564 7 T 4.9875 8.1674 108.9799 61.0164 71.3526 173.3805 8 G 4.2388 8.8820 111.8509 46.3090 0.0000 171.7382 9 V 4.7375 8.0152 112.9916 59.5049 33.9398 176.1505 10 V 4.1351 8.6271 126.0797 63.4625 31.7365 176.4551 11 V 4.2822 8.5900 127.3270 61.8866 33.1412 175.9751 12 S 4.7512 7.7469 116.1081 56.6859 65.7887 173.6753 13 D 5.0544 8.5836 123.0761 53.0679 40.6576 175.7849 14 K 4.4246 7.5422 118.7566 56.7598 31.8096 176.7576 15 M 4.8626 7.4963 115.8401 53.6360 36.2609 175.2414 16 Q 4.0377 8.6481 120.7930 57.0948 29.6227 176.6127 17 K 4.4656 9.0483 119.7868 56.2693 30.0178 174.3099 18 T 5.2305 7.4410 111.4588 62.5275 72.8448 173.7113 19 V 4.7067 8.7736 115.3099 60.5399 36.8503 173.7682 20 T 4.9708 8.7545 120.6393 62.2971 70.5691 173.9571 21 V 4.6523 9.2277 126.6366 60.9594 34.6729 173.6430 22 L 5.1059 8.4189 130.1134 53.7122 43.9184 175.4012 23 V 4.5554 8.7166 119.0084 59.7321 35.3929 175.0976 24 E 5.1590 8.8338 124.2215 55.4149 32.1858 175.9630 25 R 4.6625 9.0392 118.3388 55.3795 32.5603 175.0597 26 Q 4.9586 8.8397 122.9437 55.0957 30.2153 174.8820 27 F 4.8172 7.8700 114.2952 55.8339 41.3512 171.5187 28 P 5.2474 0.0000 0.0000 62.1656 32.0923 175.9858 29 H 4.3460 9.0888 125.2778 55.3439 30.2852 174.2747 30 P 4.4789 0.0000 0.0000 64.5593 31.1262 176.3717 31 L 4.5004 7.8536 116.8864 54.9964 44.4465 175.8419 32 Y 4.8416 7.9090 112.8099 56.9383 39.6603 176.0392 33 G 4.2780 8.2429 116.4724 46.8010 0.0000 174.0306 34 K 4.0774 7.5684 120.7066 54.2325 33.5726 176.2097 35 V 4.3732 8.0541 127.1070 61.0830 29.2641 175.3360 36 I 3.8563 7.2718 116.8389 61.4335 39.1963 176.6438 37 K 5.1251 8.2762 120.9955 54.9224 35.8060 175.6678 38 R 4.9957 8.8635 121.3749 54.8181 35.2260 173.7132 39 S 5.6064 8.3800 113.5695 56.6679 66.7820 172.8232 40 K 4.5146 8.3754 118.9016 55.2700 35.4848 173.9713 41 K 4.9850 8.3773 125.1771 55.1167 33.6589 175.2574 42 Y 4.6424 9.1047 123.0025 56.0828 40.7604 174.9277 43 L 4.8417 8.5550 122.6166 53.8795 43.2607 175.2977 44 A 4.9758 9.4929 127.9179 50.6516 21.5246 175.5224 45 H 4.5620 9.1228 122.6010 55.9394 30.9947 173.7301 46 D 5.1557 8.5108 127.7596 51.7698 41.0449 174.8557 47 P 4.2811 0.0000 0.0000 64.7289 31.7604 177.6591 48 E 4.2871 8.2929 116.3508 55.6310 30.3927 175.3498 49 E 3.9636 7.6369 117.5535 57.1707 27.4297 175.7014 50 K 3.9580 8.2829 117.9453 58.4927 33.2916 176.2402 51 Y 4.5646 8.9380 118.6549 55.8195 37.7787 175.4642 52 K 4.3910 8.3997 124.9975 54.6577 35.1629 175.8010 53 L 3.9796 8.1680 120.0245 56.6241 42.2590 177.9580 54 G 4.1011 8.5245 111.2122 45.9156 0.0000 174.1803 55 D 4.6734 7.7889 120.5672 54.7615 41.8653 176.1633 56 V 4.2910 8.6837 124.0245 62.6544 33.2228 175.1757 57 V 5.1329 8.4434 118.7964 60.1474 36.5283 173.6859 58 E 5.3128 8.9492 123.1639 55.5869 31.3425 175.6403 59 I 5.0670 8.0380 115.0675 59.3858 41.5575 173.4578 60 I 4.7289 8.6636 125.2402 58.7659 40.6300 174.2534 61 E 2.7298 7.9954 129.3763 56.7615 29.8692 176.0465 62 S 4.5086 7.6365 121.0689 56.9295 67.7870 174.0347 63 R 3.8402 8.5365 121.0297 56.0767 30.1123 174.3888 64 P 4.4391 0.0000 0.0000 63.3070 31.9338 175.9603 65 I 4.2023 8.8336 124.2640 62.7333 38.3238 175.3988 66 S 4.5460 7.4418 110.8375 57.0975 65.3451 172.7842 67 K 4.0310 8.8983 120.2612 59.4508 31.7901 178.0646 68 R 4.4395 7.8085 114.1135 56.0302 32.0967 176.1753 69 K 4.6558 7.9011 117.5738 55.4174 31.0252 176.8176 70 R 5.0525 8.4623 125.9528 55.2838 32.1662 174.9230 71 F 4.8710 8.3647 115.9819 56.3340 43.6971 174.1028 72 R 4.9541 8.6107 121.6296 54.4348 33.0629 175.4917 73 V 3.8599 7.7685 120.5491 63.0221 31.6151 175.4491 74 L 4.4309 