NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *1 A 4.4350 8.1233 123.5442 51.9451 21.1916 177.8871 2 R 3.9082 5.8400 116.6725 53.6732 29.3640 174.8255 3 V 4.5340 7.6426 120.2668 60.6529 32.3601 172.3903 4 T 4.9792 8.3184 115.9202 62.6002 70.0271 173.3640 5 V 4.1754 8.1522 126.2610 61.0641 33.6812 174.2307 6 K 4.0772 9.5752 124.6042 55.9937 30.4378 178.5975 7 Y 3.9419 8.8182 117.0777 57.0718 38.2503 170.8262 8 D 5.1273 8.5905 126.8665 54.4938 40.7193 175.0629 9 R 4.2906 8.2705 118.5229 55.0154 31.5949 171.9279 10 R 3.5578 8.9058 121.0980 56.6515 31.3583 176.2426 11 E 3.7550 8.3737 119.0855 57.2850 26.9171 176.4022 12 L 4.3647 7.3844 118.7154 57.1974 42.2407 179.0170 13 Q 4.0174 8.0535 116.8131 58.4222 28.7527 178.2026 14 R 4.0785 7.5980 119.0362 58.7200 30.6771 178.6989 15 R 3.5799 8.4238 117.8849 58.7331 30.0820 179.0704 16 L 4.0055 9.4302 119.2079 57.3112 41.4044 178.4337 17 D 4.3912 8.6384 118.1483 55.6910 40.9149 177.3258 18 V 2.0000 6.8248 116.9426 61.9552 31.6112 175.9248 19 E 4.8566 7.7495 118.2050 56.0780 31.2982 177.2804 20 K 4.2007 8.0118 119.2033 58.4181 32.5320 178.1992 21 W 4.3697 8.2819 117.2756 59.3643 27.5473 178.0146 22 I 3.8080 7.5929 112.5649 63.2578 37.7817 177.1070 23 D 4.3055 7.8483 120.5101 56.7961 40.4682 178.8898 24 G 3.6377 8.0001 105.2394 47.5693 0.0000 175.9371 25 R 3.9840 7.6735 121.3177 58.8777 30.2332 179.0175 26 L 4.1708 8.9118 119.6393 57.9712 41.5056 179.1904 27 E 3.9119 7.6616 118.8187 58.8091 29.5217 178.1286 28 E 4.4366 7.8681 116.8070 57.2316 31.7865 177.3342 29 L 4.0076 8.8592 118.1513 58.3717 40.2206 178.1437 30 Y 4.8966 8.3087 114.9397 59.3534 40.4241 176.3568 31 R 3.6427 6.8096 116.7146 60.9914 30.7864 177.2337 32 G 3.8272 8.0295 105.5648 46.3942 0.0000 173.5369 33 R 4.5508 9.0967 118.2530 55.3433 30.9530 177.0760 34 E 3.7256 7.8675 121.1483 58.7550 29.4550 177.6721 35 A 4.5054 7.7759 118.0686 51.9597 19.5446 176.3745 36 D 4.5517 9.1336 115.6366 54.5943 41.5452 176.3103 37 M 4.3484 7.0408 118.6728 52.7961 34.9891 172.5360 38 P 4.6862 0.0000 0.0000 61.4544 34.1620 174.7899 39 D 4.6476 7.9371 116.4835 52.0357 39.4702 177.1140 40 E 5.1082 7.4941 115.0852 56.7935 31.3771 174.0515 41 V 4.7456 7.2100 113.5101 59.7543 35.6640 176.5028 42 N 4.4674 8.9698 116.0871 56.9401 38.9964 177.7631 43 I 3.7119 7.8595 119.1953 64.5410 37.8602 177.2031 44 D 4.3098 8.3205 119.6622 57.4121 41.0389 178.1962 45 E 3.9737 8.1093 118.3698 59.6328 29.7533 179.0346 46 L 3.5988 8.4662 119.2562 58.0137 41.3991 179.5256 47 L 4.0827 7.6364 119.0064 57.5839 42.0178 177.5170 48 E 4.4214 8.5805 118.1366 55.3302 29.8684 175.9569 49 L 4.3553 7.1046 117.2602 54.1857 42.4712 176.7306 50 E 4.2756 8.5578 120.8585 57.1351 30.5076 178.6971 51 S 4.5410 7.6843 112.9418 58.6686 63.7463 172.4463 52 E 4.4530 8.6005 116.0179 57.7066 31.7342 177.0175 53 E 4.6426 7.9014 115.3742 54.9793 31.6077 176.5848 54 E 4.2092 8.2461 118.7007 59.5777 29.4039 178.5672 55 R 3.9500 7.9381 116.1321 59.3831 29.5819 178.5222 56 S 4.2557 7.9516 112.9485 60.0798 62.3600 175.8410 57 R 3.8283 8.4084 122.3051 59.3984 29.9713 178.3363 58 K 3.9982 7.9411 118.9564 59.5030 32.3946 178.9440 59 I 3.8386 7.6693 119.9481 63.9180 37.0276 178.2685 60 Q 4.6099 8.1642 123.0349 58.6095 28.7656 178.0615 61 G 3.7890 7.6984 104.2226 46.3246 0.0000 175.4597 62 L 4.1440 7.5213 121.0645 57.3035 41.8894 178.5302 63 L 4.4599 7.3004 115.6255 56.3668 41.7846 177.6294 64 K 3.8938 7.3789 120.8077 57.1078 32.5280 176.3486 65 S 3.9494 8.1472 111.1591 62.1643 63.0229 176.2637 66 C 3.6304 7.8644 116.3872 62.5711 28.2646 175.1555 67 T 4.5013 12.0000 113.5655 63.4140 67.6599 174.2576 68 N 3.8337 7.4333 115.8335 52.8054 39.4578 171.0755 69 P 4.3068 0.0000 0.0000 63.9059 31.5217 176.7102 70 T 4.6053 8.1560 112.9877 58.8552 69.1332 172.5643 71 E 4.4978 8.4443 129.7792 58.3764 31.2968 176.1725 72 N 4.5436 8.1387 116.2593 55.9027 39.2934 176.6334 73 F 4.5772 8.3956 122.3649 61.2551 39.4598 177.4863 74 V 4.0986 8.1988 117.5571 64.8277 31.6355 177.6388 75 Q 4.0977 8.0765 119.9157 58.9467 28.8879 178.0402 76 E 3.4634 7.9723 119.2239 59.2805 29.1508 178.8675 77 L 3.6268 7.2555 119.7057 58.2789 41.6073 178.5901 78 L 3.8671 7.6144 119.7757 58.3649 41.8799 179.0461 79 