NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.4116 8.3149 122.0154 56.4054 33.2530 174.8295 3 V 4.2930 8.5939 120.2605 57.2339 35.7975 173.5239 4 T 4.6871 8.3681 113.1017 60.4378 72.4043 175.4071 5 F 4.0964 8.6911 122.7881 61.5700 39.1964 176.8651 6 E 3.8965 8.2706 117.4103 59.7437 29.4697 179.1616 7 Q 3.9772 7.9061 117.6605 58.7897 28.7747 178.9518 8 L 3.6091 7.8153 121.2377 58.0395 42.1364 178.9818 9 K 3.8780 7.8305 119.5118 59.1767 31.9286 178.6235 10 A 3.9057 8.1951 121.3278 55.1753 18.4995 179.5376 11 A 3.8779 7.7302 119.1345 55.0521 18.3388 179.9930 12 F 3.8633 7.5116 116.2461 60.5424 38.9202 177.3421 13 N 4.3917 8.5255 117.0318 56.7936 38.8031 176.9541 14 R 3.9232 8.3297 119.7754 59.4357 29.9948 179.1976 15 V 3.6661 7.5181 115.9840 65.9013 31.7673 177.7600 16 L 4.2031 8.2520 118.6262 58.0225 41.6020 179.4033 17 I 4.1870 8.2123 121.2723 63.8095 36.9230 178.1605 18 S 4.4144 8.0374 111.9820 59.7840 62.8468 175.2827 19 R 4.4936 7.9882 121.2834 56.0941 30.4531 175.9930 20 G 4.0593 8.2130 108.7871 45.5481 0.0000 175.2103 21 V 3.6593 7.7679 119.9851 62.7970 32.2152 175.1029 22 D 4.6201 8.6104 126.7239 53.0539 41.5230 176.7386 23 S 4.0087 8.6943 114.9107 62.1657 62.2658 175.9866 24 E 3.9297 8.3097 120.7524 60.0211 29.3486 178.9268 25 T 3.8955 8.6293 115.2083 66.6363 68.6065 176.3741 26 A 4.1169 8.5345 123.0220 55.3667 18.3044 179.2564 27 D 4.3931 8.3717 116.2110 57.3402 41.1020 178.3184 28 A 4.0038 7.8606 120.3206 55.2769 18.5040 178.8477 29 C 4.2380 8.3999 116.1391 62.6955 31.9900 175.2796 30 A 4.3066 8.2796 122.3800 55.0239 17.8463 179.5166 31 E 4.0964 8.3303 114.4179 57.4319 29.6264 178.4526 *33 F 4.2021 8.0264 117.5003 56.9926 41.0916 177.3184 34 A 4.2220 8.3799 122.2183 55.2434 18.1495 179.8646 35 R 4.0606 8.4167 116.7543 59.7412 30.1402 179.3695 36 T 3.6088 7.7488 114.9235 66.8445 68.4836 176.6898 37 T 3.6269 7.7614 117.3080 66.6082 68.3333 176.5578 38 E 4.2248 8.8368 121.2153 58.9636 29.3712 178.1868 39 S 4.4300 7.5270 112.8917 58.6519 63.1373 174.7607 40 G 4.0168 7.9556 110.7370 45.1768 0.0000 174.5219 41 V 4.1886 7.3615 121.2357 61.2971 30.9706 175.6767 42 Y 4.1698 8.4235 124.0067 60.1576 38.7532 178.0246 43 S 4.1988 8.5161 113.0544 61.7367 62.6181 175.2602 44 H 5.1588 8.2450 115.0359 54.8842 30.1984 174.9520 45 G 4.3228 8.0062 111.1537 44.3599 0.0000 177.2325 46 V 4.0136 8.8039 126.7008 64.6684 31.0906 178.0963 47 N 4.5482 8.4642 116.6477 55.6299 38.7698 175.4778 48 R 4.4987 8.3807 116.7870 56.3655 30.8555 177.5286 49 F 3.9555 8.3377 119.4997 61.6723 39.2600 174.9109 50 P 4.1048 0.0000 0.0000 65.6423 31.1969 178.3463 51 R 3.8879 8.0787 116.8365 59.3884 29.9629 177.9838 52 F 4.2678 8.2273 120.2017 61.5359 39.3542 177.1133 53 I 3.1512 7.5102 119.4832 64.0830 36.7119 177.9985 54 Q 3.9987 8.2096 120.7480 59.6087 28.7264 178.8139 55 Q 3.9601 8.0550 118.7698 58.5175 28.6929 178.4031 56 L 3.6858 7.5157 121.4823 58.2160 41.8820 178.9563 57 E 3.9117 7.9883 117.3617 59.3602 29.4589 178.6628 58 N 4.4862 7.5676 114.5157 54.2898 38.3629 176.1758 59 G 3.8895 7.9959 109.5970 44.9768 0.0000 175.1541 60 D 3.8846 7.4012 119.2218 55.9976 41.0038 176.7298 61 I 4.5586 6.8251 119.1989 59.3110 39.5915 175.5044 62 I 4.3081 8.1957 124.9630 58.7221 37.7739 174.5413 63 P 4.2430 0.0000 0.0000 65.9015 31.3566 177.9950 64 D 4.4274 8.1884 115.9493 57.0427 40.9884 177.4516 65 A 4.1649 7.4597 120.9101 52.7251 18.8746 176.4182 66 Q 4.6002 8.1805 119.6100 53.5059 32.3452 172.8806 67 P 4.9767 0.0000 0.0000 63.3014 32.5283 175.7382 68 K 4.6056 8.9231 119.7577 55.4031 36.0312 175.5479 69 R 2.5113 7.3937 124.0416 56.0184 30.2561 175.0259 70 I 4.2560 8.5486 125.2086 62.7365 39.3066 176.2128 71 T 4.6709 7.4461 116.6300 61.9391 73.2302 173.0723 72 S 4.9240 8.6338 120.2462 56.9488 65.3599 173.6780 73 L 4.5255 8.5693 124.3965 54.0853 43.1496 176.5728 74 G 4.0488 8.7148 107.9591 45.2512 0.0000 174.9373 75 A 4.0650 9.2283 129.3371 52.9811 20.7036 179.3257 76 I 5.1632 7.6573 108.8448 59.1308 41.1101 174.5630 77 E 5.2605 9.1755 122.7179 54.8953 34.2815 173.9279 78 Q 5.1297 9.1242 125.1688 54.5114 30.9973 174.3819 79 W 5.1800 9.8183 126.3169 54.8417 33.7744 174.0711 80 D 5.2799 9.1774 122.1167 52.4664 42.4062 176.8378 81 A 4.1152 9.3116 130.8134 53.4193 18.7264 177.2600 82 Q 3.8254 9.1788 114.0934 57.6604 27.0415 173.5822 83 R 3.8985 8.3144 111.5975 57.1737 28.4828 177.3410 84 S 4.9021 7.6954 