NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2210 8.1633 120.2932 54.6857 33.1619 174.2406 2 K 3.9308 8.5210 126.3854 56.2381 32.5134 175.7780 3 G 3.9445 8.5427 113.8312 44.9568 0.0000 171.7382 4 D 4.6561 8.4443 119.2911 54.0867 42.0133 177.1960 5 T 3.8613 8.8479 122.7475 66.8682 68.5581 176.6840 6 K 3.8053 8.1668 120.9097 59.2118 32.2489 178.8490 7 V 3.9131 8.6016 118.8980 66.0718 31.4902 177.9882 8 I 3.7330 7.7817 119.4445 64.5977 36.9082 178.0350 9 N 4.2749 8.3288 117.3338 56.4820 38.3141 177.0168 10 Y 4.1074 8.0182 117.9047 61.1174 38.0387 178.5227 11 L 3.8628 8.5002 120.0929 58.0720 41.7103 179.3271 12 N 4.2563 8.6419 116.5014 56.1648 38.5687 177.3814 13 K 3.8545 8.2142 121.1425 59.4402 32.3869 178.7328 14 L 3.8232 8.1226 119.6041 57.6568 41.4117 178.9556 15 L 3.9717 7.8433 120.5852 58.4697 41.7688 179.1632 16 G 3.7173 8.2463 105.4608 48.0790 0.0000 175.3078 17 N 4.3666 7.9348 118.1577 56.2611 38.5754 177.4442 18 E 4.1211 8.3561 120.2538 59.2328 29.4321 179.2970 19 L 4.2215 8.4052 120.1193 58.1584 40.4421 179.7510 20 V 3.5474 7.6825 120.6693 64.6324 31.4211 178.0843 21 A 3.8025 7.9802 121.5504 54.9092 18.3192 179.6232 22 I 3.7710 8.2183 118.5976 64.6949 37.1214 178.5048 23 N 4.4103 7.7634 116.7974 56.2957 38.4106 177.3847 24 Q 3.8349 8.3289 121.3198 59.3607 29.0840 177.9827 25 Y 4.3455 8.3044 118.2096 60.8860 37.9029 178.0367 26 F 3.8454 8.3119 121.2967 61.0893 39.4934 176.6240 27 L 3.9188 8.2429 120.1142 58.7113 41.7897 178.3949 28 H 3.7331 8.2750 115.7687 58.8535 28.6232 177.2070 29 A 4.1689 8.3535 122.5899 55.7134 18.1264 179.9451 30 R 3.8508 7.7349 115.5598 58.6842 30.1267 179.2884 31 M 3.4414 7.7211 119.2822 58.1302 31.8677 178.5047 32 F 4.5388 7.6282 118.1867 60.5009 39.1462 177.5307 33 K 3.8600 8.3796 119.5078 59.6363 31.7783 177.9316 34 N 4.2384 7.9516 115.9635 56.8121 38.9077 176.3608 35 W 4.7412 7.9015 117.4098 57.8650 29.2864 177.2717 36 G 4.0208 8.1822 107.5419 45.5956 0.0000 174.9740 37 L 4.3996 8.0167 121.8294 53.0203 38.1807 177.1685 38 K 3.8288 7.9523 122.8778 60.0963 32.5197 177.3209 39 R 3.9295 8.3867 118.9291 59.0800 29.9423 178.3624 40 L 4.1310 7.9472 118.9577 57.1762 41.6469 178.6728 41 N 4.5280 8.1625 116.6483 56.8009 39.0017 176.2544 42 D 4.3019 8.1419 120.2381 57.5333 40.9255 179.2394 43 V 3.3362 7.4874 117.9683 66.0703 31.4335 178.0025 44 E 3.6982 8.3213 118.3704 59.0657 29.2981 178.6429 45 Y 3.8970 8.0729 119.8315 61.1604 38.9194 178.0961 46 H 4.2169 8.0489 116.5734 58.4870 28.6003 177.6389 47 E 3.6813 7.9217 120.9516 58.7167 29.1459 178.8670 48 S 4.1435 7.9873 113.7743 61.5446 62.3803 176.3293 49 I 3.5503 7.2865 122.1694 64.2667 36.8848 177.5492 50 D 4.2418 7.8001 118.7770 57.7930 40.9486 178.5046 51 E 4.1689 8.4121 118.8441 59.6280 29.3529 179.4368 52 M 4.0663 8.0638 118.8795 58.2479 32.0367 178.7319 53 K 3.8914 8.1669 118.7561 59.7564 32.2242 178.8937 54 H 4.0707 8.0451 115.9106 58.8583 28.6220 177.4339 55 A 4.2312 8.2137 122.4412 55.4653 18.1468 178.8797 56 D 4.3252 8.2425 116.4223 57.7839 41.3136 178.8978 57 R 3.8475 7.8685 118.1505 59.4482 30.0505 178.6042 58 Y 4.3251 7.7051 116.3496 61.2480 37.8873 178.7219 59 I 3.7689 8.2381 120.9956 64.7382 37.2821 178.4396 60 E 4.0809 8.5919 119.3334 58.8600 29.2052 179.5291 61 R 4.0180 7.9080 118.8341 59.4962 30.3131 178.2943 62 I 3.7567 8.4234 119.9206 64.6372 37.1484 178.3795 63 L 4.0816 8.1573 119.6095 57.8148 41.2103 179.4335 64 F 4.4186 8.0784 119.6966 61.1450 39.6571 176.4044 65 L 4.2948 8.2963 117.9122 53.6239 41.1521 176.9473 66 E 3.5239 7.8767 117.4765 57.5102 27.1367 174.5597 67 G 3.9513 8.3228 107.7462 44.0273 0.0000 173.7986 68 L 4.5352 8.0075 118.9551 51.9753 42.1535 175.2296 69 P 4.3962 0.0000 0.0000 62.5446 31.7448 175.8876 70 N 4.7003 9.6081 