# 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 103.90 3.57 20.63 24.33 103.11 -128.16 -77.21 59.57 99.81 0.18 0.00 99.74 0.10 0.02 0.00 0.00 0.00 0.13 0.00 1 I C C 36.66 20.60 10.51 29.76 117.90 -158.75 -99.03 129.71 61.84 38.05 0.11 60.75 0.56 0.17 0.02 0.05 0.00 37.74 0.71 2 Q E E 100.58 4.80 21.64 27.32 123.41 -168.88 -118.99 137.71 21.57 78.24 0.19 19.80 1.32 0.25 0.07 0.11 0.00 77.31 1.12 3 M E E 50.30 20.18 12.84 31.84 122.28 -157.05 -111.52 134.65 16.67 83.16 0.17 15.61 0.87 0.17 0.07 0.09 0.00 81.83 1.35 4 T E E 65.35 7.61 20.50 28.77 125.23 -171.20 -121.28 143.05 26.98 72.78 0.24 23.47 2.81 0.44 0.07 0.16 0.00 71.41 1.63 5 Q C E 82.15 12.43 16.95 29.42 125.80 -153.36 -118.42 138.06 55.68 44.08 0.24 39.44 15.80 1.15 0.05 0.23 0.00 41.87 1.44 6 S C C 49.88 12.17 16.37 28.77 122.14 -142.00 -99.68 146.06 84.37 15.53 0.11 58.15 25.15 0.87 0.02 0.11 0.00 14.99 0.71 7 P C C 52.47 10.73 16.76 28.05 115.63 -5.93 -71.41 151.63 90.54 8.90 0.56 68.94 17.12 3.62 0.07 0.64 0.00 9.03 0.58 8 S C S 67.82 8.55 17.09 26.45 97.29 -145.01 -82.27 -21.46 82.34 17.31 0.35 28.64 49.18 3.53 0.02 0.37 0.00 17.64 0.62 9 S E E 57.03 6.82 20.31 28.30 135.94 16.66 -146.48 150.78 23.39 76.17 0.44 17.76 5.23 1.02 0.07 0.38 0.00 74.93 0.60 10 L E E 32.73 19.68 14.92 33.94 131.86 -175.47 -139.24 145.73 5.10 94.85 0.04 4.54 0.44 0.05 0.01 0.02 0.00 94.64 0.31 11 S E E 63.62 6.99 23.12 31.29 125.66 -160.21 -121.36 141.95 4.20 95.76 0.03 3.75 0.35 0.04 0.01 0.01 0.00 95.52 0.30 12 A E E 12.89 19.45 14.73 34.23 138.43 169.15 -146.83 159.53 20.00 79.89 0.11 17.56 1.75 0.20 0.03 0.08 0.00 79.80 0.58 13 S E E 54.64 5.04 23.66 28.54 123.27 -112.20 -89.30 158.19 43.19 56.35 0.45 35.99 5.56 1.23 0.15 0.39 0.00 51.70 4.98 14 V C T 59.73 15.45 14.30 29.60 109.09 -83.01 -60.76 134.73 96.05 2.80 1.15 1.47 7.96 87.10 0.08 1.01 0.00 1.98 0.41 15 G C T 44.78 4.88 20.02 25.56 96.18 22.79 89.36 -6.44 98.28 0.89 0.83 2.11 10.03 86.15 0.04 0.86 0.00 0.68 0.13 16 D C C 60.73 9.17 17.62 27.73 122.48 116.45 -83.28 154.82 92.65 6.75 0.60 46.88 44.35 1.99 0.09 0.55 0.00 5.26 0.89 17 R C C 124.94 8.39 20.03 29.26 118.64 -122.13 -91.70 136.70 70.64 29.33 0.03 69.34 0.94 0.06 0.00 0.02 0.00 29.14 0.50 18 V E E 9.85 23.02 14.75 37.88 127.22 -166.74 -124.39 142.13 1.92 98.08 0.00 1.92 0.03 0.00 0.00 0.00 0.00 97.92 0.13 19 T E E 58.24 8.56 25.59 34.61 119.53 -150.29 -110.49 130.30 0.64 99.36 0.00 0.60 0.01 0.00 0.00 0.00 0.00 99.38 0.01 20 I E E 3.99 25.92 17.00 43.84 120.49 -166.24 -115.94 129.01 1.72 98.28 0.00 1.58 0.06 0.00 0.00 0.00 0.00 98.35 0.02 