# 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 97.70 4.34 21.42 25.94 106.45 -135.57 -80.38 85.01 99.85 0.15 0.00 99.74 0.13 0.03 0.00 0.00 0.00 0.10 0.00 1 I C C 33.46 20.86 11.09 30.95 116.84 -152.49 -97.91 130.29 62.92 37.00 0.07 61.91 0.56 0.14 0.01 0.04 0.00 36.69 0.65 2 V E E 72.41 6.33 21.88 28.93 120.47 -167.46 -115.56 131.86 15.27 84.66 0.06 13.95 1.04 0.12 0.02 0.04 0.00 84.17 0.66 3 M E E 44.73 19.85 13.85 33.15 120.13 -157.20 -107.97 130.89 7.24 92.72 0.04 6.87 0.36 0.05 0.01 0.02 0.00 92.16 0.53 4 T E E 61.39 8.04 21.35 29.97 124.15 -171.49 -120.12 139.97 14.52 85.39 0.09 13.07 1.12 0.15 0.03 0.05 0.00 84.14 1.44 5 Q C E 68.16 15.35 15.06 30.01 125.93 -163.87 -126.09 139.77 51.01 48.83 0.16 39.97 10.26 0.68 0.03 0.15 0.00 47.64 1.27 6 S C C 56.50 8.88 17.77 27.33 119.06 -136.97 -97.47 148.25 85.58 14.31 0.11 55.29 29.15 0.93 0.01 0.11 0.00 13.86 0.63 7 P C C 59.44 9.34 16.51 26.72 114.48 5.12 -72.03 148.94 91.45 8.27 0.27 73.83 14.98 1.84 0.03 0.31 0.00 8.52 0.50 8 L C S 94.43 9.58 16.49 26.80 98.54 -156.55 -86.71 -23.61 84.41 15.45 0.14 27.91 54.01 1.42 0.01 0.14 0.00 16.11 0.40 9 S E E 56.11 6.93 20.02 28.18 136.89 14.69 -146.77 148.89 15.19 84.70 0.10 12.12 2.78 0.29 0.01 0.10 0.00 84.28 0.42 10 L E E 33.77 19.28 14.61 33.38 132.83 -175.43 -139.22 145.24 2.61 97.38 0.01 2.35 0.16 0.01 0.00 0.01 0.00 97.30 0.18 11 S E E 65.48 6.35 22.86 30.46 124.75 -157.56 -119.47 140.16 3.67 96.31 0.01 3.28 0.27 0.02 0.00 0.01 0.00 96.26 0.17 12 T E E 19.09 18.60 14.65 33.32 139.12 164.87 -147.41 161.51 22.88 77.09 0.03 20.67 1.32 0.07 0.01 0.02 0.00 77.50 0.40 13 S E E 54.99 4.82 23.54 28.15 124.51 -114.17 -93.04 159.43 45.16 54.60 0.24 39.35 4.75 0.61 0.11 0.18 0.00 48.10 6.90 14 V C T 62.55 14.84 14.21 28.98 109.15 -81.46 -60.23 134.42 98.60 0.90 0.51 0.52 4.22 94.21 0.03 0.36 0.00 0.52 0.13 15 G C T 45.09 4.42 19.91 25.06 95.94 23.11 89.15 -6.19 99.38 0.28 0.34 0.82 4.94 93.70 0.02 0.29 0.00 0.19 0.04 16 D C C 58.49 9.29 16.90 27.44 120.88 122.73 -77.00 151.64 96.34 3.47 0.19 68.16 27.86 0.66 0.03 0.17 0.00 2.59 0.53 17 R C C 130.39 8.06 19.32 28.61 120.69 -127.88 -101.37 136.57 73.91 26.08 0.01 73.98 0.62 0.03 0.00 0.01 0.00 24.70 0.65 18 V E E 13.07 21.77 14.87 36.54 129.39 -172.54 -129.15 144.55 1.31 98.68 0.00 1.36 0.02 0.00 0.00 0.00 0.00 98.50 0.11 19 S E E 52.47 8.60 24.47 33.53 121.78 -150.78 -113.54 134.76 0.38 99.62 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.61 0.01 20 L E E 6.47 25.00 16.60 42.01 122.22 -168.53 -118.46 133.64 1.63 98.37 0.00 1.51 0.04 0.00 0.00 0.00 0.00 98.44 0.01 21 T E E 46.97 