122.5891 52.4819 38.6497 173.8606 71 L 4.6518 8.3563 124.8124 54.6047 42.2430 177.4129 72 Q 4.1996 8.5653 122.7171 57.5823 29.5651 175.8132 73 D 4.6983 8.0402 117.2253 52.7418 41.9818 175.2393 74 L 4.5796 8.2825 125.3787 52.7258 44.1188 176.3975 75 G 3.7792 8.4739 115.2655 44.7520 0.0000 171.9407 76 K 4.1035 8.3066 120.6850 55.5075 32.2094 176.5600 77 L 4.0169 8.4138 127.1617 54.6440 42.1272 176.1905 78 N 4.8392 8.7503 121.4733 52.0152 40.3275 174.0583 79 I 3.8969 8.5912 126.8657 63.7865 37.7905 178.1355 80 G 4.1752 8.2598 101.9439 45.9297 0.0000 172.5841 81 E 4.7599 8.7270 116.4278 55.6987 31.8038 176.3045 82 D 5.0569 7.6972 117.7373 50.3141 43.9814 176.1683 83 V 4.0419 8.5338 119.1596 66.7968 31.3457 177.3862 84 E 3.8521 8.2612 117.9286 59.4206 29.5036 177.8820 85 E 3.9671 8.6211 119.2704 59.7977 29.6244 179.0414 86 M 4.2069 8.4165 116.9136 58.2455 31.5689 178.3381 87 L 4.1362 8.6955 120.5779 57.7535 41.8445 179.5963 88 R 3.9251 8.5428 118.8575 59.2562 30.0953 178.5245 89 S 4.0953 8.1989 113.0486 61.5970 62.4866 175.7508 90 D 4.3066 8.1421 121.5428 57.3470 40.4581 178.8082 91 L 4.0274 8.2494 120.5140 58.1739 42.1989 178.7610 92 A 3.9822 8.1702 120.7499 55.0232 18.2018 179.4959 93 L 3.9065 7.8504 118.4297 58.3860 42.2779 178.9017 94 E 4.0758 8.2607 118.5459 59.4605 29.5152 179.3751 95 L 4.0542 8.2706 119.2059 58.0459 41.7753 179.3909 96 D 4.5301 8.2759 118.9425 57.1598 40.6807 179.0010 97 G 3.6882 8.4176 106.0699 47.2443 0.0000 175.8452 98 A 4.0250 8.0747 123.3192 54.7753 18.4563 179.3258 99 K 3.7961 7.9229 117.8828 59.9948 32.1897 178.6294 100 N 4.3860 8.0890 116.2727 56.3316 38.3698 177.3741 101 L 3.9671 8.1454 120.4047 57.8859 41.7761 179.7023 102 R 3.9095 8.3888 118.3514 59.2849 30.0361 179.0674 103 E 3.8678 8.0139 117.4561 59.3282 29.4685 179.0518 104 A 2.7336 7.6834 120.7667 54.9233 18.3403 179.5500 105 I 3.6864 7.9640 118.6137 64.6124 37.2753 178.8162 106 G 3.6221 7.8542 105.8781 47.9041 0.0000 175.1705 107 Y 3.9774 7.8251 121.5160 60.2053 38.9181 177.1046 108 A 3.7934 8.0983 122.1457 55.5369 18.4922 179.0112 109 D 4.0471 7.8821 116.2878 57.4926 41.0189 178.5703 110 S 4.1231 7.3780 112.8630 60.3756 63.2497 175.7379 111 V 3.9094 6.8562 114.2521 60.8165 31.4048 176.0731 112 H 2.9481 7.0121 113.8451 56.5642 27.1102 176.4205 113 D 4.5431 7.2912 121.4330 53.5144 37.7958 176.2284 114 Y 4.2917 7.5480 121.3360 60.2987 38.3623 177.9754 115 V 3.7805 7.8275 119.9762 64.5065 31.9051 178.2828 116 S 4.1558 8.4634 115.8570 61.4472 62.6326 176.5858 117 R 3.8854 8.0911 121.1293 59.5343 29.8818 177.9421 118 D 4.3168 8.2649 117.7803 57.6443 41.2466 177.8819 119 M 4.0049 8.3449 118.9047 58.9313 32.1322 178.0379 120 M 4.1220 8.4417 119.1856 58.4401 32.1396 178.7995 121 I 3.7028 8.0745 120.1637 64.4730 37.3926 178.3045 122 E 3.9769 8.0934 119.1832 59.3611 29.2085 179.4613 123 I 3.5145 7.6967 119.7844 64.3772 37.1553 178.1988 124 L 3.9455 8.1681 121.3181 58.0666 41.8209 178.9089 125 R 3.8891 8.1150 118.6918 59.5764 30.0070 178.2174 126 D 4.3290 7.9290 118.3813 57.3474 40.8164 178.6978 127 E 3.9343 8.2716 119.1227 59.4270 29.4683 178.8507 128 E 4.1128 8.6544 119.9075 59.2259 29.6498 178.9883 129 G 3.7203 7.9889 105.6279 48.3830 0.0000 175.3194 130 H 4.4461 8.0998 119.1135 58.4380 28.6199 177.8639 131 I 3.8146 8.4792 122.0034 64.5565 37.0116 177.5397 132 D 4.4238 8.5117 119.1616 57.3848 40.9421 178.4934 133 W 4.1322 8.3013 128.2294 60.4994 30.8339 177.7077 134 L 3.7629 8.3559 118.9415 58.0112 41.1404 179.4230 135 E 3.9389 8.4762 118.5226 59.7485 29.3571 179.6781 136 T 3.8073 7.9133 115.6329 66.5752 68.4636 176.6418 137 E 3.7884 7.7058 120.4110 59.3817 29.4697 179.4033 138 L 3.7590 7.7206 118.8810 57.8793 41.6170 179.3595 139 D 4.3679 8.0830 118.7506 56.9550 