21 T E E 42.45 9.63 27.24 37.64 120.58 -162.44 -110.60 133.04 8.36 91.64 0.00 7.72 0.17 0.00 0.00 0.00 0.00 92.05 0.05 22 C E E 3.15 26.11 16.69 43.51 129.17 -172.63 -129.63 144.92 11.08 88.91 0.00 10.34 0.33 0.01 0.00 0.00 0.00 89.17 0.14 23 R E E 101.58 7.10 27.66 35.66 121.19 -165.06 -120.11 130.88 4.81 95.17 0.02 4.61 0.18 0.02 0.01 0.01 0.00 93.93 1.24 24 A E E 6.72 24.75 12.75 37.47 119.23 -151.80 -95.26 139.76 29.83 70.03 0.14 28.69 1.18 0.18 0.03 0.10 0.00 67.57 2.24 25 S C S 68.99 4.20 22.73 27.24 99.15 -158.00 -92.96 -13.78 86.22 13.53 0.25 28.69 53.52 3.65 0.02 0.30 0.00 13.24 0.58 26 S C S 47.99 5.34 22.05 27.76 137.32 23.40 -141.57 166.12 92.54 7.21 0.25 8.56 77.91 6.01 0.01 0.26 0.00 6.85 0.39 27 S C C 61.90 7.28 22.05 29.66 113.83 -79.66 -75.01 138.65 94.02 5.77 0.22 82.99 8.01 2.46 0.02 0.32 0.00 5.79 0.42 28 V C C 10.61 23.75 13.52 37.17 127.07 -169.40 -125.68 143.39 50.97 48.94 0.10 49.78 1.39 0.14 0.03 0.06 0.00 42.37 6.22 29 E C S 95.88 6.97 24.56 32.25 98.49 -165.31 -90.29 -28.93 66.71 33.27 0.02 17.40 48.07 0.51 0.00 0.02 0.00 33.71 0.28 30 F E E 48.10 12.84 24.51 37.73 133.94 11.12 -146.78 142.92 11.33 88.65 0.01 8.12 2.61 0.13 0.00 0.01 0.00 88.94 0.19 31 I E E 3.75 26.42 19.10 46.10 124.75 -168.15 -125.45 132.79 1.58 98.41 0.00 1.49 0.05 0.00 0.00 0.00 0.00 98.43 0.03 32 H E E 34.99 14.99 28.09 43.12 124.24 -171.94 -120.44 136.96 0.59 99.41 0.00 0.56 0.01 0.00 0.00 0.00 0.00 99.42 0.00 33 W E E 8.74 24.49 22.01 46.42 124.04 -160.07 -111.41 137.37 0.69 99.31 0.00 0.64 0.02 0.00 0.00 0.00 0.00 99.34 0.00 34 Y E E 25.88 16.26 23.85 40.27 132.38 -175.10 -131.14 150.80 0.65 99.35 0.00 0.57 0.02 0.00 0.00 0.00 0.00 99.37 0.03 35 Q E E 41.19 14.83 21.28 36.33 120.80 -144.26 -108.79 135.74 3.10 96.90 0.00 2.50 0.35 0.01 0.00 0.00 0.00 97.05 0.08 36 Q E E 50.94 13.86 15.63 30.13 120.16 -149.53 -105.39 136.47 27.19 72.79 0.02 24.89 1.62 0.06 0.00 0.01 0.00 72.02 1.40 37 K C C 98.42 6.18 15.51 23.00 119.81 -136.45 -90.62 145.87 97.46 2.50 0.04 95.60 1.98 0.18 0.01 0.02 0.00 1.80 0.40 38 P C T 104.18 3.81 11.43 17.26 109.30 -85.60 -58.79 133.76 99.61 0.11 0.28 0.32 3.28 96.05 0.01 0.26 0.00 0.07 0.02 39 G C T 69.01 0.30 12.94 10.66 95.99 17.89 83.32 -2.94 99.61 0.10 0.29 0.45 3.41 95.74 0.01 0.30 0.00 0.07 0.01 40 K C S 110.69 4.29 10.68 17.14 128.12 93.26 -114.99 159.08 92.01 7.64 0.35 37.74 53.24 1.26 0.08 0.28 0.00 2.79 4.61 41 A C C 74.61 2.76 16.12 19.45 115.95 -96.06 -69.22 148.59 96.91 3.05 0.03 87.37 9.55 0.20 0.01 0.03 0.00 2.41 0.43 42 P C C 46.48 17.61 10.80 27.58 115.02 -101.87 -65.89 145.18 87.14 12.83 0.03 84.71 2.22 0.16 0.00 0.03 0.00 12.33 0.55 43 K E E 106.88 6.22 21.16 28.32 123.86 -155.66 -118.95 139.29 13.60 86.33 0.07 11.70 1.93 0.12 0.02 0.04 0.00 84.94 1.24 44 P E E 55.91 15.58 17.57 32.69 111.69 -109.48 -69.38 134.60 2.85 97.13 0.02 2.67 0.13 0.01 0.01 0.01 0.00 97.07 0.10 45 L E E 25.79 18.12 20.51 38.40 101.51 175.47 -94.64 -34.98 6.94 93.03 0.04 3.80 3.07 0.11 0.01 0.02 0.00 92.95 0.05 46 I E E 12.59 21.38 20.58 41.77 135.38 6.51 -145.55 142.34 0.79 99.20 0.01 0.62 0.09 0.01 0.00 0.00 0.00 99.23 0.04 47 S E E 34.83 15.26 22.73 37.29 129.40 -171.77 -130.83 141.81 3.93 96.01 0.06 3.41 0.28 0.04 0.02 0.02 0.00 96.06 0.17 48 A E E 19.08 18.85 18.09 36.37 115.54 -161.92 -107.20 126.65 37.76 60.19 2.05 27.59 8.89 2.19 0.91 1.07 0.00 58.52 0.84 49 T C C 67.21 9.91 19.89 29.82 109.04 -154.45 -97.93 43.23 64.12 23.56 12.32 31.69 21.45 12.99 3.58 7.73 0.06 20.61 1.90 50 S C C 56.71 8.42 17.92 26.72 115.01 57.32 -102.48 135.28 70.77 8.66 20.57 25.62 25.22 21.99 6.88 12.25 0.10 5.82 2.12 51 N C C 92.08 7.60 17.98 26.20 108.21 -0.16 -94.25 83.24 68.66 9.78 21.56 35.76 16.84 17.35 8.04 12.74 0.08 6.19 2.99 52 L C C 56.71 16.05 12.31 27.60 111.09 -149.05 -89.66 119.78 68.67 10.62 20.71 44.97 12.87 10.81 10.28 10.48 0.04 6.81 3.74 53 A C C 67.04 6.75 15.84 23.67 109.67 -143.00 -89.25 113.20 70.48 10.66 18.87 39.30 14.17 17.59 8.46 9.87 0.07 6.59 3.95 54 S C T 76.43 5.07 15.57 21.97 107.84 -69.20 -80.84 112.00 80.81 5.17 14.02 19.39 18.88 43.26 5.27 8.01 0.05 3.11 2.03 55 G C T 50.07 5.01 17.06 23.09 101.71 -3.27 84.74 -0.33 92.11 3.85 4.05 24.60 28.17 39.83 0.73 3.18 0.00 2.42 1.06 56 V C C 38.55 16.66 11.98 28.57 117.46 112.95 -99.11 131.81 85.43 13.90 0.68 53.01 31.81 1.61 0.27 0.43 0.00 6.58 6.28 57 P C C 60.93 8.50 18.54 27.94 111.29 -109.63 -66.91 146.72 88.13 9.41 2.46 67.88 12.64 7.15 0.62 2.09 0.00 7.08 2.54 58 S C C 58.32 12.88 15.98 28.44 101.02 -128.36 -78.53 -2.77 84.72 10.61 4.68 51.81 19.94 13.24 0.70 4.38 0.00 8.43 1.49 59 R C C 117.40 8.25 21.14 29.68 111.23 84.82 -103.27 83.81 67.43 28.49 4.08 38.64 21.71 7.80 0.70 3.22 0.01 26.38 1.53 60 F E E 30.18 22.54 13.30 34.99 123.03 140.36 -110.65 138.32 25.53 73.63 0.84 21.40 3.82 0.94 0.32 0.51 0.00 71.52 1.49 61 S E E 55.12 6.85 23.84 31.84 134.35 -176.12 -137.60 153.86 10.08 89.70 0.21 8.84 1.05 0.22 0.09 0.10 0.00 89.01 0.69 62 G E E 22.94 18.10 15.80 32.73 140.28 168.41 -156.60 166.99 9.20 90.69 0.11 7.73 1.19 0.22 0.03 0.06 0.00 90.30 0.46 63 S E E 63.01 5.62 21.81 29.06 136.07 -167.49 -146.48 157.89 15.58 84.28 