# 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 A C C 55.32 8.81 17.69 26.97 115.82 -121.48 -78.40 147.72 99.88 0.11 0.01 99.76 0.10 0.06 0.00 0.00 0.00 0.06 0.01 1 A C C 40.32 13.19 14.79 28.34 116.59 -150.59 -101.86 135.98 88.91 10.88 0.21 84.29 3.64 0.91 0.05 0.13 0.00 9.25 1.72 2 V E B 76.76 6.72 19.61 27.29 122.43 -148.68 -114.59 137.17 20.94 78.91 0.15 16.97 1.97 0.08 0.12 0.03 0.00 10.79 70.04 3 C C C 13.03 20.10 10.40 30.71 110.91 -115.22 -73.40 131.31 92.65 7.31 0.04 93.42 0.62 0.07 0.01 0.01 0.00 3.84 2.02 4 D C T 98.75 3.96 19.40 24.42 93.38 -145.18 -70.89 -25.38 99.58 0.29 0.14 0.80 7.44 91.38 0.01 0.10 0.00 0.19 0.08 5 I C T 75.27 10.23 16.43 27.12 101.40 41.23 -89.16 -41.43 99.81 0.10 0.09 0.11 2.75 97.01 0.00 0.05 0.00 0.04 0.04 6 C C T 52.58 9.30 15.29 25.66 101.20 18.94 -105.72 -13.05 99.80 0.09 0.11 0.31 4.18 95.36 0.01 0.07 0.00 0.05 0.02 7 G C C 42.78 4.92 17.08 23.14 96.53 -118.17 80.55 6.18 98.16 1.75 0.10 79.25 16.53 2.29 0.03 0.07 0.00 0.88 0.95 8 K C C 96.97 7.46 14.96 24.05 120.50 133.72 -85.44 145.48 76.07 23.80 0.13 67.65 6.78 0.21 0.07 0.06 0.00 6.38 18.85 9 G C C 29.10 8.20 17.28 26.36 135.51 -132.36 -133.58 172.05 72.24 27.66 0.10 62.41 9.99 0.31 0.04 0.08 0.00 19.39 7.78 10 P C C 72.52 9.94 15.02 25.59 114.73 -83.96 -70.43 147.77 78.17 21.74 0.09 65.75 10.41 0.73 0.01 0.10 0.00 21.99 1.00 11 G E E 31.40 7.83 16.15 25.18 136.45 169.00 -151.43 171.73 24.35 75.50 0.14 20.28 3.62 0.50 0.05 0.12 0.00 73.06 2.38 12 F E E 128.74 6.48 14.16 22.54 125.40 -120.19 -119.54 144.28 11.17 88.74 0.09 9.91 1.03 0.13 0.04 0.05 0.00 87.38 1.46 13 G E E 31.15 7.61 12.46 21.70 135.53 170.43 -143.35 172.80 14.82 85.05 0.14 11.71 2.83 0.35 0.03 0.09 0.00 84.51 0.47 14 K E E 134.89 3.76 13.36 18.99 121.50 -109.79 -114.75 141.09 14.42 85.37 0.21 11.97 2.02 0.35 0.06 0.12 0.00 84.95 0.52 15 S E E 57.98 7.38 10.15 19.17 123.15 -158.87 -114.72 143.56 16.56 83.04 0.39 14.16 1.94 0.46 0.13 0.21 0.00 82.47 0.64 16 V E E 95.10 3.56 10.05 15.58 118.10 -146.17 -109.32 130.07 20.95 78.38 0.66 17.69 2.66 0.68 0.34 0.38 0.00 75.97 2.28 17 S C E 53.12 4.99 7.93 14.90 123.05 -159.97 -98.78 163.67 50.45 48.42 1.13 43.31 4.48 1.62 0.29 0.73 0.00 48.54 1.03 18 H C T 169.68 0.82 8.82 9.94 95.20 -97.31 -69.49 -19.29 78.34 16.17 5.48 27.11 15.73 35.56 0.67 4.76 0.00 15.20 0.97 19 S C T 87.18 1.02 8.86 10.10 99.23 54.06 -90.88 6.64 94.25 1.51 4.24 29.09 16.80 48.07 0.50 4.10 0.00 1.12 0.32 20 H C C 154.49 2.03 8.69 12.36 96.53 -107.17 65.03 26.86 88.59 7.60 3.81 37.30 25.42 