40.6737 178.7883 140 L 4.0161 7.9203 119.8528 57.7718 41.4792 179.3640 141 I 3.4123 7.5777 119.8460 64.4520 36.6802 178.4704 142 Q 3.9872 7.2498 117.2540 58.6136 28.6879 178.4150 143 K 4.1392 7.8682 118.9955 59.0391 32.3240 178.5076 144 M 4.3754 8.2672 114.4123 53.8726 32.4303 177.0455 145 G 4.1248 7.4261 105.7245 45.9535 0.0000 174.5770 146 L 3.8994 8.3934 121.0641 58.1150 42.1849 179.0265 147 Q 4.0019 8.1657 117.4960 59.5051 28.8291 179.0503 148 N 4.3728 8.1578 116.5197 56.2625 38.3664 176.7031 149 Y 3.9575 7.7830 120.0635 60.7055 39.2489 177.7469 150 L 4.1205 8.4419 120.2805 58.0380 41.8619 179.3584 151 Q 3.9567 8.1325 119.0938 59.0613 28.7798 177.8354 152 A 4.1422 7.5788 119.4280 53.6962 18.6180 178.2799 153 Q 4.2917 7.6328 115.7723 55.6924 29.0709 177.6095 154 I 3.8770 7.5338 121.6936 63.5975 37.4182 176.6297 155 R 4.6278 7.5522 117.3033 54.1037 32.1504 175.9195 156 E 4.1446 8.5439 117.0075 56.7144 29.8599 176.5880 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 8.16 4.22 0.00 1.53 1.66 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 2 K 8.52 3.93 0.00 1.71 1.72 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.47 7.81 3 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 4 D 8.44 4.66 0.00 2.77 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 5 T 8.85 3.86 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 1.18 0.00 0.00 6 K 8.17 3.81 0.00 1.73 1.97 0.00 1.47 0.00 0.00 1.13 0.00 0.00 2.55 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.73 1.03 7.81 7 V 8.60 3.91 2.36 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 1.03 0.00 0.00 1.18 0.00 0.00 8 I 7.78 3.73 2.06 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 1.55 0.56 0.92 0.00 0.00 9 N 8.33 4.27 0.00 2.63 2.67 0.00 0.00 7.09 8.03 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 10 Y 8.02 4.11 0.00 3.30 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 11 L 8.50 3.86 0.00 2.02 1.78 1.09 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.64 4.26 0.00 2.75 2.83 0.00 0.00 6.72 8.26 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 13 K 8.21 3.85 0.00 1.79 2.03 0.00 1.61 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.46 7.81 14 L 8.12 3.82 0.00 1.08 1.20 0.90 0.45 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 15 L 7.84 3.97 0.00 1.67 1.85 1.07 1.15 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 16 G 8.25 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 17 N 7.93 4.37 0.00 3.01 2.90 0.00 0.00 7.02 7.08 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 18 E 8.36 4.12 0.00 2.25 2.28 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 2.71 2.87 0.00 19 L 8.41 4.22 0.00 1.86 1.95 0.94 1.14 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 20 V 7.68 3.55 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 0.95 0.00 0.00 0.89 0.00 0.00 21 A 7.98 3.80 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 22 I 8.22 3.77 1.89 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 1.61 1.33 0.90 0.00 0.00 23 N 7.76 4.41 0.00 2.99 2.85 0.00 0.00 6.70 7.96 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 24 Q 8.33 3.83 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.25 2.09 0.00 25 Y 8.30 4.35 0.00 3.16 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.31 3.85 0.00 3.40 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 27 L 8.24 3.92 0.00 1.94 1.59 0.88 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.27 3.73 0.00 3.47 3.25 0.00 5.71 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 29 A 8.35 4.17 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 30 R 7.73 3.85 0.00 1.72 1.87 0.00 3.25 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.64 0.00 31 M 7.72 3.44 