NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 E 4.2864 8.4444 118.7996 55.8859 30.8569 175.3919 30 N 4.3552 8.5857 121.6313 50.9759 39.7355 171.4314 31 P 4.8337 0.0000 0.0000 61.2285 34.1392 174.9279 32 A 4.1193 8.9630 123.2305 51.8396 18.9291 176.0112 33 P 4.2163 0.0000 0.0000 62.9443 31.8185 175.9474 34 D 4.5631 8.7167 123.8145 53.9689 42.3815 174.7266 35 F 5.0377 7.4712 117.7877 56.4680 41.6008 172.9898 36 T 5.5562 8.5265 115.0460 61.3568 71.6043 173.5338 37 L 4.9991 8.5834 125.5034 52.4919 46.4950 175.9522 38 N 5.0380 8.7506 119.3109 53.7982 39.8402 175.4447 39 T 5.0574 8.3685 113.1953 59.6053 70.7649 174.8152 40 L 4.1725 8.6828 121.0569 58.0031 41.5481 178.9913 41 N 4.6955 8.0429 113.8074 53.1854 37.8236 175.6613 42 G 3.8564 8.3005 104.2895 47.1898 0.0000 173.4342 43 E 4.6785 7.5644 117.2463 54.6720 32.6278 174.9024 44 V 4.9527 8.1595 111.5633 59.5377 35.5437 175.5804 45 V 4.4157 8.7570 123.3254 60.8955 34.6126 173.9706 46 K 4.7643 8.3294 128.3167 54.4932 34.1181 176.1834 47 L 3.6687 8.1440 130.4029 58.0501 41.9179 179.2097 48 S 4.0714 7.7659 112.9705 61.0098 62.8458 175.3460 49 D 4.5778 7.7124 118.9621 55.5211 40.8065 176.5600 50 L 4.5658 7.8422 119.4217 54.0439 42.0276 176.3950 51 K 4.0749 7.2595 117.8335 58.1635 32.3129 177.4081 52 G 4.0152 9.4967 111.8472 44.8470 0.0000 173.2930 53 Q 4.8735 7.7533 118.1891 53.7836 32.7364 175.0492 54 V 4.2559 8.2053 121.4420 61.1072 33.4263 175.1572 55 V 4.6516 8.7647 123.6344 61.0410 34.9680 173.9833 56 I 4.8083 7.9630 127.9205 59.7177 38.7665 175.2159 57 V 4.1773 8.7596 128.5123 61.2072 33.2904 173.9306 58 N 5.2227 8.7144 127.7940 51.8059 41.5052 172.9842 59 F 5.1767 9.2435 126.5213 56.3541 40.7187 175.1846 60 W 5.4054 8.6594 119.1043 55.5438 32.1307 173.2017 61 A 3.8681 7.9913 120.4684 50.0123 21.6077 177.2532 62 T 3.1053 8.3506 115.0590 64.2685 67.4513 175.3233 63 W 4.5832 6.8944 115.5515 56.3416 28.6594 176.6783 64 C 4.8919 7.5075 119.8170 54.5948 39.3278 171.9852 65 P 4.3187 0.0000 0.0000 65.5554 31.1963 176.8813 66 P 4.3547 0.0000 0.0000 65.4686 30.8929 179.1985 67 C 4.3065 8.3077 115.1199 60.4241 40.0218 176.3980 68 R 4.0499 7.9583 117.4933 58.7895 29.6838 178.1928 69 E 4.2600 7.9493 118.6922 58.1574 30.0569 177.3689 70 E 4.3321 8.1006 115.8131 57.0873 29.9241 178.4423 71 I 3.5384 6.8262 121.4336 64.0501 37.2278 175.8728 72 P 4.1396 0.0000 0.0000 65.1475 31.6837 177.7473 73 S 4.7846 7.2960 112.4457 57.3077 59.4748 174.3908 *76 R 4.2166 7.9212 126.9599 56.9382 32.6497 177.9146 77 L 3.8692 8.1124 119.1314 58.1084 41.8408 178.2513 78 N 4.2191 8.1559 114.7524 57.0155 38.8939 176.1211 79 A 4.1088 7.2214 117.8098 54.5666 18.8369 178.3449 80 A 4.0904 7.5887 119.2213 51.2894 19.1075 177.4501 *82 A 3.9345 7.6012 123.8748 54.5059 19.8596 178.0780 83 G 3.9796 9.2079 110.5324 44.9529 0.0000 173.1359 84 K 4.6647 7.3867 117.6801 53.6303 35.7976 174.9615 85 P 4.7491 0.0000 0.0000 62.6999 28.8103 174.6932 86 F 5.3153 7.9325 123.1290 57.3775 42.9786 174.3352 87 R 4.4151 7.8137 123.8913 54.1545 34.6707 173.5954 *89 L 4.1399 8.2843 118.1867 55.6561 43.3137 176.2967 90 C 4.7609 8.7571 123.4583 58.0415 29.0092 172.4471 91 V 4.1499 8.4376 124.6571 62.3205 32.3770 174.4502 92 S 4.1336 8.8588 123.9444 57.1132 63.5287 174.4240 93 I 4.1646 7.5554 126.3326 61.5564 38.0083 175.5849 94 D 4.3295 7.5005 123.4751 54.7812 40.7626 176.9264 95 E 3.7894 9.0844 126.2537 59.3559 29.8145 178.6227 96 G 3.6682 8.0534 106.1851 46.1293 0.0000 175.6820 97 G 3.6835 8.0533 109.3058 46.2776 0.0000 175.7026 98 K 3.7601 8.7774 120.7059 59.6214 32.1580 178.4560 99 V 3.5537 7.9249 117.6254 66.1858 31.2576 177.6022 100 A 3.9836 7.8821 119.5011 55.2662 18.2382 179.6819 101 V 3.4156 7.6168 116.6398 65.9353 31.5368 177.8160 102 E 3.9941 8.4993 118.7668 59.6415 29.0111 178.8778 103 E 3.9762 8.2119 118.3294 59.9025 29.8136 179.6363 104 F 4.2341 8.3294 120.1487 61.2641 39.4309 177.2370 105 F 4.6418 8.5923 117.9605 60.5133 38.5302 177.3980 106 R 3.8988 8.2929 117.7924 59.4155 