NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4078 8.3044 120.3218 54.2521 33.4402 174.0688 1 K 2.4875 8.3540 119.5968 54.0149 32.0834 173.4699 2 P 3.8721 0.0000 0.0000 62.4662 32.2225 174.6219 3 P 3.9543 0.0000 0.0000 65.6478 31.2645 177.3523 4 Q 3.9690 7.5417 113.2928 57.2395 28.6930 175.7313 5 F 5.3528 7.5033 118.0560 56.0239 41.4842 175.8757 6 T 4.3489 8.6077 115.0748 60.3350 71.5987 176.1449 7 W 4.2550 8.5866 120.0921 59.8940 28.9179 178.6418 8 A 4.8529 8.1706 121.7122 54.9951 17.8850 179.5880 9 Q 3.7733 8.2421 116.5222 58.6035 28.7183 178.6960 10 W 4.1909 8.5221 129.8556 60.2084 30.6298 177.8645 11 F 3.9699 8.6177 120.9180 61.2680 38.9166 176.7435 12 E 3.8971 8.5678 119.0953 59.6247 29.1878 178.8277 13 T 3.7232 7.5649 114.8519 66.5398 68.4830 176.1067 14 Q 3.7289 7.1734 118.6533 57.5657 29.2145 176.9829 15 H 4.6148 7.5575 115.6781 54.3917 29.5730 175.3057 16 I 4.1411 7.6508 123.1057 63.3596 39.0953 177.0807 17 N 4.5313 7.8100 118.0962 51.2345 35.8130 174.0333 18 M 3.7144 7.7621 121.4087 53.8666 31.8180 176.0439 19 T 4.0222 8.1011 117.2917 63.1466 69.5896 174.4938 20 S 4.7297 7.3501 116.2682 56.2256 66.3680 173.6290 21 Q 4.0401 8.4909 121.7812 57.8601 29.2692 176.2616 22 Q 4.9133 7.6298 116.8015 53.6535 32.2550 176.5083 23 C 4.1168 10.1395 124.0911 60.7082 40.1883 176.4893 24 T 4.0592 8.0552 115.0755 67.2174 68.2058 175.6130 25 N 5.1374 8.3525 118.3578 55.3339 38.6252 177.3230 26 A 3.9233 8.0974 121.8452 55.2408 18.6988 179.1884 27 M 4.1542 8.5893 116.9062 57.4625 32.0781 178.6124 28 Q 3.9857 7.7250 119.2358 59.1548 28.7604 178.9173 29 V 3.4860 7.7798 118.3071 66.0682 31.3084 177.8906 30 I 4.1659 7.7221 117.6904 64.8646 37.4530 177.9114 31 N 4.6203 8.7237 117.4129 56.0819 38.3386 177.0801 32 N 4.3184 8.4730 119.1155 56.7039 38.7612 176.1293 33 Y 4.3392 7.1599 115.9980 60.6341 38.0529 177.6104 34 Q 4.5360 7.9609 116.5816 55.2021 30.3083 176.1063 35 R 3.8038 7.8608 114.7350 56.3656 27.1492 181.0297 36 R 4.5827 7.8527 117.8430 55.6051 33.3105 173.5251 37 C 4.8448 8.8416 123.8478 56.4466 40.8583 173.8151 38 K 4.3345 9.1374 125.3251 56.3586 32.4753 176.9517 39 N 4.6815 8.8828 121.7871 56.6918 39.9865 174.1719 40 Q 5.2723 7.8592 113.5599 55.6164 31.6464 173.4922 41 N 4.6381 8.8782 117.0423 53.0406 42.7747 173.0213 42 T 4.9375 8.2997 122.2615 61.8703 71.5686 173.0820 43 F 5.0122 8.9919 125.1393 55.7302 41.3102 174.6615 44 L 4.5553 8.7330 125.3206 53.0564 42.1618 178.1065 45 L 4.4579 7.9230 128.5614 54.0294 39.3666 175.1870 46 T 4.6941 7.2999 112.6071 59.5450 71.5594 173.1619 47 T 4.3943 8.1274 114.0644 60.8421 71.2343 175.3569 48 F 4.1786 8.8280 123.6129 61.4375 39.5189 176.9550 49 A 3.7149 8.2641 119.9193 55.4549 18.1242 179.1171 50 N 4.2477 7.9275 114.4542 56.4207 38.5333 177.7896 51 V 3.9857 7.2922 120.9620 65.5952 31.4159 178.1221 52 V 3.2283 7.1689 119.0416 66.5194 31.2944 178.0926 53 N 4.3993 7.9191 119.0129 57.4722 37.4306 179.8232 54 V 4.5018 7.5931 122.2582 65.5776 31.3300 177.4386 55 C 4.1850 8.0739 115.5880 59.4708 40.0508 175.5298 56 G 3.5525 7.8663 105.4293 44.8132 0.0000 173.6097 57 N 4.6376 7.7501 119.8930 51.5289 39.4030 172.6598 58 P 4.4824 0.0000 0.0000 63.1913 31.4179 175.8651 59 N 4.4710 8.9149 120.1895 54.2251 38.6214 174.0405 60 M 4.8832 9.1141 120.7066 53.0948 35.1758 175.1090 61 T 4.0135 8.4123 116.6161 63.9612 69.2742 174.8547 62 C 4.4490 8.9795 124.2470 56.0229 40.4855 172.8145 63 P 4.3252 0.0000 0.0000 65.6778 31.2988 178.2835 64 S 4.0943 8.9871 114.7015 61.4068 63.3470 175.1298 65 N 4.8042 7.5607 127.9003 49.8381 37.9876 177.7609 66 K 4.2690 8.6152 129.0968 57.0315 32.1027 177.1669 67 T 4.1201 7.8828 108.3209 63.3098 68.9722 179.9787 68 R 4.7375 8.0623 121.3672 55.5447 32.0976 177.0265 69 K 4.9113 8.3424 121.4091 54.5609 33.3722 175.9131 70 N 4.9764 8.1776 115.4220 54.0853 38.6995 174.8960 71 C 5.3295 7.7289 116.1285 56.8310 37.5067 172.6230 72 H 5.1770 8.7677 117.3190 54.4639 32.8067 172.4056 73 H 4.7542 8.8524 123.2264 55.6798 30.5941 176.1452 74 S 3.5569 