NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3574 0.0000 0.0000 62.8695 33.6266 174.3073 3 R 4.7252 7.8760 117.0925 54.8705 32.5435 174.0042 4 Y 5.0124 8.6604 118.9442 56.3481 43.6928 173.5722 5 Q 4.9882 9.3082 122.0402 54.4699 32.2483 173.7148 6 A 5.3052 9.6034 128.6489 50.6443 22.1080 175.4901 7 T 4.9499 8.9496 119.4462 62.2318 70.0854 173.2660 8 L 5.0860 8.8858 127.7691 52.9599 44.1407 175.7163 9 L 5.0576 8.8953 124.3235 53.2560 44.2057 175.6681 10 I 4.9789 8.7838 123.9961 59.8251 40.0187 174.3965 11 E 5.0484 8.9319 125.9794 53.8999 33.7960 175.8755 12 L 4.4148 8.3778 120.9087 54.3506 42.6799 177.7570 13 K 4.2132 8.3865 121.6807 55.7160 32.8017 176.8389 14 K 4.2187 8.2643 121.0505 58.3381 33.1091 176.2328 15 G 4.1108 8.9230 109.1450 45.9430 0.0000 174.2736 16 I 3.9385 7.2344 120.3574 60.3386 37.6995 175.6010 17 L 4.0578 8.4665 127.3388 55.1995 42.6696 176.4524 18 D 4.8558 8.3269 125.9619 50.9584 41.1095 173.8628 19 P 4.2590 0.0000 0.0000 65.4977 31.3872 178.1575 20 Q 4.0198 8.1223 118.9582 58.8576 29.0725 178.2922 21 G 3.7596 8.7203 108.4510 47.3694 0.0000 175.8777 22 R 4.2387 8.3322 121.4705 58.4342 30.0564 178.9882 23 A 4.0136 8.2564 120.9986 55.0947 18.3478 179.9025 24 V 3.5423 8.0081 116.8520 66.0266 31.0685 177.9829 25 E 4.0543 8.2999 118.5549 59.4001 29.2555 179.5410 26 G 3.6697 7.9180 105.1737 47.9999 0.0000 175.9019 27 V 3.6117 7.8066 121.2143 65.4532 31.5391 178.0171 28 L 3.9700 8.4141 119.2813 57.5383 41.4606 179.3694 29 K 3.8947 8.2424 119.5741 59.8194 31.9898 178.5939 30 D 4.4448 8.1281 117.8744 56.9849 40.7785 177.8830 31 L 4.4751 7.9407 117.1344 54.5492 41.9224 177.5185 32 G 3.9355 8.2128 107.6644 45.6711 0.0000 174.1572 33 H 4.8695 8.2595 115.6743 53.1589 28.4451 172.4585 34 P 4.2838 0.0000 0.0000 63.0236 32.1057 176.7728 35 V 4.5632 8.0182 114.9275 59.3023 35.3835 175.2406 36 E 4.1399 8.6735 121.4371 58.7812 29.8761 176.2678 37 E 4.9315 7.3457 114.3624 55.3748 32.2640 174.4997 38 V 4.3874 8.7755 124.0785 60.9957 34.1208 174.4853 39 R 4.7418 8.6358 125.6120 54.3236 32.3764 174.9540 40 V 4.2536 9.2904 123.7524 61.1459 32.8234 174.9787 41 G 4.3161 8.3777 116.2607 43.7224 0.0000 170.8798 42 K 4.8570 8.3922 117.4640 54.8668 35.7701 175.5278 43 V 4.8590 8.4036 121.2058 59.9351 33.9631 174.6281 44 L 4.6809 9.0383 124.2762 53.0414 44.4922 175.3661 45 E 4.8695 8.9255 124.4755 55.2679 30.5832 175.6256 46 I 4.4853 8.9416 127.1968 59.4631 39.6829 175.0371 47 V 4.9802 8.5256 127.8611 61.5293 32.5704 174.7431 48 F 5.1405 8.9941 122.2194 55.2833 41.6042 171.4869 49 P 5.2692 0.0000 0.0000 62.4233 32.8524 174.6986 50 A 4.6669 8.4402 120.4065 51.3969 21.9552 176.6962 51 E 4.0762 9.7328 121.0934 59.3343 29.8219 177.3576 52 N 5.1190 7.5136 115.6279 51.4194 41.1701 174.7407 53 L 3.6243 8.4857 120.9022 58.1442 42.0371 178.6758 54 L 3.9254 7.8539 118.3783 57.9270 41.6314 179.0507 55 E 3.9534 9.2644 119.2404 58.9548 29.4235 178.7025 56 A 3.9831 7.8944 121.4751 54.8517 18.2736 179.1783 57 E 3.8830 8.4031 118.3101 59.3499 29.7599 178.6812 58 E 3.9318 8.2503 119.3349 59.2859 29.4984 178.9923 59 K 3.8950 8.1886 117.4977 59.1421 32.1474 178.8680 60 A 3.8076 8.0496 120.5424 55.2285 18.7040 179.7402 61 K 4.0947 8.1264 116.4703 58.9720 31.9950 179.1246 62 A 4.1353 7.5928 120.0012 52.4106 18.2861 179.4500 *64 G 3.1165 8.0934 111.1832 46.8223 0.0000 176.0886 65 A 3.8752 6.8164 121.9557 54.6312 18.5460 178.8775 66 L 4.1056 7.7072 115.2712 57.3571 41.8422 178.3503 67 L 4.1805 7.6294 116.6518 55.9664 42.3300 176.9013 68 A 4.4588 7.7044 121.0706 50.9287 19.3953 176.5127 69 N 4.4818 9.5015 121.2306 52.5569 39.1086 173.1596 70 P 4.3520 0.0000 0.0000 65.9515 31.2131 177.1176 71 V 3.8873 7.8048 116.0080 62.9267 31.1818 174.8406 *73 E 4.3613 7.7697 116.9131 56.4397 30.6962 175.0215 74 V 4.7143 8.5910 112.4610 59.9095 36.0111 174.5574 75 Y 5.4464 8.1933 120.6321 55.4632 41.1515 174.7909 76 A 4.5221 8.8536 