NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8777 8.3549 109.7296 44.4068 0.0000 174.5946 4 P 3.9797 0.0000 0.0000 61.7069 32.4714 172.8687 5 E 3.8182 9.4618 126.4538 59.0274 31.0459 175.5422 6 Y 4.9918 7.4489 118.4632 56.9340 39.5141 174.4351 7 K 4.6962 9.5526 125.7235 55.6857 33.6591 176.2542 8 V 4.8920 8.6925 124.7519 60.9844 34.6657 174.1194 9 A 4.9668 8.8349 127.6457 50.0695 22.9947 174.8563 10 I 5.0832 8.4580 119.5267 59.4771 41.3264 174.2236 11 L 5.1692 9.0788 129.3403 53.7873 44.2451 174.9699 12 T 4.8572 9.1257 124.0347 62.2108 70.6132 173.9227 13 V 4.6733 8.3385 126.4313 61.2382 33.7520 174.8248 14 S 4.8883 9.0503 120.5591 57.1833 66.2292 176.9219 15 D 4.4259 9.1918 129.8441 58.1216 40.5229 179.6861 16 T 3.8755 7.7931 115.1921 66.6832 68.6572 176.9399 17 V 3.8639 7.8570 121.5301 65.5257 31.3890 178.0155 18 S 4.1679 8.2373 111.5029 60.5366 62.2807 175.0011 19 A 4.3878 7.5773 121.7103 51.9969 19.4069 178.0871 20 G 3.8435 8.0459 105.9261 45.2268 0.0000 174.8468 21 A 4.2207 7.6997 121.3619 52.7544 18.4362 177.2726 22 G 3.9695 7.3860 103.1329 44.4350 0.0000 171.8324 23 P 4.6242 0.0000 0.0000 61.3365 33.1598 174.1610 24 D 4.8038 8.4445 117.2715 53.0815 41.0766 176.4438 25 R 4.4504 8.5048 125.6777 56.7705 31.6012 178.5419 26 S 4.6758 8.2495 113.1963 60.2775 63.8382 176.0029 27 G 3.9799 10.6549 110.9968 46.5869 0.0000 173.8248 28 P 4.3347 0.0000 0.0000 65.1787 31.2887 178.6880 29 R 3.9245 7.6138 118.1189 58.9066 29.9074 178.6851 30 A 3.9729 8.0198 120.6490 55.1205 18.4328 179.5529 31 V 3.5360 7.8593 117.0359 66.4862 31.5606 178.4344 32 S 4.2309 7.9638 113.2346 60.9766 62.7528 176.5925 33 V 3.5586 7.9759 121.9170 65.9939 31.2812 177.6046 34 V 3.6619 8.1175 118.1801 66.1571 31.2804 177.2498 35 D 4.8693 8.2354 118.0878 57.8955 40.7186 179.2734 36 S 4.3002 8.4796 111.4732 60.0850 62.6522 175.0134 37 S 4.6747 8.9589 116.9717 58.4856 62.8625 175.2716 38 S 4.0999 8.0561 118.0771 62.1136 61.9179 175.3773 39 E 3.9337 8.2504 121.1382 59.2090 29.1977 178.5140 40 K 3.3191 8.0073 119.3264 59.2276 32.4313 177.7899 41 L 4.3107 7.9703 116.8196 54.7548 41.6751 177.2540 42 G 3.7690 9.0472 108.3820 45.5481 0.0000 170.0650 43 G 3.7424 10.6227 116.7048 44.6651 0.0000 173.1348 44 A 4.9394 9.0010 126.1390 50.4615 22.8209 175.1199 45 K 4.5787 8.9819 120.0943 54.7986 36.4389 175.3069 46 V 4.3955 7.7999 126.9575 62.5793 31.7484 175.9421 47 V 4.3856 8.1146 120.2211 60.7070 32.6542 175.5291 48 A 4.5394 7.2384 120.0640 51.4399 22.0122 175.7491 49 T 5.3151 8.4922 109.5907 60.6661 72.6459 172.3094 50 A 4.7979 8.9311 122.3379 51.1745 23.3257 175.2168 51 V 4.9614 8.2958 118.2490 61.4327 34.4296 175.0354 52 V 4.6979 8.4692 119.0601 59.0889 36.5857 172.9229 53 P 4.8244 0.0000 0.0000 62.1203 32.8801 177.2290 54 D 4.7888 9.2743 121.1328 53.6218 38.3501 174.9382 55 E 4.6052 7.9135 119.5223 53.7814 33.8965 176.6981 56 V 3.6157 8.6713 117.8593 64.5550 31.5534 178.4191 57 E 4.0242 8.0879 117.7204 59.5574 28.9932 179.4965 58 R 3.8625 7.8642 117.5376 59.1837 30.2036 179.1240 59 I 3.6573 7.7803 119.6678 64.0605 37.1464 178.3073 60 K 3.8027 8.9838 120.2888 59.7618 31.9048 178.7760 61 D 4.3147 8.1939 118.9867 57.5326 40.7182 179.1926 62 I 3.2261 7.1489 119.4157 64.1982 36.8995 178.2993 63 L 3.9584 7.5030 119.5886 57.9831 41.4502 179.7822 64 Q 3.9907 8.3688 118.0192 58.8093 28.7572 178.5967 65 K 3.9194 8.5502 120.8347 59.4901 30.9140 178.4961 66 W 4.6228 8.6590 117.9085 58.3038 28.8077 178.0977 67 S 4.6087 7.6704 114.9392 60.5633 63.2932 175.5587 68 D 4.5643 8.5819 120.4052 56.1883 40.9492 177.7372 69 V 4.0427 7.6611 117.5795 65.0978 32.1665 176.8877 70 D 4.4297 8.1396 117.3691 54.6615 41.1232 174.1532 71 E 3.4996 7.3729 119.8325 56.5856 29.8657 174.2316 *73 D 4.7509 8.4056 121.2370 53.8562 44.0742 175.1848 74 L 5.0856 7.9071 119.9673 53.5243 46.0609 174.9151 75 I 5.0373 8.7557 126.6116 59.6053 40.7201 174.1980 76 L 5.2452 8.7437 127.5663 