# 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 G C C 51.51 3.27 11.22 15.86 113.88 -146.64 -67.67 161.77 99.92 0.04 0.04 99.71 0.14 0.09 0.02 0.00 0.00 0.02 0.01 1 K C C 155.32 1.87 8.89 12.25 114.59 -84.07 -91.37 131.74 86.94 2.74 10.32 81.98 1.81 4.05 7.31 2.11 0.00 1.35 1.40 2 K C C 148.83 2.29 7.63 11.71 114.26 -133.42 -89.90 135.63 77.77 6.34 15.89 59.13 11.16 6.92 10.49 5.84 0.00 4.15 2.30 3 R C C 160.93 2.74 7.59 12.19 112.92 -138.73 -86.99 133.88 70.08 8.44 21.48 53.20 9.68 6.58 13.59 8.52 0.01 6.34 2.07 4 K C C 144.40 2.64 8.53 12.81 109.76 -130.97 -85.21 122.66 64.12 10.06 25.82 47.49 9.40 6.76 16.33 10.22 0.02 7.61 2.18 5 K C C 142.46 2.91 8.94 13.48 107.54 -139.23 -85.23 105.03 63.18 9.22 27.60 44.73 10.75 7.32 18.15 10.12 0.03 7.09 1.80 6 K C C 140.57 2.85 9.87 14.18 108.67 -150.71 -88.85 103.42 63.73 10.50 25.76 43.86 11.96 7.60 17.24 9.09 0.05 7.81 2.39 7 V C C 97.34 4.25 9.41 15.15 109.13 62.64 -92.58 85.18 67.36 11.54 21.10 47.86 11.67 7.23 14.75 7.06 0.05 8.17 3.20 8 Y C C 140.73 5.09 8.64 15.20 109.24 71.27 -92.07 95.75 76.35 9.18 14.48 53.95 12.83 8.93 9.99 5.04 0.01 6.17 3.08 9 T C C 103.06 2.35 10.84 14.20 102.60 118.78 -96.56 0.89 84.53 7.01 8.45 53.23 23.11 8.28 5.63 2.97 0.01 4.21 2.55 10 T C C 84.46 3.96 9.37 15.09 118.36 86.16 -102.49 133.52 94.54 3.66 1.79 55.76 37.55 1.66 1.37 0.50 0.00 2.00 1.17 11 P C C 88.74 4.76 8.91 15.51 112.26 -108.49 -67.85 148.60 87.18 2.47 10.34 66.19 12.11 8.88 6.12 4.21 0.00 1.67 0.83 12 K C C 150.77 2.33 9.70 13.64 112.47 -128.98 -87.25 135.61 77.65 7.61 14.74 48.59 19.53 9.68 8.46 6.24 0.01 5.27 2.22 13 K C C 151.24 2.31 9.66 13.49 113.14 -116.72 -89.47 128.56 69.85 14.50 15.64 50.86 12.40 5.93 9.96 6.21 0.03 10.04 4.56 14 I C C 95.79 6.46 7.10 15.06 115.30 -149.30 -97.10 126.37 76.04 11.60 12.36 66.08 6.31 3.11 9.18 3.54 0.01 8.82 2.94 15 K C C 155.94 1.64 10.80 13.21 108.95 -159.92 -90.18 103.26 76.74 9.78 13.48 57.16 13.01 5.94 10.48 3.79 0.02 7.00 2.60 16 H C C 120.52 4.32 8.11 14.18 114.06 69.93 -100.37 123.36 77.25 8.31 14.44 55.48 13.86 7.46 10.43 4.57 0.02 5.56 2.62 17 K C C 142.93 2.79 9.78 14.16 104.06 -158.79 -82.78 0.36 75.42 5.29 19.29 45.88 15.69 13.77 12.43 7.05 0.02 3.53 1.63 18 H C C 128.67 3.79 8.64 14.07 107.00 62.19 -90.18 67.65 75.59 5.19 19.22 41.38 16.98 