# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 A C C 66.74 5.78 11.06 18.34 113.99 -130.93 -77.60 139.53 99.81 0.07 0.12 99.67 0.11 0.09 0.08 0.01 0.00 0.03 0.01 1 K C C 138.77 2.96 10.07 14.64 111.36 -138.13 -85.66 131.24 76.07 1.07 22.87 71.57 0.97 3.11 22.54 0.92 0.00 0.41 0.48 2 T H H 93.52 3.02 9.43 13.95 106.96 -156.00 -81.65 84.06 47.69 1.25 51.07 35.55 5.51 6.11 49.82 1.97 0.00 0.60 0.43 3 S H H 68.13 3.18 10.10 14.66 99.77 57.23 -72.10 -32.16 32.94 0.97 66.09 24.22 4.20 5.13 63.43 2.22 0.00 0.51 0.29 4 M H H 107.49 2.85 11.43 15.37 95.32 55.70 -69.00 -35.46 14.07 0.91 85.03 10.28 2.29 2.98 81.29 2.38 0.01 0.59 0.19 5 V H H 76.29 3.38 12.03 16.75 93.59 53.12 -66.85 -40.91 8.91 0.96 90.13 6.16 1.46 2.35 86.89 2.22 0.01 0.75 0.16 6 A H H 54.45 3.30 12.26 16.89 92.78 51.06 -65.72 -40.08 8.50 0.75 90.75 5.44 1.32 2.63 87.52 2.36 0.01 0.59 0.14 7 K H H 121.35 2.21 12.78 15.63 92.94 51.35 -66.95 -38.23 10.94 0.56 88.50 5.86 1.75 4.12 85.12 2.61 0.02 0.37 0.15 8 Q H H 102.94 2.72 12.29 16.04 93.54 52.08 -68.38 -35.29 17.43 0.42 82.14 7.42 2.77 7.82 79.17 2.43 0.02 0.22 0.16 9 Q H H 110.74 2.87 11.89 15.85 94.52 54.71 -71.77 -28.69 31.19 0.51 68.30 13.95 5.54 12.19 65.54 2.30 0.02 0.22 0.24 10 K H H 125.35 3.22 10.86 15.32 97.47 58.99 -75.11 -27.99 44.72 0.79 54.50 25.12 8.26 11.60 51.41 2.90 0.01 0.34 0.35 11 K C H 136.41 2.51 11.07 14.69 97.86 61.76 -75.50 -24.51 52.25 0.99 46.76 32.55 7.98 11.88 41.85 4.83 0.01 0.47 0.44 12 Q C C 117.90 3.26 10.06 14.76 102.53 65.37 -80.33 5.87 58.82 1.10 40.08 36.58 8.17 13.81 33.33 7.01 0.01 0.54 0.54 13 K C C 142.39 2.57 10.57 14.40 100.93 82.76 -81.00 -14.81 62.50 1.47 36.03 33.83 12.27 16.72 28.24 7.48 0.03 0.67 0.76 14 Y C C 143.07 4.33 9.19 15.10 108.57 64.10 -94.40 73.31 67.68 2.28 30.03 39.53 15.65 12.87 23.05 6.64 0.02 1.01 1.23 15 A C C 75.44 3.20 11.04 15.70 106.03 113.01 -82.36 51.00 69.79 2.88 27.33 38.66 19.46 12.06 21.01 6.11 0.02 1.48 1.20 16 V C C 92.34 5.20 9.95 16.78 111.52 71.52 -94.26 116.70 64.64 6.89 28.48 40.27 13.99 10.59 20.13 8.31 0.06 3.98 2.67 17 R C C 140.02 5.58 11.56 18.71 112.30 -157.66 -91.15 126.20 66.03 8.90 25.07 44.16 12.36 9.42 16.87 8.54 0.06 5.95 2.62 18 E C C 126.05 4.20 14.24 19.63 102.72 -154.19 -88.67 4.52 66.03 12.35 21.63 45.03 10.53 10.05 13.04 9.00 0.05 9.27 3.04 19 Y C C 105.59 9.29 14.45 24.62 120.55 74.03 -110.46 136.25 72.37 17.01 10.61 56.26 