NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4729 8.3049 118.1933 54.6980 33.2337 176.1839 2 L 3.8949 7.9549 119.1726 54.9860 42.0668 175.1961 3 G 4.0023 8.9098 107.1173 46.2010 0.0000 173.4907 4 L 4.1806 8.0560 118.2497 54.6167 42.3094 177.5029 5 K 4.5271 8.4391 120.5942 56.2288 32.7052 176.6299 6 T 4.1809 7.6012 109.2525 61.7201 69.5945 174.8501 7 S 4.3594 9.4722 119.5277 61.2162 63.5977 174.7243 8 I 4.3052 8.5266 118.0754 62.8614 39.0597 175.8505 9 I 4.0217 7.8874 122.3941 63.6702 36.8012 176.2262 10 G 4.1513 9.0573 114.6381 45.1657 0.0000 174.2065 11 R 4.1118 7.7762 119.0987 58.7263 30.5119 177.2448 12 R 4.8439 7.7126 114.7946 54.3943 34.8245 174.5607 13 V 4.9767 8.4220 121.1423 61.3364 34.7788 174.3479 14 I 4.4310 9.2560 128.9680 59.8780 39.2667 173.7709 15 Y 5.2070 8.5131 128.5390 55.9859 40.7074 174.5843 16 F 4.1952 8.2200 124.1411 55.3616 40.5968 176.2161 17 Q 4.0747 8.2846 122.1067 58.2810 29.6896 176.0219 18 E 5.0132 7.8176 116.9696 55.0543 32.8338 174.0885 19 I 4.5074 8.2162 124.5495 59.9703 41.9031 175.6957 20 T 4.0565 8.4700 116.2024 63.7942 69.9371 174.5643 21 S 4.8604 7.5100 116.8595 55.3655 65.5735 174.8369 22 T 3.8091 9.1810 119.6595 64.8668 68.3733 176.6442 23 N 4.3175 8.0345 118.8965 56.0078 38.6764 176.7703 24 E 3.9110 8.1627 120.7434 59.2007 29.7621 178.6223 25 F 3.9604 8.2057 120.4662 61.3040 39.2459 176.9790 26 A 4.0606 8.0796 119.1816 55.0020 18.1829 179.5220 27 K 4.0663 7.9477 116.6974 59.3966 32.3418 178.9573 28 T 4.1764 7.7005 106.9687 61.4452 69.6472 174.6293 29 S 4.5707 6.8069 117.6671 56.5485 65.0181 173.1216 30 Y 4.2208 8.3933 125.3751 57.2227 38.9117 174.8311 31 L 4.5623 7.3686 126.3448 52.3847 46.1193 176.1879 32 E 3.9542 8.3232 120.1039 55.6018 30.3421 175.9652 33 E 4.1122 8.4066 121.1878 58.0598 30.1910 177.3955 34 G 3.9565 9.3619 114.0235 45.2325 0.0000 173.3611 35 T 4.4806 7.7017 117.6089 63.6646 69.7864 173.4086 36 V 4.7914 8.7709 126.1919 61.2857 34.0956 174.1554 37 I 5.2219 9.1780 129.2925 59.6885 39.3542 175.0891 38 V 5.2206 9.2121 126.0839 60.1037 34.9391 174.3095 39 A 5.1040 8.8043 123.6372 50.3487 21.8280 176.0422 40 D 4.8061 8.9845 120.7082 57.3073 42.1655 176.7296 41 K 4.8662 7.8815 113.3243 55.8663 36.2690 174.8771 42 Q 5.0037 7.9856 121.2983 54.5927 30.5368 175.8994 43 T 4.1057 8.9125 113.8833 62.6035 70.4681 174.4871 44 M 4.7191 7.7426 121.4557 53.3316 31.0274 176.3756 45 G 3.6697 7.4924 108.8796 46.2671 0.0000 173.1204 *55 S 2.9706 7.4598 117.9044 57.6498 63.4123 172.4572 56 P 4.8369 0.0000 0.0000 61.7636 33.5518 176.5280 57 E 4.5727 8.1439 121.3307 57.3063 29.6144 176.3552 58 G 4.0362 9.3770 113.9403 45.3780 0.0000 173.7881 59 G 3.4381 7.5323 106.5258 44.6118 0.0000 173.1301 60 L 4.2315 7.4455 122.1898 53.0096 43.6664 175.3165 61 W 5.4658 8.2905 127.4684 55.0731 31.6798 174.7846 62 L 5.3067 8.9475 124.3837 54.8817 44.2749 174.8985 63 S 5.2237 9.4316 114.7202 56.9663 67.5928 173.3234 64 I 4.9194 8.6654 123.6935 59.4654 40.6244 174.7212 65 V 4.3205 8.5599 127.2298 62.2578 32.6606 174.7991 66 L 4.9411 9.1149 127.2842 52.8026 45.7157 176.7131 67 S 4.8620 9.0862 116.8069 56.3917 63.9180 172.1499 68 P 4.7148 0.0000 0.0000 63.1389 32.3208 178.7124 69 K 4.3560 8.4561 125.2261 55.0501 30.5843 175.6608 70 V 4.5016 7.1237 112.8556 58.0930 35.9385 174.2147 71 P 4.3583 0.0000 0.0000 62.7730 31.8345 177.3235 72 Q 3.9963 9.0005 122.2101 59.6296 28.5429 179.5247 73 K 4.0943 8.0818 117.6997 59.5324 32.8852 177.8902 74 D 4.7110 8.3283 119.7855 55.7588 40.6514 178.2141 75 L 4.1475 7.7493 120.0707 57.5870 41.4064 177.7038 76 P 4.4808 0.0000 0.0000 65.0188 31.7559 177.3404 77 K 4.3375 8.5455 116.9785 57.5154 32.5703 178.8098 78 I 3.3477 7.4304 120.5659 64.3886 36.9603 178.0235 79 V 3.3626 7.4108 118.3304 66.1197 31.0712 177.9852 80 F 4.4226 7.3778 117.1084 60.1773 38.5539 177.6669 81 L 4.0805 7.7761 119.1779 57.6512 41.4184 179.7218 82 G 3.4866 7.9249 104.8876 47.6491 0.0000 175.4091 83 A 3.9928 7.8421 123.4007 54.9436 18.3705 179.9785 84 V 3.6834 8.2798 117.3132 65.9225 31.5877 178.3786 85 G 3.6095 8.3634 105.8767 47.8189 0.0000 175.8382 86 V 3.5670 7.8852 120.6958 65.6242 31.5757 178.2076 