17.66 11.11 7.91 0.04 3.26 1.67 19 K C C 139.29 3.27 9.69 14.74 105.17 95.47 -84.55 33.05 77.73 5.76 16.51 44.40 17.67 15.87 9.41 7.11 0.02 3.88 1.65 20 K C C 153.78 2.13 11.15 14.45 105.28 57.13 -87.88 44.40 78.28 10.02 11.70 47.69 18.01 12.56 7.46 4.52 0.02 7.55 2.19 21 V C C 71.92 8.19 8.82 18.46 120.05 118.20 -105.62 137.23 75.92 15.91 8.16 56.65 14.71 4.07 6.27 2.39 0.01 13.11 2.80 22 K C C 146.00 2.72 14.41 18.35 113.64 -135.18 -89.50 129.64 71.91 20.01 8.08 57.52 9.19 4.04 6.06 2.34 0.01 18.22 2.63 23 L C C 73.63 12.31 10.81 23.45 119.41 -150.19 -97.36 137.12 64.14 26.33 9.52 54.35 5.99 2.70 6.74 2.79 0.00 23.70 3.73 24 A C C 51.64 7.47 16.54 25.17 115.05 -138.16 -91.33 136.65 58.58 31.26 10.16 49.33 5.74 2.73 6.75 3.38 0.01 27.92 4.15 25 V C C 63.20 12.89 13.81 26.96 113.60 -136.40 -95.02 128.08 42.71 32.56 24.74 34.34 5.36 4.05 10.02 14.10 0.02 28.62 3.49 26 L C E 84.34 8.31 16.79 25.80 101.08 -150.96 -90.23 -29.68 42.04 27.20 30.76 21.23 12.40 12.37 6.78 21.91 0.07 23.52 1.71 27 S C E 44.19 8.62 18.99 28.49 135.62 -0.62 -147.05 151.01 43.54 30.29 26.17 22.39 11.17 12.72 3.82 20.53 0.02 28.38 0.97 28 Y C C 77.16 13.71 15.75 29.84 123.80 -158.88 -117.15 138.50 54.63 40.80 4.57 41.87 9.53 2.90 0.82 3.46 0.00 40.56 0.87 29 Y E E 55.74 13.40 14.38 28.83 128.31 -165.33 -121.48 150.87 11.52 88.42 0.06 10.79 0.70 0.07 0.02 0.03 0.00 87.96 0.43 30 K E E 109.94 5.25 18.44 24.96 125.41 -151.48 -120.26 146.46 1.29 98.70 0.01 1.22 0.08 0.01 0.00 0.00 0.00 98.64 0.05 31 V E E 62.60 11.51 9.86 22.26 117.35 -126.66 -97.51 132.84 2.16 97.83 0.01 2.16 0.07 0.00 0.00 0.00 0.00 95.92 1.84 32 D C C 58.94 4.47 10.87 17.40 124.49 -139.95 -86.41 175.42 96.86 3.12 0.02 97.23 0.23 0.05 0.00 0.01 0.00 2.14 0.35 33 A C T 105.95 0.46 9.30 9.55 89.65 -90.13 -63.26 -21.72 99.51 0.17 0.32 0.30 2.68 96.59 0.01 0.29 0.00 0.11 0.02 34 E C T 157.70 0.49 10.90 10.03 92.47 53.84 -88.09 0.36 99.62 0.06 0.32 0.14 2.48 97.05 0.00 0.28 0.00 0.03 0.01 35 G C S 39.92 6.24 9.76 17.84 95.96 -105.91 83.73 7.23 99.40 0.34 0.26 14.18 84.51 0.83 0.02 0.18 0.00 0.18 0.11 36 K C C 116.87 2.36 14.90 18.13 118.80 137.11 -85.01 143.34 96.27 3.72 0.02 95.44 1.50 0.05 0.00 0.01 0.00 2.38 0.62 37 V E E 56.40 14.58 9.57 24.10 115.31 -126.59 -93.64 129.68 1.35 98.65 0.00 1.43 0.03 0.00 0.00 