# 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 91.34 9.06 12.82 22.82 118.97 -161.05 -97.09 138.24 99.95 0.05 0.00 99.91 0.05 0.01 0.00 0.00 0.00 0.02 0.01 1 A C C 68.17 5.40 11.62 18.62 112.50 -124.07 -80.36 140.25 80.85 2.60 16.56 76.17 1.38 5.59 4.85 9.39 0.00 1.58 1.04 2 E C C 125.91 5.04 10.69 17.39 107.91 -141.18 -85.67 98.04 70.77 3.52 25.71 41.09 14.45 15.74 5.52 19.87 0.01 2.02 1.31 3 D C C 100.80 4.48 12.08 18.11 102.48 61.03 -85.58 6.81 69.19 3.14 27.66 39.10 15.40 15.12 5.32 22.13 0.00 1.83 1.08 4 E C C 119.35 5.30 14.16 20.71 102.74 77.82 -86.91 13.54 77.30 3.54 19.16 40.30 18.40 19.50 4.41 14.10 0.01 2.05 1.23 5 G C C 29.15 10.80 15.09 26.35 122.63 -119.47 108.31 171.64 85.49 8.98 5.53 49.74 20.34 15.53 0.87 4.67 0.00 7.80 1.06 6 Y C C 77.30 12.39 18.69 31.62 122.74 -94.97 -114.36 135.81 57.71 42.15 0.14 40.76 17.11 0.44 0.04 0.11 0.00 38.84 2.69 7 P C E 46.11 11.49 22.47 34.27 114.86 -113.59 -69.88 145.40 50.36 49.61 0.03 47.46 2.12 0.14 0.01 0.03 0.00 49.47 0.78 8 A E E 5.94 24.35 15.92 40.25 130.89 -159.40 -125.00 153.44 15.17 84.82 0.01 14.11 0.63 0.03 0.00 0.01 0.00 84.87 0.34 9 E E E 78.55 7.59 26.16 34.47 121.73 -142.05 -113.24 134.67 3.55 96.44 0.00 3.28 0.14 0.01 0.00 0.00 0.00 96.43 0.13 10 V E E 26.15 20.84 14.61 35.64 109.46 -119.40 -75.79 123.21 0.75 99.25 0.00 0.71 0.01 0.00 0.00 0.00 0.00 99.25 0.02 11 I E E 75.93 6.48 20.25 27.91 100.68 174.62 -97.54 -33.03 1.23 98.77 0.00 0.84 0.19 0.01 0.00 0.00 0.00 98.96 0.00 12 E E E 92.42 4.21 22.46 27.24 137.54 -2.04 -151.60 149.58 0.34 99.65 0.00 0.25 0.03 0.00 0.00 0.00 0.00 99.72 0.00 13 I E E 66.79 16.29 12.81 28.66 114.21 -134.48 -101.19 120.50 0.25 99.75 0.00 0.24 0.00 0.00 0.00 0.00 0.00 99.75 0.00 14 I E E 84.49 6.13 17.31 24.66 102.99 -172.22 -99.50 -19.26 1.10 98.90 0.01 0.89 0.09 0.01 0.00 0.00 0.00 99.00 0.01 15 G E E 31.07 5.69 17.45 24.48 140.63 -33.04 162.47 174.15 3.39 96.61 0.01 2.46 0.62 0.05 0.00 0.00 0.00 96.84 0.03 16 R E E 135.51 6.49 13.03 21.55 125.70 -95.00 -121.98 145.22 9.59 90.38 0.03 8.74 0.61 0.06 0.01 0.02 0.00 89.89 0.67 17 T E E 76.78 6.24 10.37 18.46 121.03 -152.79 -114.48 146.07 42.23 57.56 0.21 36.26 4.81 0.59 0.07 0.17 0.00 55.88 2.22 18 G C S 47.69 2.57 11.41 15.30 124.18 30.34 98.05 -165.90 86.96 8.27 4.77 21.37 34.30 31.61 0.35 4.72 0.00 6.28 1.36 19 T C T 125.58 0.61 10.56 10.76 93.87 -59.15 -68.73 -23.77 95.29 0.49 4.22 2.07 20.33 72.45 0.16 4.51 0.00 0.29 0.20 20 T C T 105.37 1.54 10.65 12.72 99.33 44.43 -91.80 0.56 95.63 0.55 3.81 2.23 14.53 78.33 0.14 4.23 0.00 0.33 0.21 21 G C S 39.46 5.55 11.24 18.42 104.17 -112.50 85.88 3.43 91.84 4.89 3.27 30.01 39.54 22.29 0.30 3.43 0.00 3.15 1.27 22 D C C 87.48 4.27 14.52 19.84 99.00 121.54 -79.64 -6.87 83.20 16.27 0.54 65.22 13.43 3.48 0.09 0.54 0.00 15.94 1.30 23 V E E 46.46 11.68 13.51 26.51 126.69 42.98 -119.63 144.44 30.38 