# 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 115.51 5.76 11.79 18.89 114.19 -162.54 -95.49 128.50 99.74 0.24 0.02 99.75 0.07 0.03 0.01 0.00 0.00 0.12 0.02 1 L C C 110.59 4.56 9.44 15.66 114.14 -151.12 -93.49 131.93 74.33 9.11 16.56 68.52 1.88 4.64 10.28 5.31 0.00 6.46 2.91 2 A C C 76.43 3.73 9.47 14.93 111.40 -138.63 -87.70 131.79 64.11 11.80 24.08 40.78 11.31 12.53 12.42 11.48 0.05 8.94 2.50 3 S C C 77.99 3.73 10.16 15.46 110.14 -140.41 -90.86 114.68 63.34 11.75 24.91 36.89 13.88 13.33 13.50 11.26 0.09 8.42 2.65 4 F C C 123.90 6.00 10.31 17.58 107.39 69.54 -92.73 55.92 60.97 7.67 31.36 38.39 14.12 8.69 23.23 8.41 0.06 4.99 2.12 5 S C H 60.40 5.22 12.38 18.93 108.81 72.95 -83.01 132.55 53.24 2.34 44.43 38.25 9.57 5.14 41.32 3.70 0.00 1.50 0.51 6 P H H 79.97 5.58 12.62 19.23 98.91 -93.08 -67.83 -32.47 34.38 2.44 63.18 24.05 4.82 6.62 56.53 5.62 0.01 1.87 0.47 7 L H H 96.90 4.91 13.00 18.75 97.65 57.14 -71.17 -35.44 16.90 3.95 79.15 10.83 2.81 4.77 68.33 8.93 0.04 3.81 0.47 8 L H H 90.60 5.47 13.32 19.77 97.58 57.79 -70.81 -35.64 12.77 4.99 82.24 7.57 2.05 4.00 71.50 9.23 0.04 5.18 0.44 9 F H H 110.59 6.28 13.56 20.58 98.56 53.65 -73.32 -34.12 12.58 5.51 81.91 6.84 1.98 4.43 71.99 8.57 0.05 5.68 0.46 10 L H H 93.69 5.46 14.27 20.35 98.79 53.03 -72.89 -33.63 14.69 4.75 80.56 7.34 2.31 5.67 71.72 7.64 0.06 4.81 0.45 11 C H H 74.20 4.98 14.49 20.19 98.05 55.03 -72.87 -33.29 20.30 4.31 75.39 8.54 3.08 8.97 67.47 7.20 0.09 4.10 0.54 12 Y H H 121.63 6.09 14.26 21.18 97.82 53.37 -76.14 -26.91 26.46 4.90 68.63 10.41 4.62 12.01 61.67 6.06 0.16 4.31 0.77 13 C H H 66.39 6.92 13.88 21.73 98.58 55.57 -81.08 -16.88 31.92 6.19 61.89 14.61 5.64 11.98 57.51 4.05 0.11 5.17 0.92 14 C H H 66.39 6.13 13.94 20.98 98.51 62.11 -72.05 -36.72 27.00 6.73 66.28 17.75 4.45 5.30 63.74 2.32 0.03 5.63 0.78 15 V H H 89.05 3.89 15.33 19.78 95.66 51.25 -68.66 -39.10 12.47 4.71 82.82 8.07 1.94 2.90 80.32 1.81 0.04 4.55 0.37 16 I H H 91.53 5.16 14.67 20.71 95.31 49.72 -67.83 -39.53 8.93 4.15 86.93 5.61 1.33 2.53 83.70 2.07 0.04 4.45 0.27 17 S H H 55.30 6.16 13.97 21.12 95.16 51.14 -67.71 -39.09 8.30 2.99 88.71 4.91 1.29 2.76 85.25 2.32 0.03 3.22 0.23 18 S H H 63.76 3.99 14.58 19.33 94.64 52.35 -68.83 -37.57 9.90 2.54 