NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 57 D 4.6013 8.3649 120.3107 52.5991 41.5767 176.1596 58 P 4.1540 0.0000 0.0000 59.6367 31.7833 173.6845 59 P 4.5216 0.0000 0.0000 61.9069 33.1190 175.8116 60 I 3.7990 8.0426 119.8403 61.7850 37.5354 175.9041 61 Q 4.5116 9.0043 124.9034 55.5365 29.8646 175.3024 62 R 5.2950 9.2130 120.1230 55.0119 33.5277 173.8266 63 L 5.2330 9.1840 122.7707 53.8013 46.0969 174.3235 64 R 5.1546 9.6212 126.1741 54.5888 33.2316 174.3609 65 G 4.2675 9.4404 112.5177 44.3296 0.0000 171.5597 66 A 4.8427 8.5716 125.5348 51.3070 20.4276 176.8713 67 V 4.9198 8.8632 120.5031 60.6258 33.6674 175.8557 68 T 4.5656 8.9758 117.3719 60.6943 70.9286 173.5850 69 R 4.7553 7.6289 116.8947 54.9733 32.6625 173.5478 70 C 5.4515 8.5310 116.9895 54.7277 40.5133 172.4846 71 E 4.6422 9.4018 126.3836 55.8550 32.3153 174.9121 72 D 4.6234 9.7787 125.8154 55.6554 38.6757 174.5002 73 G 3.9903 8.4124 103.3921 45.9314 0.0000 173.4334 74 Q 5.0811 7.7399 117.2667 53.2473 32.4318 174.6794 75 L 4.3863 8.4577 121.8949 55.0757 41.9790 176.5673 76 F 4.5426 9.3828 127.2794 57.7606 40.6545 174.2263 77 I 4.3276 8.6028 128.4149 60.2830 37.9862 175.7773 78 S 4.4276 8.9207 124.5377 56.4510 63.0352 172.7962 79 S 4.6441 8.2837 122.6233 58.0079 62.7875 173.4101 80 Y 4.2283 8.1824 125.2865 57.9925 38.6278 176.2964 81 K 4.3107 8.7286 124.3990 55.7239 31.9651 175.1502 82 N 4.8511 8.1594 123.1419 51.9506 41.7174 175.0887 83 E 3.9353 8.6124 121.8582 59.4788 29.5559 177.6673 84 Y 4.5548 7.8774 115.2800 59.1754 38.2967 175.5881 85 Q 4.2783 7.9523 120.5096 56.0407 28.9927 175.8598 86 T 4.6573 8.8130 111.6208 61.2359 69.6247 173.1998 87 M 4.9948 7.8883 119.9993 53.9673 36.0098 174.3854 88 E 4.7243 8.6745 119.3124 54.8929 32.6436 174.9438 89 V 4.7574 8.2550 122.3947 61.2819 33.4850 174.8007 90 Q 4.4443 8.8138 128.3696 55.5993 31.9736 174.4783 91 N 3.9115 9.5980 121.3291 54.6593 36.2814 173.2022 92 N 4.0236 8.2799 109.4427 54.3565 37.7870 173.1696 93 S 4.9416 7.6797 108.8404 56.1883 67.3585 173.1062 94 V 4.2433 8.7283 122.6617 62.4673 32.4034 175.0807 95 V 4.1262 8.5958 129.6901 62.5184 32.1524 175.3510 96 I 4.1848 8.5626 129.9366 60.7165 37.7118 176.4677 97 K 4.6461 8.9432 126.5497 56.8569 34.2609 176.9837 98 C 5.6167 8.1151 116.3941 54.7057 42.8765 174.0511 99 D 4.9481 9.5419 123.8066 53.9621 41.4600 176.2984 100 G 4.1886 7.8871 109.9721 44.8041 0.0000 171.1905 101 L 4.8600 8.0124 120.2209 54.4245 42.9344 176.2403 102 Y 5.0841 8.9963 120.6758 56.1683 42.0873 174.6955 103 I 4.7070 8.6171 123.6646 60.7772 39.1011 174.7659 104 I 5.0838 9.1949 127.8199 59.7284 39.7458 173.8944 105 Y 5.1771 9.4424 128.4848 55.6490 41.8705 173.8907 106 L 5.3468 8.4480 128.1577 53.1216 45.6671 175.1381 107 K 5.3697 8.2051 124.0392 54.1196 36.5288 175.3603 108 G 4.2089 7.8119 106.0069 46.4451 0.0000 172.0928 109 S 5.3770 8.3082 118.3278 56.4499 66.0741 173.3735 110 F 4.8293 9.4276 122.0573 55.8092 42.0784 175.3604 111 F 5.0330 8.7486 117.9885 58.0934 39.5965 175.8511 112 Q 4.6558 7.7297 117.1016 53.7238 31.5655 174.1342 113 E 4.1384 8.7366 120.2974 56.5961 30.0765 176.3974 114 V 4.4737 8.1303 124.7374 59.8306 35.1231 174.7302 115 K 4.4952 8.4214 120.9628 54.7228 34.8832 175.0126 116 I 4.9977 8.1517 125.0185 59.4603 40.6466 174.1588 117 D 5.1811 8.8613 125.1030 52.3015 44.6649 174.4310 118 L 4.7451 8.5673 124.7654 53.6670 44.2680 174.6838 119 H 4.8694 8.8562 123.5722 54.1435 31.2515 174.9059 120 F 5.0619 8.2182 118.5987 58.0474 41.4972 175.0916 121 R 4.8383 7.5737 117.1456 55.3560 32.6756 174.9776 122 E 4.2999 9.2611 119.4665 58.2037 29.4928 177.8931 123 D 4.8464 8.0392 115.7663 53.0494 39.8064 175.3232 124 H 4.5346 7.7630 119.3642 55.5292 30.5770 174.2784 125 N 4.3780 8.3432 125.4255 52.3564 39.0897 172.8351 126 P 4.2603 0.0000 0.0000 62.5446 32.8146 175.6935 127 I 4.0138 7.9912 122.6666 60.4756 38.5059 175.1314 128 S 4.6174 8.3560 122.4709 57.4519 62.9429 173.2830 129 I 3.4854 8.0358 129.3132 59.5821 37.3527 174.5330 130 P 