NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 3.9995 8.0549 120.3917 62.4528 32.5941 175.1639 3 S 4.1547 8.3767 122.6915 57.2182 63.6017 172.1459 4 A 3.9811 9.0659 124.7237 52.7104 19.5987 176.8142 5 T 4.4971 8.7090 118.8348 61.8178 71.6288 172.8859 6 Y 5.2578 8.6075 122.4843 56.4021 40.8776 175.2972 7 S 4.8854 9.5621 120.1951 57.0615 65.3048 173.7086 8 V 4.2636 8.5942 126.4152 61.9235 31.2338 175.5774 9 V 2.7924 8.7403 129.9498 65.2975 32.4018 175.5033 10 Y 4.4421 7.6788 119.9900 57.1987 41.8466 172.9767 11 E 4.4382 8.4455 126.0605 56.9164 30.7327 178.2525 12 T 4.1457 6.7628 113.1346 60.6804 72.6830 173.1634 13 G 3.7820 8.8255 107.8128 44.9545 0.0000 174.2092 14 K 4.3287 8.2949 121.8325 55.5060 32.5787 175.8222 15 K 3.9372 7.1977 116.3575 54.7567 35.1977 175.6447 16 L 4.5576 8.3447 120.1394 54.9538 42.0901 176.7757 17 N 4.7085 9.1823 119.3014 52.9508 40.1283 174.4467 18 S 4.0622 8.7117 115.2983 59.9680 62.9648 174.3791 19 G 3.6501 9.1041 114.0763 45.6335 0.0000 172.0399 20 F 5.2728 7.6447 116.0389 55.4223 42.2128 174.1140 21 D 4.9067 8.8469 120.6119 52.7787 45.4733 173.4039 22 N 5.2853 8.9507 121.6144 51.8433 39.9101 174.6770 23 W 5.0168 9.2815 129.0174 56.7711 29.9005 177.4697 24 G 3.7698 8.3421 110.9868 45.2435 0.0000 173.3619 25 W 5.0572 7.7512 114.1673 56.3067 31.1863 173.6811 26 D 4.7381 8.8710 116.9995 54.8073 37.9709 172.9292 27 S 5.0553 7.5030 109.8937 57.7878 66.3067 174.0663 28 K 4.5564 8.7692 119.0095 54.7551 35.5624 175.2851 29 M 4.7900 8.6258 125.1263 54.4648 33.4421 174.9080 30 S 4.7270 8.6124 120.0580 56.5801 67.6689 172.5663 31 F 5.2776 8.5932 116.8408 54.7570 41.6393 174.7380 32 K 4.6260 8.5687 123.6326 55.7033 35.2332 174.5652 33 D 4.6411 9.3745 119.6984 55.8337 39.6050 172.4747 34 N 4.2951 8.5545 109.9928 53.9356 37.6057 172.6105 35 S 5.1114 8.0230 108.2568 56.0492 67.8207 172.3315 36 L 3.8887 8.5257 122.6522 53.6653 43.2444 175.1329 37 V 4.4369 8.1668 126.6096 60.8516 34.1744 173.6935 38 L 4.4779 8.2928 130.4108 54.0046 43.7576 175.1094 39 T 4.6944 8.4151 122.7616 61.3022 71.2479 173.4908 40 A 4.3899 8.4384 128.8810 51.6619 19.9089 176.4844 41 D 4.5986 8.9336 121.2109 53.3937 42.4338 174.5372 42 P 4.3274 0.0000 0.0000 64.6810 31.6282 176.1808 43 D 4.4927 8.8944 120.4389 54.9045 38.5876 173.1093 44 E 4.7798 8.0015 118.8916 54.8317 32.0357 175.4419 45 Y 4.8644 8.4711 124.1080 56.7383 37.5125 174.8260 46 G 4.0605 7.7371 110.5339 45.1740 0.0000 170.5287 47 A 4.9373 7.9536 121.6944 49.8042 23.0064 175.4587 48 I 4.3563 7.8601 113.4700 59.7772 40.5839 175.2295 49 S 4.4536 8.9776 118.0230 56.9792 65.4421 173.0320 50 L 4.9881 9.1477 129.8315 53.4821 42.5902 175.8776 51 K 4.5729 8.8503 127.3541 55.3106 33.5711 175.1414 52 N 4.2406 8.3083 127.0630 53.1305 38.7691 174.5024 53 L 4.2036 8.2896 126.3093 55.0273 42.0240 177.8902 54 N 4.2724 8.0260 117.3516 55.1917 38.4437 175.0017 55 S 4.6689 7.3686 110.1859 55.8361 65.8556 174.1101 56 N 4.1551 8.4809 120.2653 55.6707 38.4285 175.1740 57 Y 4.8026 6.8636 110.2646 56.0334 42.2246 174.9178 58 Y 3.8375 8.4479 120.7705 59.1947 38.2512 177.1578 59 G 3.9980 6.1528 104.1845 45.2781 0.0000 170.0050 60 K 4.8882 8.4169 120.5569 55.2536 34.2396 177.2353 61 G 4.0088 9.6517 117.1378 47.1695 0.0000 170.9045 62 G 4.0692 9.5377 105.3039 43.8604 0.0000 171.8360 63 C 5.4090 8.7439 119.0423 55.0710 46.2185 174.2169 64 I 4.9607 8.9370 126.7712 59.9019 39.0695 173.8338 65 Y 5.2614 8.9376 128.9767 55.8963 41.4952 174.2462 66 L 5.2714 7.7154 124.0099 56.0465 44.7236 173.3500 67 Q 5.2800 8.9700 118.6241 54.3032 31.5027 175.1970 68 V 5.1024 