87.56 5.04 1.52 3.90 84.08 2.53 0.04 2.64 0.24 19 L H H 97.76 3.50 14.65 18.85 94.92 51.96 -69.70 -37.58 12.22 2.31 85.47 5.33 1.84 5.52 82.18 2.60 0.07 2.16 0.31 20 V H H 78.80 5.34 13.55 19.95 95.41 51.42 -69.91 -38.70 15.22 1.96 82.82 7.62 2.51 5.66 80.06 2.20 0.05 1.53 0.37 21 M H H 101.23 5.03 13.78 19.77 95.97 51.28 -71.25 -36.77 20.39 1.18 78.43 12.92 2.95 5.10 76.11 1.93 0.01 0.73 0.25 22 T H H 77.80 3.75 14.31 18.92 97.88 53.17 -71.49 -37.74 22.84 0.97 76.19 14.37 3.03 6.13 73.30 2.33 0.02 0.58 0.24 23 E H H 115.37 3.27 14.79 18.67 95.66 50.05 -69.24 -36.95 20.30 0.89 78.82 11.42 3.23 6.67 75.04 2.83 0.02 0.55 0.23 24 V H H 79.88 4.52 13.65 19.25 94.31 49.84 -68.51 -39.72 18.92 1.18 79.90 10.34 3.55 6.12 75.83 3.09 0.03 0.74 0.31 25 A H H 56.60 4.34 13.49 19.12 93.93 51.98 -67.36 -37.87 22.78 1.16 76.06 13.55 3.43 6.75 72.28 2.94 0.02 0.71 0.32 26 A H H 61.38 3.71 13.26 18.08 95.37 53.83 -68.59 -36.40 28.17 1.24 70.59 14.11 5.05 9.86 66.13 3.72 0.03 0.74 0.37 27 T H H 81.42 3.37 12.94 17.32 98.60 53.05 -77.18 -23.32 34.19 1.78 64.03 17.32 6.45 11.44 59.48 3.69 0.04 1.03 0.55 28 K H H 121.31 3.92 11.81 17.08 98.41 58.10 -71.63 -32.77 35.09 2.18 62.74 20.33 7.06 9.12 56.83 4.70 0.04 1.27 0.65 29 K H H 132.80 3.02 12.02 16.30 98.03 57.06 -71.75 -28.63 39.42 2.01 58.56 24.12 6.32 9.89 52.01 5.81 0.02 1.20 0.61 30 E H H 122.55 3.55 11.46 16.42 99.81 58.20 -78.46 -18.23 45.41 2.10 52.48 28.00 6.47 11.56 45.50 6.52 0.02 1.23 0.70 31 K C H 135.56 3.38 11.48 16.28 101.46 67.02 -78.05 -14.29 55.65 2.30 42.04 29.25 10.03 16.78 35.99 5.81 0.03 1.26 0.86 32 K C C 138.20 3.21 12.23 16.67 104.43 56.43 -88.98 22.19 67.73 2.95 29.32 36.85 14.45 16.55 25.11 4.27 0.02 1.40 1.34 33 A C C 48.84 7.46 9.91 19.02 115.55 104.80 -80.81 148.38 85.16 1.24 13.59 52.09 27.97 3.77 13.88 1.25 0.00 0.52 0.53 34 P C C 79.03 3.90 12.74 17.90 107.66 -103.48 -67.34 151.76 73.18 1.11 25.71 60.24 5.60 5.54 25.35 2.28 0.00 0.56 0.43 35 Q H H 123.11 3.34 12.36 16.98 96.15 -95.32 -65.51 -36.23 31.38 0.78 67.84 19.52 6.98 6.07 62.76 4.02 0.01 0.39 0.25 36 E H H 114.36 4.47 12.88 18.43 95.07 55.27 -69.44 -35.92 20.62 1.70 77.69 13.56 3.94 4.82 71.33 4.70 0.02 1.30 0.32 37 E H H 102.67 4.40 13.61 19.22 95.04 54.32 -69.38 -37.28 