NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7653 8.3549 109.7374 45.5036 0.0000 172.4318 *2 T 4.1500 8.1889 114.9239 63.1902 69.2027 174.1288 3 F 4.1378 9.0422 125.6301 57.2507 39.7598 175.0796 4 R 4.7226 8.2931 122.9476 54.4969 32.8293 175.4236 5 D 4.8453 8.2110 119.9180 53.1692 42.4668 178.0142 6 T 3.8941 8.4003 111.5584 64.1989 68.8600 176.4486 7 S 4.0835 8.1176 116.0831 61.0798 62.6978 175.3554 8 A 3.9538 8.2281 123.8911 54.0058 18.2410 176.6628 9 I 4.2847 7.3369 117.2171 60.0374 37.6405 175.6497 10 A 4.2385 8.8126 129.3637 54.7090 19.1710 176.8439 11 S 4.4805 7.0550 107.4540 57.9197 66.2786 174.5090 12 W 4.8560 8.6283 119.2723 55.0106 32.5989 174.7087 13 H 5.4863 8.8134 119.1553 53.9493 31.8650 172.8503 14 A 5.1024 9.0646 123.1375 50.4166 22.6093 174.6820 15 H 5.2509 9.3545 118.3504 53.8622 32.2931 173.1522 16 V 4.1052 8.4328 124.7450 62.6742 32.2656 174.3467 17 Y 5.6673 9.1434 126.7984 57.1308 40.1572 174.7815 18 F 5.0819 8.7530 117.3209 56.7139 41.8420 172.0229 19 D 3.3700 8.8634 116.9251 51.4694 42.3500 175.4593 20 A 4.2035 7.6008 120.5749 55.6536 18.3611 180.1497 21 S 4.3078 7.8302 109.7746 60.6844 63.1700 175.2855 22 S 4.8585 8.2876 113.8631 57.3466 63.5259 175.8995 23 R 4.2664 8.1667 119.9197 60.1144 29.0374 178.5159 24 D 4.4400 8.3002 118.9026 57.0895 40.9299 178.3627 25 A 4.0580 8.1613 120.5883 55.0964 18.4890 179.2162 26 A 4.1188 8.4844 119.6540 55.2151 18.4118 179.7092 27 W 3.7124 8.6806 127.0281 60.7805 30.7731 178.2890 28 T 3.8663 8.2391 115.7695 66.5324 67.8760 176.2586 29 L 4.0461 8.1437 122.2062 58.1412 42.1469 178.7424 30 R 3.7448 7.9297 118.5465 59.7709 29.8674 178.3976 31 E 3.7545 7.7631 117.7832 58.9181 29.3522 179.0372 32 Q 4.0811 8.0550 119.9944 58.7675 29.1349 177.9675 33 I 3.8093 8.3534 121.5020 64.4005 36.7127 177.8141 34 E 3.9001 8.1236 119.1425 59.5646 29.3325 179.4707 35 A 3.9265 7.8839 120.1909 55.4479 18.3068 179.0344 36 H 3.6093 8.2724 115.5378 58.6263 30.0739 176.6642 37 W 4.4498 7.9285 118.4179 55.2266 29.1314 176.4490 38 S 3.7907 8.7367 113.5944 59.7114 60.4109 173.2301 39 G 3.9585 8.1623 104.3709 46.3374 0.0000 175.6285 40 K 4.2184 8.1288 119.6938 57.1272 32.6295 177.1183 41 L 4.3077 7.7116 119.2693 53.3666 42.5890 176.3697 42 Q 4.1375 8.7095 122.9229 56.3166 29.7248 175.1600 43 L 5.2237 8.5145 125.5192 53.3080 44.9446 176.3058 44 G 4.1667 9.2315 114.2359 44.8819 0.0000 173.3391 45 R 4.2298 8.4704 118.5090 56.3370 30.9233 177.7063 46 F 4.8111 8.9243 124.5663 58.0430 38.9586 173.2613 47 H 4.6726 9.4506 122.4990 53.9200 29.7955 175.9673 48 E 3.6248 8.0886 127.1012 54.5333 29.6978 176.0327 49 R 4.2909 6.7263 112.1139 53.9951 32.2668 172.8510 50 P 4.3707 0.0000 0.0000 62.9070 31.9524 176.5006 51 V 4.4269 7.6755 113.9209 60.3204 35.6239 176.1001 52 G 3.6660 8.4713 111.3732 46.4919 0.0000 173.2962 53 P 4.5247 0.0000 0.0000 63.6664 30.6070 175.5259 54 H 4.9714 8.3184 118.3659 53.8187 28.8118 173.9394 55 P 4.3218 0.0000 0.0000 63.0129 31.2424 175.9579 *57 W 4.8914 7.8395 117.7670 57.7358 30.6524 174.3177 58 S 6.0942 8.7070 115.3786 58.8641 66.2477 173.0977 59 Y 5.4596 8.3107 117.9631 55.5975 41.8607 173.4913 60 Q 4.9393 8.9457 121.8932 54.8591 31.4888 173.9868 61 L 5.4330 9.1118 124.9847 52.8989 45.2134 175.2345 62 A 5.3374 8.5137 124.1164 50.3980 21.8036 175.2133 63 F 5.0000 8.4688 114.9564 56.3513 41.9989 173.3987 64 T 4.6762 9.3084 110.7844 60.3229 70.7152 175.6434 65 Q 4.3056 8.9655 122.7522 59.5031 29.0886 178.1328 66 E 4.2869 7.8806 114.2608 58.0758 29.9827 177.8286 67 Q 4.4523 8.0340 117.3213 55.9422 29.2354 177.1806 68 F 3.8929 8.0089 122.2982 61.3247 39.4346 176.8102 69 A 4.0345 8.1492 119.7168 55.1839 18.2598 179.1361 70 D 4.3472 8.0134 116.8871 57.4375 40.9589 178.7134 71 L 3.5610 7.4337 120.4050 58.1239 41.9583 179.1774 72 V 3.3255 7.4382 118.6259 65.4323 31.4047 178.0238 73 G 3.6848 7.9168 105.6706 47.7087 0.0000 175.4344 74 W 4.1679 8.1064 130.6755 60.1035 30.8246 178.0808 75 L 3.9892 8.5348 119.4182 58.0708 40.7977 179.6242 76 T 3.8314 7.9590 115.2254 