8.1702 120.2045 59.6295 62.8351 174.7238 75 G 4.3879 8.3372 108.9217 44.8400 0.0000 173.3843 76 S 5.0413 7.5109 111.6531 55.9380 65.3693 173.8058 77 Q 3.9655 8.1054 123.2915 55.8676 29.7521 175.3836 78 V 4.5433 8.5582 119.5888 60.6258 35.6861 172.6610 79 P 5.0805 0.0000 0.0000 62.7716 32.8303 174.8154 80 L 4.9390 8.7752 122.3296 54.3685 46.3607 174.2696 81 I 4.9193 8.5456 123.3712 60.1466 41.4640 173.8942 82 H 5.0448 9.3196 125.5796 54.8063 30.5709 173.5880 83 C 5.3937 9.2690 122.0713 55.4750 41.4434 172.5746 84 N 5.4347 9.2326 122.4259 50.8434 41.0321 173.9863 85 L 3.5402 8.6790 127.3171 55.7563 41.8640 176.5061 86 T 4.4730 8.6602 116.5590 62.1552 71.4490 174.5613 87 T 4.6094 7.4266 118.3313 60.8095 71.9793 172.2927 88 P 4.7003 0.0000 0.0000 62.3605 32.9549 176.9416 89 S 4.7007 8.0030 110.3116 56.5662 63.5248 173.1864 90 P 4.2653 0.0000 0.0000 65.6750 31.2901 178.1292 91 Q 4.3492 7.9195 114.8769 56.4833 29.4998 175.8163 92 N 4.9396 8.0938 116.8222 51.3659 39.9841 173.9644 93 I 3.7043 8.3486 124.7861 64.0518 37.6257 178.3910 94 S 4.2565 8.0888 113.0243 60.5781 62.8723 174.3972 95 N 4.7956 8.1392 117.4244 53.1739 38.5869 174.4627 96 C 4.6810 8.0444 116.7935 57.1912 39.8544 173.3067 97 R 4.9469 8.7174 121.0534 54.6868 32.8162 174.5999 98 Y 5.1762 9.0136 119.6951 56.2274 41.4444 174.9953 99 A 4.9144 9.1008 124.9893 50.7207 21.4904 176.0481 100 Q 5.2200 8.5607 116.8342 54.8036 32.2405 174.9964 101 T 4.6098 8.7462 116.8247 61.4273 72.2003 172.2309 102 P 5.0359 0.0000 0.0000 62.2343 32.7783 174.9919 103 A 4.3339 7.8871 121.3950 52.1101 23.5400 175.3836 104 N 5.6100 7.9102 115.0374 51.2729 42.3752 173.9386 105 M 5.1110 8.2893 122.0700 54.0143 37.5670 174.1858 106 F 4.9787 9.3017 119.1670 57.0421 41.3410 174.8815 107 Y 5.3311 8.4794 117.6816 55.5055 42.0648 174.3128 108 I 4.9405 9.3398 121.5388 59.9610 40.2949 174.9087 109 V 4.9367 8.5491 120.0220 59.4315 34.8497 174.7933 110 A 5.0063 9.0111 126.1853 51.0804 20.3132 175.6887 111 C 5.4071 8.9403 119.9240 55.2739 44.9230 173.0042 112 D 5.0586 8.6803 120.3435 52.0644 45.3798 174.6889 113 N 4.9777 8.7319 117.3480 53.2207 39.0098 175.7333 114 R 4.1260 8.9234 120.2535 56.4106 30.7329 176.6279 115 D 4.5342 9.8323 122.7640 54.0109 39.7845 177.3143 116 Q 4.2049 8.8339 124.3915 56.7243 28.4587 175.9086 117 R 4.5720 8.8306 115.7843 58.5872 32.0999 181.1441 118 R 4.4447 8.2988 115.8596 57.5285 31.2387 177.3469 119 D 4.6025 7.8683 116.0678 53.1470 41.8456 174.3861 120 P 4.3265 0.0000 0.0000 62.0932 31.7384 175.9051 121 P 4.4483 0.0000 0.0000 64.9453 31.4037 177.4752 122 Q 4.0641 7.8796 116.3484 58.1201 28.7572 175.7712 123 Y 4.9933 7.3631 116.5135 54.8046 38.3242 172.9062 124 P 4.4973 0.0000 0.0000 64.8400 32.7117 176.5751 125 V 4.8642 7.7877 118.9418 60.9121 33.8911 175.2675 126 V 4.6251 8.7093 120.0960 58.5270 36.6542 172.9806 127 P 4.6422 0.0000 0.0000 63.0544 31.9197 176.9423 128 V 4.6468 8.3511 114.4958 61.1429 34.1262 175.1740 129 H 4.7823 7.5955 118.3439 55.0237 33.2784 172.3341 130 L 4.6331 8.5248 128.0867 54.3961 41.5673 175.7299 131 D 4.5266 8.9731 127.2558 56.9008 41.6206 176.0226 132 R 4.7701 7.6119 116.2377 55.3714 33.7272 172.8448 133 I 5.1313 8.2769 118.1755 59.8864 40.5451 175.8585 134 I 4.2086 8.6595 124.9541 61.1026 36.7910 171.4284 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 0 M 8.30 4.41 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 1 K 8.35 2.49 0.00 0.97 1.03 0.00 0.87 0.00 0.00 0.61 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.57 0.21 7.81 2 P 0.00 3.87 0.00 1.60 1.76 0.00 2.20 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.89 0.00 3 P 0.00 3.95 0.00 1.88 2.04 0.00 3.45 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.94 0.00 4 Q 7.54 3.97 0.00 1.85 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.74 0.00 0.00 0.00 0.00 0.00 1.16 1.50 0.00 5 F 7.50 5.35 0.00 2.82 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 6 T 8.61 4.35 4.33 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 