NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3026 8.1749 111.0584 61.0553 70.4653 172.6608 2 W 4.6340 8.0633 120.8839 55.1771 29.7590 174.8378 3 G 4.1475 8.0712 110.1720 46.6913 0.0000 171.1201 4 V 5.2365 8.4570 118.7831 61.5488 34.9194 173.8360 5 S 5.0288 9.9838 124.9097 56.9300 64.9371 173.3348 6 S 5.2800 8.7431 117.8270 57.0314 65.5109 172.7071 7 P 4.4783 0.0000 0.0000 62.8166 31.8841 176.2941 8 K 4.3128 8.6202 120.8938 58.8387 33.3759 176.2130 9 N 5.6320 8.0316 114.8786 51.5781 42.8120 174.3268 10 V 4.5611 8.8589 121.0265 61.6528 35.5769 173.3131 11 Q 5.1483 8.2359 125.2017 53.1356 31.9855 174.8054 12 G 4.2941 8.4350 108.6548 44.4536 0.0000 171.0233 13 L 5.0127 8.2784 119.8683 53.3957 43.3523 176.6056 14 S 4.1916 8.5469 118.5068 60.0088 62.4094 173.3991 15 G 4.2572 9.2829 115.3883 45.7623 0.0000 174.7267 16 S 4.5367 7.6196 119.1862 58.1341 62.7655 171.8705 17 C 5.2404 8.2651 113.1208 56.7136 33.1679 173.4556 18 L 4.7416 8.8775 120.6096 53.1996 45.5006 174.5668 19 L 4.9356 8.4523 126.7227 53.3617 44.7121 175.5036 20 I 4.3153 8.5550 128.6588 58.7355 38.4565 173.4516 21 P 4.8335 0.0000 0.0000 63.5292 32.5823 175.9466 22 C 5.3115 9.8953 121.2545 55.7847 46.0373 172.5547 23 I 5.1890 8.8788 119.1053 59.1497 40.7799 173.9747 24 F 5.2983 7.7829 118.6315 55.2200 41.1034 174.0645 25 S 4.5225 8.9925 113.4306 57.0685 66.5978 172.2883 26 Y 4.1532 7.1231 117.4724 54.2968 41.0297 172.6211 27 P 4.1047 0.0000 0.0000 63.1270 31.9089 177.2665 28 A 4.2598 8.7861 126.5459 54.5537 18.5634 178.2718 29 D 4.3364 8.6578 115.2389 57.0178 41.1214 178.3673 30 V 3.0477 7.6239 116.9095 59.1305 32.2890 173.0570 31 P 4.8470 0.0000 0.0000 61.7129 33.2214 175.9852 32 V 4.4387 7.9296 120.4796 61.9525 30.1405 174.7410 *33 S 4.6206 8.0162 119.0054 58.6952 66.4255 177.1257 *34 N 4.3115 8.0341 114.6889 53.3379 37.5143 180.6856 35 G 3.9900 7.6316 102.5337 45.4065 0.0000 172.7227 36 I 3.1179 7.0508 116.8508 61.8838 36.9594 173.2390 37 T 4.5384 8.5411 124.6369 62.1245 69.9645 174.0141 38 A 4.9306 9.1413 129.6343 51.0093 21.2255 176.0734 39 I 4.9149 8.5328 121.7830 59.7988 42.0105 174.0689 40 W 5.1950 8.6777 125.7442 55.4121 31.6165 174.8956 41 Y 5.5312 9.4650 120.6400 56.4747 41.7925 173.8896 42 Y 4.7458 8.9244 122.3563 56.0170 42.1240 175.0449 43 D 4.1633 7.7544 126.0116 54.6956 40.1281 174.3906 44 Y 3.9709 8.3008 120.5878 61.0146 39.1291 177.4696 45 S 4.3118 8.1347 114.3156 61.0402 64.8498 175.1035 46 G 3.9198 7.9903 108.4859 45.8088 0.0000 176.1225 47 K 3.9414 8.0317 126.7842 57.3945 32.4025 177.3987 48 R 3.6668 7.6148 112.8096 57.3002 28.0574 174.1066 49 Q 4.9260 9.0349 121.5439 53.6708 32.1487 174.6120 50 V 4.1874 8.4923 122.4115 62.9280 32.3053 176.5315 51 V 4.0782 8.8781 128.5486 64.7527 32.1262 175.5449 52 I 4.6609 7.5291 111.4270 60.5144 41.1628 174.0399 53 H 4.6373 8.6311 122.1587 55.5450 30.9684 173.8579 54 S 3.8416 9.0701 122.8400 61.3627 62.8422 175.5713 55 G 3.7416 8.0354 110.2775 47.0965 0.0000 172.7418 56 D 4.6647 7.5651 115.7598 50.1756 42.4923 174.7209 57 P 4.4781 0.0000 0.0000 64.2462 31.5470 177.9694 58 K 4.2588 7.9575 117.8246 58.9122 32.5176 177.3936 59 L 4.3247 7.4071 118.5963 55.1964 42.1140 177.1284 60 V 3.8608 7.9003 120.2333 62.2653 32.2834 175.1663 61 D 4.5709 8.8648 126.8400 53.7898 42.0553 177.1850 62 K 3.8968 8.8161 125.0163 59.5026 32.3915 179.1057 63 R 3.6861 8.8119 118.8505 58.5934 30.0100 177.0482 64 F 4.7911 7.8970 114.2669 56.7524 39.8265 175.5107 65 R 3.9803 7.4794 120.7539 58.0902 29.9610 175.9641 66 G 4.0086 8.9492 111.2851 46.4777 0.0000 173.5233 67 R 4.7068 8.3497 116.9739 55.6968 31.8459 175.2931 68 A 5.2193 7.7872 119.4866 50.4983 22.7774 174.9935 69 E 4.6392 8.9245 119.0221 54.9026 33.8581 173.9116 70 L 4.7255 8.5777 128.2762 54.1966 42.6163 177.2111 71 M 4.4933 8.6047 131.2564 54.0595 29.7248 174.2949 72 G 4.5889 7.5680 106.0290 43.6442 0.0000 170.3951 73 N 4.9548 8.4860 117.1924 51.8878 41.0037 174.5239 74 M 4.3840 9.0866 125.4275 58.6378 31.2158 177.9819 75 D 4.6636 8.0604 116.4405 55.8462 41.1561 176.0438 76 H 4.7747 8.2752 114.6512 54.2816 30.9138 173.3966 77 K 2.9373 7.5700 118.0411 57.1626 29.6070 175.1734 78 V 4.6200 7.4767 118.1058 61.0677 33.6409 174.5461 79 C 5.1242 9.0663 122.1752 54.9486 41.8634 173.6219 80 N 5.0756 8.3425 115.9747 54.1430 39.4448 173.2262 81 