# 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 M C C 122.24 3.90 11.98 17.74 118.32 -159.66 -104.37 136.85 99.68 0.32 0.00 99.73 0.05 0.01 0.00 0.00 0.00 0.20 0.01 1 T C C 93.56 4.56 9.38 15.97 117.53 -153.86 -104.96 135.56 81.95 15.37 2.68 78.59 1.04 2.58 0.78 1.29 0.00 13.95 1.77 2 S C C 71.02 4.42 10.07 16.37 119.60 -158.58 -103.29 144.59 69.92 25.60 4.48 51.96 11.16 6.67 1.05 3.37 0.00 23.94 1.85 3 K C C 145.64 3.64 10.40 16.07 115.13 -152.38 -104.85 129.36 63.47 31.69 4.83 42.82 14.71 6.54 1.03 3.57 0.01 29.88 1.43 4 E C E 110.69 5.35 11.64 18.84 122.64 -165.59 -111.62 140.89 54.21 41.61 4.17 40.00 10.01 4.36 0.91 2.91 0.00 40.67 1.14 5 T E E 90.48 5.27 12.75 19.87 121.02 -146.48 -110.67 138.78 48.39 49.62 1.99 40.80 5.21 1.84 0.56 1.29 0.00 48.89 1.40 6 F E E 81.91 11.79 11.04 23.62 124.29 -167.57 -117.48 142.85 38.88 60.34 0.78 34.61 3.11 0.75 0.34 0.47 0.00 57.04 3.67 7 T E E 87.59 5.04 16.60 22.70 117.00 -149.49 -105.44 129.29 47.94 51.58 0.49 40.93 5.10 0.92 0.15 0.35 0.00 50.94 1.61 8 H C C 84.20 11.90 13.71 26.03 118.02 -153.97 -103.20 131.06 61.74 37.58 0.69 44.49 14.80 2.66 0.16 0.60 0.00 35.68 1.61 9 Y C C 99.20 11.35 15.76 27.60 118.50 -163.74 -107.28 131.84 75.16 24.42 0.42 54.68 18.51 1.87 0.10 0.40 0.00 22.07 2.37 10 Q C C 93.85 8.42 19.75 28.77 117.94 -145.27 -111.07 128.21 83.89 15.99 0.12 67.89 14.80 0.62 0.03 0.12 0.00 15.56 0.99 11 P C C 43.26 17.79 15.74 32.90 113.69 -118.12 -69.92 144.70 78.93 20.00 1.07 69.14 5.95 2.82 0.24 0.92 0.00 17.90 3.03 12 Q C C 68.27 13.51 18.48 31.86 117.44 -158.68 -109.68 136.65 57.83 40.37 1.80 41.52 9.83 5.06 0.71 1.43 0.02 26.68 14.75 13 G C C 38.07 10.10 16.57 27.09 118.84 46.15 -121.34 170.00 77.30 21.42 1.29 41.64 25.67 11.24 0.22 1.35 0.00 16.22 3.64 14 N C C 77.71 9.02 14.70 24.57 125.30 132.27 -115.83 147.28 89.69 9.51 0.80 43.30 37.25 9.66 0.11 0.89 0.00 6.82 1.97 15 S C S 80.45 4.53 14.96 20.89 98.55 -142.08 -88.82 -4.71 96.16 3.52 0.32 27.74 64.27 4.37 0.04 0.30 0.00 2.44 0.84 16 D C S 88.16 4.54 15.92 21.88 118.94 91.41 -94.83 139.91 96.32 3.60 0.08 28.50 67.12 1.09 0.01 0.08 0.00 2.69 0.52 17 P C C 78.79 7.61 16.67 25.30 114.13 -101.48 -66.43 147.31 92.94 6.84 0.22 81.15 9.78 1.54 0.03 0.24 0.00 6.65 0.61 18 A E E 34.55 18.77 12.27 30.00 116.46 -117.48 -82.27 142.94 40.57 59.12 0.31 34.94 4.51 0.79 0.07 0.27 0.00 57.15 2.26 19 H E E 89.40 8.85 20.77 30.12 120.45 -137.60 -106.77 135.83 13.06 86.85 0.10 11.58 1.30 0.18 0.03 0.06 0.00 86.10 0.76 20 T E E 68.54 14.25 15.47 29.74 127.80 -165.85 -124.19 143.13 8.52 91.43 0.05 7.45 0.81 0.09 0.01 0.03 0.00 91.34 0.27 21 A E E 37.40 10.04 19.29 30.36 136.24 177.27 -141.24 156.89 6.79 