NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7125 8.2827 118.1251 53.3307 41.0147 175.9666 3 K 3.8005 8.0294 118.5988 59.1795 31.7208 177.2172 4 G 3.6468 8.9029 106.5558 47.4614 0.0000 174.5649 5 Q 4.0123 7.8193 119.5226 58.2859 29.2768 177.9068 6 R 3.8274 8.8501 120.4637 59.6758 30.1212 178.2277 7 H 4.2155 8.4031 116.2029 59.0365 28.5156 177.8350 8 I 3.7116 7.3654 121.2255 64.1527 36.9200 178.3970 9 K 3.9731 8.1133 120.4474 59.6099 32.0872 178.8207 10 I 3.6029 8.0530 120.4486 64.5291 35.4939 178.5785 11 R 3.9339 7.8768 118.8359 59.0276 29.8251 178.8006 12 E 4.0529 7.7201 117.8081 59.1167 29.7072 178.6820 13 I 3.6870 7.5976 120.0745 64.4301 37.0690 178.2826 14 I 3.9528 7.4389 110.7040 63.1301 37.5965 177.1960 15 T 4.3119 7.2072 114.5234 64.6957 69.1961 176.0248 16 S 4.6128 7.9965 114.8930 58.0140 63.7482 173.5795 17 N 5.0993 7.4268 117.6762 51.5800 42.3153 174.7182 18 E 4.3895 8.4002 120.6568 55.1967 28.4446 174.1191 19 I 4.3057 7.8519 122.8172 60.6703 37.9901 176.5211 20 E 4.7346 10.0224 124.7829 55.9128 31.1132 176.2906 21 T 4.9838 7.7131 107.7770 58.7732 71.6929 174.6812 22 Q 3.8027 8.8769 122.0170 59.2928 28.5658 179.1525 23 D 4.3561 8.0352 119.4087 57.4342 41.0296 178.3623 24 E 3.9415 8.0301 118.5835 59.4304 29.1381 179.2506 25 L 3.9568 7.6624 119.7001 57.5423 42.1746 179.1441 26 V 3.5547 7.6440 118.5377 66.0305 31.5620 177.7465 27 D 4.3171 8.1730 118.7086 57.7108 40.5005 178.6142 28 M 4.0860 7.7366 117.0110 58.2350 32.5410 177.5603 29 L 4.0470 7.5542 120.1328 57.2197 42.1943 179.0596 30 K 4.4356 8.1266 120.4419 58.8157 31.9549 178.9555 31 Q 4.1936 7.9271 114.6899 58.0785 28.5417 176.3284 32 D 4.7589 7.8111 117.0253 54.1750 40.8748 176.5710 33 G 3.7911 8.2870 106.8449 46.6073 0.0000 173.1865 34 Y 4.4438 7.9926 116.9260 55.4760 39.9895 175.3518 35 K 4.3353 8.6705 125.2244 55.7735 31.8732 176.5242 36 V 4.5870 7.9995 122.4817 59.3257 34.6407 174.5187 37 T 4.7322 8.6782 111.0294 59.1580 73.0175 174.8508 38 Q 3.9306 8.6532 120.0153 59.2311 28.4517 179.2836 39 A 3.9927 7.9345 119.9273 55.4753 18.7878 179.1559 40 T 3.9402 7.4206 107.4943 65.1670 68.5982 176.6784 41 V 3.8381 8.0479 122.7235 64.9835 31.4440 178.0163 42 S 4.2996 8.1757 114.9162 60.2373 62.7165 176.5350 43 R 3.9850 7.7677 122.2337 58.8433 29.6966 178.3191 44 D 4.2844 7.8498 118.1417 57.5584 40.9603 178.5806 45 I 3.6137 7.8845 120.4314 64.2860 36.8914 178.1489 46 K 4.0598 7.5359 119.5416 58.7824 31.9217 178.7437 47 E 3.8451 8.3226 118.7423 59.0348 29.4814 177.6646 48 L 4.1927 8.2915 116.1653 54.4679 41.8537 176.1601 49 H 4.0869 7.4496 114.9041 56.4720 26.8124 175.0452 50 L 4.3168 7.8313 118.1363 55.2489 42.3747 177.2990 51 V 4.4411 8.6862 115.3793 59.3610 36.0672 174.2722 52 K 4.8678 8.4571 119.9563 54.9819 34.2375 176.5538 53 V 4.4883 8.4465 117.8530 58.6634 35.5216 173.7738 54 P 4.8121 0.0000 0.0000 61.7530 32.6150 175.1111 55 T 4.6630 7.8186 109.8720 59.4954 72.0040 174.6469 56 N 4.3120 8.6964 118.4494 56.3546 38.6016 176.4888 57 N 4.2952 7.4502 116.1971 55.3096 39.0578 175.5335 58 G 4.0476 7.9327 105.2016 45.0097 0.0000 173.6920 59 S 4.7390 7.9069 114.6266 58.1124 65.1411 172.1811 60 Y 5.2078 8.6368 116.7937 55.9947 40.6413 175.3564 61 K 4.8997 8.7868 122.3059 55.0574 36.2360 175.3012 62 Y 4.6802 8.8748 119.5757 58.6761 38.8103 174.6634 63 S 4.5784 8.7091 115.2890 57.5717 66.9823 174.3811 64 L 4.4681 8.2489 122.2350 53.6226 42.2037 176.6932 65 P 3.9041 0.0000 0.0000 65.7727 31.2409 178.0102 66 A 4.0769 7.9132 118.1036 53.4195 18.5145 176.6946 67 D 4.3754 8.0064 117.2916 54.1421 41.5373 176.6034 