# 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 Q C C 118.96 4.92 16.15 22.28 107.89 -158.38 -89.63 98.51 99.92 0.07 0.01 99.84 0.08 0.04 0.00 0.00 0.00 0.04 0.01 1 H C C 92.43 10.57 12.70 23.91 113.78 -165.24 -99.97 118.78 88.23 10.38 1.38 84.22 1.26 2.60 0.39 0.63 0.00 9.61 1.28 2 A C C 53.41 9.15 15.41 25.60 121.92 -163.13 -106.79 140.26 66.42 32.16 1.41 52.09 10.61 3.10 0.39 1.07 0.00 30.82 1.90 3 V E E 36.91 16.96 14.01 30.89 120.16 -150.90 -110.54 130.32 42.77 55.95 1.28 36.22 4.74 1.32 0.49 0.78 0.00 53.98 2.46 4 I E E 88.22 7.27 20.99 28.95 116.66 -158.15 -105.43 125.26 40.29 58.86 0.85 34.99 3.88 0.76 0.46 0.48 0.00 55.34 4.09 5 L C C 25.99 20.45 10.77 30.23 123.47 -165.45 -110.88 141.00 66.32 33.42 0.26 60.46 5.39 0.26 0.16 0.12 0.00 31.56 2.06 6 D C C 80.42 3.40 18.86 22.03 116.74 -113.43 -75.96 155.77 95.99 3.83 0.18 95.09 0.94 0.08 0.13 0.02 0.00 3.54 0.20 7 Q H H 119.42 4.87 12.99 19.70 92.12 -106.81 -58.50 -38.87 1.95 0.00 98.05 0.23 0.24 1.25 97.86 0.42 0.00 0.00 0.00 8 E H H 133.35 1.10 17.25 16.74 92.08 51.74 -65.15 -39.68 1.45 0.00 98.54 0.15 0.12 1.07 98.03 0.63 0.00 0.00 0.00 9 K H H 66.84 9.97 15.50 26.53 92.38 48.56 -66.77 -39.24 0.77 0.00 99.22 0.15 0.06 0.47 98.62 0.69 0.00 0.00 0.00 10 Y H H 28.54 18.99 13.16 32.01 91.49 52.26 -62.79 -42.53 0.34 0.00 99.66 0.07 0.03 0.17 99.59 0.14 0.00 0.00 0.00 11 D H H 76.74 3.47 20.59 24.05 91.42 51.07 -63.33 -40.77 0.52 0.00 99.48 0.07 0.02 0.32 99.50 0.08 0.00 0.00 0.00 12 R H H 115.80 3.30 21.30 24.15 91.62 50.43 -64.65 -41.17 0.44 0.00 99.56 0.03 0.01 0.33 99.53 0.10 0.00 0.00 0.00 13 I H H 9.23 20.99 15.38 36.75 91.95 49.61 -64.06 -42.77 0.27 0.00 99.73 0.02 0.01 0.19 99.60 0.18 0.00 0.00 0.00 14 L H H 49.53 15.63 16.87 32.17 91.63 52.51 -63.95 -38.01 0.89 0.00 99.11 0.05 0.03 0.77 98.26 0.90 0.00 0.00 0.00 15 K H H 146.41 1.37 21.18 20.99 92.33 51.14 -68.17 -34.94 7.89 0.00 92.11 0.11 0.17 7.98 90.63 1.09 0.00 0.00 0.00 16 E H H 90.65 7.42 18.24 26.22 94.23 46.29 -77.05 -32.10 15.63 0.01 84.35 0.27 0.93 14.63 83.38 0.76 0.02 0.00 0.01 17 V C C 12.80 20.86 11.11 31.49 104.38 37.25 -112.91 52.89 95.13 0.34 4.53 53.14 39.02 2.98 3.29 1.08 0.00 0.08 0.41 18 P C T 78.20 7.60 15.93 25.02 93.14 145.78 -64.97 -23.82 94.22 0.22 5.56 23.14 6.25 64.55 0.70 5.12 0.00 0.13 0.11 19 T C T 104.28 1.92 18.61 20.12 95.83 52.26 -91.80 -4.15 93.41 0.38 6.21 9.04 9.75 73.73 0.52 6.55 0.00 0.22 0.19 20 Y C C 56.99 17.52 10.03 26.83 116.56 104.62 -83.62 137.02 95.64 2.05 2.30 85.25 8.51 1.88 0.43 2.01 0.00 1.07 0.86 21 R C S 154.25 3.83 19.98 24.94 98.03 -163.32 -85.22 -25.78 96.55 2.52 0.92 19.96 72.23 4.63 0.12 0.79 0.00 1.76 0.51 22 Y E E 90.23 10.33 20.99 31.65 127.01 29.72 -131.23 140.77 42.07 56.45 1.48 14.02 25.66 5.11 0.37 