L 4.6485 8.2822 124.7169 53.1157 44.3500 174.2879 82 L 4.8966 8.8982 129.0722 53.4016 44.2655 174.7164 83 L 4.8936 9.0970 127.3137 53.0744 43.6209 175.6836 84 K 4.4129 9.2178 124.4227 55.8201 33.6768 176.4459 85 D 4.3136 8.7163 119.5121 54.9074 39.1932 173.0841 86 L 4.3597 8.5043 121.9908 54.7816 42.9920 176.7814 87 K 4.8919 9.5927 119.7598 54.3355 36.6171 175.8262 88 P 4.3323 0.0000 0.0000 65.8646 31.3799 178.8818 89 E 4.0567 8.1742 116.1939 59.0945 29.4181 177.6623 90 D 4.6401 7.9150 117.2971 55.7780 41.1595 177.0740 91 S 4.6211 8.1254 116.1057 58.8980 63.6848 175.0937 92 G 3.8618 8.1705 109.9117 44.9522 0.0000 171.8484 93 T 5.2835 7.9551 116.1616 62.0791 71.6645 173.2451 94 Y 5.4341 9.2736 122.3497 56.4419 41.5703 174.4171 95 N 5.5075 9.4986 120.4391 51.5316 42.6956 173.5004 96 F 4.3462 8.4000 124.5987 57.0474 41.6580 174.1926 97 R 4.7726 6.9484 123.4745 54.5065 34.0481 173.6851 98 F 5.7851 7.9696 118.4689 54.7485 41.9537 173.0686 99 E 4.7123 8.6918 119.8994 55.0678 32.5425 176.4360 100 I 3.9130 8.6529 125.7840 62.8903 38.4384 175.5853 101 S 4.7283 7.5157 112.4299 56.5353 65.7308 174.0536 102 D 4.3790 8.9002 122.3727 57.3607 40.3981 179.2118 103 S 4.7745 7.7882 110.7950 58.0237 64.3307 174.7504 104 N 5.0006 7.8938 115.3363 53.2685 39.9508 173.5277 105 R 4.9831 7.3224 117.3466 54.1033 34.5739 176.0058 106 W 4.7883 7.9939 129.7136 55.7248 34.6142 173.1510 107 L 4.8447 7.1257 127.2174 52.9827 44.3068 175.1115 108 D 4.6659 8.7478 126.4374 53.8580 41.4331 176.5189 109 V 3.7588 8.2222 120.3127 63.4829 32.2037 177.9253 110 K 3.9462 8.3056 118.8374 59.2406 32.1783 178.7628 111 G 4.0357 8.8730 106.8775 44.9889 0.0000 172.0383 112 T 4.8375 8.9409 115.2252 62.2972 72.6218 173.7834 113 T 4.7555 9.1717 125.0070 63.0797 69.8287 173.9727 114 V 4.9317 9.7029 128.7275 61.3096 33.4446 174.4170 115 T 4.8341 8.5923 118.0488 59.8615 71.2870 173.0705 116 V 4.4707 9.0311 128.0152 62.4281 32.4763 174.9663 117 T 4.6887 9.1331 122.6976 60.5746 71.1398 174.2460 118 T 4.2123 8.2632 118.2761 63.6456 69.0263 174.4164 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 1 T 8.17 4.30 4.29 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 1.23 0.00 0.00 2 W 8.06 4.63 0.00 1.78 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 0.00 0.00 0.00 3 G 8.07 4.15 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 4 V 8.46 5.24 2.40 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 1.07 0.00 0.00 1.53 0.00 0.00 5 S 9.98 5.03 0.00 3.61 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 6 S 8.74 5.28 0.00 4.03 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 7 P 0.00 4.48 0.00 2.39 2.12 0.00 3.96 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.96 0.00 8 K 8.62 4.31 0.00 1.92 1.88 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.53 7.81 9 N 8.03 5.63 0.00 2.61 2.68 0.00 0.00 6.59 7.68 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 10 V 8.86 4.56 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 0.92 0.00 0.00 11 Q 8.24 5.15 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.59 0.00 0.00 0.00 0.00 0.00 2.44 2.18 0.00 12 G 8.44 4.29 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 0.00 13 L 8.28 5.01 0.00 1.61 1.58 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.55 4.19 0.00 3.89 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 15 G 9.28 4.26 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 0.00 0.00 0.00 16 S 7.62 4.54 0.00 3.90 3.83 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 17 C 8.27 5.24 0.00 3.10 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.88 4.74 0.00 1.64 1.33 0.87 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.45 4.94 0.00 1.57 1.43 0.86 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 20 I 8.56 4.32 1.47 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.14 0.87 0.00 0.00 21 P 0.00 4.83 0.00 2.11 2.17 0.00 3.70 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 2.08 1.96 0.00 22 C 9.90 5.31 0.00 3.21 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 23 I 8.88 5.19 1.68 0.00 0.00 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 1.33 0.74 0.83 0.00 0.00 24 F 7.78 5.30 0.00 2.63 2.93 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 25 S 8.99 4.52 0.00 3.55 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.12 