NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 K 3.7942 8.1733 119.9796 55.8616 35.3007 174.6021 11 F 5.1552 7.6471 120.4006 55.5098 40.7051 173.4248 12 N 4.9804 9.9830 124.1183 52.6893 42.4137 173.9818 13 D 4.1615 9.9429 122.5045 55.3198 38.5913 174.1621 14 G 3.9532 8.5542 103.4973 46.3588 0.0000 173.7705 15 N 5.1417 7.8131 116.1086 50.4805 41.4321 173.9526 16 L 4.4264 8.7755 123.3109 55.2166 42.3584 176.3000 17 N 4.2681 9.3309 127.0547 52.0479 37.9575 175.3199 18 I 3.9041 8.1725 119.5624 62.1571 38.2974 177.1729 19 A 4.1561 7.9504 124.3680 54.2330 18.9844 176.8835 20 Y 4.2766 7.5695 117.2440 59.2191 38.9402 175.9562 21 A 3.3492 7.9904 128.0654 52.4373 17.0040 177.5978 22 K 4.2241 7.6281 116.2958 55.7565 32.9608 175.3163 23 P 4.5227 0.0000 0.0000 63.2315 32.2509 175.5851 24 T 5.0241 8.3369 112.6987 60.2153 72.1655 172.6473 25 T 4.8814 8.4305 112.0308 60.6562 73.0257 172.0715 26 Q 4.3265 8.0541 119.1984 54.7227 31.2944 174.5472 27 S 3.2875 7.3444 114.0947 60.9281 63.4413 174.2353 28 S 4.3831 6.9021 112.6922 57.7915 64.8515 174.2630 29 V 4.6869 8.1868 119.3052 61.0649 33.9495 173.7758 30 D 4.7315 8.6240 124.7542 53.2210 44.3173 174.1917 31 Y 3.8841 8.7833 117.2240 59.0951 35.5616 170.8515 32 N 4.2605 8.5691 111.9827 54.3815 36.9314 176.1909 33 G 4.1611 8.2147 108.5727 44.6243 0.0000 173.9801 34 D 4.7644 7.7382 120.8655 53.7301 42.3141 176.6500 35 P 4.7952 0.0000 0.0000 65.7842 31.3404 178.1850 36 N 4.6091 8.2580 116.1145 55.1496 37.0244 176.7612 37 R 4.0862 8.0394 119.7292 58.2318 30.3922 177.4269 38 A 4.5937 8.1018 119.6719 52.3623 18.8624 178.1208 39 V 4.7491 7.8494 111.2309 61.1408 32.9215 176.4117 40 D 4.5502 8.6025 117.4138 53.0370 39.5996 177.0900 41 G 3.9002 8.9603 107.9487 45.7912 0.0000 172.9554 42 N 4.7742 8.2175 118.0990 51.7198 39.7632 174.5224 43 R 3.9310 8.3514 124.2405 56.3914 30.6524 176.2453 44 N 4.1290 8.1884 117.8147 54.4079 39.0281 174.3060 45 G 3.8857 8.6495 113.4752 45.2924 0.0000 172.0136 46 N 4.9391 7.8729 119.8537 52.4852 39.0519 174.9919 47 F 3.8671 9.6266 130.1750 61.5116 39.4769 176.7306 48 N 4.4898 8.2833 115.2830 54.7777 38.4909 175.7143 49 S 4.1974 7.7737 112.4609 58.8924 63.5845 175.2702 50 G 3.7552 7.7371 109.2101 45.1351 0.0000 173.6720 51 S 4.7996 7.1627 113.4391 57.7646 63.0039 173.4442 52 V 4.7605 7.3601 117.6221 61.0436 33.8833 175.4350 53 T 4.5723 8.8661 118.2897 62.2104 70.9231 172.9801 54 H 4.8230 9.1077 118.9676 55.8714 33.6655 173.3358 55 T 5.2241 8.1739 116.5252 59.4789 71.0684 174.2706 56 R 4.1974 8.4573 121.8168 55.8641 31.3650 177.9458 57 A 4.3403 8.3468 122.2109 51.7084 17.2841 177.0126 58 D 4.6245 8.6067 122.3896 53.1460 43.7487 175.4110 59 N 5.2591 8.3804 114.5075 51.1307 37.9134 172.1224 60 P 4.9507 0.0000 0.0000 60.6669 34.5156 176.0432 61 S 4.4616 8.2903 114.3481 58.5242 64.0149 173.7081 62 W 5.7992 8.2223 119.0923 55.4338 32.0594 173.1193 63 W 5.7959 9.7480 129.5927 56.2624 34.2050 173.1424 64 E 5.0028 8.5694 125.6266 54.5876 33.2786 173.8787 65 V 4.3706 8.1074 125.1450 59.7776 34.3590 173.9915 66 D 5.0808 8.5779 123.8019 52.6396 42.0677 175.9502 67 L 4.0851 8.7750 126.6789 55.5267 41.9960 178.9020 68 K 4.1914 10.0930 119.0453 56.0159 31.5369 176.0337 69 K 4.5948 7.1853 114.9535 55.2213 35.8549 175.9899 70 M 4.2621 8.5130 120.7090 56.2397 32.6303 175.2507 71 D 4.8081 9.0700 121.5053 52.9632 46.0813 173.1632 72 K 4.9374 8.5734 117.8525 54.6036 35.0247 175.5403 73 V 4.2323 8.9220 126.1762 62.0823 33.4847 174.2735 74 G 4.0550 9.5288 114.8588 46.5632 0.0000 175.6901 75 L 4.8597 