9.1356 131.8931 56.4636 42.6172 176.4124 75 R 4.7177 7.1366 112.0205 55.8042 31.9889 173.3343 76 L 4.5116 8.8709 122.1966 55.5392 42.5411 176.3746 77 V 4.4520 8.2262 120.6455 63.7687 34.4036 175.2393 78 E 4.4253 7.7326 114.8743 56.5955 31.4280 175.5573 79 S 4.7618 8.5861 113.9540 58.9081 63.2957 173.9228 80 G 3.7299 7.8306 115.2280 46.6491 0.0000 174.3625 81 R 4.8603 7.9706 127.4347 54.0525 31.6138 177.5240 82 M 4.1255 8.3631 120.3408 58.2981 31.9882 177.4014 83 D 4.3988 8.2608 119.0089 56.8587 39.1212 179.2078 84 L 4.0106 7.6693 119.0494 57.6162 41.8543 179.2951 85 V 3.6827 7.9165 117.6205 66.1863 31.1326 177.7221 86 E 3.9194 9.0299 118.4647 59.8171 29.3546 178.9500 87 K 3.9616 7.7507 117.6469 60.4561 32.0479 178.2827 88 Y 4.0282 8.2593 118.8827 60.7135 38.7698 178.4543 89 L 3.8393 7.9078 119.9143 57.3591 41.7944 179.3353 90 I 3.6476 8.4820 120.6499 63.9473 36.7529 178.0803 91 R 3.5816 7.6337 118.9635 59.6757 29.9571 178.4281 92 R 3.4737 7.0913 117.5042 59.4900 29.9208 178.2366 93 Q 3.8730 7.7565 117.3444 59.4479 28.5885 178.6037 94 N 4.5035 8.4174 119.0642 55.3264 38.4089 177.0194 95 Y 4.4529 7.4967 118.6423 60.9253 37.6619 177.7268 96 Q 4.0896 8.3679 121.0545 59.1392 29.2876 177.8269 97 S 4.6812 7.6369 113.2907 57.7116 62.8824 174.7505 98 L 4.4246 7.6289 118.9330 57.1204 45.7724 177.7077 99 S 4.3822 7.2653 111.8717 58.2668 63.4572 174.3417 100 K 4.1403 8.1281 118.3979 57.2393 32.3420 175.9697 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 2 P 0.00 4.37 0.00 2.18 2.14 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 3 K 8.51 4.05 0.00 1.88 1.90 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.45 7.81 4 K 7.05 4.36 0.00 1.75 1.72 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.50 7.81 5 V 8.18 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 0.90 0.00 0.00 0.93 0.00 0.00 6 L 8.24 5.08 0.00 1.38 1.40 0.16 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.17 4.99 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 1.18 0.00 0.00 8 G 8.88 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 0.00 0.00 0.00 0.00 9 V 8.02 4.74 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 0.88 0.00 0.00 0.90 0.00 0.00 10 V 8.63 4.14 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 1.02 0.00 0.00 1.08 0.00 0.00 11 V 8.59 4.28 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 0.19 0.00 0.00 0.53 0.00 0.00 12 S 7.75 4.75 0.00 3.88 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 13 D 8.58 5.05 0.00 2.78 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 14 K 7.54 4.42 0.00 1.74 1.88 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.47 7.81 15 M 7.50 4.86 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.57 0.00 16 Q 8.65 4.04 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.28 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 17 K 9.05 4.47 0.00 1.92 1.79 0.00 1.91 0.00 0.00 1.79 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.40 7.81 18 T 7.44 5.23 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 19 V 8.77 4.71 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 0.88 0.00 0.00 0.97 0.00 0.00 20 T 8.75 4.97 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 1.13 0.00 0.00 21 V 9.23 4.65 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 0.85 0.00 0.00 0.86 0.00 0.00 22 L 8.42 5.11 0.00 1.63 1.33 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.72 4.56 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 0.68 0.00 0.00 1.06 0.00 0.00 24 E 8.83 5.16 0.00 1.87 1.91 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 2.28 2.31 0.00 25 R 9.04 4.66 0.00 1.89 2.06 0.00 2.83 0.00 0.00 3.26 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.83 0.00 26 Q 8.84 4.96 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.04 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 27 F 7.87 4.82 0.00 3.20 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 28 P 0.00 5.25 0.00 2.06 2.15 0.00 3.95 0.00 0.