69.58 0.04 27.49 1.86 0.10 0.01 0.03 0.00 69.92 0.60 24 T E E 35.30 12.01 17.69 31.00 122.49 -155.64 -114.41 138.29 2.54 97.45 0.00 2.34 0.10 0.01 0.00 0.00 0.00 97.50 0.05 25 Q E E 56.54 11.71 20.03 32.56 120.30 -146.91 -105.40 133.89 0.43 99.57 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.00 26 V E E 10.72 20.31 16.55 37.53 124.40 -166.59 -119.81 137.46 0.23 99.77 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.79 0.00 27 K E E 69.01 8.73 24.51 34.00 115.91 -138.56 -94.38 129.38 0.22 99.78 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.80 0.00 28 V E E 7.94 23.21 15.63 39.07 126.36 -171.57 -121.98 141.88 0.73 99.27 0.00 0.64 0.02 0.00 0.00 0.00 0.00 99.33 0.01 29 R E E 90.34 7.58 24.18 32.19 119.63 -157.20 -111.11 132.46 1.96 98.00 0.04 1.76 0.10 0.02 0.01 0.02 0.00 97.98 0.11 30 I E E 28.24 17.25 13.26 31.22 110.77 -127.39 -82.62 123.54 16.11 83.57 0.31 14.93 1.13 0.33 0.10 0.19 0.00 82.55 0.76 31 L C C 77.80 6.30 16.89 24.65 99.42 -176.96 -90.06 -30.84 79.22 18.73 2.06 41.46 30.32 7.89 0.35 1.65 0.00 17.31 1.02 32 E C S 114.92 2.24 16.62 19.20 133.62 5.87 -143.50 154.20 84.89 11.13 3.98 12.69 55.43 17.55 0.56 3.06 0.01 8.61 2.08 33 G C S 49.62 1.87 14.95 17.25 121.27 22.26 82.82 -158.38 83.42 2.53 14.05 12.87 51.08 19.88 1.32 12.22 0.00 1.37 1.26 34 R C T 189.69 1.22 13.67 15.07 94.11 -35.19 -72.60 -19.86 79.00 1.00 20.00 4.14 19.72 54.48 1.23 19.30 0.01 0.53 0.59 35 D C T 67.71 8.74 10.57 20.68 96.90 56.87 -96.84 9.55 80.91 2.01 17.08 9.48 15.63 54.50 1.39 16.94 0.01 1.22 0.85 36 K C T 120.76 6.27 11.48 20.00 110.93 133.88 -63.94 130.71 92.88 2.94 4.18 5.00 7.02 80.87 0.72 3.48 0.00 1.83 1.09 37 G C T 56.24 2.29 16.16 18.81 94.50 19.59 83.40 -0.88 95.20 2.70 2.11 6.11 9.14 79.74 0.19 2.12 0.00 2.40 0.30 38 R C C 106.88 7.36 14.72 23.60 118.52 119.02 -86.72 141.34 82.62 16.87 0.51 71.70 8.39 1.25 0.07 0.51 0.00 17.27 0.80 39 V E E 72.59 11.12 15.29 27.16 120.23 -149.34 -110.40 133.29 6.77 93.21 0.02 6.58 0.26 0.02 0.01 0.01 0.00 92.67 0.45 40 I E E 41.23 13.51 16.30 31.04 121.61 -165.25 -115.12 132.22 0.63 99.37 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.35 0.01 41 R E E 119.02 10.46 17.87 29.31 124.69 -164.17 -120.03 133.89 0.30 99.70 0.00 0.27 0.01 0.00 0.00 0.00 0.00 99.72 0.00 42 R E E 77.28 11.50 17.97 30.34 134.52 174.18 -140.09 148.90 1.47 98.52 0.00 1.29 0.04 0.00 0.00 0.00 0.00 98.64 0.01 43 N E E 80.91 6.91 21.29 28.66 112.95 -113.92 -80.12 129.82 4.54 95.45 0.01 3.91 0.28 0.02 0.00 0.00 0.00 95.69 0.09 44 V E E 20.01 21.37 10.89 31.53 118.28 -159.02 -107.88 130.34 16.57 83.39 0.04 16.65 0.41 0.03 0.02 0.01 0.00 80.65 2.23 45 R C C 160.58 2.78 19.81 22.81 101.92 -159.61 -94.08 7.70 65.68 34.26 0.05 34.05 31.42 0.68 0.01 0.06 0.00 32.75 1.03 46 G C S 31.86 3.88 20.95 24.91 139.38 -9.64 149.59 -176.95 85.45 14.54 0.01 3.49 81.14 0.82 0.00 0.01 0.00 