66.6504 68.4453 176.4656 77 L 4.1343 7.6569 119.5023 56.6423 40.3500 178.1400 78 N 4.6835 7.5143 113.7190 52.7252 39.5089 175.7970 79 H 4.3055 8.3483 118.2578 55.8562 28.9051 176.6294 80 G 3.5438 7.4916 108.3815 46.9752 0.0000 175.6064 81 A 4.2037 8.7067 127.0679 52.7242 18.6242 177.3831 82 L 4.5430 7.6421 117.1188 53.6253 42.4439 176.5362 83 D 4.9750 8.7715 123.8851 54.4077 42.6895 175.4551 84 I 4.8790 8.6982 122.1153 59.5587 41.0241 174.1094 85 F 4.4268 8.6177 130.4018 56.9491 40.4976 174.3642 86 L 5.1124 8.6713 126.3707 53.2248 45.1476 175.2070 87 H 5.2790 8.5074 116.6306 53.5501 32.0647 171.2383 88 P 3.6178 0.0000 0.0000 62.3595 32.6755 175.2796 89 N 4.9062 8.6096 119.3245 52.0486 39.9694 175.4127 90 T 4.4074 8.7864 113.2706 60.3439 69.5117 175.1646 91 G 3.8998 9.1306 109.9386 45.6020 0.0000 173.8477 92 D 4.5232 7.7461 119.0562 50.6868 42.0817 175.1550 93 A 4.0169 8.5595 126.6210 54.7142 18.4673 178.7048 94 L 3.8677 7.8182 117.9453 58.6476 42.2428 179.3799 95 R 3.9817 8.1733 117.4978 58.9774 29.6892 178.7879 96 D 4.2825 8.3783 119.3775 57.6335 40.5727 178.5678 97 H 4.4343 7.9238 115.1087 58.8169 28.9237 177.5877 98 R 4.1488 8.2769 119.5671 58.8906 30.1568 176.7461 99 D 4.8264 8.3227 115.5803 54.1706 42.4049 176.7087 100 A 4.7044 7.4784 120.1425 51.4734 19.4544 175.8157 101 A 4.5544 8.1160 121.0399 53.4625 19.4663 178.2366 102 V 4.5934 8.7035 121.3982 60.8395 35.2921 174.3867 103 W 5.4165 8.7770 125.6064 55.0965 32.6072 174.6530 104 I 3.8106 9.0811 127.1047 64.0708 37.6117 175.1388 105 G 4.2509 9.9719 118.9624 44.3984 0.0000 174.2241 106 H 4.8999 5.3094 112.1583 53.6309 33.3136 173.5427 107 S 2.7900 8.0170 116.5387 57.3083 64.0420 173.0136 108 H 4.5479 5.2900 116.8232 53.6176 32.3472 173.2080 109 E 4.1898 8.4773 121.3894 55.8279 29.5665 177.1570 110 L 4.4000 8.3621 124.1212 54.5545 42.8813 177.8216 111 V 4.0842 8.3007 122.5757 61.5966 29.9386 176.5160 112 L 4.0918 7.8870 124.6201 56.5202 42.1893 179.5263 113 S 4.0780 8.0437 112.1152 60.6087 62.9679 175.3698 114 A 4.0810 7.7604 123.5087 54.3972 18.3896 177.3105 115 L 4.1442 7.7726 120.5171 55.0981 41.6288 176.7853 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 0 G 8.35 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 *2 T 8.19 4.15 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 1.24 0.00 0.00 3 F 9.04 4.14 0.00 2.98 3.02 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 4 R 8.29 4.72 0.00 1.74 1.79 0.00 3.14 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 5 D 8.21 4.85 0.00 2.70 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 6 T 8.40 3.89 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 7 S 8.12 4.08 0.00 3.98 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 8 A 8.23 3.95 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 9 I 7.34 4.28 1.86 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 0.72 0.39 0.41 0.00 0.00 10 A 8.81 4.24 1.16 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 11 S 7.06 4.48 0.00 3.89 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 12 W 8.63 4.86 0.00 1.78 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 0.00 0.00 0.00 0.00 13 H 8.81 5.49 0.00 2.66 2.99 0.00 5.57 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 14 A 9.06 5.10 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 15 H 9.35 5.25 0.00 3.17 3.40 0.00 5.61 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.43 4.11 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.72 0.00 0.00 17 Y 9.14 5.67 0.00 3.17 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 F 8.75 5.08 0.00 3.13 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 19 D 8.86 3.37 0.00 2.16 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 0.00 0.00 0.00 20 A 7.60 4.20 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 21 S 7.83 4.31 0.00 3.95 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 22 S 8.29 4.86 0.00 4.14 4.14 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 23 R 8.17 4.27 0.00 2.71 2.90 0.00 3.23 