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 29 H 9.09 4.35 0.00 3.15 3.29 0.00 5.59 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.48 0.00 2.12 2.12 0.00 3.56 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 1.60 1.90 0.00 31 L 7.85 4.50 0.00 1.28 1.08 0.75 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.91 4.84 0.00 2.86 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 33 G 8.24 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 0.00 0.00 0.00 0.00 34 K 7.57 4.08 0.00 1.86 1.71 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.48 1.48 7.81 35 V 8.05 4.37 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 0.84 0.00 0.00 0.92 0.00 0.00 36 I 7.27 3.86 1.71 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 -0.11 0.82 0.00 0.00 37 K 8.28 5.13 0.00 1.59 1.70 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.29 1.38 7.81 38 R 8.86 5.00 0.00 1.98 1.87 0.00 3.18 0.00 0.00 3.37 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 39 S 8.38 5.61 0.00 3.90 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 40 K 8.38 4.51 0.00 1.72 1.59 0.00 1.47 0.00 0.00 1.29 0.00 0.00 2.13 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.37 1.07 7.81 41 K 8.38 4.98 0.00 1.59 1.65 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.25 1.43 7.81 42 Y 9.10 4.64 0.00 2.64 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 43 L 8.56 4.84 0.00 1.70 1.66 0.93 0.86 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 44 A 9.49 4.98 1.19 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 45 H 9.12 4.56 0.00 3.33 3.26 0.00 5.75 0.00 0.00 0.00 0.00 6.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.51 5.16 0.00 2.90 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 47 P 0.00 4.28 0.00 2.26 2.29 0.00 3.91 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.08 0.00 48 E 8.29 4.29 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 49 E 7.64 3.96 0.00 2.05 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 0.00 2.26 2.23 0.00 50 K 8.28 3.96 0.00 1.55 1.75 0.00 1.49 0.00 0.00 1.38 0.00 0.00 2.20 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.25 0.23 7.81 51 Y 8.94 4.56 0.00 3.19 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 52 K 8.40 4.39 0.00 1.87 1.85 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.37 7.81 53 L 8.17 3.98 0.00 1.76 1.61 1.04 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.52 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 D 7.79 4.67 0.00 2.93 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 56 V 8.68 4.29 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 0.92 0.00 0.00 0.93 0.00 0.00 57 V 8.44 5.13 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.86 0.00 0.00 58 E 8.95 5.31 0.00 1.89 1.82 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 2.36 2.12 0.00 59 I 8.04 5.07 1.95 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.41 0.84 0.00 0.00 60 I 8.66 4.73 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.47 0.86 0.00 0.00 61 E 8.00 2.73 0.00 1.90 1.68 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 2.05 1.91 0.00 62 S 7.64 4.51 0.00 3.56 3.61 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 