NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4833 8.3044 120.3254 54.3118 33.5598 172.9515 2 R 4.2588 7.8647 117.8571 54.8555 33.5548 169.1198 3 V 3.6027 9.3135 117.0428 65.7230 32.6864 176.5515 4 K 4.3787 7.9389 119.3936 55.2948 32.8603 175.7921 5 M 4.8419 8.3943 122.2540 53.9501 36.0093 175.1915 6 H 5.1048 8.0642 116.7217 56.0491 29.2721 174.8185 7 V 3.5726 8.0377 117.8563 62.3356 33.0018 175.8555 8 K 4.6378 8.0225 124.1506 55.7212 30.9596 177.9980 9 K 3.8037 9.5738 125.0201 61.7025 32.1270 177.3719 10 G 3.6689 7.6441 103.3072 46.4753 0.0000 172.7604 11 D 4.7631 8.0159 119.1393 54.9090 45.3188 174.5903 12 T 4.9565 7.8469 120.1439 63.3959 73.7137 172.5307 13 V 4.5259 8.4318 122.8516 61.0890 35.3267 175.2530 14 L 4.8601 8.1283 121.2934 51.9740 43.0864 176.9757 15 V 4.3623 8.5945 135.0000 61.5364 33.1595 178.3743 16 A 4.2915 8.8858 124.9445 52.7291 17.8775 176.7579 17 S 4.4107 8.4903 121.8207 58.5891 64.9817 175.8873 18 G 4.1714 8.0043 103.3477 44.3230 0.0000 172.1286 19 K 3.9280 6.8035 121.6423 56.8616 39.9389 177.2936 20 Y 4.6535 7.5919 119.3525 58.8467 37.3642 171.4755 21 K 4.2868 7.8809 119.3639 55.9074 31.2090 176.5574 22 G 4.5096 7.7031 106.7293 46.2481 0.0000 172.9319 23 R 4.4497 7.7309 113.3072 56.0044 33.5283 173.1774 24 V 4.0890 8.2985 112.6761 61.8113 32.1182 175.8778 25 G 3.7177 8.0093 112.8639 44.5588 0.0000 172.5442 26 K 3.8422 9.4819 126.7544 59.9812 31.7829 176.9437 27 V 4.7706 7.5117 115.9185 60.3935 35.9606 173.4225 28 K 5.1572 8.3336 119.0923 55.1385 35.2541 176.0128 29 E 3.9633 8.9400 124.0303 60.7318 29.6645 177.1720 30 V 3.9228 7.8824 119.1056 63.3417 28.7795 169.9984 31 L 4.4915 7.7228 118.0337 56.1259 43.5309 175.8468 32 P 4.5725 0.0000 0.0000 61.7042 29.8480 177.5069 33 K 4.4448 8.3461 125.6478 58.0312 33.1528 177.1133 34 K 3.9398 7.6938 117.4847 51.2628 31.1728 174.4830 35 Y 5.8031 7.9171 120.5079 55.6450 42.1426 173.4332 36 A 5.2127 8.6663 122.3755 50.3614 21.2831 177.3961 37 V 3.7847 8.9127 121.5769 61.6424 32.7800 175.8549 38 I 3.6604 7.9055 120.7041 62.6392 34.2193 173.9810 39 V 4.2746 7.3060 113.4580 61.6188 34.1575 173.8558 40 E 5.2673 8.0697 118.0355 56.7320 33.9718 174.9386 41 G 4.8622 8.0549 117.4293 44.0451 0.0000 174.6270 42 V 4.1374 8.1955 120.3223 61.0510 35.7982 173.2044 43 N 5.0652 8.2855 116.7108 52.7939 41.4296 176.2742 44 I 3.1530 8.0232 115.6327 60.8379 34.8470 173.6757 45 V 4.0139 8.1470 109.6481 61.5244 29.8523 174.6537 46 K 3.9193 8.6951 115.6028 57.1142 31.7516 177.2401 47 K 4.4604 7.8294 124.9688 58.6166 32.4197 177.1446 48 A 3.8219 7.9492 118.3708 52.1989 17.1335 178.1339 49 V 4.1544 7.3658 111.1576 61.5483 32.9807 176.9254 50 R 4.5998 8.3292 119.8226 56.7330 29.8939 177.5963 51 V 3.6241 7.8414 117.4221 65.8293 31.7732 175.7183 52 S 4.6667 7.7590 113.8532 55.0887 64.2887 170.5477 53 P 4.3962 0.0000 0.0000 64.0410 30.8620 176.8700 54 K 4.4708 8.1597 123.8919 59.0192 33.0956 175.0140 55 Y 4.3901 7.9421 117.9281 56.0140 37.8046 172.1754 56 P 4.8576 0.0000 0.0000 63.4504 33.6708 172.4204 57 Q 4.5737 8.2172 114.9711 56.3916 32.5207 172.7199 58 G 4.8275 7.6641 107.0170 43.7370 0.0000 173.0394 59 G 3.8075 8.2450 108.0399 45.9404 0.0000 173.9048 60 F 4.3853 8.7847 127.4788 57.7487 40.1596 174.3088 61 I 4.6038 8.1985 129.4391 60.0456 39.2845 175.1304 62 E 4.8548 8.2382 119.4853 55.8164 31.7144 174.0609 63 K 4.2962 8.0740 118.8600 54.5835 33.2343 175.7144 64 E 4.2513 8.7346 127.3433 56.1092 30.2562 176.0248 65 A 4.2109 9.8688 135.0000 52.8665 18.3163 177.9682 66 P 3.9146 0.0000 0.0000 59.8581 33.7747 175.8618 67 L 4.8097 8.2233 122.7915 54.2582 41.3341 175.6413 68 H 5.1501 7.7476 111.6621 55.5627 31.2969 174.4701 69 A 4.5742 8.0059 120.7636 51.0298 19.4833 179.5206 70 S 4.3926 9.7006 121.2507 58.4500 59.4681 172.5619 71 K 4.5186 7.6778 122.4584 53.7296 34.9045 175.8139 72 V 3.1088 8.3812 118.6807 64.4238 31.2793 174.0709 73 R 5.0818 8.2712 122.7505 52.6516 30.5526 174.5896 74 P 4.6170 0.0000 0.0000 62.5092 31.6605 178.9904 75 I 4.0938 8.2358 118.3677 61.0316 37.3884 177.5752 76 C 4.5502 9.2124 119.6619 54.4454 44.3885 