# 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 97.27 4.32 20.26 24.88 103.67 -150.28 -85.10 60.60 99.74 0.26 0.00 99.67 0.10 0.03 0.00 0.00 0.00 0.20 0.01 1 I C C 37.69 20.05 11.04 29.96 118.40 -156.20 -102.26 130.10 52.38 47.52 0.10 51.36 0.57 0.16 0.02 0.05 0.00 47.02 0.81 2 Q E E 100.12 5.02 21.14 27.13 122.67 -167.71 -116.76 136.70 19.32 80.54 0.15 17.50 1.43 0.23 0.05 0.08 0.00 80.01 0.70 3 M E E 47.53 20.21 12.99 32.24 123.01 -161.24 -113.93 135.70 10.90 88.99 0.10 10.26 0.60 0.11 0.04 0.05 0.00 88.19 0.75 4 T E E 63.96 7.45 21.29 29.46 126.18 -171.89 -123.23 144.39 15.78 84.07 0.15 14.18 1.34 0.22 0.06 0.08 0.00 82.50 1.62 5 Q E E 69.44 15.57 14.72 29.86 124.75 -159.56 -118.78 138.53 46.55 53.27 0.18 36.27 9.81 0.75 0.04 0.16 0.00 51.56 1.41 6 S C C 57.16 8.68 17.50 27.00 120.83 -141.38 -101.85 148.49 83.96 15.95 0.09 57.96 24.53 0.93 0.01 0.10 0.00 15.79 0.68 7 P C C 60.66 8.13 17.00 26.06 116.15 19.45 -73.60 153.29 91.71 7.95 0.34 57.05 29.95 4.15 0.03 0.40 0.00 7.98 0.43 8 S C S 64.67 9.89 16.26 26.78 97.01 -147.51 -84.84 -20.32 76.74 23.02 0.23 27.48 44.97 2.81 0.02 0.26 0.00 23.95 0.51 9 T E E 69.52 6.95 19.78 27.98 131.54 29.31 -136.78 142.18 13.75 86.14 0.11 11.39 1.96 0.21 0.01 0.09 0.00 85.96 0.37 10 L E E 29.65 19.61 14.78 33.95 130.13 -175.15 -134.71 142.93 1.89 98.10 0.01 1.72 0.10 0.01 0.00 0.00 0.00 98.07 0.09 11 S E E 65.33 6.34 23.27 30.88 124.17 -158.15 -118.25 140.04 2.12 97.88 0.01 1.90 0.14 0.01 0.00 0.00 0.00 97.85 0.09 12 A E E 12.05 19.22 14.58 34.06 138.81 166.29 -147.80 160.03 16.27 83.70 0.03 14.52 0.98 0.06 0.01 0.02 0.00 84.07 0.34 13 S E E 54.80 4.86 23.71 28.33 124.17 -114.05 -90.31 159.42 40.31 59.51 0.19 36.18 3.10 0.44 0.07 0.14 0.00 54.74 5.32 14 V C T 60.89 15.00 14.19 29.14 109.20 -82.12 -59.80 134.63 98.62 0.85 0.53 0.42 3.47 95.11 0.02 0.37 0.00 0.49 0.12 15 G C T 45.09 4.39 19.93 25.06 95.90 23.04 89.02 -6.25 99.36 0.27 0.37 0.60 4.18 94.69 0.02 0.31 0.00 0.17 0.04 16 D C C 59.02 9.05 16.87 27.16 121.33 121.97 -78.71 152.44 96.36 3.40 0.24 61.54 34.46 0.72 0.05 0.20 0.00 2.48 0.55 17 R C C 131.14 7.74 19.27 28.29 120.16 -126.09 -100.38 136.47 75.21 24.78 0.02 75.57 0.57 0.03 0.00 0.01 0.00 23.23 0.59 18 V E E 13.35 21.75 14.45 36.20 127.70 -171.50 -127.32 142.58 1.33 98.67 0.00 1.33 0.02 0.00 0.00 0.00 0.00 98.56 0.09 19 T E E 64.25 7.55 24.70 32.72 117.46 -145.26 -106.42 127.91 0.33 99.67 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.67 0.00 20 I E E 5.49 25.32 16.20 42.29 120.25 -167.24 -114.51 128.57 1.21 98.79 0.00 1.13 0.02 0.00 0.00 0.00 0.00 98.83 0.01 21 T E E 44.97 9.10 