68 Q 3.9916 9.0446 126.4091 59.4698 28.7611 179.0032 69 R 4.0644 8.1642 114.8066 58.0713 31.0755 177.5587 70 F 4.4616 8.6299 120.9671 59.1169 38.7736 176.2597 71 N 4.5982 8.5254 116.1059 50.5479 38.8907 173.2143 72 P 4.1375 0.0000 0.0000 65.3365 31.8496 177.5790 73 L 3.8428 7.7105 118.4707 58.1205 42.2318 178.8871 74 S 4.0643 7.8947 113.4891 61.4951 62.9194 176.2164 75 K 3.8858 7.9632 122.7113 58.8435 31.7594 178.9204 76 L 3.9087 8.2346 120.8239 57.9767 41.9160 178.6386 77 K 3.9142 8.3897 122.1168 60.4252 32.1500 179.4217 78 R 3.9309 7.8851 119.8383 61.3370 29.3344 180.5004 79 A 4.2234 8.1143 121.7810 55.1056 18.3136 179.8060 80 L 4.0575 8.2657 117.7020 58.2305 41.5089 179.2974 81 M 3.8844 8.0120 116.9885 58.7602 32.1539 177.4570 82 D 4.5849 8.1963 117.4621 55.5929 41.7173 177.0465 83 A 4.5978 8.4483 120.5104 51.5517 20.6288 176.0423 84 F 4.2774 8.7848 119.4568 58.8163 39.8948 173.6112 85 V 4.3676 7.2607 126.1381 63.6162 33.0908 175.4259 86 K 4.4547 6.6483 116.4705 56.1054 35.2481 173.4875 87 I 5.0982 8.1415 120.3906 60.0234 41.7433 173.3764 88 D 4.8593 8.6112 123.3858 53.5394 44.9187 174.1883 89 S 5.2174 8.5748 117.2824 57.2045 66.4720 172.2328 90 A 4.6228 9.0466 122.7002 51.0989 21.7205 176.6286 91 S 3.4529 7.1388 106.8700 58.6727 64.3821 174.3774 92 H 5.2518 8.2244 113.8851 54.0230 30.8496 173.4781 93 M 5.3314 8.0889 117.1766 53.6706 36.5309 174.1608 94 I 4.9378 8.9606 123.1415 59.4799 40.9792 174.5917 95 V 4.7635 9.0936 126.4711 61.0135 34.0163 173.8608 96 L 5.0371 8.7864 129.9559 53.2325 44.9678 175.0501 97 K 5.1229 8.7255 126.2921 55.3276 34.3085 175.6993 98 T 5.1438 8.4789 113.2449 59.8064 72.8311 173.2743 99 M 4.2090 8.5938 121.2400 54.6274 33.0469 174.9164 100 P 4.2276 0.0000 0.0000 64.5857 31.9141 176.3848 101 G 3.9134 8.9985 110.1972 46.6453 0.0000 173.8461 102 N 4.8955 7.8046 113.9828 51.5461 40.8360 176.4256 103 A 3.9247 7.6819 120.1280 55.0139 18.3847 178.9434 104 Q 3.8509 8.1197 116.4823 59.4278 29.1690 179.0193 105 A 3.9794 8.0162 120.6869 55.4878 18.4362 179.4050 106 I 3.7607 7.6560 117.7446 64.4415 37.1331 178.9706 107 G 3.5416 8.2867 106.2986 47.7538 0.0000 175.4434 108 A 3.9940 7.8388 122.3215 54.8781 18.6323 179.5242 109 L 4.0138 7.7523 116.7722 58.2959 41.3478 179.6958 110 M 3.8495 8.0802 118.3168 58.0984 31.5736 178.2041 111 D 4.5362 7.8921 117.8140 55.8036 40.9610 177.2372 112 N 4.8098 7.6920 115.8856 52.7138 38.8922 175.9544 113 L 3.5174 7.1995 122.0129 55.5361 42.5673 175.8559 114 D 4.3178 7.0824 116.8683 55.5958 39.4820 173.6290 115 W 5.0723 7.6078 118.5784 54.9042 31.2026 177.3716 116 D 4.4720 9.0030 124.0738 57.5236 40.8183 177.5862 117 E 4.1913 8.3908 118.3493 59.6866 30.5775 177.7068 118 M 4.6743 7.8734 118.7708 55.7965 31.8993 176.7771 119 M 4.2903 9.6402 123.6674 55.1880 33.8607 176.3427 120 G 4.1598 7.3050 104.1516 46.9018 0.0000 171.1030 121 T 5.7822 7.8799 108.1052 60.4224 72.0173 173.3761 122 I 4.6155 8.3080 122.4938 59.9133 40.6386 174.1636 123 C 5.1848 8.9445 124.1818 57.8377 30.8002 174.5031 124 G 4.2548 8.7051 111.3619 45.5867 0.0000 173.5193 125 D 4.5601 8.6959 117.8570 55.8463 42.0322 177.4952 126 D 4.9744 7.9141 114.4111 52.8199 41.7691 175.0514 127 T 5.1350 7.8614 115.4609 62.0985 73.0428 172.7790 128 I 4.9219 8.5141 124.1770 59.5874 41.5965 173.9061 129 L 4.9585 9.0254 129.7725 53.6487 43.8872 174.9541 130 I 4.5577 8.8746 128.5871 59.8307 39.4004 174.7557 131 I 4.8073 8.3803 128.8630 60.2001 38.5717 175.0428 132 C 5.1568 8.7139 124.8627 57.9030 30.5646 174.2081 133 R 4.1838 9.0835 122.1762 59.2689 29.6722 176.6553 134 T 