NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3563 0.0000 0.0000 62.5538 32.6263 175.0425 3 R 4.2798 8.3378 118.4279 54.1385 32.0299 174.2285 4 A 4.5893 8.1563 130.1547 49.7905 19.0322 175.2752 5 K 4.1412 8.1193 119.8262 56.7399 33.6081 178.5126 6 T 3.8564 8.3697 118.1558 66.5791 69.2453 175.8848 7 G 3.7052 8.0172 111.2736 46.1018 0.0000 175.9873 8 V 3.6639 8.5126 119.4433 65.1380 30.8930 178.6253 9 V 3.6262 7.4363 117.4026 65.7675 31.3251 178.0909 10 R 3.7969 7.8903 117.8697 59.4374 30.1562 177.8569 11 R 3.9333 8.1498 118.1099 59.9245 29.7446 178.1830 12 R 3.8610 7.6310 116.0157 59.2218 30.2108 178.8831 13 K 3.8415 8.0153 118.1213 60.1663 32.0846 178.9231 14 H 4.1971 8.2889 116.2083 58.7938 28.6918 177.6336 15 K 3.8824 8.5311 120.9846 60.3678 31.7758 178.6346 16 K 3.9551 8.1182 118.5872 59.4970 32.3581 178.9775 17 I 3.8587 7.7197 119.4676 64.3228 37.0923 178.3244 18 L 3.9557 8.3221 120.2599 57.9634 41.6091 179.4905 19 K 3.8070 8.6956 118.6808 59.9088 31.8751 179.0809 20 L 4.0981 7.7668 116.5100 56.5022 41.9061 178.1957 21 A 4.1030 8.0850 120.0127 50.4233 19.2699 176.8728 22 K 3.8484 6.8035 117.5980 58.0612 32.4330 177.2200 23 G 3.9718 8.8066 111.9900 45.5116 0.0000 173.3470 24 Y 4.7232 7.2329 116.7094 57.2647 38.6935 175.3712 25 W 4.2138 9.0511 131.9051 58.7822 32.6620 176.2449 26 G 4.2119 7.7718 113.9504 45.9518 0.0000 176.5493 27 L 3.9571 8.8479 126.1703 57.5874 41.4629 178.7497 28 R 4.2254 8.7308 117.2251 57.8375 29.9878 177.5631 29 S 4.9112 8.4105 110.7520 57.5241 64.0033 174.4723 30 K 4.3723 8.0012 118.4515 55.9284 34.0956 175.6232 31 S 4.4990 8.0708 116.7392 58.0657 62.5167 176.3309 *32 F 3.3008 7.5383 127.0640 58.6311 39.2045 173.9838 33 R 4.6039 9.2469 113.4674 56.5391 32.3442 177.5535 34 K 3.8581 9.3627 119.2779 59.3020 31.9729 178.4943 35 A 4.4156 8.0744 121.6714 54.8328 18.2053 179.1109 36 R 3.5304 7.9331 115.7776 59.7808 29.8950 178.3789 37 E 3.6997 7.7958 117.7060 59.6925 29.5291 179.2257 38 T 3.7371 7.9317 115.9016 66.8123 68.3581 176.5738 39 L 4.1146 8.1151 121.0987 57.4736 41.5660 179.5577 40 F 4.4347 7.5784 117.1553 60.6295 38.8775 177.1467 41 A 3.6534 7.7985 119.7805 55.2781 18.0737 179.3363 42 A 4.1458 8.0819 118.9323 55.5376 18.5406 179.8544 43 G 3.9924 8.4497 104.2626 48.2822 0.0000 175.5551 44 N 4.3212 8.2824 119.3733 55.9609 38.6927 176.9318 45 Y 4.4436 7.6691 118.3472 61.4265 37.9274 178.7049 46 A 4.0390 8.6252 121.4799 55.6653 18.6235 178.5128 47 Y 3.9911 8.2528 116.9811 61.0847 38.7957 178.2160 48 A 4.1966 9.2789 122.3416 55.9650 18.2582 179.1196 49 H 4.5588 8.7529 114.0654 58.3030 28.9080 178.0348 50 R 3.6043 8.6352 119.7987 58.8966 30.0162 178.8423 51 K 4.0756 8.0019 118.2606 59.4263 32.3022 179.7538 52 R 3.7742 8.3785 118.5972 59.2558 30.0506 178.7682 53 R 3.8096 9.0677 119.6167 59.2638 30.1799 178.5775 54 K 4.0114 8.0377 118.2737 59.6869 32.0241 179.5458 55 R 3.9049 7.8689 117.7046 59.0376 29.9889 178.1619 56 D 4.1039 8.3142 118.1998 57.5536 41.0459 178.6486 57 F 3.5370 7.7248 117.8484 60.8979 38.3744 177.0485 58 R 3.9604 7.6447 114.4968 59.8425 29.7957 178.5166 59 R 3.8950 8.4379 117.3978 59.8919 30.3496 178.6100 60 L 3.8446 7.6438 116.9789 57.1875 42.0900 179.3850 61 W 4.4441 9.4691 115.3984 60.6126 28.5884 180.6673 62 I 3.2181 6.1130 122.3494 62.8990 37.7373 176.3064 63 V 3.8415 7.9942 117.6905 67.1977 31.4710 177.9163 64 R 3.8294 8.7543 116.6769 59.5012 29.7930 178.5579 65 I 3.6745 7.8414 118.3271 65.5967 37.4432 176.9917 66 N 4.3525 9.6858 117.5954 56.7631 38.3763 176.3205 67 A 3.9340 8.4060 123.2557 55.6765 18.9536 179.2155 68 A 3.8088 8.3046 119.8321 55.1466 18.3835 179.5058 69 C 4.1378 8.8560 112.5958 61.2360 29.3456 175.3644 70 R 4.8710 8.4121 120.0355 56.6095 29.5968 177.0347 71 Q 4.2313 8.4767 118.6824 57.7996 29.3237 175.4304 72 H 4.9508 8.0954 117.0505 56.4201 29.4159 175.2143 73 G 3.9247 8.1961 103.7529 45.5202 0.0000 171.4241 74 L 4.2333 7.5056 119.5248 53.0533 45.0715 173.6653 75 N 4.6680 8.7748 124.1424 53.7369 39.8666 174.8331 76 Y 4.3575 8.8604 125.9780 61.1787 38.8512 178.5904 77 S 4.7121 8.6506 114.5643 62.3155 62.8356 176.6615 78 T 3.9349 7.9443 113.6869 63.6583 68.3771 175.8956 79 F 4.0700 9.0636 123.5878 61.1833 39.6920 176.7476 80 I 3.3452 8.2730 120.3189 64.6891 36.9442 177.8669 81 H 4.1206 8.1631 