111.7654 57.1061 64.8063 173.9770 85 I 4.0495 8.3459 121.0982 61.4331 37.7884 176.6022 86 G 4.3514 9.4345 113.9323 47.2591 0.0000 175.2620 87 N 5.1111 7.9499 120.7586 54.9572 37.6500 176.9008 88 L 3.9963 7.9629 121.2271 57.9389 41.5372 179.6616 89 T 3.8448 7.8534 113.9816 66.3393 68.4168 176.4777 90 A 3.5536 7.6230 122.0231 54.5516 18.3311 179.2612 91 K 4.2685 7.7326 117.1271 59.0610 34.0636 177.9503 92 K 3.9864 7.2907 119.6003 56.8216 29.9395 176.8835 *95 D 4.4331 7.8897 121.0033 54.0262 43.6678 178.3810 96 R 3.7742 7.5302 118.4650 58.9864 29.7982 178.3770 97 A 3.9596 7.6381 120.3432 54.9385 18.4424 179.5105 98 I 3.1278 7.3841 117.8925 64.4491 36.7860 178.3406 99 E 3.9599 7.9448 119.2832 59.3074 29.1497 179.4371 100 L 4.3325 7.7536 118.5176 57.5116 41.6670 179.2307 101 A 4.0229 8.2329 120.8588 54.8810 18.0432 179.4454 102 A 4.3585 7.9437 119.8873 53.9193 18.5318 178.4387 103 D 4.7974 7.4643 115.5519 54.5429 42.4562 176.6140 104 H 4.7632 8.7300 113.9985 54.8703 30.9110 173.4228 105 G 4.2566 9.9096 108.2227 45.0522 0.0000 173.3169 106 I 5.0256 7.2921 117.4774 59.3221 41.2707 174.5746 107 G 4.3366 9.3555 115.6590 44.4598 0.0000 171.3715 108 L 5.2857 8.8421 123.6358 53.3354 46.0599 174.7040 109 V 4.9062 9.1989 126.5658 61.0912 34.1302 173.8119 110 A 4.9423 9.2166 130.5995 50.2763 21.0155 174.8707 111 L 5.3768 8.9035 125.5160 53.5181 44.8324 175.6614 112 R 4.8978 8.8462 121.8627 53.8973 33.4131 174.7928 113 N 4.1431 8.5010 112.6339 54.3431 36.2683 174.3385 114 A 4.8018 8.2138 120.4945 51.0055 21.4649 176.3322 115 N 5.3473 8.1678 115.4237 51.1150 41.6992 174.0560 116 H 3.9171 8.8559 118.7596 56.8065 31.7744 172.8799 117 W 4.1436 8.9721 124.4796 57.6412 26.5612 178.3971 *119 R 3.8958 9.1038 123.9649 55.3323 30.4901 174.7960 120 G 2.6165 8.3860 113.5656 47.2083 0.0000 174.4742 121 G 3.5785 8.3539 108.1635 47.1250 0.0000 175.8037 122 S 3.7496 7.0976 116.0537 61.1847 62.4497 175.9698 123 Y 4.4907 7.0257 120.3875 60.3699 37.7847 178.0261 124 G 3.7249 7.9247 106.4698 47.1610 0.0000 175.5970 125 W 3.9559 8.4692 131.2044 60.3968 30.5990 178.0908 126 Q 4.0424 8.1191 115.9036 59.1760 28.0571 178.4822 127 A 4.1107 7.7553 121.2225 55.1395 18.4657 179.4724 128 A 4.6749 7.7453 120.5742 54.8858 18.1615 179.6350 129 E 3.7566 8.1140 116.4879 58.5769 29.4259 178.6676 130 K 4.5432 7.7255 116.7078 55.7136 32.5540 177.2735 131 G 3.7628 8.1487 107.1121 45.6892 0.0000 173.2738 132 Y 4.8421 7.4562 116.6454 56.0062 41.2028 174.9632 133 I 4.4994 8.8057 123.4855 61.0578 39.0026 175.1927 134 G 4.6002 9.2659 113.4579 44.5170 0.0000 171.8805 135 I 5.9525 9.1332 124.9524 58.7246 41.2710 174.1902 136 C 5.1416 8.8388 120.2174 57.3240 33.1491 172.5094 137 W 6.0073 8.3559 115.8045 57.1066 31.7290 172.7316 138 T 4.6518 8.2435 114.3893 60.6705 71.0246 171.6091 139 N 5.4516 7.8212 122.1041 52.3576 40.1497 172.7973 140 S 4.3906 7.7621 111.0830 58.1630 65.2749 174.2794 141 I 3.7474 8.3514 120.3031 60.3680 38.0712 175.6458 142 A 4.2971 8.3932 128.0522 53.1103 17.5005 178.4610 143 V 4.4191 7.9871 119.1564 61.0321 32.6189 174.8861 *145 P 4.8009 0.0000 0.0000 61.8048 32.6221 174.6217 146 P 4.4804 0.0000 0.0000 61.9668 31.9513 175.3336 147 W 4.6747 8.9843 130.5995 59.8618 30.7062 176.1620 148 G 3.5904 8.3470 113.5896 44.8728 0.0000 172.7150 149 A 4.6498 7.7627 122.1168 50.3177 21.2338 176.3986 150 K 4.4054 8.3591 116.2136 56.3060 34.3336 175.7136 151 E 4.6464 7.7231 120.9180 54.3327 31.5919 174.2859 152 C 4.7976 8.5197 122.9222 60.0292 28.5806 174.1149 153 R 4.6771 8.4942 119.7563 56.0943 33.5013 174.4434 154 I 4.6863 7.6942 118.5738 59.3961 40.4913 174.4200 155 G 4.4961 8.2116 110.4361 43.9066 0.0000 174.5051 156 T 3.8118 8.4507 108.0732 64.0556 69.2720 177.1245 157 N 4.6902 7.1720 116.6759 53.5521 34.3256 171.1060 158 P 4.4916 0.0000 0.0000 62.5742 33.1484 174.8432 159 L 4.9616 8.6607 126.0023 53.5123 43.8693 175.2253 160 I 4.9494 8.9819 127.1519 59.6441 40.3280 175.0867 161 V 4.8626 8.7990 125.6609 61.5498 34.2201 173.9915 162 A 5.0804 9.5622 130.1129 50.1780 22.0705 174.4647 163 I 4.7650 8.7951 122.9581 57.9017 39.6278 175.2430 164 P 4.3813 0.0000 0.0000 62.3454 30.3234 175.4615 165 S 4.5134 7.4918 113.6948 58.1463 65.3966 173.0161 166 T 4.4988 8.0236 116.5733 60.9668 69.8866 172.7399 167 P 4.5163 0.0000 0.0000 61.4214 32.5817 175.8576 168 I 3.8458 7.8550 119.0518 61.7000 37.2406 175.9564 169 T 4.7945 8.2610 