4.2927 0.0000 0.0000 62.8558 31.8730 175.7034 131 M 4.7423 8.3401 121.3559 53.6124 34.6403 175.1879 132 L 4.6114 8.8405 121.3453 53.4410 44.8681 175.7874 133 N 4.2217 8.9910 113.4793 55.5083 35.8837 174.2956 134 D 4.1780 9.1573 110.1931 55.6735 38.9883 175.1826 135 G 3.8423 8.3229 102.7422 45.9205 0.0000 174.7718 136 R 4.7593 7.7404 115.5311 55.4839 32.5605 175.4308 137 R 5.2074 8.4162 119.9632 54.5410 34.0884 173.5853 138 I 4.7784 9.0196 126.6866 59.5459 40.1984 174.9055 139 V 4.4574 8.4205 125.7476 61.3016 34.0215 174.0950 140 F 4.8848 8.8464 130.5098 56.7965 42.7445 173.2338 141 T 5.0942 7.9833 122.1444 61.6029 71.4879 173.7501 142 V 4.3846 8.6154 124.5344 59.8841 35.1969 174.2210 143 V 4.9237 8.4381 122.5038 61.3610 33.3199 174.5094 144 A 4.7600 8.8183 127.9859 50.3921 23.1928 174.9711 145 S 4.7425 8.6850 115.5734 58.0020 63.0384 173.3596 146 L 4.9339 9.0982 127.2748 52.9500 44.9353 175.6821 147 A 5.1622 8.9782 122.9652 49.7715 22.3730 175.4060 148 F 4.5230 8.7774 121.0711 60.2584 39.6782 176.2338 149 K 3.7646 8.0816 126.6744 55.8340 31.1965 176.7219 150 D 4.6857 7.8698 118.9904 54.3108 42.1394 175.8004 151 K 4.9962 8.9066 120.8685 54.9406 35.7544 176.0537 152 V 4.6266 8.9279 126.9891 62.0603 32.5240 174.4466 153 Y 5.3297 8.6561 125.1918 55.7002 42.5475 173.7522 154 L 5.1962 8.6366 118.6877 53.3010 45.2271 176.0206 155 T 5.0559 8.7806 114.4858 60.1887 71.7561 173.7949 156 V 4.5073 8.1650 123.5618 61.3044 32.8476 175.4639 157 N 4.6638 8.8088 128.0368 53.4363 37.9189 173.6765 158 A 4.4035 7.9872 125.8438 50.2900 22.2548 174.2179 159 P 4.4462 0.0000 0.0000 62.6604 32.1503 177.6964 160 D 4.4111 8.7968 120.3511 58.0823 40.7052 179.1893 161 T 3.8910 8.1428 115.3350 66.9013 68.6195 176.4099 162 L 4.2479 7.6025 119.4968 57.1631 41.5655 178.8195 163 C 4.3936 7.9968 119.4045 59.6280 43.5017 175.3193 164 E 3.7897 7.5436 116.9401 58.6213 29.2407 177.0265 165 H 4.7482 7.4611 114.0878 55.3787 29.6032 174.8461 166 L 4.1979 7.7902 123.0992 55.0081 42.3674 175.7637 167 Q 4.7111 8.6557 124.2743 54.0775 31.7896 174.7467 168 I 4.1028 8.3394 124.1730 59.3633 40.3143 174.3769 169 N 4.8428 8.5035 124.1873 51.6252 41.2014 174.2595 170 D 4.4642 8.3893 118.5684 55.2688 40.1234 172.9805 171 G 4.3730 7.6082 104.0930 43.9859 0.0000 173.2500 172 E 5.3865 9.1278 124.6703 54.9016 33.9611 173.2002 173 L 5.3656 9.2909 129.0995 53.3750 45.0015 174.8714 174 I 5.1838 9.1623 126.8465 59.5120 40.8163 174.5090 175 V 5.1250 8.9429 126.5581 61.0596 34.4473 174.6417 176 V 4.9533 8.8301 126.9265 60.0921 34.8209 174.1963 177 Q 3.4193 8.9318 127.2484 55.8544 28.8535 175.3506 178 L 4.5913 8.9547 126.7658 55.4963 43.8547 176.9520 179 T 4.7753 7.3650 107.5679 58.9197 72.2678 172.1667 180 P 4.5776 0.0000 0.0000 63.1709 32.8973 174.9616 181 G 4.0776 8.0796 105.8283 45.6909 0.0000 172.0115 182 Y 4.2818 8.5625 120.3647 58.6760 39.5485 176.1313 183 C 5.1093 7.9276 122.6164 54.6189 43.2344 173.3985 184 A 3.6117 7.6405 125.9711 50.4767 18.3121 175.8699 185 P 4.1550 0.0000 0.0000 62.3249 32.1302 175.8845 186 E 3.8884 8.5115 121.7604 57.9936 29.7137 177.5366 187 G 3.9436 9.0264 111.3952 45.8143 0.0000 173.7895 188 S 4.6365 7.6659 113.0043 58.0560 64.0739 173.6246 189 Y 4.7756 7.6570 121.2341 56.2503 41.7442 174.2546 190 H 4.3966 7.5705 121.8939 56.0630 29.8993 173.2008 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 57 D 8.36 4.60 0.00 2.76 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 58 P 0.00 4.15 0.00 2.10 1.98 0.00 3.63 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 1.94 2.06 0.00 59 P 0.00 4.52 0.00 2.19 2.07 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 60 I 8.04 3.80 1.83 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 1.35 0.49 0.86 0.00 0.00 61 Q 9.00 4.51 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.71 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 62 R 9.21 5.30 0.00 1.85 1.99 0.00 2.75 0.00 0.00 3.13 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 63 L 9.18 5.23 