26.11 0.43 3.67 0.00 6.20 0.87 21 R C C 148.10 1.88 9.38 12.85 118.39 142.68 -95.02 138.85 57.08 42.29 0.64 46.13 6.44 2.74 0.14 0.52 0.00 42.67 1.36 22 R E E 159.46 3.70 8.94 14.99 116.49 -131.62 -92.34 133.27 23.84 75.91 0.25 20.96 2.19 0.49 0.10 0.17 0.00 73.69 2.39 23 T E E 66.00 4.99 10.80 17.86 126.28 -177.08 -125.03 149.42 21.03 78.87 0.10 18.49 1.85 0.23 0.03 0.06 0.00 78.56 0.79 24 S E E 82.26 3.19 11.58 16.68 114.95 -121.32 -87.16 134.97 24.25 75.69 0.06 20.71 2.28 0.21 0.01 0.04 0.00 76.41 0.34 25 R E E 109.86 7.35 11.36 20.56 126.98 -176.41 -126.51 144.91 21.70 78.26 0.03 19.42 1.52 0.10 0.01 0.02 0.00 78.60 0.32 26 R E E 144.71 4.63 13.78 20.44 118.22 -140.08 -104.93 132.83 10.13 89.85 0.02 9.30 0.68 0.08 0.01 0.01 0.00 89.06 0.86 27 W E E 82.23 12.40 11.59 24.92 124.47 -169.37 -118.58 142.95 13.41 86.55 0.03 12.17 0.80 0.06 0.02 0.02 0.00 79.92 7.02 28 N C C 93.87 4.99 18.17 24.22 112.08 -147.79 -107.69 112.40 74.21 25.76 0.03 69.97 3.07 0.12 0.00 0.02 0.00 26.34 0.46 29 P C C 43.24 15.01 13.49 28.46 111.75 -142.31 -73.35 148.07 82.39 17.22 0.39 38.55 27.62 15.26 0.02 0.56 0.00 17.62 0.37 30 N C E 68.96 7.65 18.30 26.89 104.44 -121.68 -85.86 57.30 62.94 36.68 0.38 31.52 17.49 12.76 0.02 0.56 0.00 37.10 0.55 31 I E E 55.03 14.72 13.49 28.52 118.43 127.93 -104.52 130.35 16.78 83.19 0.02 15.61 0.88 0.05 0.00 0.01 0.00 81.94 1.50 32 Q E E 70.67 8.39 17.61 27.35 124.96 -172.85 -121.93 140.32 8.04 91.96 0.00 7.41 0.22 0.01 0.00 0.00 0.00 92.26 0.10 33 P E E 74.67 7.89 17.03 25.96 115.70 -122.68 -80.56 136.89 3.12 96.88 0.00 2.81 0.10 0.00 0.00 0.00 0.00 97.05 0.04 34 V E E 32.60 13.60 13.15 28.07 129.32 -175.35 -131.64 146.41 2.93 97.06 0.00 2.61 0.15 0.00 0.00 0.00 0.00 97.17 0.06 35 R E E 137.18 4.74 17.80 23.76 116.98 -131.72 -97.75 130.51 1.70 98.29 0.00 1.50 0.09 0.00 0.00 0.00 0.00 98.33 0.07 36 A E E 22.64 14.08 11.88 26.95 129.40 -173.47 -128.32 150.85 2.96 97.03 0.00 2.71 0.12 0.01 0.00 0.00 0.00 97.09 0.07 37 V E E 76.80 4.92 15.48 21.94 114.63 -121.13 -93.59 127.34 6.02 93.96 0.02 5.40 0.42 0.03 0.00 0.01 0.00 93.60 0.53 38 T C E 58.26 9.25 9.92 20.45 111.32 -154.37 -86.46 128.65 51.11 48.83 0.06 46.47 3.24 0.19 0.01 0.05 0.00 49.02 1.02 39 R C T 155.41 2.25 11.86 15.10 122.81 -38.23 -116.35 148.30 94.99 3.63 1.37 11.62 25.74 57.82 0.09 1.47 0.00 2.65 0.62 40 P C T 118.77 1.26 9.87 12.00 107.85 -63.18 -63.80 127.72 98.79 0.18 1.03 0.50 4.58 93.65 0.02 1.10 0.00 0.10 0.04 41 G C T 66.04 0.52 11.27 10.60 97.65 11.54 83.95 -1.43 98.97 0.16 0.87 0.83 4.50 93.49 