6.5251 126.4325 54.8505 43.9239 174.7515 76 V 4.9475 9.3998 126.5467 61.1293 34.1076 173.8185 77 K 5.0057 9.4663 130.1499 54.7631 34.6283 174.5108 78 I 4.8279 8.6918 128.7692 59.7775 39.9557 174.0366 79 Y 4.9024 8.9814 125.6844 56.1511 39.6487 175.3087 80 N 4.7961 8.9321 123.9339 52.7487 40.1107 174.5646 81 R 4.3059 8.5844 123.2055 57.3890 30.0832 176.1440 82 T 4.6020 8.8387 113.9002 61.5881 70.7070 175.0617 83 D 4.4316 8.2728 120.8312 55.8698 39.9584 175.8031 84 A 4.3768 7.9125 118.9029 51.9639 21.8250 174.5159 85 E 4.0873 8.9538 115.2615 56.4138 27.1473 177.6378 86 T 3.9413 7.9351 110.7045 64.5225 68.9855 175.8895 87 Q 4.1341 8.0222 119.4150 58.0734 29.0040 178.2489 88 R 3.8606 7.7764 118.1463 59.0465 30.2023 177.0584 89 L 4.1682 7.2609 120.7547 53.2051 40.3046 175.2952 90 S 4.8111 8.0054 115.7143 56.9509 66.7596 174.2161 91 N 4.2165 9.0036 118.2747 54.6263 37.4450 172.6804 92 F 5.4489 8.1130 114.0214 55.3382 42.5052 175.1740 93 D 5.3301 9.1505 119.9228 52.8406 43.6775 175.7023 94 V 4.9507 8.9328 122.2280 61.4853 33.9601 174.2802 95 I 4.8523 9.0519 129.2776 59.4159 40.5881 174.5416 96 L 4.9734 8.3661 126.4453 53.2891 43.8644 175.1829 97 Y 5.3197 8.8136 120.5128 56.3489 42.1737 175.9082 98 D 4.6960 8.7829 122.0344 52.2853 41.7621 176.3502 99 N 4.5042 8.7576 116.3093 56.0895 37.8927 175.4559 100 N 4.8824 8.7151 114.5718 52.8254 39.0484 174.9937 101 R 4.0805 8.0494 115.4105 57.2139 28.3114 176.1395 102 N 4.6342 7.7786 115.3335 52.5997 39.2765 174.5042 103 E 4.1603 8.8461 123.6680 56.4294 30.0004 176.4102 104 V 4.3289 8.1545 119.5880 62.2787 33.5926 175.8934 105 A 4.6197 7.4886 119.1598 51.1865 22.3731 175.1295 106 K 5.0933 8.6110 119.8593 55.1338 35.5730 175.3052 107 K 4.7175 9.4456 125.8925 54.8491 35.8036 174.3461 108 H 5.0923 8.7715 123.3858 54.4671 31.9156 173.7533 109 V 4.0949 7.9602 125.4701 61.2423 33.2250 175.8239 110 N 4.6022 8.8889 125.9037 55.9973 39.8124 174.6229 111 N 4.7772 7.6231 112.4962 52.6413 39.4951 172.9567 112 L 4.7774 8.4292 118.4468 53.0887 43.6365 177.1823 113 S 4.4618 8.7242 116.9355 59.5409 64.4155 174.1789 114 G 4.3546 7.5992 110.3774 44.7790 0.0000 172.3983 115 E 4.4579 8.7798 118.4821 57.8032 30.6868 176.3576 116 S 5.1581 7.7104 112.9778 56.9343 66.5204 173.5162 117 V 4.5549 8.6010 118.9573 59.9913 34.6983 174.5201 118 S 5.2449 8.6952 118.3923 56.8312 65.3923 173.3833 119 L 4.7469 9.1696 124.2858 52.7742 45.5432 175.1380 120 D 5.2571 8.3993 121.7304 52.7533 43.0749 175.3500 121 F 4.4019 9.4518 124.9424 56.6625 39.3742 176.3859 122 K 4.1460 9.2830 119.3103 57.8074 29.7867 175.8681 123 E 3.9482 8.6450 114.1092 56.5100 27.6324 174.9554 124 K 3.9886 7.9150 120.7626 56.9044 33.3769 175.9818 125 G 4.1957 8.6866 114.1660 45.9085 0.0000 172.5883 126 A 4.7268 8.9854 125.8829 51.3153 22.7949 176.3297 127 R 4.1798 9.1336 119.9897 56.9715 32.5281 175.6753 128 Y 5.3167 7.8872 115.1463 56.0481 41.8968 175.0267 129 I 4.9481 8.6718 123.2484 59.6068 40.5827 174.1672 130 K 5.1367 9.2609 129.4992 54.6625 34.7314 174.8890 131 V 5.0343 9.4104 127.8103 61.2606 33.6969 174.1652 132 K 5.1834 9.3041 129.6944 54.3770 34.8715 175.3217 133 L 4.5402 8.7805 128.3438 55.3341 41.7776 177.3780 134 L 4.5235 8.8823 121.8568 55.4187 42.9902 176.9226 135 T 4.3057 7.9278 116.3165 61.8882 68.3646 174.8132 136 S 4.2217 8.4479 121.6153 59.5175 63.5973 174.3841 137 G 3.8704 9.1580 109.8038 45.8178 0.0000 173.2088 138 V 4.4272 7.4430 118.3325 59.8323 33.7628 173.6793 139 P 4.5211 0.0000 0.0000 62.6866 32.4509 175.2827 140 L 4.5192 8.6946 125.8340 