# 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 G C C 34.91 9.08 15.33 25.09 120.15 -137.67 -80.67 164.45 99.88 0.11 0.01 99.72 0.13 0.07 0.00 0.00 0.00 0.07 0.01 1 K C C 113.83 7.66 14.83 23.50 120.08 -136.92 -108.20 138.80 81.34 18.16 0.50 75.23 4.33 1.62 0.14 0.34 0.00 15.23 3.11 2 Q E B 102.75 5.35 16.58 23.28 121.60 -147.07 -108.94 137.95 32.17 67.16 0.67 25.72 3.67 0.41 0.50 0.22 0.00 24.27 45.21 3 C C C 20.81 17.14 9.88 27.26 110.88 -115.04 -75.49 128.50 76.27 23.50 0.23 75.18 1.61 0.38 0.10 0.11 0.00 15.73 6.90 4 F C T 123.27 5.22 17.27 23.76 93.89 -141.67 -70.62 -25.78 97.73 1.78 0.50 1.63 7.53 88.77 0.07 0.36 0.00 1.32 0.33 5 V C T 69.95 9.19 15.12 25.00 99.86 44.88 -85.66 -38.55 99.34 0.40 0.27 0.28 3.56 95.68 0.02 0.15 0.00 0.23 0.09 6 T C T 63.85 6.91 14.44 22.59 101.52 20.72 -104.21 -14.29 99.28 0.36 0.36 0.72 4.31 94.39 0.04 0.23 0.00 0.22 0.09 7 G C C 47.17 3.68 15.38 20.18 96.93 -118.73 81.10 5.39 95.69 3.98 0.33 73.95 15.06 6.60 0.10 0.26 0.00 2.69 1.35 8 R C C 111.32 7.36 12.00 21.20 119.02 142.36 -81.04 145.13 82.18 17.41 0.41 73.57 7.37 0.90 0.15 0.30 0.00 11.78 5.93 9 K E C 132.97 3.58 15.39 20.71 122.70 -145.33 -112.36 143.68 47.32 52.14 0.53 39.81 5.61 0.73 0.27 0.36 0.00 38.91 14.30 10 A C C 56.03 11.33 10.99 22.81 119.50 -114.03 -83.74 145.93 52.99 46.75 0.26 48.11 3.34 0.49 0.06 0.18 0.00 46.80 1.02 11 S E E 60.85 5.83 14.72 22.36 128.52 -165.61 -128.35 150.88 18.96 80.79 0.25 16.51 2.22 0.38 0.10 0.15 0.00 78.24 2.39 12 T E E 91.22 5.43 12.46 20.14 124.35 -149.25 -118.36 142.90 15.97 83.80 0.22 14.36 1.37 0.27 0.10 0.12 0.00 82.25 1.54 13 G E E 34.51 6.54 11.91 20.11 132.85 166.82 -145.16 172.07 26.19 73.32 0.48 21.28 4.56 0.87 0.16 0.30 0.00 71.74 1.08 14 N E E 106.07 3.98 11.70 17.56 120.30 -99.61 -107.17 139.74 32.38 66.81 0.81 26.20 5.26 1.17 0.28 0.48 0.00 65.40 1.20 15 R E E 140.89 5.00 10.25 17.28 118.47 -159.41 -109.97 136.62 39.46 58.77 1.77 31.63 6.46 1.95 0.72 0.97 0.01 56.40 1.86 16 R C E 162.18 2.52 9.62 14.01 117.21 -146.73 -101.37 131.95 48.63 48.49 2.89 38.55 7.64 2.50 1.48 1.47 0.01 45.51 2.83 17 S C C 62.62 4.58 7.04 13.48 122.34 -160.51 -104.98 157.01 65.95 30.70 3.34 54.19 7.24 3.52 1.39 1.87 0.00 29.31 2.47 18 H C C 171.60 0.67 8.33 9.05 98.75 -116.11 -76.20 -15.97 77.28 10.55 12.17 31.36 19.93 27.41 2.87 8.41 0.02 8.37 1.63 19 A C T 90.11 1.04 7.86 9.43 108.57 58.69 -93.76 76.83 86.44 2.50 11.06 30.25 20.58 36.06 2.28 8.42 0.00 1.69 0.72 20 L C C 132.19 1.88 7.85 11.17 107.73 -96.46 -78.20 101.08 82.32 6.30 11.38 34.39 23.44 25.54 2.05 8.75 0.01 4.37 1.45 21 N C C 109.16 2.29 8.73 12.69 116.85 138.23 -98.20 135.54 73.78 22.55 3.68 45.83 13.38 14.87 0.85 2.79 0.00 19.93 2.35 22 S C C 77.69 4.24 8.38 14.52 117.89 -143.86 -97.65 138.64 55.92 41.65 2.43 43.24 8.52 3.95 0.79 1.76 0.01 38.09 3.64 23 T C E 82.43 3.63 10.69 16.13 121.60 -166.11 -113.69 142.75 49.88 49.07 1.05 38.42 8.78 2.45 0.30 0.77 0.00 47.57 1.72 24 K E E 139.37 3.93 10.35 16.50 117.08 -131.42 -95.05 134.19 43.13 56.48 0.39 36.17 4.90 0.87 0.10 0.26 0.00 56.94 0.75 25 R E E 115.86 6.75 11.39 20.00 124.93 -173.31 -120.72 142.79 25.78 74.06 0.16 23.45 1.65 0.23 0.05 0.08 0.00 73.83 0.71 26 R E E 147.36 4.52 13.33 19.98 119.88 -146.80 -108.55 133.27 9.41 90.52 0.07 8.77 0.59 0.09 0.03 0.03 0.00 88.97 1.51 27 W E E 92.62 11.19 11.45 23.76 123.63 -168.32 -116.17 141.36 14.76 85.05 0.19 13.23 1.20 0.21 0.09 0.10 0.00 81.82 3.36 28 N C C 101.44 4.34 16.73 22.19 115.95 -142.14 -97.65 135.15 63.35 35.86 0.79 52.43 8.67 1.44 0.15 0.67 0.00 35.65 0.99 29 A C S 42.06 11.64 13.74 25.90 113.99 -111.91 -78.22 150.95 71.42 24.98 3.61 25.64 26.98 19.37 0.17 4.02 0.00 23.03 0.79 30 N C E 73.16 8.20 17.54 26.52 100.17 1.74 -67.28 46.40 63.35 32.46 4.18 28.14 17.27 17.97 0.17 4.49 0.00 31.30 0.65 31 L E E 54.05 13.96 13.35 27.78 119.29 145.83 -94.99 135.09 25.53 74.29 0.17 22.66 2.11 0.24 0.02 0.13 0.00 74.43 0.39 32 Q E E 68.51 9.06 17.21 27.58 126.23 -169.83 -121.01 142.97 2.63 97.36 0.01 2.30 0.14 0.01 0.00 0.00 0.00 97.49 0.05 33 K E E 115.51 6.96 16.91 25.22 115.40 -124.24 -89.24 130.68 0.67 99.33 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.40 0.01 34 V E E 29.56 13.68 12.92 27.97 130.10 -176.25 -131.23 148.90 0.55 99.45 0.00 0.52 0.01 0.00 0.00 0.00 0.00 99.47 0.01 35 R E E 132.18 4.87 17.66 23.76 115.66 -129.78 -96.86 128.79 0.65 99.35 0.00 0.60 0.01 0.00 0.00 0.00 0.00 99.38 0.01 36 I E E 29.92 14.74 11.10 26.78 128.24 -174.95 -123.75 149.36 0.96 99.04 0.00 0.82 0.03 0.00 0.00 0.00 0.00 99.13 0.01 37 L E E 94.37 3.88 14.73 20.03 113.62 -128.91 -95.48 124.17 3.88 96.11 0.01 3.31 0.21 0.02 0.00 0.00 0.00 96.42 0.04 38 V E E 53.69 10.76 8.20 19.90 118.20 176.44 -127.41 118.59 7.30 92.61 0.09 4.58 1.97 0.57 0.02 0.08 0.00 92.06 