NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 34 S 4.3906 8.1933 116.7881 58.3238 65.1626 174.4512 35 S 3.9449 7.7676 116.4812 58.1243 62.6022 174.6741 36 G 3.6917 7.7300 113.0986 48.1612 0.0000 176.3911 37 R 3.9859 7.5987 115.2188 58.4703 29.6942 177.1113 38 F 5.1553 8.3002 117.7010 56.9500 39.5733 176.6596 39 G 3.8622 7.7757 109.4460 47.0650 0.0000 174.7264 40 A 4.5310 8.3403 119.6473 52.4099 19.0162 175.9905 41 R 4.4156 7.1523 119.3826 56.1496 34.5022 175.2914 42 Y 3.9086 8.2170 120.1686 60.5917 36.2661 169.1884 43 G 3.9347 7.8470 102.7153 43.5521 0.0000 174.4895 44 R 3.9035 8.7115 117.7334 59.4045 30.3070 179.4596 45 V 3.7745 7.7064 116.0870 64.8851 31.7985 177.8041 46 S 4.2191 7.8951 115.9196 60.9043 62.8798 175.6105 47 R 5.0668 7.6499 114.2632 55.0451 29.6588 176.5324 48 R 4.4144 7.9751 118.8731 58.0734 31.0045 177.2114 49 R 4.1368 8.1075 115.9209 57.5249 30.2781 178.2526 50 V 4.1551 7.2288 114.2186 64.1182 32.1173 177.4667 51 A 4.1463 7.9099 119.4418 54.5292 18.7999 178.4780 52 E 4.1253 7.9849 117.8833 58.9293 29.5797 178.7385 53 I 3.8798 7.1557 119.0894 63.3746 37.0835 177.0462 54 E 4.5815 7.4326 116.1950 56.1615 29.6727 176.4061 55 S 4.6416 7.9580 114.4840 58.3640 63.7387 174.1481 56 E 5.2061 8.1310 118.7260 55.0379 30.0085 175.4000 57 M 5.2150 8.2955 115.0384 54.3659 33.9829 174.9121 58 N 5.2014 8.3201 115.4124 53.4306 39.8586 173.7033 59 E 4.8083 8.0917 120.4387 55.1303 32.0491 174.2890 60 D 5.1902 8.4149 121.8983 53.4911 42.5691 175.4641 61 H 5.0305 8.4256 120.9892 53.3595 31.3769 174.3213 62 A 4.9223 8.7044 124.8270 52.1579 18.9148 176.1998 63 C 4.4414 8.6257 122.4013 57.2740 32.9270 172.6510 64 P 4.2742 0.0000 0.0000 63.3995 31.1431 176.5938 65 N 4.6708 8.8268 115.7985 52.8784 41.8523 173.4601 66 C 5.0230 7.8839 111.2352 56.5851 32.3815 173.5101 67 G 3.9039 8.4746 107.4355 45.8216 0.0000 173.4578 68 E 4.2390 7.6295 119.7991 55.5054 31.5521 176.1440 69 D 5.4371 8.1971 118.2835 53.7903 42.5471 176.9621 70 R 4.6257 7.9490 120.1651 54.9307 29.0120 174.0429 71 V 5.1702 7.9390 119.8088 61.0001 34.7758 173.9559 72 D 5.2690 9.2871 126.8792 52.3469 44.7963 175.2707 73 R 3.6259 8.5608 122.0860 56.0240 30.8328 175.9055 74 Q 4.2986 8.3744 124.4175 57.3550 30.5395 175.4784 75 G 3.6459 6.8289 106.1269 45.1672 0.0000 172.1520 76 T 4.0022 8.3001 120.4361 65.1143 67.7943 174.9139 77 G 3.9350 8.6208 115.7678 45.5787 0.0000 170.9640 78 I 4.6174 6.7682 120.7157 59.2702 39.3513 174.8601 79 W 5.2046 8.6392 125.8648 54.8606 33.1319 174.1556 80 Q 5.1506 9.0123 123.1930 53.4442 33.0149 172.9978 81 C 5.2847 8.7973 124.0706 58.3448 32.9567 173.8768 82 S 4.0728 9.0008 120.4627 60.0871 62.7166 174.1296 83 Y 4.3681 8.3447 121.2652 58.5357 39.1804 174.4069 84 C 4.1315 8.2196 120.5340 58.6801 32.3656 173.1814 85 D 5.1699 7.9483 115.2639 55.5550 37.3481 174.1098 86 Y 4.6002 7.9590 121.6669 56.9208 38.6230 172.5284 87 K 4.7835 8.3458 126.4146 55.6882 33.2027 175.1657 88 F 5.0190 9.5968 123.7323 55.5090 42.0831 172.8717 89 T 4.8805 8.6910 108.4988 60.2670 70.0352 173.9420 90 G 4.6459 8.5610 111.5153 44.6387 0.0000 171.6445 91 G 4.4118 8.6979 106.7220 45.5865 0.0000 173.8479 92 S 4.2796 8.8377 116.0252 60.9604 62.3409 174.9310 93 Y 4.9257 7.7353 114.5360 58.0642 39.8597 175.9055 94 K 4.5540 7.9508 119.3617 53.4501 34.3466 175.3751 95 P 2.9700 0.0000 0.0000 64.3196 31.2025 175.9895 96 E 4.9692 7.5230 116.1491 54.3098 33.2729 174.7276 97 T 4.7170 8.0060 110.7561 58.7380 71.4359 173.1234 98 P 4.2981 0.0000 0.0000 65.9151 30.6570 179.1048 99 G 3.7480 8.1028 