# 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 34.37 8.55 18.78 27.77 121.42 -156.38 99.09 147.62 99.51 0.49 0.00 99.38 0.14 0.04 0.00 0.00 0.00 0.42 0.01 1 V C C 54.32 14.78 14.17 28.75 119.55 -116.57 -104.16 132.93 51.07 48.84 0.09 49.65 0.65 0.17 0.02 0.05 0.00 48.56 0.91 2 L E E 81.76 8.42 18.23 27.58 118.84 -160.84 -108.44 128.69 17.62 82.30 0.08 15.50 1.61 0.19 0.03 0.05 0.00 82.08 0.53 3 M E E 48.13 17.68 14.52 31.80 121.13 -161.85 -110.29 133.09 7.61 92.34 0.05 6.99 0.48 0.07 0.02 0.02 0.00 92.04 0.38 4 T E E 63.70 8.84 20.33 29.93 126.74 -171.08 -124.22 140.70 9.44 90.48 0.07 8.57 0.68 0.10 0.03 0.04 0.00 89.54 1.04 5 Q E E 65.04 16.27 14.78 30.46 126.03 -162.91 -120.07 139.65 34.78 65.12 0.11 28.43 5.86 0.42 0.02 0.09 0.00 64.03 1.14 6 S C C 57.17 7.42 18.92 27.10 121.93 -139.39 -98.57 147.58 74.31 25.60 0.09 52.82 20.10 0.61 0.01 0.09 0.00 25.71 0.67 7 P C C 67.97 8.72 17.44 26.86 114.74 -29.44 -69.15 148.78 84.04 15.75 0.21 63.72 17.09 1.61 0.02 0.24 0.00 16.83 0.49 8 L C C 68.00 14.30 15.29 29.42 101.50 -149.55 -86.84 -12.59 65.17 34.61 0.23 44.72 18.62 1.45 0.03 0.24 0.00 34.07 0.86 9 S E E 58.78 8.27 20.38 29.43 132.93 18.77 -135.06 146.87 19.82 80.10 0.08 17.16 2.40 0.21 0.01 0.07 0.00 79.26 0.89 10 L E E 30.70 18.61 15.25 33.66 124.69 -172.93 -131.61 131.52 4.91 95.09 0.01 4.37 0.43 0.02 0.00 0.00 0.00 94.97 0.22 11 P E E 79.29 5.75 23.72 29.83 114.04 -123.52 -76.05 137.22 5.41 94.59 0.01 4.96 0.30 0.02 0.00 0.01 0.00 94.55 0.17 12 V E E 13.82 22.18 12.52 34.38 134.30 178.24 -138.60 154.42 16.72 83.24 0.03 16.22 0.57 0.04 0.01 0.02 0.00 81.13 2.01 13 R C C 126.80 3.80 23.61 27.38 121.19 -129.54 -97.09 146.25 52.78 47.10 0.12 52.01 1.47 0.19 0.05 0.07 0.00 40.19 6.02 14 L C T 71.13 14.78 13.35 28.00 109.32 -88.13 -60.00 134.19 99.12 0.55 0.33 0.28 2.49 96.64 0.02 0.21 0.00 0.31 0.06 15 G C T 47.35 3.87 19.07 23.73 96.23 23.18 89.48 -6.63 99.57 0.19 0.23 0.36 3.19 96.13 0.01 0.16 0.00 0.13 0.02 16 D C C 65.63 7.43 17.42 26.15 124.36 116.82 -84.26 154.99 96.64 3.18 0.18 57.30 39.37 0.43 0.03 0.15 0.00 2.19 0.53 17 Q C C 107.12 7.11 19.00 27.42 118.33 -113.14 -86.17 141.36 81.06 18.88 0.06 80.42 1.08 0.11 0.01 0.04 0.00 17.46 0.89 18 A E E 10.36 22.07 14.17 35.98 131.08 -171.34 -130.51 150.74 