NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3626 0.0000 0.0000 62.6136 32.6506 175.0557 2 Q 4.3689 8.4376 120.8287 54.0648 30.4711 173.3682 3 I 4.5170 8.0070 125.2994 59.6288 40.7926 175.2545 4 T 4.4069 8.4769 115.5428 61.2137 70.0246 174.0753 5 L 4.6869 7.7673 118.6827 54.3067 42.1817 178.3422 6 W 4.1376 8.3364 121.8118 58.5530 29.1873 176.1978 7 K 4.7671 7.7051 114.9101 54.0624 35.0671 175.7498 8 R 3.9684 8.4854 118.4544 56.4918 30.6938 176.2534 9 P 4.6649 0.0000 0.0000 61.9896 29.8769 174.3035 10 L 4.9162 7.7418 124.7931 54.9820 43.3365 176.7313 11 V 4.6230 8.9723 115.3167 59.8767 36.6536 174.5604 12 T 4.8846 8.3758 118.8201 62.8940 70.0731 174.0768 13 I 5.0966 9.0952 118.7947 59.0454 41.6550 173.9622 14 K 4.9994 8.9986 124.9003 54.7213 34.9132 174.6978 15 I 4.6422 8.7429 127.3318 59.8942 41.8507 175.0094 16 G 3.9563 9.6823 117.4294 46.7215 0.0000 174.3391 17 G 3.8863 8.3883 104.8844 45.4756 0.0000 174.0591 18 Q 4.6720 7.9171 118.7951 53.8983 31.2049 174.1146 19 L 5.1753 8.2173 119.8387 53.2295 43.8904 175.9320 20 K 4.7328 9.0171 121.6646 55.1490 37.3146 174.7094 21 E 5.1651 8.6474 119.9592 55.1982 31.7949 175.5977 22 A 4.7911 8.8373 123.1332 50.5945 23.5202 174.8639 23 L 4.7274 8.6752 122.8997 54.0579 43.6873 175.8087 24 L 4.4610 8.6914 127.4267 54.6993 42.3869 176.3942 25 D 4.8806 8.9319 125.7396 52.2938 42.3546 176.6423 26 T 3.9801 8.7532 116.7832 63.7089 69.0567 175.4794 27 G 3.8701 8.3705 110.0641 45.2321 0.0000 172.7928 28 A 4.6842 7.6741 122.4102 49.9591 20.9382 177.8194 29 D 4.4595 8.9878 122.8710 56.6614 42.3835 176.0325 30 D 5.4301 8.0495 116.3027 52.6603 45.1706 175.1606 31 T 4.7396 7.9215 117.5026 62.4030 70.5037 174.5666 32 V 4.9399 8.5707 125.5153 59.9336 34.4789 174.6888 33 L 5.0574 9.0249 124.4222 52.4261 45.4376 175.9145 34 E 4.6663 8.5687 120.3471 55.0821 30.6494 176.2589 35 E 3.7546 8.5084 121.0387 57.2209 29.8037 175.8307 36 M 4.1730 7.6750 120.8968 55.1234 33.0505 173.4879 37 N 4.8584 8.5069 116.5967 51.0657 39.5929 173.8488 38 L 4.7204 7.6240 118.7523 52.0868 45.8247 174.2947 39 P 4.4880 0.0000 0.0000 63.5319 32.2830 176.5975 40 G 3.8755 8.7705 106.5328 44.5291 0.0000 172.6595 41 R 4.3531 8.0599 118.5329 55.5500 30.9225 175.3674 42 W 5.3284 7.7779 117.2316 54.4700 31.3514 174.1908 43 K 4.3917 8.5631 120.3562 54.1272 35.0210 173.8064 44 P 5.1122 0.0000 0.0000 63.5905 32.2044 175.3912 45 K 4.6270 9.0172 122.0199 55.6039 36.1137 174.1666 46 I 5.2200 8.4150 125.8547 59.4547 39.6932 174.9065 47 I 4.6038 8.1851 118.9532 59.1823 40.3272 175.2287 48 G 4.1076 8.7727 112.8137 43.4711 0.0000 173.5459 49 G 3.9855 7.6097 104.2175 46.7914 0.0000 172.1883 50 I 4.0755 8.2015 120.0654 63.6332 38.2568 177.4726 51 G 3.4705 7.9481 108.4080 48.4637 0.0000 172.9821 *54 I 4.0276 7.3726 119.4813 59.9059 39.9757 174.2872 55 K 4.5268 8.5002 123.8155 56.4793 32.9551 176.6999 56 V 4.7082 8.6727 118.0840 59.4257 36.2468 174.9904 57 R 4.9511 8.4852 122.1093 55.1237 32.3107 175.0883 58 Q 5.0333 8.9606 124.2509 54.6152 31.5390 173.7532 59 Y 4.9953 9.2133 123.4925 56.3518 41.5009 174.4685 60 D 5.2168 8.7903 121.6019 52.2019 44.4985 174.9985 61 Q 3.3591 8.5041 117.6003 57.1987 27.7177 173.5353 62 I 4.2884 7.8692 117.2333 60.0901 38.9739 175.7841 63 L 4.6537 8.4716 129.3574 54.7912 43.0199 175.6711 64 I 4.7681 8.9900 126.1152 59.3569 41.8355 173.2764 65 E 5.0077 9.2900 129.1081 54.7655 31.8705 174.8381 66 I 4.5625 8.7649 126.2484 59.5615 39.6321 175.7424 67 C 4.2238 9.9701 130.6179 60.3306 30.3434 174.0108 68 G 3.9469 8.4274 105.4673 45.4675 0.0000 172.9904 69 H 4.7650 8.3254 118.3461 53.7534 30.3451 174.0829 70 K 4.8159 8.5147 123.8623 56.3366 32.9929 176.1865 71 A 4.8967 8.9617 123.9886 50.6730 23.2019 175.0438 72 I 4.9427 8.5225 119.9112 59.6380 40.7920 176.0073 73 G 3.9492 8.2905 112.7804 45.9571 0.0000 171.6622 74 T 4.7459 8.5687 116.3106 63.4485 69.3580 174.7791 75 V 4.5123 9.0353 125.4131 61.1175 35.2918 173.8683 76 L 5.1634 8.9757 127.6159 53.1140 44.3298 175.5430 77 V 4.7511 9.0939 123.8516 61.5802 33.7423 174.2348 78 G 4.1953 8.4958 116.1841 44.4527 0.0000 169.5527 79 P 4.7605 0.0000 0.0000 61.8701 30.7091 176.2693 80 T 4.3082 7.3470 112.5988 60.5799 68.6484 172.3382 81 P 4.4904 0.0000 0.0000 63.2969 31.6477 175.6637 82 A 4.4660 7.2775 119.4989 51.3598 22.4749 175.8081 83 N 4.7943 8.5092 118.6566 53.0713 40.2686 174.1703 84 I 4.6975 9.0477 124.5651 59.5265 40.6760 174.5418 85 I 4.2205 8.9340 128.9788 60.0011 38.7157 175.9104 86 G 4.3772 8.3810 115.8606 43.9017 0.0000 173.7957 87 R 4.0611 9.0319 118.6771 59.1282 30.1684 179.1837 88 N 4.3557 7.8817 114.3404 55.2962 37.5280 176.2637 