29.9578 178.0247 107 K 4.2118 7.5242 114.9350 57.3690 32.4941 177.9356 108 T 4.0106 7.0182 107.7550 60.3875 69.9821 175.4090 109 G 3.7367 8.1587 108.5370 45.7420 0.0000 173.4839 110 F 4.7180 7.0575 117.6393 57.1340 39.6921 175.0875 111 T 3.4307 7.6190 115.8962 60.3136 70.3015 173.0278 112 L 4.4779 7.7368 125.5721 52.4372 45.8574 173.9892 113 P 4.4862 0.0000 0.0000 63.0386 32.1681 174.9598 114 V 4.9646 8.4665 125.0113 61.1171 34.3286 174.1356 115 L 5.2358 8.6341 126.1266 52.8781 44.9315 175.6665 116 L 4.4774 8.8806 123.9473 53.6898 42.8373 177.1615 117 D 4.6543 8.3837 122.6290 52.4154 41.5162 176.6081 118 A 4.0732 8.2567 123.4026 55.1477 18.6161 178.6101 119 D 4.5851 7.9759 111.9694 52.9947 40.0066 177.4044 120 K 4.1131 8.3467 119.1589 57.1542 30.9016 177.8822 121 R 3.9024 7.9196 120.0331 59.7652 29.9686 178.5975 122 V 3.7334 7.9986 118.0148 65.5527 31.3169 177.8496 123 G 3.3147 8.0033 105.9338 47.9959 0.0000 175.7916 124 K 3.9774 8.6339 121.7981 58.7317 31.7821 179.2940 125 L 4.0201 7.9801 120.1741 57.5937 42.1064 177.5529 126 Y 3.9745 7.9902 114.3501 56.8667 38.0576 175.7728 127 G 3.9452 7.6236 107.3871 46.3094 0.0000 174.4000 128 T 5.0234 7.2690 108.5842 61.6185 68.9607 174.0605 129 T 4.4222 8.6533 118.5800 62.8978 70.2833 174.1362 130 G 4.0389 7.0598 108.3995 45.8034 0.0000 172.1433 131 V 4.5777 8.1720 111.7511 58.6344 34.9153 174.1025 132 P 5.5143 0.0000 0.0000 62.0719 33.4811 174.5452 133 E 5.1353 8.8155 121.0293 55.1874 33.0791 173.8028 134 T 5.2481 9.6518 124.2150 61.8310 72.1353 172.9111 135 F 5.2195 9.7262 124.6533 55.7691 41.8510 174.4719 136 V 4.8327 8.9404 124.1175 61.3803 33.6171 174.3622 137 I 5.1635 8.9368 128.8716 59.5098 40.3624 175.4228 138 D 5.0018 8.9765 126.9484 52.2574 41.1170 177.4268 139 R 4.0014 8.5862 116.2684 58.6251 29.9877 178.0043 140 H 4.6561 8.2554 112.7262 55.5931 29.0591 176.0922 141 G 3.9076 8.5794 108.9888 45.3924 0.0000 173.3857 142 V 4.3609 7.5646 119.1569 61.0706 32.7550 175.2900 143 I 4.3058 8.3113 127.1349 61.8107 37.5612 175.5577 144 L 4.4840 9.3539 128.5752 57.1484 43.1221 176.9390 145 K 4.5125 7.8859 117.4195 55.2480 35.7297 173.8104 146 K 4.5248 8.7489 128.6385 54.5095 34.1824 174.9479 147 V 4.3289 9.0540 128.2441 61.1687 33.6968 174.2729 148 V 4.3537 8.5191 128.0985 62.6021 32.8792 176.5672 149 G 3.9687 8.8127 112.7067 44.9739 0.0000 172.6899 150 A 5.1351 7.9204 121.2630 51.1559 19.2084 177.2630 *152 E 3.9323 8.3721 117.3514 56.1056 29.4561 177.2377 153 W 4.3809 9.0257 125.1467 58.2435 29.2976 177.3602 154 D 4.6945 7.9814 117.1041 53.8115 39.9631 176.0954 155 H 4.4262 7.7594 117.6800 55.1654 29.5919 174.3442 156 P 4.2392 0.0000 0.0000 66.1426 31.1105 178.5057 157 E 3.9916 8.2800 116.5269 59.4890 29.3870 179.5365 158 V 3.6510 7.9279 117.8881 66.1651 31.6647 177.7512 159 I 3.6751 8.0043 118.9199 64.7435 36.9058 177.9898 160 A 4.0016 8.1893 121.1256 54.9563 18.2242 179.3536 161 F 4.2664 8.2905 119.1985 61.5011 39.4794 177.3691 162 L 3.7412 8.0632 118.3604 57.9542 41.2676 179.1212 163 N 4.2510 7.9809 114.9472 56.3452 38.7837 176.4971 164 N 4.3924 8.2721 118.3043 56.9540 38.8499 176.8444 165 E 3.9359 7.7221 118.1305 59.0184 29.7472 179.0312 166 L 4.1464 7.7813 119.8142 57.5451 41.4385 179.4378 167 S 4.4026 7.6069 112.8956 60.0843 63.6517 175.0414 168 K 4.0474 7.4110 121.1714 56.0905 30.2616 176.7776 169 A 4.1260 8.3448 125.0856 52.4307 18.6586 176.8329 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 29 E 8.44 4.29 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 2.20 2.33 0.00 30 N 8.59 4.36 0.00 2.77 2.76 0.00 0.00 7.14 6.80 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 31 P 0.00 4.83 0.00 2.09 2.03 0.00 3.57 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 1.94 2.08 0.00 32 A 8.96 4.12 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 33 P 0.00 4.22 0.00 1.63 1.86 0.00 3.00 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.81 0.00 34 D 8.72 4.56 0.00 2.60 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 