NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 N 5.3926 8.5081 118.6084 53.1453 40.9699 176.3153 30 E 4.6720 7.8855 115.5198 55.9534 30.3112 175.0659 31 I 4.1712 8.0123 119.4158 62.5847 38.8876 176.9295 32 S 4.7712 7.2089 115.4371 56.2310 65.1952 174.2435 33 S 4.5981 8.1545 120.1852 57.7450 64.4390 175.2171 34 D 4.5697 8.6143 121.4704 54.7377 39.0491 177.9065 35 T 4.0189 7.9953 120.1219 67.1241 68.2319 175.8443 36 L 4.0366 8.1570 120.7396 58.1611 41.4829 179.2786 37 E 4.1951 8.6579 118.7368 59.4111 29.4244 179.3355 38 Q 4.0198 7.9610 117.6397 58.9927 28.8582 178.6909 39 L 3.9295 8.3550 120.4258 57.8848 41.5754 178.9144 40 Y 4.0822 8.4359 119.9419 60.8177 38.7735 178.1296 41 S 3.9250 8.5904 114.5113 60.9469 62.3855 175.9840 42 L 3.8540 7.8469 122.9614 58.1771 41.9417 178.8297 43 A 3.9152 8.0539 121.1257 54.7709 18.0145 179.3842 44 F 3.9743 8.1022 119.3496 61.6526 39.5236 177.1218 45 N 4.4766 8.3510 116.0877 56.5210 38.2668 177.4241 46 Q 3.9652 8.3182 119.5483 59.0962 28.6453 178.2521 47 Y 4.1539 8.0973 120.5720 60.8624 38.6217 178.1338 48 Q 3.9583 7.9672 118.1397 58.5997 28.9062 177.9196 49 S 4.5759 7.8080 113.5893 57.5140 63.7960 172.2604 50 G 2.6524 6.8544 113.6993 45.4133 0.0000 172.6067 *52 Y 4.9612 7.9284 123.3842 57.8582 40.1353 177.6401 53 E 4.0263 8.2619 119.3777 59.0495 30.2146 177.6132 54 D 4.4499 8.2348 117.5253 57.1911 41.4415 177.2616 55 A 4.4956 8.1625 120.9986 55.0320 18.6179 179.5427 56 H 4.3949 8.6176 112.7032 57.0869 29.6702 177.0433 *58 V 3.9036 7.9453 118.9022 62.4280 33.1181 177.4037 59 F 4.2253 8.3173 118.7531 60.6945 38.4259 177.4519 60 Q 3.8444 8.1337 118.0244 59.0660 29.2303 177.8906 61 A 4.0896 7.7376 121.4294 54.9170 18.4992 179.4543 62 L 3.6375 7.7947 117.6922 57.8866 41.1561 179.3135 63 C 4.1958 8.1691 116.3648 61.9318 27.6351 176.0367 64 V 3.8465 7.1809 118.9950 65.4222 31.8343 177.5998 65 L 4.3765 7.7555 118.2230 56.8325 42.4870 175.9772 66 D 4.8784 8.3363 118.6179 53.7505 42.1768 174.2321 67 H 5.0070 8.2826 115.4403 55.1538 28.7705 176.1874 68 Y 4.5707 7.5300 115.4889 58.0958 38.5268 175.0824 69 D 4.5816 8.0697 121.6482 52.6624 40.9725 177.0318 70 S 4.6220 8.5330 123.0972 60.9150 63.2050 176.2266 71 R 3.9586 7.9317 122.4276 59.4576 29.6450 178.8302 72 F 4.8075 7.6690 117.3846 60.6368 38.9369 177.8363 73 F 4.1862 8.4435 117.0958 60.0885 38.9949 177.5006 74 L 4.3204 8.7144 120.7657 57.9626 41.8980 179.3329 75 G 2.4320 7.9508 105.6640 47.2231 0.0000 175.3429 76 L 3.9330 7.6483 123.8815 57.7846 42.0499 179.2791 77 G 3.0498 8.0214 105.2207 47.5689 0.0000 175.4985 78 A 4.2470 7.5994 123.9511 54.5288 18.3742 179.5367 79 C 4.2948 8.0853 115.2734 63.2181 28.2184 176.6228 80 R 3.9048 7.9592 119.6441 59.1670 29.6251 178.9067 81 Q 3.9182 8.2641 119.2819 59.1472 28.8685 178.2146 82 A 3.7914 7.9917 121.0307 54.5049 18.2514 178.4488 83 M 4.3110 7.2971 114.5519 54.5288 32.2388 176.7891 84 G 3.1542 7.3503 106.6387 46.6072 0.0000 176.0690 85 Q 4.1430 7.6149 121.8756 54.6157 26.2603 175.8552 86 Y 4.3202 7.5054 121.8247 60.9333 38.5267 177.0658 87 D 4.4263 8.1610 119.3875 57.5120 41.0118 178.7569 88 L 4.0350 7.9207 118.7378 57.4792 41.6273 179.2384 89 A 3.6816 7.9701 120.8375 55.2636 18.3710 179.8097 90 I 3.9160 8.0396 118.4087 64.7210 37.1068 178.2036 91 H 4.1812 8.3286 119.2774 59.4275 29.7284 177.6121 92 S 4.2846 8.0773 117.0261 61.8049 62.5382 176.2797 93 Y 4.8949 8.0601 119.5253 61.0866 37.4290 178.4335 94 E 3.9661 8.3752 119.8692 59.3275 29.4096 178.9945 95 E 3.8040 7.8527 117.6895 59.3343 29.8896 179.4698 96 G 3.1635 