NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2156 8.3449 119.6827 56.8851 30.3426 174.6567 2 D 4.0722 9.6787 122.9317 53.2738 36.7204 170.1077 3 N 4.7801 8.5011 120.0812 53.6895 39.9672 174.9122 4 S 4.2197 7.7534 109.3131 58.5563 62.7817 175.4795 5 R 3.8433 7.7465 121.2058 60.2569 30.0152 177.1526 6 Y 4.5878 8.1527 118.8932 61.1536 38.9289 177.1350 7 T 4.0170 7.2199 112.1276 62.5727 67.4446 175.7890 8 H 4.3961 8.1828 119.2517 59.1155 28.8806 177.2730 9 F 4.4004 8.2873 122.0776 61.2631 39.3492 176.7332 10 L 3.9165 7.7601 117.4837 56.4115 41.3156 179.3445 11 T 3.8559 7.3526 115.6546 66.8335 68.5225 176.3227 12 Q 4.0557 7.7803 118.0511 58.4010 29.0070 176.5692 13 H 4.1969 7.9012 115.6195 57.4308 30.7864 174.8195 14 Y 4.8290 7.3747 120.4051 57.5080 39.0155 174.4505 15 D 4.3692 9.1442 127.1097 52.0827 42.4701 174.4268 16 A 3.7390 7.8374 129.9068 54.8016 18.5524 177.4878 17 K 4.3652 7.2521 113.2373 54.7407 35.0230 173.5180 18 P 4.2458 0.0000 0.0000 61.7908 32.1531 176.5988 19 Q 3.9532 7.9908 117.7568 58.5207 28.7041 176.9470 20 G 4.0557 7.1784 102.7448 44.8017 0.0000 173.1317 21 R 4.3910 8.0098 117.9158 53.7437 29.1493 175.0703 22 D 4.7266 7.5216 120.9638 51.1815 44.0577 175.8009 23 D 4.5048 8.6370 118.9109 56.0976 39.5053 178.2066 24 R 4.0263 8.1025 120.3736 59.0025 30.0930 177.6784 25 Y 4.0691 7.9180 119.2619 60.6787 39.0805 177.8179 26 C 3.4896 8.0453 118.7309 58.7655 38.2476 175.3599 27 E 4.0665 8.0875 120.5574 59.2038 29.1531 179.0728 28 S 4.0120 7.7829 112.8712 61.3375 62.4610 175.9637 29 I 3.6066 7.2444 121.0160 63.6845 37.7012 177.6421 30 M 4.0668 7.5828 119.4109 57.7985 31.4568 178.6714 31 R 3.9001 7.8352 118.8623 59.5152 30.0851 178.7869 32 R 4.0288 7.5617 116.1235 59.0926 30.2774 178.8942 33 R 4.1128 7.9414 117.2734 56.9748 31.5072 176.3393 34 G 3.6901 7.5059 104.9309 46.1142 0.0000 172.9326 35 L 4.6789 8.3278 116.5699 55.1639 42.6518 178.4032 36 T 4.4059 7.9201 112.3197 62.4314 67.7151 174.2163 37 S 4.7541 7.7087 114.4197 56.3703 64.2888 171.5331 38 P 4.6531 0.0000 0.0000 62.1425 32.4788 176.8253 39 C 4.5945 8.4673 118.7357 57.1766 40.4245 174.0940 40 K 4.2927 8.5623 125.4002 56.3016 32.8238 176.5261 41 D 4.6146 8.7650 125.6272 57.1856 42.1018 176.3548 42 I 5.0134 7.4950 117.0987 59.7634 41.3202 173.7391 43 N 4.9189 9.1155 127.5121 52.5724 42.7280 172.8177 44 T 4.7370 8.5588 122.7441 62.2598 70.2289 174.0689 45 F 4.4683 8.8336 126.0962 56.6137 40.3668 175.3908 46 I 4.3744 8.3497 125.1269 61.0025 39.2359 174.8005 47 H 5.4243 9.5186 121.1827 52.9258 33.0005 173.6286 48 G 4.4869 7.8792 108.6221 46.1875 0.0000 172.4708 49 N 5.0359 8.2594 121.2664 52.0394 41.7940 175.5199 50 K 3.7209 8.5422 123.5620 58.8836 32.6678 179.4999 51 R 4.0324 7.9427 118.2877 59.0301 29.8173 178.6591 52 S 4.1735 7.9343 111.9704 61.2355 62.9376 175.6655 53 I 3.9188 7.7845 122.1325 64.4990 36.9858 178.3472 54 K 3.9862 8.1034 119.8431 59.2632 32.0612 177.8436 55 A 4.3852 7.9268 118.2454 52.9338 17.8477 179.0495 56 I 4.1092 7.6735 119.7747 63.5076 37.5015 177.2445 57 C 4.4574 7.8520 118.3581 57.8975 42.2726 173.6021 58 E 4.3388 7.5026 119.0346 56.3365 29.5613 177.1832 59 N 4.7356 8.4336 116.9123 53.2733 38.2451 176.2880 60 K 4.1221 8.0253 120.3001 58.8590 32.5232 176.6920 61 N 5.0537 7.3575 117.7626 52.7272 40.1187 173.8962 62 G 4.2095 7.6024 99.5251 45.6409 0.0000 173.3788 63 N 5.0480 8.5720 122.1698 51.3229 40.7174 172.8113 64 P 4.5809 0.0000 0.0000 63.1085 32.6110 175.3645 65 H 4.6877 8.9928 122.5349 55.1120 32.4768 175.8952 66 R 3.5214 8.8408 