15.00 2.69 82.31 10.77 2.37 3.43 75.84 4.80 0.01 2.47 0.30 38 V H H 73.09 4.74 14.15 20.14 94.10 53.13 -67.48 -39.78 14.61 3.38 82.01 10.13 2.28 3.48 76.63 3.94 0.02 3.13 0.39 39 V H H 68.69 5.99 13.79 21.14 94.25 50.78 -68.67 -38.98 18.03 3.37 78.61 11.87 2.84 4.63 73.55 3.75 0.03 2.85 0.50 40 V H H 73.28 6.55 12.99 20.80 94.99 51.87 -71.88 -32.52 26.32 2.38 71.30 15.80 4.23 7.52 66.72 3.54 0.03 1.64 0.52 41 Q H H 111.93 3.86 13.78 18.71 96.66 60.11 -72.70 -23.03 42.52 1.51 55.98 22.86 6.31 13.61 52.63 3.25 0.02 0.84 0.49 42 Q C H 106.24 5.30 11.89 18.54 102.35 74.91 -81.06 -2.08 59.10 1.29 39.61 31.16 10.73 16.99 35.83 4.11 0.01 0.61 0.55 43 T C C 88.75 4.69 12.00 18.10 101.36 72.69 -82.99 -4.12 70.81 1.44 27.76 32.05 14.74 23.95 22.50 5.39 0.02 0.67 0.67 44 D C C 97.35 4.49 13.46 19.26 104.33 76.77 -86.16 16.24 79.77 1.80 18.43 29.45 25.11 25.97 11.63 6.13 0.02 0.92 0.79 45 Q C C 105.45 6.00 15.68 22.74 109.36 94.11 -88.17 109.94 87.43 5.46 7.11 53.28 22.04 12.71 2.72 4.00 0.00 4.32 0.93 46 A C C 36.30 15.99 13.22 28.79 118.07 -128.91 -84.94 141.47 76.67 21.86 1.47 63.02 9.27 2.99 0.36 1.00 0.00 22.49 0.87 47 Q E E 69.22 12.07 21.31 33.26 125.05 -160.59 -116.93 141.44 31.59 67.93 0.47 25.73 5.01 0.88 0.12 0.32 0.00 66.89 1.04 48 V E E 42.76 14.90 22.04 36.82 117.99 -128.59 -95.60 136.21 18.31 81.61 0.08 15.38 2.14 0.21 0.02 0.05 0.00 81.80 0.40 49 G E E 4.20 22.26 18.25 40.27 131.25 -166.99 -120.87 158.34 6.73 93.25 0.01 5.71 0.56 0.04 0.00 0.01 0.00 93.62 0.07 50 L E E 57.07 9.88 25.90 36.50 120.92 -129.73 -111.67 133.31 1.55 98.45 0.00 1.34 0.06 0.00 0.00 0.00 0.00 98.56 0.03 51 I E E 18.80 22.08 15.33 37.91 109.46 -121.35 -76.81 123.63 0.45 99.55 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.57 0.01 52 I E E 72.29 7.18 21.35 29.64 100.75 175.44 -96.84 -33.39 1.08 98.92 0.00 0.68 0.19 0.01 0.00 0.00 0.00 99.11 0.00 53 K E E 93.50 4.74 23.74 29.23 139.56 -3.18 -153.70 152.11 0.52 99.47 0.00 0.31 0.10 0.01 0.00 0.00 0.00 99.57 0.00 54 V E E 49.51 18.34 14.11 31.67 115.32 -136.71 -103.04 123.40 0.52 99.48 0.01 0.49 0.01 0.00 0.00 0.00 0.00 99.49 0.01 55 L E E 71.37 8.27 17.97 27.41 106.25 -168.54 -96.83 54.61 2.32 97.67 0.01 1.81 0.25 0.03 0.00 0.00 0.00 97.88 0.02 56 G E E 28.83 