87 V 3.5807 7.8006 118.0090 66.1522 31.2221 177.8775 88 E 4.0095 8.4916 118.5125 59.6968 28.7554 179.5264 89 T 3.9760 8.0710 115.7685 66.6346 68.4636 176.7000 90 L 4.0622 8.2806 121.3061 57.7675 41.6343 179.4670 91 K 4.1349 8.1131 120.8123 59.0789 31.8736 178.6895 92 E 4.0201 7.9446 117.7841 58.5775 29.3170 178.2325 93 F 4.4478 7.6112 114.8125 56.4854 39.4079 175.6628 94 S 3.8841 8.1783 113.1513 60.0006 60.2628 171.1173 95 I 4.4313 8.0312 120.3295 59.6172 39.5039 175.0281 96 D 4.5313 8.7171 125.6211 53.0404 40.1816 175.6767 97 G 4.1700 8.2559 111.2464 44.7939 0.0000 171.4261 98 R 4.9597 8.9307 121.5859 53.9949 34.2616 174.8273 99 I 4.4666 9.0020 124.4745 60.9520 38.8761 175.0078 100 K 4.9098 9.2256 129.7845 54.3046 32.8046 175.3191 101 W 4.5587 9.0783 135.0000 57.6488 30.8924 173.8370 102 P 4.2864 0.0000 0.0000 62.4916 31.9386 175.0330 103 N 4.9317 7.7776 114.7668 52.3398 39.1824 173.2425 104 D 5.4661 8.2672 119.2331 52.7624 44.8796 175.0298 105 V 4.5431 8.6119 120.2725 61.2350 34.4078 174.4730 106 L 5.2979 9.2193 127.3428 52.9206 45.6323 175.6856 107 V 4.4317 8.4843 120.9327 61.2916 34.3221 175.4054 108 N 4.2026 9.5697 126.6940 54.8340 35.9706 174.6504 109 Y 3.4984 7.9006 111.0625 58.3393 35.9838 169.5445 110 K 4.6768 7.8625 120.7511 54.0635 33.9710 175.6131 111 K 4.5117 8.6850 125.4804 56.9574 32.7329 176.5873 112 I 4.6317 9.1581 126.2712 61.1452 40.9418 174.4733 113 A 5.1552 7.8031 121.6393 50.8182 22.7467 175.2041 114 G 4.4522 9.2588 106.1706 43.5155 0.0000 171.7343 115 V 4.9540 8.6187 122.8466 60.7671 34.3110 174.9512 116 L 4.6604 8.9544 126.8059 53.1097 45.4718 175.2870 117 V 4.7667 8.4341 124.0866 61.2711 33.3489 174.3428 118 E 4.8441 8.9333 126.2005 54.9198 34.0480 174.4039 119 G 4.4384 8.3185 105.9194 45.9604 0.0000 173.5240 120 K 4.3523 9.1771 119.3522 56.3438 36.3119 175.8143 121 G 3.8087 8.4912 115.2129 47.1132 0.0000 173.0284 122 D 4.6883 8.8243 125.2671 53.9231 41.3824 175.2307 123 K 4.8670 7.7643 118.9658 53.9064 34.8945 174.7584 124 I 4.9004 9.2654 128.1035 59.4634 40.4323 174.5198 125 V 4.6397 8.8061 127.0323 61.1061 33.7036 174.1404 126 L 4.6208 8.8877 131.7913 53.8437 43.0644 175.0885 127 G 4.5092 8.9016 114.9775 44.0925 0.0000 171.7029 128 I 5.1759 9.0526 124.4531 59.2798 41.7044 174.4590 129 G 4.7454 9.3062 113.7618 44.4050 0.0000 171.3033 130 L 5.1050 8.3690 127.6913 53.0563 45.5376 175.0106 131 N 4.4203 9.1683 124.6975 53.5312 39.0425 173.9218 132 V 4.1380 8.8841 123.9922 62.3182 33.1508 175.7811 133 N 5.0584 8.6263 120.6564 52.8244 40.2148 174.7146 134 N 4.8134 8.0592 116.4907 52.2487 38.5469 175.3042 135 K 4.2415 8.6107 119.7052 56.6007 32.8970 177.0334 136 V 4.6253 7.8873 114.4252 58.5781 35.5302 174.0039 137 P 4.4445 0.0000 0.0000 62.0368 31.8800 175.9380 138 N 4.5073 8.5389 118.6315 54.8818 37.3919 174.9139 139 G 3.9150 9.2005 109.3603 44.8608 0.0000 172.8119 140 A 4.7101 7.5022 120.4891 50.9739 21.5328 175.0187 141 T 4.8206 8.6447 113.3539 61.3937 71.3025 172.2747 142 S 4.7499 8.2857 115.6395 56.1233 66.3406 175.2021 143 M 4.0211 8.8499 120.4011 58.3239 31.4383 179.1179 144 K 4.3922 8.2174 121.4610 59.1259 32.1759 178.9643 145 L 4.0043 7.8058 118.1145 57.7086 41.5645 179.0089 146 E 4.1404 8.1620 117.9992 58.8105 29.5596 178.4766 147 L 4.4449 8.1652 117.3803 54.2821 42.1731 177.6485 148 G 3.9305 9.4643 106.8658 45.5483 0.0000 173.1280 149 S 4.5617 7.3777 111.7017 56.4496 65.4149 173.3974 150 E 4.2515 8.6995 122.8288 56.3229 29.8479 176.0478 151 V 4.2568 8.8131 126.4633 60.0571 33.1380 172.9789 152 P 4.2259 0.0000 0.0000 62.8095 31.5241 176.4705 153 L 3.8628 8.7288 126.0174 58.2551 41.8596 178.5803 154 L 4.0349 7.9055 119.8418 58.0625 42.0401 178.9076 155 S 4.2458 8.0302 114.3394 61.3183 62.8228 176.7877 156 V 3.5099 7.7464 121.4509 65.5548 31.2703 177.4425 157 F 4.0319 8.2550 120.4092 61.4876 39.2567 177.1465 158 R 3.9083 8.5348 117.8822 59.3775 29.9332 178.9747 159 S 4.0895 8.1304 112.6943 61.3629 62.3862 175.9822 160 L 4.2190 7.9947 124.5404 57.7167 41.7635 178.9469 161 I 3.4961 7.6568 120.0371 64.4666 37.0610 178.5392 162 T 3.8225 7.8136 116.5015 66.7614 68.2437 176.4645 163 N 4.3588 8.1828 