4.07 95.91 0.02 3.91 0.15 0.01 0.00 0.01 0.00 95.64 0.28 19 S E E 54.21 8.44 24.79 33.89 125.40 -150.91 -121.00 140.03 0.96 99.04 0.00 0.92 0.04 0.00 0.00 0.00 0.00 99.00 0.05 20 I E E 7.69 25.13 16.61 42.12 124.15 -168.55 -124.06 132.41 4.02 95.97 0.01 3.76 0.18 0.01 0.00 0.00 0.00 95.90 0.13 21 S E E 42.69 9.18 26.57 36.18 123.15 -159.64 -109.93 141.61 26.13 73.84 0.03 24.07 0.97 0.07 0.00 0.02 0.00 74.69 0.17 22 C E E 6.09 25.35 16.37 41.88 129.36 -171.22 -130.38 142.15 34.63 65.26 0.11 31.65 1.90 0.19 0.02 0.07 0.00 65.47 0.69 23 R E E 104.38 8.07 26.09 34.72 123.77 -162.22 -118.68 135.55 17.74 81.81 0.46 15.19 1.70 0.38 0.29 0.24 0.00 72.95 9.25 24 S E E 15.90 22.08 14.11 35.42 123.98 -162.36 -107.18 146.63 43.41 54.23 2.36 38.04 3.82 1.10 1.14 1.34 0.01 50.95 3.60 25 S C C 64.59 6.02 20.61 27.17 99.74 -144.90 -86.72 -9.53 73.96 18.13 7.91 40.59 28.00 6.49 2.82 4.60 0.02 15.79 1.70 26 Q C S 91.86 8.13 17.71 26.44 120.23 48.52 -106.92 150.22 69.59 12.42 17.98 22.68 33.46 15.41 7.38 8.96 0.18 9.63 2.30 27 S C C 60.65 8.31 18.80 27.66 115.18 -106.24 -85.69 135.92 65.63 16.71 17.66 43.19 12.64 10.45 7.27 9.90 0.03 14.74 1.78 28 I C C 43.99 17.29 15.32 32.16 113.98 -143.59 -97.64 123.51 46.13 34.47 19.40 32.14 9.42 6.32 10.34 8.68 0.16 29.89 3.05 29 V E E 54.55 12.32 17.68 30.45 116.57 -165.71 -104.34 126.33 33.75 51.41 14.84 22.93 7.12 5.77 9.10 5.77 0.23 45.44 3.65 30 Y E E 103.73 11.12 15.69 27.25 116.21 -159.80 -106.96 124.20 37.43 51.89 10.68 26.17 7.60 5.83 6.01 4.76 0.16 45.72 3.75 31 S C E 53.00 9.99 13.69 24.47 113.61 165.40 -109.53 109.79 56.62 36.82 6.56 30.59 12.73 15.26 2.67 3.63 0.09 31.88 3.14 32 N C T 118.59 3.00 16.70 20.36 98.16 -29.24 18.12 30.18 91.20 4.51 4.29 12.93 23.48 55.02 1.10 2.94 0.00 3.72 0.80 33 G C T 42.00 7.00 15.37 23.33 97.97 -79.17 84.10 2.00 94.11 3.47 2.42 10.58 35.38 48.38 0.26 2.11 0.00 2.78 0.51 34 N C E 64.55 10.25 18.17 29.04 119.77 104.21 -103.92 134.84 53.47 45.50 1.03 29.31 19.49 7.01 0.16 0.95 0.00 41.19 1.88 35 T E E 21.35 19.64 17.29 36.57 118.16 -148.68 -108.07 130.98 29.00 70.78 0.21 24.16 3.76 0.71 0.05 0.17 0.00 70.19 0.96 36 Y E E 40.72 14.57 24.93 39.74 131.98 175.06 -130.38 150.72 9.91 90.04 0.04 8.52 0.99 0.10 0.01 0.03 0.00 89.99 0.37 37 L E E 4.05 