NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5621 8.3049 120.3436 55.4204 33.4765 174.8137 2 Y 4.4865 8.4253 119.1653 56.6612 40.3514 172.3482 3 Q 4.5433 8.9131 122.8224 54.8375 31.4466 173.6585 4 L 5.0645 8.5501 128.0741 53.3848 44.2272 174.7862 5 Q 4.5370 8.9018 128.7317 54.4987 30.9649 174.0625 6 F 4.9836 8.8017 125.4561 56.6281 40.6327 175.2553 7 I 4.3767 8.9701 124.7131 59.8339 39.8603 174.6802 8 N 5.3467 9.3027 126.9108 51.4101 39.4539 174.2636 9 L 4.5917 8.9905 125.4991 54.6832 42.9523 176.5800 10 V 4.8029 8.7103 118.2595 59.7853 33.4707 174.9453 11 Y 4.7082 8.0179 121.5884 56.0421 40.3678 174.0094 12 D 4.6401 8.6323 121.9361 52.9605 40.9262 176.7484 13 T 4.0135 8.6042 118.8706 65.0452 68.6306 175.8786 14 T 4.2488 8.2215 109.2293 62.4738 68.7195 174.7881 15 K 4.5088 8.2446 120.6376 56.2240 32.9706 175.7157 16 L 4.9021 7.4160 119.1010 52.7926 43.9883 177.1278 17 T 4.1759 8.3941 113.0551 61.3983 70.8470 175.0887 18 H 4.0927 8.8086 120.7317 59.7690 29.6175 176.9274 19 L 3.8038 7.7737 121.2644 58.0658 42.0096 178.5946 20 E 3.8498 8.0005 118.1955 59.3437 29.3399 179.3742 21 Q 3.9589 8.0459 118.1734 59.0440 28.5540 178.6228 22 T 3.7766 7.6765 115.7466 66.8324 68.7391 175.9762 23 N 4.3245 8.1674 118.1802 56.3766 38.5111 177.5571 24 I 3.8053 7.7106 121.1074 64.5392 36.8999 178.2610 25 N 4.4353 8.2211 116.8792 55.8373 38.0574 177.2942 26 L 3.9662 7.2976 119.5354 56.9598 41.5835 178.4210 27 F 4.7567 7.9111 115.9234 56.9545 39.4773 176.1689 28 I 4.0410 7.3108 119.4438 60.5242 37.4359 176.5915 29 G 3.7672 7.5857 113.1594 45.3392 0.0000 169.7202 30 N 5.4430 7.5205 116.3176 51.2553 41.6838 174.0867 31 W 5.7917 9.1127 121.8620 55.3400 34.0658 174.3617 32 S 5.4859 9.7402 118.3830 56.9936 67.5511 172.5209 33 N 5.0646 9.4830 122.1785 52.2211 40.2924 174.9401 34 H 4.4556 9.1971 123.6267 58.7268 29.2958 177.0707 35 Q 4.1139 8.2359 116.6808 59.0501 28.5582 177.8992 36 L 3.9952 8.1650 115.5077 55.2807 42.5000 176.7536 37 Q 2.0000 7.4012 117.2237 56.5126 26.7670 172.8794 38 K 5.2291 7.3654 116.9477 54.7569 36.3772 175.0972 39 S 5.5569 9.5776 120.5065 56.5230 66.5694 172.4269 40 I 4.9290 9.0526 118.0743 59.1538 40.7593 173.6954 41 C 5.2170 8.8939 126.1349 57.9841 33.6168 172.1926 42 I 4.9375 8.9300 128.5540 59.9359 38.8126 175.4364 43 R 5.0376 8.8376 124.8112 54.4668 35.1788 174.0021 44 H 4.8753 9.0314 121.1672 56.3371 30.0999 174.4096 45 G 4.3502 8.6953 117.2791 45.1846 0.0000 169.9484 46 D 4.7683 8.2956 118.4830 52.2929 42.0507 175.2599 47 D 4.3743 8.7271 117.6471 57.1681 40.8022 177.0897 48 T 4.2931 7.8854 107.8125 61.4005 69.3682 175.2310 49 S 4.3307 7.5628 118.7703 58.5554 63.5592 173.7274 50 H 4.5062 8.4277 120.2899 55.4790 29.9800 174.3995 51 N 4.2956 8.6546 114.4230 54.6734 35.7798 174.6032 52 Q 4.9323 7.8667 115.9272 56.2425 30.6467 176.0136 53 Y 4.9621 9.3773 120.3760 56.5065 42.3311 173.8456 54 H 5.1670 9.1738 123.2720 54.8755 32.1186 173.7954 55 I 4.4458 8.1068 126.1194 61.0900 37.2136 175.6917 56 L 4.4204 9.1547 128.2977 57.2435 42.4964 177.2442 57 F 4.9240 7.9342 118.4636 57.0172 43.0309 172.9427 58 I 4.3368 7.2449 125.2148 59.5903 39.6386 174.9759 59 D 4.6162 9.1570 129.2634 52.8540 40.6973 176.8985 60 T 4.0863 8.3021 116.2009 63.8741 69.4600 176.4237 61 A 4.0655 8.0756 124.2942 54.5271 18.5134 177.4485 62 H 4.8620 7.9519 109.2693 54.7213 30.6690 173.7598 63 Q 3.8668 8.0950 117.7106 55.6468 26.5032 172.9335 64 R 5.3791 7.4637 117.3255 54.6513 34.5548 174.3896 65 I 5.0826 8.6338 118.6506 59.0351 41.3983 174.2828 66 K 5.2847 9.0401 122.9491 54.9304 35.8669 175.2242 67 F 5.5375 8.5752 117.7747 56.4119 41.8843 172.7419 68 S 5.1875 9.1782 113.3785 57.3276 66.9455 172.5803 69 S 4.4051 8.5307 114.8374 56.7835 63.3914 174.9065 70 F 4.1157 7.7198 125.9730 60.8868 38.5679 176.5680 71 D 4.4260 7.7373 119.6436 56.4204 41.4812 177.0939 72 N 4.8184 7.6189 117.4109 51.4327 36.2346 175.6478 73 E 4.3817 8.1083 116.4181 58.2238 30.4605 178.6132 74 E 4.1332 8.1300 117.7120 