118.2499 56.3491 38.4912 177.5306 164 L 3.9621 8.2412 120.8020 57.6990 41.6181 179.0542 165 D 4.3739 8.3115 118.1792 57.2688 41.3000 178.2999 166 R 3.8933 7.8932 118.7452 59.5683 30.1245 178.4351 167 L 4.0714 8.1838 118.9736 57.9747 41.5748 179.0284 168 Y 4.2557 8.4900 119.8178 60.7876 38.2560 177.8470 169 L 3.8833 8.2349 120.0806 57.8139 41.5990 179.0766 170 N 4.5784 8.2032 116.7512 56.3918 38.6666 176.7311 171 F 3.8687 8.1752 121.5943 61.2930 39.5216 176.9014 172 L 3.8651 7.7000 117.5851 56.5953 41.3239 178.6682 173 K 4.3280 7.0410 117.4474 56.8998 34.7954 176.7901 174 N 4.9454 8.4894 117.3387 50.3146 38.3481 173.4422 175 P 3.9376 0.0000 0.0000 64.9514 31.9379 178.3005 176 M 4.2718 7.8180 118.2883 57.3800 32.8630 177.8381 177 D 4.3998 8.1228 119.2379 57.5222 40.8392 178.5660 178 I 3.7734 7.9696 118.4303 64.1307 37.8636 177.7072 179 L 3.8309 7.8452 119.6595 57.7438 41.3969 179.2481 180 N 4.3283 8.0518 116.0774 56.2159 38.2414 177.5007 181 L 4.0079 7.7787 119.0941 57.5816 42.0921 179.2661 182 V 3.6742 7.8948 118.2914 65.9710 31.2666 177.8495 183 R 3.8761 7.8401 117.2274 59.7284 30.0149 177.6809 184 D 4.6378 8.0570 115.5026 55.5429 41.1896 176.5760 185 N 4.9648 8.1300 116.4672 52.7097 39.7218 173.3762 186 M 5.1399 7.7726 115.4979 53.4716 34.3081 175.4221 187 I 4.1729 8.3524 120.8954 60.8997 37.5249 175.5279 188 L 4.7464 8.2265 125.9583 53.4046 45.8868 176.8439 189 G 3.9267 9.2364 106.8087 46.1090 0.0000 173.6507 190 V 4.6582 7.3379 111.4151 58.8531 36.2618 174.7218 191 R 4.7190 8.5015 122.5428 56.5979 31.4221 175.5746 192 V 5.0754 9.1524 118.1504 59.6168 36.9958 174.0587 193 K 4.7948 8.8405 122.9729 54.7556 35.4277 174.8613 194 I 4.4554 8.0996 128.9133 60.0724 38.1849 175.6461 195 L 4.3239 8.3895 127.8485 54.8463 42.8893 176.6777 196 G 3.8007 8.5831 105.4075 44.0071 0.0000 172.2744 197 D 4.3615 8.4690 118.6650 54.5396 39.7673 176.1442 198 G 3.9083 8.8597 110.3869 46.2721 0.0000 173.3955 199 S 4.6725 7.6855 113.8060 58.2663 63.0535 173.1595 200 F 5.0677 7.9253 118.3946 56.2313 40.8648 172.0439 201 E 4.9563 8.8824 116.5696 54.7726 33.1741 175.2564 202 G 3.9692 8.0471 106.3689 46.0668 0.0000 171.1917 203 I 4.6914 7.6861 120.1481 60.1662 38.9186 175.7085 204 A 4.4656 9.0408 129.6705 51.9510 18.0651 177.8115 205 E 3.9170 9.1039 122.0809 59.7192 30.5329 176.5585 206 D 4.3816 6.9922 115.6042 54.4964 45.4726 174.4375 207 I 4.8424 8.4300 118.4830 59.5665 40.3899 175.5108 208 D 4.8725 8.4454 123.7180 52.1041 41.6126 176.4965 209 D 4.6319 8.8278 117.4231 55.2466 39.3698 176.3767 210 F 4.4485 9.2387 118.2625 57.2384 39.9418 176.5848 211 G 4.3646 8.6500 109.3608 45.2146 0.0000 173.9710 212 R 4.7315 8.2393 119.1293 55.8581 31.7581 175.4556 213 L 4.0039 8.0148 125.7084 54.6961 43.3041 175.4656 214 I 4.7119 8.7944 127.9615 60.1777 38.8283 174.6169 215 I 4.8938 8.7499 128.7123 59.4055 40.2746 174.7020 216 R 4.8571 8.6807 127.5942 54.6401 31.3461 176.0001 217 L 4.7817 8.9146 127.4573 54.1712 42.5051 178.0840 218 D 4.4037 8.6705 120.4209 57.4867 40.8354 178.5337 219 S 4.1774 7.9427 112.3702 59.4560 63.2959 174.9426 220 G 4.0277 8.2129 109.2206 44.9451 0.0000 173.7223 221 E 4.0290 8.0416 121.3423 56.5038 30.8475 175.6194 222 V 4.8431 8.2611 125.3712 61.0943 33.5830 174.7036 223 K 4.6659 8.9103 126.5377 54.4151 35.9116 175.0721 224 K 4.9104 8.5479 121.9266 54.7267 34.5849 175.5272 225 V 4.4096 8.7770 126.0990 61.4752 33.1437 175.1463 226 I 4.6558 8.6241 128.8395 61.3612 38.2566 175.5981 227 Y 4.5015 7.8476 123.4294 55.6368 40.2076 173.8956 228 G 4.3998 9.2311 114.4714 45.7440 0.0000 173.7862 229 D 4.7770 7.3483 119.3856 51.1162 41.1516 174.5701 230 V 4.4524 7.5058 119.6983 60.4345 35.4169 174.3159 231 S 4.6880 8.5660 119.5112 56.5285 64.4745 172.2028 232 L 5.2401 8.5321 128.6641 53.1879 45.0761 175.3324 233 R 4.5819 8.4453 124.2198 54.4428 33.5527 174.0962 234 F 4.9144 8.8002 124.6437 57.2891 40.1037 175.5239 235 L 4.4109 8.6915 122.2352 54.8656 41.3303 176.4172 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 M 8.30 4.47 0.00 2.10 2.24 0.00 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 2 L 7.95 3.89 0.00 1.77 1.81 