NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.5920 8.1849 122.7616 55.1938 43.3529 175.6096 2 Q 4.6108 9.2573 124.1527 53.9668 33.7038 172.3725 3 R 5.3032 8.7553 118.9508 54.9491 33.7830 174.8339 4 T 4.7495 8.8275 115.7251 60.4416 71.9245 171.8010 5 L 5.1808 8.4634 126.8630 53.4218 44.3468 175.1275 6 V 5.0430 9.0574 126.1656 61.1185 34.6477 173.8624 7 L 5.0127 8.9018 127.4955 53.0558 44.5118 175.3310 8 I 4.7022 8.7025 125.2478 60.1651 38.7871 175.9470 9 K 4.6943 9.0338 127.3471 54.7361 33.8203 176.4188 10 P 4.6452 0.0000 0.0000 65.1181 30.5323 178.7212 11 D 4.5845 8.4247 117.5428 56.2550 39.4568 178.3254 12 A 4.0574 8.1997 122.5025 54.9519 18.2487 179.6707 13 F 3.9872 8.2409 115.9856 60.6721 38.9270 177.4025 14 E 4.0924 8.3587 117.9075 58.7036 29.5319 178.0624 15 R 4.3824 7.9323 115.0323 54.8185 31.0500 176.1241 16 S 3.7269 7.7361 113.4988 60.3150 60.8894 172.5760 17 L 4.6262 8.2142 116.7997 54.5520 42.7216 179.2110 18 V 3.3509 7.7073 119.9974 66.1607 31.3122 177.9017 19 A 3.9922 7.8292 119.9149 54.9575 18.1368 178.9056 20 E 3.8685 8.1202 117.4188 59.4728 29.1753 179.0944 21 I 3.6972 7.8172 119.6054 64.8252 37.2218 178.3406 22 M 4.3000 8.2192 119.6105 58.4201 31.6507 179.1443 23 G 3.6503 8.5555 106.3620 47.8127 0.0000 176.0369 24 R 3.9375 7.5944 119.6361 59.0643 30.1779 178.9526 25 I 3.8294 7.4498 118.8181 64.1744 37.0898 177.9476 26 E 3.9960 8.5702 120.6438 59.3947 29.2517 179.0879 27 K 4.1114 8.2058 117.3580 58.4887 32.1530 178.2068 28 K 4.1965 7.4932 118.0448 55.9358 32.1812 175.9594 29 N 4.3025 7.8257 114.8418 54.8237 37.7563 173.6020 30 F 4.7790 7.8681 113.6815 55.9395 40.4593 175.1098 31 K 4.8676 8.7808 123.2731 54.5584 35.0013 175.6267 32 I 4.0386 8.5005 125.0328 61.5700 37.0314 175.7476 33 V 4.1886 8.6228 127.2375 64.0925 33.2763 175.9249 34 S 4.6525 7.3961 113.9025 57.5268 67.4386 173.0675 35 M 5.3725 8.3711 120.5532 54.7205 35.1695 173.8579 36 K 4.6584 9.5454 124.9228 54.5324 36.4167 174.6684 37 F 5.1058 8.6475 126.0420 56.3302 41.3438 174.5856 38 W 4.4453 8.2826 126.5508 54.5680 30.6473 176.7553 39 S 3.7210 8.5428 120.7298 60.7963 62.6512 174.5746 40 K 4.3494 7.5528 120.8503 54.7005 34.3198 174.8190 41 A 4.0639 8.4050 130.1249 51.0968 19.0704 175.1477 42 P 4.2704 0.0000 0.0000 62.5746 32.1511 177.6644 43 R 3.8243 8.6488 122.4440 59.4285 29.9865 178.4762 44 N 4.2607 8.0145 116.4941 55.8571 37.1516 177.0744 45 L 3.4948 7.3487 121.2596 57.4025 41.5519 179.5195 46 I 3.8090 7.4119 119.1554 64.5498 36.9030 178.2523 47 E 4.2241 8.2679 118.5794 59.3763 29.5441 179.1678 48 Q 4.1253 8.1353 118.2152 59.2476 28.5781 178.0973 49 H 4.0203 8.0970 117.9942 58.8886 29.9672 175.9566 50 Y 4.8600 7.9133 117.1491 57.8137 38.6422 177.7745 51 K 3.9420 8.0810 123.9333 60.2167 32.1495 178.0998 52 E 3.9824 8.3601 119.2655 58.5693 29.9951 176.6330 53 H 4.8671 8.6315 115.3867 55.4245 29.0417 176.6749 54 S 2.7900 7.5585 115.9077 60.1157 62.6243 174.9465 55 E 4.2545 7.6425 118.0721 56.3309 30.1539 176.1644 56 Q 4.1498 7.6182 119.2467 54.9991 29.4162 177.3574 57 S 4.1209 8.3710 115.0885 61.1836 63.4507 174.7072 58 Y 4.4776 7.2750 117.0932 57.0069 38.8172 176.5842 59 F 4.0739 7.8131 124.0566 62.0272 39.2971 176.6969 60 N 4.1479 8.1973 115.1469 56.4127 38.4587 177.0754 61 D 4.3334 8.0413 119.8046 57.2893 40.9659 178.2105 62 N 4.3235 8.6745 118.0284 56.8826 38.8222 176.7681 63 C 3.9779 7.8187 118.1023 62.7615 27.8932 175.8108 64 D 4.3025 7.9964 119.7761 57.2593 40.7083 178.2159 65 F 4.3928 8.2202 121.1021 61.7022 39.2240 176.9842 66 M 3.7212 7.8582 116.1840 56.8673 31.6878 177.9922 67 V 4.2330 6.8342 111.3731 60.8604 32.4006 176.3930 68 S 4.3247 7.7465 113.2533 58.9862 63.4814 173.6917 69 G 3.8837 6.8982 107.8674 44.6900 0.0000 170.9918 70 P 4.5834 0.0000 0.0000 61.7358 32.6525 