1.01 0.07 50.61 3.15 23 V E E 11.21 23.49 17.14 40.55 117.72 -165.32 -112.93 123.89 26.10 73.45 0.45 21.75 4.31 0.26 0.35 0.22 0.00 59.95 13.16 24 S C C 25.89 10.26 26.06 37.13 130.01 -142.91 -109.22 163.34 70.00 29.74 0.26 70.08 1.45 0.10 0.25 0.06 0.00 25.59 2.48 25 V H H 24.03 21.57 17.41 38.65 91.54 -110.75 -59.71 -37.65 1.94 0.01 98.05 0.10 0.17 1.63 97.66 0.43 0.00 0.00 0.00 26 S H H 54.33 6.29 23.28 30.01 91.61 55.97 -63.37 -40.95 1.06 0.00 98.93 0.06 0.07 0.88 98.54 0.44 0.00 0.00 0.00 27 V H H 37.89 8.99 21.85 31.98 92.04 48.75 -65.25 -42.12 0.55 0.01 99.43 0.06 0.05 0.40 98.88 0.59 0.00 0.01 0.00 28 L H H 3.85 23.91 15.99 40.28 91.72 49.48 -64.31 -43.23 0.66 0.04 99.30 0.10 0.09 0.44 99.04 0.31 0.01 0.02 0.01 29 V H H 24.63 14.44 15.98 31.30 91.88 49.83 -63.68 -42.83 1.55 0.08 98.37 0.20 0.23 1.06 98.12 0.31 0.02 0.03 0.02 30 D H H 105.88 1.56 19.95 20.47 92.32 47.77 -65.22 -40.81 2.48 0.03 97.49 0.21 0.18 1.96 97.04 0.57 0.02 0.01 0.01 31 R H H 123.85 6.41 17.10 24.45 93.05 45.69 -69.75 -37.25 5.36 0.02 94.62 0.17 0.38 4.73 94.14 0.55 0.02 0.00 0.01 32 L H H 40.94 15.02 13.05 28.37 96.85 35.79 -96.54 -4.26 18.63 0.09 81.27 1.27 3.04 14.00 80.93 0.64 0.03 0.02 0.06 33 K C T 168.42 1.16 19.47 19.69 93.45 -126.29 57.10 40.28 99.57 0.08 0.35 25.60 10.46 63.60 0.16 0.10 0.00 0.04 0.03 34 I C C 37.76 16.33 10.97 27.24 128.14 131.82 -120.07 149.89 98.43 1.31 0.26 79.00 18.61 0.71 0.15 0.09 0.00 0.45 0.99 35 G C C 42.84 3.24 21.55 24.15 119.03 -106.41 -78.16 160.86 99.26 0.36 0.37 97.95 1.15 0.29 0.24 0.05 0.00 0.11 0.22 36 G H H 31.39 13.78 15.15 28.23 96.18 -104.28 -50.76 -46.39 18.76 0.10 81.14 3.46 5.22 10.35 78.49 2.36 0.03 0.03 0.06 37 S H H 70.76 3.03 23.24 25.47 93.04 52.01 -65.55 -40.42 8.50 0.04 91.45 1.11 1.15 5.99 89.32 2.38 0.02 0.02 0.02 38 L H H 45.96 12.18 21.13 33.56 92.32 50.12 -65.71 -41.11 2.41 0.01 97.57 0.57 0.28 1.40 95.96 1.77 0.01 0.00 0.01 39 A H H 2.10 25.81 15.79 42.11 91.18 51.41 -63.81 -42.78 0.43 0.00 99.57 0.11 0.04 0.20 99.40 0.26 0.00 0.00 0.00 40 R H H 103.47 10.53 24.41 34.71 91.45 51.55 -62.83 -41.66 0.20 0.00 99.80 0.03 0.01 0.11 99.75 0.10 0.00 0.00 0.00 41 I H H 72.50 4.33 26.94 31.43 91.23 50.18 -63.53 -42.74 0.08 0.00 99.92 0.01 0.00 0.05 99.91 0.03 0.00 0.00 0.00 42 A H H 4.19 20.99 21.42 42.65 91.47 49.81 -63.70 -43.68 0.09 0.00 99.91 0.01 0.00 0.06 99.90 0.03 0.00 0.00 0.00 43 L H H 4.55 25.25 19.92 45.03 91.43 49.69 -64.08 -42.02 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.02 0.00 0.00 0.00 44 R H H 120.93 4.60 25.30 30.04 91.41 51.54 -63.34 -42.16 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 45 H H H 72.46 6.34 23.00 29.87 91.74 49.30 -64.36 -41.88 0.21 0.00 99.79 0.02 0.01 0.12 99.82 0.03 0.00 0.00 0.00 46 L H H 6.11 