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.92 0.00 24 D 8.30 4.44 0.00 2.80 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 25 A 8.16 4.06 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 26 A 8.48 4.12 1.18 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 27 W 8.68 3.71 0.00 3.28 3.20 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 0.00 28 T 8.24 3.87 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 29 L 8.14 4.05 0.00 1.97 2.03 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.93 3.74 0.00 1.34 1.27 0.00 2.25 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.83 0.00 31 E 7.76 3.75 0.00 1.79 1.81 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 1.47 2.16 0.00 32 Q 8.06 4.08 0.00 2.38 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.69 2.82 0.00 33 I 8.35 3.81 2.11 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.03 0.89 0.00 0.00 34 E 8.12 3.90 0.00 2.06 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 0.00 2.23 2.31 0.00 35 A 7.88 3.93 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 36 H 8.27 3.61 0.00 2.65 2.52 0.00 5.94 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 W 7.93 4.45 0.00 3.58 2.99 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 38 S 8.74 3.79 0.00 4.00 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 39 G 8.16 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 40 K 8.13 4.22 0.00 1.94 1.92 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.77 1.59 7.81 41 L 7.71 4.31 0.00 1.53 1.46 -0.09 0.60 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 42 Q 8.71 4.14 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 43 L 8.51 5.22 0.00 1.70 1.49 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.23 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 0.00 0.00 0.00 0.00 45 R 8.47 4.23 0.00 1.46 1.83 0.00 3.25 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 46 F 8.92 4.81 0.00 3.15 3.25 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 47 H 9.45 4.67 0.00 3.38 3.15 0.00 5.65 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.09 3.62 0.00 1.37 1.12 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 2.11 2.19 0.00 49 R 6.73 4.29 0.00 1.76 1.59 0.00 2.98 0.00 0.00 3.13 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.54 0.00 50 P 0.00 4.37 0.00 2.05 2.14 0.00 3.65 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 2.07 2.19 0.00 51 V 7.68 4.43 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 0.65 0.00 0.00 0.96 0.00 0.00 52 G 8.47 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 53 P 0.00 4.52 0.00 2.12 2.18 0.00 3.58 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 1.66 1.90 0.00 54 H 8.32 4.97 0.00 3.26 3.00 0.00 5.62 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.32 0.00 2.11 2.09 0.00 3.70 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 1.95 2.25 0.00 *57 W 7.84 4.89 0.00 2.19 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 0.00 0.00 0.00 58 S 8.71 6.09 0.00 4.11 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 59 Y 8.31 5.46 0.00 3.20 3.43 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 60 Q 8.95 4.94 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.15 0.00 61 L 9.11 5.43 0.00 1.61 1.55 0.80 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.51 5.34 1.18 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 63 F 8.47 5.00 0.00 3.13 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 64 T 9.31 4.68 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 65 Q 8.97 4.31 0.00 2.31 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.98 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 66 E 7.88 4.29 0.00 2.11 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 2.38 2.37 0.00 67 Q 8.03 4.45 0.00 2.40 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 68 F 8.01 3.89 0.00 3.03 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 69 A 8.15 4.03 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 70 D 8.01 4.35 0.00 2.76 