4.8549 7.6450 106.8447 58.3326 72.3333 172.7942 135 P 5.0304 0.0000 0.0000 65.3508 31.0461 178.8982 136 E 3.9840 8.0449 116.9628 59.4479 29.5966 178.8899 137 D 4.3891 7.9524 118.3217 57.0932 40.6652 179.0915 138 T 3.8844 7.8154 116.7251 66.6661 68.5127 176.4391 139 E 4.0447 8.1758 121.2723 59.0300 29.4967 179.2457 140 G 3.4166 7.8279 105.9075 47.8451 0.0000 175.8579 141 V 3.4479 7.5568 121.2447 65.1979 31.4225 177.8986 142 K 3.9298 8.1094 119.2808 59.7806 32.0373 178.5527 143 N 4.3270 7.9352 116.3042 56.2410 38.2003 177.3010 144 R 3.8423 7.8511 119.2474 59.5559 30.2544 178.2966 145 L 4.2816 8.0849 118.7108 57.6610 41.3495 179.3970 146 L 3.8616 7.9304 119.0723 57.3545 41.3641 178.5798 147 E 4.0268 8.3088 116.7328 57.6194 29.6169 178.3015 148 L 4.2345 7.3673 119.6399 56.7169 41.9863 176.5990 149 L 4.1297 7.1502 122.7345 55.8017 40.6237 176.4263 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 2 N 8.28 4.71 0.00 2.77 2.95 0.00 0.00 6.63 6.80 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 3 K 8.03 3.80 0.00 1.85 1.74 0.00 1.71 0.00 0.00 1.80 0.00 0.00 3.15 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.27 1.40 7.81 4 G 8.90 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 5 Q 7.82 4.01 0.00 2.36 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 6 R 8.85 3.83 0.00 2.11 2.02 0.00 3.23 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.47 0.00 7 H 8.40 4.22 0.00 3.19 3.29 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.37 3.71 2.05 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 1.42 1.33 0.92 0.00 0.00 9 K 8.11 3.97 0.00 1.87 1.58 0.00 1.71 0.00 0.00 1.49 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.42 7.81 10 I 8.05 3.60 1.99 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 1.37 0.89 0.81 0.00 0.00 11 R 7.88 3.93 0.00 2.08 1.97 0.00 3.11 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 12 E 7.72 4.05 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 13 I 7.60 3.69 1.80 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 1.53 0.55 0.87 0.00 0.00 14 I 7.44 3.95 2.07 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 1.69 0.52 0.93 0.00 0.00 15 T 7.21 4.31 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 1.20 0.00 0.00 16 S 8.00 4.61 0.00 3.88 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 7.43 5.10 0.00 2.85 2.66 0.00 0.00 6.91 7.76 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 18 E 8.40 4.39 0.00 1.96 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 0.00 2.25 2.32 0.00 19 I 7.85 4.31 1.96 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 1.43 0.90 0.97 0.00 0.00 20 E 10.02 4.73 0.00 1.95 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 2.63 2.23 0.00 21 T 7.71 4.98 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 1.27 0.00 0.00 22 Q 8.88 3.80 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.94 0.00 0.00 0.00 0.00 0.00 2.25 2.54 0.00 23 D 8.04 4.36 0.00 2.69 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 24 E 8.03 3.94 0.00 2.24 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 2.34 2.34 0.00 25 L 7.66 3.96 0.00 1.56 1.68 0.80 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 26 V 7.64 3.55 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.95 0.00 0.00 27 D 8.17 4.32 0.00 2.72 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 M 7.74 4.09 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.52 0.00 29 L 7.55 4.05 0.00 2.00 1.73 0.53 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.13 4.44 0.00 2.12 1.85 0.00 1.74 