NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6071 8.3649 120.1916 54.1986 42.4021 175.3398 2 C 4.9604 8.3869 121.4667 53.5911 39.7414 171.4209 3 P 4.4835 0.0000 0.0000 62.6311 32.4498 177.3489 4 S 4.3757 8.7058 113.7675 60.5137 63.1145 174.6497 5 D 4.7009 8.3253 118.8935 53.2953 40.0398 175.8873 6 W 4.8920 8.0997 119.9093 55.3093 31.6884 175.1749 7 S 4.9686 9.6059 117.5178 56.9489 64.2176 172.5927 8 S 5.3064 8.8656 121.2852 57.0658 63.9294 172.7186 9 Y 4.0742 9.1353 127.8350 57.0866 41.4989 174.7961 10 E 3.6364 9.1816 128.6480 57.4576 27.2811 175.4194 11 G 3.9197 7.9845 101.8230 46.4343 0.0000 172.2460 12 H 4.9385 8.2382 115.3937 53.6479 32.8033 171.6069 13 C 5.3260 8.1738 118.6697 55.4744 41.0939 172.7348 14 Y 5.5483 9.2965 122.1536 56.2739 40.8828 175.1497 15 K 4.4723 8.7288 124.4021 54.4550 35.6102 172.9317 16 P 5.3326 0.0000 0.0000 62.0404 33.1227 174.7709 17 F 4.9472 9.1025 120.8983 55.2176 42.4566 175.2053 18 S 3.8908 7.9803 112.3273 57.9730 62.6316 174.0965 19 E 4.3499 7.6231 123.3804 54.3128 30.3580 172.4107 20 P 4.7662 0.0000 0.0000 62.3753 32.0307 175.7834 21 K 4.8258 8.6179 122.6659 54.1198 37.1396 175.8219 22 N 5.6866 8.5784 119.0625 52.0001 38.5375 175.9201 23 W 2.7045 8.7759 126.6465 60.1123 30.4680 177.2735 24 A 3.9924 8.1189 120.0460 55.4140 17.8669 179.1352 25 D 4.1465 9.2169 117.8675 57.5194 40.7577 179.0354 26 A 3.2438 7.7528 121.0418 54.1314 17.8451 178.8511 27 E 3.5124 6.8513 116.5549 58.5668 29.9772 177.2006 28 N 4.2393 8.1705 117.9538 55.8296 38.8767 176.4373 29 F 3.8018 8.9349 121.8960 61.8329 39.7541 177.3955 30 C 4.5005 7.8994 115.7747 60.0918 38.2013 176.1467 31 T 4.0606 8.0801 112.9072 63.7233 68.1768 175.7783 32 Q 4.2966 7.4195 118.2153 56.1708 28.8080 176.2554 33 Q 4.3445 7.4772 117.2533 56.2258 29.8423 175.4273 34 H 4.0540 7.3531 117.1673 54.9044 33.3154 173.1629 35 A 3.8439 7.9054 128.0157 54.2471 18.2407 177.7877 36 G 3.8624 8.9164 110.7296 45.7814 0.0000 173.5137 37 G 4.0782 7.9502 106.8510 46.5974 0.0000 173.0342 38 H 5.1776 8.7032 117.1867 54.4444 34.1418 172.8878 39 L 4.6581 8.7075 122.4796 54.7300 43.0057 176.8130 40 V 4.0479 8.6977 123.2598 61.7186 32.4285 175.2478 41 S 4.6614 8.4461 120.2461 56.3305 63.9917 174.1956 42 F 4.9806 8.4063 125.3398 56.6466 37.7443 175.6088 43 Q 4.4102 9.3394 124.4796 56.1813 29.1443 175.9703 44 S 4.6308 7.3688 111.9494 56.3915 65.3220 177.1371 45 S 4.0374 8.3414 115.8257 61.4743 62.6533 176.2268 46 E 3.8772 8.0474 121.7680 59.1717 29.4016 178.6610 47 E 2.8584 7.6535 118.1945 59.0793 29.4824 178.8037 48 A 2.5800 7.6417 120.5599 54.3043 18.1314 179.5261 49 D 3.9414 7.8122 117.7511 57.3401 41.0239 178.2672 50 F 3.8599 8.0267 121.5830 61.6038 39.1951 177.4689 51 V 3.1069 7.2813 117.2815 65.6551 31.1909 178.2214 52 V 3.2432 6.9019 117.9875 65.7535 31.3865 178.2401 53 K 3.9599 8.0578 118.6252 59.0725 31.4523 179.2116 54 L 3.6671 7.5698 120.4442 58.1296 41.5181 179.0038 55 A 3.8559 7.8988 120.6798 55.2861 18.0693 178.6349 56 F 4.3437 8.2975 119.8016 60.9737 39.1939 176.9142 57 Q 3.7136 8.3590 119.2908 59.8935 28.8686 178.9872 58 T 3.6654 7.5559 115.9357 64.7054 68.2909 174.9704 59 F 4.6394 7.1370 118.7252 57.1252 39.5975 178.2679 60 G 3.6218 8.1085 110.7453 46.7884 0.0000 173.3658 61 H 5.2968 8.2466 115.8087 56.4740 32.9760 172.5081 62 S 4.5904 7.7126 121.3743 57.8885 66.1888 172.9565 63 I 4.8787 7.6538 113.9038 59.2349 39.4319 174.7801 64 F 4.6338 8.7379 125.5886 55.2074 41.8901 176.0521 65 W 5.3761 8.7530 122.0397 57.3956 30.8003 174.5202 66 M 4.6261 8.8101 118.5623 54.5882 35.2800 175.5186 67 G 4.1123 8.7404 108.1686 45.7957 0.0000 173.2630 68 L 4.6472 7.9145 120.1149 52.5353 43.9582 176.2288 69 S 3.8502 7.6920 115.9103 58.3150 65.5317 172.7507 70 N 3.8305 7.8965 115.2287 54.9149 37.0306 176.3192 71 V 3.5379 7.0470 113.5754 63.9998 32.1141 178.1069 72 W 4.8964 7.5470 116.8888 56.7692 30.0872 177.9672 73 N 4.3660 8.2829 116.8910 55.9930 38.0612 176.0744 74 Q 4.9572 7.8581 115.1155 55.8651 29.4443 175.5321 75 C 4.3083 7.7593 114.9541 58.8432 29.0820 173.6666 76 N 4.5670 8.2362 119.1115 52.7229 37.8819 174.8358 77 W 4.8225 8.5554 123.8198 54.7832 31.3334 175.6104 78 Q 4.6738 8.2027 118.9026 54.7261 30.9291 174.1575 79 W 4.4568 8.7989 120.2248 56.3672 29.7361 177.6987 80 S 4.4242 8.8593 114.3288 60.3312 62.7002 174.4267 81 N 4.6214 8.3276 117.8252 52.6770 37.1502 175.6832 82 A 3.8247 8.1111 119.4693 52.4183 17.5758 178.7740 