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 71 L 7.43 3.56 0.00 0.87 0.73 -0.15 -0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.44 3.33 1.20 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 0.65 0.00 0.00 -0.34 0.00 0.00 73 G 7.92 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 74 W 8.11 4.17 0.00 3.57 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.53 3.99 0.00 1.78 1.66 0.71 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.96 3.83 4.35 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 1.19 0.00 0.00 77 L 7.66 4.13 0.00 1.59 1.59 0.91 0.72 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 78 N 7.51 4.68 0.00 1.67 2.07 0.00 0.00 6.68 8.14 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 79 H 8.35 4.31 0.00 3.56 3.67 0.00 5.61 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 80 G 7.49 3.54 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 0.00 0.00 0.00 81 A 8.71 4.20 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 82 L 7.64 4.54 0.00 1.90 1.89 1.11 1.27 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 83 D 8.77 4.98 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.70 4.88 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.84 0.88 0.00 0.00 85 F 8.62 4.43 0.00 2.10 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 86 L 8.67 5.11 0.00 1.56 1.58 0.84 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 87 H 8.51 5.28 0.00 3.16 2.91 0.00 5.45 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 3.62 0.00 1.33 0.49 0.00 3.56 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.51 0.00 89 N 8.61 4.91 0.00 2.34 2.61 0.00 0.00 6.86 7.06 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 90 T 8.79 4.41 4.12 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 1.03 0.00 0.00 91 G 9.13 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 92 D 7.75 4.52 0.00 2.58 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.56 4.02 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 94 L 7.82 3.87 0.00 1.75 1.67 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.17 3.98 0.00 2.16 1.94 0.00 3.32 0.00 0.00 3.14 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 96 D 8.38 4.28 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.92 4.43 0.00 3.36 3.43 0.00 5.85 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.28 4.15 0.00 1.90 2.04 0.00 3.24 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 99 D 8.32 4.83 0.00 2.79 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 0.00 100 A 7.48 4.70 1.16 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 0.00 101 A 8.12 4.55 1.54 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 0.00 0.00 102 V 8.70 4.59 2.16 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 1.05 0.00 0.00 1.14 0.00 0.00 103 W 8.78 5.42 0.00 3.21 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 0.00 104 I 9.08 3.81 1.78 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 1.08 0.79 0.56 0.00 0.00 105 G 9.97 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 0.00 0.00 0.00 0.00 106 H 5.31 4.90 0.00 3.09 3.03 0.00 5.85 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 S 8.02 2.79 0.00 2.79 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 0.00 108 H 5.29 4.55 0.00 2.98 3.14 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.48 4.19 0.00 1.92 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 2.23 2.23 0.00 110 L 8.36 4.40 0.00 1.65 1.56 0.78 0.68 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 0.00 111 V 8.30 4.08 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 0.95 0.00 0.00 0.90 0.00 0.00 112 L 7.89 4.09 0.00 1.74 1.68 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.04 4.08 0.00 3.96 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 0.00 114 A 7.76 4.08 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 0.00 115 L 7.77 4.14 0.00 1.71 1.54 0.74 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 * Residues marked with a * may have inaccurate shift predictions.