NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 61 S 4.4059 8.3349 115.2830 57.6203 64.3089 174.9345 62 N 4.6452 7.7119 115.9459 52.0340 39.0753 174.5011 63 A 4.4157 8.0044 116.6343 53.4078 21.7826 177.3184 64 G 3.9973 8.0638 104.8514 46.3089 0.0000 173.7701 65 Q 4.5624 7.6090 120.0019 54.3502 31.7161 174.0223 66 L 5.1238 8.1351 118.6893 52.8090 44.9614 176.4440 67 C 4.4261 8.3708 121.2225 59.4312 32.3050 173.2512 68 C 4.8507 8.1121 115.0887 57.9185 29.8283 173.2023 69 L 4.8386 7.7830 117.9976 54.0840 45.5822 176.7489 70 R 4.6544 8.1929 119.7932 54.6934 32.6135 174.9508 71 E 4.5501 9.1413 127.4272 54.7951 29.4355 175.4570 72 D 4.2367 9.1261 128.8616 55.0221 39.9463 175.0253 73 G 3.9331 8.5932 105.6318 44.9149 0.0000 173.5604 74 E 4.3485 7.5947 120.7807 55.0552 30.8071 177.2521 75 R 4.3262 8.4712 127.7697 57.5417 28.2937 177.1668 76 C 3.7914 8.3993 116.4314 57.3358 33.8773 172.0630 77 G 4.1453 8.1297 109.6118 45.7632 0.0000 173.9887 78 R 4.1602 7.7662 119.6233 55.5594 31.2860 176.2520 79 A 4.6123 8.5866 127.1599 51.8695 19.4221 176.6792 80 A 4.1937 8.6588 121.5468 51.8820 19.0638 178.7892 81 G 4.1770 9.1777 111.3067 45.4121 0.0000 173.8320 82 N 4.5459 8.7452 119.3826 53.6078 39.8087 175.5578 83 A 4.5459 7.6743 120.6168 52.3486 19.8593 176.1728 84 S 4.9538 8.1144 114.1381 56.5680 66.6171 174.3180 85 F 4.4294 8.8111 125.9599 57.8841 38.8926 174.3793 86 S 4.8146 7.7121 124.7296 56.3248 65.9371 174.3273 87 K 3.8121 8.3553 117.9521 59.7757 31.8905 178.9574 88 R 3.8402 7.8466 118.4677 59.6841 29.8015 178.4206 89 I 3.6854 7.1730 118.0123 64.1450 36.9527 178.1196 90 Q 3.9380 7.2242 119.1191 59.2092 28.9409 178.4830 91 K 3.8822 8.3322 119.7794 59.5163 32.0886 179.0814 92 S 4.0828 8.4609 113.6360 61.4961 62.2757 176.3119 93 I 3.6693 8.0266 122.5246 64.5811 36.6780 178.3033 94 S 4.1238 8.0468 114.8073 61.8411 62.7653 176.4611 95 Q 4.1021 7.9015 120.5290 59.2939 28.9320 178.1850 96 K 4.0591 7.8451 118.0631 56.8119 33.3759 176.4940 97 K 3.7750 8.3488 118.6763 56.8897 28.9786 174.0152 98 V 4.5365 7.3415 113.1511 59.3056 36.6672 176.6962 99 K 4.2948 8.2014 120.4026 55.6507 30.4747 177.2463 100 I 5.0300 7.5442 117.5943 58.3466 40.6388 176.1874 101 E 4.8064 8.4971 124.3562 53.8448 33.3660 174.8591 102 L 3.8777 8.3401 122.9687 55.1311 43.0461 175.4263 103 D 4.6822 7.8415 124.2677 53.3308 41.4592 176.5616 104 K 4.1964 8.7415 124.8050 57.7703 32.7027 178.2927 105 S 4.0955 7.6959 111.7577 59.0752 63.1961 174.1154 106 A 4.4359 7.1074 124.4988 51.6837 19.4541 177.0246 107 R 4.5765 8.3461 115.3011 55.7192 32.2744 175.3601 108 H 5.0680 7.9553 111.6028 53.6303 31.4673 173.9738 109 L 4.5821 7.6529 119.2174 52.5401 40.7633 174.1949 110 Y 5.2020 8.0474 117.1178 55.7203 42.5326 174.7665 111 I 4.7559 8.6349 118.1457 59.4030 41.1460 174.5371 112 C 4.8833 8.4823 117.1695 57.5825 31.1331 174.5663 113 D 4.4279 8.8024 119.2750 57.5784 40.3028 177.9847 114 Y 4.0368 8.1470 119.6660 61.4870 38.6663 178.0240 115 H 4.3154 8.3112 116.3121 58.4700 28.8620 177.6045 116 K 3.9238 8.0628 121.4281 59.5994 32.1064 178.3410 117 N 4.2311 8.3110 117.2843 56.5431 38.6883 176.3772 118 L 3.8175 7.5678 120.4193 58.4033 42.1883 178.7823 119 I 3.9453 7.8120 118.5650 64.3178 37.3330 178.1377 120 Q 4.1726 8.3104 119.1493 58.4817 28.3082 177.1813 121 S 4.7776 7.9429 113.0390 58.7441 62.4999 174.6289 122 V 4.1990 7.4778 119.4973 62.5800 32.5565 176.3335 123 R 4.5449 7.4077 117.2188 55.3172 30.4596 175.6157 124 N 4.4395 7.8175 112.1667 53.6127 39.8666 171.9754 125 R 4.6797 8.2674 123.1778 56.6765 37.2167 174.1556 126 R 4.7090 7.5772 115.0066 55.1695 33.4367 174.4367 127 K 4.5674 8.3007 116.0090 56.1982 33.2666 175.0219 128 R 4.5975 7.7409 115.6552 55.0357 32.8706 173.0870 129 K 4.6589 8.6131 123.3866 58.1568 38.9128 175.4251 130 G 4.2381 7.8394 105.5103 46.0363 0.0000 172.8181 131 S 4.1184 7.8705 118.4116 58.4718 62.5991 173.1944 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 61 S 8.33 4.41 0.00 3.82 3.88 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 62 N 7.71 4.65 0.00 2.68 2.59 0.00 0.00 6.45 6.43 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 63 A 8.00 4.42 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 64 G 8.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 7.61 4.56 0.00 1.87 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.22 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.19 0.00 66 L 8.14 5.12 0.00 1.49 1.58 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 67 C 8.37 4.43 0.00 3.09 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 68 C 8.11 4.85 0.00 2.97 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 69 L 7.78 4.84 0.00 1.50 1.46 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.19 4.65 0.00 1.76 1.82 0.00 3.08 0.00 0.00 3.07 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.49 0.00 71 E 9.14 4.55 0.00 2.16 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 2.31 2.32 0.00 72 D 9.13 4.24 0.00 2.86 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 73 G 8.59 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 74 E 7.59 4.35 0.00 2.21 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 2.27 2.37 0.00 75 R 8.47 4.33 0.00 1.74 1.87 0.00 3.41 