NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 M 4.4316 8.3049 120.3198 54.9409 33.5546 175.1358 16 D 4.3897 8.6031 123.4398 55.4837 40.9183 175.4556 17 R 4.5708 8.2323 112.6494 54.7045 33.0087 174.0206 18 S 4.2081 8.4630 114.2131 58.8470 63.2485 174.5873 19 L 4.3758 8.1755 123.3508 54.5091 42.3736 177.9877 20 R 4.3547 9.1475 122.6117 54.9166 32.4254 176.2946 21 P 4.2958 0.0000 0.0000 65.8543 31.3282 178.9640 22 E 4.0715 8.2157 117.0948 59.2978 29.3811 178.9681 23 E 4.1218 8.0357 118.2762 59.0388 29.6560 178.8696 24 I 3.7943 8.0069 120.1094 64.4727 37.3457 177.8646 25 E 3.9745 8.3323 120.2358 59.4370 29.4811 178.7832 26 E 4.1389 8.3157 117.3083 59.2149 29.7213 178.9842 27 L 4.3222 8.1588 120.1908 57.7407 41.6465 179.4897 28 R 3.7959 8.5829 118.3000 59.3771 30.0853 178.7536 29 E 3.9549 8.1370 117.5813 59.6044 29.4545 179.4210 30 A 4.1402 8.2615 120.5869 55.1982 18.3670 179.4532 31 F 3.1399 8.5641 119.6039 60.9563 39.3264 177.6599 32 R 3.7327 8.0133 117.8073 59.0917 29.9082 178.1912 33 E 3.8249 7.9469 118.9549 59.4887 29.5536 178.4116 34 F 3.9805 8.3008 120.4296 61.7094 39.1793 176.7882 35 D 4.0272 8.2973 118.8726 57.4150 40.9207 178.5512 36 K 4.0680 7.6162 123.7355 59.4765 31.8937 181.9464 37 D 4.7514 8.0735 119.5788 55.9108 40.8132 176.6881 38 K 3.7940 7.4851 123.1045 56.1442 31.4518 176.7719 39 D 4.5626 8.1686 126.9065 51.9281 39.9923 171.8939 40 G 4.2563 8.5795 117.1113 44.9178 0.0000 171.7546 41 Y 4.8664 7.1830 115.6992 54.1238 41.4844 173.6490 42 I 4.0170 8.3403 120.0735 58.9140 40.0250 174.8679 43 N 5.0074 7.8969 124.3605 51.6661 39.3209 175.7458 44 C 4.2698 8.7273 118.0910 63.4388 28.0508 177.0881 45 R 3.9610 7.9542 121.8174 61.5830 29.1520 180.6757 46 D 4.5755 8.0599 119.2131 57.1849 40.8343 178.5724 47 L 4.2513 8.2989 120.9794 58.3592 42.0622 179.3213 48 G 3.7033 8.5005 105.7660 47.9882 0.0000 175.4594 49 N 4.4793 8.3688 119.2311 56.1291 38.4878 177.3171 50 C 4.3274 8.4814 115.9910 61.4783 29.7867 175.9268 51 M 4.1875 8.1250 121.0961 58.3322 31.4622 178.8775 52 R 4.2275 8.1409 119.6891 58.9894 29.9940 179.0403 53 T 4.0215 8.1196 115.1878 66.0680 68.4555 175.2659 54 M 4.6041 7.5613 115.9101 54.7693 31.6601 176.4561 55 G 3.9420 8.5446 107.9130 46.0978 0.0000 172.5536 56 Y 4.5747 8.2967 120.2093 55.5514 40.7170 174.7898 57 M 4.3203 7.6637 126.9226 53.0920 31.6842 174.0221 58 P 4.7379 0.0000 0.0000 61.9589 32.9666 176.8217 59 T 4.3301 8.6715 110.6089 60.9505 71.2922 175.5459 60 E 3.9418 8.5677 121.8292 59.5547 29.6677 178.5886 61 M 4.0405 8.0056 117.8771 58.6330 32.4112 177.5719 62 E 4.1586 8.3358 118.7800 59.7586 29.6120 179.6039 63 L 4.0529 7.6719 118.7567 57.7649 41.8014 179.3795 64 I 3.7259 7.8696 119.7714 64.6581 37.0815 178.3332 65 E 4.0019 8.2115 119.1556 59.4221 29.1984 179.4770 66 L 4.0552 8.1591 119.0176 57.5249 41.6684 179.2477 67 S 4.2445 8.2778 115.4109 61.9997 62.8023 176.9062 68 Q 4.1070 7.9890 119.9233 59.1228 28.6539 178.6439 69 Q 3.9889 8.0565 120.4209 59.3447 28.9561 178.7281 70 I 3.8330 8.1280 120.7942 64.6346 37.2534 178.1994 71 N 4.5416 9.0656 118.2449 56.3647 38.6731 177.0600 72 M 4.1437 8.4335 120.3070 57.6618 32.2448 178.2590 73 N 4.4144 8.0742 115.7129 56.1777 39.1547 176.2117 74 L 4.4021 8.0656 115.5015 53.8736 42.4057 177.3731 75 G 3.9541 8.3886 105.4335 46.3436 0.0000 175.3021 76 G 3.8498 8.5930 107.1845 45.5074 0.0000 174.3252 77 H 4.6937 7.9056 117.5507 54.5906 28.3284 175.4038 78 V 4.5037 8.3214 124.6569 60.4398 33.6548 175.1347 79 D 4.9864 8.7842 128.7526 52.3545 42.6571 176.5896 80 F 3.3121 8.3006 119.6508 61.2528 39.2044 176.7384 81 D 4.1510 8.0121 118.1614 57.2696 40.5489 178.3763 82 D 4.2645 8.4365 119.3148 57.3917 40.8814 178.6174 83 F 