171.1025 77 P 4.0236 0.0000 0.0000 65.3131 30.8832 175.8942 78 A 4.6159 8.2567 129.3578 51.0268 17.5630 176.6165 79 C 4.7491 8.2787 114.9758 57.0743 33.4215 174.7448 80 G 4.1559 8.2978 107.0690 45.3667 0.0000 172.5718 81 K 4.7802 8.3888 119.8691 53.8651 36.2693 175.1358 82 P 4.9840 0.0000 0.0000 62.5187 32.2114 173.9947 83 T 4.3397 7.8917 118.7050 62.8874 75.5794 175.9563 84 R 4.7856 8.4117 124.1114 56.6877 31.3056 174.1255 85 V 4.2392 7.9293 116.2974 61.8382 32.0210 175.2673 86 R 4.1063 8.3814 119.9696 55.3106 29.5622 178.6980 87 K 4.0907 8.1641 119.7054 57.1267 32.6229 175.2906 88 K 4.7083 8.9759 117.2794 53.6703 35.3564 175.2113 89 F 3.9997 9.2328 120.9351 59.2075 38.9097 175.6010 90 L 3.4580 8.1485 122.0431 55.4575 37.9127 173.0359 91 E 4.5830 7.6564 121.3766 53.8755 30.3310 176.1481 92 N 4.2823 8.8320 122.9338 52.4584 37.8373 176.3838 93 G 4.0160 9.2149 112.8392 46.7966 0.0000 175.1059 94 K 4.2438 8.3179 109.7693 57.3954 32.5060 176.7208 95 K 4.5492 8.7339 121.2305 51.3537 35.1145 175.2634 96 I 4.2010 8.5243 125.9103 60.5822 38.3641 175.2840 97 R 4.7098 8.3415 126.2717 54.8064 32.6062 176.1735 98 V 4.0830 8.9305 123.5455 62.7965 35.1480 172.1645 99 C 4.0195 9.1300 124.4291 56.0173 40.2195 176.5461 100 A 4.1912 8.6906 123.9337 52.2662 18.5611 176.7579 101 K 4.8940 7.6382 117.1201 55.8221 36.5037 175.6781 102 C 4.7893 8.3654 114.3266 59.7393 32.2817 175.1747 103 G 4.0232 9.0303 109.7277 44.7122 0.0000 173.4757 104 G 3.7394 8.9289 107.4459 45.9646 0.0000 174.1259 105 A 3.7004 7.1068 121.1690 50.9487 16.6678 178.1242 106 L 3.8803 8.4295 122.8474 57.8979 41.4716 177.5407 107 D 4.7156 8.0413 118.6208 53.0310 42.5924 176.2863 108 T 3.8881 8.4058 111.6024 65.4296 67.4878 172.8203 109 E 4.5505 9.7817 115.9124 57.6037 34.1728 175.9740 110 E 4.0825 8.5355 123.3690 56.1968 30.5715 175.3170 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 M 8.30 4.48 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.63 0.00 2 R 7.86 4.26 0.00 1.76 1.76 0.00 3.29 0.00 0.00 3.13 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.77 0.00 3 V 9.31 3.60 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 0.85 0.00 0.00 0.93 0.00 0.00 4 K 7.94 4.38 0.00 1.93 1.70 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.44 7.81 5 M 8.39 4.84 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 6 H 8.06 5.10 0.00 3.10 3.01 0.00 5.74 0.00 0.00 0.00 0.00 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.04 3.57 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 0.68 0.00 0.00 0.87 0.00 0.00 8 K 8.02 4.64 0.00 1.75 1.35 0.00 2.02 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.39 1.40 7.81 9 K 9.57 3.80 0.00 2.28 1.92 0.00 2.07 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 10 G 7.64 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.02 4.76 0.00 2.66 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 12 T 7.85 4.96 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 1.24 0.00 0.00 13 V 8.43 4.53 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 0.83 0.00 0.00 0.96 0.00 0.00 14 L 8.13 4.86 0.00 1.76 1.66 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 15 V 8.59 4.36 2.09 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 0.65 0.00 0.00 0.89 0.00 0.00 16 A 8.89 4.29 1.46 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 0.00 0.00 17 S 8.49 4.41 0.00 3.92 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 18 G 8.00 4.17 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 0.00 0.00 0.00 19 K 6.80 3.93 0.00 1.43 1.60 0.00 1.98 0.00 0.00 1.50 0.00 0.00 2.83 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.33 1.32 7.81 20 Y 7.59 4.65 0.00 3.32 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 21 K 7.88 4.29 0.00 1.86 1.92 0.00 1.59 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.40 7.81 22 G 7.70 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 0.00 0.00 0.00 23 R 7.73 4.45 0.00 1.84 2.04 0.00 2.96 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.68 0.00 24 V 8.30 4.09 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 0.90 