NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4119 8.3044 118.1922 54.8461 32.8148 173.5202 2 E 4.0800 8.4886 119.5865 55.8183 30.6316 174.7134 3 L 5.2292 8.6551 125.9467 53.7342 45.8756 174.2174 4 T 4.7522 8.8745 114.0779 61.6551 71.1026 171.8843 5 T 5.2509 8.4877 110.8846 60.0087 71.8550 173.3001 6 R 4.7417 8.9610 121.9387 54.9926 34.2975 173.9130 7 T 5.0555 8.3731 120.4061 61.6063 70.7618 173.9346 8 L 4.3278 8.9713 128.6732 53.5657 42.6729 175.7539 9 P 4.6412 0.0000 0.0000 62.1714 32.1538 176.2063 10 A 4.0352 8.5115 122.0436 54.2686 18.3363 177.7944 11 R 4.2243 7.5889 116.1205 54.8078 29.3011 175.7159 12 K 4.3590 8.3237 124.4355 56.4733 34.0379 175.9370 13 H 5.0868 9.5962 120.9051 54.7389 30.3632 173.8345 14 I 5.0326 9.0877 125.3998 59.4933 39.6273 174.7250 15 A 5.2283 8.9090 128.5391 50.2309 21.5800 175.4353 16 L 5.0552 9.0269 122.3363 52.9150 44.7589 175.9259 17 V 4.7068 9.0465 123.6175 61.2090 35.1335 173.9540 18 A 5.3966 8.4772 126.9708 51.1511 22.2191 175.6736 19 H 4.7219 9.2848 118.4507 55.5892 30.0805 176.3631 20 D 4.4777 9.2303 120.9709 58.4591 40.5258 179.4178 21 H 4.3520 8.4563 113.2291 57.7273 29.0899 176.2205 22 C 4.6963 8.4080 117.8706 59.2750 28.9595 175.5753 23 K 4.0141 7.9112 123.8631 60.4916 31.7499 179.4316 24 Q 4.1027 8.1835 120.0745 60.6550 27.9554 180.1928 25 M 4.3565 8.1083 119.5832 58.3053 32.2261 177.9545 26 L 4.3092 8.1876 120.8619 58.1039 42.2027 178.7021 27 M 4.1149 8.5046 119.2142 58.6387 31.9924 178.6341 28 S 4.1236 8.3314 113.1797 61.1818 62.2884 176.0425 29 W 4.1433 7.9965 129.9840 60.2397 30.7952 177.9981 30 V 3.6585 8.4443 118.6022 66.2348 30.9646 177.9359 31 E 3.9528 8.3843 118.4129 59.3606 29.0466 179.3481 32 R 3.9070 7.7849 117.6741 58.4011 30.2298 176.6625 33 H 4.6599 7.4837 114.1099 55.0412 29.9337 174.8894 34 Q 3.8779 7.7620 123.4309 59.1406 28.3749 177.1082 35 P 4.1944 0.0000 0.0000 65.6585 31.6524 177.9989 36 L 4.1528 7.7442 118.2267 58.2035 42.2186 178.6972 37 L 4.1333 8.0999 118.9162 57.7100 41.2428 179.0674 38 E 3.9759 8.2624 118.7870 58.9061 29.5587 177.8739 39 Q 4.3497 7.8860 115.6586 55.9396 29.1656 174.2090 40 H 4.9820 7.9983 117.0425 53.8754 33.0265 172.8279 41 V 4.2109 8.3742 119.1482 61.7301 32.8205 174.4538 42 L 5.2967 8.3599 128.0057 53.6457 43.8777 175.2652 43 Y 5.2084 9.2177 119.8213 56.6081 42.5032 174.0943 44 A 5.2020 8.6277 120.7803 52.2454 23.6033 176.0704 45 T 3.9243 8.4030 109.8007 61.3167 70.4797 174.7159 46 G 3.7376 8.8789 104.9249 49.0827 0.0000 175.9455 47 T 3.8857 7.8429 115.5721 66.2292 69.1191 176.5205 48 T 4.0086 8.1092 117.0611 66.7312 68.5046 176.4273 49 G 3.6654 8.5678 107.6000 48.1270 0.0000 175.4599 50 N 4.4005 8.0244 118.9970 55.7751 38.4317 177.5217 51 L 4.0083 8.0131 120.4240 57.8533 41.7153 179.7627 52 I 3.7449 7.7697 119.5699 64.4173 37.0157 178.4650 53 S 4.4015 8.1392 119.7041 61.9292 62.5302 177.6443 54 R 3.8313 7.9909 121.6527 61.4245 29.1296 180.2187 55 A 4.4871 7.7850 119.5389 53.8558 18.8621 178.6153 56 T 4.4816 7.9387 105.4765 60.5496 70.3623 175.5330 57 G 3.9320 8.7306 109.6547 45.7899 0.0000 173.8651 58 M 4.2571 7.6915 120.0525 54.8109 32.6468 175.4688 59 N 4.5910 8.4792 119.9052 53.1471 39.4091 174.8651 60 V 4.4298 7.9654 122.0004 61.1974 34.9106 174.9038 61 N 4.5978 8.9130 125.8541 52.5187 38.4913 173.4940 62 A 4.6607 8.3432 125.7709 51.9434 19.4110 176.7560 63 M 4.5724 8.9575 123.2494 53.6053 35.5341 175.5629 64 L 4.1941 8.8668 119.5098 54.7996 43.2173 177.1862 65 S 4.4500 8.6376 115.1465 58.4331 63.3729 174.9040 66 G 3.8079 9.1155 112.2149 47.9726 0.0000 174.2287 67 P 4.2907 0.0000 0.0000 64.6691 31.4177 177.5824 68 M 4.4218 