NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 T 4.0555 8.1329 112.9154 64.9545 69.4754 178.0777 5 L 2.8752 7.0311 121.8045 51.7953 43.9528 177.5169 6 T 4.0434 8.7590 109.8994 65.3565 70.1417 175.7691 7 A 3.9507 8.2210 126.1418 55.2807 18.4762 180.1642 8 R 3.9541 8.1470 121.1554 62.5465 28.8511 180.8039 9 L 3.8743 9.0566 123.4916 59.8916 40.8174 179.8965 10 Y 3.8632 8.3182 121.3473 61.3259 38.3536 179.3068 11 S 4.2991 8.5099 123.2302 64.3752 62.7957 179.4552 12 L 4.3858 7.6745 124.4050 58.4704 41.2537 180.1779 13 L 4.6871 8.8762 119.6765 56.2808 42.4893 178.6555 14 F 4.8485 7.7748 114.2284 58.6699 39.0340 176.5947 15 R 3.4524 7.1018 121.5778 58.7342 30.4818 176.2902 16 R 4.0567 7.6567 117.0576 56.2173 30.4116 177.9513 17 T 3.8417 8.6692 120.8015 66.5597 68.8916 176.6385 18 S 4.0289 8.1558 114.7288 61.7274 62.7955 175.7389 19 T 4.0229 8.0619 117.8412 67.8488 68.3358 176.1960 20 F 3.8779 8.9265 120.6727 61.1845 39.6826 177.1101 21 A 4.1404 8.3994 119.7088 55.6785 18.6936 179.2316 22 L 3.8878 7.9574 118.6297 58.8187 41.9512 179.2483 23 T 4.0770 8.3511 109.5688 64.0473 68.8392 177.0464 24 I 3.5574 7.6934 123.1105 65.0856 37.2229 177.5096 25 V 3.6131 8.0697 118.2962 65.5390 30.7426 177.2879 26 V 3.7163 8.1185 118.3530 66.1852 31.5486 179.0957 27 G 3.5547 8.3840 105.5359 47.7137 0.0000 175.4045 28 A 4.0585 8.7152 124.9876 54.9948 18.2053 179.5909 29 L 3.9090 8.0481 117.1627 57.9850 41.6982 179.9485 30 L 4.0291 7.6351 118.4229 57.7206 41.6030 179.0412 31 F 4.1580 9.0576 121.7733 62.0874 39.2325 175.7664 32 E 3.8999 9.6211 120.5196 59.4078 28.6076 179.8392 33 R 3.8144 7.8154 119.2650 61.4147 30.1835 180.5361 34 A 4.1707 8.1067 121.9455 54.7108 18.5562 179.4414 35 F 3.9566 8.4997 120.2628 62.0248 39.2390 176.3786 36 D 4.0774 8.4056 118.7668 56.6670 40.4813 178.4530 37 Q 3.9320 8.0971 117.5692 59.3336 29.0498 180.3700 38 G 3.4408 7.9904 105.9904 47.7313 0.0000 175.2853 39 A 3.7273 7.9637 124.2776 54.6985 18.2434 179.0214 40 D 4.3286 8.5938 117.5161 57.7160 40.9160 179.2972 41 A 3.9786 8.0683 120.5959 55.2775 18.2102 179.2954 42 I 3.6139 7.9154 117.2775 65.5529 37.5413 177.2325 43 Y 4.0784 8.7063 120.1471 60.2618 38.4238 177.6466 44 E 3.7637 8.9787 119.1759 60.1248 29.7572 179.2069 45 H 4.0431 8.2499 116.5169 59.4281 29.9016 176.4769 46 I 4.1286 7.5308 118.1005 61.8507 37.5372 175.7542 47 N 4.9938 8.6027 118.7446 52.0697 39.5770 174.5837 48 E 3.9583 8.1528 117.4101 57.7552 30.2922 177.8690 49 G 3.9815 8.9850 110.1612 46.1413 0.0000 174.0318 50 K 4.4577 7.7644 119.4297 56.5085 34.3847 177.0649 51 L 4.3836 7.4728 118.1336 53.5532 42.6897 177.5553 52 W 4.2347 8.8159 130.4649 60.5187 30.3505 178.2742 53 K 3.9965 8.1023 118.4844 59.3507 31.7102 177.6026 54 H 4.5989 8.4821 115.2115 56.8143 29.2158 176.3452 55 I 3.9346 6.9621 119.2502 60.4095 38.4449 176.7832 56 K 2.0000 7.1735 121.0315 58.8525 31.7293 177.4088 57 H 4.9196 7.4134 115.6279 56.9082 28.5596 177.4228 58 K 4.0264 7.4472 117.8258 56.8681 30.9471 177.5401 59 Y 4.6509 6.6932 112.4870 58.6000 40.3627 173.9989 60 E 5.0137 10.6764 120.6417 57.4402 33.3439 176.6255 61 N 3.8124 9.2639 114.4525 53.8403 36.1499 177.4391 62 K 3.9556 8.4861 121.1161 53.4827 32.2161 173.7502 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 4 T 8.13 4.06 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 5 L 7.03 2.88 0.00 1.72 1.81 0.92 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.76 4.04 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 1.22 0.00 0.00 7 A 8.22 3.95 1.35 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 8 R 8.15 3.95 0.00 1.83 1.97 0.00 3.26 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.28 0.00 9 L 9.06 3.87 0.00 1.65 1.68 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 10 Y 8.32 3.86 0.00 2.88 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 11 S 8.51 4.30 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 12 L 7.67 4.39 0.00 1.76 1.60 0.92 1.05 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 13 L 8.88 4.69 0.00 1.72 1.96 0.91 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.77 4.85 0.00 2.78 3.13 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 15 R 7.10 3.45 0.00 1.50 1.79 0.00 3.32 0.00 0.00 