# 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 105.06 6.83 11.03 19.23 115.83 -159.10 -96.91 133.38 99.95 0.05 0.01 99.90 0.06 0.02 0.00 0.00 0.00 0.02 0.01 1 D C C 101.61 3.33 10.58 15.49 109.26 -146.51 -88.05 111.25 89.11 1.95 8.93 83.39 1.28 5.49 1.34 6.64 0.00 1.13 0.72 2 A C T 77.59 4.31 8.87 14.93 100.85 -147.97 -80.21 -5.68 86.03 1.78 12.18 28.55 18.30 37.88 0.80 12.86 0.00 0.97 0.63 3 K C T 150.17 2.34 11.48 15.03 103.07 68.48 -85.93 5.01 84.67 2.65 12.68 28.98 21.13 33.55 0.72 13.28 0.00 1.52 0.81 4 T C S 71.68 6.79 10.45 18.92 117.17 91.02 -98.01 133.33 97.06 2.66 0.28 39.87 57.16 0.61 0.07 0.17 0.00 1.34 0.78 5 P C C 82.71 4.81 14.62 20.75 113.63 -110.73 -67.58 147.63 95.45 4.45 0.10 82.75 11.84 0.88 0.02 0.10 0.00 3.84 0.57 6 V C C 64.94 13.84 11.90 25.53 118.86 -124.93 -96.48 137.03 69.55 30.34 0.10 61.32 6.46 0.53 0.02 0.10 0.00 30.48 1.09 7 T E E 57.32 9.69 19.55 29.90 125.29 -163.78 -120.89 139.83 21.75 78.21 0.03 19.21 2.13 0.10 0.01 0.03 0.00 77.71 0.82 8 L E E 64.20 12.18 20.23 32.60 116.74 -123.79 -85.38 136.09 9.18 90.81 0.01 8.46 0.48 0.04 0.00 0.01 0.00 90.58 0.42 9 A E E 8.53 21.37 16.29 37.55 130.52 -165.87 -121.29 153.78 6.32 93.67 0.01 5.70 0.48 0.03 0.00 0.00 0.00 93.73 0.05 10 K E E 92.80 6.85 24.97 32.32 118.78 -130.27 -106.49 132.78 2.19 97.81 0.00 1.90 0.10 0.01 0.00 0.00 0.00 97.95 0.04 11 V E E 22.34 21.21 13.13 34.50 109.41 -118.40 -75.58 123.79 0.62 99.38 0.00 0.58 0.01 0.00 0.00 0.00 0.00 99.40 0.01 12 I E E 83.21 5.17 20.10 26.26 100.60 174.67 -97.64 -32.92 1.22 98.78 0.00 0.82 0.19 0.01 0.00 0.00 0.00 98.98 0.00 13 K E E 102.81 3.62 22.29 26.41 137.53 -0.93 -152.04 150.40 0.44 99.55 0.00 0.30 0.05 0.00 0.00 0.00 0.00 99.64 0.00 14 V E E 56.98 17.01 12.75 29.09 116.67 -142.28 -110.44 123.80 0.36 99.64 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.64 0.00 15 L E E 78.45 6.85 17.00 25.07 111.65 -168.00 -98.13 124.37 1.56 98.44 0.01 1.26 0.14 0.02 0.00 0.00 0.00 98.57 0.01 16 G E E 34.09 6.53 15.97 23.81 136.95 -32.10 164.63 175.28 4.43 95.56 0.01 3.19 0.90 0.08 0.00 0.00 0.00 95.78 0.04 17 R E E 135.40 5.96 12.94 20.92 124.38 -94.85 -116.46 144.25 8.07 91.90 0.03 7.27 0.53 0.05 0.01 0.02 0.00 91.46 0.66 18 T E E 88.11 4.84 10.73 17.54 118.60 -144.33 -105.80 140.68 33.38 66.33 0.28 27.97 4.71 0.64 0.09 0.22 0.00 64.01 2.36 19 G C S 45.03 2.53 11.17 15.09 127.29 32.72 114.70 -173.82 81.23 7.57 11.20 20.92 31.84 29.15 0.98 10.14 0.01 5.74 1.21 20 S C T 103.26 0.66 10.11 10.54 95.09 -70.82 -69.31 -21.24 83.54 0.80 15.66 3.75 21.88 56.84 0.82 15.85 0.00 0.45 0.41 21 R C T 184.68 0.99 10.30 11.51 99.94 52.13 -90.00 9.76 82.37 0.78 16.84 2.90 14.10 63.78 0.86 17.51 0.00 0.45 0.41 22 G