0.02 1.03 0.00 0.10 0.03 42 G C C 41.20 5.06 8.22 15.06 118.01 115.67 -84.59 163.86 97.62 1.74 0.64 62.18 20.56 14.72 0.08 0.78 0.00 1.15 0.53 43 N C C 112.85 1.50 13.37 15.01 117.63 -108.40 -88.37 146.19 88.61 11.32 0.06 81.73 6.16 0.28 0.01 0.06 0.00 11.13 0.63 44 K E E 124.68 6.97 10.53 19.37 116.00 -112.48 -80.16 138.97 8.88 91.10 0.02 8.46 0.39 0.04 0.00 0.01 0.00 90.43 0.67 45 Q E E 83.32 7.08 13.81 22.62 126.11 -168.00 -124.36 144.93 1.57 98.42 0.01 1.39 0.08 0.01 0.00 0.00 0.00 98.50 0.01 46 R E E 141.83 6.30 14.95 23.29 119.22 -135.80 -102.71 132.74 0.53 99.47 0.00 0.47 0.02 0.00 0.00 0.00 0.00 99.50 0.01 47 I E E 36.51 14.67 14.77 30.39 129.62 -175.77 -130.24 147.48 1.41 98.59 0.00 1.27 0.03 0.00 0.00 0.00 0.00 98.69 0.01 48 N E E 70.93 9.01 22.34 31.83 115.92 -131.60 -94.00 132.52 2.52 97.48 0.00 1.94 0.30 0.01 0.00 0.00 0.00 97.72 0.02 49 A E E 8.11 21.13 17.02 38.04 133.99 164.01 -132.52 155.05 6.72 93.26 0.02 6.37 0.29 0.01 0.01 0.00 0.00 92.91 0.41 50 C E E 20.33 13.19 19.31 33.81 116.71 -106.58 -71.40 150.99 45.05 54.89 0.05 45.58 0.51 0.02 0.05 0.01 0.00 52.95 0.87 51 T H H 61.02 9.00 19.28 29.40 92.23 -118.50 -59.97 -36.51 3.87 0.02 96.10 0.45 0.57 2.77 94.18 1.99 0.01 0.01 0.00 52 S H H 59.93 3.44 22.34 25.48 91.59 55.32 -64.11 -39.08 1.75 0.02 98.23 0.17 0.16 1.36 95.92 2.37 0.01 0.01 0.00 53 C H H 13.29 16.16 15.34 32.48 91.96 50.43 -65.16 -41.64 1.01 0.03 98.96 0.16 0.10 0.72 96.34 2.65 0.00 0.03 0.00 54 I H H 40.01 16.66 14.16 30.49 91.91 50.59 -64.18 -41.82 1.81 0.05 98.13 0.30 0.16 1.31 96.51 1.66 0.01 0.04 0.01 55 K H H 149.46 1.92 18.07 20.01 90.65 52.01 -66.31 -31.12 12.43 0.10 87.46 0.69 0.68 11.02 86.38 1.08 0.06 0.05 0.04 56 A C T 65.47 3.93 15.17 20.07 92.38 54.74 -81.66 -9.93 57.15 0.16 42.70 1.30 2.74 50.70 43.97 1.10 0.02 0.06 0.10 57 G C T 47.76 5.48 14.92 21.88 95.32 -112.58 80.56 10.39 97.20 0.76 2.04 8.60 14.41 74.41 1.38 0.52 0.00 0.51 0.17 58 K C C 111.09 5.93 17.54 24.44 102.66 120.85 -97.43 24.10 84.35 14.36 1.29 67.28 11.75 4.70 0.50 0.81 0.00 13.97 1.00 59 V C C 37.51 18.90 10.51 28.38 123.45 104.94 -111.86 136.59 60.69 38.46 0.85 50.97 7.11 1.41 0.43 0.47 0.00 36.59 3.02 60 S E E 64.18 4.83 18.37 24.45 126.86 -172.32 -120.22 149.56 41.54 57.68 0.78 36.68 2.89 0.83 0.50 0.38 0.00 54.33 4.38 61 R C C 147.20 7.09 12.46 21.38 115.04 -123.22 -88.95 135.14 57.53 42.01 0.45 54.38 1.42 0.61 0.22 0.20 0.00 40.35 2.82 62 A C C 68.41 6.52 13.30 20.97 110.90 -120.89 -77.17 136.51 99.87 0.12 0.00 99.83 0.06 0.02 0.00 0.00 0.00 0.08 0.01