93.18 0.03 5.61 0.86 0.08 0.01 0.02 0.00 93.29 0.13 22 T E E 80.24 8.51 19.79 29.37 121.12 -127.67 -105.63 135.53 8.65 91.32 0.04 7.56 0.71 0.08 0.01 0.02 0.00 91.14 0.48 23 A E E 16.24 19.36 15.43 34.41 129.94 -175.36 -129.69 146.43 20.70 79.23 0.07 18.76 1.28 0.12 0.01 0.05 0.00 79.15 0.63 24 P E E 71.99 7.11 22.51 29.85 113.93 -106.19 -69.50 146.01 30.50 68.05 1.45 24.03 4.85 2.14 0.31 1.24 0.00 65.84 1.57 25 G C C 23.09 16.51 17.51 32.90 114.40 -119.14 -84.12 148.70 61.58 29.33 9.10 30.16 17.84 16.10 1.60 7.30 0.03 24.67 2.30 26 G C C 30.66 10.50 20.90 31.41 101.69 28.97 86.70 -2.20 67.36 21.19 11.45 35.17 16.59 17.50 2.05 9.42 0.03 16.15 3.10 27 L C C 43.24 19.05 14.76 32.51 98.46 114.49 -75.53 -13.78 66.11 16.73 17.17 30.93 16.32 21.41 3.07 13.36 0.06 11.44 3.40 28 S C C 73.93 5.52 19.34 25.67 99.76 65.63 -89.77 0.34 75.45 10.66 13.89 32.06 20.07 24.74 2.49 11.00 0.02 7.23 2.40 29 A C S 51.31 9.81 15.69 26.30 118.96 99.75 -89.32 150.05 84.48 8.11 7.41 35.49 35.51 14.14 1.41 5.83 0.01 5.68 1.93 30 K C C 147.88 3.37 19.91 24.30 112.26 -107.75 -85.90 125.75 86.59 10.79 2.62 58.54 19.83 8.11 0.66 2.24 0.00 7.20 3.42 31 A C C 21.55 21.14 11.75 31.70 121.74 -158.46 -102.91 142.00 91.22 8.45 0.33 75.84 14.87 0.67 0.13 0.22 0.00 5.46 2.82 32 P C C 63.45 6.93 22.21 29.51 114.56 -105.15 -67.50 151.91 91.51 7.02 1.46 83.38 4.75 3.24 0.26 1.36 0.00 4.78 2.23 33 A C S 50.36 12.42 18.95 31.19 113.09 -95.77 -66.41 143.28 89.90 8.41 1.70 12.74 41.63 35.75 0.16 1.72 0.00 6.62 1.38 34 M C T 57.85 15.55 22.55 37.14 94.98 16.74 69.28 24.54 77.07 21.26 1.68 22.90 24.93 30.63 0.19 1.72 0.01 17.16 2.44 35 T C C 18.52 18.18 23.54 41.56 117.59 142.73 -100.56 132.45 70.91 29.04 0.05 55.84 14.44 0.23 0.01 0.05 0.00 28.52 0.91 36 P E E 10.47 21.19 25.62 46.60 115.47 -117.26 -71.60 142.73 30.73 69.26 0.01 29.32 0.73 0.03 0.00 0.01 0.00 69.36 0.54 37 L E E 2.08 26.60 23.49 50.23 123.00 -150.80 -109.08 139.51 2.17 97.83 0.00 1.94 0.10 0.00 0.00 0.00 0.00 97.88 0.08 38 M E E 19.51 18.17 26.79 44.35 132.48 -172.27 -131.70 151.15 0.20 99.80 0.00 0.17 0.01 0.00 0.00 0.00 0.00 99.81 0.00 39 L E E 29.15 18.27 19.31 37.51 116.65 -129.68 -99.71 128.63 0.40 99.59 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.57 0.04 40 D E E 34.87 10.18 16.50 28.94 108.05 -137.73 -90.76 113.40 25.91 74.06 0.02 24.69 0.64 0.05 0.00 0.01 0.00 74.23 0.36 41 T C T 81.54 7.82 13.75 23.30 93.75 -162.42 -68.80 -26.78 97.92 0.40 1.68 0.80 7.04 89.98 0.03 1.80 0.00 0.28 0.06 42 S C T 96.44 0.62 14.83 13.75 95.17 50.31 -71.88 -38.28 97.83 0.15 2.02 0.47 5.61 91.62 0.03 2.15 0.00 0.08 0.04 43 S C T 64.91 3.14 13.93 17.93 98.78 26.04 -99.09 -12.24 98.09 