7.9348 105.3484 47.1632 0.0000 175.7016 97 A 3.3317 6.8389 122.5538 54.7053 18.0730 179.7112 98 V 3.4232 6.9345 116.0754 66.2708 31.6193 177.5493 99 M 4.4534 7.2567 115.4871 55.7853 32.9725 176.6626 100 D 4.5844 7.2603 117.3241 53.6746 43.1343 175.2294 101 I 3.9468 7.6714 125.1725 59.7916 37.6766 177.3106 *103 E 4.0747 7.8933 120.6037 56.3325 30.7978 174.1539 104 P 4.1997 0.0000 0.0000 65.4973 31.3297 178.8473 105 R 3.8673 8.0819 116.8956 58.6561 29.9038 179.1569 106 F 4.0673 7.5549 117.4112 60.2413 39.1200 176.0195 107 P 4.3454 0.0000 0.0000 65.1686 31.0799 178.5835 108 F 4.0234 8.0343 119.6448 61.7454 39.4154 177.0804 109 H 4.2026 8.3358 116.9184 58.0243 28.3571 177.7666 110 A 4.1825 7.6536 122.2801 55.0219 18.1913 179.5413 111 A 3.8523 7.7033 119.2723 55.2073 18.0620 179.6399 112 E 3.7165 7.6666 117.1087 59.7514 29.3526 179.4784 113 C 3.9271 8.0727 116.6908 62.7175 28.1474 176.1650 114 L 3.9656 8.0045 120.5811 57.6390 40.8941 179.5757 115 L 3.9500 7.6002 118.3772 57.4008 41.8122 179.5312 116 Q 4.1504 7.2211 118.3740 55.4617 28.6023 176.9822 *118 G 3.8168 7.8900 105.1413 45.4586 0.0000 174.3587 119 E 4.5287 8.0687 121.8814 54.2274 28.7115 176.7643 120 L 3.9594 7.8841 122.7029 57.2120 42.2133 178.5473 121 A 3.9340 7.8593 120.3972 55.2904 18.4622 179.3206 122 E 3.9133 8.1618 116.4098 59.4829 29.4888 179.3883 123 A 3.9062 7.8204 120.7594 55.0191 18.3489 179.2755 124 E 3.5081 8.3782 118.2359 59.3354 29.6588 179.2545 125 S 4.3518 7.9538 114.9207 61.5546 62.8282 176.8570 126 G 3.6433 7.8552 107.9737 47.8992 0.0000 175.7589 127 L 4.0279 8.0044 121.5373 57.4424 41.5875 179.5903 128 F 4.5762 8.2950 118.2598 60.4293 38.8169 177.5166 129 L 4.2194 8.3794 121.0458 57.6638 41.9158 178.6787 130 A 3.9540 8.2788 121.0898 55.3555 18.3510 179.2535 131 Q 3.9024 8.3351 117.9991 59.5879 28.6856 178.5811 132 E 4.0489 8.2783 119.4394 59.1877 29.2762 179.2361 133 L 4.0226 8.1326 118.8614 57.3895 41.6787 179.3241 134 I 3.4943 7.8588 119.4998 63.0419 37.5712 177.0208 135 A 3.5417 8.4385 119.5663 53.0998 16.4239 174.1896 136 N 4.0171 8.1902 123.8802 53.6067 37.7241 172.8795 *138 P 4.4895 0.0000 0.0000 62.3023 33.3908 178.8335 139 E 3.5875 8.2140 114.5675 57.9318 29.6936 176.6434 140 F 4.5276 7.5125 118.7947 55.7078 39.2299 175.3504 *142 E 4.2897 8.4449 125.4542 56.0906 31.5997 178.5359 143 L 3.7492 7.7720 119.5067 57.8737 42.0656 178.8881 144 S 4.0325 8.4959 113.6911 61.6962 62.4090 176.1448 145 T 3.9348 7.9138 117.9718 66.7790 68.1356 176.3754 146 R 3.9924 7.8680 120.3845 59.2338 30.0067 178.8427 147 V 3.7201 7.8259 118.2597 66.1985 31.6007 178.2240 148 S 4.1365 8.6582 115.2896 61.5669 62.5987 176.7689 149 S 4.1111 8.1174 115.8922 61.6360 62.2092 176.1302 150 M 4.0911 8.2932 121.5402 58.2860 31.4190 178.7438 151 L 3.8930 7.9524 118.6590 57.7778 41.8667 178.9244 152 E 4.0646 7.9786 118.0597 58.7984 29.5672 178.5680 153 A 4.1687 7.7823 120.3836 55.1248 18.5683 180.6996 154 I 3.6341 7.1819 113.7239 61.7202 38.6137 177.2317 *156 L 4.0241 7.6147 118.0611 54.8533 42.1281 177.9271 *159 E 4.2123 7.5816 117.4859 56.4174 30.3167 176.5005 160 M 4.3634 7.8539 120.9155 55.3733 33.1732 175.2218 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 N 8.51 5.39 0.00 2.81 2.89 0.00 0.00 6.73 6.77 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 30 E 7.89 4.67 0.00 2.21 2.05 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 0.00 2.23 2.42 0.00 31 I 8.01 4.17 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.87 0.92 0.00 0.00 32 S 7.21 4.77 0.00 3.99 3.72 