0.00 0.00 0.96 0.00 0.00 25 G 8.01 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 26 K 9.48 3.84 0.00 1.76 1.93 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.53 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.44 1.37 7.81 27 V 7.51 4.77 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 0.77 0.00 0.00 0.93 0.00 0.00 28 K 8.33 5.16 0.00 1.98 1.89 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.34 1.45 7.81 29 E 8.94 3.96 0.00 1.98 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 2.25 2.38 0.00 30 V 7.88 3.92 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 0.75 0.00 0.00 0.93 0.00 0.00 31 L 7.72 4.49 0.00 1.62 1.62 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.57 0.00 2.35 2.15 0.00 3.75 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.84 0.00 33 K 8.35 4.44 0.00 1.89 2.31 0.00 1.84 0.00 0.00 1.83 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.58 7.81 34 K 7.69 3.94 0.00 1.85 1.53 0.00 1.92 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.21 1.41 7.81 35 Y 7.92 5.80 0.00 3.06 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 36 A 8.67 5.21 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 37 V 8.91 3.78 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 0.90 0.00 0.00 0.94 0.00 0.00 38 I 7.91 3.66 2.11 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.67 0.93 0.00 0.00 39 V 7.31 4.27 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 0.74 0.00 0.00 0.96 0.00 0.00 40 E 8.07 5.27 0.00 1.91 1.90 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 2.07 2.04 0.00 41 G 8.05 4.86 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 42 V 8.20 4.14 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 0.95 0.00 0.00 43 N 8.29 5.07 0.00 2.75 2.73 0.00 0.00 7.73 7.98 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 44 I 8.02 3.15 1.88 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 1.42 0.36 0.91 0.00 0.00 45 V 8.15 4.01 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 0.86 0.00 0.00 0.93 0.00 0.00 46 K 8.70 3.92 0.00 1.93 2.11 0.00 1.70 0.00 0.00 1.92 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.44 7.81 47 K 7.83 4.46 0.00 1.83 1.80 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.49 7.81 48 A 7.95 3.82 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 49 V 7.37 4.15 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 0.74 0.00 0.00 0.97 0.00 0.00 50 R 8.33 4.60 0.00 1.78 1.93 0.00 3.08 0.00 0.00 3.82 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 51 V 7.84 3.62 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 0.82 0.00 0.00 0.93 0.00 0.00 52 S 7.76 4.67 0.00 3.92 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 0.00 53 P 0.00 4.40 0.00 2.38 2.13 0.00 3.88 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 2.24 2.03 0.00 54 K 8.16 4.47 0.00 1.78 1.95 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.66 7.81 55 Y 7.94 4.39 0.00 2.94 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 56 P 0.00 4.86 0.00 2.12 2.20 0.00 3.70 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.35 0.00 57 Q 8.22 4.57 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.93 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 58 G 7.66 4.83 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 0.00 0.00 0.00 59 G 8.24 3.81 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 0.00 60 F 8.78 4.39 0.00 2.97 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 61 I 8.20 4.60 2.07 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.59 0.95 0.00 0.00 62 E 8.24 4.85 0.00 2.54 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 0.00 2.25 2.49 0.00 63 K 8.07 4.30 0.00 1.61 1.74 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.66 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.38 7.81 64 E 8.73 4.25 0.00 2.32 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 2.40 2.53 0.00 65 A 9.87 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 3.91 0.00 2.15 2.00 0.00 3.86 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 2.05 2.16 0.00 67 L 8.22 