118.9114 59.0336 29.5697 176.5655 82 G 3.7334 7.8835 106.8642 44.6494 0.0000 174.9983 83 L 3.9282 7.8350 121.6403 56.5736 42.2589 178.1188 84 K 3.7221 7.7988 117.4294 60.0154 32.0340 178.0512 85 K 3.9978 7.7103 117.0518 59.3325 32.0789 179.0878 86 A 4.0807 7.6239 119.5805 53.2429 18.2153 178.1691 87 G 3.7649 8.0054 105.2665 46.0849 0.0000 175.0628 88 I 4.0088 7.2547 113.6126 59.0937 36.5121 176.7071 89 E 4.3403 7.7347 129.9961 56.9450 29.5479 175.3610 90 V 4.0330 6.9891 126.4611 62.3384 32.1308 179.0094 91 D 3.5469 9.0624 110.9758 50.4134 43.5483 170.2251 92 R 3.8211 7.3173 125.9866 56.2683 32.3047 177.4347 93 K 4.4957 8.6220 124.6278 59.7585 32.5577 177.8295 94 N 2.0000 7.5571 115.5530 55.2887 38.4051 175.0744 95 L 4.2743 8.6025 114.6383 54.5542 41.9426 176.2636 96 A 4.9265 7.7273 122.0501 51.6533 19.1019 179.8708 97 D 4.5347 7.9263 122.0551 56.7707 40.5425 178.1969 98 L 3.6730 8.4650 121.3040 57.1697 41.1757 178.7711 99 A 3.1705 7.3022 118.4269 55.0692 18.1278 179.3187 100 V 3.6997 8.2805 116.4338 64.5841 32.0526 176.4001 101 R 4.0612 7.5232 117.9451 57.1817 31.3972 176.0646 102 E 3.9641 8.6280 113.6119 56.9670 27.9668 173.7402 103 P 4.8031 0.0000 0.0000 64.8735 32.0130 178.4855 104 Q 3.9529 7.9813 118.5574 59.3154 28.8359 178.3373 105 V 3.9006 7.4540 117.9438 65.7890 31.2744 177.8983 106 F 4.0440 8.2103 119.9101 60.9261 39.4097 176.8659 107 A 4.0856 8.5441 120.7866 55.3902 18.4442 179.2977 108 E 4.1094 8.7338 117.7808 59.0763 29.4385 179.0005 109 L 4.0025 7.3373 118.8016 57.5504 41.7360 179.3273 110 V 3.8752 7.9432 118.6165 66.0297 31.4825 177.9911 111 E 4.0216 8.6844 118.9023 59.4730 29.3831 179.5474 112 R 4.1465 7.9824 117.3876 58.8027 30.0441 179.0067 113 A 4.6316 7.5284 122.0724 54.4683 18.4148 179.5833 114 K 3.9892 8.6490 117.3254 59.3860 32.3416 179.3359 115 A 3.9381 8.6245 120.9306 55.1598 18.3151 178.3689 116 A 4.6165 7.6443 117.5596 52.0397 19.5568 178.2164 117 Q 4.5227 8.0870 118.1023 57.7164 35.3542 175.4343 118 G 3.7503 7.8139 112.0602 45.7541 0.0000 173.3925 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 2 P 0.00 4.36 0.00 2.17 2.14 0.00 3.41 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 1.88 2.08 0.00 3 R 8.34 4.28 0.00 1.82 1.82 0.00 3.21 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.69 0.00 4 A 8.16 4.59 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 5 K 8.12 4.14 0.00 1.88 1.83 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.47 7.81 6 T 8.37 3.86 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 1.22 0.00 0.00 7 G 8.02 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 0.00 0.00 0.00 8 V 8.51 3.66 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 0.85 0.00 0.00 0.93 0.00 0.00 9 V 7.44 3.63 2.20 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 0.98 0.00 0.00 0.93 0.00 0.00 10 R 7.89 3.80 0.00 1.93 1.93 0.00 3.34 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 11 R 8.15 3.93 0.00 1.93 2.11 0.00 3.24 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 12 R 7.63 3.86 0.00 2.13 1.95 0.00 3.22 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 13 K 8.02 3.84 0.00 1.83 1.83 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.49 7.81 14 H 8.29 4.20 0.00 3.40 3.34 0.00 5.67 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.53 3.88 0.00 1.92 2.12 0.00 1.32 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.63 7.81 16 K 8.12 3.96 0.00 1.95 1.92 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.49 7.81 17 I 7.72 3.86 1.89 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 0.95 0.89 0.00 0.00 18 L 8.32 3.96 0.00 1.85 1.72 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.70 3.81 0.00 2.00 1.87 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.60 7.81 20 L 7.77 4.10 0.00 1.86 1.74 0.94 0.88 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 21 A 8.08 4.10 1.47 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 22 K 6.80 3.85 0.00 1.74 1.69 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.49 7.81 23 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 24 Y 7.23 4.72 0.00 3.10 2.87 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 25 W 9.05 4.21 0.00 3.54 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 26 G 7.77 4.21 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 