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 3 G 8.91 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 0.00 0.00 0.00 4 L 8.06 4.18 0.00 1.69 1.65 1.13 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.44 4.53 0.00 1.72 1.80 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.34 7.81 6 T 7.60 4.18 4.54 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 1.22 0.00 0.00 7 S 9.47 4.36 0.00 3.97 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 8 I 8.53 4.31 2.06 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.37 1.03 0.00 0.00 9 I 7.89 4.02 1.84 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.40 0.81 0.00 0.00 10 G 9.06 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 11 R 7.78 4.11 0.00 1.88 2.04 0.00 3.31 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 12 R 7.71 4.84 0.00 1.73 1.79 0.00 3.12 0.00 0.00 3.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 13 V 8.42 4.98 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.15 0.00 0.00 14 I 9.26 4.43 2.05 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 1.17 0.78 0.67 0.00 0.00 15 Y 8.51 5.21 0.00 2.85 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 F 8.22 4.20 0.00 2.69 2.82 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 17 Q 8.28 4.07 0.00 1.94 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.81 0.00 0.00 0.00 0.00 0.00 2.58 2.21 0.00 18 E 7.82 5.01 0.00 1.91 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 2.15 2.27 0.00 19 I 8.22 4.51 1.32 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.68 0.65 0.00 0.00 20 T 8.47 4.06 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 1.17 0.00 0.00 21 S 7.51 4.86 0.00 3.75 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 22 T 9.18 3.81 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 23 N 8.03 4.32 0.00 2.81 2.97 0.00 0.00 6.79 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 24 E 8.16 3.91 0.00 1.99 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 2.28 2.44 0.00 25 F 8.21 3.96 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 26 A 8.08 4.06 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 27 K 7.95 4.07 0.00 1.88 1.85 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.59 7.81 28 T 7.70 4.18 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 1.21 0.00 0.00 29 S 6.81 4.57 0.00 3.41 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 30 Y 8.39 4.22 0.00 2.91 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 31 L 7.37 4.56 0.00 1.46 1.40 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.32 3.95 0.00 2.13 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 2.34 2.28 0.00 33 E 8.41 4.11 0.00 1.97 1.94 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 2.33 2.45 0.00 34 G 9.36 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 35 T 7.70 4.48 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 1.29 0.00 0.00 36 V 8.77 4.79 2.27 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 1.06 0.00 0.00 1.02 0.00 0.00 37 I 9.18 5.22 1.97 0.00 0.00 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 1.43 1.10 0.92 0.00 0.00 38 V 9.21 5.22 2.31 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 0.75 0.00 0.00 1.06 0.00 0.00 39 A 8.80 5.10 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 40 D 8.98 4.81 0.00 2.99 2.85 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 0.00 0.00 0.00 41 K 7.88 4.87 0.00 1.87 1.93 0.00 1.25 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.38 7.81 42 Q 7.99 5.00 0.00 1.59 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.94 0.00 0.00 0.00 0.00 0.00 2.15 1.94 0.00 43 T 8.91 4.11 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 1.15 0.00 0.00 44 M 7.74 4.72 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.58 0.00 45 G 7.49 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 *55 S 7.46 2.97 0.00 3.19 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 56 P 0.00 4.84 0.00 2.20 2.21 0.00 3.76 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 2.30 2.04 0.00 57 E 8.14 4.57 0.00 2.07 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 2.37 2.17 0.00 58 G 9.38 