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 76 C 8.40 3.79 0.00 3.09 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 77 G 8.13 4.15 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 0.00 0.00 0.00 78 R 7.77 4.16 0.00 1.81 1.74 0.00 3.15 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 79 A 8.59 4.61 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.66 4.19 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.18 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 0.00 0.00 0.00 0.00 82 N 8.75 4.55 0.00 2.70 2.86 0.00 0.00 6.75 7.96 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 83 A 7.67 4.55 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 84 S 8.11 4.95 0.00 3.82 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 85 F 8.81 4.43 0.00 2.90 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 S 7.71 4.81 0.00 3.88 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 87 K 8.36 3.81 0.00 1.70 1.80 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.36 7.81 88 R 7.85 3.84 0.00 1.78 1.86 0.00 3.29 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 89 I 7.17 3.69 1.57 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.46 0.97 0.00 0.00 90 Q 7.22 3.94 0.00 1.89 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 91 K 8.33 3.88 0.00 1.96 1.82 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.56 7.81 92 S 8.46 4.08 0.00 3.88 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 93 I 8.03 3.67 2.09 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.72 1.01 0.00 0.00 94 S 8.05 4.12 0.00 4.04 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 95 Q 7.90 4.10 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.97 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 96 K 7.85 4.06 0.00 1.93 1.87 0.00 1.98 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.67 7.81 97 K 8.35 3.78 0.00 1.85 1.85 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.54 7.81 98 V 7.34 4.54 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 0.85 0.00 0.00 0.94 0.00 0.00 99 K 8.20 4.29 0.00 1.83 1.77 0.00 1.65 0.00 0.00 2.04 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.46 7.81 100 I 7.54 5.03 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.02 0.86 0.00 0.00 101 E 8.50 4.81 0.00 1.96 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 0.00 2.22 2.22 0.00 102 L 8.34 3.88 0.00 0.86 1.40 0.55 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 103 D 7.84 4.68 0.00 2.68 2.46 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 0.00 104 K 8.74 4.20 0.00 1.83 1.80 0.00 1.70 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.39 7.81 105 S 7.70 4.10 0.00 4.10 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 0.00 106 A 7.11 4.44 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 0.00 107 R 8.35 4.58 0.00 1.79 1.97 0.00 3.18 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 108 H 7.96 5.07 0.00 3.41 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 7.65 4.58 0.00 1.32 1.51 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 110 Y 8.05 5.20 0.00 2.94 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 0.00 111 I 8.63 4.76 2.01 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 1.54 1.01 1.04 0.00 0.00 112 C 8.48 4.88 0.00 3.08 3.31 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 0.00 113 D 8.80 4.43 0.00 2.85 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 0.00 114 Y 8.15 4.04 0.00 3.03 2.89 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 0.00 115 H 8.31 4.32 0.00 3.35 3.39 0.00 5.70 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.06 3.92 0.00 2.03 2.02 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.50 7.81 117 N 8.31 4.23 0.00 2.84 2.91 0.00 0.00 6.80 6.84 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 0.00 118 L 7.57 3.82 0.00 1.53 1.72 0.72 0.96 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 0.00 119 I 7.81 3.95 1.94 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 1.54 0.85 0.92 0.00 0.00 120 Q 8.31 4.17 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.09 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 121 S 7.94 4.78 0.00 3.99 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 0.00 122 V 7.48 4.20 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 0.93 0.00 0.00 0.99 0.00 0.00 123 R 7.41 4.54 0.00 1.79 1.87 0.00 3.28 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 124 N 7.82 4.44 0.00 2.58 2.67 0.00 0.00 6.90 7.64 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 0.00 125 R 8.27 4.68 0.00 1.76 1.85 0.00 3.39 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 126 R 7.58 4.71 0.00 1.73 1.74 0.00 3.28 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 1.63 1.59 0.00 127 K 8.30 4.57 0.00 1.67 1.68 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.32 1.48 7.81 128 R 7.74 4.60 0.00 1.74 1.74 0.00 3.37 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.66 0.00 129 K 8.61 4.66 0.00 1.85 1.84 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.40 7.81 130 G 7.84 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 0.00 0.00 0.00 0.00 131 S 7.87 4.12 0.00 3.77 3.66 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 0.00 0.00 0.00 0.00