63 R 8.54 3.84 0.00 1.72 1.80 0.00 3.21 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 64 P 0.00 4.44 0.00 2.07 1.99 0.00 3.68 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 2.01 2.10 0.00 65 I 8.83 4.20 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.81 0.91 0.00 0.00 66 S 7.44 4.55 0.00 3.94 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 67 K 8.90 4.03 0.00 1.75 1.91 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.78 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.49 7.81 68 R 7.81 4.44 0.00 1.84 1.96 0.00 3.26 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 69 K 7.90 4.66 0.00 1.99 1.86 0.00 1.67 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.42 7.81 70 R 8.46 5.05 0.00 1.91 1.83 0.00 3.24 0.00 0.00 3.40 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 71 F 8.36 4.87 0.00 2.91 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 8.61 4.95 0.00 1.79 1.85 0.00 3.12 0.00 0.00 3.05 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 73 V 7.77 3.86 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.92 0.00 0.00 74 L 9.14 4.43 0.00 1.68 1.63 0.93 -0.08 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 75 R 7.14 4.72 0.00 1.93 2.00 0.00 3.20 0.00 0.00 3.24 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.37 0.00 76 L 8.87 4.51 0.00 1.86 1.70 1.08 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.23 4.45 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 0.86 0.00 0.00 0.93 0.00 0.00 78 E 7.73 4.43 0.00 2.03 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 2.13 2.16 0.00 79 S 8.59 4.76 0.00 3.86 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 80 G 7.83 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 81 R 7.97 4.86 0.00 2.09 1.87 0.00 3.83 0.00 0.00 3.30 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.55 0.00 82 M 8.36 4.13 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.26 4.40 0.00 2.87 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 84 L 7.67 4.01 0.00 1.75 1.75 0.92 0.77 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 85 V 7.92 3.68 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 1.12 0.00 0.00 0.94 0.00 0.00 86 E 9.03 3.92 0.00 2.16 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 2.51 2.50 0.00 87 K 7.75 3.96 0.00 1.97 1.88 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.63 1.66 7.81 88 Y 8.26 4.03 0.00 3.08 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 89 L 7.91 3.84 0.00 2.01 1.66 0.98 0.87 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 90 I 8.48 3.65 1.79 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 1.64 0.90 0.85 0.00 0.00 91 R 7.63 3.58 0.00 1.71 1.77 0.00 3.24 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.44 0.00 92 R 7.09 3.47 0.00 1.70 1.79 0.00 3.14 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.36 0.00 93 Q 7.76 3.87 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.51 0.00 94 N 8.42 4.50 0.00 2.63 2.87 0.00 0.00 6.71 7.09 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 95 Y 7.50 4.45 0.00 3.12 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 96 Q 8.37 4.09 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.54 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 97 S 7.64 4.68 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.63 4.42 0.00 1.72 1.66 1.06 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.27 4.38 0.00 4.11 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 0.00 100 K 8.13 4.14 0.00 1.81 1.74 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.36 7.81