# 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 101.17 3.92 21.11 25.15 103.42 -128.31 -76.05 60.22 99.86 0.14 0.00 99.78 0.10 0.02 0.00 0.00 0.00 0.09 0.00 1 I C C 32.13 21.37 10.49 30.57 117.54 -153.95 -98.53 130.86 64.80 35.10 0.10 63.79 0.52 0.17 0.02 0.05 0.00 34.71 0.74 2 Q E E 99.52 4.82 22.15 27.78 123.54 -168.37 -119.49 137.46 20.77 79.05 0.18 18.87 1.49 0.27 0.07 0.10 0.00 78.00 1.19 3 M E E 48.56 20.32 12.91 32.16 121.56 -157.85 -110.22 132.89 14.81 85.04 0.15 13.77 0.85 0.17 0.06 0.08 0.00 83.68 1.39 4 T E E 66.70 7.16 20.63 28.48 123.62 -170.92 -120.29 142.79 25.15 74.64 0.21 21.94 2.53 0.41 0.07 0.15 0.00 73.22 1.68 5 Q C E 78.43 12.93 16.07 29.06 126.30 -156.73 -120.93 138.83 56.29 43.49 0.22 40.56 15.05 1.10 0.04 0.21 0.00 41.74 1.29 6 S C C 55.72 10.13 17.08 27.84 121.38 -143.71 -104.60 144.20 85.29 14.60 0.11 54.11 29.86 1.12 0.01 0.12 0.00 14.09 0.69 7 P C C 53.53 10.69 16.27 27.55 115.96 15.66 -72.91 150.78 91.17 8.36 0.47 65.29 20.86 4.21 0.05 0.57 0.00 8.48 0.53 8 S C S 68.21 8.21 16.91 26.07 97.62 -151.82 -86.14 -20.26 80.52 19.20 0.28 27.47 48.49 3.34 0.02 0.31 0.00 19.78 0.58 9 S E E 56.86 6.63 20.34 28.16 135.91 14.68 -147.58 150.30 19.06 80.72 0.22 14.60 4.13 0.64 0.03 0.20 0.00 79.97 0.44 10 V E E 30.86 19.58 14.62 33.63 130.24 -173.26 -138.16 142.62 3.66 96.33 0.01 3.29 0.24 0.02 0.00 0.01 0.00 96.28 0.16 11 S E E 64.76 6.47 23.28 30.88 123.94 -157.70 -116.75 139.85 2.81 97.18 0.01 2.56 0.18 0.02 0.00 0.01 0.00 97.09 0.15 12 A E E 12.87 19.48 14.60 34.12 138.27 168.62 -147.24 159.76 14.35 85.62 0.03 12.97 0.80 0.06 0.01 0.02 0.00 85.75 0.39 13 S E E 54.10 5.07 23.75 28.66 124.67 -117.83 -92.18 158.95 38.05 61.75 0.20 33.51 3.48 0.51 0.08 0.16 0.00 57.09 5.17 14 V C T 61.40 14.87 14.41 29.28 109.04 -81.52 -59.78 134.77 98.46 1.04 0.50 0.48 3.79 94.60 0.02 0.35 0.00 0.62 0.13 15 G C T 44.70 4.60 20.06 25.39 95.81 23.05 88.68 -6.22 99.33 0.32 0.36 0.78 4.84 93.82 0.02 0.29 0.00 0.21 0.04 16 D C C 57.11 9.86 17.03 27.97 120.87 122.55 -78.50 152.87 96.30 3.48 0.22 63.24 32.64 0.76 0.04 0.19 0.00 2.61 0.52 17 R C C 128.27 8.02 19.99 29.12 120.51 -125.15 -99.49 136.46 74.39 25.60 0.01 74.86 0.51 0.03 0.00 0.01 0.00 24.04 0.55 18 V E E 10.98 22.67 14.86 37.54 128.39 -171.51 -127.05 144.15 1.30 98.70 0.00 1.32 0.02 0.00 0.00 0.00 0.00 98.56 0.11 19 T E E 60.76 8.30 25.34 34.13 118.71 -148.03 -109.35 129.38 0.40 99.60 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.59 0.00 20 I E E 4.52 25.76 16.84 43.41 120.58 -166.24 -114.99 129.47 1.38 98.62 0.00 1.29 0.03 0.00 0.00 0.00 0.00 98.67 0.01 21 T E E 