3.8695 8.0714 121.0974 61.1200 39.3232 177.2832 84 V 3.3315 7.8493 118.2768 65.8583 31.0199 177.8260 85 E 3.8465 7.7601 117.1583 59.3906 29.3652 179.1320 86 L 3.9527 7.8143 118.1160 57.6307 41.9057 178.6778 87 M 4.0274 7.9438 118.1114 56.3145 32.4664 178.5010 88 G 3.7104 7.9970 106.7212 47.6992 0.0000 173.9454 89 P 4.2028 0.0000 0.0000 64.7184 31.5705 178.5257 90 K 3.7610 7.4569 117.1080 58.6524 32.0942 178.4947 91 L 4.3491 7.7439 122.3158 57.7540 41.7382 179.2933 92 L 4.0902 7.9025 116.5276 56.9337 41.5749 178.2526 93 A 4.4307 7.5297 118.8882 51.1566 19.1855 177.1859 94 E 4.0931 8.0501 119.9223 56.8798 30.2943 176.7640 95 T 4.6659 8.1645 112.3569 59.4193 71.8617 174.9693 96 A 3.9457 8.8505 124.3768 55.7518 17.9121 179.8659 97 D 4.3570 7.9803 115.3963 56.6272 39.5345 178.0298 98 M 4.2121 7.9702 119.2045 57.5409 32.1471 178.2348 99 I 3.9906 7.3944 119.3688 61.5324 37.9860 177.6605 100 G 4.1653 7.6229 103.0387 45.8786 0.0000 174.3378 101 V 3.7297 8.3124 119.1560 65.6225 31.4911 178.3752 102 K 3.9305 8.0315 118.8863 59.7253 32.1238 178.4915 103 E 4.0521 8.2143 118.3155 59.3478 29.4528 179.2202 104 L 4.2341 8.1872 119.1570 57.9444 41.7839 179.5078 105 R 4.2096 8.7098 119.1181 59.6047 29.9632 178.3065 106 D 4.4445 8.6213 118.7911 57.2089 40.8035 178.6202 107 A 4.1757 8.4691 121.4219 55.2234 18.4718 179.2063 108 F 2.9220 8.7720 119.5834 61.3570 39.0963 177.3002 109 R 3.9564 8.0762 116.9268 59.4739 29.8807 178.0771 110 E 4.1435 7.9631 117.2885 59.2800 29.5514 178.9753 111 F 4.2488 8.1568 116.7890 59.7503 40.3396 176.7244 112 D 4.4497 8.2142 121.2905 53.5641 39.0980 176.4600 113 T 3.8918 8.0676 121.4192 65.7314 69.0270 175.2875 114 N 4.6478 8.3880 116.1094 51.7589 37.4430 174.8634 115 G 4.0857 7.6365 105.7165 46.8888 0.0000 173.8919 116 D 4.5576 8.3904 116.0196 52.7770 39.6041 176.7815 117 G 4.1246 9.8608 107.7633 46.1624 0.0000 173.1021 118 E 4.9826 8.3602 118.4870 54.5152 33.2656 174.6105 119 I 4.4818 8.9105 128.4531 59.9952 38.6508 175.9294 120 S 4.7668 9.0675 123.1294 57.6494 64.5227 175.6885 121 T 4.0005 8.5749 110.8580 64.8762 68.4265 176.6312 122 S 4.1028 8.0361 116.6721 61.2720 63.0429 176.2402 123 E 3.9015 7.9146 122.0035 59.0620 29.2417 179.0892 124 L 4.0640 8.4293 120.8173 57.9188 42.1117 179.0215 125 R 3.8255 8.1696 118.7991 59.4459 30.0857 178.0851 126 E 3.8673 8.0855 118.1322 59.5944 29.4302 179.3618 127 A 3.5981 7.8094 120.3594 55.2895 18.2427 179.6519 128 M 3.9189 7.9303 117.1643 58.2720 32.0321 178.7929 129 R 4.5695 8.2392 119.9969 58.9546 30.0178 178.4296 130 A 3.9562 7.7336 118.9682 55.2247 18.4427 179.3662 131 L 4.0768 7.9696 116.6238 57.0988 41.7847 178.7328 132 L 4.5081 7.8142 116.8516 53.8181 42.4805 177.7805 133 G 3.9619 8.7401 106.4894 45.6747 0.0000 172.5084 134 H 4.8908 7.2188 113.7280 53.5407 31.6347 172.5581 135 Q 4.3661 8.4505 120.8800 55.8769 29.5953 175.0530 136 V 4.4175 8.3996 122.5101 60.6675 33.9550 176.0491 137 G 3.9070 8.5148 115.0351 45.1739 0.0000 174.1901 138 H 4.2408 8.8114 116.5007 58.5836 28.4042 177.9112 139 R 3.9004 7.8210 120.2512 59.3042 29.8455 178.5618 140 D 4.3600 7.9472 118.0111 57.3089 40.8228 178.8702 141 I 3.7119 7.6760 119.8116 64.3873 37.2065 177.9658 142 E 3.9615 8.0798 119.3968 59.5682 29.2466 179.1775 143 E 3.9329 8.2582 119.0515 59.1888 29.7756 178.7296 144 I 3.6944 7.9136 119.8996 64.5429 37.2553 178.2902 145 I 3.7002 8.1510 120.7827 64.4491 36.7583 178.2553 146 R 3.8990 8.2764 118.2297 59.8795 29.9848 178.0907 147 D 4.4800 8.3182 116.9661 56.3322 40.8534 177.8480 148 V 4.3658 7.5371 116.8907 62.2209 32.7960 174.7726 149 D 4.6340 7.7953 118.2476 53.0582 40.5473 175.8159 150 L 4.3136 8.9412 127.8700 55.8249 41.8535 177.6602 151 N 4.8246 