26.78 36.56 120.53 -164.47 -113.42 134.03 6.43 93.57 0.00 5.84 0.15 0.00 0.00 0.00 0.00 93.97 0.04 22 C E E 4.56 25.52 16.44 42.42 125.95 -170.89 -124.92 139.19 8.52 91.47 0.01 7.72 0.33 0.01 0.00 0.00 0.00 91.85 0.10 23 R E E 104.60 7.13 27.18 35.04 121.10 -164.88 -115.75 130.06 5.20 94.78 0.02 4.91 0.22 0.02 0.01 0.01 0.00 93.68 1.15 24 A E E 9.50 23.72 13.65 37.05 119.83 -149.32 -96.74 140.67 36.48 63.26 0.27 35.39 1.19 0.21 0.08 0.17 0.00 60.53 2.42 25 S C S 57.82 6.53 21.18 28.07 104.16 -155.24 -91.04 -25.09 83.29 16.22 0.50 38.56 41.87 3.11 0.05 0.52 0.00 15.19 0.69 26 Q C S 107.59 5.32 19.72 25.68 116.02 10.74 -110.24 131.81 88.41 10.87 0.72 19.04 64.18 5.37 0.07 0.71 0.00 9.76 0.87 27 S C C 51.43 12.13 15.95 28.19 119.30 -103.42 -97.40 138.48 90.17 9.04 0.78 78.52 8.62 2.75 0.12 0.84 0.00 7.74 1.42 28 I C C 77.21 11.67 17.72 29.52 103.34 -160.51 -92.47 -6.00 88.55 10.68 0.77 61.20 22.06 5.17 0.18 0.76 0.00 7.02 3.61 29 S C C 29.70 14.47 17.47 32.13 123.32 98.62 -107.88 148.40 90.02 9.48 0.50 58.61 26.25 5.09 0.07 0.56 0.00 7.93 1.49 30 T C S 65.51 10.98 21.33 32.31 99.72 -150.05 -94.74 -10.23 89.06 10.74 0.20 23.04 63.01 2.33 0.02 0.18 0.00 10.95 0.48 31 W E E 70.13 13.25 23.02 36.40 124.17 51.48 -121.25 140.31 31.51 68.37 0.12 24.45 5.91 0.61 0.02 0.12 0.00 68.43 0.47 32 L E E 4.73 25.49 19.71 45.35 126.99 -169.24 -124.90 139.96 3.01 96.98 0.01 2.72 0.17 0.01 0.00 0.00 0.00 97.02 0.08 33 A E E 10.36 17.69 27.32 44.92 129.40 -167.57 -126.02 146.15 0.40 99.60 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.00 34 W E E 7.82 24.65 22.67 47.21 124.37 -155.18 -115.98 140.88 0.33 99.67 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.69 0.00 35 Y E E 24.96 16.91 24.07 40.97 132.59 -173.64 -130.61 150.29 0.45 99.55 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.59 0.01 36 Q E E 37.42 15.31 21.43 36.89 121.25 -146.04 -111.18 135.93 2.15 97.85 0.00 1.77 0.15 0.01 0.00 0.00 0.00 98.01 0.05 37 Q E E 50.80 13.83 16.08 30.56 120.05 -156.40 -107.84 135.64 26.03 73.95 0.02 23.78 1.38 0.05 0.00 0.01 0.00 73.85 0.92 38 K C C 96.46 6.44 15.60 23.35 119.40 -135.17 -88.97 146.02 97.45 2.51 0.04 95.45 2.13 0.19 0.01 0.03 0.00 1.81 0.38 39 P C T 102.90 4.03 11.58 17.64 109.47 -84.60 -58.81 134.21 99.58 0.11 0.31 0.42 3.65 95.54 0.01 0.30 0.00 0.07 0.02 40 G C T 68.79 0.32 13.16 10.94 95.98 18.21 83.17 -3.17 99.60 0.08 0.32 0.53 3.64 95.42 0.01 0.34 0.00 0.06 0.01 41 E C S 99.92 4.86 10.88 17.87 128.81 94.70 -113.26 157.69 92.93 6.68 0.39 35.25 56.42 1.30 0.08 0.32 0.00 2.35 4.27 42 A C C 71.68 3.13 16.85 20.51 115.75 -97.14 -70.95 