35 F 7.47 5.04 0.00 3.18 3.19 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 36 T 8.53 5.56 4.29 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 1.24 0.00 0.00 37 L 8.58 5.00 0.00 1.65 1.62 0.65 0.78 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 38 N 8.75 5.04 0.00 2.73 2.75 0.00 0.00 6.72 7.05 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 39 T 8.37 5.06 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 1.23 0.00 0.00 40 L 8.68 4.17 0.00 1.73 1.85 1.11 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.04 4.70 0.00 2.85 2.93 0.00 0.00 6.00 7.00 0.00 0.00 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 G 8.30 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 0.00 0.00 0.00 43 E 7.56 4.68 0.00 2.10 2.11 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 2.22 2.28 0.00 44 V 8.16 4.95 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 0.73 0.00 0.00 0.94 0.00 0.00 45 V 8.76 4.42 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 0.91 0.00 0.00 0.93 0.00 0.00 46 K 8.33 4.76 0.00 1.79 1.56 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.27 7.81 47 L 8.14 3.67 0.00 0.74 1.09 0.82 0.76 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 48 S 7.77 4.07 0.00 3.97 4.13 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 0.00 0.00 0.00 49 D 7.71 4.58 0.00 2.80 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 50 L 7.84 4.57 0.00 1.71 1.57 0.82 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 51 K 7.26 4.07 0.00 1.77 1.75 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.38 1.38 7.81 52 G 9.50 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 53 Q 7.75 4.87 0.00 2.16 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 54 V 8.21 4.26 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 0.98 0.00 0.00 1.06 0.00 0.00 55 V 8.76 4.65 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 0.89 0.00 0.00 0.82 0.00 0.00 56 I 7.96 4.81 1.66 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 1.18 1.14 0.59 0.00 0.00 57 V 8.76 4.18 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 0.32 0.00 0.00 0.98 0.00 0.00 58 N 8.71 5.22 0.00 2.57 2.42 0.00 0.00 6.76 8.55 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 59 F 9.24 5.18 0.00 3.32 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 60 W 8.66 5.41 0.00 3.34 3.03 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 61 A 7.99 3.87 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.35 3.11 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 1.21 0.00 0.00 63 W 6.89 4.58 0.00 3.51 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 64 C 7.51 4.89 0.00 2.72 2.61 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 65 P 0.00 4.32 0.00 2.28 2.19 0.00 3.79 0.00 0.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.31 0.00 66 P 0.00 4.35 0.00 2.21 2.14 0.00 3.63 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 67 C 8.31 4.31 0.00 3.26 3.32 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 68 R 7.96 4.05 0.00 2.14 2.34 0.00 3.71 0.00 0.00 3.62 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.75 0.00 69 E 7.95 4.26 0.00 2.14 2.27 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 2.34 2.50 0.00 70 E 8.10 4.33 0.00 2.46 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 2.60 2.39 0.00 71 I 6.83 3.54 1.33 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.47 0.27 0.00 0.00 72 P 0.00 4.14 0.00 1.97 2.04 0.00 3.65 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.70 0.00 73 S 7.30 4.78 0.00 4.23 4.18 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 *76 R 7.92 4.22 0.00 2.06 2.05 0.00 3.12 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 1.59 1.83 0.00 77 L 8.11 3.87 0.00 1.84 1.67 0.84 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.16 4.22 0.00 2.72 2.83 0.00 0.00 6.92 7.96 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 79 A 7.22 4.11 1.26 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 0.00 0.00 80 A 