# 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 102.73 3.64 20.79 24.54 103.66 -125.68 -76.08 59.53 99.84 0.16 0.00 99.72 0.13 0.03 0.00 0.00 0.00 0.11 0.00 1 I C C 34.47 20.94 10.54 30.13 117.92 -160.11 -98.83 131.39 65.75 34.16 0.09 64.56 0.63 0.19 0.01 0.05 0.00 33.89 0.67 2 Q E E 98.84 5.02 21.95 27.76 122.89 -167.87 -117.58 137.16 21.87 78.01 0.12 19.57 1.74 0.25 0.03 0.08 0.00 77.71 0.63 3 M E E 45.95 20.58 13.26 32.81 123.23 -159.96 -114.12 135.56 7.26 92.70 0.04 6.90 0.39 0.05 0.01 0.02 0.00 92.16 0.47 4 T E E 60.12 8.20 21.31 30.09 125.87 -171.80 -123.20 143.79 9.00 90.94 0.05 8.08 0.77 0.09 0.02 0.03 0.00 89.96 1.06 5 Q E E 76.71 14.53 16.23 30.37 125.09 -159.53 -122.25 140.30 34.30 65.59 0.11 26.99 7.16 0.48 0.03 0.10 0.00 64.01 1.24 6 S C C 50.17 11.04 16.75 28.29 121.89 -140.64 -97.33 150.29 81.90 18.01 0.09 60.80 19.55 0.69 0.01 0.09 0.00 18.25 0.62 7 P C C 57.49 8.98 17.07 26.90 115.86 2.06 -71.87 152.35 90.93 8.74 0.33 67.56 19.75 2.75 0.03 0.40 0.00 9.05 0.47 8 S C S 67.84 8.90 16.47 26.23 97.56 -148.62 -85.89 -20.39 82.86 16.94 0.20 25.43 53.70 2.45 0.01 0.22 0.00 17.71 0.48 9 S E E 57.15 6.57 20.16 27.98 135.87 18.48 -146.11 150.29 18.94 80.91 0.15 14.69 3.90 0.47 0.02 0.14 0.00 80.38 0.40 10 V E E 31.77 19.24 14.65 33.38 131.02 -174.65 -138.55 143.55 3.12 96.87 0.01 2.80 0.20 0.01 0.00 0.01 0.00 96.84 0.13 11 S E E 65.92 6.20 23.22 30.60 123.59 -154.26 -115.19 139.59 2.28 97.71 0.01 2.07 0.14 0.01 0.00 0.00 0.00 97.66 0.12 12 A E E 12.38 19.65 14.36 34.09 138.33 168.91 -147.60 159.54 12.54 87.44 0.02 11.36 0.69 0.04 0.00 0.01 0.00 87.57 0.33 13 S E E 54.77 4.86 23.88 28.55 124.44 -119.95 -93.18 159.81 37.93 61.94 0.13 34.50 2.69 0.30 0.05 0.10 0.00 57.75 4.61 14 V C T 61.63 14.95 14.27 29.17 109.32 -82.03 -59.80 134.88 98.58 1.01 0.41 0.45 3.65 94.91 0.02 0.28 0.00 0.58 0.12 15 G C T 44.79 4.44 20.05 25.25 95.72 23.02 88.68 -6.36 99.44 0.30 0.26 0.64 4.63 94.28 0.01 0.21 0.00 0.20 0.04 16 D C C 56.76 9.79 16.82 27.80 120.72 124.61 -76.57 151.57 96.74 3.12 0.14 65.84 30.67 0.54 0.03 0.12 0.00 2.35 0.45 17 R C C 130.72 7.61 19.91 28.73 119.78 -125.42 -98.97 135.91 70.33 29.65 0.01 70.73 0.57 0.03 0.00 0.01 0.00 27.91 0.75 18 V E E 11.39 22.59 14.55 37.10 128.95 -172.84 -128.38 144.91 1.51 98.49 0.00 1.53 0.02 0.00 0.00 0.00 0.00 98.36 0.09 19 T E E 62.74 7.84 25.26 33.61 118.14 -143.69 -109.43 128.73 0.36 99.64 0.00 0.36 0.00 0.00 0.00 0.00 0.00 99.63 0.00 20 I E E 4.43 25.83 16.62 43.30 120.68 -166.79 -115.10 129.66 0.99 99.01 0.00 0.91 0.02 0.00 0.00 0.00 0.00 99.06 0.01 21 T E E 40.71 9.63 27.28 