124.7680 57.4546 30.1775 179.2676 67 E 4.3500 8.9784 109.9045 54.5054 28.9243 174.9327 68 N 4.4119 8.2417 115.3117 52.7631 36.3109 174.6270 69 L 4.8082 7.3488 118.6595 54.0683 44.5350 176.0740 70 R 4.8996 8.5067 119.5090 54.7473 33.9919 173.9800 71 I 4.7476 8.2567 125.4283 59.5928 39.5678 175.3268 72 S 4.8555 8.7104 124.2640 58.3001 63.7860 174.0478 73 K 4.3588 8.7426 118.6734 56.4417 33.9838 176.6011 74 S 4.3873 7.8710 114.3406 55.3904 61.8953 172.4621 75 S 3.9444 8.1816 121.0401 58.9463 63.4151 174.2190 76 F 4.6624 8.2666 122.4975 55.4137 42.4758 174.4204 77 Q 4.8389 8.6944 122.0436 56.1061 30.4964 175.2749 78 V 4.5740 8.7423 119.3329 60.2469 35.7708 174.8005 79 T 4.3512 8.6482 124.3816 62.6521 69.8158 174.9626 80 T 4.3622 8.5077 125.5180 62.5936 69.5500 173.5323 81 C 5.1137 8.8315 125.6485 55.6775 41.5082 172.9900 82 K 5.1759 8.7539 125.7460 54.3371 34.7025 174.7567 83 L 4.4688 8.5569 129.0272 54.5266 42.5409 176.7215 84 H 4.5603 8.4574 124.5656 55.2075 27.8665 173.8653 85 G 3.5888 8.2436 108.6042 45.1299 0.0000 173.4766 86 G 3.8529 7.8408 112.2789 44.9349 0.0000 174.1118 87 S 4.4902 7.6750 114.1551 56.8777 63.4358 172.1008 88 P 4.2273 0.0000 0.0000 64.3002 32.2603 176.3110 89 W 5.1674 7.3731 118.7908 54.2894 30.9911 174.5063 90 P 4.6393 0.0000 0.0000 62.3384 31.5042 174.6219 91 P 4.7034 0.0000 0.0000 62.2160 32.8525 175.6488 92 C 4.7800 8.3405 115.3972 55.2492 44.5341 173.6385 93 Q 4.3922 8.4028 123.1213 54.8935 30.0045 174.0752 94 Y 4.9637 8.4793 122.3358 56.2283 40.1010 175.1407 95 R 4.5659 8.8590 125.4357 54.8497 31.7737 174.9736 96 A 4.5979 8.7374 128.8604 52.0413 19.8828 176.8941 97 T 4.5195 8.8114 119.6032 61.5900 70.2288 172.7764 98 A 4.5971 8.5432 128.0446 51.5552 20.0377 176.4316 99 G 4.2290 8.7558 107.6551 45.4240 0.0000 171.1411 100 F 5.0651 8.6433 122.3649 57.5777 41.7501 173.5524 101 R 4.6376 8.3440 122.2301 55.1435 33.2496 173.5573 102 N 4.9247 8.7439 117.0271 52.9986 38.3779 175.0638 103 V 4.4157 8.6197 114.6578 60.3740 34.6893 175.4566 104 V 4.7097 8.0412 123.7281 61.4664 32.2873 173.6254 105 V 4.3480 8.3316 119.7086 59.8708 33.5601 174.7826 106 A 4.6604 8.2001 127.4810 50.9697 20.3076 174.9867 107 C 5.2101 8.5511 123.4169 54.7219 40.0500 172.6470 108 E 4.6785 8.3921 126.3812 54.8776 32.4821 175.5089 109 N 4.1091 9.7159 121.7712 53.7268 35.9059 174.6241 110 G 3.8626 8.7497 104.2331 45.9161 0.0000 173.4652 111 L 4.2462 7.5980 118.6358 51.4727 44.9766 174.2168 112 P 4.3935 0.0000 0.0000 62.9705 30.8921 176.2883 113 V 4.1698 7.9738 117.1376 62.4208 32.6854 175.0803 114 H 4.2895 6.9198 119.0705 55.4181 33.7114 171.2715 115 L 4.4435 6.7791 118.4089 54.0014 44.6522 173.9189 116 D 4.5055 8.4220 126.6593 53.5904 41.6759 176.9607 117 Q 4.6235 8.3753 122.6499 55.9476 29.4448 176.6284 118 S 4.4436 7.7498 113.7421 59.7555 63.5744 174.8966 119 I 3.8239 7.3293 112.9053 62.8642 37.7749 176.4415 120 F 5.1973 7.3905 119.1088 57.0578 39.3791 176.5844 121 R 4.1868 8.1223 121.7739 57.6667 30.8093 175.6181 122 R 4.4680 7.6692 117.8353 53.6517 31.4209 172.6724 123 P 4.5474 0.0000 0.0000 62.9361 31.5833 176.3203 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 Q 8.34 4.22 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 2 D 9.68 4.07 0.00 2.91 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 3 N 8.50 4.78 0.00 2.85 3.21 0.00 0.00 6.68 7.70 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 4 S 7.75 4.22 0.00 3.91 3.80 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 5 R 7.75 3.84 0.00 1.94 1.95 0.00 3.26 