4.15 0.00 1.72 2.40 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 27 P 0.00 4.10 0.00 2.01 2.01 0.00 2.20 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.90 0.00 28 A 8.79 4.26 1.23 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 0.00 0.00 29 D 8.66 4.34 0.00 2.72 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 30 V 7.62 3.05 2.46 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 0.82 0.00 0.00 0.93 0.00 0.00 31 P 0.00 4.85 0.00 2.20 2.10 0.00 3.65 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.97 0.00 32 V 7.93 4.44 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 0.82 0.00 0.00 0.95 0.00 0.00 *33 S 8.02 4.62 0.00 3.63 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 *34 N 8.03 4.31 0.00 2.72 2.85 0.00 0.00 6.82 7.99 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 35 G 7.63 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 36 I 7.05 3.12 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.66 1.00 0.00 0.00 37 T 8.54 4.54 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 1.16 0.00 0.00 38 A 9.14 4.93 1.57 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 0.00 0.00 39 I 8.53 4.91 1.51 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.40 0.38 0.00 0.00 40 W 8.68 5.19 0.00 3.42 3.26 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 41 Y 9.46 5.53 0.00 3.17 3.03 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 42 Y 8.92 4.75 0.00 2.63 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 43 D 7.75 4.16 0.00 2.22 2.46 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 0.00 44 Y 8.30 3.97 0.00 2.85 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 45 S 8.13 4.31 0.00 3.87 3.87 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 46 G 7.99 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 47 K 8.03 3.94 0.00 1.78 1.93 0.00 1.88 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.38 7.81 48 R 7.61 3.67 0.00 1.60 1.75 0.00 2.84 0.00 0.00 2.40 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.07 0.00 49 Q 9.03 4.93 0.00 2.51 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.64 2.60 0.00 50 V 8.49 4.19 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 1.01 0.00 0.00 1.03 0.00 0.00 51 V 8.88 4.08 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 0.56 0.00 0.00 0.46 0.00 0.00 52 I 7.53 4.66 2.00 0.00 0.00 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 1.61 0.72 0.98 0.00 0.00 53 H 8.63 4.64 0.00 3.21 3.32 0.00 5.68 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 54 S 9.07 3.84 0.00 4.00 4.08 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 55 G 8.04 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 56 D 7.57 4.66 0.00 2.77 2.73 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 57 P 0.00 4.48 0.00 2.28 2.39 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 58 K 7.96 4.26 0.00 1.89 1.99 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.59 1.46 7.81 59 L 7.41 4.32 0.00 1.62 1.76 0.76 1.18 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 60 V 7.90 3.86 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 0.96 0.00 0.00 1.03 0.00 0.00 61 D 8.86 4.57 0.00 2.88 2.66 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 62 K 8.82 3.90 0.00 1.79 1.83 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.39 7.81 63 R 8.81 3.69 0.00 1.43 1.27 0.00 2.88 0.00 0.00 2.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.14 0.00 64 F 7.90 4.79 0.00 3.20 3.03 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 65 R 7.48 3.98 0.00 1.88 1.89 0.00 3.50 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 66 G 8.95 4.01 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 0.00 0.00 0.00 67 R 8.35 4.71 0.00 1.94 1.98 0.00 3.06 0.00 0.00 3.40 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.89 0.00 68 A 7.79 5.22 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 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.92 4.64 0.00 2.01 1.71 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 2.21 2.27 0.00 70 L 8.58 4.73 0.00 1.81 1.66 1.18 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 71 M 8.60 4.49 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 72 G 7.57 4.59 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 0.00 73 N 8.49 4.95 0.00 