14.35 0.18 47 P C C 80.41 5.90 19.33 25.94 114.51 -40.27 -68.35 143.47 84.37 15.61 0.02 76.81 6.43 0.23 0.00 0.02 0.00 15.97 0.52 48 V C C 20.32 22.48 10.42 32.03 121.34 -152.56 -110.64 135.31 59.81 40.16 0.03 61.45 0.84 0.04 0.02 0.02 0.00 22.81 14.83 49 R C C 131.30 3.35 22.85 26.26 128.27 -165.30 -117.03 154.74 62.86 37.10 0.04 63.41 1.40 0.09 0.02 0.02 0.00 15.70 19.35 50 V C T 94.13 8.47 14.22 23.97 108.92 -81.33 -58.52 132.64 98.64 1.12 0.24 0.29 1.87 96.95 0.01 0.15 0.00 0.57 0.17 51 G C T 49.16 3.05 18.74 22.34 95.88 23.85 89.62 -5.37 99.54 0.30 0.16 0.44 2.25 96.92 0.00 0.13 0.00 0.22 0.02 52 D C C 42.99 12.50 14.37 28.08 118.07 130.92 -73.06 147.95 94.64 5.01 0.35 90.28 4.31 0.23 0.09 0.20 0.00 4.49 0.40 53 I E E 77.28 9.87 20.64 31.10 118.29 -137.15 -105.30 129.20 8.86 90.49 0.65 8.70 0.38 0.15 0.48 0.17 0.00 84.36 5.76 54 L E E 16.77 21.48 16.63 37.92 122.68 -164.92 -111.67 135.77 6.24 91.89 1.87 5.46 0.49 0.34 1.49 0.39 0.00 91.34 0.49 55 I E E 62.93 9.71 23.55 33.69 116.75 -148.98 -106.09 126.48 15.20 81.37 3.42 13.86 0.77 0.40 2.61 0.62 0.00 81.26 0.48 56 L C C 19.74 21.21 14.73 35.75 109.69 -149.21 -89.97 114.43 45.28 37.57 17.15 39.67 2.64 1.59 14.33 2.23 0.01 38.39 1.14 57 R H H 117.93 6.21 20.63 27.19 98.52 -147.54 -71.46 -36.32 32.04 6.45 61.51 23.97 4.48 4.34 56.36 4.23 0.01 6.05 0.57 58 E H H 91.05 5.56 19.55 25.56 95.09 51.62 -68.95 -36.22 19.49 2.01 78.51 13.33 3.08 4.21 73.57 3.77 0.01 1.72 0.30 59 T H H 30.11 13.21 15.42 29.40 94.19 54.13 -67.90 -38.27 8.56 0.40 91.04 5.87 1.28 2.08 87.30 3.11 0.00 0.28 0.08 60 E H H 78.92 8.80 17.15 26.79 92.29 53.88 -64.01 -41.13 2.37 0.05 97.58 1.29 0.35 0.83 96.73 0.75 0.00 0.03 0.01 61 R H H 129.77 2.20 19.81 21.12 92.21 49.93 -65.03 -41.16 1.48 0.02 98.49 0.61 0.19 0.66 98.01 0.51 0.00 0.01 0.00 62 E H H 80.51 5.16 17.62 23.80 92.16 49.61 -65.49 -40.69 1.66 0.02 98.32 0.61 0.20 0.80 97.94 0.45 0.00 0.01 0.00 63 A H H 24.27 11.08 13.54 26.32 91.67 51.75 -63.90 -41.15 2.17 0.02 97.81 0.78 0.23 1.01 97.51 0.45 0.00 0.01 0.00 64 R H H 129.44 2.55 17.01 19.70 91.76 50.97 -64.34 -40.28 3.72 0.03 96.25 1.16 0.38 1.94 95.77 0.72 0.00 0.02 0.01 65 E H H 108.81 1.89 15.64 17.22 92.41 50.53 -66.02 -39.15 6.79 0.06 93.15 1.90 0.67 3.83 92.56 0.99 0.01 0.03 0.02 66 I H H 72.12 6.27 11.63 19.61 93.07 50.82 -67.72 -37.36 11.32 0.13 88.55 3.65 1.49 5.87 87.38 1.48 0.01 0.06 0.05 67 K H H 126.44 3.61 11.63 16.55 93.98 53.54 -70.00 -28.57 23.38 0.28 76.35 7.05 3.41 12.35 75.16 1.77 0.02 0.11 0.13 68 S H H 85.25 1.33 10.47 12.17 97.93 56.02 -78.58 -15.94 48.01 0.56 51.43 14.66 6.72 26.10 49.74 2.26 0.02 0.22 0.28 69 R C C 164.79 2.26 8.14 12.06 104.27 82.98 -82.98 33.28 73.86 0.61 25.52 50.38 1.97 19.47 25.92 1.65 0.00 0.27 0.35 70 R C C 170.62 2.34 10.41 14.29 109.41 105.96 -88.06 101.39 99.95 0.03 0.02 99.88 0.05 0.04 0.01 0.00 0.00 0.01 0.00