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 6 Y 8.15 4.59 0.00 2.92 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 7 T 7.22 4.02 3.75 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 1.19 0.00 0.00 8 H 8.18 4.40 0.00 3.51 3.34 0.00 5.70 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 8.29 4.40 0.00 3.17 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 10 L 7.76 3.92 0.00 1.50 1.58 0.36 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.35 3.86 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 1.22 0.00 0.00 12 Q 7.78 4.06 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 13 H 7.90 4.20 0.00 2.58 3.08 0.00 5.61 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.37 4.83 0.00 2.62 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 15 D 9.14 4.37 0.00 2.73 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 16 A 7.84 3.74 1.05 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 17 K 7.25 4.37 0.00 1.65 1.56 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.20 1.36 7.81 18 P 0.00 4.25 0.00 1.43 0.49 0.00 3.30 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.34 0.00 19 Q 7.99 3.95 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 20 G 7.18 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 21 R 8.01 4.39 0.00 1.74 1.90 0.00 3.03 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 22 D 7.52 4.73 0.00 2.86 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 23 D 8.64 4.50 0.00 3.11 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.10 4.03 0.00 1.89 2.11 0.00 3.10 0.00 0.00 3.10 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 25 Y 7.92 4.07 0.00 3.03 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 26 C 8.05 3.49 0.00 2.99 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 27 E 8.09 4.07 0.00 2.10 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 2.63 2.68 0.00 28 S 7.78 4.01 0.00 3.95 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 I 7.24 3.61 1.21 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.93 -0.56 0.00 0.00 30 M 7.58 4.07 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 2.42 0.00 31 R 7.84 3.90 0.00 2.17 2.06 0.00 3.16 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 32 R 7.56 4.03 0.00 1.87 1.93 0.00 3.24 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 33 R 7.94 4.11 0.00 2.00 2.04 0.00 3.23 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00 34 G 7.51 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.33 4.68 0.00 1.72 1.63 0.73 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.92 4.41 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 1.27 0.00 0.00 37 S 7.71 4.75 0.00 3.95 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 38 P 0.00 4.65 0.00 1.80 1.49 0.00 3.86 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.90 0.00 39 C 8.47 4.59 0.00 2.79 3.05 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 40 K 8.56 4.29 0.00 1.73 1.74 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.56 7.81 41 D 8.77 4.61 0.00 2.65 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 42 I 7.49 5.01 1.91 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 1.37 0.86 0.96 0.00 0.00 43 N 9.12 4.92 0.00 2.70 2.24 0.00 0.00 5.52 6.26 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 44 T 8.56 4.74 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 0.62 0.00 0.00 45 F 8.83 4.47 0.00 3.21 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 46 I 8.35 4.37 1.81 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.67 