149.17 97.41 2.56 0.03 88.33 9.15 0.15 0.01 0.03 0.00 1.98 0.35 43 P C C 41.17 18.58 11.12 28.86 115.22 -102.34 -65.85 145.07 91.83 8.14 0.03 90.32 1.63 0.11 0.00 0.02 0.00 7.63 0.28 44 K E E 102.46 6.61 21.61 29.05 123.51 -152.42 -117.07 138.18 10.82 89.11 0.06 9.48 1.19 0.10 0.02 0.03 0.00 88.52 0.64 45 L E E 63.71 15.87 17.25 32.71 110.75 -116.75 -75.26 126.20 1.00 99.00 0.01 0.93 0.04 0.00 0.00 0.00 0.00 98.99 0.04 46 L E E 30.22 16.50 20.21 36.83 101.38 176.41 -96.29 -34.03 2.69 97.29 0.01 1.87 0.69 0.02 0.00 0.00 0.00 97.40 0.01 47 I E E 26.86 17.11 21.35 38.46 136.77 5.15 -148.20 142.45 0.51 99.48 0.00 0.42 0.04 0.00 0.00 0.00 0.00 99.52 0.01 48 Y E E 55.34 18.95 19.64 37.49 128.58 -172.06 -131.86 136.16 2.36 97.60 0.04 2.09 0.11 0.02 0.02 0.01 0.00 97.68 0.07 49 K E E 77.68 11.34 23.42 34.49 120.80 -170.73 -118.14 125.31 22.98 75.65 1.37 19.00 3.34 0.86 0.62 0.64 0.00 74.89 0.67 50 A C C 26.01 17.45 16.11 33.09 113.42 -168.14 -96.42 128.25 48.96 18.72 32.33 33.79 9.02 7.69 8.16 22.50 0.03 17.46 1.36 51 S C G 60.81 7.50 18.56 26.49 110.34 -146.82 -90.67 120.91 52.10 7.31 40.59 21.73 13.46 19.17 11.26 27.48 0.11 5.15 1.62 52 N C G 92.55 6.45 18.03 25.04 102.26 41.93 -95.10 16.67 51.91 6.95 41.14 23.18 12.20 18.76 12.26 27.11 0.12 4.32 2.06 53 L C C 51.88 16.58 11.17 26.76 108.08 114.86 -86.28 97.80 63.01 7.68 29.31 39.48 13.06 10.51 15.94 13.60 0.06 4.52 2.84 54 E C C 127.48 4.36 15.68 21.27 108.33 152.09 -85.88 90.19 69.52 8.01 22.47 37.72 14.25 18.21 12.45 9.48 0.07 4.77 3.05 55 S C T 73.98 5.29 14.85 21.33 107.82 48.44 -90.73 88.16 82.45 3.59 13.97 22.17 22.09 39.22 6.16 6.79 0.03 2.00 1.55 56 G C T 48.93 5.16 16.24 22.45 103.04 -58.44 85.01 2.76 94.17 2.88 2.95 29.05 31.77 33.68 0.58 2.32 0.00 1.69 0.92 57 V C C 42.97 15.39 12.03 27.64 117.89 116.32 -98.48 131.29 89.63 9.68 0.69 57.54 30.98 1.79 0.26 0.44 0.00 4.46 4.52 58 P C C 62.10 8.70 17.78 27.41 110.18 -109.80 -67.35 147.31 90.63 6.27 3.11 63.63 16.10 10.64 0.74 2.68 0.00 4.47 1.74 59 S C C 58.34 12.27 16.22 28.23 103.31 -123.44 -80.54 28.57 86.39 8.56 5.05 55.24 17.28 13.90 0.89 4.64 0.00 6.45 1.59 60 R C C 113.44 9.27 20.13 29.56 109.68 126.10 -103.94 60.59 75.14 20.75 4.11 41.78 26.33 7.62 0.84 3.22 0.01 18.37 1.83 61 F E E 32.47 22.08 13.37 34.55 122.91 124.71 -110.97 139.31 33.09 65.69 1.23 26.47 6.24 1.60 0.46 0.79 0.00 62.51 1.93 62 S E E 56.27 6.53 23.37 31.10 134.03 -176.32 -136.40 154.34 14.72 84.92 0.36 12.76 1.67 0.41 0.15 0.18 0.00 83.90 0.93 63 G E E 24.02 18.01 15.14 31.91 139.04 161.54 -156.89 167.43 11.40 88.40 0.19 9.41 1.72 0.39 0.06 0.11 0.00 87.77 0.56 