NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3211 8.3149 120.1402 56.2166 33.4656 174.9698 7 L 4.5513 8.4110 123.9066 51.9719 43.1058 174.2902 8 H 5.0440 9.3435 117.7060 53.5640 32.5181 172.6674 9 K 4.5422 8.4074 120.4067 56.0800 33.1522 176.0398 10 E 4.9062 8.8274 122.3102 53.7260 33.6705 173.7184 11 P 4.7680 0.0000 0.0000 62.9658 32.0793 175.5699 12 A 4.9903 8.5282 123.5493 51.0690 22.9725 175.5726 13 T 4.6181 8.4001 115.2096 61.1869 72.0450 173.6732 14 L 4.2311 8.7533 128.4872 55.9359 42.3456 175.4457 15 I 4.3993 8.2270 125.5350 62.0394 39.4120 176.0507 16 K 4.3812 7.5574 118.7913 55.5454 35.4815 173.6659 17 A 4.6055 8.8104 130.7474 51.8567 19.4618 176.7779 18 I 4.1935 8.2813 123.1181 62.7242 38.8305 174.7577 19 D 4.5726 8.1969 117.9132 53.0407 44.4188 175.7887 20 G 3.6757 8.8198 109.5059 47.9457 0.0000 174.0300 21 D 4.8449 8.0648 116.6793 53.0416 40.4661 175.3341 22 T 5.2396 7.6342 117.3804 62.1819 72.4905 173.3708 23 V 4.7326 8.7966 117.8253 59.6051 36.7962 174.0013 24 K 5.0221 9.2445 126.1889 55.2440 33.7032 175.3027 25 L 5.2828 9.6732 126.7719 53.2792 46.7375 175.6015 26 M 4.8118 9.2298 121.6518 54.7028 33.0204 173.4823 27 Y 4.9342 9.1595 128.3314 55.7755 40.9577 175.8029 28 K 3.8104 9.1965 127.7732 57.4629 29.5430 176.1821 29 G 3.9513 8.0211 103.9386 45.5903 0.0000 172.5338 30 Q 4.6110 7.6938 121.6597 53.3734 30.6440 172.8523 31 P 4.8719 0.0000 0.0000 63.2619 32.3286 175.3839 32 M 4.7410 9.5065 121.4680 54.9331 36.3114 173.5877 33 T 4.7256 8.4433 121.7956 63.0665 70.6977 173.5605 34 F 5.0979 9.4989 124.0063 55.6531 42.8407 173.7913 35 R 5.0310 8.9785 124.2113 54.3839 31.9024 175.1811 36 L 4.3646 8.7058 127.7272 54.6375 42.2246 177.3859 37 L 3.9662 8.7999 124.5721 55.0914 43.2169 177.0925 38 L 3.8228 8.7406 118.5646 55.5170 39.6094 174.2348 39 V 4.9908 7.4386 107.9572 59.8177 35.9885 174.8452 40 D 4.9978 9.2663 124.2688 52.9628 43.2720 175.2310 41 T 4.8861 8.3586 113.6713 58.9209 71.1017 172.9417 42 P 4.4496 0.0000 0.0000 62.8923 32.1068 175.6809 43 E 4.7183 10.4489 121.6538 55.0611 31.8544 176.8040 44 T 4.5178 7.9496 109.8906 61.7099 70.5413 175.1745 45 K 4.5832 7.6539 121.5183 55.8530 32.8906 175.8483 46 H 4.4833 8.1707 118.8239 54.8013 30.5291 173.8318 47 P 4.2211 0.0000 0.0000 65.2244 31.4990 176.9515 48 K 4.3902 8.1987 114.5059 58.0539 33.4646 177.6717 49 K 4.0297 7.9111 118.1063 57.2969 34.2772 177.5844 50 G 3.9211 8.8964 108.4959 43.8508 0.0000 174.3774 51 V 4.7785 8.7423 118.5958 61.2040 34.1006 174.7797 52 E 4.5767 8.9487 127.9270 54.4541 32.2170 175.5457 53 K 4.0662 8.3342 120.2082 57.9538 32.5120 177.9064 54 Y 3.8074 8.5921 119.4975 58.7646 36.4942 171.7764 55 G 3.6741 8.0134 107.6306 47.4686 0.0000 174.2531 56 P 4.3476 0.0000 0.0000 64.8918 31.3292 178.7301 57 E 4.0309 8.0846 117.0014 59.4195 29.6267 179.0183 58 A 4.0582 8.4708 121.1909 54.9512 18.3515 179.7190 59 S 4.0632 8.2093 111.8603 61.5369 62.4400 176.2591 60 A 4.0645 8.1868 123.6086 54.7459 18.0872 179.3327 61 F 3.8991 8.4301 119.3104 61.8973 39.5647 177.5274 62 T 3.9387 8.0772 115.1843 66.3861 68.2630 176.3093 63 K 3.8369 8.0138 121.5157 59.6208 32.1173 178.7767 64 K 3.8642 8.1306 118.4336 59.6780 31.8092 178.7753 65 M 3.8253 7.4359 116.8459 58.9780 32.1632 178.3370 66 V 3.8339 7.6083 110.3548 63.5120 31.9292 177.7384 67 E 4.1639 8.0352 118.5473 58.0683 29.5136 176.7054 68 N 4.7229 8.1177 114.3808 52.7386 38.8445 174.5286 69 A 4.7587 7.5900 121.0888 51.1880 20.2628 178.1465 70 K 4.2629 8.8875 120.1209 57.8435 32.9878 177.9961 71 K 4.7180 8.7265 117.8665 54.4613 36.1620 175.6645 72 I 5.0589 8.3942 124.3984 59.5959 40.5869 174.3319 73 E 5.1681 9.1543 125.0939 54.6547 34.0431 175.0234 74 V 4.7354 8.5559 115.1687 59.4932 35.5301 174.6145 75 E 4.8338 9.2094 124.4167 54.4670 32.2234 175.2035 76 F 4.7109 8.9130 125.6711 57.5821 40.3636 174.8843 77 D 5.1475 8.4233 120.0729 52.8010 43.3843 175.8696 78 K 4.2569 9.4409 118.9293 58.8607 32.8426 178.4831 79 