7.59 4.09 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 *82 A 7.60 3.93 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 83 G 9.21 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 0.00 0.00 0.00 0.00 84 K 7.39 4.66 0.00 1.74 1.73 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.36 7.81 85 P 0.00 4.75 0.00 2.12 2.23 0.00 3.66 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 86 F 7.93 5.32 0.00 2.92 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 87 R 7.81 4.42 0.00 1.50 1.61 0.00 3.31 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.62 0.00 *89 L 8.28 4.14 0.00 1.52 1.61 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 90 C 8.76 4.76 0.00 2.98 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 91 V 8.44 4.15 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 0.70 0.00 0.00 0.29 0.00 0.00 92 S 8.86 4.13 0.00 2.86 3.42 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 93 I 7.56 4.16 1.81 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.57 0.97 0.00 0.00 94 D 7.50 4.33 0.00 2.38 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.08 3.79 0.00 1.91 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 2.29 2.42 0.00 96 G 8.05 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 97 G 8.05 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 98 K 8.78 3.76 0.00 1.83 1.82 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.52 1.52 7.81 99 V 7.92 3.55 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 1.00 0.00 0.00 0.93 0.00 0.00 100 A 7.88 3.98 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.62 3.42 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 0.59 0.00 0.00 0.71 0.00 0.00 102 E 8.50 3.99 0.00 2.18 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 2.56 2.54 0.00 103 E 8.21 3.98 0.00 2.35 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 0.00 2.38 2.53 0.00 104 F 8.33 4.23 0.00 3.22 3.24 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 0.00 105 F 8.59 4.64 0.00 3.25 3.07 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 0.00 0.00 0.00 106 R 8.29 3.90 0.00 1.78 2.23 0.00 3.29 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 107 K 7.52 4.21 0.00 1.69 1.77 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.62 7.81 108 T 7.02 4.01 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 0.57 0.00 0.00 109 G 8.16 3.74 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 0.00 0.00 0.00 110 F 7.06 4.72 0.00 2.85 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 0.00 111 T 7.62 3.43 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 1.08 0.00 0.00 112 L 7.74 4.48 0.00 1.74 1.43 0.46 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.49 0.00 2.09 2.22 0.00 3.59 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 2.02 1.94 0.00 114 V 8.47 4.96 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 1.21 0.00 0.00 1.31 0.00 0.00 115 L 8.63 5.24 0.00 1.53 1.49 1.06 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.88 4.48 0.00 1.47 1.56 0.87 0.94 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 0.00 117 D 8.38 4.65 0.00 2.64 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 0.00 118 A 8.26 4.07 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.98 4.59 0.00 2.79 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 0.00 120 K 8.35 4.11 0.00 2.00 2.03 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.32 1.50 7.81 121 R 7.92 3.90 0.00 2.06 1.94 0.00 3.11 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 122 V 8.00 3.73 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 0.66 0.00 0.00 0.84 0.00 0.00 123 G 8.