57.9069 30.2429 175.9983 75 I 4.8589 7.2747 120.0254 59.4854 40.2956 174.8812 76 I 4.5146 8.6784 126.3970 59.9299 39.6437 174.2595 77 Y 4.5144 8.6106 124.5419 56.5847 40.0013 174.6573 78 I 4.8811 8.6681 124.0585 59.4342 40.7621 174.2703 79 L 5.1093 8.9206 127.3125 52.9163 44.4152 175.0773 80 D 5.5134 9.1900 123.6526 52.5827 43.7228 174.8427 81 Y 4.1635 9.3493 125.7889 57.7591 38.8917 173.4001 82 D 4.5327 8.3082 126.1876 54.6522 43.3750 177.3487 83 D 4.2687 6.7185 116.3538 51.9464 42.5071 175.5512 84 T 4.0682 8.6318 108.1089 64.8093 68.5753 174.6502 85 Q 4.4573 9.3431 120.3945 56.4029 29.9801 174.6517 86 H 5.7331 8.4111 115.7059 54.2193 33.4904 172.5751 87 I 5.0491 8.8196 115.3161 59.0493 41.7217 173.8935 88 L 5.3675 9.0148 122.2934 53.1608 45.0160 175.3508 89 M 5.2251 9.1665 122.6540 53.9155 35.2396 174.1479 90 Q 4.9926 9.0654 125.6555 54.6137 33.6424 173.4166 91 T 4.9027 8.7241 112.6317 59.9333 72.4584 172.7370 92 S 4.9117 8.5984 117.0375 56.7547 66.2831 173.2035 93 S 4.6023 8.6179 123.0522 58.3872 62.7925 174.7446 94 K 4.1091 8.9728 124.3944 58.8589 32.5027 177.6188 95 Q 4.3727 8.2047 118.3455 55.1732 30.3785 175.9992 96 G 3.7661 8.8832 109.5686 44.6309 0.0000 171.5965 97 I 4.2887 7.7601 119.2694 59.6477 38.6055 175.8484 98 G 4.2302 7.9702 114.1964 45.4158 0.0000 171.4414 99 T 5.1331 8.2428 120.8842 61.9686 72.4863 174.1105 100 S 4.4556 9.0419 121.6516 57.5793 64.5216 173.7524 101 R 4.1394 8.3076 121.0960 55.4416 30.4319 174.3758 102 P 4.6763 0.0000 0.0000 62.9858 32.3973 175.5192 103 I 4.4894 8.7429 123.8200 59.4708 40.0819 174.8528 104 V 4.4259 8.3259 126.8546 62.4795 32.6012 174.4978 105 Y 5.0534 9.4597 125.6477 56.1226 41.0248 174.3992 106 E 5.4504 9.3711 121.5905 54.1550 32.7635 175.3408 107 R 3.6358 8.8020 123.2943 56.7015 30.7630 176.0159 108 L 4.0494 8.8195 127.2302 54.9695 42.0428 177.6320 109 V 3.5857 8.2957 116.7289 61.7819 31.7177 173.9474 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 4.56 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.62 0.00 2 Y 8.43 4.49 0.00 2.95 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 3 Q 8.91 4.54 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 4 L 8.55 5.06 0.00 1.59 1.44 0.68 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.90 4.54 0.00 2.15 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.67 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 6 F 8.80 4.98 0.00 3.11 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 7 I 8.97 4.38 1.65 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.87 0.09 0.00 0.00 8 N 9.30 5.35 0.00 3.10 2.87 0.00 0.00 6.69 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 9 L 8.99 4.59 0.00 1.91 1.80 0.66 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.71 4.80 2.15 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 0.95 0.00 0.00 1.25 0.00 0.00 11 Y 8.02 4.71 0.00 3.05 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 12 D 8.63 4.64 0.00 2.74 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 13 T 8.60 4.01 4.30 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 1.40 0.00 0.00 14 T 8.22 4.25 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 1.23 0.00 0.00 15 K 8.24 4.51 0.00 1.93 1.88 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.40 1.41 7.81 16 L 7.42 4.90 0.00 1.63 1.53 0.84 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.39 4.18 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 1.25 0.00 0.00 18 H 8.81 4.09 0.00 3.19 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.77 3.80 0.00 1.72 1.57 0.83 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.00 3.85 0.00 2.14 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 2.16 2.24 0.00 21 Q 8.05 3.96 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 22 T 7.68 3.78 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 1.08 0.00 0.00 23 N 8.17 4.32 0.00 2.64 2.85 0.00 0.00 7.11 7.21 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 24 I 