G 4.1141 8.2393 112.6757 44.7530 0.0000 173.2956 80 Q 4.0315 8.6826 121.5995 56.7641 29.2958 176.8701 81 R 4.4791 8.4739 119.6396 56.8222 31.0650 176.2328 82 T 5.0423 7.4052 107.2071 59.7884 71.8695 173.5182 83 D 4.6898 8.7238 124.5632 51.8857 41.1885 176.9592 84 K 3.9801 8.3431 117.1082 59.0028 32.4317 176.9107 85 Y 4.3713 8.3829 117.0974 57.6506 37.9158 176.6001 86 G 3.9357 8.1909 108.0466 45.4091 0.0000 174.3209 87 R 4.1951 7.8829 119.2228 55.6012 31.7035 176.0610 88 G 3.4858 8.4672 111.1019 45.9583 0.0000 172.4082 89 L 5.2468 9.0537 125.5721 53.5216 42.9707 175.6504 90 A 4.2910 8.2959 124.7014 51.5950 23.7763 173.7449 91 Y 4.7382 8.7080 117.0015 56.7437 39.9157 175.5721 92 V 4.7185 8.5689 124.2346 61.2858 34.3666 173.8000 93 Y 5.0771 9.2848 124.7845 56.0643 41.3445 174.4453 94 A 4.8024 9.2939 126.0437 50.0090 21.1449 176.3467 95 D 4.5287 9.8557 125.5328 56.0781 39.0339 174.8982 96 G 4.1448 8.3591 106.6001 45.2941 0.0000 173.6083 97 K 4.3851 7.9502 119.9291 55.2909 33.2381 175.7119 98 M 3.9109 8.4579 123.6100 55.0487 33.3540 177.1420 99 V 3.6449 8.8180 126.8569 65.9441 31.6288 177.7123 100 N 4.2963 8.0426 115.9020 56.4668 38.4802 176.7898 101 E 3.8845 8.0600 119.6699 59.0857 29.8477 178.2423 102 A 4.0324 8.0073 120.8536 55.2657 18.4036 179.4395 103 L 3.4494 8.0121 117.3105 58.0262 41.7419 180.0878 104 V 3.8169 7.4213 119.4113 65.4893 31.2197 178.0459 105 R 3.9649 8.3156 118.0106 58.9869 29.9422 177.4858 106 Q 4.3622 7.7197 115.6862 54.6906 29.1001 175.7214 107 G 3.9627 7.9308 108.4769 47.0662 0.0000 174.8674 108 L 4.3204 7.3962 116.1042 53.2593 42.7714 176.4484 109 A 4.4050 7.2301 117.9486 51.4605 22.1077 176.3998 110 K 4.8726 8.2996 119.7766 54.6831 35.3557 176.0434 111 V 4.3244 8.6402 122.5914 62.2982 31.6589 175.8836 112 A 5.0807 8.2576 130.0267 51.3478 19.4750 176.2198 113 Y 3.7844 8.4780 120.4316 57.3952 39.0615 175.7436 114 V 3.7040 7.6411 127.5775 62.6724 32.5254 174.7118 115 Y 4.7003 8.3453 123.7708 55.7883 39.5512 175.4357 116 K 4.4107 8.6941 124.7220 56.2231 32.7200 175.0296 117 P 4.7999 0.0000 0.0000 63.1473 31.6582 176.9878 118 N 4.9561 7.8655 119.0953 52.3195 36.9274 175.1393 119 N 5.1042 7.9238 113.7066 53.3894 39.1423 177.3072 120 T 3.8205 8.1422 117.8700 67.4325 68.7191 174.7401 121 H 4.8529 7.9865 115.5223 55.6187 29.3146 176.0139 122 E 3.9752 8.4058 123.5044 59.5945 29.3483 178.9862 123 Q 3.9612 8.0491 117.3994 59.2211 28.6631 178.0396 124 H 4.1438 8.2330 118.6073 59.5243 29.9601 177.1567 125 L 3.9788 8.1514 120.6359 57.7150 41.4597 179.6945 126 R 3.9575 8.3125 118.4531 59.0620 29.9020 179.2789 127 K 3.9611 7.9046 117.9496 59.5223 31.9729 179.6341 128 S 4.0730 7.7308 115.4224 61.4726 62.6476 176.3810 129 E 3.9509 8.3385 121.8938 59.0937 29.2879 178.7529 130 A 3.7357 7.8354 120.7984 55.0564 18.2147 179.4005 131 Q 3.7963 7.9524 116.8300 59.1663 29.4270 177.9719 132 A 4.1497 8.2131 122.0789 55.0502 18.3583 179.7020 133 K 3.1673 7.8689 117.3275 59.2967 31.8325 179.5155 134 K 3.8262 7.9768 118.3680 58.5745 32.1088 177.4581 135 E 4.4166 7.7714 116.2641 54.7965 30.5484 175.5098 136 K 4.1219 8.0850 117.9143 57.2266 30.5519 175.4840 137 L 4.2439 8.0087 117.4316 55.8732 44.4312 178.2333 138 N 3.5847 9.3790 118.3265 54.0131 38.4620 176.0852 139 I 3.0865 5.4200 124.8725 64.9641 37.5959 176.8924 140 W 4.7559 7.7857 117.2550 57.3291 29.2952 176.5268 141 S 4.4160 8.0830 119.2756 58.4726 62.6715 173.9505 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 6 K 8.31 4.32 0.00 1.79 1.85 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.49 7.81 7 L 8.41 4.55 0.00 1.79 1.71 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 8 H 9.34 5.04 0.00 3.24 3.23 0.00 5.52 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.41 4.54 0.00 1.56 1.64 0.00 1.39 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 1.26 7.81 10 E 8.83 4.91 0.00 2.14 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 2.31 2.24 0.00 11 P 0.00 4.77 0.00 