123.3923 62.0022 71.3899 174.1708 *171 V 4.2848 8.0778 116.6476 61.5508 33.4965 174.2415 172 D 5.1960 8.4997 122.3383 52.7765 45.3314 173.7977 *174 S 4.6262 8.0745 118.9065 58.2389 64.8742 175.9553 *176 S 4.3806 8.3156 112.6966 57.8151 62.9685 174.2721 *178 F 4.4155 8.4961 116.8849 56.7796 39.6427 174.7885 179 S 4.5206 8.5303 118.3791 58.0230 63.5946 173.9104 180 Y 4.1104 8.9139 119.5796 61.3721 37.9607 179.8499 181 G 3.7140 7.7785 104.5685 46.0281 0.0000 175.1262 *183 L 4.1429 8.0354 121.8437 54.3846 43.8361 179.0775 184 E 3.9672 8.2492 118.6203 59.1156 29.5387 178.8364 185 V 3.5921 7.7952 118.3540 66.2326 31.5173 177.7815 186 N 4.2556 8.0415 115.4945 56.1622 38.4637 177.0326 187 R 3.8407 7.9610 119.9978 59.6730 29.9809 178.3778 188 L 4.0568 7.9082 117.0385 57.7736 41.7490 178.8105 189 A 4.2632 7.8363 117.8904 51.6471 18.7737 177.2666 190 G 3.9027 8.4866 105.7880 46.5068 0.0000 174.0139 191 R 4.6113 7.8845 114.3679 53.7242 32.0948 175.3652 192 Q 4.2495 8.2717 118.8897 55.0001 29.5749 175.6287 193 L 3.9029 8.3211 119.9135 53.7015 41.9884 176.8615 194 P 4.4559 0.0000 0.0000 64.2288 31.4535 176.0773 195 V 4.2883 7.3452 116.0070 60.7243 34.1407 172.2470 196 D 4.5246 8.9636 120.5406 55.6006 40.9696 177.0993 197 G 4.2494 9.8480 110.8878 43.6541 0.0000 172.2377 198 G 4.2481 6.9956 110.3468 45.3834 0.0000 171.6480 199 F 5.1803 8.4408 118.6759 55.6595 41.0817 176.2857 200 D 4.8734 8.4923 123.1423 52.1507 41.3633 176.8027 201 D 4.4110 8.6518 117.7686 57.3813 40.7384 177.4700 202 E 4.2089 8.7151 117.1694 56.6303 29.8543 177.0028 203 G 3.8891 8.4879 107.1171 45.8534 0.0000 172.7709 204 N 5.1457 8.3211 116.0237 50.4904 40.7892 174.4720 205 L 4.1679 8.7256 122.3497 55.5228 42.2378 176.4506 206 T 4.7148 9.3053 118.1661 60.3566 70.6530 173.7683 207 K 4.2422 8.3439 120.3252 55.7657 33.2191 175.4873 208 E 4.4658 8.1989 122.0227 54.4858 29.5370 174.7563 209 P 4.3209 0.0000 0.0000 65.8997 31.2583 178.5443 210 G 3.7076 8.1085 103.5534 47.8296 0.0000 175.4377 211 V 3.6743 7.4923 120.4449 66.0285 31.5668 178.2812 212 I 4.0093 7.7306 118.8863 64.4548 36.7736 178.1390 213 E 4.2902 8.2210 118.6670 59.0789 29.2906 178.9961 214 K 4.2856 7.7470 118.0514 58.4552 32.6702 178.1355 215 N 4.6555 8.0353 114.2235 52.4938 37.7923 175.4265 216 R 4.2389 7.6748 118.0718 56.5131 29.1678 177.1530 217 R 4.5969 9.1308 117.7624 55.5677 28.5173 176.6743 218 I 4.1541 7.6081 119.2951 60.9733 39.2764 175.8538 219 L 4.4444 8.5231 132.2767 53.0894 42.8342 174.2793 220 P 4.8259 0.0000 0.0000 62.1929 30.4615 178.2614 *222 G 3.6210 8.7670 117.7820 45.2225 0.0000 173.2463 223 Y 2.9454 7.0098 121.4896 58.2408 37.1089 174.0514 224 W 4.0266 7.1479 131.2514 59.8925 27.6101 177.5126 225 K 4.0817 7.0500 119.3462 59.4127 31.5847 179.2143 226 G 3.6093 7.6706 104.3258 47.5070 0.0000 175.2919 227 S 4.4897 8.0850 115.4810 61.1156 62.5407 177.2069 228 G 3.9203 7.9630 105.7219 45.3021 0.0000 175.1721 *230 S 4.3208 7.9959 116.4289 58.1040 64.1480 175.8618 231 I 3.6846 7.5365 119.0672 64.6499 36.9150 178.5362 232 V 3.7640 7.4019 111.3933 64.4450 31.6188 178.3281 233 L 3.9048 7.7165 118.2280 57.4835 41.3181 179.3725 234 D 4.6473 7.8168 115.8065 54.7616 41.0554 177.9602 *236 I 4.1220 7.7734 119.7282 60.8836 39.5050 177.8401 237 A 4.0094 8.4055 121.8932 55.5667 17.5992 179.9185 238 T 3.9896 8.2549 114.3333 66.7553 68.5892 176.9853 239 L 4.0438 7.8676 120.4543 57.8768 41.6238 179.3025 240 L 4.0362 8.0443 118.6417 57.1687 41.7588 178.4639 241 S 4.5287 7.5922 109.0465 57.0764 64.0966 173.1092 242 D 4.4014 7.8221 120.3070 55.9270 40.0303 171.7220 243 G 4.3741 7.6313 107.6514 43.7294 0.0000 172.1056 244 A 4.1457 8.4523 122.4270 51.8695 19.2442 178.4952 245 S 4.7965 8.1264 118.6387 55.9998 66.6138 175.4081 246 V 3.7233 8.5946 120.8192 65.5318 31.0989 177.6378 247 A 3.9518 7.9540 119.8339 55.1663 18.2107 178.9207 248 E 3.7915 7.8305 117.7120 59.4337 29.7808 178.8022 249 V 3.4551 7.9059 118.4400 66.5100 31.2861 177.9410 250 T 3.7994 7.6937 113.6700 66.7641 68.4110 176.2690 251 Q 4.1546 7.7835 118.0958 58.8282 29.1446 177.3799 252 D 4.4790 8.6496 118.6347 56.0529 41.2936 176.4109 253 N 4.9523 7.6518 115.6426 51.1645 40.4613 175.3333 254 S 4.2772 8.5018 115.7312 60.9039 63.4545 173.2818 255 D 4.6756 7.6517 117.7389 52.2832 44.2198 174.9126 256 E 4.1340 8.5422 121.7518 56.1617 27.4288 174.7029 257 Y 4.7473 7.4684 121.1176 56.5255 40.8246 174.8886 258 