NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 K 4.3143 8.2729 122.1404 54.3038 34.5304 178.2222 16 Q 4.1531 8.0304 118.9699 60.1928 28.0054 182.7863 17 I 3.9921 7.9465 121.9254 66.0870 36.1118 181.3858 18 Q 4.2500 8.3445 124.9876 60.9398 27.7262 181.8840 19 E 4.2332 8.0510 120.9431 61.8611 29.8280 181.2862 20 M 4.2086 7.8542 124.0492 60.9249 31.3290 180.7908 21 K 4.3002 8.5291 127.5407 59.7270 31.7686 181.0681 22 E 4.2405 8.3987 118.6329 61.5165 29.6240 181.4987 23 A 4.2463 8.7095 123.3627 55.6219 18.5772 180.0674 *24 F 3.9748 9.1442 121.4008 62.8660 37.7483 181.0667 25 S 4.3538 8.3363 120.0036 64.5278 62.2992 180.0173 26 M 4.4969 7.7897 124.9748 59.8653 31.0954 181.0915 27 I 4.3126 8.0335 122.2594 65.2111 37.0946 181.7994 28 D 5.0142 8.2115 126.8827 54.9942 36.3044 178.6489 29 V 3.9271 7.9202 125.8501 64.5748 32.6549 181.3718 30 D 4.5647 8.4614 119.1783 55.6306 38.9256 180.4265 31 R 4.0316 8.7659 119.7386 59.2653 26.6647 179.8057 32 D 4.7707 7.9628 119.5770 53.2658 39.9920 179.8998 33 G 4.3824 8.5157 108.0758 47.7021 0.0000 174.3192 *34 F 5.2865 7.6129 119.6173 55.2561 42.4653 178.6211 35 V 4.4379 8.5391 121.1392 60.8502 33.5705 176.9184 36 S 4.8536 8.6126 125.8475 55.9422 66.1957 172.1670 37 K 3.8131 9.0141 126.5994 61.8053 31.0957 180.5350 38 E 4.4004 8.2766 120.1122 61.1894 29.8484 182.1520 39 D 4.6075 8.7907 123.5199 59.5352 39.9397 182.9655 40 I 3.9554 7.8671 123.9445 65.3486 35.5148 180.3506 41 K 4.0568 8.0315 124.8664 60.5908 31.4131 180.0317 42 A 4.1217 8.4759 123.0598 56.7681 17.8065 180.0854 43 I 3.7344 7.9647 121.5152 65.5782 36.1847 180.8679 44 S 4.4666 8.3979 122.3021 64.3667 61.8132 179.2791 45 E 4.2883 8.1386 123.5751 61.9129 29.5813 181.9284 46 Q 4.5070 7.8333 121.5207 59.6144 28.2148 179.1813 47 L 4.7086 8.7932 115.6429 54.0030 44.2286 183.3772 48 G 4.2188 8.0938 109.6037 43.5106 0.0000 173.1301 49 R 3.8927 8.3786 116.6400 56.6112 29.6006 173.4999 50 A 4.8185 8.2189 124.4484 49.8381 21.7898 175.4658 51 P 4.4549 0.0000 0.0000 62.4896 31.6494 177.6358 52 D 4.7315 8.5444 120.1284 53.5004 41.0804 178.9373 53 D 4.5880 8.9554 123.6158 60.3236 39.6710 181.0550 54 K 4.1716 8.3084 127.1775 60.2625 31.6875 181.3657 55 E 4.2251 8.4809 121.8120 61.7309 29.2210 182.0318 56 L 4.3225 8.0138 125.8167 60.4163 40.9503 181.2344 57 T 4.1258 8.7184 115.5013 66.0080 68.1473 178.3953 58 A 4.3275 8.4513 125.6173 55.2967 18.2995 180.1544 59 M 4.1284 7.8887 120.6106 59.5562 31.5991 183.8805 60 L 4.6562 7.5649 122.7251 59.3818 41.6701 183.5483 61 K 3.9068 8.1430 125.7973 59.6187 31.6936 180.5341 62 E 4.6509 7.5791 115.1559 59.0654 29.8248 181.8801 63 A 4.7007 8.1854 123.6908 51.9266 20.0586 175.5788 64 P 4.0866 0.0000 0.0000 65.1167 31.5334 173.6099 65 G 4.2789 7.2431 108.0334 43.2496 0.0000 170.1515 66 P 4.0617 0.0000 0.0000 60.9945 32.3499 173.8365 67 L 4.4399 8.3305 124.8589 53.5205 39.6748 176.6721 68 N 5.0981 7.9208 125.5070 51.5853 38.9253 177.4345 *69 F 4.2799 8.6450 114.9975 60.5463 38.1621 176.4360 70 T 4.3248 7.9405 118.8823 67.3564 68.8737 182.6585 71 M 4.4869 8.0381 124.8094 59.9826 31.3670 180.2927 *72 F 4.4995 8.2370 122.3845 62.2571 38.2509 183.0307 73 L 4.3274 8.1865 123.9722 60.0869 40.8409 182.7999 74 S 4.3614 8.2276 119.7226 64.6488 62.1461 181.9212 75 I 4.0805 7.5785 124.8499 65.2945 35.5028 180.7510 *76 F 4.4810 8.2481 124.0964 62.7608 37.6479 181.5184 77 S 4.5131 8.0648 120.9260 63.5118 62.2078 178.0089 78 D 4.9037 8.0716 123.4712 57.2740 39.8158 181.3954 79 K 4.5992 7.9042 126.3656 60.2625 31.9359 184.4117 80 L 4.4245 7.7041 117.6764 55.5425 40.6601 179.4415 81 S 4.7967 8.1502 116.3248 58.6746 63.9975 178.6853 82 G 4.1757 9.7631 116.1630 45.9616 0.0000 173.7738 83 T 4.7268 7.6020 110.9105 59.6333 73.2347 176.3985 84 D 4.9868 8.4081 122.5978 54.1158 41.8350 178.1877 85 S 4.8442 8.3801 117.7828 61.6599 65.3470 171.5336 86 E 4.4621 8.6533 121.1507 61.7926 29.4704 179.3956 87 E 4.4091 8.1052 118.7422 62.1705 30.2292 184.4635 88 T 4.1734 7.8991 