NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4315 8.3044 120.3227 55.8212 33.4316 174.1871 2 H 4.6982 8.4131 117.8911 55.6962 30.1333 173.2778 3 L 4.7073 8.4517 119.6656 53.4234 43.9548 176.4997 4 T 4.3155 9.1540 121.3845 61.8461 69.7464 173.9374 5 P 3.9733 0.0000 0.0000 66.6745 30.7348 178.4440 6 E 4.1009 7.9731 118.1627 57.7791 29.4795 178.8239 7 E 3.9733 8.8463 120.2726 58.9228 29.7078 179.0780 8 K 3.8901 7.8883 118.2952 59.2779 31.6483 179.1591 9 S 4.0852 8.1982 114.4195 61.7147 62.7846 175.9973 10 A 3.9628 7.5600 124.4874 55.1001 18.0436 179.6460 11 V 3.2952 7.7774 115.4521 66.2174 31.4722 178.4465 12 T 3.8722 7.9475 115.0493 66.8535 68.1810 176.5211 13 A 4.0666 8.0157 121.2197 54.7148 18.6138 179.0604 14 L 4.0035 7.6370 118.2491 57.7605 42.3664 178.5649 15 W 4.4635 8.5685 128.5180 60.6155 30.3696 178.0163 16 G 3.8246 8.0188 104.8900 47.0544 0.0000 174.6912 17 K 4.4545 7.6752 117.8012 55.2066 32.9229 176.6709 18 V 3.7420 7.3458 120.8114 62.4198 32.1038 176.2278 19 N 4.5335 8.1617 125.2772 52.0185 38.4402 175.2214 20 V 3.4361 7.9815 127.2348 65.7975 31.4421 177.1066 21 D 4.2959 8.0419 117.9738 57.4591 40.8000 178.4480 22 E 4.0491 8.1202 118.4275 59.1385 29.6126 179.5187 23 V 3.4793 7.8659 118.5125 65.6941 31.6449 178.0757 24 G 3.7949 7.9328 105.5744 48.1030 0.0000 175.8767 25 G 3.6295 7.6816 107.2801 47.0926 0.0000 175.4479 26 E 3.9341 7.9789 120.9482 58.9491 29.5910 178.6374 27 A 3.9445 8.4402 121.2832 55.0204 18.4204 179.4470 28 L 4.0003 7.8805 118.5366 57.9933 42.2322 179.0540 29 G 3.6385 7.9795 105.6944 48.1501 0.0000 175.9757 30 R 3.9224 8.2138 121.0432 58.2113 29.8527 179.1411 31 L 4.1058 7.6083 120.6928 58.3223 41.8866 178.9266 32 L 4.0529 8.0402 118.9717 57.6379 41.2557 179.8602 33 V 3.6073 7.8086 117.5525 66.1070 31.7313 178.1561 34 V 3.6520 8.0053 116.8573 64.3646 32.7344 175.4045 35 Y 4.7477 8.0384 116.6563 54.2113 38.3779 173.7870 36 P 4.5689 0.0000 0.0000 64.3480 31.6543 177.4269 37 A 4.0149 8.2184 119.7227 55.5887 18.3169 179.4769 38 T 4.2775 8.0155 107.3483 65.1353 68.4635 176.2089 39 Q 4.3070 8.2698 121.0515 58.6161 28.4562 178.4625 40 R 3.8316 7.8503 116.1475 58.2354 29.3293 177.7755 41 F 4.4724 7.9437 117.0250 57.3869 40.0490 175.8019 42 F 4.5138 8.0084 118.6460 56.5888 39.6267 177.5426 43 E 4.0373 8.2369 122.4744 59.5504 29.5806 179.3874 44 S 4.5351 7.9980 110.6057 59.6710 63.3631 174.8678 45 F 4.6275 8.1785 120.3931 58.9341 40.1128 175.7858 46 G 4.0361 7.4730 104.3621 43.9817 0.0000 176.7177 47 D 4.4889 8.7636 128.1326 54.1687 39.6068 174.7263 48 L 4.7397 8.1267 124.0969 54.4765 42.5823 178.1163 49 S 4.2597 7.6977 115.5458 61.4997 62.9839 175.3243 50 T 4.7520 7.4531 108.2342 58.2077 73.0331 172.5183 51 P 4.2234 0.0000 0.0000 66.2944 31.4238 178.6547 52 D 4.3352 8.1203 116.4799 57.0962 40.8430 178.5547 53 A 3.9881 7.5731 120.0029 55.1652 18.1893 179.6676 54 V 3.5320 7.5874 115.2666 66.6758 31.7734 177.9865 55 M 4.2618 8.3496 117.7598 57.8367 31.8568 178.3123 56 G 3.9087 7.7261 103.7446 44.4901 0.0000 173.6716 57 N 4.3228 7.5474 120.9235 53.4927 39.5107 173.5839 58 P 4.4135 0.0000 0.0000 64.7954 31.8584 178.4643 59 K 3.7178 8.2197 119.2031 59.0514 31.7474 179.0575 60 V 3.7007 7.7962 118.0775 66.1825 31.3277 177.9997 61 K 3.8925 8.0184 117.0867 59.4554 32.3282 179.0049 62 A 4.1250 7.8687 120.6149 55.2910 18.3270 179.1855 63 H 4.3230 8.3893 117.0253 59.3926 30.0984 177.7168 64 G 4.0060 8.4204 108.8567 46.5893 0.0000 175.3167 65 K 4.0885 7.8272 121.5280 58.7906 32.4133 178.5501 66 K 3.9050 8.0595 118.3934 59.6475 32.0278 178.8964 67 V 3.6540 7.7985 117.9615 66.3881 31.5126 178.1890 68 L 4.4175 8.0397 118.0425 57.4002 41.4581 179.7574 69 G 3.7712 8.5337 106.2153 48.0209 0.0000 175.6447 70 A 4.2112 8.2189 123.9724 54.4663 18.4771 179.4464 71 F 3.9069 8.4150 119.3171 61.7080 39.2974 177.4057 72 S 4.1610 8.3366 113.4078 61.8305 62.8633 176.3616 73 D 4.5947 7.9283 120.2205 57.2715 40.5913 178.7356 74 G 3.6778 7.7653 105.7390 48.1013 0.0000 175.6474 75 L 3.9168 7.4605 119.2575 56.8536 41.5994 178.8727 76 A 4.2315 8.0137 120.0834 53.5061 19.6655 176.9128 77 H 4.8799 8.0165 114.4294 54.8580 