0.00 0.00 97.87 0.67 38 T E E 68.69 4.83 17.84 23.82 124.99 -172.48 -121.97 143.01 0.76 99.24 0.00 0.75 0.03 0.00 0.00 0.00 0.00 99.18 0.03 39 K E E 103.33 10.99 13.32 24.97 112.23 -118.09 -79.52 127.26 5.48 94.50 0.02 5.29 0.30 0.04 0.00 0.01 0.00 93.79 0.57 40 L C C 70.74 9.00 15.37 25.60 103.06 -161.20 -93.38 -22.82 68.20 31.64 0.16 51.01 14.07 1.04 0.02 0.17 0.00 33.29 0.40 41 R C C 104.90 10.27 15.95 26.63 126.52 -5.27 -139.15 138.09 68.03 31.83 0.14 50.13 15.71 1.10 0.02 0.16 0.00 32.27 0.60 42 R E E 109.14 10.60 17.20 28.39 124.05 -166.94 -113.29 138.19 49.76 50.16 0.08 46.78 2.71 0.22 0.02 0.06 0.00 49.12 1.09 43 E E E 97.09 9.17 18.70 28.45 121.17 -143.84 -101.68 142.67 14.43 85.51 0.06 12.89 0.59 0.03 0.06 0.01 0.00 49.19 37.23 44 C C C 17.03 19.26 9.75 28.65 114.93 -118.60 -78.12 136.20 80.91 19.06 0.04 80.54 1.39 0.09 0.01 0.03 0.00 15.63 2.31 45 S C S 88.68 1.81 18.80 20.46 93.45 -142.60 -79.76 -13.26 98.20 1.77 0.03 43.83 53.96 0.73 0.00 0.03 0.00 1.14 0.30 46 N C S 61.01 8.12 11.60 21.64 120.76 83.85 -101.30 138.42 97.50 2.36 0.14 9.85 86.38 1.46 0.03 0.07 0.00 0.79 1.42 47 P C T 117.40 1.92 14.10 17.21 91.30 -130.60 -64.67 -21.73 98.43 0.36 1.20 1.08 19.31 77.97 0.04 1.26 0.00 0.23 0.11 48 T C T 99.43 2.75 16.77 20.17 94.54 58.35 -85.31 -12.45 97.30 1.00 1.70 1.98 17.62 77.63 0.10 1.69 0.00 0.68 0.29 49 C C C 22.09 18.65 10.44 28.18 109.01 64.00 -96.11 52.16 85.17 12.03 2.79 43.59 28.09 11.30 0.55 2.35 0.01 3.15 10.95 50 G C C 26.21 7.19 19.52 27.58 127.76 -152.65 71.23 -175.13 94.82 3.98 1.20 78.84 10.19 5.08 0.23 1.14 0.00 1.67 2.86 51 A C T 68.52 6.91 19.81 27.26 104.59 -50.68 -64.55 130.43 96.94 1.65 1.40 2.14 9.11 85.59 0.10 1.44 0.00 1.07 0.56 52 G C T 26.87 11.43 20.47 31.93 95.36 41.10 78.32 -1.84 97.52 1.23 1.25 4.16 9.66 83.24 0.04 1.68 0.00 1.08 0.14 53 V C C 21.29 18.00 18.33 36.77 118.38 118.11 -85.45 136.86 66.81 32.95 0.23 60.59 5.28 0.32 0.04 0.20 0.00 31.64 1.93 54 F E E 35.39 16.13 23.93 39.77 128.24 -165.03 -119.87 147.22 11.13 88.85 0.02 10.56 0.50 0.03 0.01 0.01 0.00 86.82 2.06 55 L E E 26.44 18.95 21.43 39.92 117.54 -123.72 -93.98 136.21 5.77 94.22 0.01 5.67 0.14 0.01 0.00 0.00 0.00 94.03 0.15 56 A E E 14.10 16.55 19.09 36.19 132.37 -174.59 -130.06 154.43 1.78 98.21 0.01 1.64 0.09 0.01 0.00 0.00 0.00 98.20 