83 A 4.4633 7.7104 118.4206 51.9938 19.7600 177.5230 84 M 4.6791 8.6101 118.1133 54.5106 33.0964 175.4362 85 L 4.1915 8.4993 121.9854 55.3137 42.2506 174.8833 86 R 4.5262 9.0221 126.0533 57.8651 32.8067 174.2681 87 Y 4.3895 7.8735 119.7641 57.5276 39.8072 175.3375 88 K 4.2332 6.8761 121.7570 55.0613 36.1175 176.7755 89 A 4.4230 7.2459 123.5019 51.1529 19.4919 176.6261 90 W 4.2735 7.8014 119.1968 58.6569 29.6182 176.7686 91 A 4.2587 8.8314 125.5439 54.0154 18.4138 177.3588 92 E 4.7415 8.0719 115.4905 54.0806 32.5285 175.3339 93 E 4.0213 8.9165 124.2577 59.2277 30.2644 176.9474 94 S 5.1025 7.2880 110.7829 58.2356 65.6892 173.5212 95 Y 4.8355 8.4296 118.6716 56.4501 41.2111 175.1987 96 C 4.9398 9.5171 120.2460 54.8963 43.8412 173.9797 97 V 4.6952 8.2916 124.1626 63.4632 32.0181 174.6230 98 Y 5.2946 8.6892 123.0530 56.0357 41.8230 173.1422 99 F 5.6230 9.0501 115.7255 54.8467 42.1127 173.5957 100 K 5.3302 8.7844 116.7962 54.8684 35.6336 177.7039 101 S 4.3449 9.1551 118.0105 60.8552 63.2852 176.0634 102 T 4.2398 8.2180 115.7005 63.8103 67.6043 173.7950 103 N 4.9733 7.6381 115.6609 51.6982 39.9364 172.8782 104 N 4.6343 8.4666 114.3021 53.7127 38.8487 175.2832 105 K 4.6229 7.9596 117.3005 54.9103 33.6337 176.3596 106 W 4.6128 9.0525 123.5031 56.6796 29.9751 175.8030 107 R 4.9368 8.8024 123.8289 54.1783 33.6960 174.6745 108 S 5.3996 8.6893 113.4427 57.1789 65.6245 173.5049 109 R 5.0689 10.0342 123.7679 53.9249 33.9015 174.0581 110 A 3.5244 8.4822 125.1537 52.2108 18.7387 178.3176 111 C 4.2296 8.9733 120.4612 60.5060 40.3755 176.9000 112 R 4.1740 7.8895 112.3049 57.5128 29.4008 176.6467 113 M 4.5661 8.1539 120.2447 54.2265 34.2952 174.6617 114 M 5.0761 8.1133 116.4800 53.3102 35.7488 174.2807 115 A 3.9953 7.4005 121.4218 51.2705 23.0218 175.7218 116 Q 4.3755 7.8445 117.9144 57.3052 31.0256 175.4504 117 F 5.2619 7.5432 112.1429 57.3835 40.9361 172.7747 118 V 5.1484 8.4738 118.9473 61.6359 34.4192 175.0930 119 C 5.8027 9.7013 125.6125 56.1065 37.4648 172.3658 120 E 5.9800 9.7154 117.7008 56.7833 33.1984 173.6434 121 F 5.3256 7.8484 114.8044 56.4964 41.4235 172.5554 122 Q 4.3485 8.7029 116.3340 54.1617 30.8692 175.4511 123 A 4.1103 8.1407 120.5947 52.8085 19.2678 176.7300 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 D 8.36 4.61 0.00 2.66 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 2 C 8.39 4.96 0.00 3.17 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 3 P 0.00 4.48 0.00 2.42 2.15 0.00 3.55 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.03 0.00 4 S 8.71 4.38 0.00 4.03 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 5 D 8.33 4.70 0.00 2.78 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 6 W 8.10 4.89 0.00 3.28 3.30 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 7 S 9.61 4.97 0.00 3.98 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 8 S 8.87 5.31 0.00 4.00 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 9 Y 9.14 4.07 0.00 1.43 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 0.00 0.00 0.00 0.00 10 E 9.18 3.64 0.00 1.87 1.80 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 1.75 1.47 0.00 11 G 7.98 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 0.00 0.00 0.00 12 H 8.24 4.94 0.00 3.34 2.68 0.00 5.56 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 13 C 8.17 5.33 0.00 1.23 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 14 Y 9.30 5.55 0.00 3.19 3.06 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 15 K 8.73 4.47 0.00 0.79 0.74 0.00 0.80 0.00 0.00 1.28 0.00 0.00 2.13 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.30 0.21 7.81 16 P 0.00 5.33 0.00 2.45 2.04 0.00 3.52 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 17 F 9.10 4.95 0.00 1.54 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 18 S 7.98 3.89 0.00 3.47 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 19 E 7.62 4.35 0.00 1.84 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 2.09 2.23 0.00 20 P 0.00 4.77 0.00 1.86 1.85 0.00 3.61 0.00 0.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.75 0.00 21 K 8.62 4.83 0.00 1.46 1.48 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.77 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.32 1.37 7.81 22 N 8.58 5.69 0.00 3.02 3.01 0.00 0.00 6.37 8.88 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 23 W 8.78 2.70 0.00 2.45 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 24 A 8.12 3.99 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 25 D 9.22 4.15 0.00 2.52 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 26 A 7.75 3.