0.00 1.75 1.55 1.01 1.10 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 64 R 9.62 5.15 0.00 1.99 1.89 0.00 3.09 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.68 0.00 65 G 9.44 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 0.00 0.00 0.00 0.00 66 A 8.57 4.84 1.05 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 67 V 8.86 4.92 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 1.07 0.00 0.00 0.95 0.00 0.00 68 T 8.98 4.57 4.22 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 0.00 0.00 0.00 1.21 0.00 0.00 69 R 7.63 4.76 0.00 1.94 2.02 0.00 2.78 0.00 0.00 3.13 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 70 C 8.53 5.45 0.00 2.99 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 71 E 9.40 4.64 0.00 1.92 1.85 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 2.19 2.19 0.00 72 D 9.78 4.62 0.00 2.87 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 73 G 8.41 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 7.74 5.08 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 75 L 8.46 4.39 0.00 1.61 1.69 1.02 0.76 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 76 F 9.38 4.54 0.00 3.14 2.95 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 77 I 8.60 4.33 1.63 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.61 0.83 0.00 0.00 78 S 8.92 4.43 0.00 3.98 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 79 S 8.28 4.64 0.00 3.88 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 80 Y 8.18 4.23 0.00 2.95 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 81 K 8.73 4.31 0.00 1.75 1.81 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.44 7.81 82 N 8.16 4.85 0.00 2.76 2.64 0.00 0.00 6.85 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 83 E 8.61 3.94 0.00 1.92 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 1.67 1.47 0.00 84 Y 7.88 4.55 0.00 3.13 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 85 Q 7.95 4.28 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.96 0.00 0.00 0.00 0.00 0.00 2.50 2.71 0.00 86 T 8.81 4.66 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 1.26 0.00 0.00 87 M 7.89 4.99 0.00 1.92 2.03 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.74 0.00 88 E 8.67 4.72 0.00 1.90 1.85 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 2.34 2.25 0.00 89 V 8.26 4.76 2.03 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 0.67 0.00 0.00 0.90 0.00 0.00 90 Q 8.81 4.44 0.00 2.05 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.02 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 91 N 9.60 3.91 0.00 2.81 2.78 0.00 0.00 6.99 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.28 4.02 0.00 2.77 2.80 0.00 0.00 6.99 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 93 S 7.68 4.94 0.00 4.10 3.84 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 94 V 8.73 4.24 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 0.98 0.00 0.00 0.95 0.00 0.00 95 V 8.60 4.13 2.12 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 0.86 0.00 0.00 0.95 0.00 0.00 96 I 8.56 4.18 1.89 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.20 0.83 0.00 0.00 97 K 8.94 4.65 0.00 1.71 1.82 0.00 1.69 0.00 0.00 2.10 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.44 7.81 98 C 8.12 5.62 0.00 2.92 2.98 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 0.00 0.00 0.00 99 D 9.54 4.95 0.00 2.72 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 0.00 100 G 7.89 4.19 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 0.00 0.00 0.00 101 L 8.01 4.86 0.00 1.57 1.59 0.