8.4276 115.2093 51.8310 37.4711 175.5418 152 G 3.9951 8.4010 104.6861 46.8012 0.0000 174.4115 153 D 4.4448 7.8483 117.0140 53.1303 39.7570 177.4896 154 G 3.8977 9.1317 110.9750 46.5459 0.0000 173.8311 155 R 4.8922 9.0305 118.9589 54.8040 34.0808 179.3306 156 V 4.6915 8.8826 118.9509 62.3356 33.6514 175.4045 157 D 5.0337 9.3664 129.0437 52.2665 41.9025 177.1474 158 F 3.4703 8.6929 119.0545 61.3262 39.1039 176.4447 159 E 3.8521 8.2646 118.3831 59.4031 29.5207 178.5234 160 E 3.9963 8.8966 118.9960 59.2117 29.2554 179.1664 161 F 4.0934 8.0274 120.0970 61.2556 39.9481 177.1290 162 V 3.3213 7.6031 117.9016 65.8920 31.3387 178.2422 163 R 3.8860 7.7151 117.4309 59.2617 29.6093 178.7702 164 M 4.0813 7.4665 117.3342 57.5180 32.0451 177.0648 165 M 4.5227 7.4033 117.1724 54.7917 32.6901 175.2243 166 S 4.9552 7.3844 113.8966 56.6624 65.8481 174.6328 167 R 4.1283 8.3498 120.0917 56.6130 29.9561 176.6949 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 15 M 8.30 4.43 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 16 D 8.60 4.39 0.00 2.73 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 17 R 8.23 4.57 0.00 1.88 1.88 0.00 3.22 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 18 S 8.46 4.21 0.00 3.88 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.18 4.38 0.00 1.63 1.60 0.86 0.92 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 20 R 9.15 4.35 0.00 1.97 2.03 0.00 3.14 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 21 P 0.00 4.30 0.00 2.18 2.12 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 22 E 8.22 4.07 0.00 2.10 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 2.44 2.50 0.00 23 E 8.04 4.12 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 24 I 8.01 3.79 2.11 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 1.47 0.75 1.09 0.00 0.00 25 E 8.33 3.97 0.00 2.24 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 0.00 2.34 2.41 0.00 26 E 8.32 4.14 0.00 2.35 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.43 0.00 27 L 8.16 4.32 0.00 2.22 2.11 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.58 3.80 0.00 2.06 1.86 0.00 3.03 0.00 0.00 2.93 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.74 0.00 29 E 8.14 3.95 0.00 2.26 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 2.36 2.61 0.00 30 A 8.26 4.14 1.70 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 0.00 0.00 31 F 8.56 3.14 0.00 2.59 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.01 3.73 0.00 2.12 1.90 0.00 3.16 0.00 0.00 3.05 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 33 E 7.95 3.82 0.00 2.08 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 0.00 2.49 2.34 0.00 34 F 8.30 3.98 0.00 3.32 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 35 D 8.30 4.03 0.00 1.74 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.62 4.07 0.00 1.92 1.70 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.34 7.81 37 D 8.07 4.75 0.00 2.59 2.58 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 38 K 7.49 3.79 0.00 0.99 1.30 0.00 1.62 0.00 0.00 1.30 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.28 1.14 7.81 39 D 8.17 4.56 0.00 2.71 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 40 G 8.58 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 41 Y 7.18 4.87 0.00 3.15 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 42 I 8.34 4.02 1.61 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.75 1.11 0.00 0.00 43 N 7.90 5.01 0.00 3.01 2.98 0.00 0.00 6.28 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 C 8.73 4.27 0.00 3.04 3.07 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 0.00 0.00 0.00 0.00 45 R 7.95 3.96 0.00 1.81 1.93 0.00 3.26 