9.43 26.63 36.66 121.61 -160.83 -114.01 134.32 5.66 94.33 0.00 5.06 0.17 0.00 0.00 0.00 0.00 94.72 0.04 22 C E E 4.35 25.41 16.61 42.46 129.22 -171.94 -130.43 144.32 5.42 94.58 0.00 4.83 0.22 0.01 0.00 0.00 0.00 94.86 0.07 23 K E E 95.44 7.14 27.26 35.30 121.11 -157.85 -115.58 133.63 3.30 96.68 0.01 3.06 0.15 0.01 0.00 0.01 0.00 96.29 0.48 24 A E E 8.16 24.28 14.20 38.17 126.28 -165.50 -112.67 147.08 31.43 68.41 0.16 30.10 1.26 0.18 0.05 0.10 0.00 66.60 1.72 25 S C C 47.99 8.01 21.07 29.44 117.34 -133.54 -87.46 157.49 76.38 22.90 0.72 58.95 14.32 2.42 0.12 0.70 0.00 22.00 1.47 26 Q C S 107.08 6.65 18.20 25.38 105.91 -54.52 -87.01 8.48 89.52 6.80 3.68 14.69 41.68 33.82 0.36 3.16 0.00 5.23 1.06 27 N C C 109.53 4.02 19.90 24.58 102.62 27.74 -75.81 51.60 92.57 4.58 2.86 33.77 26.50 32.42 0.29 2.85 0.00 3.40 0.78 28 V C C 36.91 18.63 13.97 31.65 112.00 150.76 -91.21 119.29 85.95 10.18 3.88 46.10 23.59 16.51 0.66 3.59 0.00 6.66 2.88 29 G C C 28.46 10.64 21.52 32.07 118.01 -146.23 -86.11 155.12 89.60 8.97 1.43 51.79 23.61 14.32 0.17 1.52 0.00 7.51 1.09 30 T C S 51.21 14.32 20.69 34.33 105.95 -95.43 -99.66 -3.53 82.80 16.33 0.88 33.92 43.70 4.87 0.10 0.82 0.00 15.77 0.82 31 A E E 29.47 13.42 24.63 38.20 122.33 50.90 -109.86 140.25 32.37 67.21 0.42 26.31 4.68 0.98 0.06 0.36 0.00 67.02 0.60 32 V E E 3.08 26.40 19.95 46.85 124.84 -166.56 -120.63 135.58 5.29 94.69 0.02 4.83 0.32 0.03 0.00 0.01 0.00 94.66 0.15 33 A E E 11.73 17.56 27.88 45.32 130.15 -173.03 -127.24 145.91 0.70 99.30 0.00 0.64 0.02 0.00 0.00 0.00 0.00 99.32 0.01 34 W E E 8.06 24.90 22.87 47.62 125.37 -154.73 -114.06 139.29 0.49 99.51 0.00 0.44 0.02 0.00 0.00 0.00 0.00 99.54 0.01 35 Y E E 24.85 17.19 24.33 41.39 132.82 -174.10 -131.02 150.45 0.60 99.40 0.00 0.53 0.02 0.00 0.00 0.00 0.00 99.42 0.02 36 Q E E 38.94 15.42 21.74 37.20 122.21 -146.98 -114.02 136.55 2.89 97.11 0.00 2.40 0.25 0.01 0.00 0.00 0.00 97.23 0.09 37 Q E E 48.28 14.34 16.00 30.89 119.15 -153.16 -105.03 136.03 29.86 70.12 0.02 27.13 1.79 0.07 0.00 0.01 0.00 69.80 1.19 38 K C C 97.59 6.33 16.07 23.63 120.11 -141.29 -91.60 146.96 97.74 2.24 0.02 95.64 2.20 0.16 0.01 0.02 0.00 1.63 0.35 39 P C T 99.55 4.68 11.38 18.08 109.66 -86.05 -58.62 134.61 99.69 0.10 0.21 0.35 3.51 95.86 0.01 0.19 0.00 0.06 0.02 40 G C T 69.38 0.26 13.01 10.44 95.73 18.66 83.63 -2.61 99.73 0.07 0.20 0.47 3.42 95.84 0.00 0.21 0.00 0.04 0.01 41 Q C S 93.88 4.79 10.04 17.02 129.39 95.68 -114.58 160.04 94.71 4.99 0.29 36.00 57.67 1.12 0.06 0.24 0.00 1.74 3.18 42 S C C 81.70 1.76 16.95 18.42 116.81 -96.03 -72.81 151.30 97.70 2.27 0.03 85.87 11.84 