NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *32 N 4.7871 8.2833 117.7897 52.1019 39.8807 174.7734 33 S 4.1462 8.4009 116.1314 61.2433 61.6190 175.2924 34 L 4.0647 8.2627 126.2551 60.3069 40.9923 182.6836 35 M 4.6622 8.0709 122.4828 60.0962 31.6389 181.3907 36 E 4.2515 8.0729 119.2401 61.0010 29.8200 181.5707 37 R 4.1438 8.2236 118.4799 59.4658 30.1393 179.2055 38 I 3.7193 7.2446 119.5904 64.5156 36.9972 177.8515 39 H 4.0825 8.2683 119.0505 59.5149 29.5750 177.0699 40 E 3.9475 8.3364 120.2186 59.4804 29.3749 179.2216 41 Q 4.0222 8.1228 121.6039 59.8183 29.2015 179.0005 42 I 3.8602 7.9645 121.3390 64.8780 35.5368 179.9911 43 K 4.1201 8.2842 121.6422 59.2329 31.8114 179.0480 44 K 4.0556 7.8984 119.1312 59.4750 31.8918 179.3777 45 G 3.6754 7.6894 104.5947 47.7790 0.0000 175.2817 46 E 4.0203 8.1125 120.9837 59.2811 29.6942 179.0433 47 L 4.3046 8.2676 118.6589 57.5873 41.6292 179.3221 48 A 4.0734 8.3952 121.4610 54.9290 18.1473 179.7664 49 L 3.9509 7.7783 117.6222 58.0200 41.7501 179.4462 50 F 4.0114 8.1825 117.4159 60.8033 38.7695 177.1729 51 Y 4.0266 8.5135 119.1495 60.6326 38.6545 177.6785 52 L 4.4262 8.1592 122.6377 57.7860 42.1542 178.7592 53 Q 3.9467 8.4385 119.7382 59.1690 28.8620 178.1510 54 E 3.9652 8.1123 119.8039 59.2163 29.3959 179.1860 55 Q 3.8631 8.0635 118.5153 58.9640 28.6959 178.9267 56 I 3.7152 7.8078 120.7043 64.4409 37.0073 178.1624 57 N 4.3946 8.2407 119.6861 57.4780 38.5031 177.9098 *58 H 4.2199 8.4378 120.3123 59.3682 27.8506 179.2507 59 F 4.2518 8.4267 122.7292 61.5474 39.0902 176.9405 60 E 4.0222 8.4818 119.4079 60.4523 29.3274 179.4361 61 E 4.2605 7.9429 119.4996 60.1717 30.7683 180.6086 62 K 4.5705 7.5067 125.2737 50.8125 32.2740 174.8244 63 P 3.3965 0.0000 0.0000 61.4889 32.0482 176.3000 64 T 4.5490 7.8218 114.7898 59.3581 71.6447 175.4153 65 K 4.0593 8.9787 130.5971 60.1406 31.1965 175.9011 66 E 4.2202 8.1809 118.2356 59.7180 29.3785 178.9427 67 M 4.1330 8.2340 118.3999 58.2858 32.2464 178.1276 68 K 3.4717 8.3279 119.4496 59.6087 32.2999 178.1955 69 D 4.3390 8.0879 119.0515 57.2074 40.6440 178.9429 70 K 3.9168 7.6918 119.6377 59.5201 32.2519 178.7608 71 I 3.6141 7.8908 120.3184 64.4617 37.0011 178.3300 72 V 3.4806 7.9106 118.8344 66.0836 31.3123 177.7339 73 A 3.9701 7.6783 120.1305 55.4107 18.2484 179.4265 74 E 3.9411 8.2916 116.9429 59.9217 29.5492 179.6257 75 M 4.0954 8.3575 118.9853 58.4703 32.0244 178.5954 76 D 4.4117 8.5081 119.3916 57.2610 41.0089 179.0682 77 T 3.8590 7.8790 116.5251 66.7610 68.6220 176.7927 78 I 3.7349 7.7645 121.6595 64.5097 37.0855 178.6392 79 I 3.7232 7.8155 120.3835 64.0952 36.3311 178.2819 80 A 4.0365 8.1360 124.2047 55.9581 18.1468 180.2091 81 M 4.0287 7.8722 118.2325 60.1207 31.4520 180.4069 82 I 3.8634 7.6051 121.0821 64.3363 36.7202 177.9944 83 D 4.4587 8.1637 119.6532 57.6813 40.8530 179.3313 84 G 3.6295 7.8149 104.8988 47.6256 0.0000 175.8500 85 V 3.5837 8.0113 120.6922 65.8476 31.4953 177.9352 86 R 3.9628 8.3620 118.9783 59.3997 29.9506 178.5497 87 G 3.6154 7.7348 104.5719 48.0130 0.0000 175.7001 88 V 3.6423 7.6236 120.6522 65.5456 31.4187 178.1990 89 L 3.9855 7.8567 118.7213 57.9359 41.3464 179.0440 90 D 4.4225 8.1415 117.7383 57.3120 40.9387 179.0906 91 R 4.0643 7.9064 118.3774 59.2252 29.9971 178.7908 92 L 4.0266 7.5372 118.0990 58.2082 42.2105 178.4437 93 M 4.3088 8.1785 118.1127 57.2515 31.6362 177.3459 94 Q 4.4250 7.5399 117.3603 56.1305 28.6126 176.0946 95 R 4.4034 7.5320 120.8281 55.9811 31.4049 177.0065 96 K 4.5498 8.2369 118.1092 54.8029 33.5785 175.9073 97 D 4.5322 8.1268 116.7429 57.6346 41.1055 177.1112 98 L 4.6582 8.2296 117.8326 54.9078 41.9518 177.4384 99 D 4.8286 8.8896 126.3380 52.7937 