175.7323 71 I 4.9162 8.0766 113.5946 59.4827 41.6032 173.8826 72 I 5.2241 8.5990 123.6664 59.6623 40.0504 174.5774 73 S 5.1060 9.1500 121.7378 56.7359 65.3951 173.1995 74 I 4.9916 8.9099 124.1026 59.4852 41.3999 174.2507 75 V 4.6043 8.2277 126.4837 61.7494 33.0223 174.1345 76 Y 5.2620 8.7713 125.7509 56.3850 40.8161 174.3843 77 E 5.2524 9.8878 123.2901 53.8881 33.3902 175.0992 78 G 4.5258 8.5027 113.2602 46.3222 0.0000 172.0341 79 T 4.1721 8.4835 117.0667 64.9028 68.7628 173.9605 80 D 4.5181 9.1055 124.8904 54.9920 40.0675 175.3013 81 A 3.6529 8.3253 120.7084 54.7679 18.2784 179.8214 82 I 3.5497 7.8197 117.7132 64.6000 37.1713 178.6190 83 S 4.0547 7.9227 113.2139 61.4093 62.3956 176.1808 84 K 3.9896 8.1825 121.2467 59.6120 31.7424 179.4884 85 I 3.5995 7.7340 120.2359 63.9809 36.9513 178.4964 86 R 3.8631 7.8729 119.1034 59.4900 29.6860 179.2928 87 R 3.9309 8.0036 116.7974 59.0785 30.3492 178.5153 88 L 4.0671 8.0035 120.2229 58.0001 41.9621 178.7690 89 Q 3.8806 8.3794 119.8460 59.9441 29.2905 176.3214 90 G 3.8577 8.3681 108.6782 46.0587 0.0000 171.5777 91 N 5.0222 8.1115 118.1392 51.1483 40.4043 175.3105 92 I 4.1406 8.2148 110.9346 62.5022 37.7071 176.7238 93 L 4.1821 7.8454 120.4222 56.0117 42.1519 176.6730 94 T 4.4014 7.7308 115.9069 60.5977 68.4373 171.8870 95 P 4.5670 0.0000 0.0000 63.9753 31.9158 176.9890 96 G 3.9953 9.7870 110.6123 45.4053 0.0000 174.2982 97 T 4.5807 7.3981 109.6314 59.8065 72.3375 175.5592 98 I 3.6614 8.5208 122.3959 64.8644 37.1558 179.1954 99 R 4.0694 8.3298 119.1044 59.1331 29.6357 179.4386 100 G 4.1475 7.8916 106.2175 47.2053 0.0000 174.9479 101 D 4.6187 8.2845 120.1483 55.4157 41.3178 177.2715 102 L 4.6297 7.9810 115.9994 53.8686 43.8878 176.0480 103 A 4.9018 7.8709 120.4445 50.5991 21.5905 175.5578 104 N 4.9860 8.2593 116.7764 52.5687 39.3694 173.6894 105 D 4.7547 7.8241 113.8072 52.0935 44.4781 174.7744 106 I 3.9408 8.1768 116.4340 62.1329 38.5313 176.4534 107 R 4.1040 7.9638 119.6429 57.9310 30.9970 176.7811 108 E 3.8959 8.0535 120.2775 54.8847 27.8405 175.7156 109 N 4.9746 7.8702 120.8177 52.1733 38.6239 177.0545 110 L 4.2805 9.4480 124.4998 56.3797 41.3401 174.4636 111 I 5.1385 8.0701 116.1462 59.7730 41.3979 173.6587 112 H 5.2674 9.5421 128.2923 54.3558 32.5677 172.4411 113 A 5.1153 8.2954 125.9111 49.7076 21.9149 175.9917 114 S 4.3806 8.5142 117.7052 59.4959 63.2179 174.6208 115 D 4.7194 8.8134 121.7295 53.7032 40.3802 176.2947 116 S 4.6086 7.9224 114.6408 56.2026 67.3554 175.0062 117 E 3.9525 8.6906 121.5003 59.7758 29.2129 179.4221 118 D 4.3672 8.0580 118.4819 57.4732 41.0249 178.9265 119 S 4.1632 8.2707 114.5267 61.1329 62.8928 176.3583 120 A 3.9914 8.3279 124.7269 55.0380 18.3056 179.6904 121 V 3.5542 7.7722 116.7591 66.1253 31.5772 177.7241 122 D 4.3079 8.2252 117.6092 57.5621 41.1588 178.0906 123 E 4.1132 8.7787 119.4214 59.5161 29.4087 179.3351 124 I 4.0605 8.3008 120.2428 64.8012 36.8209 178.7043 125 S 4.2944 8.1150 115.5335 61.3420 62.3502 176.9252 126 I 3.5708 7.4961 122.0742 64.0721 36.9621 177.9720 127 W 4.3998 8.0407 117.6360 57.4271 30.5850 176.8387 128 F 5.0113 8.4726 116.3867 55.0226 38.8171 172.7083 129 P 4.5823 0.0000 0.0000 64.7858 32.0504 176.9636 130 E 4.1830 8.3906 120.8617 56.8924 29.3526 176.7160 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 L 8.18 4.59 0.00 1.68 1.67 0.96 0.38 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 2 Q 9.26 4.61 0.00 2.11 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.59 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 3 R 8.76 5.30 0.00 1.66 1.80 0.00 3.15 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 4 T 8.83 4.75 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 1.18 0.00 0.00 5 L 8.46 5.18 0.00 2.00 1.65 1.21 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 