# 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 D C C 105.21 3.38 20.20 23.76 103.38 -123.66 -79.89 58.41 99.80 0.20 0.00 99.70 0.12 0.03 0.00 0.00 0.00 0.14 0.01 1 I C C 38.22 20.14 10.40 29.24 118.55 -165.08 -99.95 130.55 65.37 34.52 0.11 64.15 0.60 0.20 0.02 0.06 0.00 34.25 0.72 2 Q E E 102.43 4.61 21.28 26.79 122.81 -167.69 -116.06 136.95 26.45 73.37 0.18 23.89 1.81 0.31 0.05 0.11 0.00 73.10 0.73 3 M E E 47.37 20.37 12.78 32.07 124.02 -161.58 -116.69 136.19 11.57 88.32 0.11 10.86 0.69 0.12 0.04 0.05 0.00 87.25 0.98 4 T E E 63.39 7.54 20.88 29.16 124.63 -170.27 -122.74 143.13 14.07 85.81 0.12 12.59 1.24 0.19 0.05 0.07 0.00 84.20 1.66 5 Q E E 77.55 14.27 15.78 29.76 125.55 -160.74 -123.23 141.42 43.96 55.86 0.18 33.98 9.45 0.73 0.04 0.16 0.00 54.42 1.21 6 S C C 52.12 10.33 16.78 27.78 121.03 -139.83 -98.61 148.96 83.37 16.46 0.17 60.48 21.26 1.00 0.02 0.17 0.00 16.35 0.71 7 P C C 57.40 9.10 16.61 26.63 115.33 6.74 -72.66 151.47 89.18 9.45 1.37 61.25 21.40 5.82 0.16 1.48 0.00 9.25 0.64 8 S C S 69.53 8.39 16.40 25.74 97.63 -152.86 -85.45 -19.86 77.50 21.36 1.14 27.52 43.30 6.23 0.10 1.12 0.00 20.82 0.91 9 S E E 58.25 6.32 20.03 27.55 135.27 17.63 -146.31 149.67 26.44 71.99 1.57 19.39 6.62 2.33 0.26 1.25 0.00 69.20 0.94 10 L E E 37.41 19.25 14.26 32.79 129.86 -175.75 -136.83 143.80 11.22 88.42 0.36 9.71 1.41 0.31 0.12 0.21 0.00 87.55 0.70 11 S E E 66.19 6.15 22.66 30.14 126.81 -162.64 -122.22 142.98 9.22 90.54 0.23 7.89 1.24 0.28 0.08 0.13 0.00 89.62 0.76 12 A E E 16.65 18.64 14.11 32.72 138.70 168.93 -146.29 158.30 24.87 74.71 0.42 20.55 3.65 0.72 0.12 0.29 0.00 73.76 0.90 13 S E E 57.07 4.63 22.96 27.43 123.33 -114.69 -91.29 157.16 47.44 51.64 0.92 36.75 8.49 2.61 0.28 0.79 0.00 47.29 3.79 14 V C T 64.09 14.48 13.80 28.28 109.34 -83.62 -60.91 134.39 92.32 5.58 2.10 3.37 11.77 77.63 0.21 1.86 0.00 4.31 0.85 15 G C T 46.33 4.45 19.44 24.59 96.39 22.07 88.56 -6.35 96.72 1.69 1.59 4.36 14.86 77.41 0.12 1.60 0.00 1.38 0.27 16 D C S 63.18 8.58 17.16 26.79 123.79 114.07 -84.78 155.11 90.81 8.01 1.18 37.45 48.14 5.59 0.15 1.11 0.00 6.58 0.99 17 R C C 127.72 7.94 19.40 28.34 119.42 -118.09 -97.47 136.86 67.70 32.22 0.08 63.98 2.21 0.22 0.01 0.06 0.00 32.96 0.55 18 V E E 12.55 22.33 14.29 36.65 125.77 -167.50 -121.80 139.37 3.44 96.55 0.00 3.33 0.09 0.00 0.00 0.00 0.00 96.42 0.16 19 T E E 61.99 8.10 25.01 33.61 119.08 -149.60 -109.44 129.48 0.69 99.31 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.31 0.01 20 I E E 5.88 25.27 16.64 42.56 120.98 -168.23 -117.05 129.76 1.33 98.66 0.00 1.22 0.04 0.00 0.00 