29.3949 174.7739 78 L 3.9659 7.8694 120.6229 57.0886 42.4767 176.6900 79 D 4.6006 7.8582 115.8768 54.6566 40.7819 176.3701 80 N 5.0036 8.1038 119.0383 51.7632 39.7620 174.7777 81 L 4.0793 7.7915 122.1859 57.6389 41.7952 179.4727 82 K 4.1298 8.0579 118.3606 59.4221 31.8671 179.4617 83 G 3.6080 8.0683 104.3205 48.1704 0.0000 175.4888 84 T 3.8220 8.0036 117.4298 65.1766 68.5850 175.4275 85 F 4.7192 8.1449 117.4256 57.0752 39.8788 177.1044 86 A 4.0627 7.9418 124.7118 55.6818 18.0048 180.6943 87 T 3.7992 7.7941 113.5745 66.8327 68.7015 176.6995 88 L 4.0186 7.9679 121.6587 57.9556 42.1961 178.9063 89 S 4.2301 8.2623 113.3510 61.4678 62.3991 175.7464 90 E 3.8757 8.4602 121.6887 59.3110 29.1163 179.0887 91 L 3.8940 8.1525 120.3407 58.7555 42.1272 178.9069 92 H 4.1002 8.2735 115.8269 59.2146 28.1049 176.3136 93 C 3.7036 7.7382 120.5787 61.6199 31.0258 175.1562 94 D 4.3559 8.8620 123.3950 56.2820 40.7010 177.5838 95 K 4.2819 7.7978 117.4418 58.0429 33.2948 177.7914 96 L 4.1036 7.6841 116.2464 55.3497 42.4173 176.4376 97 H 4.1294 7.2594 112.9232 56.6768 26.2132 175.1753 98 V 3.9434 8.0165 118.6267 61.0664 32.7210 174.7382 99 D 4.2954 8.5632 127.1361 53.5043 41.7680 174.9450 100 P 2.9700 0.0000 0.0000 64.4548 31.0275 178.1761 101 E 3.8745 8.0469 117.8726 59.2737 29.1749 178.8676 102 N 4.3423 8.0647 116.9194 55.8617 38.3878 177.2807 103 F 4.4323 7.2138 119.1287 60.7204 38.9866 177.7322 104 R 3.9411 7.6311 116.1043 59.2236 29.9020 178.9146 105 L 3.7069 7.6617 118.0565 57.7950 41.6524 179.0901 106 L 4.0940 8.2638 120.4722 58.2404 41.6620 179.1780 107 G 3.7220 8.4043 105.8968 48.1084 0.0000 175.4217 108 N 4.4714 8.4054 118.8800 55.8918 38.6931 177.8133 109 V 3.6975 8.0047 119.8692 65.6622 31.5848 177.9573 110 L 3.8766 7.9572 120.3984 58.0452 41.9111 178.9975 111 V 3.6135 7.5092 117.9136 66.3432 31.4553 177.8461 112 C 4.1267 7.9577 116.1389 62.4759 27.8250 176.3207 113 V 3.5631 7.5179 119.7454 65.9815 31.0802 178.1380 114 L 3.8439 8.1500 118.9015 57.6643 41.3696 179.4295 115 A 3.5711 7.4797 120.7781 54.8870 17.9889 178.9925 116 H 4.0653 7.7613 116.1298 60.1220 30.0607 177.0455 117 H 3.9548 8.2556 116.7009 57.9177 28.8084 176.9731 118 F 4.7488 8.5960 118.5632 55.5964 40.0309 177.5146 119 G 3.9148 8.8164 107.6060 45.8645 0.0000 177.1913 120 K 3.9293 9.1022 123.0605 59.6001 32.1073 177.8412 121 E 4.1329 8.0871 118.0084 58.7300 29.7022 177.4113 122 F 4.5468 8.0969 123.0028 57.1366 37.8446 175.4621 123 T 4.3024 7.4272 115.8646 59.6472 71.5350 173.6253 124 P 4.2350 0.0000 0.0000 65.6138 31.4268 176.9818 125 P 4.1832 0.0000 0.0000 65.6588 31.1512 178.8642 126 V 3.5342 7.1881 116.6541 65.7983 31.3047 177.7670 127 Q 3.4284 8.3992 119.7259 58.9999 28.3686 177.9585 128 A 3.9594 8.1449 121.8698 55.4176 18.3732 179.5457 129 A 3.9111 7.8499 118.5220 55.5041 18.4621 179.5337 130 Y 4.0549 7.9714 115.1844 61.0000 37.9052 178.4322 131 Q 4.1699 8.5002 119.5463 58.9209 28.7180 178.9874 132 K 3.9856 7.8007 118.7538 59.3032 32.0931 179.6459 133 V 3.4888 7.6393 118.4049 66.1961 31.4378 178.5623 134 V 3.9693 8.5467 112.3196 64.2945 31.2900 178.4443 135 A 4.0954 8.1767 120.8212 55.0590 18.1631 179.9095 136 G 3.4572 8.2586 104.5653 47.8359 0.0000 176.0334 137 V 3.0297 8.0749 121.1081 65.3289 31.5032 177.5324 138 A 3.8425 8.0498 120.8568 55.5343 17.6340 179.2665 139 N 4.2396 8.2427 114.3454 56.5904 38.4290 177.6031 140 A 4.0449 7.8442 121.0996 55.0917 18.5071 179.4055 141 L 3.9301 7.6098 116.7948 57.4209 41.7460 179.0227 142 A 4.2309 8.0298 120.4227 54.4235 18.2051 178.8109 143 H 4.1380 7.7798 116.2385 59.2711 29.9250 175.9903 144 K 4.4016 8.3796 116.0424 56.2580 31.9998 176.2678 145 Y 4.0450 7.8707 118.2336 58.2648 38.3555 175.7145 146 H 4.4553 8.2537 118.4961 56.1024 28.3181 173.2103 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 4.43 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 2 H 8.41 4.70 0.00 3.14 3.25 0.00 5.73 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 3 L 8.45 4.71 0.00 1.61 1.51 0.82 0.89 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 4 T 9.15 4.32 4.30 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 1.29 