117.6686 66.2829 68.3457 178.8402 89 I 4.1572 7.9358 124.4927 65.5349 35.9324 181.8653 90 R 4.2577 7.9701 124.6595 61.2593 29.1854 180.8981 91 N 4.6754 7.8992 117.2831 57.4078 37.9355 182.2921 92 A 4.3688 7.7094 124.4245 54.8004 18.5211 179.8990 *93 F 4.3083 7.7205 119.1132 61.3142 38.7439 183.1852 94 A 4.4266 7.8656 122.3802 54.3352 17.9338 179.1073 95 M 4.4946 7.8473 120.0368 58.1000 31.6409 182.6129 *96 F 4.9195 8.3248 116.9811 57.7693 40.7730 181.2108 97 D 4.9991 7.6898 122.6245 55.5742 39.3688 182.6852 98 E 3.9968 7.7282 121.2462 60.4256 30.6728 181.5483 99 Q 4.0326 8.0920 120.2223 56.2240 28.9557 178.5798 100 E 3.8185 8.7488 114.9984 58.7715 26.7647 180.7564 101 T 4.3379 7.7294 113.1276 60.4470 70.9514 176.7181 102 K 3.8548 8.3584 121.4875 55.8695 28.3629 181.6889 103 K 4.5008 7.1981 122.1200 55.5896 35.6339 177.8941 104 L 4.8995 8.1599 126.3486 53.4065 45.1049 176.2868 105 N 4.7487 8.9489 124.0155 53.2388 38.3904 176.0369 106 I 3.7002 8.8539 129.3232 65.1751 35.6090 175.0185 107 E 4.3131 8.3302 122.2628 61.9364 29.5085 180.5507 *108 Y 4.2424 8.3846 124.2048 62.3099 36.9086 181.4202 109 I 3.9635 7.8304 123.0028 65.8508 35.6868 180.7993 110 K 4.1658 8.0864 127.9793 60.5187 31.5179 181.3154 111 D 4.6340 8.1587 124.5599 58.9322 39.6036 180.8170 112 L 4.2466 8.3217 126.9787 60.0404 40.8986 181.7108 113 L 4.3011 8.2312 125.1469 59.9405 40.6951 181.9053 114 E 4.3386 8.1947 120.6054 60.8888 29.8817 181.4107 115 N 5.3435 8.1462 117.6031 52.1417 39.1550 176.8575 116 M 4.8995 7.7964 117.0358 54.6890 36.8187 176.3312 117 G 3.9675 9.1021 116.5656 46.2351 0.0000 177.2138 118 D 4.7244 8.8128 120.8596 50.9697 38.8383 175.6022 119 N 4.2977 8.1579 123.6173 52.8868 38.5864 175.9100 *120 F 4.6241 8.5576 126.5056 56.4878 40.6907 172.3538 121 N 5.1240 8.5521 114.9619 52.6971 42.0536 172.2507 122 K 3.9183 8.9983 124.0050 61.9600 31.4896 179.2617 123 D 4.6813 8.1449 124.2994 58.9835 39.9289 180.6098 124 E 4.1029 8.3620 122.2567 61.8585 29.7371 181.5028 125 M 4.3687 8.8092 124.2835 60.2407 31.4726 181.6972 126 R 4.2160 8.8307 125.4440 62.1042 29.4875 181.0232 127 M 4.3426 8.7280 123.8689 60.6097 31.1543 180.9687 128 T 4.3277 8.1807 117.9197 66.2834 68.2418 178.6310 *129 F 4.7591 8.0864 123.9008 59.9679 38.1343 180.2021 130 K 4.4770 8.2194 124.5538 60.5472 31.4684 184.2171 131 E 4.5871 7.4561 116.2967 59.6216 31.1524 180.4389 132 A 3.9037 6.9547 121.6935 51.0331 19.8423 177.2811 133 P 4.5179 0.0000 0.0000 61.1102 29.4898 173.5676 134 V 4.3129 7.5688 120.0750 59.7827 32.8139 178.2744 135 E 4.4383 8.7296 122.0155 57.7745 31.4495 170.8581 136 G 4.1924 9.5690 114.8090 44.7911 0.0000 172.3151 137 G 4.0680 8.9339 113.1551 45.1968 0.0000 174.5798 138 K 4.8267 7.8350 125.6322 54.7805 33.7488 180.2035 *139 F 4.4528 9.6750 130.1476 55.4730 38.7212 171.9766 140 D 4.4531 8.5122 128.4744 54.3846 39.6643 175.1122 *141 Y 4.3020 8.6420 128.8329 60.8325 37.4166 175.3723 142 V 4.1031 7.9044 122.5233 66.2438 31.9426 184.0011 143 K 4.1011 8.1606 125.2344 60.8055 31.7267 181.5507 *144 F 4.5054 8.1151 122.8461 62.0275 37.7733 180.9941 145 T 4.2389 8.3098 112.3468 66.2032 68.4987 181.3063 146 A 4.3373 8.1043 125.0080 55.8180 18.3493 179.7373 147 M 3.9465 8.1048 120.4080 60.9105 31.5776 181.6280 148 I 4.2280 7.7894 121.5889 63.4101 36.1214 179.7193 149 K 4.9299 8.8260 120.1253 56.8950 32.3735 181.4990 150 G 3.9598 8.8659 108.9036 47.3254 0.0000 172.7174 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 15 K 8.27 4.31 0.00 1.70 1.89 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.01 7.81 16 Q 8.03 4.15 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.89 0.00 0.00 0.00 0.00 0.00 2.36 2.05 0.00 17 I 7.95 3.99 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 1.50 0.54 0.91 0.00 0.00 18 Q 8.34 4.25 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.04 0.00 19 E 8.05 4.23 0.00 2.03 1.98 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 2.24 2.19 0.00 20 M 7.85 4.21 0.00 2.01 2.15 