0.18 0.00 0.02 0.00 1.76 0.31 43 P C C 47.98 17.56 10.88 27.61 115.19 -99.98 -66.12 144.74 92.55 7.42 0.03 90.42 2.09 0.16 0.00 0.03 0.00 7.05 0.24 44 K E E 96.17 7.70 20.85 29.34 123.84 -156.87 -118.56 138.48 11.04 88.89 0.08 9.56 1.32 0.13 0.03 0.04 0.00 88.09 0.82 45 L E E 66.08 14.92 18.60 33.16 111.39 -115.21 -73.68 129.34 1.58 98.40 0.02 1.42 0.08 0.01 0.01 0.00 0.00 98.40 0.07 46 L E E 18.86 19.61 20.66 40.04 101.71 176.46 -96.73 -34.16 3.65 96.32 0.04 2.44 1.03 0.06 0.01 0.01 0.00 96.42 0.03 47 I E E 15.22 20.39 21.53 41.68 135.03 7.01 -145.29 142.80 0.79 99.19 0.02 0.63 0.07 0.01 0.01 0.00 0.00 99.26 0.02 48 Y E E 48.50 17.66 22.03 38.88 127.62 -172.03 -129.88 136.62 4.11 95.81 0.08 3.48 0.36 0.06 0.03 0.03 0.00 95.91 0.14 49 S E E 22.11 15.05 20.83 36.05 119.79 -170.96 -118.24 135.97 26.40 72.27 1.32 19.26 5.83 2.09 0.46 0.81 0.00 70.78 0.78 50 A C C 35.75 14.37 17.07 31.38 100.92 -150.28 -78.44 -12.92 60.65 26.21 13.14 24.20 16.93 22.00 2.69 9.28 0.06 22.98 1.86 51 S C T 64.86 6.69 18.07 25.11 100.37 56.89 -81.61 -20.40 77.20 6.29 16.50 18.23 21.39 38.79 3.16 12.28 0.04 4.64 1.46 52 N C T 88.45 7.55 16.10 24.31 104.79 36.76 -100.83 45.02 73.43 9.25 17.32 21.07 21.67 32.77 3.73 12.01 0.07 6.66 2.02 53 R C C 120.83 9.21 15.00 24.82 106.71 73.02 -90.32 58.88 59.95 29.60 10.45 29.65 15.72 17.42 3.57 6.37 0.13 23.28 3.87 54 Y C C 108.14 11.73 13.89 25.84 114.93 129.85 -102.04 127.29 54.71 39.11 6.18 34.39 12.45 9.54 2.64 3.70 0.07 31.97 5.25 55 T C C 85.65 5.52 16.73 23.66 117.95 -164.74 -110.30 134.24 64.62 31.58 3.80 36.12 16.58 13.86 1.31 2.44 0.03 26.47 3.18 56 G C C 39.34 6.67 18.36 25.87 114.99 12.72 99.00 -26.66 81.06 17.70 1.24 38.54 31.92 11.43 0.23 1.13 0.00 14.51 2.24 57 V C C 38.14 19.44 12.22 30.57 116.82 -62.31 -92.32 132.66 88.40 11.20 0.40 70.01 17.41 1.20 0.13 0.31 0.00 8.14 2.79 58 P C C 44.99 11.38 15.06 27.59 113.34 -109.69 -66.20 151.83 89.89 5.68 4.44 73.47 7.54 8.20 0.70 4.41 0.00 4.28 1.40 59 D C T 123.68 1.76 17.75 19.89 93.11 -113.41 -66.06 -21.41 82.52 2.83 14.65 13.20 23.28 45.51 1.09 14.24 0.01 1.83 0.84 60 R C T 105.28 10.01 17.01 27.45 94.77 61.95 -84.24 -9.26 78.64 7.05 14.32 11.91 24.00 43.24 1.07 13.09 0.01 5.64 1.04 61 F E E 19.99 23.33 11.98 34.51 118.52 71.63 -110.53 126.16 32.70 61.35 5.96 22.88 8.41 4.19 1.14 4.18 0.01 57.61 1.59 62 T E E 71.34 6.11 23.27 30.36 129.23 165.13 -129.54 148.15 10.96 88.85 0.19 9.49 1.36 0.23 0.09 0.10 0.00 87.65 1.08 63 G E E 23.20 18.49 14.97 32.12 139.87 166.20 -154.42 166.67 7.88 92.04 0.07 6.78 0.89 0.15 0.02 0.04 0.00 91.63 0.49 64 S E E 64.62 4.78 21.78 