0.00 0.00 0.00 27 L 8.85 3.96 0.00 1.76 1.79 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.73 4.23 0.00 2.20 2.06 0.00 3.11 0.00 0.00 3.11 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 29 S 8.41 4.91 0.00 3.89 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 30 K 8.00 4.37 0.00 1.72 1.83 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.77 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.28 7.81 31 S 8.07 4.50 0.00 3.82 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 *32 F 7.54 3.30 0.00 2.37 2.18 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 33 R 9.25 4.60 0.00 1.78 2.13 0.00 2.77 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 34 K 9.36 3.86 0.00 1.82 1.93 0.00 1.73 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.63 7.81 35 A 8.07 4.42 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 36 R 7.93 3.53 0.00 1.78 1.85 0.00 3.20 0.00 0.00 3.63 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.63 0.00 37 E 7.80 3.70 0.00 2.13 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 2.33 2.59 0.00 38 T 7.93 3.74 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 0.24 0.00 0.00 39 L 8.12 4.11 0.00 1.69 1.65 0.99 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.58 4.43 0.00 3.19 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 41 A 7.80 3.65 1.27 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 0.00 0.00 42 A 8.08 4.15 1.52 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 0.00 0.00 43 G 8.45 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 44 N 8.28 4.32 0.00 2.54 2.75 0.00 0.00 7.10 7.09 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 45 Y 7.67 4.44 0.00 3.13 2.81 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 46 A 8.63 4.04 1.50 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 0.00 0.00 47 Y 8.25 3.99 0.00 3.16 3.13 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 48 A 9.28 4.20 1.52 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 0.00 0.00 49 H 8.75 4.56 0.00 3.30 3.34 0.00 5.63 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.64 3.60 0.00 1.89 1.88 0.00 3.11 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 51 K 8.00 4.08 0.00 2.03 1.81 0.00 1.68 0.00 0.00 1.48 0.00 0.00 2.71 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.28 1.57 7.81 52 R 8.38 3.77 0.00 1.84 1.88 0.00 3.19 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 53 R 9.07 3.81 0.00 1.80 1.95 0.00 3.36 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 54 K 8.04 4.01 0.00 2.06 1.90 0.00 1.79 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.59 7.81 55 R 7.87 3.90 0.00 1.79 1.95 0.00 3.14 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.68 0.00 56 D 8.31 4.10 0.00 2.59 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 0.00 0.00 0.00 57 F 7.72 3.54 0.00 2.59 1.45 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 58 R 7.64 3.96 0.00 2.14 1.96 0.00 3.20 0.00 0.00 3.23 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.97 0.00 59 R 8.44 3.90 0.00 1.86 1.92 0.00 3.06 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.82 0.00 60 L 7.64 3.84 0.00 1.45 1.67 0.62 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 61 W 9.47 4.44 0.00 3.78 3.17 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 0.00 62 I 6.11 3.22 1.81 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.74 0.40 0.00 0.00 63 V 7.99 3.84 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 1.09 0.00 0.00 0.95 0.00 0.00 64 R 8.75 3.83 0.00 1.90 1.94 0.00 3.49 0.00 0.00 3.25 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.12 0.00 65 I 7.84 3.67 2.40 0.00 0.00 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 1.77 0.97 1.15 0.00 0.00 66 N 9.69 4.35 0.00 2.73 2.92 0.00 0.00 7.17 8.03 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 67 A 8.41 3.93 1.35 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 68 A 8.30 3.81 0.74 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 69 C 8.86 4.14 0.00 2.70 2.87 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 70 R 8.41 4.87 0.00 2.05 2.15 0.00 3.11 0.00 0.00 3.03 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 71 Q 8.48 4.23 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 7.21 