6 V 9.06 5.04 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 1.13 0.00 0.00 1.10 0.00 0.00 7 L 8.90 5.01 0.00 1.54 1.33 0.39 -0.22 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 8 I 8.70 4.70 1.98 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.07 0.82 0.00 0.00 9 K 9.03 4.69 0.00 2.03 1.75 0.00 1.96 0.00 0.00 1.96 0.00 0.00 3.03 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.48 1.61 7.81 10 P 0.00 4.65 0.00 1.89 2.03 0.00 3.17 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.97 0.00 11 D 8.42 4.58 0.00 2.99 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 12 A 8.20 4.06 1.33 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 13 F 8.24 3.99 0.00 3.37 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 14 E 8.36 4.09 0.00 2.22 2.19 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 2.39 2.57 0.00 15 R 7.93 4.38 0.00 1.93 1.95 0.00 3.40 0.00 0.00 3.26 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 16 S 7.74 3.73 0.00 4.00 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 0.00 17 L 8.21 4.63 0.00 1.58 1.60 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.71 3.35 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 0.84 0.00 0.00 0.04 0.00 0.00 19 A 7.83 3.99 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 20 E 8.12 3.87 0.00 2.07 2.11 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 2.37 2.46 0.00 21 I 7.82 3.70 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.96 0.92 0.00 0.00 22 M 8.22 4.30 0.00 2.17 2.16 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 2.80 2.69 0.00 23 G 8.56 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 24 R 7.59 3.94 0.00 1.88 1.99 0.00 3.16 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 25 I 7.45 3.83 1.72 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.69 -0.09 0.00 0.00 26 E 8.57 4.00 0.00 2.18 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 0.00 2.33 2.41 0.00 27 K 8.21 4.11 0.00 1.75 1.85 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.62 1.58 7.81 28 K 7.49 4.20 0.00 1.75 2.11 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.85 1.40 7.81 29 N 7.83 4.30 0.00 2.76 2.64 0.00 0.00 7.09 6.59 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 30 F 7.87 4.78 0.00 3.06 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 31 K 8.78 4.87 0.00 1.74 1.74 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.56 7.81 32 I 8.50 4.04 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.56 0.80 0.00 0.00 33 V 8.62 4.19 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 0.67 0.00 0.00 0.93 0.00 0.00 34 S 7.40 4.65 0.00 2.76 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 35 M 8.37 5.37 0.00 2.01 1.85 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.65 0.00 36 K 9.55 4.66 0.00 1.65 0.96 0.00 1.46 0.00 0.00 1.14 0.00 0.00 2.73 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.22 1.49 7.81 37 F 8.65 5.11 0.00 3.01 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 38 W 8.28 4.45 0.00 2.96 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 39 S 8.54 3.72 0.00 4.00 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 0.00 40 K 7.55 4.35 0.00 1.63 1.67 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.37 7.81 41 A 8.40 4.06 1.04 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 0.00 0.00 42 P 0.00 4.27 0.00 2.12 1.95 0.00 3.06 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 2.11 2.17 0.00 43 R 8.65 3.82 0.00 1.82 1.88 0.00 3.14 0.00 0.00 3.36 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 44 N 8.01 4.26 0.00 2.88 3.00 0.00 0.00 6.28 6.67 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 45 L 7.35 3.49 0.00 1.30 0.52 0.55 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.41 