0.34 1.58 3.18 8.83 85.68 0.04 1.98 0.00 0.23 0.06 44 R C T 126.05 9.60 13.32 24.25 93.97 -128.87 60.40 33.26 98.82 0.78 0.40 31.69 10.52 56.66 0.06 0.33 0.00 0.63 0.11 45 K E E 92.58 6.11 21.88 28.81 128.01 132.19 -110.22 149.61 41.12 58.85 0.03 36.03 3.42 0.24 0.00 0.03 0.00 59.56 0.72 46 L E E 16.80 23.15 15.58 38.86 116.26 -122.75 -92.49 132.57 1.03 98.97 0.00 1.01 0.03 0.00 0.00 0.00 0.00 98.89 0.06 47 V E E 36.27 12.05 24.83 37.31 130.76 -176.04 -130.64 145.96 0.13 99.87 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.86 0.01 48 A E E 31.85 16.71 20.40 36.61 113.90 -109.86 -73.63 138.11 1.81 98.18 0.00 1.58 0.10 0.01 0.00 0.00 0.00 98.25 0.06 49 W C C 32.89 21.01 15.00 35.53 116.49 -143.49 -96.14 136.94 64.18 35.38 0.44 51.40 9.11 1.86 0.05 0.45 0.00 36.36 0.77 50 D C C 98.56 4.35 22.01 26.63 101.12 -146.22 -93.92 12.95 85.45 13.27 1.28 52.45 23.45 9.51 0.16 1.36 0.00 11.61 1.45 51 G C S 30.90 13.62 15.12 27.97 105.77 -108.17 80.82 6.97 92.30 5.24 2.47 26.17 38.48 27.87 0.23 2.52 0.00 3.58 1.14 52 T C C 86.09 5.29 18.90 25.01 111.92 99.26 -99.58 108.89 89.05 8.04 2.91 40.59 27.08 21.72 0.41 2.88 0.00 4.77 2.54 53 T C C 55.15 14.20 13.07 26.98 117.79 92.56 -104.97 134.57 87.54 8.34 4.13 51.76 24.02 11.64 0.71 3.86 0.00 4.85 3.15 54 D C T 110.17 3.25 20.03 23.72 109.33 -131.14 -87.87 112.14 87.32 7.50 5.18 28.47 29.26 30.44 0.72 4.40 0.00 4.95 1.75 55 G C C 28.49 10.71 19.14 30.11 117.97 12.83 111.50 -5.14 83.09 12.62 4.28 29.74 27.33 27.06 0.54 3.74 0.01 9.95 1.62 56 A C C 25.46 16.20 21.68 37.53 121.30 -78.62 -99.13 143.80 67.35 30.02 2.63 50.94 11.49 4.24 0.49 2.30 0.00 28.35 2.19 57 A E E 9.39 22.35 23.32 44.91 114.29 -122.64 -82.31 138.45 29.36 70.12 0.51 26.14 2.61 0.63 0.19 0.34 0.00 67.78 2.31 58 V E E 14.08 21.86 27.01 47.79 117.98 -165.61 -111.16 129.85 16.29 83.14 0.57 11.99 4.00 1.02 0.21 0.33 0.00 81.66 0.80 59 G E E 1.91 23.64 28.19 50.79 143.92 -35.95 -136.64 167.35 8.21 91.25 0.53 5.11 2.39 0.82 0.14 0.27 0.00 91.09 0.17 60 I E E 1.16 27.58 26.80 54.56 125.53 -120.31 -122.88 137.46 3.76 95.85 0.39 3.17 0.46 0.18 0.17 0.14 0.00 95.71 0.17 61 L E E 10.32 22.33 28.50 49.85 121.92 -160.99 -114.83 134.72 3.34 96.32 0.34 2.75 0.40 0.13 0.16 0.10 0.00 96.33 0.15 62 A E E 8.08 23.55 23.97 46.57 121.70 -163.97 -112.66 133.51 5.99 93.51 0.50 4.54 1.12 0.26 0.21 0.16 0.00 93.55 0.16 63 V E E 29.34 16.00 24.40 40.11 127.83 -173.95 -126.60 141.12 9.69 89.47 0.84 7.78 1.50 0.55 0.37 0.36 0.00 89.05 0.39 64 A E E 51.26 10.63 22.30 32.99 112.91 -116.07 -75.76 133.62 25.83 73.29 0.88 20.64 4.43 1.46 0.28 0.58 0.00 71.70 0.90 65 A C C 21.07 18.65 12.39 30.42 128.52 -176.06 -125.31 149.22 66.45 