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 9.00 5.08 0.00 2.76 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 0.00 103 I 8.62 4.71 1.91 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 1.24 0.93 0.97 0.00 0.00 104 I 9.19 5.08 2.06 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.66 1.09 0.00 0.00 105 Y 9.44 5.18 0.00 3.01 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 0.00 106 L 8.45 5.35 0.00 1.81 1.50 0.97 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.21 5.37 0.00 1.85 1.79 0.00 1.93 0.00 0.00 1.97 0.00 0.00 3.18 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.46 7.81 108 G 7.81 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 0.00 0.00 0.00 109 S 8.31 5.38 0.00 3.65 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 0.00 110 F 9.43 4.83 0.00 2.72 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 0.00 111 F 8.75 5.03 0.00 3.11 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 0.00 112 Q 7.73 4.66 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 113 E 8.74 4.14 0.00 1.94 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 2.23 2.25 0.00 114 V 8.13 4.47 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 0.68 0.00 0.00 115 K 8.42 4.50 0.00 1.61 1.63 0.00 1.55 0.00 0.00 1.75 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.34 7.81 116 I 8.15 5.00 1.70 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.50 0.83 0.00 0.00 117 D 8.86 5.18 0.00 2.46 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 0.00 0.00 0.00 0.00 118 L 8.57 4.75 0.00 1.53 1.26 1.04 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.86 4.87 0.00 1.44 2.73 0.00 5.83 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.22 5.06 0.00 2.57 2.75 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 0.00 121 R 7.57 4.84 0.00 1.86 1.96 0.00 3.26 0.00 0.00 3.55 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 122 E 9.26 4.30 0.00 2.03 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 2.30 2.33 0.00 123 D 8.04 4.85 0.00 2.77 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 0.00 124 H 7.76 4.53 0.00 3.18 3.45 0.00 5.75 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 N 8.34 4.38 0.00 2.62 2.56 0.00 0.00 7.11 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.26 0.00 1.77 1.27 0.00 3.39 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.91 0.00 127 I 7.99 4.01 1.67 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 1.06 0.42 0.90 0.00 0.00 128 S 8.36 4.62 0.00 3.78 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.04 3.49 1.64 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.16 0.13 0.46 0.00 0.00 130 P 0.00 4.29 0.00 2.10 2.01 0.00 3.70 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 2.19 2.16 0.00 131 M 8.34 4.74 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 132 L 8.84 4.61 0.00 1.76 1.59 0.96 0.94 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 0.00 133 N 8.99 4.22 0.00 3.02 2.90 0.00 0.00 6.89 8.08 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 0.00 134 D 9.16 4.18 0.00 2.81 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 0.00 135 G 8.32 3.84 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 0.00 0.00 0.00 136 R 7.74 4.76 0.00 2.00 2.19 0.00 3.16 0.00 0.00 3.22 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.57 0.00 137 R 8.42 5.21 0.00 1.92 1.76 0.00 3.08 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 138 I 9.02 4.78 1.97 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 1.12 1.16 0.96 0.00 0.00 139 V 8.42 4.46 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 0.89 0.00 0.00 0.99 0.00 0.00 140 F 8.85 4.88 0.00 3.05 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 0.00 141 T 7.98 5.09 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 1.23 0.00 0.00 142 V 8.62 4.38 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 1.08 0.00 0.00 143 V 8.44 4.92 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 0.82 0.00 0.00 0.93 0.00 0.00 144 A 8.82 4.76 1.11 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 0.00 0.00 145 S 8.68 4.74 0.00 3.91 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 0.00 146 L 9.10 4.93 0.00 1.32 1.18 0.12 -0.23 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 0.00 147 A 8.98 5.16 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 0.00 148 F 8.78 4.52 0.00 3.20 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 