9.0677 122.2800 61.0328 35.4918 174.0098 69 K 4.5909 8.6098 127.7209 53.8432 34.9872 174.6930 70 T 4.6175 8.2417 119.5318 62.0668 71.2283 173.3051 71 E 4.4269 9.1613 124.0336 56.8789 30.6565 176.4322 72 T 4.7490 7.4248 115.1494 61.1988 69.1187 172.1292 73 E 4.4397 7.5812 116.0080 55.1879 32.8650 174.1223 74 G 3.7173 5.7234 103.8647 45.8071 0.0000 171.3434 75 L 5.0839 7.5501 119.2864 52.8384 45.6526 175.8576 76 V 4.8200 8.2629 121.8359 61.2082 34.0553 174.7108 77 K 5.0561 8.8773 125.5306 55.0281 37.2618 175.2021 78 V 4.9895 8.5358 113.8585 60.0154 35.2851 175.4710 79 Q 4.8070 8.4843 119.8058 55.3633 32.6880 174.3128 80 G 4.5974 8.4628 103.3605 46.2124 0.0000 173.6726 81 V 4.3085 7.8445 118.8451 61.3265 32.5465 174.9509 82 R 4.2808 8.7916 128.7628 57.9882 30.2378 176.5971 83 G 3.9662 9.3986 113.4068 45.2306 0.0000 172.3254 84 Y 4.8279 7.5396 115.7543 55.3340 41.5761 174.8659 85 D 4.5291 8.7553 120.7569 54.4743 41.9825 177.3408 86 E 4.2158 8.9844 123.9562 59.4091 29.8133 179.0691 87 T 3.9099 7.9990 108.5992 63.5637 69.2776 174.3675 88 E 3.8093 8.0896 123.9635 55.7815 30.0575 175.3686 89 A 4.9219 7.8851 127.1045 50.0560 22.1927 175.3256 90 F 4.5598 8.6984 118.5245 55.3527 42.3784 174.5006 91 N 4.8522 8.9607 121.7188 53.5643 38.5879 175.3440 92 V 4.3004 8.5701 115.6689 60.7375 34.2227 175.3607 93 G 3.7125 6.7212 106.4036 46.0353 0.0000 171.7466 94 S 5.1957 8.7257 113.4448 56.2722 66.3110 173.2604 95 F 4.9951 8.2662 115.8053 55.0886 41.2430 173.8300 96 R 4.8961 8.9162 115.5250 54.3651 32.9318 174.6837 97 S 4.8621 8.6876 115.0787 58.8109 63.5037 174.5896 98 S 4.6888 9.0691 117.4120 56.9747 65.9510 175.6707 99 S 4.1338 8.7574 119.4189 60.8861 62.8419 172.9653 100 D 4.9122 7.5045 117.2431 51.6166 44.8475 175.1119 101 F 4.3848 8.8539 118.9462 58.0614 39.4694 175.2509 102 T 4.6549 9.0759 120.6565 61.6487 71.2215 173.5108 103 E 4.5373 8.6026 125.3928 56.3205 30.7877 175.7119 104 Y 4.5595 8.5662 120.3966 55.9884 42.3710 174.5049 105 K 4.8590 8.2288 121.1190 54.5447 35.6194 175.4507 106 F 5.1172 9.0047 123.7653 55.5592 42.0318 174.4251 107 E 4.6046 9.0879 123.8441 56.2415 30.2850 176.2646 108 V 4.2028 8.7326 125.1869 61.3120 33.3603 174.6650 109 D 4.4520 8.8659 127.3644 54.8295 41.5199 177.1201 110 D 4.5090 8.7289 124.2042 56.8127 41.0656 177.4862 111 E 3.9613 8.5661 118.2730 57.9992 29.7502 176.0138 112 Y 4.8609 7.8229 117.7333 56.3926 40.0679 174.6161 113 Q 5.4718 9.0407 126.8131 53.6475 30.9564 174.1303 114 F 5.9551 8.7061 120.7319 54.1407 41.9672 174.5855 115 D 5.0455 9.0935 117.7523 53.2859 41.2276 175.5240 116 R 5.4351 8.3623 118.4091 55.1978 35.1469 173.6525 117 I 4.6983 8.7971 124.6300 59.8903 39.2950 174.5661 118 I 4.7995 8.7484 128.9250 59.6346 39.5300 174.9525 119 V 4.7653 8.1976 126.0057 61.0882 34.5207 174.0276 120 Q 4.6708 9.0007 127.8775 54.3625 33.2285 173.4508 121 D 4.7627 8.9003 126.4650 53.4390 41.1284 177.1739 122 G 3.6277 8.5809 115.8062 48.3600 0.0000 171.8765 123 P 4.1821 0.0000 0.0000 62.1654 31.8727 175.9111 124 A 4.1864 7.7706 120.1854 52.0389 16.0957 177.3845 125 S 4.4046 8.5966 114.0969 57.3378 64.6386 175.1648 126 N 4.5657 8.1640 116.7509 53.6304 37.1332 172.8199 127 I 4.4012 7.3224 116.3182 58.1405 38.7122 173.9993 128 P 4.3197 0.0000 0.0000 62.9632 32.2009 175.7673 129 I 4.2504 8.3297 123.6773 59.8832 39.4973 174.0066 130 Y 4.9579 8.7047 126.0043 57.0857 39.6232 175.0521 131 M 5.6070 9.1866 122.7853 53.9145 36.5634 174.6644 132 R 4.9311 8.7288 119.2251 54.6570 35.5275 174.1964 133 Y 3.8729 7.7010 116.0740 59.4111 35.8769 171.6174 134 I 4.6365 8.2083 120.9808 