41.62 9.72 27.20 37.67 121.49 -165.55 -114.64 134.10 5.60 94.40 0.00 5.09 0.13 0.00 0.00 0.00 0.00 94.74 0.03 22 C E E 3.62 25.94 17.18 43.67 126.49 -171.20 -125.44 138.75 5.47 94.52 0.00 4.97 0.19 0.01 0.00 0.00 0.00 94.76 0.07 23 R E E 100.46 7.72 27.57 36.13 121.75 -161.88 -119.76 133.56 3.77 96.20 0.03 3.50 0.21 0.02 0.01 0.01 0.00 95.71 0.53 24 A E E 9.47 23.83 13.73 37.18 121.21 -158.63 -106.64 140.06 37.40 62.26 0.34 35.83 1.35 0.28 0.10 0.21 0.00 60.56 1.67 25 S C C 56.97 7.04 20.65 28.12 102.23 -152.28 -83.11 -26.49 81.09 17.87 1.04 42.78 31.65 6.89 0.12 1.09 0.00 16.38 1.10 26 Q C S 113.01 4.59 19.53 24.60 113.64 11.46 -107.67 112.57 90.34 6.79 2.87 13.07 53.58 24.28 0.32 2.43 0.00 5.14 1.17 27 G C S 39.88 6.52 20.40 27.32 113.89 4.23 85.73 -153.98 92.62 3.64 3.73 28.55 40.56 23.47 0.36 3.74 0.00 2.50 0.82 28 I C C 44.49 18.58 17.16 34.56 110.61 -44.82 -91.61 116.90 82.61 8.16 9.23 50.49 19.59 12.40 1.41 8.32 0.00 5.13 2.67 29 S C C 28.17 17.47 19.89 36.34 111.47 102.12 -91.62 132.85 75.35 9.19 15.46 51.53 12.07 10.75 1.20 15.67 0.00 7.27 1.50 30 S C S 48.15 11.87 23.92 35.51 98.40 -139.15 -89.64 -13.00 73.03 12.74 14.23 19.08 37.48 17.25 0.74 12.99 0.01 11.31 1.16 31 W E E 62.87 16.05 24.20 39.57 111.03 51.18 -110.70 42.94 35.83 51.70 12.47 19.89 9.07 8.66 0.87 10.94 0.01 49.76 0.79 32 L E E 3.20 26.36 20.41 47.07 126.25 122.15 -114.30 141.54 9.91 90.02 0.06 8.85 0.89 0.07 0.01 0.03 0.00 89.92 0.22 33 A E E 9.87 18.44 27.95 46.08 132.98 -173.56 -133.09 150.01 0.66 99.34 0.00 0.62 0.02 0.00 0.00 0.00 0.00 99.34 0.01 34 W E E 9.38 24.31 23.39 47.48 124.54 -148.74 -113.51 138.16 0.38 99.62 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.63 0.00 35 Y E E 23.34 17.63 23.30 40.85 131.40 -172.85 -129.73 147.92 1.11 98.89 0.00 0.96 0.04 0.00 0.00 0.00 0.00 98.96 0.03 36 Q E E 44.25 13.85 21.46 35.69 120.73 -145.72 -108.48 135.01 4.41 95.58 0.01 3.71 0.36 0.02 0.00 0.00 0.00 95.79 0.12 37 Q E E 54.13 14.20 15.12 29.79 119.26 -149.79 -102.20 134.51 33.15 66.82 0.03 30.05 2.10 0.10 0.00 0.03 0.00 66.30 1.42 38 K C C 101.09 5.90 15.19 22.49 120.17 -143.40 -96.67 144.24 97.86 2.11 0.03 95.83 2.16 0.17 0.01 0.02 0.00 1.43 0.38 39 P C T 106.06 3.45 11.14 16.57 109.53 -85.24 -58.77 134.19 99.59 0.12 0.29 0.47 3.74 95.40 0.01 0.27 0.00 0.08 0.02 40 G C T 69.21 0.28 12.74 10.44 96.03 17.48 83.20 -2.88 99.61 0.09 0.30 0.55 3.65 95.41 0.01 0.31 0.00 0.06 0.01 41 K C S 111.83 4.03 10.75 16.94 129.18 91.05 -116.24 157.92 93.63 5.99 0.38 31.23 61.24 1.23 0.08 0.30 0.00 2.13 3.80 42 A C C 74.14 2.72 16.31 19.53 116.09 -96.20 -69.11 149.18 97.27 