NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 79 T 4.2918 8.1749 117.3733 63.5276 69.3674 172.9079 80 D 4.4994 7.6563 122.7725 52.1956 42.2864 175.6576 81 S 4.5648 9.5384 116.9067 57.5685 66.6352 174.5163 82 E 4.1314 8.7402 122.6530 59.5475 28.8543 178.6297 83 E 4.1427 8.1667 116.8910 58.8442 29.5238 178.8697 84 E 4.0333 7.9855 119.4630 59.5866 29.6458 179.2994 85 I 3.9890 8.3891 120.0336 64.1354 37.0442 178.4987 86 R 4.3042 8.2045 119.6548 59.2520 29.6564 178.2642 87 E 4.0206 7.9063 117.1816 59.3915 29.8468 178.8589 88 A 4.3163 7.9861 120.3064 55.1496 18.4750 179.3384 89 F 3.3300 8.4619 119.2426 61.4495 39.2076 177.6038 90 R 3.8622 8.1865 116.5236 58.9352 29.8191 178.8501 91 V 3.7041 7.4421 117.5448 66.0600 31.5853 177.8408 92 F 4.1136 8.0908 115.7586 59.8518 40.3599 176.6003 93 D 4.6691 7.6142 119.1418 52.3346 37.1516 176.1507 94 K 3.7867 7.7964 123.8619 59.5673 32.7564 177.9335 95 D 4.6123 8.2106 115.9946 52.5856 40.1140 176.2079 96 G 3.7229 8.5506 107.7424 48.6119 0.0000 173.6610 97 N 4.2681 7.7981 118.8651 52.6500 37.9861 175.3355 98 G 4.0221 8.0849 108.9620 44.9604 0.0000 172.6203 99 Y 5.4059 7.8868 114.3112 56.6034 43.2629 176.2917 100 I 4.7326 9.1054 123.1775 59.8938 39.8541 175.9274 101 S 4.9622 8.6522 121.6362 56.7526 65.6126 175.1856 102 A 4.0473 8.5900 120.5046 55.1595 17.9852 179.5912 103 A 3.9607 7.9343 118.9881 55.3797 18.5541 179.5934 104 E 4.0205 8.2208 116.9339 59.3424 29.4836 179.3294 105 L 4.0815 7.9481 120.2140 58.0348 42.1800 178.9567 106 R 3.8987 8.2591 118.9122 59.6089 29.9842 178.3237 107 H 4.1432 8.0617 115.7414 58.6737 28.6814 177.9333 108 V 3.4557 7.7115 120.0204 66.2602 31.2867 177.9564 109 M 4.0394 8.1128 118.3980 58.7772 31.7463 178.9553 110 T 4.0813 7.9020 117.1190 66.2265 68.3862 176.5690 111 N 4.4219 8.0849 117.4070 55.6795 38.5359 176.1265 112 L 4.5878 7.8601 118.9542 54.6702 42.7227 177.6528 113 G 3.8381 7.8502 105.4102 45.5527 0.0000 173.9643 114 E 4.4808 8.4902 119.8318 54.0275 31.0949 175.3864 115 K 4.1617 8.5698 124.4111 55.6140 32.7171 176.7411 116 L 5.1563 8.3996 122.5715 51.3383 45.4669 176.8687 117 T 4.3576 8.2309 111.5546 60.9691 71.3945 175.5018 118 D 4.3330 8.4976 120.6731 57.5037 40.6711 178.7641 119 E 3.9271 8.0859 119.3458 59.2671 29.6115 178.5739 120 E 3.9510 8.0307 118.3981 59.3429 29.5416 179.4633 121 V 3.6136 8.0101 118.4474 66.0145 31.6095 177.5441 122 D 4.3443 8.4220 118.0614 57.3452 40.9702 177.9765 123 E 3.9707 8.3283 119.2107 59.8329 29.3608 179.3437 124 M 4.0828 8.2429 118.6184 58.4443 31.9246 178.9669 125 I 3.7596 7.9334 119.9889 64.1867 37.0506 178.3284 126 R 3.8546 8.2864 118.8311 59.6121 30.0180 177.5636 127 E 4.0016 8.1829 117.4956 59.1437 29.5851 177.9846 128 A 4.5045 7.5885 118.4771 52.4938 20.9229 178.3054 129 D 4.6478 8.0671 118.5968 53.1968 37.6768 176.0598 130 I 3.6782 7.8178 124.5241 64.1691 37.6032 177.4164 131 D 4.4014 8.5788 116.8881 53.8572 39.6185 177.1954 132 G 3.8750 8.0416 108.2027 46.3205 0.0000 173.6944 133 D 4.5001 9.1399 117.3071 53.1264 39.3266 177.5583 134 G 3.9774 9.5615 109.3222 45.6129 0.0000 173.2835 135 Q 4.5730 7.8161 115.4711 54.4643 31.9725 174.4317 136 V 4.4331 8.5441 118.8726 61.4418 32.4439 175.5009 137 N 5.2258 9.1239 126.9724 52.0008 40.6176 174.9056 138 Y 3.2278 8.2602 119.7587 60.7151 38.8461 177.8444 139 E 3.8369 8.1246 118.0911 59.5763 29.5305 178.8146 140 E 4.0081 8.1027 118.0253 58.6458 29.9562 178.8087 141 F 4.2417 7.9286 120.6753 61.2592 39.3213 177.0243 142 V 3.4581 7.2312 116.4555 67.0513 31.2415 177.0569 143 Q 3.5815 7.8282 113.3195 60.7193 28.7444 178.0098 144 M 4.1426 7.7976 119.5425 57.9290 32.4362 178.7242 145 M 4.1511 7.1363 114.8955 56.5852 31.4042 177.7318 146 T 3.9086 8.2354 117.2088 65.8087 68.8559 174.5746 147 A 4.1137 7.5255 126.9524 52.6886 18.9849 175.8199 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 79 T 8.17 4.29 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 1.20 0.00 0.00 80 D 7.66 4.50 0.00 2.78 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 81 S 9.54 4.56 0.00 4.02 4.01 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 82 E 8.74 4.13 0.00 2.15 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 0.00 2.42 2.53 0.00 83 E 8.17 4.14 0.00 2.26 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 2.38 2.42 0.00 84 E 7.99 4.03 0.00 2.40 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 0.00 2.37 2.38 0.00 85 I 8.39 3.99 2.03 0.00 0.00 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 1.45 0.67 1.09 0.00 0.00 86 R 8.20 4.30 0.00 1.86 1.95 0.00 2.89 0.00 0.00 2.58 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 87 E 7.91 4.02 0.00 2.19 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 0.00 2.39 2.66 0.00 88 A 7.99 4.32 1.63 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 0.00 0.00 89 F 8.46 3.33 0.00 3.14 3.35 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 90 R 8.19 3.86 0.00 2.05 2.00 0.00 3.41 0.00 0.00 3.18 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 91 V 7.44 3.70 2.41 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 