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 33 S 8.15 4.60 0.00 3.91 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 34 D 8.61 4.57 0.00 3.02 2.89 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 35 T 8.00 4.02 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 1.21 0.00 0.00 36 L 8.16 4.04 0.00 1.81 1.91 1.06 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 37 E 8.66 4.20 0.00 2.09 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 2.52 2.54 0.00 38 Q 7.96 4.02 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 39 L 8.35 3.93 0.00 1.71 1.59 0.85 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 40 Y 8.44 4.08 0.00 3.27 3.29 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 41 S 8.59 3.92 0.00 3.98 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 42 L 7.85 3.85 0.00 1.77 1.75 0.88 0.88 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 43 A 8.05 3.92 0.10 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 0.00 0.00 0.00 0.00 0.00 44 F 8.10 3.97 0.00 2.83 3.04 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 45 N 8.35 4.48 0.00 2.97 2.89 0.00 0.00 7.11 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 46 Q 8.32 3.97 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 47 Y 8.10 4.15 0.00 3.27 3.09 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 0.00 0.00 0.00 0.00 48 Q 7.97 3.96 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.47 2.65 0.00 49 S 7.81 4.58 0.00 3.87 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 50 G 6.85 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 0.00 0.00 0.00 *52 Y 7.93 4.96 0.00 3.09 3.04 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 53 E 8.26 4.03 0.00 1.96 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 2.30 2.33 0.00 54 D 8.23 4.45 0.00 2.67 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 55 A 8.16 4.50 1.59 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 0.00 0.00 56 H 8.62 4.39 0.00 3.43 3.55 0.00 5.62 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *58 V 7.95 3.90 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 0.76 0.00 0.00 0.90 0.00 0.00 59 F 8.32 4.23 0.00 3.17 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 60 Q 8.13 3.84 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 61 A 7.74 4.09 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 62 L 7.79 3.64 0.00 1.35 0.13 0.60 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 63 C 8.17 4.20 0.00 2.96 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 64 V 7.18 3.85 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 0.84 0.00 0.00 0.98 0.00 0.00 65 L 7.76 4.38 0.00 1.72 1.73 0.85 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.34 4.88 0.00 2.93 2.98 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 67 H 8.28 5.01 0.00 3.36 3.70 0.00 5.35 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 7.53 4.57 0.00 3.12 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 69 D 8.07 4.58 0.00 2.74 1.70 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 70 S 8.53 4.62 0.00 4.59 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 71 R 7.93 3.96 0.00 1.46 1.85 0.00 2.72 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 72 F 7.67 4.81 0.00 2.88 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 73 F 8.44 4.19 0.00 3.37 3.45 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 74 L 8.71 4.32 0.00 1.81 1.87 0.70 1.07 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 75 G 7.95 2.43 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 0.00 0.00 0.00 0.00 76 L 7.65 3.93 0.00 1.72 1.61 0.70 0.89 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 77 G 8.02 3.