G 3.8816 8.9631 106.4003 46.4716 0.0000 173.9027 259 I 4.1503 7.7335 114.4872 60.1709 40.0007 174.2574 260 S 5.2555 9.6120 117.7374 56.9062 65.8315 173.8615 261 Q 4.5715 8.9086 121.7196 54.0033 33.3247 174.0226 262 I 4.4643 7.8604 122.8411 59.2375 40.3982 174.5226 263 F 5.0784 8.7506 124.7378 55.6580 42.2771 174.2384 264 I 5.2289 9.3134 123.7367 59.4501 41.2057 174.3278 265 A 5.1865 8.9452 126.9184 50.2390 22.5869 174.8632 266 I 4.9949 8.6453 122.0679 59.2473 41.0537 174.7898 267 E 4.3589 9.3787 128.7163 56.5512 30.5135 176.6116 268 V 4.1151 8.2262 124.3185 64.7046 33.3907 177.1565 269 D 4.5247 8.0133 118.9974 57.4672 40.6573 178.7432 270 K 4.0477 7.9103 115.6845 57.5792 32.4468 177.2531 271 L 4.5117 7.8169 117.8608 54.8400 42.7086 176.3840 272 I 4.3138 6.9221 116.6930 58.4530 41.3990 174.3488 273 D 4.6460 8.5760 127.1100 54.0535 42.7246 177.9156 274 G 3.5926 8.5422 108.6311 47.5331 0.0000 174.3408 275 P 4.2195 0.0000 0.0000 65.7439 31.4191 178.9102 276 T 3.8844 7.8361 114.0144 66.3805 68.3672 176.5786 277 R 3.8491 8.2351 121.0226 59.6956 30.1535 178.4423 278 D 4.3637 8.1637 118.4097 56.9156 40.7358 178.7486 279 A 3.9239 8.1044 121.4292 55.2491 18.3852 179.8822 280 K 3.9317 8.3409 117.3724 59.6159 31.8724 179.7220 281 L 4.0096 7.7088 118.4190 57.6469 41.5592 178.9891 282 Q 4.0993 7.8369 119.1047 59.0369 29.2870 177.8257 283 R 4.1125 8.0554 119.9478 59.2442 30.0660 178.5543 284 I 3.7225 7.3188 115.9443 62.5361 36.7797 177.3502 *286 D 4.7095 7.9851 121.9188 54.6225 42.6838 177.3225 287 Y 4.1714 8.0876 119.3519 60.3851 39.3030 177.3801 288 V 3.7127 7.9771 119.6231 65.9081 31.9994 178.2684 289 T 3.9211 7.8616 109.5914 64.1593 68.7281 175.3481 290 S 4.5004 7.7571 114.4399 58.1758 63.4947 174.2872 291 A 4.0495 7.3320 123.9899 51.6898 18.6730 177.4229 292 E 3.9859 8.4612 119.8107 56.4333 29.0874 177.7742 293 R 4.0450 8.4615 123.1168 55.8955 30.8092 177.7235 294 A 4.0267 8.4583 124.2907 54.2334 18.9821 177.1377 295 D 4.5443 7.6899 116.1417 52.3008 43.0493 175.4971 296 E 4.0328 8.9845 125.9450 58.9797 29.4772 177.1078 297 N 4.7802 8.7526 117.5785 52.5680 38.9948 175.7273 298 Q 4.2458 7.4834 115.6077 55.3061 30.9285 173.1498 299 A 4.1914 8.3715 128.2364 51.7269 19.2117 176.9616 300 I 4.0244 8.0811 121.5187 60.7979 37.9571 176.0172 301 R 4.6266 8.1826 120.6124 54.0150 31.9684 175.4529 302 L 4.1690 8.0858 120.9729 53.2027 42.5240 174.6158 303 P 4.2965 0.0000 0.0000 64.4592 31.6042 176.7598 304 G 4.1173 8.5760 110.3232 46.1668 0.0000 175.0705 305 H 4.3071 7.9775 116.9076 58.6021 28.5450 177.2953 306 E 4.3049 7.7932 120.2337 58.4361 29.2063 178.4697 307 F 4.6075 7.5618 117.3604 59.3579 39.1764 176.6671 308 T 4.4307 8.0184 116.2374 65.8172 69.2352 177.0746 309 T 3.8842 7.7298 111.1666 64.9027 68.9810 176.4336 310 L 4.0193 8.4002 122.6101 57.0885 41.6041 179.1967 311 L 4.1090 8.1595 120.8754 57.5691 41.8838 178.5467 312 A 3.9731 7.6426 119.1262 55.2135 18.4967 178.9189 313 E 4.0147 8.3217 117.5727 59.7117 29.8187 178.7423 314 N 4.5551 8.5352 118.0758 55.8226 38.3240 177.4532 315 R 4.0457 7.8368 118.3410 58.3495 30.1800 178.4135 316 R 4.2949 7.9668 117.3699 57.6706 30.8673 177.4619 317 N 4.8445 8.2286 112.2877 51.9837 40.1996 175.2391 318 G 3.9181 8.2258 107.6674 44.9638 0.0000 172.0999 319 I 4.4299 8.2268 118.9618 60.0144 38.4059 175.3828 320 T 4.7031 8.5071 121.0749 61.7208 70.0760 174.0389 321 V 4.4992 7.8780 125.5613 60.3116 34.3435 175.0862 322 D 4.4392 8.5475 124.5933 54.4127 42.8254 176.9373 323 D 4.4854 8.8376 126.7894 57.7802 40.9955 179.3199 324 S 4.2470 8.3610 114.5682 61.1649 63.0677 176.8453 325 V 3.6638 7.9597 121.5913 65.7267 31.5442 177.7365 326 W 4.3453 8.7055 127.8726 60.0855 30.5450 177.7836 327 A 3.9909 7.9853 120.8688 54.9281 17.8295 179.7065 328 K 3.9684 7.9577 116.6208 59.6073 31.8552 179.7047 329 I 3.8186 7.5870 119.7237 64.2886 36.8338 178.3944 330 Q 3.7679 7.5322 117.4619 58.0806 28.3772 177.9363 331 A 4.1962 7.6122 121.5324 54.4168 18.6120 179.4631 332 L 3.9350 7.4085 116.5141 57.6866 41.6461 179.3105 333 L 4.1606 7.3446 117.1616 56.4577 41.7770 176.5237 334 E 4.2082 7.5923 122.8531 56.1217 29.7131 175.1229 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 K 8.31 4.41 0.00 1.68 1.70 0.00 1.66 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.46 7.81 3 V 8.59 4.29 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 -0.35 0.00 0.00 0.57 0.00 0.00 