42.8662 177.5559 100 I 3.5585 7.9090 119.0916 65.0990 35.0424 174.4158 101 F 4.6079 7.6392 117.5847 60.7226 39.1043 177.7357 102 E 4.0869 9.6397 119.0874 59.4121 29.2690 179.0830 103 Q 3.9820 8.4961 120.0174 59.3026 29.0124 177.7348 104 Y 4.0385 7.7051 118.9452 60.9415 38.8187 177.7009 105 N 4.2628 8.1633 116.8372 56.5855 38.6651 177.3788 106 L 3.9652 7.7747 119.6105 57.8701 41.7214 179.4574 107 E 3.9070 8.1674 118.5136 59.5727 29.2484 179.4044 108 M 3.8777 7.9780 118.6952 58.1846 31.9739 178.6819 109 A 3.9472 8.1097 121.1307 54.9567 18.4860 179.6289 110 K 3.8863 8.2096 118.3110 59.5473 32.1790 179.3203 111 K 3.9906 8.1475 118.8563 59.3214 31.9232 179.4423 112 S 4.1924 8.4270 116.0347 61.6746 62.7119 177.0124 113 G 3.6197 8.0250 108.2225 47.7956 0.0000 175.3892 114 D 4.3322 7.8173 120.7728 57.2522 40.9000 178.7705 115 I 3.6726 7.9661 120.5296 64.3453 37.1243 178.2720 116 L 3.8541 8.0210 120.9069 58.2542 42.0241 178.5543 117 E 3.9377 8.3956 119.4979 59.2966 29.5026 179.0721 118 R 3.9052 8.0919 118.1013 59.3920 30.0823 178.6176 119 D 4.5027 8.1107 117.7494 56.1606 40.6734 178.7831 120 L 4.0469 7.7275 120.3221 57.6801 41.9486 179.2977 121 K 3.6550 7.9920 118.2816 59.1563 31.4656 179.4695 122 K 3.9269 8.0024 120.1329 59.3719 32.2476 178.6274 123 E 3.9459 7.8917 119.7010 59.1151 29.7093 178.2241 124 E 3.8368 8.8784 120.0201 59.3602 29.5668 178.6506 125 A 4.0032 8.0015 120.6983 55.1430 18.1269 179.6412 126 R 3.8370 7.3502 115.3824 59.4434 30.5226 178.5241 127 V 3.7068 7.6694 117.8931 66.0236 31.2650 178.1828 128 K 4.0615 7.8529 119.2441 59.9737 31.9495 179.8694 129 K 4.3062 7.6087 122.8734 57.9176 31.7009 179.8351 130 I 4.0887 7.2321 121.4859 62.3230 37.3200 176.6016 131 E 4.2389 8.7797 120.7386 56.1218 29.6697 172.8282 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 *32 N 8.28 4.79 0.00 2.62 2.75 0.00 0.00 6.78 6.48 0.00 0.00 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 S 8.40 4.15 0.00 3.94 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 34 L 8.26 4.06 0.00 1.65 1.69 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 35 M 8.07 4.66 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.16 0.00 36 E 8.07 4.25 0.00 2.00 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 2.23 0.00 37 R 8.22 4.14 0.00 2.00 2.02 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.98 0.00 38 I 7.24 3.72 2.03 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 1.42 0.75 0.92 0.00 0.00 39 H 8.27 4.08 0.00 3.21 3.50 0.00 5.59 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 40 E 8.34 3.95 0.00 2.18 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 2.66 2.49 0.00 41 Q 8.12 4.02 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 42 I 7.96 3.86 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 1.41 0.56 0.91 0.00 0.00 43 K 8.28 4.12 0.00 1.76 1.97 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.47 7.81 44 K 7.90 4.06 0.00 1.97 1.83 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.73 7.81 45 G 7.69 3.68 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 0.00 0.00 0.00 46 E 8.11 4.02 0.00 2.14 2.25 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 2.71 2.52 0.00 47 L 8.27 4.30 0.00 1.93 1.76 0.90 0.44 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 48 A 8.40 4.07 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 49 L 7.78 3.95 0.00 1.75 1.60 0.88 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.18 4.01 0.00 3.33 3.14 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 0.00 0.00 0.00 0.00 51 Y 8.51 4.03 0.00 3.23 3.18 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 52 L 8.16 4.43 0.00 1.97 1.87 0.99 0.31 