3.81 1.99 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.79 1.00 0.00 0.00 47 E 8.27 4.22 0.00 1.98 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 2.33 2.47 0.00 48 Q 8.14 4.13 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 49 H 8.10 4.02 0.00 3.21 3.44 0.00 5.93 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 50 Y 7.91 4.86 0.00 3.44 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 51 K 8.08 3.94 0.00 1.99 2.22 0.00 1.30 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.46 7.81 52 E 8.36 3.98 0.00 1.97 1.98 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 2.29 2.36 0.00 53 H 8.63 4.87 0.00 3.63 3.39 0.00 5.68 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 7.56 2.79 0.00 3.33 3.50 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 55 E 7.64 4.25 0.00 1.87 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 2.15 2.16 0.00 56 Q 7.62 4.15 0.00 1.21 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 57 S 8.37 4.12 0.00 4.00 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 58 Y 7.28 4.48 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 59 F 7.81 4.07 0.00 3.09 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 60 N 8.20 4.15 0.00 2.80 2.84 0.00 0.00 7.01 8.08 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 61 D 8.04 4.33 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.67 4.32 0.00 2.76 2.81 0.00 0.00 7.22 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 63 C 7.82 3.98 0.00 2.85 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 64 D 8.00 4.30 0.00 2.81 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.22 4.39 0.00 2.99 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 66 M 7.86 3.72 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.79 0.00 67 V 6.83 4.23 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 0.76 0.00 0.00 0.97 0.00 0.00 68 S 7.75 4.32 0.00 4.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 6.90 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 0.00 0.00 0.00 70 P 0.00 4.58 0.00 0.49 1.23 0.00 3.50 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 71 I 8.08 4.92 1.81 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.22 0.74 0.00 0.00 72 I 8.60 5.22 2.07 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.49 1.10 0.00 0.00 73 S 9.15 5.11 0.00 3.67 3.23 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 74 I 8.91 4.99 1.64 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 1.06 0.66 -0.04 0.00 0.00 75 V 8.23 4.60 1.70 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 0.96 0.00 0.00 0.38 0.00 0.00 76 Y 8.77 5.26 0.00 2.95 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 9.89 5.25 0.00 2.02 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 2.26 2.42 0.00 78 G 8.50 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.48 4.17 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 1.24 0.00 0.00 80 D 9.11 4.52 0.00 2.91 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 81 A 8.33 3.65 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 82 I 7.82 3.55 1.95 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 1.40 0.56 0.94 0.00 0.00 83 S 7.92 4.05 0.00 3.89 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 84 K 8.18 3.99 0.00 1.96 2.05 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.77 1.85 7.81 85 I 7.73 3.60 1.68 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 -0.36 0.70 0.00 0.00 86 R 7.87 3.86 0.00 2.10 1.96 0.00 3.28 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.83 0.00 87 R 8.00 3.93 0.00 1.94 1.99 0.00 3.18 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 88 L 8.00 4.07 0.00 1.93 1.71 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 8.38 3.88 