4 T 8.37 4.69 4.27 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 1.19 0.00 0.00 5 F 8.69 4.10 0.00 3.26 3.11 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 6 E 8.27 3.90 0.00 2.12 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 2.46 2.56 0.00 7 Q 7.91 3.98 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 8 L 7.82 3.61 0.00 1.76 1.33 0.98 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 9 K 7.83 3.88 0.00 1.25 1.51 0.00 1.71 0.00 0.00 1.62 0.00 0.00 3.14 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.40 1.46 7.81 10 A 8.20 3.91 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.73 3.88 1.04 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 12 F 7.51 3.86 0.00 3.08 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 13 N 8.53 4.39 0.00 2.99 2.98 0.00 0.00 7.28 7.31 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 14 R 8.33 3.92 0.00 1.85 1.97 0.00 3.16 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 15 V 7.52 3.67 2.60 0.00 0.00 0.00 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 1.06 0.00 0.00 16 L 8.25 4.20 0.00 2.07 1.82 1.23 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.21 4.19 2.03 0.00 0.00 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 1.24 2.11 0.93 0.00 0.00 18 S 8.04 4.41 0.00 4.03 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 19 R 7.99 4.49 0.00 1.86 1.88 0.00 3.23 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.65 0.00 20 G 8.21 4.06 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 0.00 0.00 0.00 21 V 7.77 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 1.11 0.00 0.00 1.01 0.00 0.00 22 D 8.61 4.62 0.00 3.01 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 23 S 8.69 4.01 0.00 3.92 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 24 E 8.31 3.93 0.00 2.09 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 0.00 2.41 2.45 0.00 25 T 8.63 3.90 4.37 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 1.29 0.00 0.00 26 A 8.53 4.12 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 27 D 8.37 4.39 0.00 2.86 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 28 A 7.86 4.00 1.40 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 29 C 8.40 4.24 0.00 3.17 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 30 A 8.28 4.31 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.33 4.10 0.00 2.23 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 2.39 2.50 0.00 *33 F 8.03 4.20 0.00 2.78 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 0.00 0.00 0.00 34 A 8.38 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 8.42 4.06 0.00 1.83 1.94 0.00 3.25 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.90 0.00 36 T 7.75 3.61 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 1.05 0.00 0.00 37 T 7.76 3.63 4.41 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 1.08 0.00 0.00 38 E 8.84 4.22 0.00 2.28 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 2.28 2.40 0.00 39 S 7.53 4.43 0.00 3.81 3.51 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 40 G 7.96 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 0.00 0.00 0.00 41 V 7.36 4.19 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 0.95 0.00 0.00 0.74 0.00 0.00 42 Y 8.42 4.17 0.00 3.11 3.08 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 43 S 8.52 4.20 0.00 3.87 4.09 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 44 H 8.24 5.16 0.00 3.17 3.33 0.00 5.65 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 45 G 8.01 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 0.00 0.00 0.00 0.00 46 V 8.80 4.01 2.49 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 1.00 0.00 0.00 1.30 0.00 0.00 47 N 8.46 4.55 0.00 3.25 3.07 0.00 0.00 6.78 7.66 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 48 R 8.38 4.50 0.00 2.28 2.16 0.00 3.24 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 49 F 8.34 3.96 0.00 2.86 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 50 P 0.00 4.10 0.00 2.24 2.11 0.00 3.93 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 51 R 8.08 3.89 0.00 1.98 2.22 0.00 3.27 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 52 F 8.23 4.27 0.00 3.29 3.11 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 53 I 7.51 3.15 1.66 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.14 0.69 0.00 0.00 54 Q 8.21 4.00 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 