10.12 5.25 6.85 4.28 0.02 13.46 3.76 20 T C C 48.57 12.14 15.57 28.45 112.03 -162.65 -105.30 103.18 73.55 21.72 4.72 59.34 9.73 3.84 2.95 2.00 0.01 19.44 2.70 21 R E B 112.73 7.20 19.80 27.87 125.29 93.90 -112.78 144.32 31.88 67.45 0.67 25.81 2.00 0.18 0.54 0.12 0.00 16.58 54.75 22 C C C 12.20 19.01 10.73 30.30 111.13 -110.75 -69.59 132.99 92.98 6.91 0.12 93.20 0.68 0.12 0.05 0.04 0.00 3.43 2.48 23 E C T 127.13 3.57 18.01 22.64 92.84 -144.77 -69.91 -27.87 99.59 0.14 0.27 1.12 7.44 91.10 0.02 0.18 0.00 0.08 0.07 24 R C T 126.69 5.95 16.23 23.31 99.35 43.41 -82.42 -40.90 99.70 0.08 0.22 0.10 3.12 96.59 0.01 0.12 0.00 0.03 0.03 25 C C T 56.90 7.29 14.25 23.07 102.52 19.48 -108.26 -13.88 99.73 0.08 0.19 0.28 4.23 95.28 0.01 0.12 0.00 0.04 0.03 26 G C C 45.97 4.59 15.48 21.47 95.57 -120.80 79.79 5.34 99.23 0.65 0.12 75.52 19.22 4.39 0.03 0.10 0.00 0.24 0.49 27 R C C 104.54 6.82 15.03 23.57 116.44 134.64 -84.08 139.85 95.97 3.96 0.07 79.30 16.58 0.32 0.02 0.05 0.00 1.26 2.48 28 P C S 73.05 7.28 17.87 25.94 112.02 -110.50 -67.14 148.00 51.66 47.58 0.76 19.56 26.53 4.17 0.30 0.53 0.02 24.70 24.19 29 H C S 87.87 11.10 18.60 29.56 116.45 4.09 -95.34 122.65 82.51 17.11 0.39 35.69 38.85 8.08 0.02 0.55 0.00 15.58 1.23 30 S C C 22.64 14.28 17.36 32.39 127.80 161.32 -121.24 151.68 63.56 36.18 0.26 55.66 6.64 0.63 0.05 0.25 0.00 34.40 2.37 31 V E E 48.95 11.60 18.84 31.48 119.22 -138.44 -111.65 130.51 16.72 83.20 0.08 12.34 4.93 0.17 0.04 0.05 0.00 77.71 4.76 32 Y E E 45.51 14.37 13.67 29.35 110.78 -157.41 -103.25 112.34 6.25 93.66 0.10 5.24 0.57 0.08 0.06 0.04 0.00 84.57 9.43 33 R C T 149.85 4.41 15.33 21.30 95.01 -167.73 -68.52 -34.37 60.92 1.71 37.37 1.52 2.93 54.32 0.56 39.19 0.00 1.34 0.14 34 K C T 147.38 1.90 16.36 18.24 93.10 49.39 -67.78 -38.32 62.19 0.24 37.57 0.45 1.64 58.00 0.55 39.17 0.00 0.15 0.05 35 F C T 77.03 10.11 13.79 25.03 98.68 30.22 -102.29 -2.35 59.34 0.12 40.53 0.45 1.38 55.87 0.93 41.27 0.00 0.07 0.03 36 K C T 116.95 6.83 19.46 27.40 94.09 -126.10 60.00 37.36 98.12 1.37 0.51 3.57 2.60 92.34 0.08 0.29 0.00 1.03 0.09 37 L E E 18.17 17.39 16.87 34.98 132.57 129.86 -125.04 155.09 7.78 92.16 0.07 5.96 1.80 0.14 0.05 0.03 0.00 80.37 11.64 38 C E E 16.83 14.35 20.41 35.81 118.63 -108.32 -71.80 153.89 27.63 72.31 0.07 28.76 0.35 0.03 0.07 0.02 0.00 65.06 5.71 39 R H H 79.75 14.20 19.32 33.67 91.67 -113.47 -58.99 -38.49 4.88 0.08 95.04 0.43 