2.68 2.55 0.00 0.00 6.62 7.65 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 74 M 9.09 4.38 0.00 2.37 2.49 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.64 0.00 75 D 8.06 4.66 0.00 2.64 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 76 H 8.28 4.77 0.00 3.06 3.17 0.00 5.78 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 77 K 7.57 2.94 0.00 1.42 0.83 0.00 1.19 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.95 1.07 7.81 78 V 7.48 4.62 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 1.04 0.00 0.00 0.87 0.00 0.00 79 C 9.07 5.12 0.00 2.03 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 80 N 8.34 5.08 0.00 2.93 2.78 0.00 0.00 7.11 6.74 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 81 L 8.28 4.65 0.00 0.27 0.50 0.59 -0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.90 4.90 0.00 1.66 1.56 0.89 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 83 L 9.10 4.89 0.00 1.43 1.46 0.48 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 84 K 9.22 4.41 0.00 1.59 1.72 0.00 2.05 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.44 7.81 85 D 8.72 4.31 0.00 2.71 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 4.36 0.00 1.82 1.59 0.98 0.70 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 K 9.59 4.89 0.00 1.85 1.76 0.00 1.66 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.59 7.81 88 P 0.00 4.33 0.00 2.20 2.13 0.00 3.62 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 2.13 2.13 0.00 89 E 8.17 4.06 0.00 1.92 2.02 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 2.31 2.42 0.00 90 D 7.92 4.64 0.00 2.90 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 91 S 8.13 4.62 0.00 4.01 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 92 G 8.17 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 0.00 0.00 0.00 93 T 7.96 5.28 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 1.38 0.00 0.00 94 Y 9.27 5.43 0.00 3.12 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 95 N 9.50 5.51 0.00 2.70 2.76 0.00 0.00 6.31 8.18 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 96 F 8.40 4.35 0.00 1.51 2.51 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 0.00 0.00 0.00 0.00 97 R 6.95 4.77 0.00 1.76 1.66 0.00 2.97 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.34 0.00 98 F 7.97 5.79 0.00 2.76 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.69 4.71 0.00 1.86 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 2.16 2.19 0.00 100 I 8.65 3.91 1.88 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.94 0.82 0.00 0.00 101 S 7.52 4.73 0.00 3.81 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.90 4.38 0.00 2.70 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 0.00 103 S 7.79 4.77 0.00 3.95 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 0.00 104 N 7.89 5.00 0.00 2.93 2.98 0.00 0.00 6.84 6.99 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 0.00 105 R 7.32 4.98 0.00 1.47 1.61 0.00 3.20 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.70 0.00 106 W 7.99 4.79 0.00 2.86 1.84 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 0.00 107 L 7.13 4.84 0.00 1.24 0.96 -0.26 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.75 4.67 0.00 2.94 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 0.00 109 V 8.22 3.76 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 0.53 0.00 0.00 0.88 0.00 0.00 110 K 8.31 3.95 0.00 1.85 1.95 0.00 2.07 0.00 0.00 1.81 0.00 0.00 3.12 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.52 1.58 7.81 111 G 8.87 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 0.00 0.00 0.00 112 T 8.94 4.84 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 1.31 0.00 0.00 113 T 9.17 4.76 4.50 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 1.29 0.00 0.00 114 V 9.70 4.93 2.38 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 1.01 0.00 0.00 0.78 0.00 0.00 115 T 8.59 4.83 4.29 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 1.27 0.00 0.00 116 V 9.03 4.47 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 0.82 0.00 0.00 1.05 0.00 0.00 117 T 9.13 4.69 4.26 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 1.29 0.00 0.00 118 T 8.26 4.21 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 * Residues marked with a * may have inaccurate shift predictions.