1.96 2.00 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 12 A 8.53 4.99 1.16 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 13 T 8.40 4.62 4.27 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 1.23 0.00 0.00 14 L 8.75 4.23 0.00 1.63 1.57 0.98 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.23 4.40 2.07 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 1.15 0.98 0.94 0.00 0.00 16 K 7.56 4.38 0.00 1.79 1.61 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.36 1.39 7.81 17 A 8.81 4.61 1.26 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 0.00 0.00 18 I 8.28 4.19 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.84 0.91 0.00 0.00 19 D 8.20 4.57 0.00 2.62 2.49 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 20 G 8.82 3.68 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 0.00 0.00 0.00 21 D 8.06 4.84 0.00 2.91 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 22 T 7.63 5.24 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 1.27 0.00 0.00 23 V 8.80 4.73 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 0.68 0.00 0.00 0.95 0.00 0.00 24 K 9.24 5.02 0.00 1.83 1.80 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.47 7.81 25 L 9.67 5.28 0.00 1.67 1.52 0.32 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.23 4.81 0.00 2.14 2.03 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 2.57 2.55 0.00 27 Y 9.16 4.93 0.00 3.34 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 28 K 9.20 3.81 0.00 1.32 1.59 0.00 1.65 0.00 0.00 0.83 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.12 0.87 7.81 29 G 8.02 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.69 4.61 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.93 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 31 P 0.00 4.87 0.00 2.02 2.01 0.00 3.81 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 2.12 0.00 32 M 9.51 4.74 0.00 2.24 1.99 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.14 0.00 33 T 8.44 4.73 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 1.22 0.00 0.00 34 F 9.50 5.10 0.00 3.03 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 35 R 8.98 5.03 0.00 1.90 1.80 0.00 3.33 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 36 L 8.71 4.36 0.00 1.57 1.61 0.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.80 3.97 0.00 1.09 1.29 0.33 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.74 3.82 0.00 1.97 1.79 1.16 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.44 4.99 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 0.76 0.00 0.00 1.00 0.00 0.00 40 D 9.27 5.00 0.00 2.57 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.36 4.89 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 1.20 0.00 0.00 42 P 0.00 4.45 0.00 2.22 2.12 0.00 3.53 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 43 E 10.45 4.72 0.00 2.16 1.97 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 2.36 2.40 0.00 44 T 7.95 4.52 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 1.22 0.00 0.00 45 K 7.65 4.58 0.00 1.71 1.79 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.37 7.81 46 H 8.17 4.48 0.00 3.17 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.22 0.00 2.02 2.07 0.00 3.29 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.02 0.00 48 K 8.20 4.39 0.00 1.83 1.86 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.38 1.43 7.81 49 K 7.91 4.03 0.00 1.52 1.52 0.00 1.59 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.43 7.81 50 G 8.90 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 51 V 8.74 4.78 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 0.83 0.00 0.00 0.97 0.00 0.00 52 E 8.95 4.58 0.00 1.93 1.83 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 2.20 2.25 0.00 53 K 8.33 4.07 0.00 1.56 1.35 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.27 1.38 7.81 54 Y 8.59 3.81 0.00 3.14 2.98 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 55 G 