7.8330 114.8012 54.7267 32.6567 175.7791 69 G 3.8100 8.3034 108.2005 45.3860 0.0000 176.4802 70 G 3.6805 8.6798 108.3224 47.9677 0.0000 175.6252 71 D 4.2789 7.9829 120.5679 57.2822 40.8121 178.5493 72 Q 4.0093 7.9485 118.0641 58.5746 28.8420 178.4230 73 Q 3.9226 7.9337 119.4622 58.8058 28.7699 178.8044 74 V 3.5680 7.8053 119.4222 65.8697 31.6032 178.1101 75 G 3.6542 8.1785 105.3673 47.7873 0.0000 175.2788 76 A 3.9262 8.1382 123.3297 55.0361 18.4568 179.7828 77 L 3.7972 7.7959 117.3264 57.7214 41.4818 179.9414 78 I 3.4694 7.6583 120.0293 64.3547 36.8937 178.7071 79 S 2.7900 7.5267 113.3083 60.4147 62.7701 175.3409 80 E 3.9936 7.3291 119.6489 55.6276 29.4056 176.9122 81 G 3.6314 7.3151 107.2976 46.1785 0.0000 174.8179 82 K 4.1018 8.1475 118.6005 56.0534 32.7380 176.7812 83 I 4.3464 7.2352 119.4854 59.4637 39.5712 174.7149 84 D 4.8633 9.0089 124.2919 54.7708 42.7578 176.9837 85 V 4.7235 7.6029 117.5519 61.0924 35.6449 173.1705 86 L 4.8738 8.9358 129.0993 53.3939 44.9199 174.9768 87 I 4.5170 8.9036 128.2483 59.6842 39.0668 174.5170 88 F 5.4819 9.0957 130.8750 56.6972 41.4813 173.6762 89 F 5.4260 9.4500 127.8363 56.0799 38.0245 175.2152 90 W 4.4172 7.7792 119.4600 54.9605 29.9927 176.1994 91 D 4.3299 9.0050 121.7678 53.2306 40.2740 174.2678 92 P 4.3070 0.0000 0.0000 63.4016 31.7118 176.4905 93 L 4.6625 8.2008 117.7545 54.3761 42.5421 176.0970 94 N 4.7063 7.8891 116.3612 51.6166 41.5048 174.1988 95 A 4.1821 8.6651 127.2024 52.1905 19.3527 176.7134 96 V 4.5486 8.0701 115.2006 58.4685 34.5666 175.2966 97 P 4.3216 0.0000 0.0000 65.6235 31.4340 177.0293 98 Q 4.4972 7.8715 116.8696 56.3330 29.9761 177.1695 99 D 4.3600 7.8788 122.7677 58.1190 41.0924 175.8714 100 P 4.2541 0.0000 0.0000 66.0048 31.3403 178.1569 101 D 4.3277 8.0809 118.2022 56.9125 40.7547 178.7850 102 V 3.7842 7.7199 118.7923 66.0849 31.5810 178.2922 103 K 3.8311 8.0769 117.9900 59.2870 31.8651 179.2117 104 A 3.9740 8.2801 121.3654 54.9379 18.3207 179.3786 105 L 3.8786 7.9855 118.7246 58.4866 42.3752 179.2205 106 L 4.0807 8.0162 118.8431 57.6682 41.4113 179.5450 107 R 3.8655 8.3876 119.0869 59.4432 30.0269 178.5752 108 L 4.0167 8.0832 118.4774 57.8939 41.5461 179.3468 109 A 4.1985 8.1750 120.5896 55.4044 18.1869 180.0045 110 T 3.8584 7.7625 113.9053 66.7108 68.4048 177.0059 111 V 3.3182 7.5806 119.2261 65.9613 31.4130 176.9454 112 W 4.3572 8.4081 116.0318 56.1237 29.1845 176.0938 113 N 4.1359 7.6177 116.5763 54.8254 36.9922 173.0807 114 I 4.7336 7.3703 111.2969 58.1109 41.3631 175.6419 115 P 4.4331 0.0000 0.0000 63.4847 32.2374 175.4532 116 V 5.1287 8.4378 122.8061 61.1782 34.9739 174.0119 117 A 4.9531 9.0736 128.7876 50.4942 21.6676 176.4886 118 T 5.3475 9.1451 110.5009 60.8853 70.2081 173.8451 119 N 4.2835 7.4742 119.4717 50.1344 41.7457 175.1440 120 V 3.3872 7.5936 118.9722 65.9990 31.5607 177.5287 121 A 4.1354 7.8825 119.9337 55.6937 18.2634 179.6340 122 T 3.8195 8.4030 114.0046 66.6632 68.5344 176.8596 123 A 4.0097 8.0447 122.7712 55.2961 18.2973 179.4958 124 D 4.6194 8.8712 117.8723 57.6195 40.7228 178.9665 125 F 3.9723 8.4547 117.4737 60.4717 39.1809 177.6192 126 I 3.9864 8.1331 119.4437 64.5446 36.8141 178.3878 127 I 2.7159 7.6256 117.8831 63.3698 37.8234 176.9905 128 Q 4.2063 7.7283 116.3584 55.2118 29.6255 176.0374 129 S 4.2857 7.5098 116.7710 57.3205 63.2409 172.7322 130 P 4.2278 0.0000 0.0000 66.2989 31.4518 176.9299 131 H 5.6614 8.0120 112.5005 55.3665 28.5467 177.0195 132 F 4.2067 8.2219 124.3781 60.5161 39.2596 175.7190 133 N 4.9277 8.2583 115.2388 52.9473 38.5155 173.4616 134 D 5.1101 7.6062 118.3825 52.0053 44.5575 175.2088 135 A 4.5314 8.4015 121.8657 