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 8.63 3.98 0.00 1.89 1.85 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.48 7.81 125 L 7.98 4.02 0.00 1.84 2.00 0.91 1.33 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 0.00 126 Y 7.99 3.97 0.00 2.62 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 0.00 127 G 7.62 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 0.00 128 T 7.27 5.02 4.17 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 0.00 0.00 0.93 0.00 0.00 129 T 8.65 4.42 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 0.00 130 G 7.06 4.04 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 0.00 0.00 0.00 131 V 8.17 4.58 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 0.86 0.00 0.00 0.79 0.00 0.00 132 P 0.00 5.51 0.00 2.31 2.29 0.00 3.88 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.90 0.00 133 E 8.82 5.14 0.00 2.32 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 2.35 2.39 0.00 134 T 9.65 5.25 4.52 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 135 F 9.73 5.22 0.00 3.04 3.15 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 0.00 0.00 0.00 136 V 8.94 4.83 2.36 0.00 0.00 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 0.00 0.00 1.21 0.00 0.00 137 I 8.94 5.16 2.02 0.00 0.00 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 1.46 0.85 1.00 0.00 0.00 138 D 8.98 5.00 0.00 2.77 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 0.00 139 R 8.59 4.00 0.00 1.75 1.96 0.00 3.49 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.60 0.00 140 H 8.26 4.66 0.00 3.27 3.32 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.58 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 0.00 0.00 0.00 142 V 7.56 4.36 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 1.17 0.00 0.00 1.04 0.00 0.00 143 I 8.31 4.31 2.04 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 1.65 0.83 1.21 0.00 0.00 144 L 9.35 4.48 0.00 1.73 2.02 1.05 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.89 4.51 0.00 1.94 1.75 0.00 1.36 0.00 0.00 1.61 0.00 0.00 2.67 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.41 1.36 7.81 146 K 8.75 4.52 0.00 1.61 1.57 0.00 1.82 0.00 0.00 1.61 0.00 0.00 2.66 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.07 0.52 7.81 147 V 9.05 4.33 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 0.82 0.00 0.00 1.04 0.00 0.00 148 V 8.52 4.35 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 0.86 0.00 0.00 0.91 0.00 0.00 149 G 8.81 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 150 A 7.92 5.14 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 *152 E 8.37 3.93 0.00 1.57 1.78 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 2.14 2.16 0.00 153 W 9.03 4.38 0.00 3.22 3.26 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 0.00 154 D 7.98 4.69 0.00 2.88 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 0.00 155 H 7.76 4.43 0.00 3.19 3.22 0.00 5.67 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 P 0.00 4.24 0.00 2.13 2.13 0.00 3.55 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 2.08 2.19 0.00 157 E 8.28 3.99 0.00 2.09 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 0.00 2.40 1.95 0.00 158 V 7.93 3.65 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 1.38 0.00 0.00 0.92 0.00 0.00 159 I 8.00 3.68 2.04 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.68 0.89 0.00 0.00 160 A 8.19 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 F 8.29 4.27 0.00 3.13 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 0.00 162 L 8.06 3.74 0.00 1.87 1.64 0.97 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 163 N 7.98 4.25 0.00 2.67 2.87 0.00 0.00 7.06 7.51 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 0.00 164 N 8.27 4.39 0.00 2.92 2.86 0.00 0.00 7.22 7.17 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 0.00 165 E 7.72 3.94 0.00 1.87 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 1.73 1.86 0.00 166 L 7.78 4.15 0.00 1.75 1.69 0.99 0.83 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 0.00 167 S 7.61 4.40 0.00 4.02 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 0.00 168 K 7.41 4.05 0.00 1.87 1.82 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.51 7.81 169 A 8.34 4.13 1.26 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 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.