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.60 4.25 1.08 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 0.00 0.00 79 C 8.09 4.29 0.00 3.30 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 80 R 7.96 3.90 0.00 1.92 2.07 0.00 3.09 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.85 0.00 81 Q 8.26 3.92 0.00 2.35 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.64 0.00 82 A 7.99 3.79 0.40 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 83 M 7.30 4.31 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 84 G 7.35 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 0.00 0.00 0.00 85 Q 7.61 4.14 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.07 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 86 Y 7.51 4.32 0.00 3.04 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 87 D 8.16 4.43 0.00 2.71 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 88 L 7.92 4.03 0.00 1.81 1.71 0.94 0.96 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 89 A 7.97 3.68 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 0.00 0.00 90 I 8.04 3.92 2.09 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.87 1.00 0.00 0.00 91 H 8.33 4.18 0.00 3.38 3.51 0.00 5.78 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 92 S 8.08 4.28 0.00 3.83 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 93 Y 8.06 4.89 0.00 3.28 3.27 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 94 E 8.38 3.97 0.00 2.22 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 2.34 2.48 0.00 95 E 7.85 3.80 0.00 1.94 1.48 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 2.18 2.37 0.00 96 G 7.93 3.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 6.84 3.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 6.93 3.42 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 0.79 0.00 0.00 0.82 0.00 0.00 99 M 7.26 4.45 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 100 D 7.26 4.58 0.00 2.69 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 0.00 101 I 7.67 3.95 1.85 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 1.28 0.70 0.89 0.00 0.00 *103 E 7.89 4.07 0.00 2.48 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 2.19 2.42 0.00 104 P 0.00 4.20 0.00 1.68 1.70 0.00 3.41 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 0.56 1.65 0.00 105 R 8.08 3.87 0.00 1.68 1.77 0.00 3.13 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.75 0.00 106 F 7.55 4.07 0.00 3.22 3.16 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 0.00 0.00 0.00 0.00 107 P 0.00 4.35 0.00 2.18 2.13 0.00 3.85 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 108 F 8.03 4.02 0.00 3.08 3.01 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 0.00 0.00 0.00 109 H 8.34 4.20 0.00 2.00 3.01 0.00 5.68 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 0.00 110 A 7.65 4.18 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 0.00 111 A 7.70 3.85 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 0.00 112 E 7.67 3.72 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 2.01 1.73 0.00 113 C 8.07 3.93 0.00 3.22 3.09 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 0.00 0.00 0.00 0.00 114 L 8.00 3.97 0.00 1.78 1.81 0.95 0.58 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 0.00 115 L 7.60 3.95 0.00 1.67 1.61 0.80 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.22 4.15 0.00 0.94 