104.1551 47.4047 0.0000 176.0484 100 G 3.6979 8.1832 107.4503 47.3005 0.0000 175.6451 101 K 4.1939 8.3114 120.8881 59.4065 31.9114 179.4286 102 T 3.9536 7.6249 115.3806 65.9833 68.0318 176.8952 103 V 3.6122 7.1500 119.2554 66.3574 31.5805 176.8139 104 R 3.8793 8.0835 116.1016 59.6596 31.6337 180.1303 105 R 2.8568 7.8635 106.3221 56.3946 30.7509 176.7298 106 S 4.3419 9.0044 119.9183 59.0838 63.3399 174.9119 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 34 S 8.19 4.39 0.00 3.83 3.89 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 0.00 0.00 0.00 35 S 7.77 3.94 0.00 4.04 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 36 G 7.73 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 37 R 7.60 3.99 0.00 1.82 1.91 0.00 2.60 0.00 0.00 3.03 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.89 0.00 38 F 8.30 5.16 0.00 3.45 3.30 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 39 G 7.78 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 40 A 8.34 4.53 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 41 R 7.15 4.42 0.00 0.89 0.75 0.00 2.87 0.00 0.00 3.06 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.38 0.00 42 Y 8.22 3.91 0.00 3.09 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 43 G 7.85 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 0.00 0.00 0.00 44 R 8.71 3.90 0.00 1.90 2.00 0.00 3.14 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.63 0.00 45 V 7.71 3.77 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 1.00 0.00 0.00 0.94 0.00 0.00 46 S 7.90 4.22 0.00 4.31 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 47 R 7.65 5.07 0.00 1.96 2.14 0.00 3.08 0.00 0.00 3.13 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.54 0.00 48 R 7.98 4.41 0.00 1.94 1.92 0.00 3.18 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 49 R 8.11 4.14 0.00 2.03 1.91 0.00 3.14 0.00 0.00 3.08 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 50 V 7.23 4.16 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 1.13 0.00 0.00 0.92 0.00 0.00 51 A 7.91 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.98 4.13 0.00 2.08 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 2.30 2.35 0.00 53 I 7.16 3.88 1.75 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 1.45 0.66 0.64 0.00 0.00 54 E 7.43 4.58 0.00 1.96 1.95 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 2.28 2.41 0.00 55 S 7.96 4.64 0.00 4.05 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 56 E 8.13 5.21 0.00 1.95 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 2.19 2.33 0.00 57 M 8.30 5.22 0.00 2.16 2.45 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.65 0.00 58 N 8.32 5.20 0.00 2.86 2.81 0.00 0.00 6.80 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 59 E 8.09 4.81 0.00 1.94 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 2.34 2.40 0.00 60 D 8.41 5.19 0.00 2.50 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 61 H 8.43 5.03 0.00 3.11 3.13 0.00 5.63 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 62 A 8.70 4.92 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 63 C 8.63 4.44 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 64 P 0.00 4.27 0.00 2.04 1.93 0.00 3.13 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.84 0.00 65 N 8.83 4.67 0.00 2.34 2.62 0.00 0.00 6.63 7.99 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 66 C 7.88 5.02 0.00 3.18 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 67 G 8.47 3.90 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 0.00 0.00 0.00 