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.16 0.00 32 F 7.63 4.54 0.00 3.31 3.24 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 33 K 8.38 3.86 0.00 1.95 1.89 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.43 7.81 34 N 7.95 4.24 0.00 2.69 2.71 0.00 0.00 7.36 8.63 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 35 W 7.90 4.74 0.00 3.73 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 36 G 8.18 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.02 4.40 0.00 2.16 1.68 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.95 3.83 0.00 1.97 1.84 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.61 1.58 7.81 39 R 8.39 3.93 0.00 2.01 2.02 0.00 3.35 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 40 L 7.95 4.13 0.00 1.65 0.90 1.07 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.16 4.53 0.00 3.14 3.00 0.00 0.00 7.21 8.49 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 42 D 8.14 4.30 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 43 V 7.49 3.34 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 -0.50 0.00 0.00 0.71 0.00 0.00 44 E 8.32 3.70 0.00 2.27 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 3.06 0.00 45 Y 8.07 3.90 0.00 2.95 3.01 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 46 H 8.05 4.22 0.00 3.26 3.22 0.00 5.67 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 47 E 7.92 3.68 0.00 1.30 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 0.00 0.00 0.00 1.70 1.89 0.00 48 S 7.99 4.14 0.00 4.03 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 49 I 7.29 3.55 1.87 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.51 0.85 0.00 0.00 50 D 7.80 4.24 0.00 2.93 2.64 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 51 E 8.41 4.17 0.00 2.10 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 0.00 2.72 2.80 0.00 52 M 8.06 4.07 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.55 0.00 53 K 8.17 3.89 0.00 1.85 1.83 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 54 H 8.05 4.07 0.00 3.56 3.37 0.00 5.65 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 55 A 8.21 4.23 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.24 4.33 0.00 2.88 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 57 R 7.87 3.85 0.00 1.80 1.76 0.00 3.14 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 58 Y 7.71 4.33 0.00 3.23 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 59 I 8.24 3.77 2.06 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 1.58 0.83 0.95 0.00 0.00 60 E 8.59 4.08 0.00 2.01 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 2.35 2.58 0.00 61 R 7.91 4.02 0.00 2.18 2.22 0.00 3.38 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.85 0.00 62 I 8.42 3.76 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.72 0.97 0.00 0.00 63 L 8.16 4.08 0.00 2.08 1.80 0.95 0.92 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 F 8.08 4.42 0.00 3.02 3.34 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.30 4.29 0.00 1.68 1.60 0.98 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.88 3.52 0.00 2.07 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 0.00 2.17 2.36 0.00 67 G 8.32 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 68 L 8.01 4.54 0.00 1.62 1.62 0.92 1.00 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 69 P 0.00 4.40 0.00 2.06 2.03 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 70 N 9.61 4.70 0.00 2.61 2.82 0.00 0.00 7.11 8.36 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 71 L 8.36 4.65 0.00 1.63 1.63 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.57 4.20 0.00 1.96 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.22 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 73 D 8.04 4.70 0.00 2.68 2.56 