25.59 20.62 46.75 120.94 -148.00 -111.78 131.84 3.83 96.16 0.01 3.38 0.23 0.02 0.00 0.00 0.00 96.29 0.08 38 E E E 37.67 15.26 27.21 42.25 125.24 -166.96 -120.46 138.99 1.03 98.97 0.00 0.96 0.04 0.00 0.00 0.00 0.00 98.99 0.01 39 W E E 7.89 24.69 20.97 45.84 125.36 -161.49 -116.64 139.49 0.56 99.44 0.00 0.54 0.01 0.00 0.00 0.00 0.00 99.44 0.01 40 Y E E 28.37 15.68 25.22 41.09 129.73 -173.46 -129.84 146.99 0.35 99.65 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.66 0.01 41 L E E 18.49 18.71 20.72 39.54 120.64 -149.29 -110.23 132.70 1.14 98.86 0.00 0.95 0.06 0.00 0.00 0.00 0.00 98.95 0.04 42 Q E E 48.02 13.25 17.68 31.79 119.81 -157.15 -107.37 133.38 15.14 84.85 0.01 13.89 0.72 0.04 0.00 0.01 0.00 84.52 0.83 43 R C C 99.53 8.16 15.73 25.14 119.01 -138.25 -86.96 144.86 96.74 3.23 0.04 94.80 1.96 0.23 0.01 0.03 0.00 2.57 0.40 44 P C T 95.86 5.30 11.84 19.06 109.22 -87.11 -58.77 135.18 99.68 0.10 0.22 0.33 3.31 96.06 0.01 0.21 0.00 0.06 0.02 45 G C T 69.70 0.24 13.23 10.35 94.74 17.86 82.90 -2.87 99.71 0.06 0.22 0.43 3.25 96.03 0.00 0.24 0.00 0.04 0.01 46 Q C S 87.87 5.70 9.60 17.41 129.79 97.09 -114.60 160.87 95.22 4.44 0.34 40.40 53.89 1.12 0.05 0.31 0.00 1.57 2.66 47 S C C 82.73 1.61 17.27 18.37 116.39 -97.59 -72.47 150.41 97.97 2.01 0.03 87.41 10.59 0.16 0.00 0.02 0.00 1.53 0.29 48 P C C 48.14 17.80 10.92 27.77 114.86 -100.89 -66.06 144.53 91.76 8.21 0.03 89.54 2.14 0.14 0.00 0.03 0.00 7.89 0.27 49 K E E 96.17 7.48 20.80 29.14 123.97 -157.52 -119.37 137.23 10.01 89.94 0.05 8.72 1.09 0.09 0.01 0.03 0.00 89.54 0.52 50 L E E 66.36 14.94 18.10 32.75 111.06 -116.20 -75.25 127.12 0.89 99.10 0.01 0.81 0.03 0.00 0.00 0.00 0.00 99.13 0.03 51 L E E 21.64 18.47 20.09 38.65 101.59 175.67 -96.53 -34.52 2.12 97.86 0.02 1.50 0.47 0.02 0.00 0.00 0.00 97.98 0.01 52 I E E 17.52 19.42 21.11 40.46 136.00 4.66 -148.82 142.55 0.46 99.53 0.01 0.38 0.03 0.00 0.00 0.00 0.00 99.57 0.01 53 Y E E 50.95 18.05 21.14 38.33 125.69 -170.59 -128.78 133.12 1.49 98.48 0.03 1.27 0.07 0.01 0.01 0.00 0.00 98.61 0.02 54 K E E 66.67 13.17 23.00 35.82 121.00 -169.15 -120.34 127.05 9.20 90.61 0.19 7.41 1.18 0.21 0.07 0.07 0.00 90.81 0.24 55 V E E 32.14 16.91 17.34 34.15 116.43 -168.30 -109.64 129.32 34.37 64.07 1.55 25.93 7.23 2.47 0.54 0.97 0.00 61.66 