# 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 99.78 8.13 14.58 23.57 116.21 -166.11 -97.80 129.94 99.92 0.07 0.01 99.87 0.06 0.03 0.00 0.00 0.00 0.03 0.01 1 F C C 100.10 9.46 9.88 20.22 112.77 -142.42 -92.83 127.16 86.95 5.34 7.71 81.81 1.49 4.15 5.26 1.88 0.00 2.71 2.70 2 S C C 70.48 4.43 11.17 17.09 110.17 -164.64 -89.99 118.26 81.75 3.50 14.75 55.13 13.79 12.52 10.81 4.34 0.00 2.00 1.41 3 D C C 108.27 3.07 11.55 16.00 101.15 -115.47 -83.38 4.64 67.14 1.31 31.54 32.86 20.45 14.07 26.09 5.31 0.02 0.59 0.61 4 F C H 111.97 6.05 11.02 18.64 104.99 94.79 -82.03 15.44 51.71 0.73 47.55 29.20 13.47 8.66 44.56 3.49 0.01 0.33 0.28 5 N H H 82.37 4.84 13.93 20.00 105.32 56.52 -77.98 89.07 45.17 0.65 54.18 35.79 3.57 5.21 52.77 2.11 0.00 0.29 0.26 6 M H H 89.41 8.75 12.82 22.52 94.55 -126.77 -65.96 -37.12 5.62 0.06 94.32 2.67 0.92 2.10 93.23 1.04 0.00 0.02 0.02 7 Y H H 130.73 2.90 16.60 19.77 92.84 52.61 -65.73 -40.43 2.45 0.03 97.52 0.93 0.33 1.15 96.90 0.67 0.00 0.01 0.01 8 E H H 91.72 4.37 17.75 22.87 92.27 50.39 -65.93 -40.03 1.17 0.01 98.82 0.40 0.14 0.56 98.52 0.37 0.00 0.00 0.00 9 A H H 23.59 11.86 14.54 27.78 92.13 51.78 -64.38 -41.26 0.68 0.00 99.32 0.20 0.07 0.32 99.25 0.16 0.00 0.00 0.00 10 K H H 99.65 5.60 18.91 25.21 92.19 51.65 -64.49 -40.91 0.51 0.00 99.49 0.14 0.04 0.25 99.47 0.10 0.00 0.00 0.00 11 V H H 71.21 3.72 19.64 23.53 91.95 49.79 -64.35 -42.60 0.48 0.00 99.51 0.11 0.04 0.27 99.50 0.08 0.00 0.00 0.00 12 F H H 77.81 9.04 18.20 28.06 92.21 49.59 -65.07 -41.77 0.68 0.01 99.32 0.14 0.05 0.40 99.31 0.09 0.00 0.00 0.00 13 L H H 63.92 9.72 17.88 28.17 92.03 49.97 -64.85 -41.19 0.57 0.00 99.42 0.11 0.04 0.34 99.42 0.09 0.00 0.00 0.00 14 K H H 117.71 2.97 20.99 23.81 92.03 51.08 -64.77 -40.73 0.92 0.00 99.07 0.14 0.06 0.60 99.07 0.12 0.00 0.00 0.00 15 A H H 43.27 5.98 19.26 26.27 92.27 50.34 -65.20 -41.16 1.76 0.00 98.23 0.24 0.13 1.19 98.29 0.15 0.00 0.00 0.00 16 V H H 43.20 11.73 17.83 30.24 92.26 49.83 -64.93 -41.74 1.03 0.00 98.97 0.20 0.10 0.58 99.03 0.09 0.00 0.00 0.00 17 A H H 48.53 5.34 20.40 26.37 91.71 51.11 -63.35 -41.62 0.53 0.00 99.47 0.11 0.04 0.27 99.51 0.07 0.00 0.00 0.00 18 D H H 78.19 2.80 21.69 23.75 91.82 49.85 -64.70 -41.01 0.48 0.00 99.52 0.08 0.03 