1.33 0.00 0.00 7 W 8.59 4.25 0.00 3.56 3.44 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 8 A 8.17 4.85 1.58 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 0.00 0.00 9 Q 8.24 3.77 0.00 2.36 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 10 W 8.52 4.19 0.00 3.24 3.31 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 11 F 8.62 3.97 0.00 3.43 3.45 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 12 E 8.57 3.90 0.00 1.95 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 0.00 2.18 2.33 0.00 13 T 7.56 3.72 4.03 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 1.30 0.00 0.00 14 Q 7.17 3.73 0.00 1.06 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 1.33 1.16 0.00 15 H 7.56 4.61 0.00 2.16 2.83 0.00 5.57 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.65 4.14 2.03 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 1.09 1.16 1.03 0.00 0.00 17 N 7.81 4.53 0.00 2.74 2.63 0.00 0.00 6.57 7.66 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 18 M 7.76 3.71 0.00 1.56 1.06 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 2.21 0.00 19 T 8.10 4.02 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 1.18 0.00 0.00 20 S 7.35 4.73 0.00 3.93 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 21 Q 8.49 4.04 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.69 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 22 Q 7.63 4.91 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.62 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 23 C 10.14 4.12 0.00 2.92 3.13 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 0.00 0.00 0.00 24 T 8.06 4.06 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 25 N 8.35 5.14 0.00 2.74 2.83 0.00 0.00 7.50 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 26 A 8.10 3.92 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 27 M 8.59 4.15 0.00 1.64 1.79 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 2.46 0.00 28 Q 7.73 3.99 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.61 0.00 29 V 7.78 3.49 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 1.05 0.00 0.00 0.91 0.00 0.00 30 I 7.72 4.17 2.07 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 1.66 0.74 0.86 0.00 0.00 31 N 8.72 4.62 0.00 2.83 2.97 0.00 0.00 6.75 6.69 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 32 N 8.47 4.32 0.00 2.88 2.76 0.00 0.00 7.03 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 33 Y 7.16 4.34 0.00 3.25 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 34 Q 7.96 4.54 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 35 R 7.86 3.80 0.00 1.97 1.81 0.00 3.27 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.41 0.00 36 R 7.85 4.58 0.00 1.94 1.88 0.00 3.46 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.80 0.00 37 C 8.84 4.84 0.00 3.05 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 K 9.14 4.33 0.00 1.83 1.96 0.00 1.62 0.00 0.00 1.51 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.65 7.81 39 N 8.88 4.68 0.00 2.88 2.85 0.00 0.00 6.72 7.00 0.00 0.00 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 Q 7.86 5.27 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.40 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 41 N 8.88 4.64 0.00 2.64 2.34 0.00 0.00 7.38 6.81 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 42 T 8.30 4.94 4.11 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 1.13 0.00 0.00 43 F 8.99 5.01 0.00 2.96 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.73 4.56 0.00 1.35 1.44 0.28 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.92 4.46 0.00 1.65 1.63 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.30 4.69 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 47 T 8.13 4.39 4.33 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 1.26 0.00 0.00 48 F 8.83 4.18 0.00 3.19 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 49 A 8.26 3.71 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.93 4.25 0.00 3.01 2.94 0.00 0.00 6.71 9.00 0.00 0.00 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 V 7.29 3.