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 6.85 3.51 0.00 1.16 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.11 0.00 28 N 8.17 4.24 0.00 2.75 2.82 0.00 0.00 6.69 8.54 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 29 F 8.93 3.80 0.00 3.01 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 C 7.90 4.50 0.00 3.13 3.36 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 31 T 8.08 4.06 4.15 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 1.19 0.00 0.00 32 Q 7.42 4.30 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00 33 Q 7.48 4.34 0.00 2.53 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.85 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 34 H 7.35 4.05 0.00 2.40 2.31 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.91 3.84 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.92 3.86 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 0.00 0.00 0.00 37 G 7.95 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 0.00 0.00 0.00 38 H 8.70 5.18 0.00 3.18 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.71 4.66 0.00 1.76 1.51 0.94 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.70 4.05 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.05 0.00 0.00 41 S 8.45 4.66 0.00 4.17 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 42 F 8.41 4.98 0.00 3.23 3.09 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 0.00 43 Q 9.34 4.41 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 44 S 7.37 4.63 0.00 3.96 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 45 S 8.34 4.04 0.00 4.02 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 46 E 8.05 3.88 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 47 E 7.65 2.86 0.00 2.11 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 2.22 2.15 0.00 48 A 7.64 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.81 3.94 0.00 2.73 2.60 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 50 F 8.03 3.86 0.00 2.86 2.50 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 51 V 7.28 3.11 1.66 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 1.03 0.00 0.00 0.74 0.00 0.00 52 V 6.90 3.24 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 0.83 0.00 0.00 0.45 0.00 0.00 53 K 8.06 3.96 0.00 1.61 1.77 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.45 7.81 54 L 7.57 3.67 0.00 1.12 1.34 0.78 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.90 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.30 4.34 0.00 3.33 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 57 Q 8.36 3.71 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 58 T 7.56 3.67 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 59 F 7.14 4.64 0.00 3.37 3.11 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 60 G 8.11 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 61 H 8.25 5.30 0.00 3.25 3.31 0.00 5.83 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 7.71 4.59 0.00 3.83 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 63 I 7.65 4.88 1.72 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.06 0.99 0.00 0.00 64 F 8.74 4.63 0.00 1.79 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 65 W 8.75 5.38 0.00 3.32 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 66 M 8.81 4.63 0.00 2.18 1.89 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 2.03 2.17 0.00 67 G 8.74 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 0.00 0.00 0.00 0.00 68 L 7.91 4.65 0.00 1.52 1.37 0.66 0.91 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 69 S 7.69 3.85 0.00 2.72 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 70 N 7.90 3.83 0.00 2.49 2.77 0.00 0.00 6.89 7.71 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 71 V 7.05 3.54 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 0.49 0.00 0.00 -0.15 0.00 0.00 72 W 7.55 4.90 0.00 3.63 3.26 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 73 N 8.28 4.37 0.00 2.87 2.81 0.00 0.00 7.01 7.30 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 74 Q 7.86 4.96 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.02 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 75 C 7.76 4.31 0.00 2.42 2.34 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 76 N 8.24 4.57 0.00 