28.12 135.51 -164.86 -146.19 155.94 15.78 84.13 0.09 13.67 1.72 0.25 0.02 0.06 0.00 83.68 0.59 65 G E E 30.68 11.57 15.35 27.51 138.81 133.16 148.27 164.55 37.44 62.39 0.17 27.67 8.97 1.33 0.02 0.18 0.00 60.74 1.08 66 S C C 76.03 3.43 20.75 24.74 116.68 -124.13 -123.29 119.83 61.50 37.80 0.70 39.16 18.18 5.61 0.11 0.76 0.00 32.94 3.23 67 G C S 33.44 10.07 19.02 29.19 110.49 -44.51 64.80 -131.71 97.75 1.40 0.85 3.28 56.06 38.57 0.03 0.87 0.00 1.01 0.19 68 T C S 55.24 14.19 16.68 30.84 97.90 -6.18 -98.62 -2.47 97.58 1.72 0.70 3.15 56.92 37.71 0.02 0.67 0.00 1.34 0.18 69 D E E 61.01 8.86 22.45 32.42 119.97 84.64 -107.71 129.95 38.12 61.63 0.25 25.14 12.32 1.67 0.03 0.29 0.00 57.90 2.65 70 F E E 7.58 24.70 16.15 41.33 128.52 -173.95 -126.55 142.13 16.02 83.98 0.01 15.05 0.51 0.03 0.00 0.00 0.00 84.08 0.33 71 T E E 34.24 10.53 27.28 38.90 121.89 -160.43 -117.83 132.57 3.48 96.52 0.00 3.08 0.14 0.00 0.00 0.00 0.00 96.71 0.06 72 L E E 2.83 26.25 19.20 46.37 119.61 -162.99 -113.12 128.48 0.25 99.75 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.72 0.00 73 T E E 37.77 10.40 27.25 38.50 120.37 -164.49 -115.48 129.84 0.12 99.88 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.86 0.00 74 I E E 7.38 24.06 16.44 41.10 117.25 -165.46 -114.08 124.89 2.78 97.22 0.00 2.86 0.03 0.00 0.00 0.00 0.00 96.74 0.37 75 S C C 46.67 7.41 22.73 30.36 126.00 -166.10 -109.64 159.70 92.48 7.46 0.07 45.65 39.06 6.29 0.00 0.10 0.00 8.65 0.24 76 N C S 105.17 3.28 23.53 26.75 95.79 10.39 58.34 52.74 98.99 0.99 0.03 8.10 83.71 7.19 0.00 0.04 0.00 0.89 0.08 77 M C C 20.88 23.72 9.66 32.60 114.00 -152.67 -73.78 135.40 99.17 0.82 0.01 98.01 1.32 0.02 0.00 0.00 0.00 0.30 0.34 78 Q C C 81.84 4.08 23.71 27.49 131.11 -174.51 -124.98 160.20 99.77 0.21 0.02 99.54 0.27 0.00 0.00 0.00 0.00 0.03 0.14 79 S H G 63.70 10.79 15.06 26.43 91.12 -102.33 -58.69 -33.41 3.01 0.01 96.97 0.15 0.18 1.97 0.30 97.38 0.00 0.01 0.00 80 E H G 130.06 3.20 20.95 24.61 89.94 62.38 -69.55 -17.81 2.58 0.02 97.40 0.08 0.14 1.81 0.20 97.75 0.00 0.02 0.00 81 D H G 13.30 20.81 15.48 36.80 93.78 59.00 -88.51 -4.17 3.40 0.03 96.56 0.35 0.31 1.68 0.28 97.35 0.00 0.03 0.00 82 L C C 40.88 16.82 19.24 36.22 115.70 107.27 -72.96 135.75 94.30 5.58 0.12 91.25 3.19 0.10 0.02 0.09 0.00 5.09 0.26 83 A E E 15.29 15.84 22.46 38.25 145.07 147.87 -161.16 174.94 6.26 93.73 0.01 5.85 0.37 0.02 0.00 0.00 0.00 93.27 0.48 84 D E E 48.53 11.74 25.51 37.66 120.01 -82.70 -102.76 135.54 0.60 99.40 0.00 0.54 0.03 0.00 0.00 0.00 0.00 99.41 0.02 85 Y E E 7.72 25.23 18.87 44.35 124.89 -166.85 -119.43 139.90 0.50 99.49 0.00 