0.27 99.54 0.08 0.00 0.00 0.00 19 A H H 31.90 9.40 17.55 28.32 91.93 50.88 -64.42 -41.30 0.42 0.00 99.58 0.05 0.02 0.25 99.59 0.09 0.00 0.00 0.00 20 Q H H 70.89 8.31 18.89 28.05 91.76 50.55 -64.01 -40.96 0.63 0.00 99.37 0.07 0.03 0.40 99.39 0.10 0.00 0.00 0.00 21 N H H 87.97 2.53 21.27 22.90 91.86 50.42 -64.64 -40.84 1.78 0.00 98.21 0.18 0.09 1.27 98.28 0.17 0.00 0.00 0.00 22 T H H 59.07 4.86 18.39 24.07 92.11 50.67 -64.71 -41.44 3.07 0.00 96.92 0.39 0.20 2.23 96.89 0.28 0.00 0.00 0.00 23 F H H 85.60 8.64 17.05 26.39 92.00 49.93 -64.82 -41.08 0.75 0.00 99.24 0.18 0.07 0.40 99.23 0.12 0.00 0.00 0.00 24 R H H 134.46 3.31 19.37 22.80 91.85 50.62 -64.43 -41.02 0.48 0.00 99.52 0.10 0.04 0.25 99.53 0.08 0.00 0.00 0.00 25 Q H H 98.36 2.60 19.70 21.71 92.17 49.53 -65.51 -40.92 0.76 0.00 99.24 0.13 0.06 0.43 99.27 0.10 0.00 0.00 0.00 26 T H H 48.43 6.84 16.93 25.21 92.45 50.28 -65.11 -40.93 0.90 0.00 99.10 0.17 0.07 0.50 99.16 0.10 0.00 0.00 0.00 27 A H H 43.39 5.39 17.20 23.84 91.85 50.96 -63.87 -41.24 0.95 0.00 99.04 0.24 0.07 0.46 99.11 0.11 0.00 0.00 0.00 28 Q H H 101.61 2.72 19.59 21.71 91.95 50.59 -64.83 -40.66 1.00 0.00 99.00 0.21 0.08 0.54 99.07 0.11 0.00 0.00 0.00 29 Q H H 86.72 5.60 17.67 24.13 92.23 50.17 -65.16 -40.51 0.98 0.00 99.01 0.20 0.08 0.52 99.08 0.11 0.00 0.00 0.00 30 E H H 101.81 4.86 17.89 23.51 91.89 50.60 -64.82 -40.22 0.88 0.00 99.11 0.21 0.07 0.45 99.17 0.11 0.00 0.00 0.00 31 N H H 80.36 3.14 18.67 21.51 91.99 50.76 -64.55 -40.53 1.05 0.00 98.95 0.19 0.07 0.60 99.01 0.13 0.00 0.00 0.00 32 Q H H 81.18 5.43 18.08 24.30 92.19 50.21 -65.22 -40.64 1.40 0.00 98.60 0.21 0.09 0.88 98.64 0.17 0.00 0.00 0.00 33 L H H 64.65 7.90 16.58 25.65 92.06 51.58 -64.00 -41.58 0.89 0.00 99.11 0.17 0.07 0.49 99.13 0.13 0.00 0.00 0.00 34 A H H 60.07 2.67 19.52 21.75 91.72 50.50 -64.18 -40.57 1.00 0.00 99.00 0.18 0.06 0.61 98.98 0.17 0.00 0.00 0.00 35 R H H 127.30 3.44 19.17 22.45 92.04 49.77 -65.20 -40.35 1.86 0.00 98.14 0.24 0.11 1.32 98.06 0.26 0.00 0.00 0.00 36 Y H H 77.59 10.60 16.33 27.73 92.55 50.02 -65.47 -40.59 1.17 0.00 98.83 0.26 0.10 0.68 98.77 0.19 0.00 0.00 0.00 37 E H H 102.52 4.55 19.18 24.28 91.76 51.78 -63.74 -40.94 0.64 0.00 99.36 0.14 0.05 0.34 99.37 0.10 0.00 0.00 0.00 38 S