0.14 13.22 2.03 0.38 0.04 0.10 0.00 83.57 0.67 64 G E E 29.08 12.15 15.49 28.10 139.38 144.18 -151.21 173.89 35.76 63.98 0.25 25.77 9.21 1.77 0.03 0.27 0.00 61.93 1.03 65 S C E 75.74 3.59 20.84 25.04 113.18 -122.90 -122.66 95.61 59.34 39.63 1.03 30.16 21.15 9.89 0.14 1.09 0.00 34.88 2.69 66 G C S 32.61 10.77 18.59 29.23 108.96 -45.70 68.56 -126.10 97.21 1.80 1.00 3.88 51.33 42.15 0.03 1.05 0.00 1.32 0.24 67 T C S 61.42 13.15 17.13 30.19 98.64 -7.01 -99.56 -3.90 97.15 2.06 0.79 3.84 54.30 39.18 0.03 0.80 0.00 1.64 0.22 68 D E E 62.54 8.57 22.16 31.78 119.29 84.20 -105.67 129.66 38.22 61.51 0.26 24.09 13.52 1.90 0.04 0.31 0.00 57.64 2.50 69 F E E 8.47 24.53 15.97 40.87 127.94 -173.87 -125.59 140.87 16.98 83.02 0.01 16.01 0.56 0.03 0.00 0.01 0.00 83.00 0.39 70 T E E 34.93 10.48 27.30 38.84 124.13 -165.34 -119.85 135.87 4.39 95.61 0.00 3.91 0.17 0.00 0.00 0.00 0.00 95.85 0.08 71 L E E 2.83 26.28 19.04 46.26 120.07 -162.07 -113.11 128.33 0.33 99.67 0.00 0.35 0.00 0.00 0.00 0.00 0.00 99.64 0.00 72 T E E 39.73 10.26 27.39 38.49 120.39 -164.50 -115.69 129.26 0.14 99.86 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.84 0.01 73 I E E 7.33 24.16 16.48 41.21 117.58 -166.04 -113.61 124.89 2.37 97.63 0.00 2.46 0.03 0.00 0.00 0.00 0.00 97.21 0.30 74 S C C 47.87 7.27 23.10 30.54 119.76 -164.94 -103.58 157.99 91.69 8.25 0.06 47.13 39.04 3.98 0.00 0.10 0.00 9.48 0.26 75 S C S 65.05 4.80 24.18 29.00 99.59 10.02 60.04 63.01 99.03 0.95 0.02 10.91 83.63 4.52 0.00 0.04 0.00 0.82 0.09 76 L C C 18.56 23.76 10.74 34.01 112.49 -142.71 -75.89 131.56 99.17 0.82 0.01 97.14 2.12 0.03 0.00 0.00 0.00 0.29 0.42 77 Q C C 80.92 4.56 23.80 28.27 130.30 -175.82 -124.99 156.10 99.88 0.11 0.01 99.29 0.60 0.00 0.00 0.00 0.00 0.02 0.08 78 P H G 71.84 12.33 14.96 27.60 91.06 -105.64 -58.27 -32.25 3.46 0.01 96.53 0.16 0.20 2.32 0.38 96.93 0.00 0.01 0.00 79 E H G 128.51 3.31 20.85 24.81 89.90 62.48 -70.03 -17.31 2.60 0.02 97.39 0.08 0.13 1.84 0.28 97.65 0.00 0.01 0.00 80 D H G 17.69 19.87 15.82 35.94 93.87 61.39 -87.19 -2.95 3.34 0.03 96.63 0.39 0.31 1.61 0.39 97.27 0.00 0.02 0.00 81 F C C 51.11 17.79 18.85 36.34 115.37 101.94 -80.32 134.85 87.36 11.46 1.18 82.49 5.02 0.36 0.18 1.01 0.00 10.14 0.81 82 A E E 20.46 14.77 22.87 37.44 140.11 151.17 -152.61 175.82 20.55 79.37 0.07 17.56 2.76 0.18 0.02 0.05 0.00 78.64 0.80 83 T E E 43.16 12.51 25.02 37.73 119.32 -77.60 -102.70 135.61 2.38 97.61 0.02 2.12 0.19 0.02 0.00 0.01 0.00 97.59 0.07 84 Y E E 8.93 24.86 19.19 44.09 124.60 -165.19 -117.50 137.53 1.00 98.99 0.01 0.90 0.07 0.01 0.00 0.00 0.00 