61.0743 38.7801 177.2007 135 I 5.1286 9.2299 128.4169 59.7973 41.1705 173.7567 136 Y 5.2067 9.2258 128.2934 56.1067 41.0061 174.0972 137 S 4.6863 8.1263 120.8808 56.3376 65.0996 174.7864 138 T 3.8832 8.3690 116.8528 63.8057 69.2973 174.8882 139 G 3.8667 7.7789 112.5637 44.0612 0.0000 173.0153 140 S 4.4806 8.1669 113.1007 57.7357 64.1262 176.0497 141 C 4.3890 8.7475 119.0636 60.2643 39.6561 175.9256 142 D 4.3314 7.3954 116.8739 57.2950 40.5242 177.7859 143 D 4.6771 7.6566 115.8041 53.7575 41.4775 175.5872 144 H 4.8224 7.6058 120.8638 54.5084 30.9693 174.2658 145 I 4.5669 7.6036 118.6460 58.1072 40.2896 175.7830 146 L 3.6611 8.2180 124.4586 57.9567 41.9668 179.0085 147 E 3.9121 7.9209 118.3253 59.5689 29.1219 178.7886 148 H 4.0772 7.3481 114.2476 58.8306 28.8400 177.0548 149 H 3.8421 7.3327 114.4839 56.5582 28.7264 175.0947 150 H 4.3684 7.4894 123.2903 56.3163 29.2798 174.4288 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 V 8.05 4.00 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 0.98 0.00 0.00 0.93 0.00 0.00 3 S 8.38 4.15 0.00 3.96 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 4 A 9.07 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.71 4.50 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 1.26 0.00 0.00 6 Y 8.61 5.26 0.00 2.96 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 7 S 9.56 4.89 0.00 4.24 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 0.00 8 V 8.59 4.26 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 0.80 0.00 0.00 1.05 0.00 0.00 9 V 8.74 2.79 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.69 0.00 0.00 10 Y 7.68 4.44 0.00 3.05 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.45 4.44 0.00 1.74 1.72 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 2.43 2.26 0.00 12 T 6.76 4.15 4.31 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 0.81 0.00 0.00 13 G 8.83 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 14 K 8.29 4.33 0.00 1.62 1.64 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.41 7.81 15 K 7.20 3.94 0.00 1.69 1.48 0.00 1.55 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.21 1.43 7.81 16 L 8.34 4.56 0.00 1.73 1.88 1.12 1.17 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 17 N 9.18 4.71 0.00 3.04 2.95 0.00 0.00 6.80 7.90 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 18 S 8.71 4.06 0.00 3.91 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.10 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 20 F 7.64 5.27 0.00 3.01 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 21 D 8.85 4.91 0.00 2.83 2.39 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 22 N 8.95 5.29 0.00 2.80 2.81 0.00 0.00 6.88 7.95 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 23 W 9.28 5.02 0.00 3.22 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.34 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 0.00 0.00 0.00 25 W 7.75 5.06 0.00 3.49 3.27 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 26 D 8.87 4.74 0.00 3.02 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 27 S 7.50 5.06 0.00 3.78 3.70 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 K 8.77 4.56 0.00 1.57 1.64 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.46 7.81 29 M 8.63 4.79 0.00 1.92 1.81 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.97 0.00 30 S 8.61 4.73 0.00 3.83 3.85 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 31 F 8.59 5.28 0.00 2.95 3.07 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 0.00 0.00 0.00 32 K 8.57 4.63 0.00 1.82 1.74 0.00 1.96 0.00 0.00 1.94 