52.0359 19.3451 177.2872 136 V 4.3979 8.6102 121.4402 61.1225 35.0707 174.0102 137 D 5.3374 8.8164 127.8042 53.5708 41.8754 175.7580 138 I 4.7001 8.8996 116.8187 58.9333 41.1333 174.4209 139 L 4.9534 8.5139 124.2480 54.3151 42.5622 176.1295 140 I 4.7959 8.8139 116.4401 58.1160 41.5366 172.9447 141 P 4.3584 0.0000 0.0000 63.2178 32.0568 177.2876 142 D 4.6784 9.3026 123.8298 52.8665 39.7998 175.9900 143 Y 4.2938 8.5591 125.9214 60.9009 38.8758 176.6005 144 Q 3.9590 8.5698 121.9235 60.2896 29.0361 179.0502 145 R 3.9174 8.1573 120.6582 61.6062 29.2402 180.1766 146 Y 4.1736 8.0527 119.5294 60.8388 38.5943 178.1541 147 L 3.3906 8.2101 121.1695 57.5475 41.8346 178.7574 148 A 3.9068 7.8535 120.6246 55.3060 18.4236 179.1207 149 D 4.3557 7.7354 116.0692 57.3877 40.8651 178.9098 150 R 3.9394 7.2026 118.2002 57.9280 30.0502 176.6352 151 L 4.2884 7.3389 122.4256 55.6745 40.5334 176.0099 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 4.41 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 2 E 8.49 4.08 0.00 2.22 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 2.39 2.49 0.00 3 L 8.66 5.23 0.00 1.54 1.55 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.87 4.75 4.29 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 1.36 0.00 0.00 5 T 8.49 5.25 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 6 R 8.96 4.74 0.00 1.91 1.79 0.00 2.99 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 7 T 8.37 5.06 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 1.25 0.00 0.00 8 L 8.97 4.33 0.00 1.55 1.56 0.93 0.74 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 9 P 0.00 4.64 0.00 2.17 2.06 0.00 3.78 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 2.13 2.02 0.00 10 A 8.51 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 11 R 7.59 4.22 0.00 1.72 1.85 0.00 3.17 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 12 K 8.32 4.36 0.00 1.52 1.60 0.00 1.55 0.00 0.00 1.87 0.00 0.00 2.49 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.10 0.57 7.81 13 H 9.60 5.09 0.00 3.18 3.22 0.00 5.78 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 9.09 5.03 2.03 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.94 1.07 0.00 0.00 15 A 8.91 5.23 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 16 L 9.03 5.06 0.00 1.57 1.55 1.01 0.63 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 17 V 9.05 4.71 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 0.75 0.00 0.00 0.71 0.00 0.00 18 A 8.48 5.40 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 19 H 9.28 4.72 0.00 3.25 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 9.23 4.48 0.00 2.78 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 21 H 8.46 4.35 0.00 3.26 3.39 0.00 5.86 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 22 C 8.41 4.70 0.00 3.24 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 23 K 7.91 4.01 0.00 1.96 1.94 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.78 7.81 24 Q 8.18 4.10 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.00 0.00 25 M 8.11 4.36 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.54 0.00 26 L 8.19 4.31 0.00 1.94 1.96 0.53 0.97 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 27 M 8.50 4.11 0.00 2.09 2.32 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 2.67 2.94 0.00 28 S 8.33 4.12 0.00 3.96 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 29 W 8.00 4.14 0.00 3.61 3.56 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 30 V 8.44 3.66 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 1.00 0.00 0.00 1.20 0.00 0.00 31 E 8.38 3.95 0.00 2.03 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 