H H 60.77 2.58 20.67 22.11 91.95 49.73 -65.16 -40.74 0.83 0.00 99.17 0.14 0.06 0.50 99.19 0.11 0.00 0.00 0.00 39 Q H H 63.94 9.55 18.64 28.98 92.21 49.98 -65.27 -40.96 0.70 0.00 99.30 0.11 0.05 0.42 99.32 0.10 0.00 0.00 0.00 40 S H H 30.66 11.68 17.10 29.70 91.79 51.29 -63.89 -40.70 0.76 0.00 99.24 0.13 0.06 0.42 99.31 0.09 0.00 0.00 0.00 41 Q H H 105.11 2.31 22.38 23.59 91.75 50.62 -64.47 -40.45 1.02 0.00 98.98 0.19 0.08 0.56 99.06 0.11 0.00 0.00 0.00 42 S H H 47.09 5.66 20.34 26.49 91.93 50.91 -65.00 -41.22 1.13 0.00 98.87 0.21 0.09 0.64 98.90 0.14 0.00 0.00 0.00 43 L H H 34.64 15.95 16.24 32.17 92.34 50.36 -64.90 -41.67 1.03 0.00 98.96 0.22 0.10 0.56 98.97 0.15 0.00 0.00 0.00 44 L H H 79.71 5.88 20.23 26.65 92.08 50.02 -64.41 -41.37 1.74 0.01 98.25 0.36 0.17 1.03 98.15 0.28 0.01 0.01 0.00 45 N H H 96.23 1.89 21.98 21.99 92.44 49.22 -66.09 -39.68 4.31 0.03 95.65 0.58 0.44 3.04 95.34 0.56 0.02 0.01 0.01 46 G H H 14.98 11.61 14.01 27.10 92.94 51.98 -66.12 -38.30 9.42 0.08 90.50 1.84 1.23 6.19 89.12 1.49 0.04 0.03 0.04 47 S H H 49.70 11.71 14.20 26.01 93.76 53.67 -67.16 -37.67 15.31 0.22 84.47 3.58 2.04 9.98 81.29 2.82 0.06 0.11 0.12 48 T H H 110.47 1.22 17.20 17.44 94.47 48.00 -73.13 -31.18 22.89 0.24 76.88 3.03 3.18 17.14 73.69 2.62 0.10 0.11 0.13 49 S C T 78.64 2.34 16.47 18.71 96.78 41.36 -89.28 -4.75 60.05 0.18 39.77 3.41 6.98 48.42 38.17 2.80 0.03 0.07 0.14 50 G C T 34.83 9.58 15.08 25.42 97.86 -115.85 77.74 16.69 98.48 0.65 0.87 10.14 22.40 66.13 0.23 0.50 0.00 0.52 0.09 51 A C C 38.41 8.88 18.27 28.27 115.97 117.53 -107.44 145.07 62.27 37.54 0.19 46.70 11.73 1.36 0.02 0.21 0.00 39.58 0.39 52 I E E 24.77 19.87 12.98 32.42 125.90 78.47 -119.57 138.31 4.78 95.21 0.01 4.34 0.28 0.02 0.00 0.00 0.00 95.19 0.17 53 S E E 44.71 6.72 21.67 29.07 124.25 -157.38 -114.77 143.01 0.76 99.24 0.00 0.69 0.02 0.00 0.00 0.00 0.00 99.25 0.03 54 I E E 62.71 14.50 11.20 25.81 117.31 -146.80 -108.84 125.77 1.98 98.01 0.01 1.70 0.15 0.02 0.00 0.00 0.00 98.06 0.06 55 T E E 84.33 3.09 13.47 17.87 113.76 174.49 -124.63 105.90 22.78 77.14 0.08 18.92 2.42 0.45 0.01 0.07 0.00 77.83 0.30 56 G C T 61.69 0.86 13.48 13.69 106.69 -48.86 59.91 -118.14 99.59 0.23 0.18 1.05 20.17 78.37 0.00 0.20 0.00 0.18 0.03 57 D C