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.52 7.81 33 D 9.37 4.64 0.00 2.80 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 34 N 8.55 4.30 0.00 2.86 2.85 0.00 0.00 6.99 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.02 5.11 0.00 4.17 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 0.00 36 L 8.53 3.89 0.00 0.27 0.91 0.51 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.17 4.44 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.83 0.00 0.00 38 L 8.29 4.48 0.00 1.58 1.28 0.71 0.38 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 39 T 8.42 4.69 4.14 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 0.00 0.00 1.14 0.00 0.00 40 A 8.44 4.39 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 41 D 8.93 4.60 0.00 2.60 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.33 0.00 2.04 2.02 0.00 3.81 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 2.13 0.00 43 D 8.89 4.49 0.00 2.84 2.78 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 44 E 8.00 4.78 0.00 2.12 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 2.48 2.39 0.00 45 Y 8.47 4.86 0.00 2.79 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 46 G 7.74 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 0.00 0.00 0.00 47 A 7.95 4.94 -0.20 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 0.00 0.00 48 I 7.86 4.36 1.80 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.47 0.71 0.00 0.00 49 S 8.98 4.45 0.00 3.87 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 50 L 9.15 4.99 0.00 1.69 1.73 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.85 4.57 0.00 0.94 0.85 0.00 1.20 0.00 0.00 0.69 0.00 0.00 2.19 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.30 0.67 7.81 52 N 8.31 4.24 0.00 1.44 2.05 0.00 0.00 7.19 7.55 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 53 L 8.29 4.20 0.00 1.40 1.53 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 N 8.03 4.27 0.00 2.59 2.71 0.00 0.00 6.62 7.14 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 55 S 7.37 4.67 0.00 3.71 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 56 N 8.48 4.16 0.00 2.41 2.21 0.00 0.00 6.68 7.46 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 57 Y 6.86 4.80 0.00 2.86 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 58 Y 8.45 3.84 0.00 1.48 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 59 G 6.15 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.42 4.89 0.00 1.66 1.72 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.41 7.81 61 G 9.65 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 0.00 0.00 0.00 62 G 9.54 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 63 C 8.74 5.41 0.00 3.11 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 64 I 8.94 4.96 2.13 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 1.33 0.89 1.07 0.00 0.00 65 Y 8.94 5.26 0.00 2.77 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 66 L 7.72 5.27 0.00 1.79 1.75 0.85 0.97 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 67 Q 8.97 5.28 0.00 2.32 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 68 V 9.07 5.10 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 0.80 0.00 0.00 0.71 0.00 0.00 69 K 8.61 4.59 0.00 0.79 0.74 0.00 1.59 0.00 0.00 1.04 0.00 0.00 2.13 0.00 0.00 2.20 0.00 0.00 0.00 0.00 1.03 1.01 7.81 70 T 8.24 4.62 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 1.41 0.00 0.00 71 E 9.16 4.43 0.00 2.03 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 2.28 2.32 0.00 72 T 7.42 4.75 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 1.30 0.00 