1.19 56 S C S 49.52 9.15 19.14 28.51 115.42 -105.10 -104.87 145.01 73.74 22.31 3.96 25.88 28.67 20.44 0.79 2.85 0.02 19.72 1.63 57 N C S 89.73 8.56 17.52 26.45 103.81 18.95 -92.51 30.83 81.58 12.72 5.70 25.64 31.97 25.32 1.06 4.14 0.03 9.91 1.93 58 R C C 117.07 8.54 17.10 26.39 117.05 102.28 -102.33 133.04 69.76 24.60 5.64 43.94 15.36 11.57 1.59 4.15 0.03 19.11 4.26 59 F C C 72.95 15.45 12.52 27.59 114.52 -153.53 -98.77 123.04 69.04 26.34 4.62 46.54 12.70 9.98 1.44 3.42 0.02 20.29 5.60 60 S C T 71.71 5.75 16.85 23.77 116.44 -166.12 -103.22 132.33 77.87 19.04 3.08 28.23 18.79 32.77 0.68 2.26 0.02 14.67 2.59 61 G C S 51.40 4.29 17.63 22.88 102.75 14.73 83.89 1.07 88.64 9.76 1.60 24.85 32.48 31.95 0.19 1.53 0.00 7.69 1.30 62 V C C 39.51 16.33 11.43 27.65 117.31 119.85 -96.50 129.54 88.51 10.96 0.53 61.76 25.54 1.67 0.18 0.40 0.00 7.00 3.46 63 P C C 68.22 7.72 17.20 25.95 108.99 -113.72 -66.81 147.63 85.61 7.60 6.79 47.27 16.40 22.12 1.51 5.51 0.00 5.86 1.33 64 D C C 88.42 9.38 17.26 26.94 101.28 -104.72 -77.02 17.08 80.22 10.19 9.60 38.50 18.77 23.77 2.05 7.53 0.01 7.91 1.44 65 R C C 98.91 11.73 19.01 30.57 105.84 97.28 -95.67 26.60 64.33 25.27 10.41 37.20 18.90 9.36 2.87 7.30 0.03 22.12 2.22 66 V E E 24.19 21.50 14.77 35.44 119.47 83.17 -108.93 131.57 32.03 63.35 4.62 23.40 6.31 3.05 2.68 2.40 0.04 55.71 6.41 67 S E E 53.50 8.60 22.50 31.83 130.90 142.04 -131.59 152.24 32.90 65.45 1.66 26.00 5.03 1.99 0.86 0.98 0.01 61.14 3.99 68 G E E 25.50 16.13 16.89 31.98 135.08 158.73 -159.28 170.00 47.95 51.21 0.84 35.37 10.67 3.18 0.21 0.71 0.00 47.74 2.11 69 S C C 66.29 6.59 20.63 28.34 127.88 -140.08 -126.95 149.51 62.33 36.75 0.92 46.89 11.65 3.88 0.21 0.87 0.00 33.74 2.76 70 G C C 30.93 12.67 16.13 28.61 129.96 116.13 -106.60 158.43 75.28 23.34 1.38 42.75 23.15 10.19 0.21 1.48 0.00 19.47 2.75 71 S C S 71.83 5.02 20.70 26.61 113.78 -117.20 -108.05 113.20 77.20 19.83 2.96 26.83 29.41 22.84 0.37 2.89 0.02 13.48 4.17 72 G C S 28.42 12.34 18.12 30.14 117.22 -32.80 82.55 -150.46 92.41 4.85 2.73 13.25 45.09 34.22 0.19 2.77 0.00 3.47 1.01 73 T C S 59.07 13.26 18.34 31.30 100.09 -33.01 -96.21 0.91 88.33 9.37 2.30 18.10 47.35 23.12 0.21 2.29 0.00 7.34 1.59 74 D C C 63.93 9.01 22.75 32.49 120.95 80.64 -104.23 134.30 65.62 33.39 