98.98 0.04 85 Y E E 40.12 15.24 27.04 42.27 128.60 -169.77 -124.57 146.14 2.84 97.14 0.03 2.48 0.17 0.02 0.00 0.01 0.00 97.24 0.08 86 C E E 4.41 24.75 20.80 45.62 122.11 -158.37 -113.80 134.55 13.58 86.26 0.16 11.76 1.17 0.18 0.04 0.08 0.00 86.47 0.30 87 Q E E 43.43 14.06 25.31 39.22 125.22 -171.35 -120.67 139.33 16.37 83.17 0.46 14.12 1.81 0.44 0.13 0.22 0.00 82.73 0.54 88 Q E E 38.90 18.53 18.40 36.30 120.68 -155.15 -107.29 135.08 22.18 77.07 0.75 18.66 3.02 0.90 0.22 0.43 0.00 75.87 0.90 89 W E E 111.12 9.82 19.39 29.70 118.30 -161.51 -108.63 130.36 34.46 64.68 0.85 26.48 7.22 2.16 0.23 0.64 0.00 61.26 2.00 90 S C C 42.69 12.15 12.62 25.29 122.73 165.81 -116.36 145.99 61.77 37.53 0.69 40.75 16.90 4.87 0.12 0.65 0.00 35.05 1.66 91 S C S 82.93 3.17 15.17 19.30 101.73 -135.94 -88.18 0.85 88.85 10.73 0.42 27.18 53.30 7.91 0.05 0.44 0.00 10.24 0.89 92 A C S 62.92 4.53 13.93 20.04 122.00 60.90 -103.66 144.82 92.77 6.90 0.33 20.62 67.02 5.04 0.04 0.31 0.00 6.17 0.80 93 P C C 84.34 5.59 15.85 22.59 112.76 -83.15 -69.37 146.36 90.26 9.28 0.47 57.18 26.38 6.14 0.06 0.51 0.00 9.10 0.63 94 W C C 84.76 15.67 12.67 28.13 120.68 -149.39 -105.08 136.16 56.03 43.47 0.50 47.35 6.12 1.64 0.11 0.44 0.00 42.50 1.85 95 T E E 66.78 8.56 20.19 29.47 123.63 -160.75 -119.47 136.58 27.73 71.93 0.34 24.24 2.38 0.50 0.14 0.22 0.00 67.36 5.16 96 F E E 58.15 18.04 14.79 32.09 116.33 -155.49 -99.73 129.07 34.96 64.32 0.72 27.46 6.18 2.02 0.29 0.55 0.00 58.98 4.51 97 G C C 29.03 10.50 18.42 29.04 118.93 -148.05 -65.54 -162.27 71.98 27.26 0.75 37.43 26.56 8.35 0.10 0.74 0.00 25.46 1.37 98 Q C C 120.51 5.18 20.11 25.70 101.39 -40.68 -82.64 7.45 77.25 21.63 1.12 33.38 32.57 11.90 0.12 1.12 0.00 19.60 1.30 99 G C C 19.96 15.18 16.66 31.20 126.99 -123.71 100.78 177.54 73.94 25.54 0.52 51.01 17.01 4.66 0.05 0.58 0.00 25.91 0.78 100 T E E 33.68 16.68 17.69 34.19 124.88 -99.70 -115.90 142.34 29.13 70.78 0.09 26.01 2.07 0.20 0.02 0.06 0.00 71.08 0.56 101 K E E 107.03 8.14 22.57 31.43 120.22 -144.77 -105.43 133.32 4.45 95.53 0.03 3.97 0.34 0.03 0.01 0.01 0.00 95.48 0.16 102 V E E 16.28 22.02 14.48 36.31 121.15 -166.16 -116.34 130.58 2.28 97.71 0.01 2.23 0.07 0.01 0.00 0.00 0.00 97.61 0.08 103 E E E 93.41 5.71 22.90 29.09 118.12 -158.44 -107.54 128.72 3.57 96.41 0.02 3.49 0.13 0.02 0.00 0.01 0.00 96.14 0.20 104 I E E 31.03 19.92 11.22 30.49 116.34 -157.36 -103.67 126.12 20.10 79.84 0.06 20.23 0.24 0.05 0.02 0.02 0.00 78.63 0.80 105 K C C 127.65 4.15 19.41 24.39 114.67 -159.34 -98.48 129.80 98.95 1.04 0.00 99.04 0.06 0.01 0.00 0.00 0.00 0.88 0.01