0.00 73 E 7.58 4.44 0.00 2.04 1.91 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 2.18 2.14 0.00 74 G 5.72 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 75 L 7.55 5.08 0.00 1.58 1.46 1.06 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.26 4.82 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 0.97 0.00 0.00 0.85 0.00 0.00 77 K 8.88 5.06 0.00 1.65 1.69 0.00 1.65 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.28 1.33 7.81 78 V 8.54 4.99 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 -0.12 0.00 0.00 0.66 0.00 0.00 79 Q 8.48 4.81 0.00 2.46 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.33 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 80 G 8.46 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.84 4.31 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 0.89 0.00 0.00 0.82 0.00 0.00 82 R 8.79 4.28 0.00 1.61 1.78 0.00 3.07 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 83 G 9.40 3.97 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 0.00 0.00 0.00 84 Y 7.54 4.83 0.00 3.22 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 D 8.76 4.53 0.00 2.84 2.62 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 86 E 8.98 4.22 0.00 2.33 2.33 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 2.43 2.38 0.00 87 T 8.00 3.91 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 88 E 8.09 3.81 0.00 1.95 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 0.00 1.47 1.87 0.00 89 A 7.89 4.92 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 0.00 0.00 0.00 0.00 0.00 90 F 8.70 4.56 0.00 2.52 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 91 N 8.96 4.85 0.00 2.61 2.72 0.00 0.00 6.95 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 92 V 8.57 4.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.75 0.00 0.00 93 G 6.72 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 0.00 0.00 0.00 94 S 8.73 5.20 0.00 3.77 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 95 F 8.27 5.00 0.00 2.67 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.92 4.90 0.00 1.83 1.97 0.00 3.32 0.00 0.00 3.32 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 97 S 8.69 4.86 0.00 3.81 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 98 S 9.07 4.69 0.00 3.95 3.96 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 99 S 8.76 4.13 0.00 3.87 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 0.00 100 D 7.50 4.91 0.00 2.63 2.55 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 0.00 101 F 8.85 4.38 0.00 3.08 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 0.00 102 T 9.08 4.65 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 0.80 0.00 0.00 103 E 8.60 4.54 0.00 1.76 1.81 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 2.41 2.37 0.00 104 Y 8.57 4.56 0.00 2.51 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.23 4.86 0.00 1.52 1.66 0.00 1.82 0.00 0.00 1.85 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.54 7.81 106 F 9.00 5.12 0.00 2.95 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 0.00 107 E 9.09 4.60 0.00 1.93 1.94 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 2.37 2.38 0.00 108 V 8.73 4.20 2.32 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 0.94 0.00 0.00 0.96 0.00 0.00 109 D 8.87 4.45 0.00 2.49 1.59 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 0.00 110 D 8.73 4.51 0.00 2.65 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 0.00 111 E 8.57 3.96 0.00 1.42 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 2.24 2.25 0.00 112 Y 7.82 4.86 0.00 2.85 