0.00 0.00 5 P 0.00 3.97 0.00 2.23 2.32 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 6 E 7.97 4.10 0.00 2.04 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 2.38 2.29 0.00 7 E 8.85 3.97 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 8 K 7.89 3.89 0.00 1.92 1.80 0.00 1.64 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.43 7.81 9 S 8.20 4.09 0.00 4.03 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 10 A 7.56 3.96 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 11 V 7.78 3.30 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.39 0.00 0.00 12 T 7.95 3.87 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 1.24 0.00 0.00 13 A 8.02 4.07 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 14 L 7.64 4.00 0.00 2.08 2.06 0.48 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.57 4.46 0.00 3.81 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 16 G 8.02 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.68 4.45 0.00 2.08 2.07 0.00 1.85 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.62 7.81 18 V 7.35 3.74 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 0.02 0.00 0.00 0.90 0.00 0.00 19 N 8.16 4.53 0.00 2.69 2.57 0.00 0.00 6.81 7.71 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 20 V 7.98 3.44 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 1.03 0.00 0.00 0.84 0.00 0.00 21 D 8.04 4.30 0.00 2.96 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 22 E 8.12 4.05 0.00 1.94 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 0.00 2.29 2.26 0.00 23 V 7.87 3.48 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 0.79 0.00 0.00 0.55 0.00 0.00 24 G 7.93 3.79 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 0.00 0.00 0.00 25 G 7.68 3.63 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 0.00 0.00 0.00 26 E 7.98 3.93 0.00 2.30 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 2.30 2.31 0.00 27 A 8.44 3.94 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 28 L 7.88 4.00 0.00 1.89 1.63 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.98 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.21 3.92 0.00 1.90 1.98 0.00 3.09 0.00 0.00 3.04 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 31 L 7.61 4.11 0.00 1.89 1.94 1.03 0.68 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 32 L 8.04 4.05 0.00 1.89 1.74 0.79 0.78 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 33 V 7.81 3.61 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 0.76 0.00 0.00 0.98 0.00 0.00 34 V 8.01 3.65 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.82 0.00 0.00 35 Y 8.04 4.75 0.00 3.14 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 36 P 0.00 4.57 0.00 2.18 2.14 0.00 3.93 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 37 A 8.22 4.01 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 38 T 8.02 4.28 4.57 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 1.39 0.00 0.00 39 Q 8.27 4.31 0.00 2.20 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 40 R 7.85 3.83 0.00 1.70 1.85 0.00 2.59 0.00 0.00 2.92 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.50 0.00 41 F 7.94 4.47 0.00 2.15 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 42 F 8.01 4.51 0.00 2.86 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.24 4.04 0.00 2.03 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 2.37 2.36 0.00 44 S 8.00 4.54 0.00 4.14 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 45 F 8.18 4.63 0.00 3.29 3.18 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 46 G 7.47 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 47 D 8.76 4.49 0.00 2.68 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 48 L 8.13 4.74 0.00 1.69 1.68 1.09 1.04 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 49 S 7.70 4.26 0.00 3.94 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 50 T 7.45 4.75 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.22 0.00 2.16 2.15 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 52 D 8.12 4.34 0.00 2.68 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 53 A 7.57 3.99 1.51 