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.51 7.81 31 Q 7.93 4.19 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 7.14 0.00 0.00 0.00 0.00 0.00 2.55 2.43 0.00 32 D 7.81 4.76 0.00 3.04 2.99 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 33 G 8.29 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 0.00 0.00 0.00 34 Y 7.99 4.44 0.00 3.23 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 35 K 8.67 4.34 0.00 1.75 1.79 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.41 7.81 36 V 8.00 4.59 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 0.81 0.00 0.00 0.93 0.00 0.00 37 T 8.68 4.73 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 38 Q 8.65 3.93 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 39 A 7.93 3.99 1.29 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 0.00 0.00 0.00 40 T 7.42 3.94 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 41 V 8.05 3.84 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 1.11 0.00 0.00 0.94 0.00 0.00 42 S 8.18 4.30 0.00 4.09 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 0.00 43 R 7.77 3.98 0.00 2.13 2.00 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.90 0.00 44 D 7.85 4.28 0.00 2.74 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 45 I 7.88 3.61 1.83 0.00 0.00 0.57 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 1.03 0.96 0.00 0.00 46 K 7.54 4.06 0.00 2.03 1.88 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.47 7.81 47 E 8.32 3.85 0.00 2.02 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 2.41 0.00 48 L 8.29 4.19 0.00 1.54 1.62 0.80 0.94 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 49 H 7.45 4.09 0.00 3.23 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 7.83 4.32 0.00 1.77 1.77 0.92 0.48 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 51 V 8.69 4.44 1.53 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 -0.16 0.00 0.00 0.55 0.00 0.00 52 K 8.46 4.87 0.00 1.59 1.73 0.00 1.00 0.00 0.00 0.61 0.00 0.00 2.63 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.64 1.03 7.81 53 V 8.45 4.49 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.98 0.00 0.00 54 P 0.00 4.81 0.00 1.67 1.51 0.00 3.45 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.88 0.00 55 T 7.82 4.66 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 1.19 0.00 0.00 56 N 8.70 4.31 0.00 2.72 2.91 0.00 0.00 6.81 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 57 N 7.45 4.30 0.00 2.66 2.85 0.00 0.00 7.48 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 58 G 7.93 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 0.00 0.00 0.00 59 S 7.91 4.74 0.00 4.11 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 60 Y 8.64 5.21 0.00 2.83 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 61 K 8.79 4.90 0.00 1.89 1.88 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.25 1.36 7.81 62 Y 8.87 4.68 0.00 2.84 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.71 4.58 0.00 3.84 3.61 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 64 L 8.25 4.47 0.00 1.72 1.54 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 3.90 0.00 2.01 2.05 0.00 3.65 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.31 0.00 66 A 7.91 4.08 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.01 4.38 0.00 2.81 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 9.04 3.99 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 69 R 8.16 4.06 0.00 1.88 1.97 0.00 3.48 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 70 F 8.63 4.46 0.00 2.88 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 