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.60 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 90 G 8.37 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 91 N 8.11 5.02 0.00 2.90 2.88 0.00 0.00 5.74 7.85 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 92 I 8.21 4.14 1.85 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 1.39 0.58 0.94 0.00 0.00 93 L 7.85 4.18 0.00 1.88 1.76 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.73 4.40 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 95 P 0.00 4.57 0.00 2.03 1.99 0.00 3.63 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 96 G 9.79 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 97 T 7.40 4.58 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 1.27 0.00 0.00 98 I 8.52 3.66 1.86 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 1.51 0.62 0.91 0.00 0.00 99 R 8.33 4.07 0.00 1.95 1.97 0.00 3.32 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.73 0.00 100 G 7.89 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 0.00 0.00 0.00 0.00 101 D 8.28 4.62 0.00 2.71 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 0.00 102 L 7.98 4.63 0.00 1.71 1.66 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.87 4.90 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 0.00 104 N 8.26 4.99 0.00 2.60 2.70 0.00 0.00 6.71 8.47 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 0.00 105 D 7.82 4.75 0.00 2.53 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.18 3.94 1.77 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.85 0.85 0.00 0.00 107 R 7.96 4.10 0.00 1.53 1.78 0.00 2.95 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.39 0.00 108 E 8.05 3.90 0.00 1.76 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 1.47 1.64 0.00 109 N 7.87 4.97 0.00 2.89 3.11 0.00 0.00 6.20 6.67 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 0.00 110 L 9.45 4.28 0.00 1.97 1.92 0.98 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.07 5.14 1.90 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 1.13 0.90 0.98 0.00 0.00 112 H 9.54 5.27 0.00 3.38 3.14 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 0.00 113 A 8.30 5.12 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 0.00 114 S 8.51 4.38 0.00 3.80 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 0.00 115 D 8.81 4.72 0.00 2.79 2.79 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 0.00 116 S 7.92 4.61 0.00 4.06 3.98 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 0.00 117 E 8.69 3.95 0.00 2.04 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 0.00 2.41 2.42 0.00 118 D 8.06 4.37 0.00 2.69 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 0.00 119 S 8.27 4.16 0.00 4.08 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 0.00 120 A 8.33 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 0.00 121 V 7.77 3.55 2.25 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 1.01 0.00 0.00 1.01 0.00 0.00 122 D 8.23 4.31 0.00 2.94 2.79 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 0.00 123 E 8.78 4.11 0.00 2.20 2.25 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 2.27 2.46 0.00 124 I 8.30 4.06 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.99 1.02 0.00 0.00 125 S 8.11 4.29 0.00 4.11 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 0.00 126 I 7.50 3.57 1.77 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.57 0.05 0.00 0.00 127 W 8.04 4.40 0.00 3.39 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 0.00 128 F 8.47 5.01 0.00 3.21 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 0.00 129 P 0.00 4.58 0.00 2.07 2.14 0.00 3.82 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.28 0.00 130 E 8.39 4.18 0.00 2.06 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 0.00 2.37 2.38 0.00