53.6979 43.7673 175.2538 141 S 5.3363 8.3863 121.4425 55.5727 66.2474 173.3866 142 L 4.6109 8.7881 123.8719 52.8550 44.4627 177.5325 143 A 4.0136 8.9843 126.4104 54.9092 19.1190 177.3596 144 E 4.7026 7.6141 112.2441 55.4183 33.1707 174.8492 145 V 4.9128 8.8777 125.7997 61.3531 33.9195 174.3275 146 E 4.8803 9.4305 128.1217 54.6141 32.3362 175.3559 147 V 4.8022 8.4126 122.8232 61.1393 34.9397 174.2759 148 F 5.4306 9.2147 125.4914 55.7405 42.6828 176.3775 149 R 4.5805 9.2528 118.2881 57.0796 30.5633 175.7930 150 E 4.6338 7.8989 117.5536 55.3056 33.0636 176.2222 *151 S 4.2554 8.4958 113.9257 58.4235 63.0531 171.1947 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 10 K 8.17 3.79 0.00 1.60 1.58 0.00 1.23 0.00 0.00 1.66 0.00 0.00 2.74 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.63 7.81 11 F 7.65 5.16 0.00 3.16 3.01 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 0.00 0.00 0.00 12 N 9.98 4.98 0.00 3.06 2.92 0.00 0.00 6.68 8.43 0.00 0.00 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 9.94 4.16 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.55 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 15 N 7.81 5.14 0.00 2.70 2.83 0.00 0.00 6.68 6.75 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 16 L 8.78 4.43 0.00 1.88 1.78 0.79 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17 N 9.33 4.27 0.00 2.63 2.79 0.00 0.00 6.53 8.25 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 18 I 8.17 3.90 1.85 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 1.36 0.66 0.92 0.00 0.00 19 A 7.95 4.16 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 20 Y 7.57 4.28 0.00 2.83 2.96 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 21 A 7.99 3.35 0.77 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 0.00 0.00 22 K 7.63 4.22 0.00 1.84 1.90 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.60 7.81 23 P 0.00 4.52 0.00 2.03 1.93 0.00 3.71 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 2.07 2.05 0.00 24 T 8.34 5.02 3.98 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 0.00 0.00 1.28 0.00 0.00 25 T 8.43 4.88 4.35 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 1.22 0.00 0.00 26 Q 8.05 4.33 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.13 0.00 0.00 0.00 0.00 0.00 2.16 2.39 0.00 27 S 7.34 3.29 0.00 3.48 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 28 S 6.90 4.38 0.00 3.88 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 29 V 8.19 4.69 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 0.86 0.00 0.00 0.92 0.00 0.00 30 D 8.62 4.73 0.00 2.63 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.78 3.88 0.00 3.04 3.11 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 32 N 8.57 4.26 0.00 2.95 2.93 0.00 0.00 7.12 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.21 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.74 4.76 0.00 2.76 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 35 P 0.00 4.80 0.00 2.32 2.59 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 36 N 8.26 4.61 0.00 2.97 3.14 0.00 0.00 6.31 7.66 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 37 R 8.04 4.09 0.00 1.94 2.07 0.00 3.24 0.00 0.00 3.32 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 38 A 8.10 4.59 1.03 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 0.00 0.00 0.00 0.00 0.00 39 V 7.85 4.75 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 1.18 0.00 0.00 1.05 0.00 0.00 40 D 8.60 4.55 0.00 2.80 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 41 