71 N 8.53 4.60 0.00 2.43 2.49 0.00 0.00 6.82 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 72 P 0.00 4.14 0.00 2.01 1.96 0.00 3.49 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 2.03 2.35 0.00 73 L 7.71 3.84 0.00 1.71 1.62 1.02 0.93 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 74 S 7.89 4.06 0.00 4.04 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.96 3.89 0.00 2.01 1.90 0.00 1.76 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.49 1.61 7.81 76 L 8.23 3.91 0.00 1.73 1.82 0.89 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.39 3.91 0.00 1.94 2.01 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.61 7.81 78 R 7.89 3.93 0.00 1.89 1.93 0.00 3.33 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 79 A 8.11 4.22 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 80 L 8.27 4.06 0.00 1.96 1.82 1.01 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 81 M 8.01 3.88 0.00 2.02 2.29 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 2.60 2.59 0.00 82 D 8.20 4.58 0.00 2.73 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 83 A 8.45 4.60 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 84 F 8.78 4.28 0.00 3.06 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 85 V 7.26 4.37 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.88 0.00 0.00 86 K 6.65 4.45 0.00 1.78 1.77 0.00 1.46 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.23 1.28 7.81 87 I 8.14 5.10 2.14 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.13 1.16 0.00 0.00 88 D 8.61 4.86 0.00 2.85 2.43 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 89 S 8.57 5.22 0.00 3.86 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 90 A 9.05 4.62 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 91 S 7.14 3.45 0.00 3.94 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.22 5.25 0.00 3.08 3.49 0.00 5.84 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 93 M 8.09 5.33 0.00 1.97 1.90 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 2.54 2.53 0.00 94 I 8.96 4.94 1.92 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 1.15 0.76 1.03 0.00 0.00 95 V 9.09 4.76 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 0.92 0.00 0.00 0.93 0.00 0.00 96 L 8.79 5.04 0.00 1.78 1.44 0.86 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.73 5.12 0.00 1.54 1.59 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.44 7.81 98 T 8.48 5.14 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 1.15 0.00 0.00 99 M 8.59 4.21 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.68 0.00 100 P 0.00 4.23 0.00 2.03 2.00 0.00 3.73 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 2.02 2.09 0.00 101 G 9.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 N 7.80 4.90 0.00 3.02 2.78 0.00 0.00 6.93 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 0.00 103 A 7.68 3.92 1.36 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 0.00 0.00 0.00 104 Q 8.12 3.85 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 105 A 8.02 3.98 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 0.00 106 I 7.66 3.76 1.99 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 1.77 0.92 0.92 0.00 0.00 107 G 8.29 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 7.84 3.99 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 0.00 109 L 7.75 4.01 0.00 1.83 1.63 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 110 M 8.08 3.85 0.00 1.98 2.16 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 2.88 2.49 0.00 111 D 7.89 4.54 0.00 2.80 