21.89 14.98 37.37 91.72 49.80 -64.13 -42.25 0.30 0.00 99.70 0.04 0.02 0.16 99.67 0.11 0.00 0.00 0.00 47 E H H 71.50 12.99 16.00 29.03 91.89 50.66 -63.44 -41.16 0.39 0.00 99.61 0.04 0.01 0.26 99.39 0.29 0.00 0.00 0.00 48 K H H 161.46 0.90 18.76 18.03 90.98 51.50 -64.76 -31.36 2.87 0.00 97.13 0.06 0.07 2.87 96.60 0.40 0.00 0.00 0.00 49 E C T 105.40 5.37 15.02 21.76 92.26 51.75 -84.54 -5.61 81.22 0.01 18.77 0.09 0.45 81.05 18.09 0.32 0.00 0.00 0.01 50 G C T 45.93 4.23 18.19 23.50 94.48 -113.55 79.01 13.59 99.92 0.00 0.08 0.12 0.64 99.21 0.03 0.01 0.00 0.00 0.00 51 I C S 31.72 15.43 16.24 32.59 95.39 121.19 -81.26 -25.02 99.75 0.25 0.01 7.10 92.15 0.58 0.00 0.00 0.00 0.15 0.02 52 I E E 4.74 25.16 12.70 38.54 132.03 30.65 -133.66 147.34 23.21 76.78 0.01 10.67 14.30 0.21 0.00 0.01 0.00 73.72 1.08 53 K E E 106.59 4.62 25.29 30.34 123.71 -158.78 -120.95 135.01 4.37 95.63 0.00 4.05 0.14 0.00 0.00 0.00 0.00 95.76 0.06 54 P E E 60.54 15.50 15.00 30.13 111.14 -112.55 -67.73 130.98 1.99 98.00 0.00 2.01 0.02 0.00 0.00 0.00 0.00 97.93 0.03 55 I E E 71.44 9.21 16.45 27.02 101.28 177.32 -96.30 -31.86 4.99 95.00 0.01 3.39 1.12 0.04 0.00 0.00 0.00 95.41 0.03 56 S E E 48.12 5.57 18.37 25.23 138.32 -3.93 -153.50 155.43 1.70 98.29 0.01 1.23 0.22 0.03 0.00 0.00 0.00 98.48 0.02 57 K E E 123.75 8.46 11.41 21.87 123.39 -158.49 -128.93 132.85 5.42 94.54 0.03 4.47 0.52 0.09 0.00 0.02 0.00 94.78 0.11 58 H E E 103.16 4.53 11.88 18.18 124.26 174.50 -126.10 136.82 42.26 57.63 0.11 37.60 2.85 0.34 0.02 0.09 0.00 58.64 0.47 59 S C T 99.21 0.82 13.11 13.29 100.08 -60.57 2.39 -81.43 98.22 0.76 1.02 3.34 36.95 57.83 0.03 1.16 0.00 0.59 0.11 60 K C T 160.32 2.38 12.85 15.79 98.14 -8.32 -96.99 2.13 98.57 0.43 1.00 2.98 36.03 59.38 0.03 1.21 0.00 0.32 0.07 61 Q E E 66.83 10.27 13.16 24.76 126.23 78.61 -120.98 143.06 32.15 67.48 0.37 21.51 8.40 2.66 0.03 0.35 0.00 66.63 0.42 62 A E E 23.29 13.63 17.10 32.07 120.58 -146.10 -106.51 135.47 4.05 95.95 0.00 3.82 0.11 0.00 0.00 0.00 0.00 96.01 0.05 63 I E E 21.64 14.76 21.30 37.31 120.30 -158.40 -113.62 130.99 0.47 99.53 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.59 0.01 64 Y E E 17.37 20.64 19.39 40.09 126.35 -167.74 -116.66 142.98 0.24 99.76 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.00 65 T E E 29.93 12.69 22.47 35.71 133.02 -175.10 -131.43 152.95 0.98 99.02 0.00 0.92 0.02 0.00 0.00 0.00 0.00 99.03 0.03 66 R E E 94.79 12.69 17.71 30.34 115.31 -107.76 -76.09 140.40 13.44 86.54 0.02 12.62 0.63 0.05 0.00 0.01 0.00 86.14 0.54 67 A C C 42.50 13.01 12.52 25.86 112.77 -114.44 -73.71 144.20 91.39 8.52 0.08 90.20 0.91 0.24 0.02 0.05 0.00 8.31 0.27 68 T C C 100.17 3.36 16.51 20.73 105.58 -146.50 -89.98 50.97 99.91 0.09 0.01 99.80 0.12 0.03 0.00 0.00 0.00 0.05 0.01