# 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 43.76 10.95 17.35 28.70 117.09 -134.09 -86.21 144.79 99.88 0.12 0.00 99.83 0.08 0.01 0.00 0.00 0.00 0.08 0.00 1 K E E 98.87 9.30 19.56 29.16 122.47 -141.84 -109.57 138.43 30.87 69.10 0.03 30.25 0.49 0.06 0.00 0.01 0.00 68.70 0.48 2 L E E 13.54 21.97 15.01 36.85 124.81 -161.51 -115.21 137.89 3.29 96.71 0.01 3.04 0.12 0.01 0.00 0.00 0.00 96.77 0.06 3 Q E E 59.76 9.64 26.00 36.14 120.95 -155.46 -108.94 133.70 0.67 99.33 0.00 0.60 0.02 0.00 0.00 0.00 0.00 99.38 0.01 4 I E E 3.64 26.20 17.56 44.77 120.31 -160.34 -113.11 128.98 0.27 99.72 0.00 0.25 0.00 0.00 0.00 0.00 0.00 99.74 0.00 5 T E E 35.11 9.87 26.54 37.26 123.58 -168.83 -119.28 136.59 0.34 99.66 0.00 0.32 0.00 0.00 0.00 0.00 0.00 99.66 0.01 6 L E E 19.88 21.69 15.73 37.41 111.47 -125.05 -78.98 126.88 6.08 93.89 0.03 5.89 0.24 0.02 0.01 0.01 0.00 93.67 0.15 7 T C C 61.87 8.06 21.20 29.84 101.12 174.54 -95.42 -26.67 65.52 32.69 1.79 35.07 28.06 2.73 0.39 1.12 0.00 31.83 0.79 8 R C S 113.59 5.97 20.12 26.78 134.10 11.22 -141.06 153.20 82.02 12.82 5.16 19.71 56.62 6.41 1.14 3.18 0.02 11.54 1.38 9 S C C 62.92 8.71 17.54 26.83 114.28 -101.86 -76.88 142.36 89.80 5.05 5.15 76.14 9.77 3.73 1.07 4.27 0.00 4.05 0.97 10 V C C 40.37 16.62 12.62 29.00 101.15 -151.96 -95.66 5.74 85.94 6.67 7.39 71.64 7.69 5.66 1.92 5.76 0.00 3.55 3.79 11 I C T 104.79 6.49 14.20 22.49 112.46 124.34 -69.86 131.63 91.98 4.33 3.69 19.85 16.44 55.74 0.81 2.80 0.00 2.48 1.89 12 G C T 65.03 0.76 16.80 15.86 95.50 15.84 81.35 -0.28 97.50 0.81 1.69 14.19 22.96 60.26 0.23 1.60 0.00 0.50 0.27 13 R C S 66.05 15.41 7.81 22.47 121.53 124.85 -87.81 147.97 99.11 0.76 0.13 42.06 56.89 0.27 0.06 0.04 0.00 0.21 0.47 14 P C C 71.06 3.17 16.42 20.13 115.02 -101.63 -64.33 151.53 99.42 0.34 0.24 98.18 1.17 0.16 0.17 0.03 0.00 0.09 0.21 15 E H H 135.42 3.28 13.29 18.47 91.40 -110.08 -57.15 -38.93 2.61 0.00 97.38 0.45 0.36 1.50 96.85 0.84 0.00 0.00 0.00 16 T H H 86.74 2.50 17.50 20.17 91.66 53.63 -63.92 -39.46 2.17 0.01 97.82 0.29 0.17 1.49 96.92 1.12 0.00 0.00 0.00 17 Q H H 34.45 15.48 14.86 30.58 92.15 49.12 -66.40 -39.93 1.14 0.02 98.84 0.37 0.11 0.59 98.04 0.88 0.00 0.01 0.00 18 R H H 77.03 14.38 16.37 30.52 91.56 52.52 -62.41 -42.23 0.26 0.00 99.73 0.08 0.03 0.10 