0.00 0.00 98.72 0.02 21 T E E 43.45 9.32 26.81 36.88 120.50 -164.14 -112.20 134.11 4.98 95.01 0.00 4.47 0.16 0.01 0.00 0.00 0.00 95.32 0.04 22 C E E 4.38 25.69 16.62 42.81 125.36 -172.16 -123.99 138.93 6.81 93.19 0.01 6.18 0.25 0.01 0.00 0.00 0.00 93.45 0.10 23 R E E 105.21 7.17 27.10 34.99 120.57 -162.21 -117.13 130.40 4.65 95.34 0.02 4.32 0.22 0.02 0.01 0.01 0.00 94.83 0.58 24 A E E 10.72 23.40 13.66 36.57 121.82 -160.74 -103.27 142.36 32.24 67.59 0.17 30.86 1.27 0.20 0.05 0.11 0.00 65.29 2.22 25 S C C 57.04 6.54 20.39 27.41 113.77 -143.99 -91.16 146.28 80.82 18.76 0.42 49.62 28.35 2.77 0.06 0.43 0.00 17.80 0.97 26 Q C S 111.46 5.57 17.83 24.02 114.84 -32.98 -103.88 133.75 91.70 7.35 0.96 22.65 57.93 11.34 0.10 0.92 0.00 6.14 0.92 27 S C C 66.01 6.78 17.35 25.11 114.29 -0.96 -94.64 136.09 93.63 5.03 1.34 51.72 29.79 12.14 0.18 1.46 0.00 3.66 1.06 28 V C C 64.42 12.98 16.37 29.23 109.71 -111.52 -92.73 95.77 90.42 7.73 1.85 43.77 31.95 15.10 0.28 1.84 0.00 5.00 2.07 29 S C C 33.13 14.07 18.36 32.43 122.85 80.89 -109.82 145.87 89.29 9.46 1.25 60.10 18.96 9.99 0.15 1.39 0.00 8.05 1.35 30 S C S 47.78 12.46 20.83 33.12 101.23 -158.88 -96.46 -7.48 84.66 14.92 0.43 34.09 47.11 2.95 0.04 0.41 0.00 14.73 0.68 31 A E E 27.76 12.92 24.27 37.57 129.49 45.92 -126.57 145.96 25.11 74.64 0.25 20.72 3.58 0.53 0.04 0.20 0.00 74.32 0.60 32 V E E 3.29 26.14 19.29 45.98 124.88 -163.16 -123.77 135.13 3.63 96.35 0.01 3.34 0.20 0.02 0.00 0.01 0.00 96.33 0.10 33 A E E 16.79 15.48 27.59 43.20 125.12 -166.80 -119.63 140.99 0.79 99.21 0.00 0.71 0.03 0.00 0.00 0.00 0.00 99.25 0.01 34 W E E 9.68 24.31 21.56 45.85 123.66 -155.27 -111.20 138.19 0.60 99.40 0.00 0.54 0.02 0.00 0.00 0.00 0.00 99.43 0.01 35 Y E E 28.65 15.74 23.52 39.55 132.23 -174.10 -130.95 150.99 0.58 99.42 0.00 0.50 0.02 0.00 0.00 0.00 0.00 99.45 0.02 36 Q E E 42.53 14.58 20.86 35.74 121.41 -145.63 -112.68 134.91 2.82 97.17 0.00 2.30 0.28 0.01 0.00 0.00 0.00 97.33 0.07 37 Q E E 56.76 13.21 15.35 29.27 118.90 -147.71 -105.14 134.94 27.75 72.23 0.02 25.04 1.79 0.07 0.00 0.02 0.00 72.08 1.00 38 K C C 97.14 6.22 14.78 22.43 119.30 -138.95 -90.99 145.88 97.82 2.14 0.03 96.08 1.85 0.18 0.01 0.02 0.00 1.52 0.35 39 P C T 106.72 3.33 11.20 16.50 109.48 -84.81 -59.00 133.76 99.55 0.12 0.33 0.44 3.75 95.37 0.01 0.32 0.00 0.08 0.02 40 G C T 69.24 0.28 12.63 10.30 95.94 17.19 83.04 -2.86 99.55 0.09 0.35 0.52 3.74 95.28 0.01 0.37 0.00 0.06 0.02 41 K C S 111.92 4.05 10.50 16.70 128.57 90.22 -116.48 160.64 93.13 6.44 0.43 32.33 59.19 1.72 0.09 0.35 0.00 2.38 3.94 42 A C C 73.94 2.64 16.32 