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 1.00 0.00 0.00 52 V 7.17 3.23 1.54 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 0.37 0.00 0.00 -0.20 0.00 0.00 53 N 7.92 4.40 0.00 2.78 2.81 0.00 0.00 6.62 6.99 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 54 V 7.59 4.50 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 0.88 0.00 0.00 1.01 0.00 0.00 55 C 8.07 4.18 0.00 2.97 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 56 G 7.87 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.75 4.64 0.00 2.88 2.75 0.00 0.00 6.63 7.58 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 58 P 0.00 4.48 0.00 2.16 2.08 0.00 3.78 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 1.98 1.98 0.00 59 N 8.91 4.47 0.00 2.61 3.03 0.00 0.00 6.88 7.66 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 60 M 9.11 4.88 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 61 T 8.41 4.01 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 1.19 0.00 0.00 62 C 8.98 4.45 0.00 3.35 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 63 P 0.00 4.33 0.00 2.15 2.13 0.00 3.87 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 64 S 8.99 4.09 0.00 3.99 4.13 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 0.00 0.00 0.00 65 N 7.56 4.80 0.00 2.71 2.74 0.00 0.00 7.26 6.95 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 66 K 8.62 4.27 0.00 1.77 1.76 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.01 7.81 67 T 7.88 4.12 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 68 R 8.06 4.74 0.00 1.83 2.03 0.00 3.10 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 69 K 8.34 4.91 0.00 1.72 1.60 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.24 0.95 7.81 70 N 8.18 4.98 0.00 2.89 3.01 0.00 0.00 6.04 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 71 C 7.73 5.33 0.00 3.03 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 72 H 8.77 5.18 0.00 3.09 3.22 0.00 5.80 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 73 H 8.85 4.75 0.00 3.15 3.06 0.00 5.67 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 74 S 8.17 3.56 0.00 3.26 2.63 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 75 G 8.34 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 0.00 0.00 0.00 0.00 76 S 7.51 5.04 0.00 3.88 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 77 Q 8.11 3.97 0.00 1.63 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.53 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 78 V 8.56 4.54 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.05 0.00 0.00 79 P 0.00 5.08 0.00 2.10 1.94 0.00 3.95 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.91 0.00 80 L 8.78 4.94 0.00 1.64 1.61 0.90 0.74 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 81 I 8.55 4.92 1.98 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 1.22 0.92 0.97 0.00 0.00 82 H 9.32 5.04 0.00 3.24 3.21 0.00 5.60 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 9.27 5.39 0.00 2.92 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 9.23 5.43 0.00 2.65 2.74 0.00 0.00 6.19 6.74 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 85 L 8.68 3.54 0.00 1.57 1.54 0.36 0.68 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 86 T 8.66 4.47 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 1.27 0.00 0.00 87 T 7.43 4.61 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 1.18 0.00 0.00 88 P 0.00 4.70 0.00 2.05 2.02 0.00 3.76 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 89 S 8.00 4.70 0.00 3.82 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.27 0.00 2.22 2.20 0.00 3.80 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 2.02 0.00 91 Q 7.92 4.35 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.18 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 92 N 8.09 4.94 0.00 2.72 2.63 0.00 0.00 7.01 7.86 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 93 I 8.35 3.70 1.90 