89 L 4.4602 7.7588 117.4514 55.8946 42.7157 178.5325 90 L 4.0139 7.9808 119.5844 58.0170 41.5812 179.6013 91 T 3.9399 8.0702 109.6145 64.8773 68.3734 176.5997 92 Q 4.0379 7.8725 120.1351 58.1328 28.8654 176.8671 93 I 4.1667 7.6824 108.9749 60.2009 37.9362 175.5585 94 G 3.7846 7.7188 108.0890 46.9534 0.0000 173.4874 95 C 4.3680 7.9416 120.0059 58.5453 32.2637 172.7270 96 T 4.7494 8.0880 115.2594 59.8707 71.6545 172.8215 97 L 4.7293 8.2619 121.9088 53.4588 43.4695 176.1201 98 N 5.0057 8.4039 118.6650 51.7558 42.5610 174.5632 99 F 4.4702 8.1150 116.3867 57.4516 37.4483 173.8385 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 P 0.00 4.36 0.00 2.21 2.14 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.97 0.00 2 Q 8.44 4.37 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 3 I 8.01 4.52 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.80 0.93 0.00 0.00 4 T 8.48 4.41 4.46 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 1.35 0.00 0.00 5 L 7.77 4.69 0.00 1.37 1.52 0.84 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 6 W 8.34 4.14 0.00 3.33 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.71 4.77 0.00 1.86 1.84 0.00 1.63 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.45 7.81 8 R 8.49 3.97 0.00 1.83 1.93 0.00 3.20 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 9 P 0.00 4.66 0.00 2.11 2.20 0.00 3.67 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 10 L 7.74 4.92 0.00 1.56 1.63 0.96 0.93 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 11 V 8.97 4.62 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 0.76 0.00 0.00 0.99 0.00 0.00 12 T 8.38 4.88 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 1.21 0.00 0.00 13 I 9.10 5.10 1.93 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 1.29 0.73 0.91 0.00 0.00 14 K 9.00 5.00 0.00 1.77 1.65 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.47 7.81 15 I 8.74 4.64 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.60 0.87 0.00 0.00 16 G 9.68 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 0.00 0.00 0.00 17 G 8.39 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 18 Q 7.92 4.67 0.00 2.20 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 19 L 8.22 5.18 0.00 1.49 1.56 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 20 K 9.02 4.73 0.00 1.63 1.77 0.00 1.60 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.39 7.81 21 E 8.65 5.17 0.00 1.83 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 2.22 2.23 0.00 22 A 8.84 4.79 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 23 L 8.68 4.73 0.00 1.78 1.54 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.69 4.46 0.00 1.56 1.61 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 25 D 8.93 4.88 0.00 2.76 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 26 T 8.75 3.98 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 27 G 8.37 3.87 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 0.00 0.00 0.00 28 A 7.67 4.68 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 29 D 8.99 4.46 0.00 2.62 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 30 D 8.05 5.43 0.00 2.57 2.55 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 31 T 7.92 4.74 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 1.23 0.00 0.00 32 V 8.57 4.94 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 0.83 0.00 0.00 0.99 0.00 0.00 33 L 9.02 5.06 0.00 1.48 1.52 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.57 4.67 0.00 1.82 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 2.50 2.13 0.00 35 E 8.51 3.75 0.00 1.85 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 2.25 2.34 0.00 36 M 7.68 4.17 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.37 0.00 37 N 8.51 4.86 0.00 2.77 2.77 0.00 0.00 5.81 7.79 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 38 L 7.62 4.72 0.00 0.32 1.22 0.44 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.49 0.00 2.22 2.07 0.00 3.68 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 2.01 1.97 0.00 40 G 8.77 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 0.00 0.00 0.00 41 R 8.06 4.35 0.00 1.74 1.81 0.00 2.97 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 42 W 7.78 5.33 0.00 2.79 1.75 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 43 K 8.56 4.39 0.00 1.74 1.76 0.00 1.28 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.29 1.50 7.81 44 P 0.00 5.11 0.00 1.99 2.17 0.00 3.55 0.00 0.