99.73 0.06 0.00 0.00 0.00 19 K H H 118.52 2.09 23.86 24.41 91.77 50.26 -64.33 -41.42 0.15 0.00 99.85 0.03 0.01 0.06 99.87 0.02 0.00 0.00 0.00 20 T H H 29.79 11.23 20.51 32.75 91.93 50.03 -64.10 -43.07 0.12 0.00 99.88 0.01 0.01 0.06 99.89 0.03 0.00 0.00 0.00 21 V H H 2.79 25.67 15.25 41.33 91.33 49.76 -63.40 -43.33 0.15 0.00 99.85 0.01 0.01 0.08 99.81 0.09 0.00 0.00 0.00 22 E H H 108.41 6.97 21.26 29.14 91.52 50.34 -62.87 -40.70 0.44 0.00 99.56 0.03 0.01 0.34 99.37 0.26 0.00 0.00 0.00 23 A H H 67.83 3.73 21.66 25.65 90.68 54.25 -64.54 -30.52 4.46 0.00 95.53 0.05 0.08 4.60 94.89 0.37 0.00 0.00 0.00 24 L C T 24.39 18.65 15.67 34.56 92.03 52.98 -83.35 -8.39 66.50 0.02 33.48 0.22 0.90 65.48 32.61 0.76 0.00 0.00 0.02 25 G C T 36.34 4.90 24.08 29.99 97.28 -111.15 85.49 16.69 99.69 0.01 0.31 1.95 1.11 96.73 0.16 0.04 0.00 0.00 0.00 26 L C C 11.49 23.88 9.34 32.48 110.08 153.90 -79.07 120.12 99.16 0.48 0.36 98.25 0.71 0.35 0.15 0.08 0.00 0.15 0.31 27 K C C 147.98 2.11 20.33 22.62 101.28 168.51 -103.54 -16.43 99.33 0.42 0.24 86.97 11.16 1.18 0.09 0.12 0.00 0.17 0.32 28 K C S 117.28 2.45 20.79 23.00 131.54 46.71 -126.65 159.02 89.17 10.20 0.64 15.01 70.90 1.95 0.22 0.28 0.00 1.46 10.18 29 T C T 75.59 9.49 14.80 25.27 111.88 -86.65 -63.16 138.53 98.75 0.71 0.55 0.59 8.09 90.17 0.02 0.51 0.00 0.38 0.23 30 N C T 100.96 6.03 17.77 25.13 93.25 13.98 68.66 20.40 99.40 0.41 0.19 1.37 7.39 90.62 0.00 0.25 0.00 0.32 0.05 31 S C C 41.30 8.41 17.73 27.58 122.07 131.23 -95.14 147.60 70.42 29.48 0.10 58.19 12.26 0.36 0.01 0.12 0.00 26.69 2.36 32 S E E 42.93 15.93 16.03 31.43 132.98 -161.76 -126.95 153.13 15.54 84.45 0.01 15.49 0.23 0.01 0.00 0.01 0.00 83.54 0.73 33 V E E 34.26 14.61 19.18 34.45 126.10 -156.81 -125.66 139.20 2.47 97.53 0.00 2.30 0.07 0.00 0.00 0.00 0.00 97.59 0.04 34 V E E 67.25 11.93 20.19 32.31 118.44 -151.48 -107.82 126.44 0.46 99.54 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.54 0.02 35 V E E 34.13 15.25 15.49 31.35 128.09 -174.43 -126.59 142.73 2.77 97.23 0.00 2.71 0.05 0.00 0.00 0.00 0.00 97.10 0.14 36 E C E 116.12 3.60 21.65 25.32 115.26 -106.37 -72.05 144.41 51.93 48.01 0.06 42.70 5.99 0.50 0.01 0.06 0.00 50.43 0.31 37 D C C 59.37 16.36 11.67 27.42 106.70 -109.09 -71.06 115.89 98.25 1.62 0.12 75.19 21.95 