32.64 0.91 53.05 8.91 3.10 0.19 0.77 0.00 32.36 1.61 66 D C C 118.89 1.91 19.15 20.64 99.41 -153.17 -92.64 7.91 87.69 11.57 0.74 47.62 31.55 8.40 0.10 0.77 0.00 10.56 1.00 67 Q C S 85.75 7.55 13.74 22.67 126.11 88.92 -108.44 151.55 91.95 6.79 1.26 36.01 44.48 11.75 0.17 1.23 0.00 5.19 1.16 68 T C S 103.47 3.59 15.39 20.29 98.45 -129.08 -79.32 -15.52 91.89 6.83 1.27 24.84 41.16 26.07 0.13 1.28 0.00 5.65 0.86 69 S C C 65.05 5.24 17.08 23.45 113.49 40.73 -118.83 109.69 80.09 19.08 0.84 35.21 23.93 21.05 0.07 0.94 0.00 17.96 0.83 70 T C C 37.58 16.13 14.36 30.31 123.36 146.79 -116.68 138.97 56.72 43.04 0.24 45.24 9.43 1.08 0.03 0.24 0.00 43.01 0.96 71 T E E 59.08 8.85 23.65 32.91 121.23 -145.15 -107.36 134.83 20.55 79.37 0.08 18.02 1.94 0.24 0.01 0.06 0.00 78.92 0.79 72 L E E 6.43 24.70 17.12 42.24 124.89 -169.00 -120.55 136.30 6.79 93.20 0.02 5.99 0.53 0.04 0.00 0.01 0.00 93.21 0.21 73 T E E 32.14 12.22 27.19 40.20 118.59 -151.70 -107.20 131.85 3.70 96.29 0.01 3.21 0.26 0.02 0.00 0.01 0.00 96.41 0.08 74 F E E 6.65 25.02 20.56 45.63 125.88 -170.47 -120.57 138.17 1.58 98.41 0.01 1.43 0.09 0.01 0.00 0.00 0.00 98.38 0.08 75 Y E E 35.30 16.51 24.43 40.76 117.91 -155.10 -108.49 129.76 3.77 96.22 0.02 3.50 0.19 0.02 0.00 0.01 0.00 95.90 0.38 76 K E E 54.93 17.54 21.16 37.51 103.53 -167.26 -98.59 -15.47 34.19 65.60 0.21 20.59 12.28 1.59 0.03 0.19 0.00 64.82 0.49 77 S C E 45.86 9.69 23.99 33.60 131.25 27.23 -136.24 152.33 57.12 42.67 0.21 19.42 32.06 4.13 0.01 0.22 0.00 43.75 0.41 78 G E E 18.18 9.56 22.34 33.19 140.74 71.46 145.76 -170.25 37.87 62.05 0.09 18.47 18.36 1.19 0.01 0.09 0.00 61.53 0.35 79 T E E 50.56 10.51 24.92 36.14 125.91 -67.08 -118.02 142.21 13.71 86.26 0.02 12.43 1.01 0.10 0.00 0.02 0.00 85.78 0.65 80 F E E 6.95 25.56 15.94 42.10 123.00 -160.78 -116.71 136.35 4.38 95.61 0.01 4.31 0.14 0.01 0.00 0.00 0.00 91.72 3.82 81 R E E 83.47 8.27 25.89 34.61 109.80 -145.10 -98.89 115.22 48.29 51.68 0.03 47.94 0.73 0.03 0.00 0.02 0.00 50.78 0.49 82 Y H G 48.43 20.93 14.17 34.57 92.26 -149.74 -61.35 -33.27 10.77 1.45 87.78 1.71 1.57 6.64 0.82 87.64 0.00 1.56 0.05 83 E H G 134.07 3.23 21.59 25.57 90.35 64.82 -69.08 -18.79 10.43 1.21 88.36 0.88 1.26 7.42 0.66 88.46 0.00 1.26 0.05 84 D H G 57.49 11.50 18.85 30.92 95.13 52.85 -94.19 -1.77 10.03 1.56 88.41 1.74 1.51 6.04 0.73 88.26 0.00 1.64 0.08 85 V E E 5.83 25.69 13.31 39.36 115.07 94.36 -94.20 125.29 42.24 56.25 1.51 33.90 8.19 0.82 0.78 0.88 0.01 47.77 7.63 86 L E E 63.81 9.85 25.34 35.31 114.33 -161.25 -104.87 120.67 24.91 74.60 0.49 20.98 2.26 0.32 0.41 0.19 0.00 47.78 28.07 87 W C C 30.08 21.94 15.32 36.54 114.68 -165.91 -110.33 112.72 91.34 8.23 0.43 