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.29 0.00 46 D 8.06 4.58 0.00 2.61 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 47 L 8.30 4.25 0.00 1.97 1.91 1.17 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.50 3.70 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 0.00 0.00 0.00 49 N 8.37 4.48 0.00 2.81 3.03 0.00 0.00 6.79 7.43 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 50 C 8.48 4.33 0.00 3.50 3.38 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 51 M 8.12 4.19 0.00 2.27 2.46 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.58 0.00 52 R 8.14 4.23 0.00 2.08 2.02 0.00 3.34 0.00 0.00 3.29 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 53 T 8.12 4.02 4.56 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 1.28 0.00 0.00 54 M 7.56 4.60 0.00 2.42 2.24 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 2.81 2.84 0.00 55 G 8.54 3.94 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 0.00 56 Y 8.30 4.57 0.00 3.10 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 57 M 7.66 4.32 0.00 1.89 1.77 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 58 P 0.00 4.74 0.00 2.28 2.31 0.00 3.76 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 59 T 8.67 4.33 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 1.25 0.00 0.00 60 E 8.57 3.94 0.00 2.11 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 0.00 2.39 2.45 0.00 61 M 8.01 4.04 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.70 0.00 62 E 8.34 4.16 0.00 2.33 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 2.39 2.44 0.00 63 L 7.67 4.05 0.00 1.96 1.76 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 64 I 7.87 3.73 2.01 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 1.55 1.23 0.93 0.00 0.00 65 E 8.21 4.00 0.00 2.23 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 0.00 2.34 2.43 0.00 66 L 8.16 4.06 0.00 1.73 1.72 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.28 4.24 0.00 4.08 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 68 Q 7.99 4.11 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.77 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 69 Q 8.06 3.99 0.00 2.33 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 70 I 8.13 3.83 2.20 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.60 1.18 0.00 0.00 71 N 9.07 4.54 0.00 2.77 2.92 0.00 0.00 7.09 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 72 M 8.43 4.14 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.72 0.00 73 N 8.07 4.41 0.00 2.98 2.91 0.00 0.00 6.84 7.85 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 74 L 8.07 4.40 0.00 2.15 1.80 0.96 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.39 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 0.00 0.00 0.00 76 G 8.59 3.85 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 0.00 0.00 0.00 77 H 7.91 4.69 0.00 3.37 3.32 0.00 5.60 0.00 0.00 0.00 0.00 6.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.32 4.50 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 1.06 0.00 0.00 1.21 0.00 0.00 79 D 8.78 4.99 0.00 3.09 2.91 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 80 F 8.30 3.31 0.00 2.43 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 81 D 8.01 4.15 0.00 2.86 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 82 D 8.44 4.26 0.00 2.93 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.07 3.87 0.00 3.02 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 7.85 3.33 1.83 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 0.72 0.00 0.00 -0.03 0.00 0.00 85 E 7.76 3.85 0.00 2.04 1.90 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 2.47 2.42 0.00 86 L 7.81 3.95 0.00 1.37 1.46 0.84 