55 Q 8.06 3.96 0.00 2.22 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.63 2.50 0.00 56 L 7.52 3.69 0.00 1.18 1.48 0.76 0.59 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 57 E 7.99 3.91 0.00 2.00 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 0.00 2.24 2.45 0.00 58 N 7.57 4.49 0.00 2.71 2.80 0.00 0.00 7.27 9.01 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 59 G 8.00 3.89 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 0.00 60 D 7.40 3.88 0.00 2.60 2.50 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 61 I 6.83 4.56 1.74 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.55 0.96 0.00 0.00 62 I 8.20 4.31 1.87 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 1.25 0.65 0.93 0.00 0.00 63 P 0.00 4.24 0.00 2.04 2.17 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 64 D 8.19 4.43 0.00 2.65 2.76 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 65 A 7.46 4.16 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 66 Q 8.18 4.60 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 67 P 0.00 4.98 0.00 2.12 2.14 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.13 0.00 68 K 8.92 4.61 0.00 1.69 1.85 0.00 1.41 0.00 0.00 1.57 0.00 0.00 2.73 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.53 1.35 7.81 69 R 7.39 2.51 0.00 0.67 1.06 0.00 3.24 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.69 0.00 70 I 8.55 4.26 1.88 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.00 0.85 0.00 0.00 71 T 7.45 4.67 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 1.19 0.00 0.00 72 S 8.63 4.92 0.00 3.69 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 73 L 8.57 4.53 0.00 1.64 1.68 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.71 4.05 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 75 A 9.23 4.06 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 76 I 7.66 5.16 1.89 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 1.35 0.95 0.92 0.00 0.00 77 E 9.18 5.26 0.00 2.22 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 2.30 2.34 0.00 78 Q 9.12 5.13 0.00 2.13 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 79 W 9.82 5.18 0.00 3.22 3.11 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 80 D 9.18 5.28 0.00 2.66 2.54 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 81 A 9.31 4.12 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 82 Q 9.18 3.83 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.71 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 83 R 8.31 3.90 0.00 2.00 1.98 0.00 3.26 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 84 S 7.70 4.90 0.00 4.07 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 85 I 8.35 4.05 1.98 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.00 1.12 0.00 0.00 86 G 9.43 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 0.00 0.00 0.00 0.00 87 N 7.95 5.11 0.00 2.98 3.04 0.00 0.00 6.73 6.67 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 88 L 7.96 4.00 0.00 1.75 1.79 1.00 0.77 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 89 T 7.85 3.84 4.37 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 1.16 0.00 0.00 90 A 7.62 3.55 0.75 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 91 K 7.73 4.27 0.00 1.93 2.04 0.00 1.83 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.68 7.81 92 K 7.29 3.99 0.00 1.77 1.53 0.00 1.68 0.00 0.00 1.57 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.57 7.81 *95 D 7.89 4.43 0.00 2.87 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.53 3.77 0.00 1.49 1.45 0.00 3.09 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.57 0.00 97 A 7.64 3.96 1.26 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 98 I 7.38 3.13 1.79 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 1.19 0.57 0.14 0.00 0.00 99 E 7.94 3.96 0.00 2.16 1.98 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 2.29 2.41 0.00 100 L 7.75 4.33 0.00 1.88 1.72 0.95 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.23 4.02 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 0.00 102 A 7.94 4.36 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 0.00 0.00 0.00 0.00 0.00 103 D 7.46 4.80 0.00 2.75 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 0.00 104 H 8.73 4.76 0.00 3.34 3.33 0.00 5.83 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 0.00 105 G 9.91 