64 S E E 65.91 5.04 21.17 27.72 133.91 -163.14 -143.25 155.65 14.96 84.86 0.18 12.52 2.15 0.46 0.05 0.12 0.00 83.89 0.80 65 G E E 31.78 11.09 14.96 26.69 138.58 136.51 111.29 167.03 34.98 64.77 0.25 23.02 11.41 2.12 0.04 0.26 0.00 62.34 0.81 66 S C E 79.79 2.87 20.00 23.33 114.68 -112.82 -118.07 113.82 60.18 39.12 0.70 34.44 20.52 6.89 0.10 0.77 0.00 35.09 2.19 67 G C S 36.30 8.35 18.67 27.46 111.06 -46.40 67.80 -131.42 97.94 1.37 0.68 3.16 54.67 40.25 0.02 0.70 0.00 1.02 0.16 68 T C S 54.80 14.38 16.22 30.56 97.72 -11.54 -98.85 0.10 97.66 1.83 0.51 3.01 56.10 38.70 0.01 0.50 0.00 1.52 0.15 69 E E E 77.30 8.96 22.14 32.19 121.79 85.39 -106.92 133.95 28.43 71.44 0.12 20.40 7.80 0.85 0.02 0.14 0.00 69.03 1.77 70 F E E 8.57 24.12 16.12 40.62 129.01 -173.99 -127.90 142.62 9.72 90.28 0.00 9.18 0.29 0.01 0.00 0.00 0.00 90.27 0.24 71 T E E 35.18 10.31 26.75 38.11 121.99 -157.89 -116.86 132.96 3.12 96.88 0.00 2.68 0.14 0.00 0.00 0.00 0.00 97.15 0.04 72 L E E 3.27 25.91 18.85 45.63 119.65 -163.91 -112.77 128.13 0.32 99.68 0.00 0.33 0.00 0.00 0.00 0.00 0.00 99.66 0.00 73 T E E 40.24 10.01 27.06 37.87 119.48 -163.20 -114.42 128.58 0.19 99.81 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.01 74 I E E 7.49 24.01 16.25 40.81 117.63 -166.93 -114.60 124.68 4.09 95.91 0.00 4.23 0.05 0.00 0.00 0.00 0.00 95.20 0.52 75 S C C 50.95 6.82 22.87 29.84 121.15 -162.61 -99.98 156.57 94.61 5.31 0.07 46.12 42.59 4.98 0.00 0.13 0.00 5.95 0.23 76 S C S 66.36 4.51 23.96 28.50 100.02 10.34 61.71 63.31 99.27 0.70 0.04 11.76 82.03 5.51 0.00 0.05 0.00 0.56 0.08 77 L C C 19.71 23.69 10.54 33.64 112.98 -142.95 -76.34 130.12 99.46 0.53 0.01 97.90 1.61 0.03 0.00 0.00 0.00 0.17 0.28 78 Q C C 80.69 4.57 23.65 28.11 130.17 -175.52 -125.34 157.10 99.89 0.10 0.01 99.31 0.59 0.00 0.00 0.00 0.00 0.02 0.07 79 P H G 73.46 11.85 15.10 27.37 91.03 -105.77 -58.62 -32.10 3.76 0.02 96.23 0.15 0.20 2.42 0.20 97.01 0.00 0.01 0.00 80 D H G 102.87 3.26 21.15 25.05 89.88 62.31 -72.40 -13.18 3.19 0.02 96.79 0.09 0.15 2.17 0.14 97.43 0.00 0.02 0.00 81 D H G 15.65 20.09 15.77 36.33 93.64 62.52 -88.77 -1.27 4.19 0.06 95.75 0.58 0.43 1.76 0.23 96.96 0.00 0.05 0.00 82 F C C 54.62 16.49 19.43 35.97 117.80 105.63 -76.86 138.32 88.70 11.14 0.16 85.86 2.99 0.09 0.02 0.14 0.00 10.53 0.37 83 A E E 14.80 15.70 22.53 38.38 144.42 150.92 -160.45 171.33 4.91 95.09 0.00 4.59 0.27 0.01 0.00 0.00 0.00 94.80 0.31 84 T E E 38.43 12.77 25.06 38.24 119.72 -87.63 -103.32 135.58 0.63 99.37 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.38 0.01 85 Y E E 8.25 24.80 19.23 44.18 125.49 -167.70 -118.42 140.66 0.51 