T 125.50 1.75 12.16 14.80 97.71 -17.91 -94.13 9.80 99.71 0.12 0.17 0.93 21.19 77.61 0.01 0.18 0.00 0.08 0.02 58 N E E 92.56 3.24 15.55 20.08 126.17 87.84 -112.70 147.25 18.40 81.56 0.04 12.07 6.03 0.47 0.00 0.03 0.00 81.02 0.39 59 I E E 52.34 16.67 10.48 26.78 116.22 -135.21 -98.95 127.13 2.39 97.61 0.00 2.24 0.08 0.00 0.00 0.00 0.00 97.55 0.13 60 Q E E 79.23 5.96 19.24 26.24 126.96 -175.33 -123.55 146.98 0.85 99.15 0.00 0.81 0.02 0.00 0.00 0.00 0.00 99.03 0.13 61 Q E E 99.59 9.07 16.74 26.65 115.91 -108.04 -72.33 142.70 7.44 92.53 0.03 6.71 0.51 0.05 0.01 0.01 0.00 92.41 0.30 62 G C C 14.92 15.29 10.69 26.14 122.69 -128.06 -86.28 161.67 79.64 18.85 1.51 68.37 8.15 1.89 0.32 1.21 0.00 19.21 0.85 63 R C S 178.23 1.83 15.93 17.97 95.06 -117.32 -71.40 -26.13 95.17 2.47 2.36 31.65 59.04 4.98 0.66 1.44 0.00 1.53 0.70 64 N C C 81.61 4.01 16.25 21.06 117.14 30.06 -125.55 119.53 95.42 1.39 3.19 63.91 28.15 3.36 1.69 1.41 0.00 0.57 0.91 65 F H G 89.98 13.07 11.39 24.75 93.16 -151.96 -63.09 -32.56 36.59 0.23 63.18 3.13 3.81 28.12 24.62 40.05 0.01 0.12 0.13 66 K H G 138.78 2.85 17.23 20.96 92.37 59.82 -66.27 -32.47 35.55 0.09 64.36 1.38 2.46 30.27 25.98 39.79 0.02 0.05 0.06 67 A H G 46.44 6.82 16.25 24.48 93.11 52.42 -73.68 -25.30 31.63 0.20 68.17 3.52 3.64 23.19 28.14 41.28 0.01 0.10 0.11 68 L H H 35.75 14.59 14.10 29.10 95.92 67.50 -70.86 -35.72 31.94 0.24 67.83 23.00 6.17 4.03 62.47 4.12 0.00 0.09 0.13 69 K H H 90.28 10.32 20.15 30.48 93.33 67.70 -64.25 -39.60 6.45 0.06 93.49 1.94 0.97 3.71 91.11 2.21 0.01 0.03 0.02 70 E H H 75.53 11.25 21.45 32.52 92.37 51.50 -65.09 -40.78 3.11 0.03 96.86 0.75 0.33 1.91 95.11 1.87 0.00 0.02 0.01 71 V H H 29.82 13.27 20.74 34.53 91.92 50.01 -65.09 -42.03 1.86 0.03 98.12 0.63 0.23 0.98 96.56 1.58 0.00 0.01 0.01 72 K H H 73.46 10.86 23.54 34.33 91.91 51.74 -63.60 -41.74 1.97 0.02 98.01 0.56 0.19 1.15 97.54 0.55 0.01 0.01 0.01 73 L H H 31.38 16.06 21.77 37.52 92.01 50.96 -63.87 -42.31 1.01 0.00 98.99 0.13 0.06 0.70 98.86 0.24 0.00 0.00 0.00 74 F H H 47.18 15.35 22.10 37.00 91.92 50.05 -64.57 -41.48 0.85 0.00 99.15 0.13 0.06 0.57 99.06 0.18 0.00 0.00 0.00 75 Q H H 71.74 8.94 24.81 33.92 91.91 50.44 -64.27 -41.56 0.60 0.00 99.40 0.09 0.04 0.39 99.34 0.14 0.00 0.00 