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 0.00 106 I 7.29 5.03 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.06 0.95 0.00 0.00 107 G 9.36 4.34 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 0.00 108 L 8.84 5.29 0.00 1.70 1.47 0.95 0.69 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 0.00 109 V 9.20 4.91 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 0.76 0.00 0.00 0.78 0.00 0.00 110 A 9.22 4.94 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 0.00 111 L 8.90 5.38 0.00 1.89 1.64 1.09 0.87 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 0.00 112 R 8.85 4.90 0.00 1.90 2.02 0.00 2.99 0.00 0.00 3.52 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 113 N 8.50 4.14 0.00 3.08 2.96 0.00 0.00 6.60 7.93 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 0.00 114 A 8.21 4.80 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 0.00 115 N 8.17 5.35 0.00 3.07 2.88 0.00 0.00 6.41 8.16 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 0.00 116 H 8.86 3.92 0.00 3.26 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 W 8.97 4.14 0.00 3.48 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 *119 R 9.10 3.90 0.00 1.70 1.55 0.00 2.81 0.00 0.00 2.87 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.42 0.00 120 G 8.39 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 0.00 0.00 0.00 121 G 8.35 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.10 3.75 0.00 3.55 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 7.03 4.49 0.00 3.02 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 0.00 124 G 7.92 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 0.00 0.00 0.00 125 W 8.47 3.96 0.00 3.44 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 0.00 126 Q 8.12 4.04 0.00 2.29 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.74 0.00 0.00 0.00 0.00 0.00 2.61 2.39 0.00 127 A 7.76 4.11 1.46 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 0.00 0.00 128 A 7.75 4.67 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 0.00 129 E 8.11 3.76 0.00 2.08 1.98 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 2.17 1.79 0.00 130 K 7.73 4.54 0.00 2.08 2.02 0.00 1.78 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.65 7.81 131 G 8.15 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 0.00 132 Y 7.46 4.84 0.00 3.01 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 0.00 133 I 8.81 4.50 1.94 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 1.18 0.96 1.01 0.00 0.00 134 G 9.27 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 9.13 5.95 2.02 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.36 1.24 0.00 0.00 136 C 8.84 5.14 0.00 2.93 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 184 E 8.25 3.97 0.00 2.16 2.23 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 2.36 2.37 0.00 185 V 7.80 3.59 2.11 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 0.97 0.00 0.00 1.06 0.00 0.00 186 N 8.04 4.26 0.00 2.89 2.96 0.00 0.00 6.70 7.66 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 0.00 187 R 7.96 3.84 0.00 1.88 2.09 0.00 3.13 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 188 L 7.91 4.06 0.00 1.79 1.91 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 189 A 7.84 4.26 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 0.00 190 G 8.49 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 0.00 191 R 7.88 4.61 0.00 1.84 1.84 0.00 3.02 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.49 0.00 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7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.78 0.00 278 D 8.16 4.36 0.00 2.73 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 0.00 279 A 8.10 3.92 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 0.00 280 K 8.34 3.93 0.00 1.85 1.85 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.55 7.81 281 L 7.71 4.01 0.00 1.72 1.73 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 282 Q 7.84 4.10 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 283 R 8.06 4.11 0.00 1.92 2.02 0.00 3.10 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 284 I 7.32 3.72 2.03 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 1.51 0.98 0.94 0.00 0.00 *286 D 7.99 4.71 0.00 2.85 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 0.00 287 Y 8.09 4.17 0.00 3.07 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 0.00 288 V 7.98 3.71 