0.60 0.00 0.00 47 H 9.52 5.42 0.00 3.18 3.33 0.00 5.77 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 48 G 7.88 4.49 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 0.00 0.00 0.00 49 N 8.26 5.04 0.00 2.88 2.80 0.00 0.00 6.55 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 50 K 8.54 3.72 0.00 1.88 1.82 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.68 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.55 7.81 51 R 7.94 4.03 0.00 1.94 1.99 0.00 3.21 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 52 S 7.93 4.17 0.00 3.85 4.21 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 53 I 7.78 3.92 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 0.78 1.05 0.97 0.00 0.00 54 K 8.10 3.99 0.00 1.96 1.84 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.28 7.81 55 A 7.93 4.39 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.67 4.11 2.00 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 1.60 2.04 0.97 0.00 0.00 57 C 7.85 4.46 0.00 2.90 3.04 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 58 E 7.50 4.34 0.00 2.39 1.85 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 2.32 2.24 0.00 59 N 8.43 4.74 0.00 2.80 2.93 0.00 0.00 6.35 7.13 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 60 K 8.03 4.12 0.00 1.74 1.87 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.42 7.81 61 N 7.36 5.05 0.00 3.03 2.90 0.00 0.00 7.00 8.12 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 62 G 7.60 4.21 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 0.00 63 N 8.57 5.05 0.00 2.67 2.74 0.00 0.00 6.55 7.59 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 64 P 0.00 4.58 0.00 2.07 2.04 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 65 H 8.99 4.69 0.00 3.20 3.32 0.00 5.93 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 8.84 3.52 0.00 1.94 1.29 0.00 2.97 0.00 0.00 3.13 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.23 0.00 67 E 8.98 4.35 0.00 1.91 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 0.00 2.18 2.21 0.00 68 N 8.24 4.41 0.00 3.14 3.16 0.00 0.00 6.12 6.62 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 69 L 7.35 4.81 0.00 1.86 1.64 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.51 4.90 0.00 1.83 1.90 0.00 3.25 0.00 0.00 3.18 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 71 I 8.26 4.75 1.76 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 1.26 1.35 0.94 0.00 0.00 72 S 8.71 4.86 0.00 4.10 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 73 K 8.74 4.36 0.00 1.63 1.86 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.40 7.81 74 S 7.87 4.39 0.00 3.80 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.18 3.94 0.00 3.68 3.29 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 76 F 8.27 4.66 0.00 2.91 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 77 Q 8.69 4.84 0.00 2.51 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.92 0.00 0.00 0.00 0.00 0.00 2.69 2.65 0.00 78 V 8.74 4.57 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.95 0.00 0.00 79 T 8.65 4.35 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 80 T 8.51 4.36 4.34 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 1.24 0.00 0.00 81 C 8.83 5.11 0.00 2.88 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 82 K 8.75 5.18 0.00 1.92 1.75 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.22 1.49 7.81 83 L 8.56 4.47 0.00 1.87 1.59 0.51 0.75 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 84 H 8.46 4.56 0.00 3.02 3.19 