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 59 G 7.53 3.44 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 0.00 0.00 0.00 60 L 7.45 4.23 0.00 1.48 1.24 1.01 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.29 5.47 0.00 3.43 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.95 5.31 0.00 1.99 1.89 0.93 0.60 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 63 S 9.43 5.22 0.00 3.74 3.73 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 64 I 8.67 4.92 1.76 0.00 0.00 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 1.07 0.79 0.76 0.00 0.00 65 V 8.56 4.32 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 0.91 0.00 0.00 0.90 0.00 0.00 66 L 9.11 4.94 0.00 1.44 1.36 0.57 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 67 S 9.09 4.86 0.00 3.87 3.78 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 68 P 0.00 4.71 0.00 2.46 2.52 0.00 3.87 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 69 K 8.46 4.36 0.00 1.77 1.82 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.42 7.81 70 V 7.12 4.50 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 0.57 0.00 0.00 1.05 0.00 0.00 71 P 0.00 4.36 0.00 2.31 1.97 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 72 Q 9.00 4.00 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.56 0.00 73 K 8.08 4.09 0.00 1.96 2.01 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.40 1.48 7.81 74 D 8.33 4.71 0.00 2.83 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 75 L 7.75 4.15 0.00 1.85 1.82 1.02 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.48 0.00 2.30 2.18 0.00 3.99 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 77 K 8.55 4.34 0.00 2.30 2.18 0.00 2.01 0.00 0.00 1.92 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.91 1.74 7.81 78 I 7.43 3.35 1.76 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.00 0.77 0.00 0.00 79 V 7.41 3.36 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 0.76 0.00 0.00 0.69 0.00 0.00 80 F 7.38 4.42 0.00 3.22 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 81 L 7.78 4.08 0.00 1.71 1.65 0.45 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.92 3.49 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 0.00 83 A 7.84 3.99 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 84 V 8.28 3.68 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 1.11 0.00 0.00 0.97 0.00 0.00 85 G 8.36 3.61 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 0.00 0.00 0.00 86 V 7.89 3.57 2.20 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 1.04 0.00 0.00 0.96 0.00 0.00 87 V 7.80 3.58 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 1.09 0.00 0.00 1.00 0.00 0.00 88 E 8.49 4.01 0.00 2.19 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 2.34 2.63 0.00 89 T 8.07 3.98 4.36 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 1.23 0.00 0.00 90 L 8.28 4.06 0.00 1.84 1.87 0.90 0.81 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 91 K 8.11 4.13 0.00 1.97 1.99 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.35 7.81 92 E 7.94 4.02 0.00 2.26 1.86 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 2.32 2.54 0.00 93 F 7.61 4.45 0.00 3.11 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 94 S 8.18 3.88 0.00 4.07 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 95 I 8.03 4.43 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 1.32 1.53 0.91 0.00 0.00 96 D 8.72 4.53 0.00 2.64 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 97 G 8.26 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 98 R 8.93 4.96 0.00 1.49 1.70 0.00 3.25 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.57 0.00 99 I 9.00 4.47 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.01 1.05 0.00 0.00 100 K 9.23 4.91 0.00 2.06 1.85 0.00 1.99 0.00 0.00 1.68 0.00 0.00 2.69 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.43 1.46 7.81 101 W 9.08 4.56 0.00 3.34 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 0.00 102 P 0.00 4.29 0.00 1.24 0.49 0.00 3.41 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.09 0.00 103 N 7.78 4.93 0.00 2.79 2.78 0.00 0.00 6.07 8.07 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 