37.72 121.63 -164.84 -113.58 135.56 3.34 96.66 0.00 2.95 0.08 0.00 0.00 0.00 0.00 96.94 0.02 22 C E E 3.25 26.31 17.30 44.25 126.11 -172.03 -124.74 137.92 3.15 96.85 0.00 2.83 0.08 0.00 0.00 0.00 0.00 97.04 0.04 23 R E E 96.23 8.22 27.80 36.90 123.26 -168.46 -123.55 134.64 2.19 97.80 0.01 1.98 0.09 0.01 0.00 0.00 0.00 97.72 0.19 24 A E E 8.99 23.84 14.29 37.83 120.64 -159.11 -106.47 140.84 24.48 75.38 0.14 23.75 0.85 0.14 0.04 0.08 0.00 74.02 1.12 25 S C C 55.86 7.22 21.01 28.60 102.48 -149.40 -81.93 -24.38 79.49 20.00 0.51 44.19 30.53 4.55 0.05 0.58 0.00 19.27 0.83 26 Q C S 110.59 5.21 19.13 24.82 113.90 18.23 -112.77 121.52 90.41 8.45 1.14 15.78 56.49 18.51 0.09 1.16 0.00 6.87 1.09 27 G C S 40.05 7.13 19.10 26.76 115.90 10.81 84.23 -169.08 94.61 4.10 1.29 36.29 40.80 17.51 0.11 1.56 0.00 2.96 0.79 28 I C C 65.41 14.78 17.71 31.76 112.02 -61.02 -94.16 118.21 90.91 6.66 2.42 44.77 29.77 16.58 0.30 2.55 0.00 4.27 1.75 29 S C C 28.02 16.35 19.46 35.22 119.00 150.02 -100.62 140.24 89.54 7.87 2.59 56.66 20.13 12.54 0.26 2.82 0.00 6.49 1.11 30 S C S 39.28 14.08 22.66 36.17 102.87 -169.56 -98.41 -7.69 85.18 13.47 1.36 31.82 48.60 4.25 0.11 1.25 0.00 13.28 0.69 31 W E E 63.56 14.61 25.28 39.86 128.93 40.80 -125.40 142.93 24.97 74.44 0.58 20.36 3.81 0.69 0.06 0.51 0.00 74.03 0.55 32 L E E 2.93 26.59 21.38 48.25 127.95 -170.68 -126.79 140.29 2.67 97.32 0.01 2.44 0.17 0.01 0.00 0.00 0.00 97.27 0.10 33 G E E 4.56 19.35 27.80 46.87 134.13 -175.04 -133.02 153.98 0.59 99.41 0.00 0.54 0.02 0.00 0.00 0.00 0.00 99.43 0.01 34 W E E 9.23 24.41 23.36 47.48 127.94 -150.51 -122.27 143.97 0.63 99.37 0.00 0.57 0.03 0.00 0.00 0.00 0.00 99.39 0.01 35 Y E E 24.53 17.61 23.59 41.07 132.29 -173.11 -130.79 148.33 1.01 98.99 0.00 0.87 0.05 0.00 0.00 0.00 0.00 99.04 0.04 36 Q E E 44.89 13.97 21.52 35.79 121.08 -143.29 -108.69 135.01 4.30 95.70 0.01 3.54 0.45 0.03 0.00 0.00 0.00 95.85 0.12 37 Q E E 54.97 14.10 15.12 29.67 118.97 -151.87 -103.98 135.61 32.33 67.64 0.03 29.26 2.13 0.10 0.01 0.02 0.00 67.09 1.38 38 K C C 101.11 5.90 15.16 22.43 119.90 -139.62 -94.04 143.66 97.47 2.50 0.03 95.34 2.20 0.19 0.01 0.02 0.00 1.80 0.43 39 P C T 106.42 3.34 11.19 16.53 109.62 -86.11 -58.79 134.54 99.58 0.13 0.28 0.49 3.92 95.21 0.01 0.27 0.00 0.08 0.03 40 G C T 69.02 0.30 12.73 10.51 95.97 17.56 82.99 -2.88 99.61 0.09 0.29 0.59 3.91 95.10 0.01 0.31 0.00 0.06 0.01 41 K C S 111.66 4.07 10.69 16.91 128.81 91.87 -116.13 159.59 93.81 5.84 0.36 31.93 60.73 1.29 0.07 0.28 0.00 2.13 3.57 42 A C C 73.62 2.79 16.24 19.54 115.96 -94.75 -70.87 148.88 97.25 2.72 0.03 87.53 9.78 0.17 