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 72 H 8.10 4.95 0.00 3.32 3.29 0.00 5.87 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 73 G 8.20 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.51 4.23 0.00 1.89 1.75 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.77 4.67 0.00 2.94 2.92 0.00 0.00 6.71 7.48 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 76 Y 8.86 4.36 0.00 3.31 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 77 S 8.65 4.71 0.00 4.19 4.31 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 78 T 7.94 3.93 4.30 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 1.25 0.00 0.00 79 F 9.06 4.07 0.00 2.85 3.17 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 0.00 80 I 8.27 3.35 1.55 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.34 0.83 0.00 0.00 81 H 8.16 4.12 0.00 3.23 3.42 0.00 5.77 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.88 3.73 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 0.00 0.00 0.00 83 L 7.84 3.93 0.00 1.39 1.39 0.06 0.88 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 84 K 7.80 3.72 0.00 1.64 1.89 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.55 7.81 85 K 7.71 4.00 0.00 1.72 1.74 0.00 1.73 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.27 7.81 86 A 7.62 4.08 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 87 G 8.01 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 88 I 7.25 4.01 1.78 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.43 0.82 0.00 0.00 89 E 7.73 4.34 0.00 1.92 1.93 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 2.27 2.28 0.00 90 V 6.99 4.03 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 0.99 0.00 0.00 0.87 0.00 0.00 91 D 9.06 3.55 0.00 2.82 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 92 R 7.32 3.82 0.00 2.01 1.89 0.00 3.09 0.00 0.00 2.96 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.52 0.00 93 K 8.62 4.50 0.00 2.24 2.23 0.00 1.79 0.00 0.00 1.89 0.00 0.00 3.14 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.85 1.90 7.81 94 N 7.56 2.00 0.00 1.44 2.22 0.00 0.00 6.92 7.78 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 95 L 8.60 4.27 0.00 1.56 1.56 0.84 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.73 4.93 1.66 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 0.00 0.00 97 D 7.93 4.53 0.00 2.84 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 98 L 8.46 3.67 0.00 1.90 1.98 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.30 3.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 8.28 3.70 2.20 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 0.86 0.00 0.00 0.90 0.00 0.00 101 R 7.52 4.06 0.00 1.92 1.83 0.00 3.40 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 102 E 8.63 3.96 0.00 2.22 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 2.31 2.24 0.00 103 P 0.00 4.80 0.00 2.31 2.42 0.00 3.88 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.91 0.00 104 Q 7.98 3.95 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.88 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 105 V 7.45 3.90 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 1.01 0.00 0.00 0.96 0.00 0.00 106 F 8.21 4.04 0.00 3.36 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 0.00 107 A 8.54 4.09 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 0.00 108 E 8.73 4.11 0.00 2.00 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 2.30 2.35 0.00 109 L 7.34 4.00 0.00 1.91 1.47 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 110 V 7.94 3.88 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 1.22 0.00 0.00 0.92 0.00 0.00 111 E 8.68 4.02 0.00 2.10 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 2.47 2.48 0.00 112 R 7.98 4.15 0.00 1.95 1.91 0.00 3.23 0.00 0.00 3.13 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 113 A 7.53 4.63 1.14 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 0.00 0.00 114 K 8.65 3.99 0.00 1.91 1.85 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.57 7.81 115 A 8.62 3.94 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 0.00 116 A 7.64 4.62 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 0.00 117 Q 8.09 4.52 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 118 G 7.81 3.75 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.