G 8.96 3.90 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 0.00 0.00 0.00 42 N 8.22 4.77 0.00 2.67 2.86 0.00 0.00 7.12 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 43 R 8.35 3.93 0.00 1.64 1.59 0.00 3.04 0.00 0.00 2.49 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.28 0.00 44 N 8.19 4.13 0.00 2.78 2.73 0.00 0.00 7.03 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 45 G 8.65 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 46 N 7.87 4.94 0.00 2.74 2.71 0.00 0.00 6.74 7.71 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 47 F 9.63 3.87 0.00 3.09 3.06 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 48 N 8.28 4.49 0.00 2.88 2.84 0.00 0.00 6.90 7.57 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 49 S 7.77 4.20 0.00 3.93 3.93 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.74 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 51 S 7.16 4.80 0.00 3.97 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 52 V 7.36 4.76 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 1.05 0.00 0.00 0.97 0.00 0.00 53 T 8.87 4.57 4.51 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 0.00 0.00 0.00 1.32 0.00 0.00 54 H 9.11 4.82 0.00 3.35 3.47 0.00 5.57 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.17 5.22 4.27 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 1.20 0.00 0.00 56 R 8.46 4.20 0.00 1.81 1.91 0.00 3.10 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 57 A 8.35 4.34 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 58 D 8.61 4.62 0.00 2.66 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 59 N 8.38 5.26 0.00 2.57 2.75 0.00 0.00 6.75 8.02 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 60 P 0.00 4.95 0.00 2.42 2.14 0.00 3.95 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 2.09 2.07 0.00 61 S 8.29 4.46 0.00 3.85 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 62 W 8.22 5.80 0.00 3.63 3.23 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 63 W 9.75 5.80 0.00 3.37 3.04 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 64 E 8.57 5.00 0.00 2.06 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.38 0.00 65 V 8.11 4.37 1.89 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 0.76 0.00 0.00 0.97 0.00 0.00 66 D 8.58 5.08 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 67 L 8.78 4.09 0.00 1.67 1.60 0.87 0.43 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 68 K 10.09 4.19 0.00 1.82 2.06 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.28 7.81 69 K 7.19 4.59 0.00 1.62 1.68 0.00 1.59 0.00 0.00 1.67 0.00 0.00 2.71 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.28 1.37 7.81 70 M 8.51 4.26 0.00 1.90 2.03 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.45 0.00 71 D 9.07 4.81 0.00 2.61 2.45 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 0.00 0.00 0.00 0.00 72 K 8.57 4.94 0.00 1.71 1.71 0.00 1.92 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.35 7.81 73 V 8.92 4.23 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 1.06 0.00 0.00 0.89 0.00 0.00 74 G 9.53 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 0.00 0.00 0.00 75 L 6.53 4.86 0.00 1.90 1.88 0.98 0.66 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 76 V 9.40 4.95 2.43 0.00 0.00 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 1.15 0.00 0.00 77 K 9.47 5.01 0.00 2.03 1.93 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.70 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.54 1.31 7.81 78 I 8.69 4.83 1.92 0.00 0.00 