88.08 3.05 0.32 0.24 0.16 0.00 7.26 0.89 88 P C G 55.03 9.73 18.69 29.20 105.70 -124.08 -65.25 -33.14 54.29 2.34 43.37 30.48 7.36 16.96 8.71 34.28 0.00 1.55 0.66 89 E H G 131.59 3.43 20.45 24.00 95.03 -55.45 -68.84 -22.53 44.30 1.18 54.52 9.23 8.62 26.29 13.15 41.45 0.03 0.65 0.59 90 A H G 30.96 14.05 14.69 28.92 95.20 63.28 -74.28 -20.25 40.41 1.42 58.17 15.45 7.68 18.20 12.50 44.81 0.01 0.79 0.57 91 A C C 28.78 16.26 11.97 27.77 102.92 73.33 -83.14 16.11 61.58 2.22 36.20 31.31 11.48 18.85 12.77 23.21 0.03 1.05 1.31 92 S C S 82.12 2.97 17.14 20.58 99.66 101.58 -87.74 -16.00 81.93 1.32 16.75 26.39 29.48 26.82 6.46 9.32 0.01 0.52 1.00 93 D C C 78.81 3.78 16.07 20.59 120.60 45.91 -112.66 135.48 93.88 0.96 5.16 53.28 37.42 3.06 4.03 1.17 0.00 0.27 0.76 94 E H H 104.80 10.34 12.54 23.53 93.92 -141.42 -62.87 -35.18 10.10 0.07 89.82 3.15 3.11 4.39 87.58 1.68 0.02 0.03 0.04 95 T H H 92.27 2.04 17.67 19.43 92.53 54.23 -65.19 -40.77 6.04 0.07 93.88 1.57 1.00 3.60 92.10 1.65 0.02 0.04 0.03 96 K H H 94.26 5.85 17.67 24.41 92.54 48.83 -66.49 -39.36 3.12 0.09 96.79 1.20 0.46 1.63 94.83 1.81 0.01 0.05 0.02 97 K H H 32.35 19.56 14.47 33.34 91.94 52.80 -63.64 -42.70 1.64 0.05 98.31 0.69 0.21 0.79 97.22 1.05 0.00 0.03 0.01 98 R H H 95.91 13.05 19.47 32.07 91.55 51.52 -63.23 -40.91 1.62 0.04 98.34 0.47 0.15 0.96 96.74 1.64 0.00 0.03 0.01 99 T H H 81.92 3.03 24.35 26.70 91.90 51.00 -65.47 -38.58 3.42 0.04 96.54 0.46 0.25 2.60 93.16 3.48 0.01 0.03 0.01 100 A H H 23.32 15.60 19.96 35.48 91.86 54.41 -67.58 -30.67 12.13 0.03 87.83 0.47 0.49 11.49 84.30 3.20 0.03 0.02 0.02 101 F H H 6.16 24.83 16.53 42.10 97.13 42.75 -97.12 -8.67 46.21 0.63 53.15 2.58 2.69 40.06 50.13 3.69 0.17 0.31 0.37 102 A C T 52.34 11.74 17.96 30.47 110.93 119.17 -61.25 131.29 95.14 0.99 3.87 2.34 2.42 90.72 2.66 0.78 0.00 0.42 0.65 103 G C T 52.82 3.31 21.34 25.38 94.48 14.72 84.12 -2.65 98.45 0.41 1.13 1.51 4.51 92.76 0.33 0.50 0.00 0.32 0.07 104 T C C 32.47 17.16 16.64 33.58 125.84 110.50 -99.93 153.25 94.69 4.73 0.58 52.02 40.15 2.73 0.15 0.39 0.00 3.99 0.56 105 A E E 38.11 10.48 24.80 35.84 110.77 -114.48 -79.95 130.34 39.23 60.52 0.26 31.53 6.10 1.09 0.05 0.21 0.00 59.80 1.21 106 I E E 4.26 26.62 15.54 43.08 121.02 -162.40 -114.47 131.66 11.89 88.07 0.04 10.87 0.70 0.06 0.01 0.02 0.00 88.05 0.30 107 S E E 37.52 9.74 26.37 36.48 124.37 -164.98 -116.55 138.98 3.07 96.91 0.02 2.83 0.12 0.02 0.01 0.01 0.00 96.87 0.14 108 I E E 30.42 20.81 16.19 36.61 116.44 -149.03 -104.63 124.65 6.88 93.10 0.02 7.11 0.12 0.01 0.00 0.01 0.00 92.18 0.56 109 V C C 55.03 10.79 20.75 32.00 116.14 -164.56 -105.67 124.80 96.74 3.26 0.00 96.94 0.05 0.00 0.00 0.00 0.00 2.99 0.02