4.81 0.00 1.77 1.68 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 68 H 7.75 5.15 0.00 3.10 3.36 0.00 5.68 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 69 A 8.01 4.57 1.09 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 0.00 0.00 70 S 9.70 4.39 0.00 3.85 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 0.00 71 K 7.68 4.52 0.00 1.67 1.56 0.00 1.82 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.47 1.50 7.81 72 V 8.38 3.11 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 0.75 0.00 0.00 0.91 0.00 0.00 73 R 8.27 5.08 0.00 1.77 1.80 0.00 3.29 0.00 0.00 3.10 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 74 P 0.00 4.62 0.00 2.19 2.22 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.95 0.00 75 I 8.24 4.09 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 1.30 1.08 0.91 0.00 0.00 76 C 9.21 4.55 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 77 P 0.00 4.02 0.00 2.25 2.09 0.00 3.74 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 2.06 1.96 0.00 78 A 8.26 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 79 C 8.28 4.75 0.00 3.05 2.85 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 80 G 8.30 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 81 K 8.39 4.78 0.00 1.70 1.69 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.30 1.32 7.81 82 P 0.00 4.98 0.00 2.18 1.99 0.00 3.80 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 2.35 2.05 0.00 83 T 7.89 4.34 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 84 R 8.41 4.79 0.00 1.90 1.99 0.00 3.14 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 85 V 7.93 4.24 2.09 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 0.83 0.00 0.00 0.94 0.00 0.00 86 R 8.38 4.11 0.00 2.04 1.93 0.00 3.49 0.00 0.00 3.33 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.56 0.00 87 K 8.16 4.09 0.00 1.91 1.91 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.49 7.81 88 K 8.98 4.71 0.00 1.74 2.13 0.00 1.97 0.00 0.00 1.84 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.55 7.81 89 F 9.23 4.00 0.00 2.95 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 90 L 8.15 3.46 0.00 1.67 1.63 0.66 0.84 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 91 E 7.66 4.58 0.00 2.35 1.76 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 2.38 2.36 0.00 92 N 8.83 4.28 0.00 2.76 2.60 0.00 0.00 7.37 7.65 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 93 G 9.21 4.02 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 0.00 0.00 0.00 94 K 8.32 4.24 0.00 1.76 1.87 0.00 1.84 0.00 0.00 2.29 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.41 7.81 95 K 8.73 4.55 0.00 1.80 1.74 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.63 7.81 96 I 8.52 4.20 2.12 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 1.22 0.36 0.93 0.00 0.00 97 R 8.34 4.71 0.00 1.64 1.83 0.00 3.25 0.00 0.00 3.15 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 98 V 8.93 4.08 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 0.68 0.00 0.00 1.01 0.00 0.00 99 C 9.13 4.02 0.00 3.22 2.40 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 0.00 100 A 8.69 4.19 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 0.00 101 K 7.64 4.89 0.00 1.68 1.72 0.00 2.00 0.00 0.00 1.62 0.00 0.00 3.06 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.59 7.81 102 C 8.37 4.79 0.00 2.91 2.75 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 0.00 103 G 9.03 4.02 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 0.00 0.00 0.00 104 G 8.93 3.74 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 0.00 105 A 7.11 3.70 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 L 8.43 3.88 0.00 1.65 1.80 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.04 4.72 0.00 2.72 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 0.00 108 T 8.41 3.89 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 0.00 109 E 9.78 4.55 0.00 1.91 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 2.10 2.08 0.00 110 E 8.54 4.08 0.00 2.01 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 0.00 2.26 2.33 0.00