V 3.6068 7.4207 115.8086 64.3479 31.0645 176.5605 80 K 4.0553 7.1065 118.0055 57.7863 33.2389 177.4141 81 L 4.2453 9.0320 118.6794 58.4881 40.1753 178.3185 82 R 4.1015 7.7378 117.9025 57.7168 31.1242 177.3412 83 G 3.6098 9.0481 104.7951 48.0061 0.0000 173.4388 84 L 4.6848 8.1081 117.2009 53.6508 44.8658 176.8068 85 H 4.9667 8.7590 113.6254 55.9207 25.8740 174.8824 86 K 4.8821 7.4669 120.9611 58.0820 32.9790 174.1751 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 8.12 4.44 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 2 R 5.84 3.91 0.00 1.46 1.27 0.00 3.33 0.00 0.00 3.37 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.98 0.00 3 V 7.64 4.53 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 0.81 0.00 0.00 1.03 0.00 0.00 4 T 8.32 4.98 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 1.34 0.00 0.00 5 V 8.15 4.18 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 0.70 0.00 0.00 0.94 0.00 0.00 6 K 9.58 4.08 0.00 1.98 2.03 0.00 1.90 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.39 7.81 7 Y 8.82 3.94 0.00 3.32 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 8 D 8.59 5.13 0.00 2.91 2.26 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 9 R 8.27 4.29 0.00 1.80 1.69 0.00 3.48 0.00 0.00 3.16 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 10 R 8.91 3.56 0.00 1.94 1.83 0.00 3.43 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 11 E 8.37 3.76 0.00 2.12 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 2.27 2.32 0.00 12 L 7.38 4.36 0.00 1.63 1.69 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.05 4.02 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 14 R 7.60 4.08 0.00 1.87 1.94 0.00 3.07 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 15 R 8.42 3.58 0.00 1.87 1.93 0.00 3.08 0.00 0.00 3.14 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.42 0.00 16 L 9.43 4.01 0.00 1.75 1.68 1.04 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.64 4.39 0.00 2.69 2.37 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 18 V 6.82 2.00 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 0.55 0.00 0.00 0.02 0.00 0.00 19 E 7.75 4.86 0.00 2.23 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 2.42 0.00 20 K 8.01 4.20 0.00 2.12 1.84 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.49 7.81 21 W 8.28 4.37 0.00 3.37 3.41 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 22 I 7.59 3.81 1.69 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 1.95 0.94 -0.91 0.00 0.00 23 D 7.85 4.31 0.00 3.08 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 24 G 8.00 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 0.00 0.00 0.00 25 R 7.67 3.98 0.00 2.01 2.02 0.00 3.35 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.00 0.00 26 L 8.91 4.17 0.00 1.74 1.78 1.16 0.85 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 27 E 7.66 3.91 0.00 2.14 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 2.27 2.64 0.00 28 E 7.87 4.44 0.00 2.00 1.83 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 2.16 2.19 0.00 29 L 8.86 4.01 0.00 1.57 1.81 0.29 0.72 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 Y 8.31 4.90 0.00 2.99 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 31 R 6.81 3.64 0.00 2.00 1.81 0.00 3.14 0.00 0.00 3.28 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 32 G 8.03 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 33 R 9.10 4.55 0.00 1.98 1.98 0.00 3.64 0.00 0.00 3.43 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 34 E 7.87 3.73 0.00 2.07 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 2.32 2.30 0.00 35 A 7.78 4.51 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 36 D 9.13 4.55 0.00 2.52 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 0.00 0.00 0.00 0.00 37 M 7.04 4.35 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.22 0.00 38 P 0.00 4.69 0.00 2.18 2.08 0.00 3.61 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.86 0.00 39 D 7.94 4.65 0.00 1.76 1.71 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 40 E 7.49 5.11 0.00 1.92 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 2.29 2.31 0.00 41 V 7.21 4.75 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 0.97 0.00 0.00 