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 74 L 8.28 4.58 0.00 1.52 1.50 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.47 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.31 4.10 0.00 1.72 1.74 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.45 7.81 77 L 8.41 4.02 0.00 1.64 1.57 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.75 4.84 0.00 2.63 2.69 0.00 0.00 7.22 8.05 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 79 I 8.59 3.90 1.89 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 1.34 0.93 0.92 0.00 0.00 80 G 8.26 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.73 4.76 0.00 1.99 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 2.27 2.30 0.00 82 D 7.70 5.06 0.00 2.81 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 83 V 8.53 4.04 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.25 0.00 0.00 84 E 8.26 3.85 0.00 2.03 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 2.32 2.26 0.00 85 E 8.62 3.97 0.00 2.42 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 2.35 2.38 0.00 86 M 8.42 4.21 0.00 2.33 1.77 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.92 0.00 87 L 8.70 4.14 0.00 1.99 1.79 1.24 0.81 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 88 R 8.54 3.93 0.00 2.06 1.94 0.00 3.10 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 89 S 8.20 4.10 0.00 4.09 4.06 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 90 D 8.14 4.31 0.00 3.17 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 91 L 8.25 4.03 0.00 1.84 1.86 0.98 0.94 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 92 A 8.17 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.85 3.91 0.00 1.94 1.82 0.90 0.64 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 94 E 8.26 4.08 0.00 2.28 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 0.00 2.58 2.74 0.00 95 L 8.27 4.05 0.00 2.03 1.74 0.96 1.43 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 96 D 8.28 4.53 0.00 2.84 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 97 G 8.42 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 0.00 0.00 0.00 98 A 8.07 4.02 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 99 K 7.92 3.80 0.00 2.04 2.03 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.51 7.81 100 N 8.09 4.39 0.00 3.01 2.90 0.00 0.00 7.11 6.65 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 0.00 101 L 8.15 3.97 0.00 2.00 1.73 0.98 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 0.00 102 R 8.39 3.91 0.00 1.96 1.98 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.99 0.00 103 E 8.01 3.87 0.00 1.93 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 2.50 0.00 104 A 7.68 2.73 0.94 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 0.00 105 I 7.96 3.69 2.05 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.71 0.91 0.00 0.00 106 G 7.85 3.62 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 0.00 0.00 0.00 107 Y 7.83 3.98 0.00 3.18 3.01 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 0.00 108 A 8.10 3.79 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 0.00 109 D 7.88 4.05 0.00 2.75 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 0.00 110 S 7.38 4.12 0.00 3.98 3.88 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 0.00 111 V 6.86 3.91 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 0.55 0.00 0.00 0.60 0.00 0.00 112 H 7.01 2.95 0.00 3.20 3.34 0.00 5.84 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.29 4.54 0.00 2.64 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 0.00 114 Y 7.55 4.29 0.00 3.11 2.96 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 0.00 115 V 7.83 3.78 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 1.02 0.00 0.00 0.99 0.00 0.00 116 S 8.46 