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 53 Q 8.44 3.95 0.00 2.15 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 54 E 8.11 3.97 0.00 1.93 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 2.67 2.49 0.00 55 Q 8.06 3.86 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 56 I 7.81 3.72 2.01 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 1.43 0.83 0.92 0.00 0.00 57 N 8.24 4.39 0.00 2.91 2.87 0.00 0.00 7.19 8.20 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 *58 H 8.44 4.22 0.00 2.91 3.07 0.00 7.21 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.43 4.25 0.00 3.20 3.28 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 60 E 8.48 4.02 0.00 2.16 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 0.00 2.48 2.68 0.00 61 E 7.94 4.26 0.00 2.01 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 2.26 2.21 0.00 62 K 7.51 4.57 0.00 1.74 1.60 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.26 1.23 7.81 63 P 0.00 3.40 0.00 1.77 1.50 0.00 3.47 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.81 0.00 64 T 7.82 4.55 4.47 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 1.21 0.00 0.00 65 K 8.98 4.06 0.00 1.78 1.88 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.12 7.81 66 E 8.18 4.22 0.00 2.09 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 2.42 2.45 0.00 67 M 8.23 4.13 0.00 2.68 2.21 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.83 0.00 68 K 8.33 3.47 0.00 1.88 2.05 0.00 1.84 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.45 1.34 7.81 69 D 8.09 4.34 0.00 2.93 2.72 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 70 K 7.69 3.92 0.00 1.85 2.01 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.51 7.81 71 I 7.89 3.61 1.63 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.66 0.77 0.00 0.00 72 V 7.91 3.48 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 73 A 7.68 3.97 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 74 E 8.29 3.94 0.00 2.19 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 2.35 2.61 0.00 75 M 8.36 4.10 0.00 2.01 2.25 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.54 0.00 76 D 8.51 4.41 0.00 2.89 2.70 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 77 T 7.88 3.86 4.43 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 0.00 0.00 0.00 1.21 0.00 0.00 78 I 7.76 3.73 1.86 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 1.52 1.35 0.90 0.00 0.00 79 I 7.82 3.72 1.99 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 1.44 0.73 0.94 0.00 0.00 80 A 8.14 4.04 1.39 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 0.00 0.00 81 M 7.87 4.03 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 82 I 7.61 3.86 1.97 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 1.51 0.77 0.97 0.00 0.00 83 D 8.16 4.46 0.00 2.89 2.71 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 84 G 7.81 3.63 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 0.00 0.00 0.00 85 V 8.01 3.58 2.21 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 0.98 0.00 0.00 0.99 0.00 0.00 86 R 8.36 3.96 0.00 1.95 2.07 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 87 G 7.73 3.62 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 0.00 0.00 0.00 88 V 7.62 3.64 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 1.02 0.00 0.00 1.02 0.00 0.00 89 L 7.86 3.99 0.00 1.91 1.68 0.90 1.08 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 90 D 8.14 4.42 0.00 2.76 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 91 R 7.91 4.06 0.00 2.03 1.96 0.00 3.13 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.90 0.00 92 L 7.54 4.03 0.00 1.72 1.84 0.93 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 