0.01 0.03 0.00 2.11 0.37 43 P C C 45.39 17.52 11.10 27.92 115.03 -102.66 -65.78 145.09 90.88 9.08 0.05 89.18 1.77 0.15 0.01 0.03 0.00 8.56 0.30 44 K E E 101.04 7.00 21.12 28.99 123.72 -156.13 -118.34 139.42 11.33 88.57 0.10 9.79 1.44 0.14 0.03 0.06 0.00 87.74 0.80 45 L E E 63.95 15.69 17.77 33.02 110.84 -114.97 -74.61 127.53 1.39 98.60 0.01 1.25 0.07 0.01 0.00 0.00 0.00 98.62 0.05 46 L E E 24.09 17.91 20.95 38.82 101.15 175.56 -95.72 -34.41 2.58 97.40 0.02 1.71 0.70 0.03 0.00 0.01 0.00 97.53 0.02 47 I E E 12.01 21.28 21.26 42.40 135.89 4.64 -149.69 144.35 0.39 99.60 0.01 0.32 0.03 0.00 0.00 0.00 0.00 99.64 0.01 48 Y E E 59.89 17.07 23.48 39.45 128.93 -171.05 -132.14 138.70 1.66 98.30 0.04 1.43 0.09 0.01 0.03 0.01 0.00 98.38 0.06 49 A E E 16.52 18.45 21.11 39.06 119.81 -166.19 -114.39 133.54 20.75 77.27 1.98 16.40 3.56 0.99 1.12 0.75 0.00 76.59 0.59 50 A C C 29.37 14.86 19.25 34.07 118.19 -167.61 -108.84 148.36 50.01 27.02 22.98 29.94 12.71 9.34 6.93 14.64 0.07 24.65 1.72 51 S C T 63.41 8.39 19.20 27.65 100.07 -127.95 -79.52 -17.62 59.19 7.67 33.14 20.77 17.70 22.70 11.13 20.32 0.18 5.36 1.83 52 S C C 60.65 7.20 18.75 26.42 105.75 48.17 -98.60 33.77 58.70 6.50 34.79 25.02 14.36 20.91 12.70 20.80 0.14 3.98 2.10 53 L C C 54.54 16.55 12.24 27.81 106.60 88.06 -86.46 79.78 62.11 8.70 29.19 37.05 13.43 11.93 15.13 14.09 0.08 5.21 3.08 54 Q C C 111.99 5.83 15.71 22.78 109.97 136.04 -92.85 105.00 67.29 9.73 22.98 36.60 13.82 17.57 12.01 10.44 0.10 5.92 3.54 55 S C T 75.55 5.08 15.10 21.47 107.97 -77.09 -88.97 110.02 80.35 4.56 15.09 19.93 18.55 42.53 6.80 7.57 0.06 2.69 1.87 56 G C T 50.14 4.76 16.55 22.41 102.62 -23.34 85.78 0.30 92.88 3.19 3.93 24.65 28.09 40.65 0.82 2.90 0.00 1.96 0.94 57 V C C 44.69 15.12 12.14 27.51 116.85 111.22 -98.24 131.14 87.56 11.69 0.75 56.24 30.32 1.76 0.29 0.48 0.00 5.59 5.31 58 P C C 62.72 8.69 17.65 27.29 110.66 -109.89 -66.65 146.86 88.87 7.76 3.37 65.21 13.58 9.71 0.80 2.89 0.00 5.79 2.01 59 S C C 59.39 12.14 16.29 28.17 102.62 -125.17 -78.85 5.09 85.98 8.61 5.41 51.02 19.51 15.55 0.78 5.16 0.00 6.67 1.32 60 R C C 110.77 9.70 20.50 30.22 104.01 84.11 -96.63 32.56 71.19 24.08 4.74 37.40 25.54 9.04 0.77 3.80 0.01 21.99 1.45 61 F E E 30.18 22.33 13.71 35.24 121.62 108.75 -107.95 137.79 25.64 73.41 0.95 21.16 4.35 1.11 0.36 0.59 0.00 70.82 1.60 62 S E E 54.89 7.04 23.48 31.67 134.29 -175.90 -137.09 154.85 10.44 89.35 0.22 9.16 1.08 0.23 0.09 0.10 0.00 88.65 0.69 63 G E E 23.60 17.47 15.99 32.41 140.79 165.58 -162.06 168.82 8.93 90.97 0.10 7.51 1.11 0.20 0.03 0.05 0.00 90.68 0.41 64 S E E 65.65 5.17 21.45 