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 54 V 7.59 3.53 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 0.91 0.00 0.00 0.96 0.00 0.00 55 M 8.35 4.26 0.00 1.99 2.11 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 2.62 2.99 0.00 56 G 7.73 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 57 N 7.55 4.32 0.00 3.03 2.89 0.00 0.00 6.77 7.20 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 58 P 0.00 4.41 0.00 2.25 2.24 0.00 3.70 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 1.99 2.01 0.00 59 K 8.22 3.72 0.00 1.57 0.74 0.00 1.46 0.00 0.00 1.27 0.00 0.00 2.80 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.04 1.20 7.81 60 V 7.80 3.70 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.17 0.00 0.00 61 K 8.02 3.89 0.00 1.75 1.85 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.70 7.81 62 A 7.87 4.12 1.35 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 63 H 8.39 4.32 0.00 3.58 3.67 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.42 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 65 K 7.83 4.09 0.00 1.88 1.87 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.62 7.81 66 K 8.06 3.90 0.00 2.07 1.92 0.00 1.84 0.00 0.00 1.90 0.00 0.00 3.12 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.61 1.57 7.81 67 V 7.80 3.65 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 1.12 0.00 0.00 0.94 0.00 0.00 68 L 8.04 4.42 0.00 1.99 1.91 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.53 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.22 4.21 1.56 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 0.00 0.00 71 F 8.41 3.91 0.00 3.49 3.32 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 72 S 8.34 4.16 0.00 4.39 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 0.00 73 D 7.93 4.59 0.00 2.82 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 74 G 7.77 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.46 3.92 0.00 1.61 1.54 0.01 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.01 4.23 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 77 H 8.02 4.88 0.00 3.10 3.16 0.00 5.82 0.00 0.00 0.00 0.00 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.87 3.97 0.00 1.51 1.63 0.84 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.86 4.60 0.00 2.78 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 80 N 8.10 5.00 0.00 2.74 2.66 0.00 0.00 7.07 7.40 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 81 L 7.79 4.08 0.00 1.75 1.84 0.85 1.32 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 82 K 8.06 4.13 0.00 1.75 1.79 0.00 1.55 0.00 0.00 1.73 0.00 0.00 2.80 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.33 1.44 7.81 83 G 8.07 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 84 T 8.00 3.82 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 0.43 0.00 0.00 85 F 8.14 4.72 0.00 3.18 2.92 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 86 A 7.94 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 87 T 7.79 3.80 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 1.22 0.00 0.00 88 L 7.97 4.02 0.00 1.85 1.84 1.02 1.00 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 89 S 8.26 4.23 0.00 4.12 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 90 E 8.46 3.88 0.00 2.14 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 2.32 2.64 0.00 91 L 8.15 3.89 0.00 1.84 1.92 0.90 1.37 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 92 H 8.27 4.10 0.00 3.62 3.79 0.00 5.85 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.74 3.70 0.00 1.23 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 94 D 8.86 4.36 0.00 2.69 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 95 K 7.80 4.28 0.00 1.75 1.78 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.40 7.81 96 L 7.68 4.10 0.00 1.72 1.64 0.