53.2982 43.8777 175.9642 77 T 5.1390 8.5821 113.6785 60.2283 71.9186 173.3996 78 L 4.8830 8.6116 122.2440 54.1550 45.2231 177.9259 79 G 4.1491 9.0036 108.4356 46.4352 0.0000 172.4674 80 G 4.2437 8.7821 103.2706 46.8725 0.0000 175.0437 81 T 4.5599 7.9663 107.9565 60.9204 70.3710 174.2874 82 G 4.2435 7.7766 114.6477 46.7333 0.0000 173.8659 83 F 4.5011 8.9069 117.4466 58.4808 40.4177 176.4355 84 T 4.0358 8.0411 117.1028 63.3108 68.7686 173.1340 85 P 4.3144 0.0000 0.0000 65.5480 31.5125 177.9545 86 R 4.0657 7.8355 114.8976 57.3048 30.5320 176.1201 87 D 4.5699 7.9448 118.8946 54.3198 40.3700 176.5830 88 V 5.1330 7.9915 115.5337 59.5016 33.3677 178.1337 89 T 3.8784 8.4267 120.2417 66.3729 68.1045 174.9204 90 P 4.2945 0.0000 0.0000 65.4197 31.2717 178.3341 91 E 3.9108 8.2335 116.8315 59.5282 29.2668 179.2482 92 A 3.9847 7.9922 120.5509 55.4278 18.3789 179.7964 93 T 3.8291 8.4049 114.6909 66.7965 68.3030 177.0724 94 K 3.9926 8.1245 119.4234 59.1150 32.1045 179.1232 95 K 4.1895 7.7352 117.6187 58.0757 32.0739 177.8693 96 V 4.3259 7.6998 110.6119 60.8276 33.6348 176.0672 97 I 4.1656 7.5834 112.6473 60.6062 38.5209 174.9861 98 E 4.6203 9.1115 120.3159 56.9403 31.8819 177.0728 99 R 4.6871 7.6942 117.3058 54.3354 34.1244 174.9583 100 E 4.6331 8.9073 122.9402 55.3390 31.0347 176.6501 101 T 4.6641 7.6521 109.1053 59.4176 68.5198 173.3582 102 P 4.3993 0.0000 0.0000 65.7118 31.8386 178.6242 103 G 3.6467 8.0490 104.7857 47.8770 0.0000 175.6665 104 L 4.1331 8.0217 120.5905 57.3403 41.6520 179.2976 105 L 4.1727 7.7671 118.0219 57.6875 41.7215 178.7109 106 F 4.1359 8.5416 120.2734 60.3780 40.8047 176.7706 107 V 3.9845 7.6736 119.0754 62.2378 28.7672 175.5281 *110 Q 4.0715 7.9373 123.6356 55.5835 31.2132 177.1444 111 E 4.0578 8.1100 117.5156 59.4230 29.4007 179.5452 112 S 4.1534 7.9984 113.7552 61.1585 63.5987 176.1904 113 L 4.4357 7.4307 122.9533 56.5672 41.0702 178.8009 114 K 4.0380 7.9747 116.9529 57.7317 32.1867 178.1664 115 I 4.2049 7.7085 120.0592 62.2661 38.4158 175.6081 116 T 4.5985 6.6382 109.7814 60.2854 70.7547 172.5064 117 P 4.1432 0.0000 0.0000 65.3270 31.4976 178.4096 118 F 4.1328 7.7708 115.2576 58.9078 39.6290 175.9773 119 A 4.2484 7.6032 125.9112 52.1102 15.8673 178.5954 *121 L 4.0869 7.5673 120.5006 53.6291 44.1097 177.6158 122 S 4.5078 7.9558 114.3336 58.3998 62.7203 174.1626 123 R 4.7329 8.6381 127.2866 55.7565 30.5661 176.6082 124 S 4.3463 7.9306 113.6421 59.1770 63.7308 173.9391 125 A 4.8676 8.0729 123.8767 50.3169 22.3021 174.4654 126 A 4.5790 7.6041 117.4815 51.5339 22.4815 177.0522 127 G 4.0572 7.0446 106.5061 45.7131 0.0000 171.3179 128 I 5.0150 7.7557 119.3378 59.3512 40.1992 174.9412 129 R 4.7464 8.7900 123.6105 55.8299 34.4732 176.4955 130 G 3.7721 9.1124 111.8459 46.6011 0.0000 174.2234 131 S 4.7033 9.2077 110.5050 57.9517 64.4949 173.9669 132 T 4.6902 8.5289 118.7690 62.3649 70.6815 173.3798 133 L 4.5024 8.4955 129.2978 54.6545 43.3795 175.3109 134 I 5.1216 8.9256 127.6178 59.6630 40.3917 174.8533 135 I 4.8208 8.3945 126.0202 59.8758 41.1209 175.2406 136 N 5.5857 8.5733 124.8920 51.2129 40.1112 172.7625 *138 P 4.2139 0.0000 0.0000 62.1258 32.4535 177.3172 139 G 3.9000 8.8374 109.8238 48.7363 0.0000 174.2594 140 N 4.4402 8.0759 116.9950 52.5667 39.1674 174.0417 141 P 4.2949 0.0000 0.0000 65.8900 31.8182 178.1464 142 N 4.5225 8.1472 114.4359 55.2048 38.5457 176.9526 143 A 4.0028 7.6731 122.5016 55.4930 18.2033 179.8904 144 V 3.7255 7.7578 114.3916 65.8064 31.6783 177.7093 145 A 4.1442 7.8012 120.1468 55.1656 18.3475 179.1709 146 E 4.1636 8.0341 115.5146 59.4341 29.9437 179.4098 147 C 4.1325 8.3256 113.3450 60.8736 27.7732 175.0630 *149 E 4.1998 8.1375 123.1890 56.1345 30.9215 177.4001 150 A 4.1862 8.0298 119.8518 54.5510 18.6217 178.9623 151 L 4.2303 7.8105 116.8096 57.0377 41.9847 178.4652 152 L 3.9308 8.0740 119.1602 58.0777 41.8620 176.9820 153 P 4.4337 0.0000 0.0000 64.4796 31.5936 176.4878 