7.71 3.81 1.66 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.31 0.72 0.00 0.00 25 N 8.22 4.44 0.00 2.87 2.88 0.00 0.00 7.05 6.86 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 26 L 7.30 3.97 0.00 0.78 0.96 0.06 0.83 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 27 F 7.91 4.76 0.00 3.10 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 28 I 7.31 4.04 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.84 1.04 0.00 0.00 29 G 7.59 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 30 N 7.52 5.44 0.00 2.44 2.61 0.00 0.00 6.60 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 31 W 9.11 5.79 0.00 3.23 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 32 S 9.74 5.49 0.00 3.88 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 33 N 9.48 5.06 0.00 1.83 2.37 0.00 0.00 7.23 7.89 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 34 H 9.20 4.46 0.00 3.15 3.43 0.00 6.01 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Q 8.24 4.11 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.10 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 36 L 8.17 4.00 0.00 1.53 1.65 0.86 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 7.40 2.00 0.00 1.96 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.75 0.00 0.00 0.00 0.00 0.00 1.69 2.00 0.00 38 K 7.37 5.23 0.00 1.81 1.75 0.00 1.74 0.00 0.00 1.91 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.59 7.81 39 S 9.58 5.56 0.00 4.07 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 40 I 9.05 4.93 1.71 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 1.02 0.84 0.64 0.00 0.00 41 C 8.89 5.22 0.00 2.89 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 42 I 8.93 4.94 2.24 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 1.14 0.64 0.87 0.00 0.00 43 R 8.84 5.04 0.00 1.95 1.82 0.00 3.33 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 44 H 9.03 4.88 0.00 3.21 3.19 0.00 5.73 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 45 G 8.70 4.35 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 0.00 0.00 0.00 46 D 8.30 4.77 0.00 2.76 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.73 4.37 0.00 2.63 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 48 T 7.89 4.29 4.18 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 1.16 0.00 0.00 49 S 7.56 4.33 0.00 3.98 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 50 H 8.43 4.51 0.00 3.10 3.27 0.00 6.05 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 N 8.65 4.30 0.00 3.08 3.32 0.00 0.00 6.83 7.91 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 52 Q 7.87 4.93 0.00 2.15 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.85 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 53 Y 9.38 4.96 0.00 2.87 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 54 H 9.17 5.17 0.00 3.08 2.95 0.00 5.77 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.11 4.45 1.80 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.66 0.88 0.00 0.00 56 L 9.15 4.42 0.00 1.68 1.81 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 57 F 7.93 4.92 0.00 3.07 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 58 I 7.24 4.34 1.55 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 1.02 0.59 0.79 0.00 0.00 59 D 9.16 4.62 0.00 3.03 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 60 T 8.30 4.09 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 1.08 0.00 0.00 61 A 8.08 4.07 1.23 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 62 H 7.95 4.86 0.00 3.28 3.33 0.00 5.83 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.09 3.87 0.00 2.43 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 64 R 7.46 5.38 0.00 2.06 1.82 0.00 3.21 0.00 0.00 3.42 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 65 I 8.63 5.08 1.78 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 1.01 0.88 0.00 0.00 66 K 9.04 5.28 0.00 1.78 1.70 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.33 1.43 7.81 67 F 8.58 5.54 