0.73 39 D C T 129.44 1.00 11.60 12.67 93.38 -14.63 52.07 41.98 99.39 0.42 0.20 0.44 4.43 94.62 0.00 0.18 0.00 0.30 0.03 40 G C T 66.64 0.61 11.02 11.07 94.44 -51.57 79.15 2.99 99.74 0.11 0.16 0.40 5.32 94.04 0.00 0.15 0.00 0.07 0.01 41 K E E 132.08 1.77 12.15 15.11 123.55 102.91 -114.65 139.41 8.83 91.16 0.01 3.60 5.78 0.22 0.00 0.01 0.00 89.45 0.94 42 P E E 88.81 5.52 10.57 18.12 113.75 -111.49 -68.30 138.16 8.36 91.64 0.00 7.27 0.30 0.01 0.00 0.00 0.00 92.35 0.05 43 K E E 87.60 7.65 13.59 22.96 127.49 -173.26 -126.23 145.41 4.09 95.90 0.01 3.53 0.19 0.02 0.00 0.00 0.00 96.23 0.03 44 K E E 121.31 6.58 15.88 24.27 117.88 -132.13 -99.73 133.13 1.22 98.78 0.00 1.06 0.04 0.00 0.00 0.00 0.00 98.89 0.02 45 V E E 23.76 16.19 15.14 32.15 129.77 -175.57 -130.14 147.49 0.61 99.39 0.00 0.51 0.01 0.00 0.00 0.00 0.00 99.47 0.00 46 W E E 99.46 10.17 22.44 33.10 117.24 -131.69 -95.64 131.63 0.41 99.59 0.00 0.33 0.01 0.00 0.00 0.00 0.00 99.65 0.00 47 V E E 9.78 21.22 17.59 38.91 130.19 -175.30 -129.09 146.49 1.33 98.67 0.00 1.25 0.02 0.00 0.00 0.00 0.00 98.68 0.05 48 S E E 17.49 12.56 20.10 33.99 117.25 -110.42 -71.95 151.80 24.49 75.48 0.03 24.26 0.39 0.02 0.01 0.01 0.00 74.84 0.47 49 A H H 42.37 10.33 18.43 29.96 92.43 -118.08 -59.78 -36.96 4.60 0.05 95.35 0.87 0.68 2.94 91.79 3.65 0.01 0.03 0.01 50 R H H 131.63 2.91 22.55 24.97 91.75 54.93 -64.00 -39.73 2.44 0.06 97.50 0.38 0.23 1.68 93.85 3.78 0.01 0.05 0.01 51 A H H 12.69 14.99 15.36 31.62 91.77 50.96 -65.13 -41.01 1.87 0.11 98.01 0.47 0.23 1.13 93.66 4.39 0.01 0.10 0.01 52 L H H 38.16 16.85 13.82 30.35 92.25 50.61 -64.60 -40.63 4.04 0.20 95.76 0.96 0.49 2.56 92.73 3.02 0.02 0.18 0.03 53 K H H 144.77 2.39 17.51 20.35 91.43 52.05 -67.24 -32.57 19.33 0.29 80.38 1.83 1.58 15.78 78.37 2.07 0.08 0.19 0.11 54 S C H 70.54 2.74 15.67 18.70 93.29 50.59 -84.96 -9.65 54.81 0.35 44.84 3.09 5.07 44.27 45.38 1.81 0.04 0.15 0.19 55 G C T 43.85 7.72 12.73 21.75 94.99 -115.33 78.77 10.24 93.81 2.09 4.10 18.14 20.28 55.99 2.35 1.36 0.00 1.42 0.47 56 K C C 120.30 4.19 16.16 21.60 107.54 120.74 -93.43 81.40 83.36 14.08 2.57 62.15 12.76 8.16 1.07 1.54 0.00 11.53 2.78 57 V C C 48.08 16.69 9.56 25.20 119.29 116.58 -106.24 130.53 82.25 16.72 1.03 78.14 2.36 1.49 0.57 0.40 0.00 13.38 3.66 58 T C C 89.93 3.91 18.53 23.35 116.98 -165.83 -106.89 132.55 99.60 0.40 0.01 99.65 0.06 0.01 0.00 0.00 0.00 0.26 0.02