2.70 0.03 86.36 10.93 0.20 0.01 0.03 0.00 2.09 0.39 43 P C C 44.67 17.67 10.97 27.96 114.95 -101.61 -65.28 144.76 91.37 8.58 0.04 89.48 1.93 0.16 0.01 0.03 0.00 8.10 0.30 44 K E E 101.46 6.83 21.15 28.89 123.95 -158.95 -119.79 139.07 11.77 88.13 0.10 10.25 1.41 0.14 0.03 0.06 0.00 87.26 0.85 45 L E E 64.51 15.75 17.55 32.84 110.82 -115.30 -75.59 127.32 1.39 98.59 0.01 1.25 0.07 0.00 0.00 0.01 0.00 98.62 0.05 46 L E E 26.73 17.42 20.88 38.25 101.25 175.83 -95.38 -34.56 2.57 97.40 0.02 1.67 0.73 0.03 0.00 0.01 0.00 97.54 0.02 47 I E E 14.02 20.90 21.18 41.84 136.09 4.69 -149.17 143.32 0.52 99.47 0.01 0.42 0.04 0.00 0.00 0.00 0.00 99.52 0.01 48 Y E E 61.81 17.14 23.03 39.03 128.09 -170.81 -130.11 136.83 2.69 97.24 0.07 2.36 0.16 0.03 0.04 0.02 0.00 97.30 0.10 49 A E E 17.15 18.00 20.93 38.53 118.50 -164.59 -111.91 130.88 28.56 66.65 4.78 22.43 5.13 1.83 2.24 2.13 0.00 65.37 0.86 50 A C C 31.42 15.49 18.74 33.85 111.33 -162.94 -86.14 132.76 45.49 19.05 35.45 27.04 10.71 9.60 11.59 22.34 0.08 16.96 1.66 51 S C G 64.65 7.74 19.56 27.47 102.29 -143.73 -86.03 -14.06 51.03 7.34 41.63 21.20 13.61 18.14 13.62 26.48 0.14 5.05 1.75 52 S C G 58.89 8.13 18.38 26.95 106.81 52.04 -96.28 30.92 51.54 6.90 41.57 24.65 12.20 16.41 14.32 25.98 0.12 4.29 2.03 53 L C C 52.56 16.88 11.99 27.87 109.44 98.06 -88.77 108.48 62.62 8.85 28.53 39.26 12.96 10.37 16.20 12.57 0.06 5.37 3.20 54 Q C C 112.93 5.55 15.78 22.63 112.39 121.38 -95.87 121.54 68.42 10.78 20.80 40.07 13.27 15.40 12.17 8.32 0.08 6.38 4.32 55 S C T 76.35 5.22 14.64 21.18 108.73 -91.81 -86.10 120.26 83.98 4.04 11.97 19.01 18.59 46.87 5.86 5.56 0.03 2.43 1.66 56 G C T 53.01 3.90 16.29 21.26 100.84 -8.77 84.63 0.92 94.56 2.11 3.33 20.90 27.81 46.16 0.75 2.40 0.00 1.30 0.68 57 V C C 45.61 14.42 11.83 26.70 117.92 108.40 -100.75 133.35 87.04 11.98 0.98 51.33 34.38 2.12 0.40 0.59 0.00 5.10 6.07 58 P C C 65.88 7.94 17.94 26.82 109.23 -108.79 -66.96 146.61 88.20 7.32 4.47 60.31 15.56 12.06 1.06 3.77 0.00 5.39 1.83 59 S C C 53.67 13.70 15.94 29.02 101.50 -128.16 -83.10 12.85 83.66 9.80 6.54 49.96 19.02 14.94 1.07 5.86 0.00 7.71 1.44 60 R C C 110.30 9.35 21.02 30.50 111.40 95.80 -105.28 83.51 65.21 28.96 5.83 39.35 19.41 7.35 1.21 4.30 0.01 26.65 1.71 61 F E E 29.63 22.51 13.64 35.33 121.46 125.31 -107.34 137.66 24.80 74.30 0.90 21.07 3.53 0.91 0.41 0.52 0.00 71.70 1.87 62 S E E 55.69 6.89 23.41 31.43 133.96 -175.71 -136.81 156.36 11.30 88.43 0.27 9.85 1.26 0.29 0.12 0.13 0.00 87.47 0.89 63 G E E 25.25 15.79 16.60 31.71 140.72 162.74 -159.13 171.43 13.22 86.60 0.18 10.92 2.06 0.42 0.05 0.11 0.00 85.74 0.71 