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.26 4.13 0.00 3.48 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.02 3.94 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 0.09 0.00 0.00 0.53 0.00 0.00 99 D 8.56 4.30 0.00 2.74 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 0.00 0.00 0.00 0.00 100 P 0.00 2.97 0.00 1.82 1.78 0.00 3.28 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.44 0.00 101 E 8.05 3.87 0.00 1.99 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 2.33 2.42 0.00 102 N 8.06 4.34 0.00 2.51 2.73 0.00 0.00 6.90 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 7.21 4.43 0.00 3.08 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 0.00 104 R 7.63 3.94 0.00 2.12 1.94 0.00 3.13 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 105 L 7.66 3.71 0.00 1.74 1.30 0.53 -0.06 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 0.00 106 L 8.26 4.09 0.00 1.81 1.89 0.94 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.40 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 0.00 108 N 8.41 4.47 0.00 2.91 2.94 0.00 0.00 6.68 7.30 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 0.00 109 V 8.00 3.70 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.23 0.00 0.00 110 L 7.96 3.88 0.00 1.70 1.72 0.85 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.51 3.61 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 1.29 0.00 0.00 1.15 0.00 0.00 112 C 7.96 4.13 0.00 3.12 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 0.00 113 V 7.52 3.56 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 0.99 0.00 0.00 0.92 0.00 0.00 114 L 8.15 3.84 0.00 1.02 1.26 0.59 0.90 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 0.00 115 A 7.48 3.57 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 0.00 116 H 7.76 4.07 0.00 3.26 3.54 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.26 3.95 0.00 2.72 2.67 0.00 5.69 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.60 4.75 0.00 3.27 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 0.00 119 G 8.82 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 0.00 120 K 9.10 3.93 0.00 1.92 2.03 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.54 7.81 121 E 8.09 4.13 0.00 2.34 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 122 F 8.10 4.55 0.00 3.02 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 0.00 123 T 7.43 4.30 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 1.26 0.00 0.00 124 P 0.00 4.23 0.00 2.15 2.16 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 125 P 0.00 4.18 0.00 2.10 2.06 0.00 3.48 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 126 V 7.19 3.53 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 0.95 0.00 0.00 0.88 0.00 0.00 127 Q 8.40 3.43 0.00 1.78 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 128 A 8.14 3.96 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 0.00 129 A 7.85 3.91 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 0.00 130 Y 7.97 4.05 0.00 3.25 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.50 4.17 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.77 2.61 0.00 132 K 7.80 3.99 0.00 1.95 1.83 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.63 7.81 133 V 7.64 3.49 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 0.80 0.00 0.00 0.79 0.00 0.00 134 V 8.55 3.97 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 1.08 0.00 0.00 1.13 0.00 0.00 135 A 8.18 4.10 1.44 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 0.00 136 G 8.26 3.46 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 0.00 137 V 8.07 3.03 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 0.42 0.00 0.00 0.33 0.00 0.00 138 A 8.05 3.84 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.24 4.24 0.00 2.99 2.85 0.00 0.00 7.00 7.29 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 0.00 140 A 7.84 4.04 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 0.00 141 L 7.61 3.93 0.00 1.11 0.45 0.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.03 4.23 1.44 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 0.00 143 H 7.78 4.14 0.00 3.31 3.65 0.00 5.76 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.38 4.40 0.00 1.76 1.80 0.00 1.57 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.48 1.71 7.81 145 Y 7.87 4.05 0.00 3.16 2.97 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 0.00 146 H 8.25 4.46 0.00 3.21 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00