28.27 135.67 -165.43 -145.66 155.95 13.35 86.55 0.10 11.48 1.53 0.25 0.02 0.06 0.00 86.12 0.53 65 G E E 29.84 10.96 15.90 27.57 140.37 128.65 103.45 168.83 29.34 70.49 0.17 21.05 8.05 1.24 0.02 0.17 0.00 68.47 1.00 66 S C C 75.44 3.55 21.13 25.24 117.01 -108.15 -119.55 126.75 57.95 41.52 0.52 39.47 15.33 4.11 0.09 0.57 0.00 37.71 2.72 67 G C S 31.01 11.64 18.81 30.21 107.96 -52.34 65.78 -123.50 98.09 1.19 0.72 2.61 54.64 41.01 0.02 0.70 0.00 0.86 0.14 68 T C S 55.51 14.33 17.05 31.19 97.65 -9.87 -98.59 -3.65 98.07 1.33 0.60 2.47 54.72 41.08 0.02 0.56 0.00 1.02 0.13 69 D E E 62.76 8.61 22.61 32.31 120.16 82.30 -108.30 129.72 35.46 64.31 0.23 24.17 10.77 1.63 0.03 0.28 0.00 61.23 1.88 70 F E E 7.86 24.68 15.88 40.98 128.41 -175.02 -127.40 142.40 11.63 88.37 0.00 11.03 0.34 0.02 0.00 0.00 0.00 88.30 0.31 71 T E E 36.65 10.26 27.31 38.63 122.88 -161.51 -118.36 134.42 2.72 97.28 0.00 2.39 0.09 0.00 0.00 0.00 0.00 97.46 0.05 72 L E E 3.01 26.21 18.88 46.00 119.98 -162.62 -114.01 128.75 0.36 99.64 0.00 0.39 0.00 0.00 0.00 0.00 0.00 99.60 0.00 73 T E E 40.07 10.16 27.31 38.29 120.70 -164.91 -115.56 129.56 0.15 99.85 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.83 0.01 74 I E E 7.58 24.14 16.20 40.91 117.25 -165.77 -113.73 125.15 2.40 97.60 0.00 2.48 0.03 0.00 0.00 0.00 0.00 97.10 0.40 75 S C C 48.92 7.09 22.93 30.23 121.21 -163.56 -106.92 157.71 92.99 6.96 0.06 48.86 38.89 3.98 0.00 0.10 0.00 7.93 0.23 76 S C S 68.06 4.32 24.02 28.35 97.63 11.98 59.64 56.78 99.17 0.81 0.02 9.88 85.06 4.27 0.00 0.03 0.00 0.69 0.07 77 L C C 18.97 23.74 10.34 33.50 113.89 -146.51 -75.21 132.18 99.39 0.60 0.01 97.71 1.76 0.03 0.00 0.00 0.00 0.21 0.29 78 Q C C 81.07 4.51 23.89 28.24 130.45 -173.74 -125.02 156.27 99.90 0.09 0.01 99.48 0.43 0.00 0.00 0.00 0.00 0.01 0.06 79 P H G 71.86 12.36 14.95 27.62 90.96 -107.29 -58.20 -32.60 3.35 0.02 96.64 0.18 0.20 2.14 0.29 97.19 0.00 0.01 0.00 80 E H G 128.88 3.31 21.12 25.07 89.81 62.81 -70.26 -16.85 2.68 0.02 97.30 0.09 0.14 1.84 0.19 97.71 0.00 0.02 0.00 81 D H G 16.02 20.12 16.01 36.50 93.96 60.20 -87.40 -3.87 3.40 0.04 96.56 0.39 0.32 1.61 0.28 97.37 0.00 0.03 0.00 82 F C C 49.18 17.78 19.38 36.94 117.36 102.71 -78.59 136.24 87.76 11.66 0.58 82.76 5.08 0.21 0.07 0.51 0.00 10.86 0.50 83 A E E 15.92 15.78 23.18 38.84 143.80 150.71 -159.69 174.77 9.26 90.72 0.02 8.56 0.64 0.05 0.01 0.01 0.00 90.07 0.66 84 T E E 36.22 13.99 25.13 39.17 119.65 -89.67 -103.16 136.52 1.85 98.15 0.00 1.61 0.12 0.00 0.00 0.00 0.00 98.18 0.07 85 Y E E 8.37 24.74 20.16 44.85 127.58 -168.44 -120.98 142.57 0.82 99.17 0.01 0.69 