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 0.89 0.00 0.00 1.04 0.00 0.00 289 T 7.86 3.92 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 1.20 0.00 0.00 290 S 7.76 4.50 0.00 4.02 4.06 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 0.00 291 A 7.33 4.05 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 0.00 292 E 8.46 3.99 0.00 1.93 1.89 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 2.28 2.25 0.00 293 R 8.46 4.04 0.00 1.85 1.92 0.00 3.11 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 294 A 8.46 4.03 1.26 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 0.00 295 D 7.69 4.54 0.00 2.84 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 0.00 0.00 0.00 296 E 8.98 4.03 0.00 2.10 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 0.00 2.27 2.35 0.00 297 N 8.75 4.78 0.00 2.78 2.86 0.00 0.00 6.76 6.64 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 0.00 298 Q 7.48 4.25 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 299 A 8.37 4.19 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 0.00 300 I 8.08 4.02 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.55 0.87 0.00 0.00 301 R 8.18 4.63 0.00 1.83 1.84 0.00 2.97 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.55 0.00 302 L 8.09 4.17 0.00 1.11 1.39 0.85 0.97 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 0.00 303 P 0.00 4.30 0.00 2.21 2.07 0.00 3.72 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 2.00 1.97 0.00 304 G 8.58 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 0.00 0.00 0.00 0.00 305 H 7.98 4.31 0.00 3.29 3.37 0.00 5.64 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 0.00 306 E 7.79 4.30 0.00 2.02 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 0.00 1.48 1.84 0.00 307 F 7.56 4.61 0.00 3.05 2.50 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 0.00 308 T 8.02 4.43 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 1.28 0.00 0.00 309 T 7.73 3.88 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 0.00 310 L 8.40 4.02 0.00 1.79 1.81 0.98 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 311 L 8.16 4.11 0.00 1.77 1.86 0.88 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 312 A 7.64 3.97 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 0.00 313 E 8.32 4.01 0.00 2.23 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 0.00 2.32 2.41 0.00 314 N 8.54 4.56 0.00 3.05 2.89 0.00 0.00 6.58 7.63 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 0.00 315 R 7.84 4.05 0.00 1.96 1.96 0.00 3.34 0.00 0.00 3.10 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.76 0.00 316 R 7.97 4.29 0.00 1.91 1.97 0.00 3.12 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 317 N 8.23 4.84 0.00 2.66 2.82 0.00 0.00 7.07 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 0.00 318 G 8.23 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 0.00 319 I 8.23 4.43 1.97 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.75 1.04 0.00 0.00 320 T 8.51 4.70 4.18 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 1.13 0.00 0.00 321 V 7.88 4.50 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 1.02 0.00 0.00 0.96 0.00 0.00 322 D 8.55 4.44 0.00 2.85 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 323 D 8.84 4.49 0.00 2.79 2.77 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 0.00 324 S 8.36 4.25 0.00 4.11 4.16 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 0.00 325 V 7.96 3.66 2.41 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 1.22 0.00 0.00 1.04 0.00 0.00 326 W 8.71 4.35 0.00 3.41 3.10 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 0.00 327 A 7.99 3.99 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 0.00 328 K 7.96 3.97 0.00 2.00 1.89 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.76 7.81 329 I 7.59 3.82 1.44 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.41 0.71 0.00 0.00 330 Q 7.53 3.77 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 1.30 2.19 0.00 331 A 7.61 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 0.00 332 L 7.41 3.94 0.00 1.79 1.74 0.92 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 333 L 7.34 4.16 0.00 1.73 1.66 0.74 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 334 E 7.59 4.21 0.00 1.85 1.73 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 2.18 2.18 0.00 * Residues marked with a * may have inaccurate shift predictions.