7.09 17.90 26.13 140.45 -59.22 162.86 -174.67 6.62 93.36 0.01 4.57 1.57 0.10 0.00 0.01 0.00 93.68 0.07 57 R E E 130.40 6.89 13.93 22.58 123.96 -84.69 -113.60 145.22 12.19 87.75 0.05 10.99 0.87 0.09 0.01 0.03 0.00 86.92 1.09 58 T E E 78.35 6.60 11.18 19.51 119.84 -149.44 -107.25 145.26 43.67 55.94 0.39 36.01 6.54 0.93 0.12 0.32 0.00 53.27 2.82 59 G C S 44.66 2.73 11.95 15.97 125.60 25.88 102.25 -170.26 86.23 5.94 7.83 21.52 32.94 31.68 0.57 7.91 0.00 4.20 1.17 60 S C T 102.03 0.82 10.66 11.37 94.73 -65.79 -69.15 -21.42 88.34 0.67 10.99 2.99 20.79 62.78 0.40 12.33 0.00 0.38 0.33 61 R C T 178.54 1.39 10.70 12.61 100.46 49.15 -90.60 6.22 87.71 0.67 11.62 2.70 14.79 68.18 0.40 13.22 0.00 0.38 0.33 62 G C S 40.13 5.93 11.16 18.45 105.39 -89.61 83.27 -6.01 88.18 2.86 8.96 22.75 34.94 30.02 0.59 9.11 0.00 1.71 0.87 63 N C C 97.87 4.38 15.52 20.78 100.54 117.49 -79.11 12.87 82.03 16.80 1.17 57.29 18.54 6.26 0.22 1.11 0.00 14.10 2.48 64 V E E 40.67 13.46 13.04 27.40 119.77 61.01 -99.50 137.69 34.60 65.31 0.09 31.45 2.28 0.18 0.02 0.06 0.00 64.22 1.79 65 T E E 44.77 10.88 19.09 30.90 105.97 -172.03 -101.40 -4.19 14.37 85.61 0.02 12.34 1.09 0.06 0.00 0.01 0.00 86.37 0.13 66 Q E E 52.53 12.69 20.80 33.82 128.81 2.91 -126.17 142.08 2.42 97.58 0.00 2.00 0.18 0.00 0.00 0.00 0.00 97.78 0.03 67 V E E 9.42 21.31 17.79 39.43 124.56 -162.70 -119.78 137.08 0.56 99.44 0.00 0.49 0.01 0.00 0.00 0.00 0.00 99.48 0.01 68 R E E 69.69 10.48 25.01 36.08 117.65 -144.32 -99.95 131.33 0.35 99.65 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.67 0.00 69 V E E 7.07 23.67 16.96 40.90 125.22 -167.68 -119.09 137.49 1.09 98.90 0.01 0.95 0.04 0.01 0.00 0.00 0.00 98.99 0.01 70 R E E 89.84 9.04 25.21 34.56 121.06 -158.00 -112.45 131.73 1.72 98.20 0.08 1.48 0.09 0.03 0.03 0.02 0.00 98.31 0.04 71 L E E 26.89 19.47 16.34 35.75 114.73 -129.99 -85.92 130.14 6.75 92.94 0.32 6.05 0.46 0.13 0.13 0.12 0.00 92.76 0.34 72 M E E 55.07 11.49 17.65 30.32 115.53 -144.95 -94.90 133.63 39.28 56.50 4.22 32.78 4.72 1.85 1.56 2.24 0.00 55.78 1.08 73 A C C 49.00 9.26 14.95 25.34 116.26 -131.85 -91.29 142.62 62.35 28.66 8.99 41.48 15.40 6.89 3.11 5.54 0.03 25.42 2.12 74 E C C 110.23 6.82 12.12 20.31 109.44 -128.69 -88.12 122.31 78.43 12.46 9.11 