93 M 8.18 4.31 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.57 0.00 94 Q 7.54 4.43 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.59 0.00 95 R 7.53 4.40 0.00 1.75 1.88 0.00 3.12 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 96 K 8.24 4.55 0.00 1.74 1.67 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.25 0.99 7.81 97 D 8.13 4.53 0.00 2.68 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 98 L 8.23 4.66 0.00 1.64 1.68 1.01 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 99 D 8.89 4.83 0.00 2.99 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 0.00 100 I 7.91 3.56 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 1.64 0.70 0.91 0.00 0.00 101 F 7.64 4.61 0.00 3.19 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 0.00 102 E 9.64 4.09 0.00 2.11 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 2.41 2.61 0.00 103 Q 8.50 3.98 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 104 Y 7.71 4.04 0.00 3.27 3.21 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 0.00 105 N 8.16 4.26 0.00 2.96 2.91 0.00 0.00 7.13 7.85 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 0.00 106 L 7.77 3.97 0.00 1.83 1.70 0.93 1.27 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 0.00 107 E 8.17 3.91 0.00 2.02 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 0.00 2.29 2.54 0.00 108 M 7.98 3.88 0.00 1.84 2.01 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.80 0.00 109 A 8.11 3.95 1.32 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 0.00 110 K 8.21 3.89 0.00 1.97 1.92 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.35 7.81 111 K 8.15 3.99 0.00 1.93 1.80 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.63 7.81 112 S 8.43 4.19 0.00 3.97 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 0.00 113 G 8.03 3.62 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 0.00 0.00 0.00 114 D 7.82 4.33 0.00 2.85 2.71 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 0.00 115 I 7.97 3.67 1.99 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 1.39 0.77 0.89 0.00 0.00 116 L 8.02 3.85 0.00 1.73 1.77 0.88 0.71 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 0.00 117 E 8.40 3.94 0.00 2.11 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 2.29 2.34 0.00 118 R 8.09 3.91 0.00 2.04 1.94 0.00 3.21 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 1.63 1.81 0.00 119 D 8.11 4.50 0.00 2.79 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 0.00 120 L 7.73 4.05 0.00 1.86 1.67 0.90 0.88 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 0.00 121 K 7.99 3.65 0.00 1.80 1.84 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.44 1.64 7.81 122 K 8.00 3.93 0.00 1.91 1.81 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.43 7.81 123 E 7.89 3.95 0.00 2.14 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 0.00 2.26 2.31 0.00 124 E 8.88 3.84 0.00 2.04 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 2.27 2.28 0.00 125 A 8.00 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.35 3.84 0.00 1.85 2.14 0.00 3.28 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 127 V 7.67 3.71 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 0.51 0.00 0.00 0.85 0.00 0.00 128 K 7.85 4.06 0.00 1.94 1.85 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.63 7.81 129 K 7.61 4.31 0.00 1.80 1.73 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.35 7.81 130 I 7.23 4.09 2.31 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.29 1.03 0.00 0.00 131 E 8.78 4.24 0.00 1.99 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 2.22 1.87 0.00 * Residues marked with a * may have inaccurate shift predictions.