4.16 0.00 4.14 4.05 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 0.00 117 R 8.09 3.89 0.00 1.89 2.20 0.00 3.32 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 118 D 8.26 4.32 0.00 3.05 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 0.00 119 M 8.34 4.00 0.00 2.22 2.02 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 2.48 2.46 0.00 120 M 8.44 4.12 0.00 2.13 2.28 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.80 0.00 121 I 8.07 3.70 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 1.53 0.96 0.92 0.00 0.00 122 E 8.09 3.98 0.00 1.98 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 2.45 2.48 0.00 123 I 7.70 3.51 1.97 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 1.10 0.53 0.74 0.00 0.00 124 L 8.17 3.95 0.00 1.76 1.85 0.99 1.16 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 0.00 125 R 8.12 3.89 0.00 1.93 2.11 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 126 D 7.93 4.33 0.00 2.99 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 0.00 127 E 8.27 3.93 0.00 2.15 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 0.00 2.58 2.53 0.00 128 E 8.65 4.11 0.00 2.31 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 2.33 2.42 0.00 129 G 7.99 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 0.00 130 H 8.10 4.45 0.00 3.53 3.55 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.48 3.81 2.12 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.85 0.97 0.00 0.00 132 D 8.51 4.42 0.00 2.95 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 0.00 133 W 8.30 4.13 0.00 3.56 3.50 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 0.00 134 L 8.36 3.76 0.00 2.02 1.76 1.27 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.48 3.94 0.00 2.14 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 136 T 7.91 3.81 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 1.18 0.00 0.00 137 E 7.71 3.79 0.00 1.56 1.68 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 1.47 1.47 0.00 138 L 7.72 3.76 0.00 1.74 1.62 0.89 0.84 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 0.00 139 D 8.08 4.37 0.00 2.77 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 0.00 140 L 7.92 4.02 0.00 1.91 1.85 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.58 3.41 1.70 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.18 0.49 0.69 0.00 0.00 142 Q 7.25 3.99 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.97 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 143 K 7.87 4.14 0.00 1.74 1.86 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.63 7.81 144 M 8.27 4.38 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.87 0.00 145 G 7.43 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 0.00 146 L 8.39 3.90 0.00 1.73 1.66 0.93 0.68 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 0.00 147 Q 8.17 4.00 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 148 N 8.16 4.37 0.00 2.98 2.89 0.00 0.00 6.65 7.48 0.00 0.00 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 Y 7.78 3.96 0.00 3.04 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 0.00 150 L 8.44 4.12 0.00 2.02 1.72 1.09 0.70 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 0.00 151 Q 8.13 3.96 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 A 7.58 4.14 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 0.00 153 Q 7.63 4.29 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.76 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 154 I 7.53 3.88 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.46 0.91 0.00 0.00 155 R 7.55 4.63 0.00 1.77 1.82 0.00 3.19 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 156 E 8.54 4.14 0.00 2.09 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 2.26 2.28 0.00