99.49 0.00 0.44 0.02 0.00 0.00 0.00 0.00 99.52 0.01 86 Y E E 35.70 15.37 26.92 42.33 129.72 -169.52 -125.45 146.44 1.81 98.19 0.01 1.58 0.10 0.01 0.00 0.01 0.00 98.26 0.04 87 C E E 2.98 25.26 21.04 46.67 124.24 -157.15 -115.21 137.54 6.44 93.49 0.07 5.47 0.67 0.08 0.01 0.05 0.00 93.60 0.13 88 Q E E 30.08 14.97 25.77 40.73 126.83 -169.64 -123.46 141.77 3.66 96.25 0.08 3.22 0.26 0.05 0.02 0.04 0.00 96.24 0.16 89 Q E E 23.00 19.02 19.59 38.47 123.38 -157.75 -115.24 134.29 5.61 94.29 0.10 4.71 0.64 0.13 0.02 0.06 0.00 94.19 0.24 90 Y E E 72.04 11.57 18.98 31.41 121.24 -164.47 -114.86 132.62 19.95 79.90 0.15 15.68 3.61 0.67 0.03 0.13 0.00 79.24 0.65 91 N C C 56.56 9.92 13.43 24.60 127.21 170.85 -126.56 164.77 64.27 35.38 0.35 49.08 10.84 2.49 0.05 0.33 0.00 36.39 0.82 92 I C S 128.79 2.86 14.16 18.03 96.15 -84.75 -69.63 -22.43 96.06 3.21 0.72 26.98 46.59 22.52 0.09 0.68 0.00 2.77 0.37 93 Y C S 158.13 2.89 13.59 17.37 106.60 19.55 -106.30 -5.11 95.65 3.61 0.74 25.58 49.13 20.94 0.08 0.72 0.00 3.10 0.43 94 S C C 57.18 5.38 16.20 22.60 129.52 -5.82 -132.53 154.79 63.82 35.85 0.33 45.55 14.02 2.81 0.05 0.34 0.00 36.36 0.87 95 W E E 86.63 15.92 13.19 28.82 121.24 -133.45 -106.34 136.74 27.04 72.87 0.09 24.26 1.59 0.27 0.02 0.06 0.00 73.23 0.57 96 T E E 48.98 10.50 20.76 32.00 127.00 -170.18 -124.36 140.76 7.86 92.11 0.03 7.19 0.47 0.06 0.01 0.02 0.00 91.19 1.06 97 F E E 60.90 17.94 16.92 34.05 118.78 -139.68 -98.82 134.35 15.45 84.46 0.09 13.47 1.49 0.26 0.03 0.06 0.00 82.91 1.79 98 G C C 17.21 14.51 17.47 32.07 121.79 -142.28 -81.84 175.67 65.08 34.76 0.16 50.40 11.31 1.62 0.02 0.15 0.00 35.82 0.67 99 Q C C 117.84 5.03 22.30 27.68 104.59 -78.39 -77.98 63.51 76.24 23.62 0.14 62.60 10.67 1.21 0.02 0.14 0.00 24.81 0.54 100 G C C 17.26 17.95 16.12 32.89 128.82 -129.21 -82.99 173.29 66.98 32.94 0.08 59.53 4.69 0.41 0.01 0.07 0.00 34.84 0.45 101 T E E 33.82 15.07 19.20 34.56 127.31 -109.71 -120.91 144.37 10.13 89.86 0.01 9.30 0.45 0.02 0.00 0.00 0.00 89.97 0.25 102 K E E 103.80 9.31 22.23 32.02 119.67 -139.83 -103.63 133.51 1.08 98.91 0.00 0.95 0.06 0.00 0.00 0.00 0.00 98.96 0.03 103 V E E 14.33 21.69 14.47 36.16 120.33 -163.27 -114.58 129.78 1.08 98.92 0.00 1.03 0.03 0.00 0.00 0.00 0.00 98.91 0.02 104 E E E 97.53 5.54 22.56 28.65 117.27 -155.15 -104.04 127.86 2.97 97.01 0.01 2.93 0.09 0.01 0.00 0.00 0.00 96.83 0.14 105 I E E 31.18 19.77 10.63 29.64 115.63 -157.19 -99.72 126.80 26.85 73.10 0.05 27.14 0.23 0.04 0.02 0.02 0.00 71.71 0.83 106 K C C 133.82 3.60 19.00 23.39 113.60 -148.73 -90.35 128.52 99.61 0.39 0.00 99.65 0.05 0.01 0.00 0.00 0.00 0.28 0.01