8.01 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 56 P 0.00 4.35 0.00 2.17 2.11 0.00 3.58 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 2.08 2.16 0.00 57 E 8.08 4.03 0.00 2.38 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 0.00 2.54 2.51 0.00 58 A 8.47 4.06 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 0.00 0.00 0.00 0.00 0.00 59 S 8.21 4.06 0.00 4.09 4.04 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 60 A 8.19 4.06 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.43 3.90 0.00 3.28 3.22 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 62 T 8.08 3.94 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 1.24 0.00 0.00 63 K 8.01 3.84 0.00 1.98 2.00 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.50 7.81 64 K 8.13 3.86 0.00 1.67 1.73 0.00 1.71 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.51 7.81 65 M 7.44 3.83 0.00 2.04 1.86 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 66 V 7.61 3.83 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 0.78 0.00 0.00 1.06 0.00 0.00 67 E 8.04 4.16 0.00 2.23 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 2.31 2.33 0.00 68 N 8.12 4.72 0.00 2.73 2.77 0.00 0.00 6.93 7.17 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 69 A 7.59 4.76 1.31 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 0.00 0.00 70 K 8.89 4.26 0.00 1.90 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.39 7.81 71 K 8.73 4.72 0.00 1.65 1.65 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.39 5.06 2.01 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 1.33 1.24 0.85 0.00 0.00 73 E 9.15 5.17 0.00 1.89 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 2.20 2.25 0.00 74 V 8.56 4.74 1.36 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 0.01 0.00 0.00 0.47 0.00 0.00 75 E 9.21 4.83 0.00 2.13 2.31 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 2.49 2.38 0.00 76 F 8.91 4.71 0.00 3.07 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 77 D 8.42 5.15 0.00 2.72 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 78 K 9.44 4.26 0.00 1.76 1.90 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.46 7.81 79 G 8.24 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 80 Q 8.68 4.03 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 81 R 8.47 4.48 0.00 1.60 1.45 0.00 2.82 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.10 0.00 82 T 7.41 5.04 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 1.14 0.00 0.00 83 D 8.72 4.69 0.00 2.92 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 84 K 8.34 3.98 0.00 1.58 1.77 0.00 1.24 0.00 0.00 1.50 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.06 0.43 7.81 85 Y 8.38 4.37 0.00 3.11 2.97 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 86 G 8.19 3.94 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 0.00 0.00 0.00 87 R 7.88 4.20 0.00 2.15 1.81 0.00 3.11 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 88 G 8.47 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 0.00 0.00 0.00 89 L 9.05 5.25 0.00 1.56 1.63 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.30 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.71 4.74 0.00 3.09 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 92 V 8.57 4.72 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 0.87 0.00 0.00 0.72 0.00 0.00 93 Y 9.28 5.08 0.00 2.89 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 94 A 9.29 4.80 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 95 D 9.86 4.53 0.00 2.77 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 96 G 8.36 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 0.00 0.00 0.00 97 K 7.95 4.39 0.00 2.06 1.77 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.18 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.45 7.81 98 M 8.46 3.91 0.00 1.87 1.50 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.39 0.00 99 V 8.82 3.64 2.04 