154 A 4.6901 8.4893 117.9946 50.4495 20.9618 177.6053 155 L 4.1728 7.9441 117.2929 57.8154 42.0052 177.9585 156 K 3.8442 8.1312 119.5037 59.9883 32.0069 177.7349 157 H 4.1755 8.2624 117.4680 59.1454 29.5827 176.9764 158 A 3.9041 8.2175 122.1801 55.4344 18.4089 179.3959 159 L 3.8830 8.1109 117.5612 57.4157 41.3309 179.5607 160 K 4.0545 7.9442 118.9714 59.8447 32.2729 178.7119 161 Q 4.0309 8.1523 119.1532 59.0806 28.5936 177.1893 *162 I 3.9624 7.2584 122.2642 59.9783 36.2960 180.1482 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 3 G 8.35 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 0.00 0.00 0.00 4 P 0.00 3.98 0.00 2.10 2.01 0.00 3.65 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 5 E 9.46 3.82 0.00 1.68 1.49 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 1.54 2.06 0.00 6 Y 7.45 4.99 0.00 3.08 2.78 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 7 K 9.55 4.70 0.00 1.68 1.68 0.00 1.56 0.00 0.00 1.53 0.00 0.00 2.74 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.38 7.81 8 V 8.69 4.89 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 0.98 0.00 0.00 1.00 0.00 0.00 9 A 8.83 4.97 0.21 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 10 I 8.46 5.08 1.91 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 1.13 0.95 0.97 0.00 0.00 11 L 9.08 5.17 0.00 1.92 1.62 0.79 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 12 T 9.13 4.86 4.40 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 1.23 0.00 0.00 13 V 8.34 4.67 2.19 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 0.81 0.00 0.00 0.92 0.00 0.00 14 S 9.05 4.89 0.00 3.92 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 15 D 9.19 4.43 0.00 2.68 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 16 T 7.79 3.88 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 1.23 0.00 0.00 17 V 7.86 3.86 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 1.14 0.00 0.00 1.01 0.00 0.00 18 S 8.24 4.17 0.00 3.83 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 19 A 7.58 4.39 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 20 G 8.05 3.84 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 0.00 0.00 0.00 21 A 7.70 4.22 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 22 G 7.39 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 23 P 0.00 4.62 0.00 2.19 2.10 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 24 D 8.44 4.80 0.00 2.71 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 25 R 8.50 4.45 0.00 1.91 1.94 0.00 3.16 0.00 0.00 3.39 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 26 S 8.25 4.68 0.00 4.03 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 0.00 27 G 10.65 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 28 P 0.00 4.33 0.00 2.28 2.33 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.10 0.00 29 R 7.61 3.92 0.00 2.02 2.02 0.00 3.30 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.79 0.00 30 A 8.02 3.97 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 31 V 7.86 3.54 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 1.04 0.00 0.00 0.96 0.00 0.00 32 S 7.96 4.23 0.00 4.13 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 33 V 7.98 3.56 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 0.82 0.00 0.00 0.97 0.00 0.00 34 V 8.12 3.66 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 0.99 0.00 0.00 0.99 0.00 0.00 35 D 8.24 4.87 0.00 2.87 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 36 S 8.48 4.30 0.00 3.81 4.11 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 37 S 8.96 4.67 0.00 3.95 3.84 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 38 S 8.06 4.10 0.00 4.04 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 39 E 8.25 3.93 0.00 2.08 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 2.39 2.41 0.00 40 K 8.01 3.32 0.00 1.90 1.90 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.50 7.81 41 L 7.97 4.31 0.00 