19.38 116.33 -97.08 -70.54 149.68 96.57 3.39 0.03 84.41 12.24 0.20 0.01 0.03 0.00 2.69 0.43 43 P C C 45.94 17.33 11.17 27.81 115.00 -100.48 -65.46 145.09 89.25 10.71 0.03 87.21 2.01 0.15 0.00 0.03 0.00 10.24 0.36 44 K E E 98.42 7.27 21.04 29.15 123.80 -157.63 -120.24 138.40 10.73 89.20 0.07 9.34 1.22 0.11 0.02 0.04 0.00 88.52 0.74 45 L E E 62.13 15.80 17.63 33.05 110.77 -116.80 -75.51 126.04 1.14 98.85 0.01 1.01 0.06 0.00 0.00 0.00 0.00 98.88 0.04 46 L E E 27.09 17.15 20.79 37.98 101.17 175.35 -96.10 -34.40 2.08 97.91 0.01 1.37 0.55 0.02 0.00 0.00 0.00 98.04 0.01 47 I E E 18.26 19.57 21.50 40.82 135.96 4.64 -148.04 142.59 0.44 99.55 0.01 0.35 0.03 0.00 0.00 0.00 0.00 99.60 0.01 48 Y E E 59.27 17.52 21.87 38.33 127.51 -171.67 -129.05 135.72 2.78 97.17 0.05 2.38 0.18 0.03 0.02 0.01 0.00 97.29 0.09 49 S E E 21.10 16.46 20.75 36.95 119.98 -171.78 -116.82 134.23 28.99 69.47 1.55 21.81 6.24 1.65 0.77 0.77 0.00 68.02 0.74 50 A C C 34.34 14.15 18.17 32.30 116.61 -175.02 -106.07 147.76 57.09 23.96 18.95 31.07 16.34 11.82 5.41 12.30 0.07 21.04 1.95 51 S C T 68.34 7.25 18.42 25.94 100.69 -117.30 -79.35 -16.93 63.93 6.37 29.70 21.08 20.23 24.53 9.51 18.55 0.13 4.21 1.75 52 S C C 61.84 6.57 18.20 25.45 114.98 46.02 -109.02 131.01 59.60 7.49 32.91 25.55 15.14 20.68 11.63 19.95 0.15 4.66 2.24 53 L C C 63.83 15.15 13.08 27.57 110.26 -129.73 -85.90 113.92 58.40 12.71 28.88 34.71 12.45 12.30 13.36 15.16 0.16 8.40 3.45 54 Y C C 125.44 8.32 15.00 24.21 111.46 93.84 -98.04 109.03 62.76 14.88 22.36 36.94 12.21 14.41 11.54 10.47 0.17 9.92 4.34 55 S C T 74.31 5.38 15.31 22.03 111.23 -127.94 -93.81 124.18 79.57 8.33 12.10 23.81 16.47 40.21 5.83 5.61 0.07 5.45 2.54 56 G C T 50.67 4.69 16.73 22.44 102.81 -2.63 85.20 1.97 92.32 4.02 3.66 24.01 27.37 41.53 0.81 2.61 0.00 2.66 1.02 57 V C C 45.22 15.27 11.73 27.08 117.55 112.85 -98.45 131.03 88.51 10.61 0.88 53.89 33.03 2.18 0.33 0.57 0.00 5.54 4.47 58 P C C 64.56 8.42 17.26 26.62 111.04 -108.71 -66.88 146.62 89.17 6.75 4.08 58.60 16.26 14.16 0.76 3.70 0.00 5.08 1.43 59 S C C 63.24 10.68 16.33 27.14 99.34 -119.86 -73.39 7.17 84.20 9.64 6.16 47.62 19.27 17.45 0.76 5.95 0.00 7.67 1.27 60 R C C 106.82 9.94 19.58 29.64 103.07 75.32 -97.94 19.00 68.98 25.47 5.56 39.43 21.69 8.65 0.81 4.53 0.01 23.48 1.41 61 F E E 29.92 22.53 13.00 34.61 123.76 99.96 -109.33 137.53 22.32 77.04 0.64 18.91 3.30 0.76 0.23 0.40 0.00 75.03 1.36 62 S E E 56.47 5.88 23.77 30.80 133.33 -176.42 -135.82 154.07 7.21 92.66 0.13 6.38 0.67 0.13 0.05 0.06 0.00 92.23 0.49 63 G E E 24.54 18.12 14.80 31.68 141.30 165.03 -156.95 168.15 