0.66 0.00 0.00 1.01 0.00 0.00 92 F 8.09 4.11 0.00 2.64 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 93 D 7.61 4.67 0.00 2.04 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 0.00 0.00 0.00 0.00 94 K 7.80 3.79 0.00 1.74 1.83 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.39 7.81 95 D 8.21 4.61 0.00 2.78 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 96 G 8.55 3.72 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 0.00 0.00 0.00 97 N 7.80 4.27 0.00 2.90 2.95 0.00 0.00 7.12 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 98 G 8.08 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 0.00 0.00 0.00 99 Y 7.89 5.41 0.00 2.85 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.11 4.73 1.95 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.86 1.02 0.00 0.00 101 S 8.65 4.96 0.00 3.90 4.05 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 0.00 102 A 8.59 4.05 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 0.00 103 A 7.93 3.96 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 0.00 104 E 8.22 4.02 0.00 2.10 2.21 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 2.33 2.34 0.00 105 L 7.95 4.08 0.00 2.04 1.81 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.26 3.90 0.00 2.00 2.01 0.00 3.10 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 107 H 8.06 4.14 0.00 3.38 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.71 3.46 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 0.60 0.00 0.00 0.62 0.00 0.00 109 M 8.11 4.04 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.94 0.00 110 T 7.90 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 1.20 0.00 0.00 111 N 8.08 4.42 0.00 2.90 2.84 0.00 0.00 7.06 7.19 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 0.00 112 L 7.86 4.59 0.00 1.58 1.65 0.85 0.76 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 0.00 113 G 7.85 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 0.00 0.00 0.00 114 E 8.49 4.48 0.00 2.03 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 2.21 2.38 0.00 115 K 8.57 4.16 0.00 1.74 1.75 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.45 7.81 116 L 8.40 5.16 0.00 1.58 1.52 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.23 4.36 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 0.00 118 D 8.50 4.33 0.00 2.74 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 0.00 119 E 8.09 3.93 0.00 2.03 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 2.38 2.40 0.00 120 E 8.03 3.95 0.00 2.20 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 2.33 2.40 0.00 121 V 8.01 3.61 2.22 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 1.05 0.00 0.00 0.97 0.00 0.00 122 D 8.42 4.34 0.00 2.93 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.33 3.97 0.00 2.33 2.00 0.00 0.00 0.00 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 2.36 0.00 124 M 8.24 4.08 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.61 0.00 125 I 7.93 3.76 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.65 0.97 0.00 0.00 126 R 8.29 3.85 0.00 1.81 2.13 0.00 3.29 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 127 E 8.18 4.00 0.00 2.25 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 0.00 2.33 2.50 0.00 128 A 7.59 4.50 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 0.00 129 D 8.07 4.65 0.00 2.91 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.82 3.68 1.99 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 1.47 0.81 0.91 0.00 0.00 131 D 8.58 4.40 0.00 2.76 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 0.00 132 G 8.04 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 0.00 0.00 0.00 133 D 9.14 4.50 0.00 2.63 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 0.00 134 G 9.56 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 0.00 135 Q 7.82 4.57 0.00 2.30 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.64 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 136 V 8.54 4.43 2.21 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 1.28 0.00 0.00 1.01 0.00 0.00 137 N 9.12 5.23 0.00 3.24 3.43 0.00 0.00 6.20 7.08 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 0.00 138 Y 8.26 3.23 0.00 2.56 2.81 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 0.00 139 E 8.12 3.84 0.00 2.22 2.21 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 2.57 2.41 0.00 140 E 8.10 4.01 0.00 2.17 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 0.00 2.34 2.40 0.00 141 F 7.93 4.24 0.00 3.26 2.91 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 0.00 0.00 0.00 142 V 7.23 3.46 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 0.79 0.00 0.00 0.30 0.00 0.00 143 Q 7.83 3.58 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 144 M 7.80 4.14 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 145 M 7.14 4.15 0.00 1.75 1.74 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.92 0.00 146 T 8.24 3.91 4.19 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 0.00 0.00 0.00 1.17 0.00 0.00 147 A 7.53 4.11 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