1.25 0.02 0.13 0.00 1.25 0.22 38 N C C 63.81 4.85 17.07 23.22 131.88 156.45 -131.42 166.61 99.52 0.19 0.29 89.10 10.25 0.15 0.29 0.03 0.00 0.04 0.14 39 P H H 110.28 1.61 15.28 17.06 91.08 -98.91 -59.87 -35.92 2.06 0.00 97.94 0.12 0.23 1.61 97.64 0.40 0.00 0.00 0.00 40 A H H 65.01 3.09 17.01 20.59 91.87 53.80 -64.49 -40.23 1.12 0.00 98.87 0.08 0.10 0.90 98.51 0.40 0.00 0.00 0.00 41 I H H 14.52 20.17 12.60 32.51 92.51 47.53 -66.31 -41.59 0.29 0.00 99.71 0.04 0.02 0.18 99.50 0.25 0.00 0.00 0.00 42 R H H 99.17 11.04 17.65 28.98 91.41 52.94 -61.93 -41.77 0.08 0.00 99.92 0.01 0.00 0.05 99.90 0.05 0.00 0.00 0.00 43 G H H 36.22 2.13 21.90 22.59 91.37 50.43 -63.00 -41.69 0.18 0.00 99.82 0.01 0.00 0.11 99.82 0.05 0.00 0.00 0.00 44 Q H H 43.30 12.61 19.13 32.31 92.11 50.37 -65.42 -40.95 0.21 0.00 99.79 0.01 0.01 0.15 99.72 0.11 0.00 0.00 0.00 45 I H H 8.53 23.90 14.60 38.32 91.55 51.53 -63.60 -42.02 0.29 0.00 99.71 0.01 0.01 0.22 99.43 0.32 0.00 0.00 0.00 46 N H H 97.32 4.11 21.04 25.86 91.17 52.99 -63.78 -35.50 3.03 0.00 96.97 0.04 0.05 3.20 95.47 1.23 0.00 0.00 0.00 47 K H H 117.05 4.26 20.15 24.82 91.55 52.71 -69.11 -28.23 13.98 0.00 86.02 0.09 0.23 15.10 83.23 1.34 0.01 0.00 0.00 48 V H H 9.29 22.13 12.79 35.25 98.97 43.54 -101.38 1.76 38.44 0.21 61.34 2.55 3.74 32.34 57.21 3.81 0.11 0.07 0.17 49 K H G 105.46 11.98 15.58 28.25 91.83 112.01 -57.76 -35.03 23.49 0.25 76.26 1.22 1.35 19.88 1.68 75.67 0.00 0.17 0.03 50 H H G 141.37 2.15 20.74 22.69 89.95 60.66 -72.37 -15.69 25.66 0.11 74.23 0.36 1.30 23.54 0.82 73.90 0.00 0.07 0.01 51 L H G 41.23 15.72 15.95 31.84 97.58 50.34 -99.56 -6.09 24.04 0.66 75.30 0.90 1.87 20.26 0.81 75.55 0.00 0.59 0.03 52 V E E 12.40 23.70 11.85 35.11 125.24 74.38 -115.54 140.17 4.80 95.10 0.10 3.96 0.80 0.12 0.04 0.06 0.00 94.40 0.63 53 T E E 68.30 5.21 23.68 29.18 123.03 -166.94 -116.96 137.76 2.15 97.83 0.02 1.84 0.16 0.03 0.00 0.01 0.00 97.86 0.09 54 V E E 51.51 17.96 11.61 28.71 120.81 -156.31 -113.67 130.68 6.03 93.94 0.03 5.46 0.39 0.06 0.01 0.02 0.00 93.71 0.36 55 E E E 111.88 3.82 15.51 20.86 124.40 -173.30 -119.00 143.45 33.27 66.68 0.05 32.34 0.47 0.08 0.01 0.02 0.00 66.61 0.46 56 E C C 134.05 4.29 13.83 20.10 111.69 -110.00 -76.28 135.99 98.96 1.04 0.00 99.07 0.06 0.01 0.00 0.00 0.00 0.85 0.02