1.92 1.80 0.94 0.81 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 42 G 9.05 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 0.00 0.00 0.00 43 G 10.62 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 44 A 9.00 4.94 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 45 K 8.98 4.58 0.00 1.79 1.58 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.37 7.81 46 V 7.80 4.40 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 0.78 0.00 0.00 0.92 0.00 0.00 47 V 8.11 4.39 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 0.66 0.00 0.00 0.81 0.00 0.00 48 A 7.24 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 T 8.49 5.32 4.32 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 1.22 0.00 0.00 50 A 8.93 4.80 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 51 V 8.30 4.96 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 0.87 0.00 0.00 0.96 0.00 0.00 52 V 8.47 4.70 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 0.59 0.00 0.00 0.92 0.00 0.00 53 P 0.00 4.82 0.00 2.13 2.05 0.00 3.73 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 54 D 9.27 4.79 0.00 2.74 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 55 E 7.91 4.61 0.00 1.95 1.77 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 2.29 2.31 0.00 56 V 8.67 3.62 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 0.88 0.00 0.00 0.91 0.00 0.00 57 E 8.09 4.02 0.00 1.95 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 2.38 2.33 0.00 58 R 7.86 3.86 0.00 1.90 1.91 0.00 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0.00 *138 P 0.00 4.21 0.00 2.08 2.04 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.11 0.00 139 G 8.84 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 0.00 140 N 8.08 4.44 0.00 2.77 2.75 0.00 0.00 7.16 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 0.00 141 P 0.00 4.29 0.00 2.04 2.13 0.00 3.67 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 2.03 2.12 0.00 142 N 8.15 4.52 0.00 2.73 2.86 0.00 0.00 7.00 7.13 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 0.00 143 A 7.67 4.00 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 V 7.76 3.73 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 0.90 0.00 0.00 0.95 0.00 0.00 145 A 7.80 4.14 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 0.00 146 E 8.03 4.16 0.00 1.96 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 2.32 2.40 0.00 147 C 8.33 4.13 0.00 3.01 2.95 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 *149 E 8.14 4.20 0.00 2.06 2.19 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 2.20 2.33 0.00 150 A 8.03 4.19 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 0.00 151 L 7.81 4.23 0.00 1.71 1.72 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 152 L 8.07 3.93 0.00 1.62 1.74 0.93 0.94 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 0.00 153 P 0.00 4.43 0.00 2.07 2.11 0.00 3.83 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 154 A 8.49 4.69 1.25 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 0.00 0.00 0.00 155 L 7.94 4.17 0.00 1.89 1.66 0.88 0.54 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 0.00 156 K 8.13 3.84 0.00 2.04 1.78 0.00 2.01 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.62 7.81 157 H 8.26 4.18 0.00 3.28 3.30 0.00 5.94 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 0.00 158 A 8.22 3.90 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 0.00 159 L 8.11 3.88 0.00 0.89 0.81 0.44 0.25 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 0.00 160 K 7.94 4.05 0.00 1.89 2.05 0.00 1.89 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.61 7.81 161 Q 8.15 4.03 0.00 1.97 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.32 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 *162 I 7.26 3.96 1.95 0.00 0.00 0.82 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 0.69 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.