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 2.55 2.47 0.00 21 K 8.53 4.30 0.00 1.75 1.77 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.33 7.81 22 E 8.40 4.24 0.00 1.91 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 2.26 2.24 0.00 23 A 8.71 4.25 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 *24 F 9.14 3.97 0.00 2.26 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 0.00 0.00 0.00 0.00 25 S 8.34 4.35 0.00 3.66 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 M 7.79 4.50 0.00 2.11 2.02 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 2.55 2.43 0.00 27 I 8.03 4.31 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 1.38 1.10 0.91 0.00 0.00 28 D 8.21 5.01 0.00 2.72 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 29 V 7.92 3.93 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 0.67 0.00 0.00 0.93 0.00 0.00 30 D 8.46 4.56 0.00 2.60 2.67 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 31 R 8.77 4.03 0.00 1.91 2.19 0.00 3.22 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.45 0.00 32 D 7.96 4.77 0.00 2.63 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 33 G 8.52 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 *34 F 7.61 5.29 0.00 1.84 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 0.00 0.00 0.00 35 V 8.54 4.44 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 0.88 0.00 0.00 0.93 0.00 0.00 36 S 8.61 4.85 0.00 3.37 3.71 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 37 K 9.01 3.81 0.00 1.75 1.89 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.11 7.81 38 E 8.28 4.40 0.00 1.97 1.98 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 2.31 1.94 0.00 39 D 8.79 4.61 0.00 2.64 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 40 I 7.87 3.96 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 1.50 0.54 0.91 0.00 0.00 41 K 8.03 4.06 0.00 1.79 1.88 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.36 7.81 42 A 8.48 4.12 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 43 I 7.96 3.73 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 1.38 0.73 0.91 0.00 0.00 44 S 8.40 4.47 0.00 3.73 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 45 E 8.14 4.29 0.00 2.05 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 2.27 2.22 0.00 46 Q 7.83 4.51 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 47 L 8.79 4.71 0.00 1.56 1.34 0.92 0.86 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 48 G 8.09 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.38 3.89 0.00 1.84 1.77 0.00 3.23 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.24 0.00 50 A 8.22 4.82 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.45 0.00 2.10 1.85 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.58 0.00 52 D 8.54 4.73 0.00 2.60 2.57 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 0.00 0.00 0.00 0.00 53 D 8.96 4.59 0.00 2.67 2.75 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 54 K 8.31 4.17 0.00 1.75 1.86 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.45 1.09 7.81 55 E 8.48 4.23 0.00 1.96 1.98 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 2.24 2.19 0.00 56 L 8.01 4.32 0.00 1.64 1.71 0.92 0.76 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 57 T 8.72 4.13 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 58 A 8.45 4.33 1.33 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 0.00 0.00 59 M 7.89 4.13 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.42 0.00 60 L 7.56 4.66 0.00 1.67 1.68 0.92 0.83 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 61 K 8.14 3.91 0.00 1.84 1.78 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.35 7.81 62 E 7.58 4.65 0.00 1.98 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 2.26 2.19 0.00 63 A 8.19 4.70 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 64 P 0.00 4.09 0.00 2.11 1.92 0.00 3.69 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 1.65 0.00 65 G 7.24 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 