0.00 149 K 8.08 3.76 0.00 1.46 1.87 0.00 1.35 0.00 0.00 1.33 0.00 0.00 2.13 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.30 0.21 7.81 150 D 7.87 4.69 0.00 2.60 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 0.00 151 K 8.91 5.00 0.00 1.66 1.78 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.37 7.81 152 V 8.93 4.63 2.12 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 1.19 0.00 0.00 0.89 0.00 0.00 153 Y 8.66 5.33 0.00 3.02 2.95 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 0.00 154 L 8.64 5.20 0.00 1.62 1.59 0.96 0.51 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 0.00 155 T 8.78 5.06 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 1.32 0.00 0.00 156 V 8.17 4.51 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 0.72 0.00 0.00 0.97 0.00 0.00 157 N 8.81 4.66 0.00 2.88 2.70 0.00 0.00 7.05 7.84 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 0.00 158 A 7.99 4.40 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 0.00 159 P 0.00 4.45 0.00 2.19 2.00 0.00 3.61 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 2.12 0.00 160 D 8.80 4.41 0.00 2.71 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 0.00 161 T 8.14 3.89 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 1.27 0.00 0.00 162 L 7.60 4.25 0.00 1.85 1.75 0.93 0.86 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 0.00 163 C 8.00 4.39 0.00 2.96 3.28 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 0.00 164 E 7.54 3.79 0.00 2.20 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 2.40 2.29 0.00 165 H 7.46 4.75 0.00 3.31 3.39 0.00 5.66 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 7.79 4.20 0.00 1.92 1.71 1.05 0.94 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 0.00 167 Q 8.66 4.71 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.45 0.00 0.00 0.00 0.00 0.00 2.31 2.66 0.00 168 I 8.34 4.10 1.67 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 0.51 1.09 0.38 0.00 0.00 169 N 8.50 4.84 0.00 2.42 2.64 0.00 0.00 6.36 8.83 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 0.00 170 D 8.39 4.46 0.00 2.86 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 0.00 171 G 7.61 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 0.00 0.00 0.00 0.00 172 E 9.13 5.39 0.00 2.13 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 2.37 2.60 0.00 173 L 9.29 5.37 0.00 1.79 1.52 1.06 0.83 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 0.00 174 I 9.16 5.18 2.05 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 1.22 0.65 0.98 0.00 0.00 175 V 8.94 5.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.99 0.00 0.00 176 V 8.83 4.95 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 0.71 0.00 0.00 0.89 0.00 0.00 177 Q 8.93 3.42 0.00 1.35 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.83 0.00 0.00 0.00 0.00 0.00 2.07 1.49 0.00 178 L 8.95 4.59 0.00 1.60 1.61 0.90 -0.28 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 0.00 179 T 7.37 4.78 4.20 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 1.17 0.00 0.00 180 P 0.00 4.58 0.00 2.07 2.05 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 181 G 8.08 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 0.00 0.00 0.00 182 Y 8.56 4.28 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 0.00 183 C 7.93 5.11 0.00 2.57 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 A 7.64 3.61 0.01 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 0.00 185 P 0.00 4.15 0.00 2.13 1.92 0.00 3.46 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 186 E 8.51 3.89 0.00 1.94 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 2.31 2.28 0.00 187 G 9.03 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 0.00 188 S 7.67 4.64 0.00 3.98 3.98 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 0.00 0.00 0.00 189 Y 7.66 4.78 0.00 3.06 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 0.00 190 H 7.57 4.40 0.00 2.94 2.99 0.00 5.98 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