64 S E E 67.62 5.25 20.85 27.72 132.91 -148.10 -141.22 155.43 23.87 75.92 0.21 20.29 2.90 0.60 0.05 0.15 0.00 75.23 0.77 65 G E E 30.27 11.94 15.14 27.46 138.25 141.45 -149.36 175.65 45.09 54.61 0.31 29.00 14.52 2.73 0.04 0.33 0.00 52.27 1.12 66 S C E 77.07 3.46 20.72 24.72 114.94 -117.89 -118.25 82.51 62.08 36.81 1.10 26.72 26.32 10.92 0.14 1.17 0.01 31.40 3.34 67 G C S 32.42 10.66 18.75 29.24 109.04 -48.50 68.69 -124.93 97.38 1.59 1.03 3.60 51.78 42.13 0.04 1.07 0.00 1.16 0.22 68 T C S 55.42 14.29 17.03 31.15 97.89 -9.52 -99.18 -0.97 97.00 2.19 0.80 3.80 52.50 40.87 0.03 0.82 0.00 1.77 0.22 69 D E E 59.86 8.95 22.45 32.55 119.43 87.68 -105.38 130.60 35.71 63.99 0.30 24.13 10.99 1.68 0.05 0.33 0.00 59.59 3.23 70 F E E 7.87 24.56 16.12 41.10 129.02 -175.40 -127.23 142.95 16.11 83.88 0.01 15.13 0.57 0.03 0.00 0.01 0.00 83.77 0.48 71 T E E 35.33 10.52 27.18 38.77 124.36 -159.92 -119.14 135.50 5.55 94.45 0.00 4.89 0.29 0.00 0.00 0.00 0.00 94.70 0.11 72 L E E 2.91 26.22 19.04 46.19 119.91 -161.65 -113.19 128.59 0.61 99.39 0.00 0.64 0.01 0.00 0.00 0.00 0.00 99.34 0.01 73 T E E 39.13 10.35 27.25 38.43 120.08 -165.18 -115.31 129.13 0.20 99.80 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.01 74 I E E 7.61 24.07 16.49 41.10 117.79 -166.10 -113.82 125.82 2.55 97.45 0.00 2.65 0.03 0.00 0.00 0.00 0.00 96.86 0.46 75 S C C 48.36 7.31 22.98 30.47 119.05 -163.06 -107.39 159.12 92.67 7.27 0.06 49.51 38.49 3.48 0.00 0.11 0.00 8.16 0.25 76 S C S 66.29 4.63 24.15 28.79 100.14 9.62 61.44 64.37 99.07 0.90 0.02 10.68 84.67 3.76 0.00 0.03 0.00 0.77 0.08 77 L C C 19.39 23.69 10.67 33.84 113.09 -141.24 -75.56 130.82 99.30 0.69 0.01 97.62 1.76 0.03 0.00 0.00 0.00 0.23 0.35 78 Q C C 80.33 4.63 23.79 28.29 130.76 -176.14 -125.43 156.14 99.89 0.10 0.01 99.37 0.53 0.00 0.00 0.00 0.00 0.02 0.07 79 P H G 72.56 12.20 15.02 27.55 90.96 -107.20 -58.23 -32.21 3.61 0.02 96.37 0.18 0.21 2.38 0.32 96.90 0.00 0.01 0.00 80 E H G 128.26 3.41 21.02 25.06 90.04 62.73 -70.25 -17.12 2.87 0.02 97.11 0.09 0.15 2.02 0.22 97.51 0.00 0.02 0.00 81 D H G 16.10 20.22 15.90 36.46 94.08 60.05 -87.75 -3.85 3.52 0.04 96.44 0.38 0.33 1.72 0.30 97.23 0.00 0.03 0.00 82 F C C 50.65 17.53 19.39 36.70 116.96 102.68 -79.54 135.52 88.76 10.43 0.81 83.42 5.40 0.24 0.09 0.74 0.00 9.63 0.47 83 A E E 16.79 15.68 22.88 38.37 142.90 149.85 -154.82 174.25 10.90 89.08 0.03 9.99 0.82 0.06 0.01 0.02 0.00 88.47 0.64 84 T E E 39.03 13.13 25.17 38.52 119.96 -86.15 -104.32 136.97 1.67 98.33 0.00 1.45 0.12 0.01 0.00 0.00 0.00 98.36 0.07 85 Y E E 8.62 24.81 19.63 44.46 126.58 -167.30 -119.06 141.55 0.76 