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 1.49 0.34 0.96 0.00 0.00 94 S 8.09 4.26 0.00 3.99 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 95 N 8.14 4.80 0.00 3.00 2.89 0.00 0.00 7.00 8.37 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 96 C 8.04 4.68 0.00 3.02 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 97 R 8.72 4.95 0.00 1.65 1.80 0.00 3.26 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 1.62 1.71 0.00 98 Y 9.01 5.18 0.00 2.79 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 99 A 9.10 4.91 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 0.00 100 Q 8.56 5.22 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.71 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 101 T 8.75 4.61 4.33 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 1.26 0.00 0.00 102 P 0.00 5.04 0.00 1.93 1.99 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 103 A 7.89 4.33 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 0.00 104 N 7.91 5.61 0.00 2.53 2.60 0.00 0.00 7.37 7.66 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 0.00 105 M 8.29 5.11 0.00 2.12 1.96 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 2.63 2.51 0.00 106 F 9.30 4.98 0.00 3.01 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 0.00 107 Y 8.48 5.33 0.00 2.98 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 I 9.34 4.94 1.90 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 1.16 0.83 0.91 0.00 0.00 109 V 8.55 4.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.01 0.00 0.00 110 A 9.01 5.01 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 0.00 111 C 8.94 5.41 0.00 2.83 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 0.00 112 D 8.68 5.06 0.00 2.58 2.53 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 0.00 0.00 0.00 0.00 113 N 8.73 4.98 0.00 2.64 2.79 0.00 0.00 6.90 7.66 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 0.00 114 R 8.92 4.13 0.00 1.86 2.20 0.00 3.42 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.65 0.00 115 D 9.83 4.53 0.00 2.86 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 0.00 116 Q 8.83 4.20 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.59 0.00 0.00 0.00 0.00 0.00 2.29 1.95 0.00 117 R 8.83 4.57 0.00 1.73 1.80 0.00 3.22 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.42 0.00 118 R 8.30 4.44 0.00 1.89 2.02 0.00 3.12 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 119 D 7.87 4.60 0.00 2.98 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 0.00 120 P 0.00 4.33 0.00 2.06 1.88 0.00 3.72 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 121 P 0.00 4.45 0.00 2.17 2.19 0.00 3.73 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 1.95 1.94 0.00 122 Q 7.88 4.06 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.16 0.00 0.00 0.00 0.00 0.00 1.97 1.28 0.00 123 Y 7.36 4.99 0.00 3.08 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 0.00 124 P 0.00 4.50 0.00 2.15 2.36 0.00 3.83 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 2.12 2.02 0.00 125 V 7.79 4.86 2.04 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 0.86 0.00 0.00 0.93 0.00 0.00 126 V 8.71 4.63 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.11 0.00 0.00 127 P 0.00 4.64 0.00 0.49 1.66 0.00 3.41 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.50 0.00 128 V 8.35 4.65 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 0.81 0.00 0.00 0.94 0.00 0.00 129 H 7.60 4.78 0.00 3.10 3.02 0.00 5.66 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.52 4.63 0.00 1.65 1.44 0.99 1.02 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 0.00 131 D 8.97 4.53 0.00 2.78 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 R 7.61 4.77 0.00 1.91 1.71 0.00 3.19 0.00 0.00 3.41 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 133 I 8.28 5.13 1.96 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.91 0.99 0.00 0.00 134 I 8.66 4.21 1.87 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 1.09 0.44 0.91 0.00 0.00