0.06 0.00 0.00 0.00 0.00 99.20 0.04 86 Y E E 31.51 16.46 27.11 43.40 128.72 -165.42 -124.26 145.01 2.00 97.95 0.05 1.68 0.15 0.02 0.03 0.02 0.00 98.00 0.09 87 C E E 3.52 25.04 21.59 46.83 121.95 -155.58 -113.31 134.73 8.46 90.94 0.60 7.05 0.85 0.29 0.29 0.22 0.00 90.98 0.32 88 Q E E 37.17 14.49 25.01 39.41 125.78 -170.66 -121.87 141.08 13.55 85.51 0.94 11.78 1.30 0.41 0.43 0.40 0.00 84.72 0.95 89 Q E E 44.91 16.12 18.63 34.52 116.08 -135.72 -92.25 134.42 35.83 62.49 1.67 29.17 5.56 1.76 0.62 1.01 0.01 60.38 1.48 90 A C C 45.47 11.03 15.86 27.60 109.82 -141.77 -90.18 126.40 68.50 28.25 3.25 37.06 20.07 12.71 0.52 2.66 0.01 25.20 1.77 91 N C S 101.56 5.01 14.68 20.99 109.84 113.34 -101.31 53.02 87.96 8.80 3.24 25.76 35.87 26.86 0.32 3.04 0.00 6.87 1.27 92 S C S 76.12 4.08 13.79 19.00 106.55 18.98 -96.58 21.81 94.37 3.20 2.43 20.87 48.49 25.17 0.22 2.36 0.00 2.13 0.77 93 F C S 117.96 5.87 12.51 20.10 120.40 30.28 -108.90 134.29 91.76 7.23 1.01 21.52 61.70 8.82 0.14 0.91 0.00 5.34 1.57 94 P C C 78.46 6.04 15.88 23.01 113.37 -82.21 -69.86 146.73 88.52 10.69 0.79 56.17 25.60 6.46 0.10 0.86 0.00 9.93 0.89 95 R C C 90.71 14.28 14.66 28.80 116.97 -130.08 -86.45 136.57 65.14 34.33 0.52 56.75 5.18 1.44 0.09 0.45 0.00 35.00 1.09 96 T E E 52.17 11.58 20.04 31.94 126.03 -166.30 -120.04 141.52 18.06 81.68 0.26 15.63 1.62 0.37 0.13 0.16 0.00 76.73 5.37 97 F E E 51.89 18.69 16.51 34.34 117.72 -148.95 -100.91 132.30 22.28 77.32 0.41 18.06 3.37 0.94 0.17 0.29 0.00 72.67 4.50 98 G C C 22.15 12.74 18.64 31.37 121.51 -137.72 -80.11 -171.57 65.63 33.94 0.42 42.23 18.63 4.30 0.05 0.43 0.00 33.47 0.89 99 Q C C 120.41 4.76 22.30 27.46 101.70 -59.16 -77.89 10.87 74.10 25.41 0.49 47.95 20.63 4.71 0.05 0.55 0.00 25.38 0.72 100 G C C 16.58 17.77 16.61 33.32 126.13 -123.93 80.33 173.88 69.70 30.10 0.20 58.91 7.42 1.12 0.02 0.20 0.00 31.80 0.53 101 T E E 26.57 17.29 18.78 35.98 126.68 -101.88 -117.06 144.58 17.03 82.94 0.03 15.73 0.73 0.04 0.01 0.01 0.00 83.13 0.34 102 K E E 104.30 8.69 23.58 32.81 119.32 -137.69 -102.34 133.05 1.49 98.50 0.00 1.30 0.09 0.00 0.00 0.00 0.00 98.55 0.05 103 V E E 11.33 23.19 14.45 37.63 121.02 -164.40 -115.75 131.44 0.77 99.23 0.00 0.74 0.02 0.00 0.00 0.00 0.00 99.22 0.02 104 E E E 93.20 5.64 23.79 29.77 118.32 -157.48 -107.17 129.60 1.62 98.38 0.00 1.61 0.04 0.00 0.00 0.00 0.00 98.27 0.07 105 I E E 28.80 20.62 11.11 30.98 115.58 -154.20 -99.95 126.57 16.05 83.92 0.03 16.30 0.19 0.03 0.01 0.01 0.00 82.86 0.59 106 K C C 126.94 4.15 19.97 24.87 115.49 -161.55 -102.54 128.49 99.37 0.63 0.00 99.41 0.05 0.01 0.00 0.00 0.00 0.52 0.01