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.17 0.00 0.00 0.00 0.00 0.00 2.21 2.02 0.00 *118 G 7.89 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.07 4.53 0.00 2.07 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 2.21 2.21 0.00 120 L 7.88 3.96 0.00 1.69 1.66 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.86 3.93 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 0.00 122 E 8.16 3.91 0.00 2.11 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 2.39 2.37 0.00 123 A 7.82 3.91 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 0.00 124 E 8.38 3.51 0.00 1.95 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 1.47 1.78 0.00 125 S 7.95 4.35 0.00 4.10 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 0.00 126 G 7.86 3.64 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 0.00 0.00 0.00 127 L 8.00 4.03 0.00 1.59 1.63 0.77 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 128 F 8.30 4.58 0.00 3.23 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 0.00 129 L 8.38 4.22 0.00 1.92 1.89 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.28 3.95 1.43 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 0.00 0.00 0.00 131 Q 8.34 3.90 0.00 2.36 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 132 E 8.28 4.05 0.00 2.23 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 2.31 2.48 0.00 133 L 8.13 4.02 0.00 1.62 1.62 0.96 0.89 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 0.00 134 I 7.86 3.49 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.35 0.95 0.00 0.00 135 A 8.44 3.54 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 0.00 136 N 8.19 4.02 0.00 2.90 2.89 0.00 0.00 7.17 8.02 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 *138 P 0.00 4.49 0.00 2.18 2.13 0.00 3.62 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 139 E 8.21 3.59 0.00 1.67 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 2.20 1.52 0.00 140 F 7.51 4.53 0.00 3.11 2.89 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 *142 E 8.44 4.29 0.00 2.01 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 2.28 2.25 0.00 143 L 7.77 3.75 0.00 1.69 1.84 -0.39 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 144 S 8.50 4.03 0.00 3.90 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 0.00 145 T 7.91 3.93 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 1.23 0.00 0.00 146 R 7.87 3.99 0.00 2.02 2.12 0.00 3.23 0.00 0.00 3.64 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.74 0.00 147 V 7.83 3.72 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 1.11 0.00 0.00 1.12 0.00 0.00 148 S 8.66 4.14 0.00 3.99 3.93 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 0.00 0.00 0.00 149 S 8.12 4.11 0.00 4.08 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.29 4.09 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.57 0.00 151 L 7.95 3.89 0.00 1.81 1.72 1.01 0.62 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 0.00 152 E 7.98 4.06 0.00 2.11 2.13 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 2.33 2.37 0.00 153 A 7.78 4.17 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 0.00 154 I 7.18 3.63 1.93 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.61 0.84 0.00 0.00 *156 L 7.61 4.02 0.00 1.79 1.69 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 *159 E 7.58 4.21 0.00 1.99 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 2.23 2.36 0.00 160 M 7.85 4.36 0.00 1.93 1.88 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 * Residues marked with a * may have inaccurate shift predictions.