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 1.28 0.74 0.82 0.00 0.00 79 Y 8.98 4.90 0.00 3.02 2.88 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 80 N 8.93 4.80 0.00 2.72 2.72 0.00 0.00 7.19 8.14 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 81 R 8.58 4.31 0.00 1.87 1.82 0.00 3.23 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 82 T 8.84 4.60 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 1.30 0.00 0.00 83 D 8.27 4.43 0.00 2.81 2.86 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 84 A 7.91 4.38 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 85 E 8.95 4.09 0.00 2.09 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 2.25 2.11 0.00 86 T 7.94 3.94 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 1.24 0.00 0.00 87 Q 8.02 4.13 0.00 2.24 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 88 R 7.78 3.86 0.00 1.86 2.11 0.00 3.07 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 89 L 7.26 4.17 0.00 1.45 1.52 -0.01 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.01 4.81 0.00 4.19 3.90 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 91 N 9.00 4.22 0.00 2.98 2.87 0.00 0.00 7.06 7.92 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 92 F 8.11 5.45 0.00 3.23 3.01 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 0.00 0.00 0.00 93 D 9.15 5.33 0.00 2.73 2.66 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 94 V 8.93 4.95 2.38 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 1.31 0.00 0.00 1.24 0.00 0.00 95 I 9.05 4.85 1.80 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.76 0.29 0.00 0.00 96 L 8.37 4.97 0.00 1.33 1.37 -0.13 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.81 5.32 0.00 3.00 2.84 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 98 D 8.78 4.70 0.00 2.94 2.88 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 99 N 8.76 4.50 0.00 2.69 2.91 0.00 0.00 6.70 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 0.00 100 N 8.72 4.88 0.00 2.93 2.77 0.00 0.00 6.84 7.18 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 0.00 101 R 8.05 4.08 0.00 1.81 1.68 0.00 2.81 0.00 0.00 2.65 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.26 0.00 102 N 7.78 4.63 0.00 3.20 2.77 0.00 0.00 6.70 7.54 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 0.00 103 E 8.85 4.16 0.00 1.90 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 2.16 1.97 0.00 104 V 8.15 4.33 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 0.76 0.00 0.00 0.94 0.00 0.00 105 A 7.49 4.62 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.61 5.09 0.00 1.83 1.65 0.00 1.85 0.00 0.00 1.86 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.51 7.81 107 K 9.45 4.72 0.00 1.73 1.55 0.00 0.66 0.00 0.00 1.20 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.16 1.14 7.81 108 H 8.77 5.09 0.00 3.17 3.10 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.96 4.09 0.67 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 0.77 0.00 0.00 0.61 0.00 0.00 110 N 8.89 4.60 0.00 2.75 2.84 0.00 0.00 6.71 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 0.00 111 N 7.62 4.78 0.00 2.81 2.81 0.00 0.00 5.90 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 0.00 112 L 8.43 4.78 0.00 1.67 1.84 1.15 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.72 4.46 0.00 3.97 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 0.00 114 G 7.60 4.35 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 0.00 115 E 8.78 4.46 0.00 2.00 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 