0.00 3.26 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 68 S 9.18 5.19 0.00 3.93 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 69 S 8.53 4.41 0.00 3.37 3.73 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 70 F 7.72 4.12 0.00 3.17 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 71 D 7.74 4.43 0.00 2.69 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 72 N 7.62 4.82 0.00 2.93 3.03 0.00 0.00 5.79 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 73 E 8.11 4.38 0.00 2.07 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 2.29 2.26 0.00 74 E 8.13 4.13 0.00 2.15 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 0.00 2.35 2.30 0.00 75 I 7.27 4.86 1.90 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.87 0.47 0.00 0.00 76 I 8.68 4.51 1.76 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.64 0.82 0.00 0.00 77 Y 8.61 4.51 0.00 1.43 1.75 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 78 I 8.67 4.88 1.79 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 1.16 0.55 0.88 0.00 0.00 79 L 8.92 5.11 0.00 0.85 0.81 0.67 0.68 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 80 D 9.19 5.51 0.00 2.65 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 81 Y 9.35 4.16 0.00 2.76 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 82 D 8.31 4.53 0.00 2.61 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 83 D 6.72 4.27 0.00 2.83 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 84 T 8.63 4.07 4.30 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 1.33 0.00 0.00 85 Q 9.34 4.46 0.00 2.18 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.79 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 86 H 8.41 5.73 0.00 3.10 3.15 0.00 5.75 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.82 5.05 1.90 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 0.55 0.34 0.00 0.00 88 L 9.01 5.37 0.00 1.63 1.59 0.95 0.71 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 89 M 9.17 5.23 0.00 2.23 1.84 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 90 Q 9.07 4.99 0.00 2.09 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.49 0.00 0.00 0.00 0.00 0.00 2.16 2.39 0.00 91 T 8.72 4.90 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 0.60 0.00 0.00 92 S 8.60 4.91 0.00 3.76 3.56 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 0.00 93 S 8.62 4.60 0.00 3.76 3.73 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 94 K 8.97 4.11 0.00 1.60 1.84 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.44 1.38 7.81 95 Q 8.20 4.37 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.46 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 96 G 8.88 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 97 I 7.76 4.29 1.85 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 1.32 0.67 0.89 0.00 0.00 98 G 7.97 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 99 T 8.24 5.13 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 1.20 0.00 0.00 100 S 9.04 4.46 0.00 3.78 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 0.00 101 R 8.31 4.14 0.00 1.83 1.85 0.00 3.23 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 102 P 0.00 4.68 0.00 1.97 1.97 0.00 3.66 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 103 I 8.74 4.49 2.01 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 1.09 0.77 0.54 0.00 0.00 104 V 8.33 4.43 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 0.88 0.00 0.00 0.92 0.00 0.00 105 Y 9.46 5.05 0.00 2.93 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 0.00 106 E 9.37 5.45 0.00 2.08 2.15 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 2.41 2.33 0.00 107 R 8.80 3.64 0.00 1.43 1.85 0.00 3.02 0.00 0.00 2.92 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.50 0.00 108 L 8.82 4.05 0.00 1.47 1.52 0.86 1.20 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 0.00 109 V 8.30 3.59 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 0.58 0.00 0.00 0.86 0.00 0.00