51.49 16.57 10.62 3.03 6.22 0.01 9.24 2.83 75 E C C 140.04 2.65 11.66 15.80 106.81 -130.16 -85.18 89.62 90.44 3.56 6.00 40.02 22.13 28.68 1.82 4.11 0.00 2.06 1.18 76 G C S 55.69 2.56 11.48 15.21 106.61 11.25 78.37 0.25 96.22 1.45 2.33 32.12 35.33 28.68 0.42 2.08 0.00 0.71 0.65 77 S C C 58.61 4.62 9.60 15.96 119.44 99.48 -94.26 151.10 96.50 2.10 1.39 57.55 34.21 4.41 0.31 1.14 0.00 0.77 1.60 78 P C T 109.39 2.33 11.24 14.81 96.49 -97.97 -66.28 -22.26 89.77 0.64 9.60 11.99 13.73 62.99 1.02 9.56 0.00 0.34 0.37 79 D C T 97.73 4.14 11.43 16.92 99.58 55.95 -88.24 8.79 87.77 1.30 10.93 15.83 11.83 59.35 1.45 10.20 0.00 0.77 0.55 80 A C T 52.30 8.08 10.88 20.39 102.83 117.14 -80.77 10.74 80.15 3.79 16.06 25.67 19.06 35.52 1.99 14.30 0.01 2.22 1.23 81 N C T 102.43 5.16 15.18 21.41 102.78 59.57 -90.07 26.82 80.35 8.93 10.72 29.10 18.62 33.36 1.28 9.40 0.00 7.14 1.10 82 R C C 90.64 11.06 14.71 26.52 118.26 137.00 -103.28 132.81 61.45 34.69 3.87 46.67 10.80 3.95 0.60 3.34 0.00 33.31 1.33 83 T E E 57.13 12.33 16.49 29.23 124.45 -170.53 -118.33 136.52 17.02 82.80 0.18 15.56 1.35 0.17 0.06 0.09 0.00 82.24 0.53 84 I E E 38.42 14.37 17.41 32.75 120.71 -161.24 -115.30 131.68 2.12 97.86 0.02 2.01 0.12 0.01 0.01 0.01 0.00 97.77 0.08 85 V E E 60.97 12.83 18.96 32.04 121.91 -164.39 -116.04 130.38 0.88 99.11 0.01 0.82 0.03 0.00 0.00 0.00 0.00 99.10 0.04 86 R E E 70.28 13.45 19.00 32.71 129.57 -175.56 -133.24 145.03 5.32 94.65 0.02 4.90 0.23 0.02 0.00 0.01 0.00 94.76 0.07 87 N E E 74.33 8.76 22.46 31.53 113.22 -120.54 -83.67 129.23 12.56 87.35 0.09 10.76 1.22 0.13 0.02 0.04 0.00 87.52 0.30 88 V E E 14.41 22.48 12.38 34.63 117.08 -157.30 -104.15 128.98 22.40 77.50 0.09 21.81 0.78 0.07 0.05 0.04 0.00 73.24 4.00 89 K C C 133.51 3.90 21.22 25.61 109.21 -161.47 -98.00 98.78 64.12 35.77 0.11 38.89 25.44 0.76 0.02 0.11 0.00 33.05 1.73 90 G C S 28.97 5.25 21.93 27.50 137.32 -9.01 133.89 -175.78 84.37 15.61 0.02 4.48 78.34 1.05 0.00 0.02 0.00 15.85 0.27 91 P C C 70.43 7.87 21.05 29.34 114.61 -34.27 -68.60 143.65 84.50 15.47 0.03 74.89 8.24 0.34 0.00 0.04 0.00 15.75 0.75 92 C E C 9.00 24.34 12.05 36.18 123.98 -160.24 -113.81 141.79 45.51 54.43 0.06 47.24 1.02 0.06 0.04 0.02 0.00 21.45 30.16 93 K C C 102.34 4.85 24.84 30.03 