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.24 3.59 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 0.00 0.00 0.00 86 G 7.84 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 0.00 0.00 0.00 87 S 7.68 4.49 0.00 3.86 3.83 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 88 P 0.00 4.23 0.00 1.11 1.62 0.00 3.56 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 1.90 1.94 0.00 89 W 7.37 5.17 0.00 3.21 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 90 P 0.00 4.64 0.00 2.14 2.27 0.00 4.17 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 91 P 0.00 4.70 0.00 2.19 2.10 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 92 C 8.34 4.78 0.00 2.72 2.35 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.40 4.39 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 94 Y 8.48 4.96 0.00 2.93 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 95 R 8.86 4.57 0.00 2.01 1.93 0.00 3.17 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 96 A 8.74 4.60 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 8.81 4.52 4.41 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 0.00 0.00 1.26 0.00 0.00 98 A 8.54 4.60 1.27 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 0.00 0.00 99 G 8.76 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.64 5.07 0.00 2.97 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 0.00 101 R 8.34 4.64 0.00 1.99 2.08 0.00 2.96 0.00 0.00 3.54 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 102 N 8.74 4.92 0.00 2.89 2.87 0.00 0.00 5.92 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 0.00 103 V 8.62 4.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.94 0.00 0.00 104 V 8.04 4.71 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 0.94 0.00 0.00 0.78 0.00 0.00 105 V 8.33 4.35 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.94 0.00 0.00 106 A 8.20 4.66 1.22 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 0.00 0.00 0.00 107 C 8.55 5.21 0.00 2.94 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 0.00 108 E 8.39 4.68 0.00 2.07 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 109 N 9.72 4.11 0.00 2.98 2.95 0.00 0.00 6.27 6.97 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 0.00 110 G 8.75 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 0.00 111 L 7.60 4.25 0.00 1.86 1.28 0.61 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.39 0.00 2.25 2.09 0.00 3.23 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 113 V 7.97 4.17 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 0.82 0.00 0.00 0.91 0.00 0.00 114 H 6.92 4.29 0.00 3.04 2.91 0.00 5.90 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 0.00 115 L 6.78 4.44 0.00 1.29 1.25 1.07 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.42 4.51 0.00 2.46 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 8.38 4.62 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 7.12 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 118 S 7.75 4.44 0.00 3.76 3.76 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 0.00 119 I 7.33 3.82 1.42 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.74 0.00 0.00 120 F 7.39 5.20 0.00 3.06 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 0.00 121 R 8.12 4.19 0.00 2.01 1.96 0.00 3.18 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 122 R 7.67 4.47 0.00 1.76 1.82 0.00 3.37 0.00 0.00 3.33 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 123 P 0.00 4.55 0.00 2.28 2.09 0.00 3.92 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00