0.99 33.18 27.18 6.01 0.20 1.02 0.00 26.47 5.94 75 F C C 11.04 24.25 16.74 40.97 127.08 -173.09 -126.35 141.00 53.76 46.09 0.15 47.33 4.44 0.56 0.03 0.15 0.00 45.19 2.31 76 T E E 35.39 11.20 26.72 38.74 123.65 -159.37 -117.71 135.73 29.06 70.91 0.02 26.08 1.99 0.09 0.00 0.02 0.00 70.75 1.07 77 L E E 3.55 26.06 18.90 45.77 119.30 -162.63 -113.44 128.36 4.70 95.30 0.00 4.70 0.12 0.01 0.00 0.00 0.00 95.04 0.13 78 K E E 79.44 9.37 27.16 37.06 118.29 -163.61 -113.28 127.23 0.76 99.24 0.00 0.84 0.01 0.00 0.00 0.00 0.00 99.03 0.11 79 I E E 7.12 24.54 16.19 41.35 116.74 -167.36 -113.44 122.87 4.11 95.89 0.00 4.41 0.04 0.00 0.00 0.00 0.00 93.92 1.62 80 S C S 46.01 7.47 23.13 30.80 127.58 -170.41 -115.04 152.61 88.81 11.16 0.03 40.31 44.23 2.65 0.00 0.05 0.00 12.52 0.24 81 R C S 143.92 3.79 23.89 27.76 96.29 10.27 57.27 56.11 97.55 2.44 0.01 7.01 87.65 2.75 0.00 0.02 0.00 2.47 0.10 82 V C C 12.25 24.56 10.61 34.89 114.86 -160.54 -77.17 134.30 97.72 2.27 0.00 97.31 1.00 0.01 0.00 0.00 0.00 1.16 0.52 83 E C C 83.28 4.72 24.86 29.31 132.43 -168.53 -124.68 161.83 97.32 2.66 0.02 97.97 0.19 0.01 0.01 0.00 0.00 0.52 1.31 84 A H G 50.92 14.36 15.21 29.44 90.85 -102.70 -58.50 -33.79 2.56 0.02 97.42 0.16 0.17 1.62 0.28 97.75 0.00 0.01 0.00 85 E H G 127.10 3.56 21.89 26.15 90.04 62.89 -69.74 -17.52 2.24 0.02 97.73 0.08 0.13 1.55 0.19 98.04 0.00 0.02 0.00 86 D H G 12.37 21.52 16.70 38.57 93.31 60.68 -86.40 -5.44 3.16 0.03 96.81 0.31 0.28 1.60 0.23 97.55 0.00 0.03 0.00 87 L C C 38.21 17.98 19.63 37.53 114.55 113.22 -69.53 137.13 98.51 1.43 0.06 95.30 3.33 0.10 0.01 0.05 0.00 1.11 0.11 88 G E E 10.88 11.70 24.76 38.23 140.16 74.97 144.05 -168.06 9.08 90.91 0.01 7.55 1.51 0.05 0.00 0.01 0.00 90.36 0.52 89 V E E 32.27 15.79 25.40 41.12 119.64 -38.31 -103.93 133.06 0.58 99.42 0.00 0.53 0.02 0.00 0.00 0.00 0.00 99.43 0.02 90 Y E E 5.57 25.52 21.90 47.52 122.59 -163.45 -113.64 136.36 0.30 99.70 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.72 0.00 91 Y E E 21.59 19.52 27.96 46.64 128.26 -169.35 -124.30 142.63 0.67 99.33 0.00 0.58 0.03 0.00 0.00 0.00 0.00 99.37 0.01 92 C E E 2.56 25.60 23.64 49.11 124.30 -162.06 -118.41 137.28 2.95 97.05 0.01 2.49 0.20 0.01 0.00 0.00 0.00 97.23 0.05 93 F E E 26.95 17.61 25.74 42.77 129.77 -172.03 -124.70 147.52 6.29 93.69 0.02 5.76 0.34 0.03 0.00 0.01 0.00 93.38 0.47 94 Q E E 45.29 17.27 21.16 37.57 120.79 -150.82 -109.28 138.96 32.19 67.67 0.14 25.65 6.15 0.76 0.03 0.12 0.00 66.40 0.89 95 G C C 19.83 12.37 18.80 31.50 133.02 104.78 -139.28 175.26 74.12 25.45 0.43 50.20 19.48 4.36 0.06 0.48 0.00 23.92 1.50 96 S C S 71.06 6.71 16.98 24.48 103.61 -103.21 -89.81 -15.06 92.60 6.63 0.77 17.56 54.40 20.84 0.06 0.83 0.00 5.31 0.99 97 H C S 121.16 5.55 16.83 23.10 102.84 26.96 -94.42 -6.99 96.35 2.94 0.71 12.97 61.14 22.41 0.06 0.74 0.00 2.06 0.63 98 V C S 60.47 10.54 13.09 24.83 120.27 52.29 -116.77 132.01 92.49 6.97 0.54 24.27 64.30 4.33 0.10 0.45 0.00 4.78 1.76 99 P C C 76.09 6.72 18.12 25.55 112.23 -103.32 -69.62 146.74 91.35 7.89 0.76 57.40 26.17 7.55 0.10 0.84 0.00 7.15 0.78 100 Y C C 84.18 15.93 15.46 30.76 116.67 -116.58 -86.47 135.27 68.15 30.89 0.97 54.44 9.22 3.43 0.16 0.91 0.00 30.23 1.62 101 T E E 51.03 12.32 20.41 32.84 124.72 -168.52 -120.51 140.51 29.27 70.18 0.55 24.82 3.03 0.89 0.23 0.37 0.00 64.08 6.57 102 F E E 54.54 18.96 17.42 35.31 116.93 -155.80 -103.22 131.34 30.39 68.89 0.73 23.49 5.62 2.01 0.28 0.57 0.00 62.23 5.80 103 G C E 28.63 12.44 20.62 32.44 113.86 -152.03 52.85 -149.22 60.28 38.82 0.89 28.22 22.02 11.51 0.11 0.89 0.00 35.80 1.45 104 G C C 39.04 9.15 22.04 30.82 100.55 -11.40 48.78 -1.13 70.12 29.03 0.85 32.44 26.71 10.96 0.08 0.92 0.00 27.88 1.01 105 G C C 15.15 17.20 17.98 34.35 125.00 -132.06 94.29 178.24 67.74 31.97 0.29 52.96 10.97 1.79 0.03 0.32 0.00 33.24 0.68 106 T E E 25.34 18.48 19.47 37.47 127.13 -101.09 -120.06 142.79 17.92 82.05 0.03 16.43 0.82 0.06 0.01 0.02 0.00 82.31 0.35 107 K E E 95.85 10.21 24.07 34.44 121.68 -146.80 -107.01 134.58 1.48 98.51 0.00 1.32 0.08 0.00 0.00 0.00 0.00 98.53 0.06 108 L E E 11.31 23.61 15.61 39.29 120.61 -163.29 -112.41 130.61 1.04 98.96 0.00 1.02 0.03 0.00 0.00 0.00 0.00 98.92 0.03 109 E E E 89.34 6.36 24.09 30.85 119.16 -159.73 -108.18 130.18 2.42 97.57 0.01 2.38 0.08 0.01 0.00 0.00 0.00 97.38 0.13 110 I E E 28.92 20.37 11.51 31.24 116.45 -156.08 -101.70 127.03 18.57 81.39 0.04 18.80 0.23 0.04 0.02 0.02 0.00 80.11 0.78 111 K C C 125.80 4.36 19.63 24.83 115.01 -156.65 -94.01 128.51 99.43 0.56 0.00 99.48 0.05 0.01 0.00 0.00 0.00 0.45 0.01