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.19 0.00 45 K 9.02 4.63 0.00 1.86 1.65 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.44 7.81 46 I 8.42 5.22 1.89 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 1.42 0.67 0.92 0.00 0.00 47 I 8.19 4.60 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.72 0.93 0.00 0.00 48 G 8.77 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 49 G 7.61 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 50 I 8.20 4.08 1.87 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 1.34 0.62 0.91 0.00 0.00 51 G 7.95 3.47 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 0.00 0.00 0.00 *54 I 7.37 4.03 1.87 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 1.40 1.34 0.92 0.00 0.00 55 K 8.50 4.53 0.00 1.83 1.86 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.47 7.81 56 V 8.67 4.71 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 0.88 0.00 0.00 1.00 0.00 0.00 57 R 8.49 4.95 0.00 1.54 0.94 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.31 0.00 58 Q 8.96 5.03 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 59 Y 9.21 5.00 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 60 D 8.79 5.22 0.00 2.57 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 61 Q 8.50 3.36 0.00 2.14 2.15 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 2.28 2.44 0.00 62 I 7.87 4.29 2.01 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 1.22 0.80 0.88 0.00 0.00 63 L 8.47 4.65 0.00 1.64 1.57 1.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.99 4.77 1.87 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 1.23 1.30 0.98 0.00 0.00 65 E 9.29 5.01 0.00 1.92 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 2.26 0.00 66 I 8.76 4.56 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.80 0.91 0.00 0.00 67 C 9.97 4.22 0.00 3.00 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 68 G 8.43 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 69 H 8.33 4.77 0.00 3.25 3.23 0.00 5.61 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 70 K 8.51 4.82 0.00 1.65 1.74 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.44 7.81 71 A 8.96 4.90 1.23 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 0.00 0.00 0.00 72 I 8.52 4.94 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.72 1.05 0.00 0.00 73 G 8.29 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 74 T 8.57 4.75 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 1.31 0.00 0.00 75 V 9.04 4.51 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 1.04 0.00 0.00 0.94 0.00 0.00 76 L 8.98 5.16 0.00 1.73 1.58 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 77 V 9.09 4.75 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 0.97 0.00 0.00 0.81 0.00 0.00 78 G 8.50 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 79 P 0.00 4.76 0.00 2.04 2.03 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 80 T 7.35 4.31 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 1.25 0.00 0.00 81 P 0.00 4.49 0.00 2.21 2.13 0.00 3.85 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 1.98 1.95 0.00 82 A 7.28 4.47 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 83 N 8.51 4.79 0.00 2.84 2.74 0.00 0.00 6.76 7.37 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 84 I 9.05 4.70 1.87 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 1.39 1.15 0.95 0.00 0.00 85 I 8.93 4.22 1.96 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 1.16 0.96 0.91 0.00 0.00 86 G 8.38 4.38 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 87 R 9.03 4.06 0.00 1.84 2.01 0.00 3.15 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 88 N 7.88 4.36 0.00 2.82 2.98 0.00 0.00 6.94 8.99 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 89 L 7.76 4.46 0.00 1.70 1.74 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 90 L 7.98 4.01 0.00 1.69 1.71 0.92 0.43 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 91 T 8.07 3.94 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 1.26 0.00 0.00 92 Q 7.87 4.04 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.02 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 93 I 7.68 4.17 1.80 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.58 0.93 0.00 0.00 94 G 7.72 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 0.00 0.00 0.00 95 C 7.94 4.37 0.00 2.94 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 96 T 8.09 4.75 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 97 L 8.26 4.73 0.00 1.70 1.73 0.96 0.96 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 98 N 8.40 5.01 0.00 2.66 2.64 0.00 0.00 6.79 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 99 F 8.12 4.47 0.00 3.05 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 * Residues marked with a * may have inaccurate shift predictions.