0.42 0.04 0.00 0.00 0.00 0.00 99.53 0.01 86 F E E 29.52 15.58 27.18 42.86 129.38 -171.63 -124.56 145.45 1.90 98.09 0.01 1.62 0.17 0.02 0.00 0.01 0.00 98.11 0.07 87 C E E 2.72 25.55 21.21 47.14 123.74 -153.92 -114.44 139.13 7.30 92.62 0.09 6.23 0.69 0.10 0.02 0.07 0.00 92.70 0.20 88 Q E E 32.17 14.88 26.05 40.88 127.11 -170.79 -123.92 141.94 5.17 94.74 0.09 4.52 0.44 0.08 0.03 0.04 0.00 94.63 0.26 89 Q E E 25.06 19.35 18.96 37.99 122.94 -158.01 -112.87 136.44 8.11 91.74 0.16 6.74 1.11 0.23 0.04 0.10 0.00 91.40 0.37 90 Y E E 87.45 10.62 19.20 30.51 118.74 -159.39 -109.26 129.34 24.38 75.37 0.24 19.27 4.50 0.90 0.05 0.20 0.00 74.11 0.97 91 S C C 40.78 10.27 12.77 24.14 129.59 164.36 -130.12 167.88 68.08 31.50 0.41 49.80 14.05 3.20 0.06 0.41 0.00 31.36 1.13 92 S C S 89.51 2.19 14.56 17.37 97.63 -92.41 -78.66 -17.24 97.00 2.51 0.49 15.35 62.72 18.98 0.04 0.50 0.00 2.06 0.35 93 Y C S 148.70 3.00 13.33 17.73 121.44 34.59 -115.61 135.42 96.82 2.74 0.44 14.79 68.26 13.88 0.04 0.43 0.00 2.16 0.44 94 P C C 79.75 4.84 15.97 21.76 115.71 -38.37 -76.35 150.04 80.06 19.57 0.38 48.29 26.27 4.83 0.05 0.41 0.00 19.23 0.93 95 L E E 53.14 16.56 12.82 29.06 115.13 -114.69 -81.99 134.61 44.12 55.71 0.17 38.89 3.08 0.62 0.03 0.13 0.00 56.50 0.74 96 T E E 52.17 10.53 20.92 31.98 126.00 -169.81 -121.74 139.80 11.10 88.84 0.06 9.93 0.80 0.12 0.03 0.04 0.00 86.94 2.14 97 F E E 58.00 18.73 17.10 34.84 118.44 -136.55 -99.33 132.90 15.82 84.05 0.13 13.48 1.75 0.35 0.05 0.09 0.00 81.70 2.59 98 G C C 19.01 14.28 18.80 32.94 118.52 -143.46 -80.65 -168.14 62.23 37.44 0.33 44.79 13.40 2.94 0.04 0.33 0.00 37.68 0.82 99 A C C 64.65 7.27 22.71 29.88 100.31 -62.67 -76.51 -2.67 70.59 28.99 0.42 43.85 21.22 4.76 0.04 0.47 0.00 28.89 0.76 100 G C C 16.32 17.22 18.04 34.21 125.84 -121.34 88.79 174.34 67.24 32.57 0.19 54.15 9.12 1.51 0.02 0.20 0.00 34.53 0.47 101 T E E 26.45 17.68 19.11 36.55 127.69 -111.14 -122.29 144.14 14.48 85.50 0.02 13.42 0.58 0.04 0.00 0.01 0.00 85.62 0.33 102 K E E 100.65 9.16 23.95 33.47 119.12 -139.17 -101.51 133.84 1.36 98.64 0.00 1.21 0.07 0.00 0.00 0.00 0.00 98.65 0.06 103 L E E 11.25 23.67 14.80 38.51 121.07 -162.49 -112.67 132.94 1.22 98.77 0.00 1.16 0.03 0.00 0.00 0.00 0.00 98.77 0.03 104 E E E 90.14 6.13 24.07 30.57 119.56 -160.49 -111.08 131.14 2.07 97.92 0.01 2.05 0.06 0.01 0.00 0.00 0.00 97.76 0.12 105 L E E 30.30 20.42 11.41 31.07 116.33 -150.45 -95.99 127.71 15.31 84.64 0.05 15.70 0.21 0.03 0.02 0.02 0.00 83.23 0.80 106 R C C 141.71 4.35 19.68 24.93 116.98 -158.73 -104.94 130.91 99.26 0.73 0.00 99.34 0.05 0.01 0.00 0.00 0.00 0.59 0.01