0.06 57 N E E 78.96 9.19 17.86 27.87 118.30 -127.58 -102.29 131.21 3.48 96.49 0.02 2.93 0.43 0.05 0.00 0.01 0.00 96.32 0.25 58 H E E 68.81 11.37 11.28 23.58 121.06 175.34 -131.34 124.68 36.36 63.52 0.12 32.25 3.18 0.41 0.02 0.10 0.00 63.38 0.66 59 K C T 169.32 1.04 14.21 14.77 98.63 -37.76 52.90 -17.91 98.70 1.04 0.26 1.79 35.76 61.21 0.01 0.28 0.00 0.85 0.10 60 D C T 127.16 1.50 13.25 15.20 96.27 -31.57 -22.67 11.17 99.12 0.69 0.19 1.87 33.91 63.37 0.00 0.21 0.00 0.57 0.06 61 R E E 98.32 7.76 13.58 23.04 129.54 91.93 -121.25 148.58 27.61 72.36 0.04 22.51 3.83 0.26 0.00 0.03 0.00 72.98 0.38 62 L E E 57.14 13.02 15.80 29.65 118.50 -143.34 -105.96 130.48 3.34 96.66 0.00 2.93 0.17 0.01 0.00 0.00 0.00 96.82 0.07 63 Y E E 56.41 12.15 20.67 33.74 132.27 -176.34 -132.63 149.23 1.45 98.55 0.00 1.23 0.08 0.00 0.00 0.00 0.00 98.56 0.13 64 C E E 21.96 17.80 17.42 35.44 125.41 -149.84 -116.63 140.34 20.68 79.27 0.04 17.78 1.92 0.16 0.01 0.03 0.00 79.77 0.32 65 G C S 22.39 10.48 21.21 31.83 130.87 33.97 98.61 -165.17 77.80 15.10 7.10 14.48 35.93 27.80 0.42 6.86 0.01 13.27 1.22 66 K C T 126.16 6.15 21.20 28.16 93.21 -49.01 -71.59 -19.74 85.92 6.14 7.94 6.18 34.02 46.14 0.48 7.53 0.01 4.45 1.19 67 C C T 32.83 16.14 17.02 33.16 98.18 53.68 -97.44 2.25 79.50 12.76 7.74 14.98 24.89 40.26 0.65 7.32 0.02 10.10 1.79 68 H C C 52.81 17.92 16.52 33.54 122.07 102.34 -103.86 139.18 63.34 33.32 3.33 44.12 13.76 6.07 0.78 2.80 0.01 28.89 3.56 69 S E E 42.85 10.38 21.40 32.11 120.99 -157.63 -102.35 138.60 46.44 52.50 1.06 39.04 5.22 1.78 0.31 0.80 0.00 51.01 1.85 70 V E E 60.47 15.06 15.53 30.30 123.14 -158.39 -116.08 136.21 25.77 73.71 0.53 21.83 2.93 0.71 0.18 0.34 0.00 72.60 1.41 71 Y E E 100.62 9.37 16.54 26.99 123.31 -167.07 -119.23 138.39 14.74 84.86 0.40 12.84 1.41 0.42 0.17 0.23 0.00 83.63 1.28 72 K E E 120.27 7.15 14.27 22.87 117.84 -148.74 -104.60 131.91 16.28 83.25 0.47 14.36 1.23 0.45 0.21 0.26 0.00 82.08 1.41 73 V E E 72.01 8.98 10.39 20.67 119.77 -164.40 -111.55 134.61 34.60 64.67 0.73 29.51 3.44 1.17 0.28 0.44 0.00 63.13 2.03 74 N C C 127.83 1.62 12.15 14.78 112.23 -130.80 -89.88 120.92 61.44 37.97 0.59 57.42 1.38 1.25 0.20 0.31 0.00 37.38 2.06 75 A C C 70.14 6.67 10.44 18.32 106.37 -134.36 -81.99 96.44 99.74 0.25 0.01 99.70 0.08 0.03 0.00 0.00 0.00 0.18 0.01