0.00 76 Y H H 56.95 11.90 23.34 35.57 91.84 49.15 -64.78 -42.10 0.71 0.00 99.29 0.09 0.05 0.51 99.21 0.15 0.00 0.00 0.00 77 S H H 9.79 19.67 20.05 39.53 91.62 50.82 -64.22 -41.56 0.66 0.00 99.34 0.08 0.05 0.44 99.32 0.11 0.00 0.00 0.00 78 N H H 50.16 12.26 21.86 34.08 91.73 51.06 -64.79 -40.71 0.94 0.00 99.06 0.08 0.06 0.70 99.03 0.12 0.00 0.00 0.00 79 E H H 81.53 5.21 23.64 28.99 92.07 50.54 -65.18 -41.56 1.13 0.00 98.86 0.10 0.09 0.88 98.71 0.23 0.00 0.00 0.00 80 I H H 23.83 14.63 19.48 34.81 92.04 49.37 -64.19 -43.04 0.75 0.00 99.24 0.10 0.06 0.54 98.79 0.51 0.00 0.00 0.00 81 F H H 21.00 20.42 15.65 35.77 92.05 49.73 -65.43 -39.66 0.63 0.00 99.37 0.05 0.03 0.48 98.70 0.74 0.00 0.00 0.00 82 K H H 116.67 6.07 18.26 25.39 91.69 52.94 -66.08 -33.81 1.61 0.00 98.39 0.06 0.06 1.47 97.36 1.05 0.00 0.00 0.00 83 K H H 127.36 3.39 19.11 22.92 94.58 47.39 -75.17 -32.38 5.56 0.00 94.44 0.08 0.16 5.63 93.29 0.84 0.00 0.00 0.00 84 Y H H 76.51 12.83 15.22 28.40 102.36 30.31 -103.64 -23.39 16.81 0.02 83.17 0.35 1.12 15.63 82.09 0.77 0.02 0.00 0.01 85 L C C 27.57 18.58 10.49 28.28 113.26 46.68 -118.31 102.50 91.37 0.80 7.83 43.72 40.01 7.51 6.10 1.60 0.00 0.20 0.87 86 A C T 79.56 2.55 17.88 21.01 108.82 -135.56 -65.11 129.47 75.97 0.35 23.67 3.70 4.83 67.58 6.02 17.44 0.00 0.18 0.26 87 G C T 37.89 5.40 17.24 23.68 96.57 17.78 83.37 -4.59 75.26 0.10 24.65 4.17 4.02 67.31 5.93 18.43 0.00 0.05 0.10 88 F H G 24.27 21.48 9.58 29.92 93.65 114.44 -65.41 -29.65 24.06 0.20 75.74 10.85 3.17 8.85 7.61 69.35 0.00 0.11 0.06 89 D H G 102.53 4.39 16.15 22.21 91.43 67.33 -66.16 -21.11 26.47 0.19 73.34 4.00 3.18 17.96 7.24 67.44 0.00 0.10 0.07 90 S H G 84.91 1.70 17.48 18.61 94.03 57.33 -88.51 -1.12 31.77 0.28 67.95 6.65 4.16 19.55 5.14 64.25 0.00 0.16 0.09 91 F C C 46.72 18.23 7.62 24.21 112.33 105.42 -82.92 129.42 82.57 1.99 15.44 58.84 16.88 6.65 5.65 9.68 0.00 0.78 1.52 92 S C C 90.81 1.55 17.01 18.25 104.99 -164.23 -100.11 58.49 87.93 1.52 10.55 49.91 14.72 23.54 4.73 5.48 0.00 0.70 0.92 93 G C S 46.29 5.53 14.31 21.14 108.36 18.62 88.66 -4.23 87.47 0.98 11.55 14.70 42.81 31.39 4.59 5.44 0.01 0.43 0.63 94 D C C 87.85 3.75 17.35 21.61 109.19 64.66 -91.27 111.15 84.27 1.29 14.44 63.61 13.60 6.79 10.75 3.86 0.00 0.48 