121.4518 50.5895 22.9927 175.4365 77 L 4.4349 8.7559 125.5456 54.2912 41.1599 175.7857 78 E 4.2487 9.2193 128.4938 58.9987 30.3445 176.1895 79 A 4.6768 7.8358 118.3532 51.3137 22.9540 175.2118 80 L 5.0164 8.2044 120.4778 54.1364 45.0376 174.5712 81 K 4.8205 9.0764 125.0113 55.0724 36.3942 175.1724 82 E 4.3391 8.8648 122.8192 56.0114 30.4751 175.4541 83 L 4.7300 8.1141 125.3348 51.7215 45.0279 175.0002 84 P 4.3142 0.0000 0.0000 63.2495 31.2752 176.5833 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 4.36 0.00 1.72 2.16 0.00 3.99 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.99 0.00 3 R 7.88 4.73 0.00 1.64 1.68 0.00 3.02 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 4 Y 8.66 5.01 0.00 1.88 2.54 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 0.00 0.00 0.00 0.00 5 Q 9.31 4.99 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 6 A 9.60 5.31 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 7 T 8.95 4.95 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 1.24 0.00 0.00 8 L 8.89 5.09 0.00 1.57 1.59 0.86 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 9 L 8.90 5.06 0.00 1.61 1.59 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.78 4.98 1.89 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 1.30 0.72 0.99 0.00 0.00 11 E 8.93 5.05 0.00 1.89 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 0.00 2.22 2.26 0.00 12 L 8.38 4.41 0.00 1.64 1.60 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.39 4.21 0.00 1.81 1.72 0.00 1.83 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.50 7.81 14 K 8.26 4.22 0.00 1.85 1.81 0.00 1.53 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.43 7.81 15 G 8.92 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.23 3.94 1.97 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 1.31 0.85 0.91 0.00 0.00 17 L 8.47 4.06 0.00 1.58 1.58 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.33 4.86 0.00 2.67 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.26 0.00 2.30 2.30 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.03 0.00 20 Q 8.12 4.02 0.00 2.18 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 21 G 8.72 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 22 R 8.33 4.24 0.00 2.05 1.99 0.00 3.24 0.00 0.00 3.27 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 23 A 8.26 4.01 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 24 V 8.01 3.54 2.22 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 1.00 0.00 0.00 0.95 0.00 0.00 25 E 8.30 4.05 0.00 2.19 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 2.34 2.67 0.00 26 G 7.92 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 27 V 7.81 3.61 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 1.11 0.00 0.00 0.97 0.00 0.00 28 L 8.41 3.97 0.00 1.86 1.97 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.24 3.89 0.00 1.90 2.06 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.49 7.81 30 D 8.13 4.44 0.00 2.84 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 31 L 7.94 4.48 0.00 1.81 1.75 0.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.21 3.94 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 0.00 0.00 0.00 33 H 8.26 4.87 0.00 3.02 3.26 0.00 5.87 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.28 0.00 2.04 2.01 0.00 3.61 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 2.02 2.12 0.00 35 V 8.02 4.56 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 0.81 0.00 0.00 0.94 0.00 0.00 36 E 8.67 4.14 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 37 E 7.35 4.93 0.00 1.90 1.74 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 2.12 2.21 0.00 38 V 8.78 4.39 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 0.95 0.00 0.00 0.93 0.00 0.00 39 R 8.64 4.74 0.00 1.79 1.80 0.00 3.40 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 40 V 9.29 4.25 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 