0.73 3.48 94.97 0.30 0.03 0.04 0.02 40 I H H 75.49 5.79 23.97 30.17 91.68 53.85 -63.59 -41.70 1.62 0.03 98.35 0.12 0.16 1.39 98.06 0.22 0.03 0.01 0.01 41 C H H 17.86 14.19 20.75 35.72 91.72 48.93 -64.64 -42.46 0.40 0.00 99.59 0.05 0.03 0.28 99.42 0.22 0.00 0.00 0.00 42 F H H 11.26 22.83 17.52 40.30 91.64 50.43 -63.69 -43.11 0.08 0.00 99.92 0.01 0.00 0.04 99.90 0.04 0.00 0.00 0.00 43 R H H 99.85 9.11 21.97 31.21 91.57 50.41 -63.54 -42.06 0.09 0.00 99.91 0.01 0.00 0.06 99.91 0.02 0.00 0.00 0.00 44 E H H 86.57 4.13 22.37 26.34 91.73 49.26 -64.65 -42.30 0.10 0.00 99.90 0.00 0.00 0.07 99.90 0.02 0.00 0.00 0.00 45 L H H 22.06 12.77 16.88 31.27 91.77 49.09 -64.55 -41.93 0.19 0.00 99.81 0.01 0.01 0.13 99.80 0.05 0.00 0.00 0.00 46 A H H 21.01 14.68 13.66 29.05 91.95 50.69 -63.48 -42.03 0.45 0.00 99.55 0.03 0.01 0.34 99.45 0.17 0.00 0.00 0.00 47 Y H H 157.52 2.77 16.78 20.28 91.72 50.44 -65.99 -33.01 2.68 0.00 97.31 0.05 0.06 2.73 96.92 0.23 0.00 0.00 0.00 48 K C T 132.59 2.27 15.44 17.89 92.63 51.16 -86.01 -3.45 66.79 0.02 33.19 0.14 0.70 66.25 32.42 0.46 0.00 0.00 0.02 49 G C T 49.01 5.18 13.56 20.34 94.47 -112.14 79.09 13.36 99.21 0.01 0.78 0.70 2.00 96.63 0.59 0.06 0.00 0.00 0.01 50 Q C S 101.04 5.30 16.16 22.82 95.01 124.19 -77.03 -22.26 99.41 0.49 0.10 28.15 69.72 1.55 0.04 0.05 0.00 0.15 0.34 51 I C S 24.67 19.49 10.52 29.52 114.62 36.71 -125.63 104.54 98.79 1.02 0.19 35.11 62.83 0.88 0.05 0.12 0.00 0.34 0.68 52 P C T 83.14 4.49 18.96 24.24 112.05 -137.02 -67.18 137.99 98.49 0.75 0.76 13.92 13.51 70.84 0.09 0.80 0.00 0.45 0.39 53 G C T 45.14 5.07 18.20 23.91 98.57 18.40 85.85 -2.12 96.02 2.87 1.12 12.77 12.40 70.72 0.14 1.17 0.00 2.23 0.58 54 V C C 39.31 18.31 9.90 27.53 115.57 132.78 -86.17 130.25 83.10 16.04 0.85 75.91 6.06 1.01 0.32 0.57 0.00 8.64 7.49 55 R C C 141.83 3.54 17.43 22.28 125.68 -171.10 -123.42 146.80 76.90 21.54 1.56 71.03 3.82 1.29 0.66 0.94 0.00 15.88 6.38 56 K C C 127.03 6.57 12.95 21.10 114.15 -105.63 -71.98 140.66 71.33 18.53 10.13 52.87 11.44 6.86 2.23 8.21 0.01 15.57 2.81 57 A C C 62.69 7.93 8.90 17.99 110.25 -119.69 -79.59 135.03 80.83 6.76 12.41 49.92 16.50 13.63 1.25 12.43 0.00 5.31 0.97 58 S C C 91.85 1.59 10.38 12.86 105.63 -146.67 -92.37 26.48 85.91 4.76 9.33 71.17 3.66 11.24 1.34 7.93 0.00 3.60 1.05 59 W C C 169.52 4.50 10.55 16.59 104.35 94.70 -88.36 19.62 99.65 0.28 0.07 99.46 0.19 0.12 0.02 0.01 0.00 0.17 0.04