0.98 0.00 0.00 42 N 8.97 4.47 0.00 2.87 2.91 0.00 0.00 6.88 7.35 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 43 I 7.86 3.71 2.16 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 1.47 1.35 1.20 0.00 0.00 44 D 8.32 4.31 0.00 2.78 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 45 E 8.11 3.97 0.00 2.11 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 2.45 2.47 0.00 46 L 8.47 3.60 0.00 1.78 1.80 1.05 0.57 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 47 L 7.64 4.08 0.00 1.92 1.72 0.98 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.58 4.42 0.00 2.15 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 0.00 2.30 2.36 0.00 49 L 7.10 4.36 0.00 1.90 1.60 1.01 0.65 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 50 E 8.56 4.28 0.00 1.93 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 2.30 0.00 51 S 7.68 4.54 0.00 4.03 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 52 E 8.60 4.45 0.00 1.94 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 0.00 2.22 2.22 0.00 53 E 7.90 4.64 0.00 2.00 1.85 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 2.27 2.27 0.00 54 E 8.25 4.21 0.00 2.08 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 2.39 2.38 0.00 55 R 7.94 3.95 0.00 2.12 2.23 0.00 3.07 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 56 S 7.95 4.26 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 57 R 8.41 3.83 0.00 1.94 2.05 0.00 3.15 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 58 K 7.94 4.00 0.00 1.94 1.80 0.00 1.58 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.53 7.81 59 I 7.67 3.84 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.95 0.94 0.00 0.00 60 Q 8.16 4.61 0.00 2.14 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.19 0.00 61 G 7.70 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 L 7.52 4.14 0.00 1.82 1.74 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.30 4.46 0.00 2.07 1.82 0.72 0.70 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 64 K 7.38 3.89 0.00 1.99 1.84 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.27 1.37 7.81 65 S 8.15 3.95 0.00 3.83 3.78 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 66 C 7.86 3.63 0.00 2.66 1.76 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 67 T 12.00 4.50 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 68 N 7.43 3.83 0.00 2.90 3.09 0.00 0.00 7.13 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 69 P 0.00 4.31 0.00 2.20 2.11 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 70 T 8.16 4.61 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 1.07 0.00 0.00 71 E 8.44 4.50 0.00 2.08 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 2.32 2.37 0.00 72 N 8.14 4.54 0.00 2.97 2.92 0.00 0.00 6.93 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 73 F 8.40 4.58 0.00 3.30 3.10 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 74 V 8.20 4.10 2.28 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 1.00 0.00 0.00 1.04 0.00 0.00 75 Q 8.08 4.10 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.84 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 76 E 7.97 3.46 0.00 1.77 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 1.96 1.84 0.00 77 L 7.26 3.63 0.00 2.05 1.87 1.04 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.61 3.87 0.00 1.77 1.59 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.42 3.61 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 0.77 0.00 0.00 0.80 0.00 0.00 80 K 7.11 4.06 0.00 1.30 1.32 0.00 1.15 0.00 0.00 1.00 0.00 0.00 2.40 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.30 0.39 7.81 81 L 9.03 4.25 0.00 1.81 1.92 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 82 R 7.74 4.10 0.00 1.72 1.91 0.00 3.21 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 83 G 9.05 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 0.00 0.00 0.00 84 L 8.11 4.68 0.00 1.88 1.62 1.06 1.05 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 H 8.76 4.97 0.00 3.31 3.52 0.00 6.02 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.47 4.88 0.00 2.20 1.85 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.49 7.81 * Residues marked with a * may have inaccurate shift predictions.