7.41 92.52 0.07 6.15 0.90 0.14 0.01 0.04 0.00 92.58 0.19 64 S E E 61.72 4.85 22.18 28.29 134.03 -151.84 -142.65 153.95 8.06 91.85 0.09 6.61 1.04 0.19 0.02 0.06 0.00 91.84 0.24 65 R E E 99.15 16.56 12.27 27.87 128.28 -163.07 -131.06 142.14 15.47 84.36 0.17 11.45 3.72 0.76 0.03 0.15 0.00 83.23 0.66 66 S E E 75.12 2.72 19.32 22.23 116.29 -170.76 -125.08 107.73 41.39 58.26 0.35 31.15 8.21 2.64 0.06 0.36 0.00 56.19 1.39 67 G C T 44.22 5.19 18.00 23.91 109.07 -55.60 63.54 -128.29 98.94 0.78 0.28 1.64 43.23 54.18 0.01 0.28 0.00 0.59 0.08 68 T C T 59.94 13.07 15.18 28.50 97.59 -11.35 -99.77 -0.53 98.94 0.83 0.22 1.48 44.25 53.33 0.00 0.23 0.00 0.65 0.06 69 D E E 57.81 9.05 21.21 31.40 120.82 86.95 -105.63 135.42 25.34 74.61 0.04 19.08 6.07 0.35 0.00 0.05 0.00 73.53 0.92 70 F E E 8.45 24.11 15.63 40.24 127.94 -171.51 -125.89 141.20 5.24 94.76 0.00 5.12 0.10 0.00 0.00 0.00 0.00 94.65 0.13 71 T E E 32.88 10.13 26.81 38.07 122.40 -162.88 -117.65 133.57 1.25 98.75 0.00 1.09 0.02 0.00 0.00 0.00 0.00 98.87 0.01 72 L E E 3.14 26.00 18.87 45.76 119.22 -162.48 -112.55 128.69 0.23 99.77 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.76 0.00 73 T E E 37.52 10.18 27.11 38.16 120.45 -164.89 -116.06 129.60 0.13 99.87 0.00 0.14 0.00 0.00 0.00 0.00 0.00 99.85 0.00 74 I E E 7.92 23.95 16.49 40.94 116.45 -163.96 -112.06 125.19 1.91 98.09 0.00 1.96 0.02 0.00 0.00 0.00 0.00 97.73 0.29 75 S C C 46.59 7.39 22.61 30.27 121.46 -164.74 -103.55 158.65 89.97 9.97 0.06 44.76 39.03 4.19 0.00 0.10 0.00 11.65 0.25 76 S C S 68.35 4.22 23.86 28.13 98.09 10.34 58.07 61.06 98.75 1.23 0.02 9.56 85.00 4.20 0.00 0.03 0.00 1.11 0.09 77 L C C 21.65 23.32 10.38 32.99 113.65 -145.88 -77.66 131.32 98.76 1.23 0.02 96.56 2.34 0.04 0.01 0.01 0.00 0.46 0.59 78 Q C C 82.35 4.42 23.32 27.63 129.23 -174.50 -124.54 154.84 99.86 0.12 0.02 99.48 0.40 0.01 0.00 0.00 0.00 0.02 0.08 79 P H G 74.16 11.44 14.83 26.79 91.18 -105.52 -58.28 -33.00 3.73 0.02 96.26 0.23 0.24 2.46 0.59 96.48 0.00 0.01 0.00 80 E H G 128.80 3.26 20.53 24.35 89.94 62.20 -70.28 -16.86 2.72 0.02 97.26 0.11 0.16 1.91 0.50 97.30 0.00 0.02 0.00 81 D H G 19.48 19.51 15.33 35.06 93.42 62.34 -85.06 -4.40 3.42 0.04 96.55 0.46 0.34 1.60 0.64 96.93 0.00 0.03 0.00 82 F C C 59.45 16.59 18.77 35.10 115.41 105.84 -77.89 135.13 88.24 9.18 2.58 81.06 6.56 0.86 0.41 2.26 0.00 7.88 0.97 83 A E E 20.86 14.43 22.43 36.82 140.89 144.70 -155.08 172.78 33.96 65.87 0.16 29.50 3.77 0.36 0.04 0.14 0.00 64.84 1.36 84 T E E 44.49 12.18 24.75 37.20 119.53 -81.80 -102.87 136.45 4.34 95.62 0.04 3.97 0.36 0.04 0.01 0.02 0.00 