2.33 2.58 0.00 32 R 7.78 3.91 0.00 1.78 1.87 0.00 3.11 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.46 0.00 33 H 7.48 4.66 0.00 2.53 2.81 0.00 5.70 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.76 3.88 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.26 6.74 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 35 P 0.00 4.19 0.00 2.02 2.09 0.00 3.65 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 1.98 2.12 0.00 36 L 7.74 4.15 0.00 1.75 1.74 1.14 0.60 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 37 L 8.10 4.13 0.00 1.72 1.76 0.84 0.80 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 38 E 8.26 3.98 0.00 2.27 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 39 Q 7.89 4.35 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.43 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 40 H 8.00 4.98 0.00 3.20 3.43 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.37 4.21 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 0.87 0.00 0.00 42 L 8.36 5.30 0.00 1.62 1.60 0.96 0.93 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 43 Y 9.22 5.21 0.00 2.83 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 44 A 8.63 5.20 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.40 3.92 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 1.15 0.00 0.00 46 G 8.88 3.74 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 0.00 0.00 0.00 47 T 7.84 3.89 4.28 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 1.24 0.00 0.00 48 T 8.11 4.01 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 49 G 8.57 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 50 N 8.02 4.40 0.00 2.78 2.89 0.00 0.00 7.11 6.53 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 51 L 8.01 4.01 0.00 1.88 1.75 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.77 3.74 2.03 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 1.57 1.04 0.94 0.00 0.00 53 S 8.14 4.40 0.00 4.01 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 54 R 7.99 3.83 0.00 1.91 1.86 0.00 3.26 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 55 A 7.79 4.49 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 56 T 7.94 4.48 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 1.25 0.00 0.00 57 G 8.73 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 58 M 7.69 4.26 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 59 N 8.48 4.59 0.00 2.67 2.70 0.00 0.00 6.65 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 60 V 7.97 4.43 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 0.80 0.00 0.00 0.97 0.00 0.00 61 N 8.91 4.60 0.00 2.18 2.64 0.00 0.00 6.53 8.78 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 62 A 8.34 4.66 1.22 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 0.00 0.00 0.00 63 M 8.96 4.57 0.00 2.09 2.03 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 2.57 2.81 0.00 64 L 8.87 4.19 0.00 1.64 1.60 0.92 0.89 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 65 S 8.64 4.45 0.00 3.92 3.74 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 66 G 9.12 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 67 P 0.00 4.29 0.00 2.05 2.16 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 68 M 7.83 4.42 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 69 G 8.30 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 70 G 8.68 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 71 D 7.98 4.28 0.00 2.71 2.66 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 0.00 0.00 0.00 0.00 72 Q 7.95 4.01 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 73 Q 7.93 3.92 