0.00 0.00 0.00 0.00 66 P 0.00 4.06 0.00 2.11 1.82 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.65 0.00 67 L 8.33 4.44 0.00 1.56 1.60 0.92 0.64 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 68 N 7.92 5.10 0.00 2.64 2.74 0.00 0.00 6.87 8.12 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 *69 F 8.64 4.28 0.00 2.20 2.31 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 70 T 7.94 4.32 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 71 M 8.04 4.49 0.00 2.01 2.11 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 2.61 2.18 0.00 *72 F 8.24 4.50 0.00 2.28 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 0.00 0.00 0.00 0.00 73 L 8.19 4.33 0.00 1.69 1.74 0.92 0.99 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 74 S 8.23 4.36 0.00 3.74 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 75 I 7.58 4.08 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 1.38 1.10 0.91 0.00 0.00 *76 F 8.25 4.48 0.00 2.30 2.32 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 77 S 8.06 4.51 0.00 3.72 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.07 4.90 0.00 2.79 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 79 K 7.90 4.60 0.00 1.76 1.77 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.31 7.81 80 L 7.70 4.42 0.00 1.66 1.58 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.15 4.80 0.00 3.59 3.65 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 0.00 0.00 0.00 82 G 9.76 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 0.00 0.00 0.00 83 T 7.60 4.73 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 84 D 8.41 4.99 0.00 2.68 2.48 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 0.00 0.00 0.00 0.00 85 S 8.38 4.84 0.00 3.72 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 86 E 8.65 4.46 0.00 1.97 1.98 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 2.31 1.94 0.00 87 E 8.11 4.41 0.00 1.96 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 2.27 1.93 0.00 88 T 7.90 4.17 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 89 I 7.94 4.16 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 1.38 0.55 0.91 0.00 0.00 90 R 7.97 4.26 0.00 1.76 1.98 0.00 3.22 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 91 N 7.90 4.68 0.00 2.67 2.84 0.00 0.00 6.72 8.12 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 92 A 7.71 4.37 1.33 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 0.00 0.00 *93 F 7.72 4.31 0.00 2.26 2.29 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 94 A 7.87 4.43 1.33 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 0.00 0.00 95 M 7.85 4.49 0.00 2.17 1.98 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 2.55 2.42 0.00 *96 F 8.32 4.92 0.00 2.22 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 0.00 0.00 0.00 0.00 97 D 7.69 5.00 0.00 2.60 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.73 4.00 0.00 1.99 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 2.24 1.94 0.00 99 Q 8.09 4.03 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.77 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 100 E 8.75 3.82 0.00 2.07 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 2.16 2.11 0.00 101 T 7.73 4.34 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 0.00 102 K 8.36 3.85 0.00 1.94 1.80 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.25 0.99 7.81 103 K 7.20 4.50 0.00 1.47 1.53 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.14 0.87 7.81 104 L 8.16 4.90 0.00 1.32 1.51 0.92 0.51 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 0.00 105 N 8.95 4.75 0.00 2.41 2.74 0.00 0.00 6.91 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 0.00 106 I 8.85 3.70 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 1.38 0.52 0.91 0.00 0.00 107 E 8.33 4.31 0.00 1.97 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 2.31 1.94 0.00 *108 Y 8.38 4.24 0.00 2.29 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 0.00 0.00 0.00 