0.84 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 87 M 7.94 4.03 0.00 1.52 1.45 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.23 0.00 88 G 8.00 3.71 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 0.00 0.00 0.00 89 P 0.00 4.20 0.00 1.90 2.04 0.00 3.51 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.08 0.00 90 K 7.46 3.76 0.00 1.29 0.74 0.00 1.31 0.00 0.00 1.46 0.00 0.00 2.72 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.04 1.14 7.81 91 L 7.74 4.35 0.00 1.63 1.81 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.90 4.09 0.00 1.62 1.71 0.89 0.69 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 93 A 7.53 4.43 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 94 E 8.05 4.09 0.00 2.21 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.72 0.00 95 T 8.16 4.67 4.31 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 1.23 0.00 0.00 96 A 8.85 3.95 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 97 D 7.98 4.36 0.00 2.82 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 98 M 7.97 4.21 0.00 2.21 2.25 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 99 I 7.39 3.99 2.02 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 1.50 0.62 0.98 0.00 0.00 100 G 7.62 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 0.00 101 V 8.31 3.73 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 1.09 0.00 0.00 1.00 0.00 0.00 102 K 8.03 3.93 0.00 1.88 1.82 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.55 7.81 103 E 8.21 4.05 0.00 2.26 2.07 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 0.00 2.47 2.46 0.00 104 L 8.19 4.23 0.00 2.22 2.04 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 105 R 8.71 4.21 0.00 1.73 2.15 0.00 2.94 0.00 0.00 2.67 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 106 D 8.62 4.44 0.00 2.98 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 A 8.47 4.18 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 8.77 2.92 0.00 2.76 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 0.00 109 R 8.08 3.96 0.00 2.08 2.22 0.00 3.35 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 110 E 7.96 4.14 0.00 2.29 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 111 F 8.16 4.25 0.00 2.65 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 0.00 112 D 8.21 4.45 0.00 2.09 2.37 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 0.00 113 T 8.07 3.89 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 1.18 0.00 0.00 114 N 8.39 4.65 0.00 2.86 2.90 0.00 0.00 7.11 6.43 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 0.00 115 G 7.64 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 0.00 0.00 0.00 116 D 8.39 4.56 0.00 2.84 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 9.86 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 0.00 118 E 8.36 4.98 0.00 2.02 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 119 I 8.91 4.48 1.87 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 -0.23 1.00 0.00 0.00 120 S 9.07 4.77 0.00 3.92 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 0.00 121 T 8.57 4.00 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 1.23 0.00 0.00 122 S 8.04 4.10 0.00 4.06 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 0.00 123 E 7.91 3.90 0.00 2.17 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 0.00 2.29 2.29 0.00 124 L 8.43 4.06 0.00 1.88 1.86 1.17 0.91 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 0.00 125 R 8.17 3.83 0.00 2.03 2.16 0.00 3.21 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 126 E 8.09 3.87 0.00 2.09 1.90 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 2.29 2.44 0.00 127 A 7.81 3.60 0.28 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 