0.00 104 D 8.27 5.47 0.00 2.67 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 0.00 105 V 8.61 4.54 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 1.04 0.00 0.00 0.93 0.00 0.00 106 L 9.22 5.30 0.00 1.43 1.66 1.07 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.48 4.43 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 1.09 0.00 0.00 0.92 0.00 0.00 108 N 9.57 4.20 0.00 2.92 2.91 0.00 0.00 7.23 7.46 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 0.00 109 Y 7.90 3.50 0.00 3.14 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 0.00 110 K 7.86 4.68 0.00 1.95 1.81 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.52 7.81 111 K 8.68 4.51 0.00 1.90 1.74 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.83 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.55 1.49 7.81 112 I 9.16 4.63 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.72 0.96 0.00 0.00 113 A 7.80 5.16 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 0.00 114 G 9.26 4.45 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 0.00 115 V 8.62 4.95 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.89 0.00 0.00 116 L 8.95 4.66 0.00 1.52 1.46 0.89 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.43 4.77 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 0.75 0.00 0.00 0.83 0.00 0.00 118 E 8.93 4.84 0.00 1.90 1.78 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 2.18 2.19 0.00 119 G 8.32 4.44 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 0.00 0.00 0.00 120 K 9.18 4.35 0.00 1.79 1.69 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.35 7.81 121 G 8.49 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 0.00 0.00 0.00 122 D 8.82 4.69 0.00 2.68 2.70 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 0.00 123 K 7.76 4.87 0.00 1.87 1.80 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.79 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.19 7.81 124 I 9.27 4.90 1.96 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 1.13 0.56 0.93 0.00 0.00 125 V 8.81 4.64 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 0.94 0.00 0.00 0.90 0.00 0.00 126 L 8.89 4.62 0.00 1.68 1.44 0.81 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.90 4.51 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 0.00 0.00 0.00 128 I 9.05 5.18 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.98 0.89 0.00 0.00 129 G 9.31 4.75 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 0.00 130 L 8.37 5.10 0.00 1.61 1.26 0.89 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 131 N 9.17 4.42 0.00 2.73 2.74 0.00 0.00 6.09 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 8.88 4.14 2.14 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 0.91 0.00 0.00 0.75 0.00 0.00 133 N 8.63 5.06 0.00 2.56 2.84 0.00 0.00 7.21 7.54 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 0.00 134 N 8.06 4.81 0.00 2.89 3.09 0.00 0.00 6.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 8.61 4.24 0.00 1.80 1.81 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.49 7.81 136 V 7.89 4.63 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 0.84 0.00 0.00 0.97 0.00 0.00 137 P 0.00 4.44 0.00 2.20 1.98 0.00 3.65 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 2.13 2.09 0.00 138 N 8.54 4.51 0.00 2.84 2.86 0.00 0.00 6.36 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 9.20 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 0.00 0.00 0.00 140 A 7.50 4.71 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 0.00 141 T 8.64 4.82 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 1.34 0.00 0.00 142 S 8.29 4.75 0.00 3.99 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 0.00 143 M 8.85 4.02 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.41 0.00 144 K 8.22 4.39 0.00 2.05 1.81 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.41 7.81 145 L 7.81 4.00 0.00 1.82 1.72 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.16 4.14 0.00 2.08 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 0.00 2.57 2.48 0.00 147 L 8.17 4.44 0.00 1.69 1.75 1.03 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.46 