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 74 V 7.81 3.57 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 0.88 0.00 0.00 0.91 0.00 0.00 75 G 8.18 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.14 3.93 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 77 L 7.80 3.80 0.00 1.66 1.47 0.75 0.77 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 78 I 7.66 3.47 1.95 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 1.47 0.77 0.90 0.00 0.00 79 S 7.53 2.79 0.00 3.91 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 80 E 7.33 3.99 0.00 1.98 1.82 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 2.14 2.10 0.00 81 G 7.32 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 82 K 8.15 4.10 0.00 1.58 1.60 0.00 1.50 0.00 0.00 1.60 0.00 0.00 2.76 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.26 1.21 7.81 83 I 7.24 4.35 1.70 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.64 0.86 0.00 0.00 84 D 9.01 4.86 0.00 2.50 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.60 4.72 2.21 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 1.19 0.00 0.00 1.05 0.00 0.00 86 L 8.94 4.87 0.00 1.80 1.52 0.85 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.90 4.52 1.65 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.66 -0.00 0.00 0.00 88 F 9.10 5.48 0.00 3.01 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 89 F 9.45 5.43 0.00 2.93 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 90 W 7.78 4.42 0.00 3.04 1.75 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 91 D 9.01 4.33 0.00 2.77 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 92 P 0.00 4.31 0.00 1.88 1.17 0.00 3.45 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.52 0.00 93 L 8.20 4.66 0.00 1.53 1.62 0.85 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 94 N 7.89 4.71 0.00 2.75 2.63 0.00 0.00 7.01 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 95 A 8.67 4.18 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 96 V 8.07 4.55 2.29 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 0.87 0.00 0.00 0.97 0.00 0.00 97 P 0.00 4.32 0.00 2.18 2.20 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 98 Q 7.87 4.50 0.00 2.43 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.88 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 99 D 7.88 4.36 0.00 2.97 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 P 0.00 4.25 0.00 2.30 2.28 0.00 3.76 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 2.07 2.05 0.00 101 D 8.08 4.33 0.00 2.98 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 0.00 102 V 7.72 3.78 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 0.74 0.00 0.00 1.21 0.00 0.00 103 K 8.08 3.83 0.00 1.95 1.77 0.00 1.31 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.35 1.34 7.81 104 A 8.28 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.99 3.88 0.00 1.85 1.91 0.84 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.02 4.08 0.00 1.81 1.69 0.44 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.39 3.87 0.00 1.97 2.08 0.00 3.07 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 1.59 1.64 0.00 108 L 8.08 4.02 0.00 1.97 1.88 1.00 0.98 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 0.00 109 A 8.18 4.20 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.76 3.86 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 1.19 0.00 0.00 111 V 7.58 3.32 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 -0.03 0.00 0.00 0.84 0.00 0.00 112 W 8.41 4.36 0.00 3.40 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 0.00 113 N 7.62 4.14 0.00 2.77 2.91 0.00 0.00 6.89 8.09 