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 0.00 113 Q 9.04 5.47 0.00 1.98 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.99 0.00 114 F 8.71 5.96 0.00 3.40 3.14 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 0.00 0.00 0.00 115 D 9.09 5.05 0.00 2.55 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 0.00 116 R 8.36 5.44 0.00 1.92 1.97 0.00 3.55 0.00 0.00 3.58 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 117 I 8.80 4.70 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 1.13 0.36 0.88 0.00 0.00 118 I 8.75 4.80 1.96 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.75 0.77 0.00 0.00 119 V 8.20 4.77 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 0.65 0.00 0.00 0.79 0.00 0.00 120 Q 9.00 4.67 0.00 1.90 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.73 0.00 0.00 0.00 0.00 0.00 1.58 1.93 0.00 121 D 8.90 4.76 0.00 2.89 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 8.58 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 0.00 123 P 0.00 4.18 0.00 2.04 2.08 0.00 4.13 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 124 A 7.77 4.19 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 0.00 125 S 8.60 4.40 0.00 3.99 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 N 8.16 4.57 0.00 2.84 2.90 0.00 0.00 7.28 7.94 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 0.00 127 I 7.32 4.40 1.87 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 1.36 0.93 0.93 0.00 0.00 128 P 0.00 4.32 0.00 1.15 1.74 0.00 3.70 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 2.00 1.99 0.00 129 I 8.33 4.25 1.65 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 1.28 0.90 0.49 0.00 0.00 130 Y 8.70 4.96 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 0.00 131 M 9.19 5.61 0.00 1.89 1.88 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 132 R 8.73 4.93 0.00 1.21 0.66 0.00 2.21 0.00 0.00 2.45 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.19 0.00 133 Y 7.70 3.87 0.00 3.41 3.07 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 0.00 0.00 0.00 134 I 8.21 4.64 1.98 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 1.28 0.74 0.96 0.00 0.00 135 I 9.23 5.13 2.02 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.13 1.03 0.00 0.00 136 Y 9.23 5.21 0.00 3.08 3.07 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 0.00 0.00 0.00 137 S 8.13 4.69 0.00 3.99 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 8.37 3.88 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 1.40 0.00 0.00 139 G 7.78 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 0.00 0.00 0.00 140 S 8.17 4.48 0.00 4.03 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 0.00 141 C 8.75 4.39 0.00 3.02 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 0.00 142 D 7.40 4.33 0.00 2.65 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 D 7.66 4.68 0.00 2.76 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 0.00 144 H 7.61 4.82 0.00 3.20 3.33 0.00 5.73 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 I 7.60 4.57 1.73 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.55 0.88 0.00 0.00 146 L 8.22 3.66 0.00 1.22 1.47 0.49 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 147 E 7.92 3.91 0.00 1.93 1.84 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 2.31 2.36 0.00 148 H 7.35 4.08 0.00 3.22 3.19 0.00 5.68 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 H 7.33 3.84 0.00 3.08 3.19 0.00 5.81 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 0.00 150 H 7.49 4.37 0.00 3.28 3.21 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00