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 0.00 0.00 0.00 149 S 7.38 4.56 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 0.00 150 E 8.70 4.25 0.00 1.93 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 2.29 2.36 0.00 151 V 8.81 4.26 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 0.76 0.00 0.00 0.95 0.00 0.00 152 P 0.00 4.23 0.00 2.29 2.04 0.00 3.79 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.11 0.00 153 L 8.73 3.86 0.00 1.70 1.63 0.83 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 154 L 7.91 4.03 0.00 1.73 1.64 0.86 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 155 S 8.03 4.25 0.00 4.23 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 0.00 156 V 7.75 3.51 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 0.86 0.00 0.00 0.53 0.00 0.00 157 F 8.25 4.03 0.00 3.16 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 0.00 158 R 8.53 3.91 0.00 2.11 2.03 0.00 3.26 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.03 0.00 159 S 8.13 4.09 0.00 4.07 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 0.00 160 L 7.99 4.22 0.00 1.76 1.61 0.89 1.05 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 0.00 161 I 7.66 3.50 1.55 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 -0.36 0.77 0.00 0.00 162 T 7.81 3.82 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 1.21 0.00 0.00 163 N 8.18 4.36 0.00 2.85 3.01 0.00 0.00 7.10 6.13 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 0.00 164 L 8.24 3.96 0.00 1.58 1.65 0.82 0.78 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 0.00 165 D 8.31 4.37 0.00 2.88 2.81 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 0.00 166 R 7.89 3.89 0.00 1.98 2.09 0.00 3.17 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 1.65 1.69 0.00 167 L 8.18 4.07 0.00 1.91 1.77 1.01 1.03 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 0.00 168 Y 8.49 4.26 0.00 3.08 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 0.00 169 L 8.23 3.88 0.00 1.91 1.70 1.09 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.20 4.58 0.00 2.90 2.85 0.00 0.00 6.82 7.14 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 0.00 171 F 8.18 3.87 0.00 3.16 3.23 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 0.00 172 L 7.70 3.87 0.00 1.65 1.56 0.62 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 173 K 7.04 4.33 0.00 1.92 1.78 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.54 7.81 174 N 8.49 4.95 0.00 2.65 2.70 0.00 0.00 6.83 7.91 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 0.00 175 P 0.00 3.94 0.00 1.82 1.46 0.00 3.67 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.74 0.00 176 M 7.82 4.27 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.43 0.00 177 D 8.12 4.40 0.00 2.87 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 0.00 178 I 7.97 3.77 2.07 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.31 1.17 0.00 0.00 179 L 7.85 3.83 0.00 1.82 1.66 1.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 180 N 8.05 4.33 0.00 2.85 2.86 0.00 0.00 6.98 7.35 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 0.00 181 L 7.78 4.01 0.00 1.78 1.74 0.95 0.88 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 0.00 182 V 7.89 3.67 1.96 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 0.81 0.00 0.00 0.74 0.00 0.00 183 R 7.84 3.88 0.00 1.87 2.11 0.00 3.30 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 184 D 8.06 4.64 0.00 2.70 2.70 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 0.00 185 N 8.13 4.96 0.00 2.83 2.76 0.00 0.00 6.47 7.03 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 0.00 186 M 7.77 5.14 0.00 2.16 2.23 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.83 0.00 187 I 8.35 4.17 2.09 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.63 0.77 0.00 0.00 188 L 8.23 4.75 0.00 1.49 1.55 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 189 G 9.24 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 0.00 0.00 0.00 190 V 7.34 4.66 2.17 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 0.81 0.00 0.00 1.18 0.00 0.00 191 R 8.50 4.72 0.00 1.94 1.83 0.00 3.14 