99.24 0.00 0.64 0.05 0.00 0.00 0.00 0.00 99.27 0.04 86 Y E E 35.09 15.69 27.14 42.81 129.43 -167.39 -125.22 145.40 2.20 97.76 0.04 1.84 0.16 0.02 0.02 0.02 0.00 97.85 0.08 87 C E E 3.56 25.09 21.09 46.43 122.54 -154.72 -114.43 135.68 9.03 90.43 0.53 7.55 0.92 0.29 0.24 0.21 0.00 90.50 0.30 88 Q E E 39.86 14.07 25.21 39.19 125.77 -170.74 -122.36 141.57 11.91 87.29 0.80 10.31 1.17 0.37 0.36 0.34 0.00 86.63 0.82 89 Q E E 46.41 16.41 18.44 34.52 116.74 -136.41 -94.65 133.95 30.87 67.79 1.33 26.01 4.02 1.24 0.51 0.75 0.00 66.15 1.32 90 A C C 45.09 10.91 16.15 27.80 110.58 -144.44 -92.23 128.28 65.08 32.87 2.05 39.42 17.97 8.73 0.37 1.64 0.00 30.28 1.59 91 N C S 100.06 5.39 14.68 21.38 107.20 97.05 -97.83 52.56 85.88 12.24 1.88 30.42 35.43 20.59 0.20 1.83 0.00 10.10 1.44 92 S C S 75.29 4.47 13.91 19.55 107.12 41.16 -96.66 23.04 94.95 3.58 1.46 21.42 52.77 20.90 0.14 1.47 0.00 2.55 0.75 93 F C S 117.47 5.92 12.61 20.19 120.84 22.01 -107.36 136.58 93.10 6.14 0.77 19.65 65.75 7.91 0.11 0.68 0.00 4.58 1.32 94 P C C 82.49 5.37 16.10 22.50 113.10 -67.35 -70.27 146.83 89.09 10.12 0.79 54.02 27.93 6.99 0.11 0.83 0.00 9.20 0.91 95 L C C 57.47 15.67 13.10 28.55 116.85 -128.87 -88.08 134.34 63.31 36.01 0.68 54.08 6.04 1.78 0.14 0.56 0.00 35.90 1.50 96 T E E 62.87 9.16 19.95 29.77 123.65 -161.79 -116.68 136.80 24.99 74.53 0.47 21.53 2.43 0.66 0.22 0.29 0.00 69.68 5.19 97 F E E 61.20 18.19 15.04 32.28 115.38 -157.99 -103.96 122.39 28.73 70.52 0.76 21.36 6.71 2.39 0.28 0.59 0.00 64.66 4.01 98 G C E 33.35 9.90 19.02 28.97 115.57 -70.37 66.79 -159.29 60.04 38.97 0.99 24.59 22.91 14.17 0.10 0.96 0.00 36.02 1.24 99 G C S 45.92 6.47 20.57 27.19 101.85 -35.85 76.25 2.32 71.46 27.42 1.11 25.10 29.63 16.89 0.09 1.13 0.00 26.23 0.91 100 G C C 19.63 15.56 16.29 31.23 123.67 -128.56 93.77 176.54 63.73 35.77 0.49 40.66 17.73 4.45 0.04 0.56 0.00 35.87 0.69 101 T E E 35.33 15.97 18.66 34.42 125.35 -99.53 -117.89 141.11 22.81 77.14 0.05 20.52 1.26 0.10 0.01 0.03 0.00 77.81 0.28 102 K E E 102.22 9.32 22.69 32.46 120.02 -142.75 -102.41 133.71 2.16 97.83 0.01 1.86 0.16 0.01 0.00 0.00 0.00 97.89 0.08 103 V E E 13.56 22.53 14.74 37.14 121.09 -165.49 -117.02 131.56 0.95 99.05 0.00 0.88 0.03 0.00 0.00 0.00 0.00 99.06 0.02 104 E E E 96.40 5.51 23.52 29.45 117.05 -155.22 -105.61 128.27 1.86 98.14 0.01 1.80 0.05 0.01 0.00 0.00 0.00 98.06 0.08 105 I E E 29.89 20.42 11.10 30.78 116.05 -155.16 -99.68 126.66 16.31 83.65 0.04 16.52 0.22 0.04 0.02 0.02 0.00 82.54 0.65 106 K C C 127.39 4.15 19.84 24.79 116.56 -160.57 -102.53 131.23 99.28 0.72 0.00 99.33 0.05 0.01 0.00 0.00 0.00 0.59 0.01