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 0.00 114 I 7.37 4.73 2.13 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 1.31 0.91 1.00 0.00 0.00 115 P 0.00 4.43 0.00 2.21 2.16 0.00 3.88 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 116 V 8.44 5.13 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 0.90 0.00 0.00 1.07 0.00 0.00 117 A 9.07 4.95 1.22 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 0.00 0.00 0.00 118 T 9.15 5.35 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 119 N 7.47 4.28 0.00 2.62 2.59 0.00 0.00 5.86 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 0.00 120 V 7.59 3.39 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 1.33 0.00 0.00 0.71 0.00 0.00 121 A 7.88 4.14 1.31 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 0.00 0.00 122 T 8.40 3.82 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 1.23 0.00 0.00 123 A 8.04 4.01 0.79 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 0.00 124 D 8.87 4.62 0.00 3.08 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 0.00 125 F 8.45 3.97 0.00 3.13 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 0.00 126 I 8.13 3.99 1.96 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.90 1.09 0.00 0.00 127 I 7.63 2.72 1.99 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.18 0.85 0.00 0.00 128 Q 7.73 4.21 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.60 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 129 S 7.51 4.29 0.00 4.22 3.87 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 0.00 130 P 0.00 4.23 0.00 1.87 2.04 0.00 3.73 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 2.00 2.10 0.00 131 H 8.01 5.66 0.00 3.26 3.32 0.00 5.90 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 F 8.22 4.21 0.00 3.15 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 0.00 133 N 8.26 4.93 0.00 2.80 2.85 0.00 0.00 6.77 8.06 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 0.00 134 D 7.61 5.11 0.00 2.67 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.40 4.53 1.21 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 0.00 136 V 8.61 4.40 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 1.03 0.00 0.00 1.02 0.00 0.00 137 D 8.82 5.34 0.00 2.61 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.90 4.70 1.91 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 1.37 0.80 0.94 0.00 0.00 139 L 8.51 4.95 0.00 1.57 1.65 0.93 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 0.00 140 I 8.81 4.80 2.17 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.45 1.15 0.00 0.00 141 P 0.00 4.36 0.00 1.47 1.72 0.00 3.16 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.75 0.00 142 D 9.30 4.68 0.00 2.78 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 0.00 143 Y 8.56 4.29 0.00 3.35 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 0.00 144 Q 8.57 3.96 0.00 2.38 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.63 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 145 R 8.16 3.92 0.00 1.85 1.94 0.00 3.31 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.27 0.00 146 Y 8.05 4.17 0.00 3.06 3.04 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 0.00 147 L 8.21 3.39 0.00 1.01 1.29 0.82 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 148 A 7.85 3.91 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 0.00 149 D 7.74 4.36 0.00 2.68 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 R 7.20 3.94 0.00 1.68 1.80 0.00 3.05 0.00 0.00 2.89 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.00 0.00 151 L 7.34 4.29 0.00 1.63 1.53 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00