0.76 0.00 0.00 0.93 0.00 0.00 41 G 8.38 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 0.00 0.00 0.00 0.00 42 K 8.39 4.86 0.00 1.82 1.89 0.00 1.26 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.35 7.81 43 V 8.40 4.86 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 0.78 0.00 0.00 0.95 0.00 0.00 44 L 9.04 4.68 0.00 1.59 1.59 0.92 0.64 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 45 E 8.93 4.87 0.00 1.87 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 46 I 8.94 4.49 1.92 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.80 0.92 0.00 0.00 47 V 8.53 4.98 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.97 0.00 0.00 48 F 8.99 5.14 0.00 3.22 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 49 P 0.00 5.27 0.00 2.15 2.11 0.00 4.05 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 50 A 8.44 4.67 1.11 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 0.00 0.00 0.00 0.00 0.00 51 E 9.73 4.08 0.00 2.05 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 2.47 2.50 0.00 52 N 7.51 5.12 0.00 2.98 2.94 0.00 0.00 6.37 6.67 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 53 L 8.49 3.62 0.00 1.87 1.72 0.98 0.60 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 54 L 7.85 3.93 0.00 1.93 1.68 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.26 3.95 0.00 1.98 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 2.32 2.33 0.00 56 A 7.89 3.98 0.35 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 57 E 8.40 3.88 0.00 2.05 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 0.00 2.31 2.37 0.00 58 E 8.25 3.93 0.00 2.16 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 2.29 2.34 0.00 59 K 8.19 3.89 0.00 2.01 1.67 0.00 2.01 0.00 0.00 1.89 0.00 0.00 3.08 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.48 1.72 7.81 60 A 8.05 3.81 1.37 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 61 K 8.13 4.09 0.00 1.86 2.03 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.71 7.81 62 A 7.59 4.14 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 *64 G 8.09 3.12 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 0.00 0.00 0.00 65 A 6.82 3.88 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 66 L 7.71 4.11 0.00 1.54 1.66 0.84 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.63 4.18 0.00 1.54 1.67 0.85 0.71 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 68 A 7.70 4.46 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 N 9.50 4.48 0.00 2.65 2.77 0.00 0.00 7.16 7.64 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 70 P 0.00 4.35 0.00 2.23 2.21 0.00 3.82 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 2.00 1.98 0.00 71 V 7.80 3.89 2.18 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 0.79 0.00 0.00 0.93 0.00 0.00 *73 E 7.77 4.36 0.00 2.24 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 2.23 2.36 0.00 74 V 8.59 4.71 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 0.80 0.00 0.00 0.97 0.00 0.00 75 Y 8.19 5.45 0.00 2.90 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 76 A 8.85 4.52 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 77 L 8.76 4.43 0.00 1.75 1.70 1.06 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 78 E 9.22 4.25 0.00 2.02 2.15 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 2.34 2.34 0.00 79 A 7.84 4.68 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 80 L 8.20 5.02 0.00 1.68 1.57 1.10 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 81 K 9.08 4.82 0.00 1.84 1.86 0.00 1.38 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.39 7.81 82 E 8.86 4.34 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.58 0.00 83 L 8.11 4.73 0.00 1.33 1.45 0.87 0.98 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 84 P 0.00 4.31 0.00 1.98 1.94 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 * Residues marked with a * may have inaccurate shift predictions.