68 E 7.63 4.24 0.00 1.78 1.72 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 1.83 2.15 0.00 69 D 8.20 5.44 0.00 2.56 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 70 R 7.95 4.63 0.00 1.87 1.97 0.00 2.93 0.00 0.00 3.21 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 71 V 7.94 5.17 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 1.25 0.00 0.00 1.22 0.00 0.00 72 D 9.29 5.27 0.00 2.64 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.56 3.63 0.00 0.68 1.44 0.00 2.39 0.00 0.00 2.92 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 0.00 74 Q 8.37 4.30 0.00 1.86 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.32 0.00 0.00 0.00 0.00 0.00 2.20 2.35 0.00 75 G 6.83 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 76 T 8.30 4.00 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 1.07 0.00 0.00 77 G 8.62 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 0.00 0.00 0.00 78 I 6.77 4.62 1.72 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 1.12 0.64 0.76 0.00 0.00 79 W 8.64 5.20 0.00 1.81 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 80 Q 9.01 5.15 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 81 C 8.80 5.28 0.00 3.32 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 82 S 9.00 4.07 0.00 4.02 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 83 Y 8.34 4.37 0.00 2.91 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 84 C 8.22 4.13 0.00 2.83 2.95 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 85 D 7.95 5.17 0.00 2.91 2.80 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 86 Y 7.96 4.60 0.00 3.08 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 87 K 8.35 4.78 0.00 1.81 1.67 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.39 7.81 88 F 9.60 5.02 0.00 2.97 2.38 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 89 T 8.69 4.88 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 1.21 0.00 0.00 90 G 8.56 4.65 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 91 G 8.70 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 0.00 0.00 0.00 0.00 92 S 8.84 4.28 0.00 3.49 3.07 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 93 Y 7.74 4.93 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 94 K 7.95 4.55 0.00 1.82 1.72 0.00 1.70 0.00 0.00 1.93 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.57 1.50 7.81 95 P 0.00 2.97 0.00 1.77 0.80 0.00 3.11 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.23 0.00 96 E 7.52 4.97 0.00 1.83 1.79 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 2.18 2.19 0.00 97 T 8.01 4.72 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 1.22 0.00 0.00 98 P 0.00 4.30 0.00 2.18 2.17 0.00 3.60 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 2.13 2.18 0.00 99 G 8.10 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 0.00 0.00 0.00 100 G 8.18 3.70 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 0.00 0.00 0.00 101 K 8.31 4.19 0.00 1.81 1.85 0.00 1.66 0.00 0.00 1.63 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.65 7.81 102 T 7.62 3.95 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 1.21 0.00 0.00 103 V 7.15 3.61 2.24 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 0.84 0.00 0.00 1.00 0.00 0.00 104 R 8.08 3.88 0.00 1.92 1.93 0.00 3.23 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 1.67 1.71 0.00 105 R 7.86 2.86 0.00 2.05 1.71 0.00 3.15 0.00 0.00 3.27 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 106 S 9.00 4.34 0.00 3.97 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