2.62 2.71 0.00 0.00 6.80 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 77 W 8.56 4.82 0.00 3.30 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.20 4.67 0.00 2.44 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.05 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 79 W 8.80 4.46 0.00 3.55 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 80 S 8.86 4.42 0.00 4.04 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 81 N 8.33 4.62 0.00 2.87 2.97 0.00 0.00 6.12 7.26 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 82 A 8.11 3.82 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 83 A 7.71 4.46 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 84 M 8.61 4.68 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 85 L 8.50 4.19 0.00 1.98 1.79 0.96 1.09 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 86 R 9.02 4.53 0.00 1.88 1.91 0.00 3.54 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 87 Y 7.87 4.39 0.00 2.95 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 88 K 6.88 4.23 0.00 1.56 1.52 0.00 2.31 0.00 0.00 1.98 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.48 7.81 89 A 7.25 4.42 1.14 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 0.00 0.00 90 W 7.80 4.27 0.00 3.25 3.25 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 91 A 8.83 4.26 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 92 E 8.07 4.74 0.00 2.05 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 0.00 1.84 2.18 0.00 93 E 8.92 4.02 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 2.18 2.18 0.00 94 S 7.29 5.10 0.00 3.67 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 95 Y 8.43 4.84 0.00 2.51 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 9.52 4.94 0.00 2.66 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.29 4.70 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.85 0.00 0.00 98 Y 8.69 5.29 0.00 3.18 3.16 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 99 F 9.05 5.62 0.00 3.23 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 0.00 100 K 8.78 5.33 0.00 2.05 2.08 0.00 1.62 0.00 0.00 2.00 0.00 0.00 2.99 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.51 1.54 7.81 101 S 9.16 4.34 0.00 4.47 4.51 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 0.00 102 T 8.22 4.24 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 1.34 0.00 0.00 103 N 7.64 4.97 0.00 2.80 2.71 0.00 0.00 6.05 8.04 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 0.00 104 N 8.47 4.63 0.00 2.64 2.67 0.00 0.00 6.90 7.61 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 0.00 105 K 7.96 4.62 0.00 1.97 1.83 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.43 7.81 106 W 9.05 4.61 0.00 3.21 3.25 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 0.00 107 R 8.80 4.94 0.00 0.67 1.62 0.00 2.85 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 108 S 8.69 5.40 0.00 4.07 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 0.00 109 R 10.03 5.07 0.00 1.80 1.79 0.00 3.05 0.00 0.00 2.38 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.51 0.00 110 A 8.48 3.52 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 0.00 111 C 8.97 4.23 0.00 2.80 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 0.00 112 R 7.89 4.17 0.00 1.76 1.95 0.00 3.16 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 113 M 8.15 4.57 0.00 1.97 2.19 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.42 0.00 114 M 8.11 5.08 0.00 1.85 1.81 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 115 A 7.40 4.00 0.28 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 0.00 116 Q 7.84 4.38 0.00 0.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.71 0.00 0.00 0.00 0.00 0.00 1.77 1.60 0.00 117 F 7.54 5.26 0.00 3.17 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 0.00 118 V 8.47 5.15 2.42 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 1.33 0.00 0.00 1.20 0.00 0.00 119 C 9.70 5.80 0.00 3.42 3.49 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 0.00 0.00 0.00 0.00 120 E 9.72 5.98 0.00 1.84 2.26 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 2.43 2.25 0.00 121 F 7.85 5.33 0.00 3.12 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 0.00 122 Q 8.70 4.35 0.00 2.02 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.06 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 123 A 8.14 4.11 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