0.90 95 Y H H 73.26 16.55 11.66 27.61 94.56 -157.00 -65.21 -33.86 10.88 0.06 89.06 5.76 2.44 3.26 87.17 1.30 0.00 0.02 0.03 96 T H H 87.22 2.36 19.63 21.64 92.35 59.08 -63.52 -40.34 4.09 0.02 95.89 1.05 0.50 2.34 94.96 1.12 0.00 0.01 0.01 97 A H H 40.02 4.85 18.46 24.57 91.71 51.17 -64.11 -40.44 2.07 0.01 97.92 0.60 0.22 1.15 96.95 1.08 0.00 0.01 0.00 98 F H H 16.33 19.85 14.06 34.07 91.81 51.19 -64.42 -41.36 0.76 0.00 99.24 0.21 0.07 0.38 98.89 0.45 0.00 0.00 0.00 99 K H H 83.18 11.58 19.14 30.74 91.37 52.92 -62.23 -41.15 0.45 0.00 99.55 0.10 0.03 0.22 99.51 0.12 0.00 0.00 0.00 100 K H H 124.97 1.76 23.48 23.43 91.62 50.55 -64.59 -41.57 0.47 0.00 99.52 0.09 0.03 0.27 99.51 0.10 0.00 0.00 0.00 101 F H H 59.30 11.23 20.40 32.20 91.96 48.92 -64.95 -42.38 0.35 0.00 99.64 0.06 0.02 0.20 99.65 0.06 0.00 0.00 0.00 102 L H H 10.94 22.14 16.89 38.80 91.75 48.95 -64.32 -42.45 0.34 0.00 99.66 0.06 0.02 0.18 99.69 0.05 0.00 0.00 0.00 103 N H H 70.79 6.86 22.13 29.40 91.40 50.55 -63.56 -41.09 0.49 0.00 99.51 0.07 0.03 0.28 99.57 0.05 0.00 0.00 0.00 104 E H H 97.26 2.64 23.80 25.18 91.64 49.57 -64.87 -40.83 0.37 0.00 99.63 0.04 0.02 0.22 99.67 0.05 0.00 0.00 0.00 105 S H H 11.48 14.90 18.09 34.18 91.69 51.02 -63.91 -42.35 0.42 0.00 99.58 0.05 0.03 0.25 99.61 0.07 0.00 0.00 0.00 106 V H H 24.51 16.63 17.97 34.66 91.82 49.95 -64.09 -42.00 0.39 0.00 99.61 0.05 0.03 0.23 99.61 0.08 0.00 0.00 0.00 107 K H H 113.96 2.53 22.06 23.66 91.65 50.72 -63.99 -41.06 0.56 0.00 99.44 0.07 0.04 0.33 99.44 0.11 0.00 0.00 0.00 108 K H H 98.96 3.83 19.50 23.55 91.95 49.98 -64.88 -40.32 1.61 0.00 98.39 0.21 0.11 1.09 98.29 0.30 0.00 0.00 0.00 109 I H H 27.05 15.89 12.95 29.30 92.17 50.97 -65.44 -40.41 2.68 0.01 97.31 0.44 0.23 1.73 96.78 0.81 0.00 0.00 0.00 110 E H H 102.02 7.07 14.83 23.13 92.04 52.29 -64.60 -36.90 7.12 0.02 92.86 1.05 0.58 4.93 91.88 1.54 0.00 0.01 0.01 111 Q H H 138.51 1.07 15.22 15.49 92.90 52.64 -69.05 -29.61 26.27 0.06 73.67 2.65 1.75 20.79 73.08 1.66 0.01 0.02 0.04 112 D C H 91.57 4.56 12.04 18.03 97.16 52.61 -83.89 -10.72 53.29 0.11 46.60 18.82 1.17 29.78 48.90 1.21 0.00 0.04 0.08 113 A C C 47.07 12.86 10.75 23.36 103.11 88.37 -78.87 23.16 99.94 0.01 0.04 99.84 0.05 0.06 0.04 0.00 0.00 0.00 0.00