95.32 0.27 85 Y E E 10.65 24.52 18.94 43.43 125.26 -165.54 -118.26 138.66 2.62 97.35 0.04 2.35 0.21 0.04 0.01 0.02 0.00 97.20 0.17 86 Y E E 45.25 14.54 26.98 41.60 128.52 -169.07 -124.77 144.86 7.17 92.73 0.10 6.26 0.57 0.10 0.02 0.05 0.00 92.72 0.29 87 C E E 5.17 24.53 20.25 44.81 121.16 -151.26 -108.11 135.07 21.44 78.09 0.48 18.17 2.47 0.52 0.15 0.24 0.00 77.84 0.62 88 Q E E 43.60 13.82 25.04 38.74 126.24 -170.37 -120.32 141.59 19.93 79.13 0.94 16.93 2.40 0.77 0.33 0.45 0.00 77.93 1.17 89 Q E E 49.08 17.26 18.70 35.33 121.48 -146.91 -104.32 137.61 25.78 72.85 1.36 21.96 3.15 1.08 0.51 0.70 0.00 71.46 1.16 90 S E E 35.62 11.85 17.21 29.90 124.69 -169.67 -118.50 147.03 35.26 63.20 1.54 27.14 7.09 2.44 0.47 1.00 0.00 60.35 1.50 91 K E E 114.31 7.51 14.53 23.22 109.63 -150.45 -98.95 87.24 48.94 49.34 1.72 31.20 14.38 5.66 0.33 1.36 0.01 45.36 1.70 92 Y C C 139.52 5.38 12.30 19.13 110.56 143.04 -95.81 105.41 66.27 30.81 2.92 31.44 21.59 15.58 0.49 2.39 0.02 26.23 2.25 93 D C S 116.10 2.09 13.45 16.36 104.93 -24.71 -91.19 41.15 87.24 10.07 2.68 26.22 30.99 30.77 0.33 2.37 0.00 8.04 1.28 94 G C S 42.86 5.05 14.29 20.45 118.82 -23.36 115.92 60.86 90.49 7.36 2.16 24.31 39.46 27.11 0.22 2.04 0.00 5.91 0.94 95 L C C 86.60 8.59 14.44 24.06 117.88 -45.50 -91.75 138.19 72.63 26.16 1.21 48.25 16.32 7.25 0.20 1.08 0.00 25.65 1.26 96 I E E 52.05 14.71 15.06 30.23 120.60 -152.45 -107.93 133.09 41.59 58.01 0.40 36.00 4.11 0.86 0.10 0.28 0.00 57.46 1.19 97 T E E 58.88 10.78 20.69 31.84 122.71 -160.71 -114.18 134.84 17.59 82.14 0.27 15.39 1.79 0.36 0.13 0.14 0.00 79.78 2.40 98 F E E 50.57 18.26 16.31 33.91 117.90 -161.90 -105.67 132.85 25.31 74.26 0.43 21.32 3.25 0.79 0.22 0.26 0.00 70.53 3.62 99 G C C 22.85 11.50 18.70 30.37 124.00 -145.53 -90.86 -177.83 75.40 23.31 1.29 48.84 19.06 7.11 0.19 1.27 0.00 22.26 1.27 100 Q C T 120.69 5.24 19.89 25.83 107.69 -56.39 -72.56 126.56 79.30 17.71 2.99 14.52 26.61 38.99 0.32 2.64 0.01 15.13 1.77 101 G C T 31.19 10.91 17.67 28.64 104.80 17.64 87.53 -2.91 77.52 20.49 1.99 25.66 19.87 31.93 0.18 1.97 0.00 19.50 0.89 102 T C E 35.64 18.49 13.65 31.38 118.12 133.36 -92.11 137.95 51.04 48.47 0.49 45.43 3.41 0.83 0.10 0.37 0.00 48.96 0.90 103 K E E 118.03 5.48 20.50 27.29 123.59 -160.87 -115.12 138.98 9.75 90.08 0.16 9.01 0.70 0.14 0.10 0.07 0.00 87.14 2.84 104 V E E 60.43 15.66 12.45 27.68 116.83 -145.62 -99.59 129.63 15.10 84.78 0.12 15.03 0.35 0.09 0.08 0.05 0.00 81.69 2.71 105 A C C 55.26 8.21 17.95 26.54 122.40 -162.00 -110.76 151.36 99.18 0.81 0.00 99.23 0.05 0.01 0.00 0.00 0.00 0.69 0.01