2.42 2.33 0.00 116 S 7.71 5.16 0.00 3.32 3.39 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 0.00 117 V 8.60 4.55 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 1.06 0.00 0.00 0.93 0.00 0.00 118 S 8.70 5.24 0.00 3.71 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 0.00 119 L 9.17 4.75 0.00 1.60 1.21 1.04 0.52 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 0.00 120 D 8.40 5.26 0.00 2.61 2.46 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 0.00 121 F 9.45 4.40 0.00 3.39 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 0.00 122 K 9.28 4.15 0.00 1.92 1.91 0.00 1.79 0.00 0.00 2.05 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.52 7.81 123 E 8.64 3.95 0.00 2.19 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 2.26 2.27 0.00 124 K 7.91 3.99 0.00 2.18 1.75 0.00 1.53 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.47 7.81 125 G 8.69 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 0.00 126 A 8.99 4.73 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 0.00 127 R 9.13 4.18 0.00 1.62 1.46 0.00 2.85 0.00 0.00 2.79 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.10 0.00 128 Y 7.89 5.32 0.00 3.08 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 0.00 129 I 8.67 4.95 1.98 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 1.00 0.71 1.02 0.00 0.00 130 K 9.26 5.14 0.00 2.10 1.88 0.00 1.34 0.00 0.00 1.62 0.00 0.00 2.61 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.52 1.65 7.81 131 V 9.41 5.03 2.38 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 0.85 0.00 0.00 1.19 0.00 0.00 132 K 9.30 5.18 0.00 2.00 1.77 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.60 7.81 133 L 8.78 4.54 0.00 1.76 1.66 0.95 1.07 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 0.00 134 L 8.88 4.52 0.00 1.70 1.78 1.04 0.86 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 0.00 135 T 7.93 4.31 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 1.24 0.00 0.00 136 S 8.45 4.22 0.00 4.01 3.91 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 0.00 137 G 9.16 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 0.00 138 V 7.44 4.43 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 0.84 0.00 0.00 0.94 0.00 0.00 139 P 0.00 4.52 0.00 1.80 2.05 0.00 3.67 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 140 L 8.69 4.52 0.00 1.72 1.48 0.76 1.11 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 0.00 141 S 8.39 5.34 0.00 3.64 3.70 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 0.00 142 L 8.79 4.61 0.00 1.06 1.13 0.20 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 143 A 8.98 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 0.00 144 E 7.61 4.70 0.00 1.96 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 2.10 2.32 0.00 145 V 8.88 4.91 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 1.02 0.00 0.00 0.28 0.00 0.00 146 E 9.43 4.88 0.00 2.28 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 2.30 2.40 0.00 147 V 8.41 4.80 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 0.98 0.00 0.00 0.99 0.00 0.00 148 F 9.21 5.43 0.00 3.18 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 0.00 149 R 9.25 4.58 0.00 1.90 2.05 0.00 3.25 0.00 0.00 2.25 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.64 0.00 150 E 7.90 4.63 0.00 2.12 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 2.32 2.34 0.00 *151 S 8.50 4.26 0.00 3.62 3.72 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 * Residues marked with a * may have inaccurate shift predictions.