3.22 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.47 0.00 16 R 7.66 4.06 0.00 1.93 1.87 0.00 3.20 0.00 0.00 3.33 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 17 T 8.67 3.84 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 1.10 0.00 0.00 18 S 8.16 4.03 0.00 3.87 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 19 T 8.06 4.02 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 1.40 0.00 0.00 20 F 8.93 3.88 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 21 A 8.40 4.14 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.96 3.89 0.00 1.81 1.91 0.94 0.87 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 23 T 8.35 4.08 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 1.23 0.00 0.00 24 I 7.69 3.56 2.02 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.33 0.90 0.00 0.00 25 V 8.07 3.61 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 1.05 0.00 0.00 0.99 0.00 0.00 26 V 8.12 3.72 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 0.97 0.00 0.00 0.99 0.00 0.00 27 G 8.38 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.72 4.06 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.05 3.91 0.00 1.90 1.77 0.94 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.64 4.03 0.00 1.90 1.75 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.06 4.16 0.00 3.05 3.24 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 32 E 9.62 3.90 0.00 2.25 1.99 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 2.50 2.41 0.00 33 R 7.82 3.81 0.00 1.82 1.92 0.00 3.32 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 34 A 8.11 4.17 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 35 F 8.50 3.96 0.00 1.61 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 36 D 8.41 4.08 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 37 Q 8.10 3.93 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.66 0.00 38 G 7.99 3.44 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 0.00 39 A 7.96 3.73 0.79 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 0.00 0.00 40 D 8.59 4.33 0.00 2.67 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 41 A 8.07 3.98 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 42 I 7.92 3.61 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.83 0.93 0.00 0.00 43 Y 8.71 4.08 0.00 3.03 3.10 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 0.00 0.00 0.00 44 E 8.98 3.76 0.00 2.06 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 0.00 2.46 2.72 0.00 45 H 8.25 4.04 0.00 3.13 3.53 0.00 5.75 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 46 I 7.53 4.13 1.85 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 1.53 0.90 0.87 0.00 0.00 47 N 8.60 4.99 0.00 2.44 2.56 0.00 0.00 6.98 8.05 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 48 E 8.15 3.96 0.00 1.87 1.80 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 2.33 2.08 0.00 49 G 8.98 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 0.00 0.00 0.00 50 K 7.76 4.46 0.00 1.77 1.84 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.56 7.81 51 L 7.47 4.38 0.00 1.43 1.53 0.86 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.82 4.23 0.00 3.47 3.15 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 53 K 8.10 4.00 0.00 1.83 1.79 0.00 1.85 0.00 0.00 1.90 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.55 7.81 54 H 8.48 4.60 0.00 3.24 3.27 0.00 5.67 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 6.96 3.93 1.74 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 1.67 1.12 1.00 0.00 0.00 56 K 7.17 2.00 0.00 0.79 1.41 0.00 1.87 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.53 7.81 57 H 7.41 4.92 0.00 3.53 3.40 0.00 5.87 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 58 K 7.45 4.03 0.00 0.92 1.18 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.35 1.28 7.81 59 Y 6.69 4.65 0.00 3.00 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 60 E 10.68 5.01 0.00 2.19 1.88 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 2.13 2.17 0.00 61 N 9.26 3.81 0.00 2.81 2.60 0.00 0.00 6.86 7.44 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 62 K 8.49 3.96 0.00 1.86 1.83 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.15 0.76 7.81