0.00 0.00 0.00 0.00 0.00 0.00 128 M 7.93 3.92 0.00 2.10 2.23 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 2.64 2.63 0.00 129 R 8.24 4.57 0.00 2.03 2.00 0.00 3.17 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 130 A 7.73 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 0.00 131 L 7.97 4.08 0.00 1.60 1.75 1.06 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 132 L 7.81 4.51 0.00 1.52 1.62 0.86 0.96 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 0.00 133 G 8.74 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 0.00 134 H 7.22 4.89 0.00 3.26 3.36 0.00 5.46 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 8.45 4.37 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 136 V 8.40 4.42 2.07 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 0.89 0.00 0.00 0.88 0.00 0.00 137 G 8.51 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 0.00 138 H 8.81 4.24 0.00 3.36 3.59 0.00 5.48 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.82 3.90 0.00 1.87 1.97 0.00 3.16 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 140 D 7.95 4.36 0.00 2.88 2.72 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 0.00 141 I 7.68 3.71 2.02 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 1.82 0.84 0.94 0.00 0.00 142 E 8.08 3.96 0.00 2.17 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 0.00 2.36 2.36 0.00 143 E 8.26 3.93 0.00 2.04 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 0.00 2.31 2.35 0.00 144 I 7.91 3.69 2.05 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 1.54 1.16 0.96 0.00 0.00 145 I 8.15 3.70 2.10 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 1.60 1.14 0.94 0.00 0.00 146 R 8.28 3.90 0.00 1.91 2.09 0.00 3.26 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 147 D 8.32 4.48 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 0.00 148 V 7.54 4.37 2.30 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 0.86 0.00 0.00 0.93 0.00 0.00 149 D 7.80 4.63 0.00 2.70 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.94 4.31 0.00 1.67 1.71 0.92 1.27 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 0.00 151 N 8.43 4.82 0.00 2.87 2.99 0.00 0.00 6.70 6.97 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 0.00 152 G 8.40 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 0.00 153 D 7.85 4.44 0.00 2.84 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 0.00 154 G 9.13 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 R 9.03 4.89 0.00 1.51 1.65 0.00 3.23 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.41 0.00 156 V 8.88 4.69 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 1.16 0.00 0.00 1.01 0.00 0.00 157 D 9.37 5.03 0.00 2.89 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 0.00 158 F 8.69 3.47 0.00 2.46 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.26 3.85 0.00 2.11 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 2.37 2.45 0.00 160 E 8.90 4.00 0.00 2.24 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 0.00 2.35 2.44 0.00 161 F 8.03 4.09 0.00 3.17 3.21 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 0.00 162 V 7.60 3.32 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 0.85 0.00 0.00 0.12 0.00 0.00 163 R 7.72 3.89 0.00 1.99 1.90 0.00 3.27 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 164 M 7.47 4.08 0.00 1.76 2.01 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.53 0.00 165 M 7.40 4.52 0.00 2.05 1.68 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 166 S 7.38 4.96 0.00 3.79 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 0.00 167 R 8.35 4.13 0.00 1.77 1.81 0.00 3.22 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00