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 0.00 112 N 7.69 4.81 0.00 2.74 2.72 0.00 0.00 6.47 6.33 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 0.00 113 L 7.20 3.52 0.00 1.18 0.52 0.56 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 114 D 7.08 4.32 0.00 2.92 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 0.00 115 W 7.61 5.07 0.00 3.40 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 0.00 116 D 9.00 4.47 0.00 2.67 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 0.00 117 E 8.39 4.19 0.00 2.02 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 2.33 2.38 0.00 118 M 7.87 4.67 0.00 1.99 2.27 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 2.91 2.66 0.00 119 M 9.64 4.29 0.00 1.86 2.22 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 2.68 2.51 0.00 120 G 7.30 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 T 7.88 5.78 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 1.22 0.00 0.00 122 I 8.31 4.62 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 1.34 0.83 0.91 0.00 0.00 123 C 8.94 5.18 0.00 2.81 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 0.00 124 G 8.71 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 0.00 0.00 0.00 0.00 125 D 8.70 4.56 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 0.00 126 D 7.91 4.97 0.00 2.94 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 0.00 127 T 7.86 5.13 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 0.00 128 I 8.51 4.92 1.86 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 1.10 0.79 0.92 0.00 0.00 129 L 9.03 4.96 0.00 1.70 1.54 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 130 I 8.87 4.56 1.92 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 1.26 0.59 0.98 0.00 0.00 131 I 8.38 4.81 1.89 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 1.25 0.73 0.93 0.00 0.00 132 C 8.71 5.16 0.00 2.86 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 0.00 133 R 9.08 4.18 0.00 1.98 2.14 0.00 3.21 0.00 0.00 3.29 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 134 T 7.64 4.85 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 1.24 0.00 0.00 135 P 0.00 5.03 0.00 2.12 2.06 0.00 3.83 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 2.03 1.72 0.00 136 E 8.04 3.98 0.00 2.03 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 0.00 2.38 2.44 0.00 137 D 7.95 4.39 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 0.00 138 T 7.82 3.88 4.42 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 1.25 0.00 0.00 139 E 8.18 4.04 0.00 2.08 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 2.29 2.36 0.00 140 G 7.83 3.42 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 0.00 141 V 7.56 3.45 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 1.20 0.00 0.00 0.98 0.00 0.00 142 K 8.11 3.93 0.00 1.99 1.99 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.55 7.81 143 N 7.94 4.33 0.00 2.84 2.81 0.00 0.00 6.73 8.89 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 0.00 144 R 7.85 3.84 0.00 1.74 1.99 0.00 2.21 0.00 0.00 2.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.51 0.00 145 L 8.08 4.28 0.00 2.02 1.83 1.08 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 146 L 7.93 3.86 0.00 1.84 1.63 0.93 0.91 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 0.00 147 E 8.31 4.03 0.00 2.02 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 0.00 2.31 2.55 0.00 148 L 7.37 4.23 0.00 1.77 1.73 1.05 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 149 L 7.15 4.13 0.00 1.46 1.46 0.78 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00