130.56 -166.68 -122.22 157.60 78.63 21.32 0.05 79.27 1.27 0.10 0.02 0.03 0.00 11.83 7.49 94 E C T 107.71 10.46 16.11 27.21 109.42 -79.95 -59.07 133.16 99.13 0.70 0.17 0.16 1.58 97.76 0.01 0.09 0.00 0.30 0.10 95 G C T 41.66 4.95 20.36 26.30 96.66 24.87 90.27 -6.29 99.66 0.24 0.11 0.33 2.17 97.24 0.01 0.08 0.00 0.16 0.01 96 D C C 33.69 14.85 16.85 32.41 118.29 131.01 -73.95 148.01 91.24 8.66 0.10 87.85 3.33 0.13 0.02 0.08 0.00 8.12 0.46 97 M E E 59.12 13.10 23.39 36.62 120.51 -137.30 -108.82 133.44 5.24 94.63 0.13 5.12 0.23 0.05 0.12 0.04 0.00 90.96 3.48 98 L E E 6.63 24.43 19.48 44.00 125.66 -166.94 -117.84 141.53 4.12 95.53 0.35 3.78 0.30 0.11 0.28 0.10 0.00 95.10 0.34 99 S E E 26.16 14.12 25.88 40.00 121.71 -157.18 -112.92 134.30 12.77 85.69 1.53 11.36 1.01 0.43 0.94 0.57 0.00 85.18 0.52 100 L E E 14.55 22.68 18.41 40.84 114.14 -150.44 -96.79 127.72 35.89 59.05 5.06 28.77 5.54 1.82 3.22 1.85 0.01 57.42 1.38 101 M C C 64.20 12.17 21.70 33.78 112.15 -151.83 -90.40 129.02 62.93 26.46 10.61 49.86 8.69 3.59 7.29 3.53 0.02 24.81 2.21 102 E C C 76.08 12.73 17.93 30.50 105.86 -126.13 -84.08 91.22 74.84 10.70 14.46 52.20 17.02 5.29 11.11 3.93 0.01 8.66 1.79 103 T C C 46.36 9.70 17.24 27.95 118.48 71.76 -95.04 156.01 72.74 3.85 23.41 56.42 10.86 4.51 21.44 3.33 0.00 2.38 1.06 104 E H H 98.80 8.58 15.22 24.72 94.50 -117.63 -63.22 -35.77 13.87 0.39 85.74 7.05 3.30 4.71 80.78 3.79 0.03 0.23 0.12 105 R H H 134.45 2.53 17.99 20.39 92.66 53.40 -65.64 -40.23 9.11 0.29 90.60 3.81 1.64 4.12 85.59 4.51 0.04 0.19 0.08 106 E H H 64.50 7.65 15.48 24.84 92.53 50.22 -66.60 -38.98 7.61 0.35 92.04 3.49 1.19 3.29 86.17 5.49 0.02 0.27 0.08 107 A H H 19.26 13.39 11.66 26.38 92.02 53.26 -64.60 -39.33 8.15 0.27 91.58 3.62 1.23 3.47 84.72 6.67 0.02 0.19 0.08 108 R H H 137.60 3.04 15.28 19.17 92.00 53.43 -64.85 -37.82 16.03 0.32 83.65 4.51 1.90 9.05 73.42 10.77 0.03 0.20 0.12 109 R H H 150.72 2.26 14.26 17.18 92.31 54.67 -68.62 -30.60 30.42 0.41 69.17 5.69 2.73 21.05 60.57 9.49 0.05 0.24 0.18 110 L H H 73.53 9.77 10.25 20.91 95.73 55.10 -78.15 -13.61 49.50 0.80 49.69 22.36 2.02 24.57 45.03 5.13 0.01 0.40 0.47 111 R C C 154.50 4.99 14.08 20.65 101.99 127.76 -67.22 55.99 99.79 0.09 0.12 99.42 0.17 0.24 0.10 0.01 0.00 0.04 0.02