C T 44.89 4.24 11.45 17.06 106.64 -83.86 86.55 4.12 86.13 2.34 11.53 15.51 25.53 44.73 0.95 11.12 0.00 1.44 0.72 23 G C C 39.29 5.07 13.54 19.89 108.85 110.91 77.50 4.24 82.37 16.37 1.25 50.96 15.19 15.90 0.20 1.17 0.00 15.25 1.33 24 V E E 57.55 10.17 13.06 24.53 122.47 54.69 -110.85 140.91 32.42 67.51 0.07 29.55 1.89 0.15 0.02 0.04 0.00 67.54 0.80 25 T E E 38.25 11.40 16.37 29.30 121.91 -154.68 -111.42 138.74 4.94 95.04 0.02 4.55 0.17 0.02 0.01 0.00 0.00 95.15 0.10 26 Q E E 63.42 11.01 19.05 30.92 120.74 -144.68 -105.61 137.37 1.32 98.68 0.01 1.13 0.06 0.01 0.00 0.00 0.00 98.78 0.02 27 V E E 14.43 18.26 16.17 35.22 125.55 -166.06 -120.46 139.45 1.22 98.78 0.00 1.09 0.03 0.00 0.00 0.00 0.00 98.86 0.01 28 R E E 81.74 8.98 22.83 32.59 118.17 -144.22 -103.30 130.96 0.67 99.32 0.00 0.59 0.02 0.00 0.00 0.00 0.00 99.38 0.01 29 V E E 12.35 20.58 15.90 36.82 122.43 -168.32 -115.93 134.72 1.26 98.74 0.00 1.11 0.04 0.00 0.00 0.00 0.00 98.83 0.02 30 E E E 66.06 8.14 22.24 31.26 120.77 -161.54 -113.30 132.38 1.78 98.21 0.01 1.57 0.07 0.01 0.00 0.00 0.00 98.31 0.04 31 F E E 44.90 14.90 13.85 29.68 115.25 -140.48 -95.15 128.18 8.99 90.89 0.12 7.56 1.02 0.18 0.03 0.06 0.00 90.88 0.27 32 L E E 67.57 7.88 13.76 23.35 116.67 -154.11 -96.11 133.42 44.70 54.29 1.01 30.92 10.55 3.69 0.17 0.81 0.00 53.21 0.66 33 E C S 139.83 3.01 13.06 17.10 100.16 -141.90 -80.86 -17.73 71.07 27.61 1.31 16.90 33.73 20.23 0.12 1.29 0.00 26.79 0.94 34 D C C 82.21 3.60 11.56 16.61 116.43 75.47 -113.22 120.80 84.92 13.64 1.44 41.90 25.93 17.52 0.17 1.53 0.00 11.81 1.13 35 A C T 83.17 3.94 9.44 15.36 95.12 -149.13 -68.84 -17.36 94.98 2.63 2.39 13.30 31.90 49.79 0.21 2.36 0.00 1.96 0.48 36 S C T 94.19 0.90 12.50 12.79 97.09 56.35 -87.37 -10.54 90.91 7.43 1.67 12.65 33.15 45.12 0.11 1.71 0.00 6.69 0.56 37 R C E 117.88 5.49 11.92 19.15 122.03 53.61 -121.65 136.50 53.73 45.32 0.95 38.79 11.53 3.20 0.14 0.89 0.00 44.52 0.93 38 T E E 63.13 10.51 11.76 23.38 126.67 -175.61 -123.17 141.77 20.32 79.58 0.11 18.13 1.49 0.19 0.03 0.06 0.00 79.72 0.39 39 I E E 58.27 9.72 15.82 27.36 120.67 -159.72 -116.45 130.97 3.06 96.88 0.06 2.70 0.25 0.04 0.02 0.02 0.00 96.82 0.14 40 V E E 72.62 10.39 16.49 27.86 120.17 -159.92 -111.03 129.02 2.15 97.80 0.04 2.00 0.09 0.02 0.01 0.01 0.00 97.76 0.11 41 R E E 90.91 10.01 17.24 28.18 130.16 175.29 -133.75 147.50 9.88 90.03 0.09 8.73 0.75 0.11 0.02 0.03 0.00 90.25 0.10 42 N E E 88.81 6.11 20.18 26.82 112.04 -117.94 -81.57 127.16 15.88 84.00 0.13 13.15 2.27 0.20 0.03 0.06 0.00 84.00 0.28 43 V E E 21.92 20.60 10.60 30.42 118.14 -160.17 -103.69 131.39 16.22 83.67 0.10 15.44 0.63 0.08 0.06 0.04 0.00 77.11 6.64 44 K C E 145.12 2.55 19.67 22.43 103.39 -165.56 -98.13 10.43 61.94 37.97 0.09 34.19 27.90 0.91 0.01 0.09 0.00 35.56 1.32 45 G C S 31.18 4.03 21.11 25.21 138.49 -2.78 151.66 -177.12 86.99 12.99 0.02 4.60 80.57 1.04 0.00 0.02 0.00 13.57 0.20 46 P C C 78.44 5.67 20.13 26.42 114.64 -39.12 -67.41 143.45 86.36 13.62 0.03 78.92 6.45 0.29 0.00 0.03 0.00 13.66 0.64 47 V C C 15.43 23.36 10.60 33.29 121.21 -150.82 -108.31 135.65 58.34 41.61 0.05 61.10 0.84 0.05 0.03 0.02 0.00 17.90 20.05 48 R C C 120.37 3.88 23.49 27.46 129.93 -168.96 -122.52 158.64 73.59 26.35 0.06 75.27 1.22 0.09 0.02 0.03 0.00 12.16 11.21 49 E C T 111.15 8.43 15.20 24.65 109.60 -80.24 -59.56 135.49 97.60 2.09 0.31 0.36 3.05 94.79 0.02 0.21 0.00 1.38 0.18 50 N C T 113.28 3.11 19.51 23.18 93.74 19.01 78.47 -0.50 98.83 0.94 0.23 0.68 3.78 94.40 0.01 0.20 0.00 0.90 0.03 51 D C C 36.86 13.93 14.21 29.10 118.87 131.28 -75.99 148.91 89.12 10.66 0.22 84.03 4.43 0.22 0.03 0.20 0.00 10.70 0.38 52 I E E 68.54 9.83 22.08 32.56 118.59 -134.94 -105.90 130.94 5.56 94.32 0.12 5.45 0.20 0.04 0.09 0.04 0.00 91.35 2.84 53 L E E 11.84 22.82 17.13 39.85 124.69 -167.65 -114.87 139.50 3.04 96.70 0.27 2.79 0.22 0.08 0.20 0.07 0.00 96.30 0.35 54 C E E 41.88 10.85 24.13 35.30 123.00 -161.28 -115.71 134.84 8.47 90.74 0.79 7.81 0.56 0.25 0.52 0.25 0.00 90.16 0.44 55 L E E 26.26 19.81 16.01 35.46 113.17 -134.81 -86.24 127.70 37.98 58.43 3.58 33.12 3.26 0.91 2.47 1.07 0.00 58.08 1.08 56 M C C 81.47 8.50 19.22 28.22 107.92 -148.82 -83.12 114.44 60.93 18.49 20.59 46.76 8.57 4.52 15.89 4.90 0.02 17.80 1.54 57 E C C 99.42 6.67 17.70 24.94 101.91 -71.29 -74.72 -18.37 60.28 7.07 32.65 39.17 12.74 8.13 27.70 5.62 0.03 5.46 1.16 58 S C H 40.85 8.84 14.69 24.85 101.06 93.15 -77.70 -30.09 52.17 2.75 45.07 39.89 6.61 6.09 40.00 4.93 0.01 1.78 0.71 59 E H H 91.71 7.01 14.81 23.00 94.17 64.76 -65.97 -38.63 11.81 0.36 87.83 7.30 2.23 3.42 83.39 3.34 0.02 0.21 0.09 60 R H H 129.81 2.52 16.31 18.96 92.81 51.79 -65.86 -40.48 6.68 0.21 93.10 3.30 1.11 2.69 89.30 3.39 0.02 0.15 0.05 61 E H H 87.10 3.65 14.79 19.62 92.40 50.39 -66.01 -39.75 6.17 0.22 93.61 2.85 0.91 2.66 89.28 4.06 0.01 0.17 0.05 62 A H H 35.70 6.68 11.13 20.14 91.84 52.72 -64.68 -39.58 7.08 0.16 92.76 2.96 1.01 3.21 87.10 5.55 0.01 0.11 0.05 63 R H H 141.78 2.35 12.78 16.09 91.99 52.68 -65.17 -38.16 14.10 0.18 85.73 3.76 1.54 8.18 76.94 9.37 0.02 0.11 0.07 64 R H H 162.91 1.35 11.73 13.44 92.54 53.44 -67.71 -31.98 28.68 0.25 71.06 5.11 2.44 20.18 63.65 8.32 0.03 0.13 0.13 65 L H H 109.14 3.02 9.37 13.93 95.36 53.97 -77.54 -15.82 48.95 0.52 50.53 21.27 1.82 24.96 46.92 4.46 0.00 0.23 0.33 66 R C C 163.93 3.10 11.74 16.48 101.45 85.84 -70.60 45.71 99.84 0.06 0.10 99.55 0.13 0.20 0.08 0.00 0.00 0.03 0.01