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 192 V 9.15 5.08 1.96 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 0.83 0.00 0.00 0.89 0.00 0.00 193 K 8.84 4.79 0.00 1.71 1.53 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.22 1.41 7.81 194 I 8.10 4.46 0.92 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.86 0.86 0.00 0.00 195 L 8.39 4.32 0.00 1.51 1.57 0.90 0.86 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 0.00 196 G 8.58 3.80 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 0.00 0.00 0.00 197 D 8.47 4.36 0.00 2.80 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 0.00 198 G 8.86 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 0.00 0.00 0.00 199 S 7.69 4.67 0.00 4.10 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 0.00 200 F 7.93 5.07 0.00 3.10 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 0.00 201 E 8.88 4.96 0.00 2.07 1.87 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 2.21 2.33 0.00 202 G 8.05 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 I 7.69 4.69 2.01 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 1.19 0.74 0.96 0.00 0.00 204 A 9.04 4.47 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 0.00 205 E 9.10 3.92 0.00 1.94 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 0.00 2.53 2.40 0.00 206 D 6.99 4.38 0.00 2.73 2.47 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 0.00 207 I 8.43 4.84 1.82 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.04 0.98 0.00 0.00 208 D 8.45 4.87 0.00 3.01 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 D 8.83 4.63 0.00 2.83 2.90 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 0.00 210 F 9.24 4.45 0.00 3.22 3.31 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 0.00 0.00 0.00 0.00 211 G 8.65 4.36 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 0.00 212 R 8.24 4.73 0.00 2.22 1.99 0.00 3.14 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.86 0.00 213 L 8.01 4.00 0.00 0.27 0.54 0.50 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 214 I 8.79 4.71 1.89 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 1.29 0.77 0.89 0.00 0.00 215 I 8.75 4.89 2.10 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.72 1.10 0.00 0.00 216 R 8.68 4.86 0.00 1.90 1.92 0.00 3.09 0.00 0.00 3.18 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 217 L 8.91 4.78 0.00 1.85 1.60 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 218 D 8.67 4.40 0.00 2.69 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 0.00 219 S 7.94 4.18 0.00 3.97 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 0.00 220 G 8.21 4.03 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 0.00 0.00 0.00 221 E 8.04 4.03 0.00 2.05 1.76 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 2.20 2.19 0.00 222 V 8.26 4.84 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 0.85 0.00 0.00 0.91 0.00 0.00 223 K 8.91 4.67 0.00 1.49 1.42 0.00 0.82 0.00 0.00 0.61 0.00 0.00 2.47 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.03 1.03 7.81 224 K 8.55 4.91 0.00 1.58 1.70 0.00 1.67 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.35 7.81 225 V 8.78 4.41 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 1.27 0.00 0.00 1.07 0.00 0.00 226 I 8.62 4.66 1.92 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 1.44 0.93 0.76 0.00 0.00 227 Y 7.85 4.50 0.00 2.51 2.31 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 0.00 0.00 0.00 0.00 228 G 9.23 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 D 7.35 4.78 0.00 2.55 2.53 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 0.00 230 V 7.51 4.45 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 1.05 0.00 0.00 1.12 0.00 0.00 231 S 8.57 4.69 0.00 3.89 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 0.00 232 L 8.53 5.24 0.00 1.71 1.46 0.99 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 233 R 8.45 4.58 0.00 1.85 1.63 0.00 3.13 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 234 F 8.80 4.91 0.00 3.05 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 0.00 235 L 8.69 4.41 0.00 1.55 1.57 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.