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 1.03 0.00 0.00 0.90 0.00 0.00 100 N 8.04 4.30 0.00 2.89 2.94 0.00 0.00 6.78 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 0.00 101 E 8.06 3.88 0.00 1.97 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 2.27 2.24 0.00 102 A 8.01 4.03 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.01 3.45 0.00 1.83 1.62 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.42 3.82 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 1.17 0.00 0.00 1.05 0.00 0.00 105 R 8.32 3.96 0.00 2.04 2.07 0.00 3.34 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 106 Q 7.72 4.36 0.00 1.71 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.17 0.00 107 G 7.93 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 0.00 0.00 0.00 108 L 7.40 4.32 0.00 1.29 1.44 0.50 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.23 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.30 4.87 0.00 1.76 1.90 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.22 7.81 111 V 8.64 4.32 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 0.78 0.00 0.00 1.03 0.00 0.00 112 A 8.26 5.08 1.45 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 0.00 0.00 113 Y 8.48 3.78 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 0.00 114 V 7.64 3.70 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 0.90 0.00 0.00 115 Y 8.35 4.70 0.00 3.09 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 0.00 116 K 8.69 4.41 0.00 1.81 1.80 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.46 7.81 117 P 0.00 4.80 0.00 2.22 2.16 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 118 N 7.87 4.96 0.00 3.00 2.89 0.00 0.00 6.64 8.02 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 0.00 119 N 7.92 5.10 0.00 2.92 2.98 0.00 0.00 6.09 7.22 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 0.00 120 T 8.14 3.82 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 1.07 0.00 0.00 121 H 7.99 4.85 0.00 2.96 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.41 3.98 0.00 2.07 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 0.00 2.30 2.36 0.00 123 Q 8.05 3.96 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.66 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 124 H 8.23 4.14 0.00 3.21 3.49 0.00 5.87 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 0.00 125 L 8.15 3.98 0.00 1.76 1.72 1.04 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.31 3.96 0.00 2.00 1.94 0.00 3.09 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.92 0.00 127 K 7.90 3.96 0.00 1.91 1.81 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.68 7.81 128 S 7.73 4.07 0.00 3.93 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 0.00 129 E 8.34 3.95 0.00 2.09 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 0.00 2.21 2.59 0.00 130 A 7.84 3.74 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 0.00 131 Q 7.95 3.80 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 132 A 8.21 4.15 1.60 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 0.00 0.00 133 K 7.87 3.17 0.00 1.42 1.24 0.00 0.70 0.00 0.00 0.61 0.00 0.00 2.46 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.30 0.40 7.81 134 K 7.98 3.83 0.00 1.69 1.99 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.57 7.81 135 E 7.77 4.42 0.00 2.12 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 2.25 2.37 0.00 136 K 8.08 4.12 0.00 1.90 1.93 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.40 7.81 137 L 8.01 4.24 0.00 1.76 1.66 1.03 0.76 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 0.00 138 N 9.38 3.58 0.00 2.53 1.42 0.00 0.00 7.11 7.24 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 0.00 139 I 5.42 3.09 1.11 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 0.94 -0.12 -0.36 0.00 0.00 140 W 7.79 4.76 0.00 3.31 3.14 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 0.00 141 S 8.08 4.42 0.00 4.02 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