109 I 7.83 3.96 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 1.50 0.53 0.91 0.00 0.00 110 K 8.09 4.17 0.00 1.78 1.87 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.35 7.81 111 D 8.16 4.63 0.00 2.70 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 0.00 112 L 8.32 4.25 0.00 1.62 1.70 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.23 4.30 0.00 1.66 1.71 0.92 0.77 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 0.00 114 E 8.19 4.34 0.00 2.07 1.91 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 2.26 2.21 0.00 115 N 8.15 5.34 0.00 2.72 2.64 0.00 0.00 6.80 7.16 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 0.00 116 M 7.80 4.90 0.00 1.93 1.79 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 2.44 2.34 0.00 117 G 9.10 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 0.00 118 D 8.81 4.72 0.00 2.69 2.48 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 0.00 0.00 0.00 0.00 119 N 8.16 4.30 0.00 2.50 2.66 0.00 0.00 6.87 7.43 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 *120 F 8.56 4.62 0.00 2.07 2.15 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 0.00 121 N 8.55 5.12 0.00 2.35 2.65 0.00 0.00 6.72 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 0.00 122 K 9.00 3.92 0.00 1.75 1.86 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.45 1.09 7.81 123 D 8.14 4.68 0.00 2.68 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 0.00 124 E 8.36 4.10 0.00 1.96 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 1.96 0.00 125 M 8.81 4.37 0.00 1.98 2.10 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 2.42 0.00 126 R 8.83 4.22 0.00 1.76 1.96 0.00 3.25 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 127 M 8.73 4.34 0.00 2.03 2.03 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 2.56 2.44 0.00 128 T 8.18 4.33 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 *129 F 8.09 4.76 0.00 2.32 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 0.00 0.00 0.00 0.00 130 K 8.22 4.48 0.00 1.86 1.76 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.33 7.81 131 E 7.46 4.59 0.00 2.22 1.87 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 2.18 2.17 0.00 132 A 6.95 3.90 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 0.00 133 P 0.00 4.52 0.00 2.01 1.97 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.57 0.00 134 V 7.57 4.31 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 0.88 0.00 0.00 0.93 0.00 0.00 135 E 8.73 4.44 0.00 1.95 1.74 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 2.16 2.12 0.00 136 G 9.57 4.19 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 0.00 137 G 8.93 4.07 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 0.00 0.00 0.00 138 K 7.83 4.83 0.00 1.46 1.70 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.40 1.00 7.81 *139 F 9.68 4.45 0.00 1.91 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 0.00 0.00 0.00 0.00 140 D 8.51 4.45 0.00 2.44 2.65 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 0.00 0.00 0.00 *141 Y 8.64 4.30 0.00 2.41 2.23 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 0.00 142 V 7.90 4.10 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 0.75 0.00 0.00 0.93 0.00 0.00 143 K 8.16 4.10 0.00 1.75 1.89 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.11 7.81 *144 F 8.12 4.51 0.00 2.23 2.32 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 0.00 145 T 8.31 4.24 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 0.00 146 A 8.10 4.34 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 0.00 147 M 8.10 3.95 0.00 2.14 2.04 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 2.57 2.47 0.00 148 I 7.79 4.23 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 1.38 1.10 0.91 0.00 0.00 149 K 8.83 4.93 0.00 1.78 0.90 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.29 1.29 7.81 150 G 8.87 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 * Residues marked with a * may have inaccurate shift predictions.