# 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 98.96 5.35 12.89 19.34 105.21 -135.62 -76.78 98.70 99.35 0.23 0.42 99.17 0.15 0.15 0.35 0.02 0.00 0.10 0.06 1 I H H 99.84 3.68 10.94 15.97 95.19 92.81 -66.93 -38.42 32.19 0.90 66.91 29.36 1.08 3.49 63.49 1.80 0.00 0.43 0.35 2 L H H 104.14 2.53 11.01 14.57 93.70 54.80 -66.06 -38.55 14.52 0.37 85.11 8.61 2.05 4.71 80.52 3.77 0.01 0.21 0.12 3 Q H H 107.95 2.23 12.44 15.35 93.25 52.46 -66.99 -38.37 8.53 0.28 91.19 4.38 1.28 3.36 85.69 5.01 0.01 0.19 0.08 4 R H H 126.86 3.26 12.92 17.23 93.25 52.01 -66.92 -39.52 6.36 0.24 93.40 3.00 1.01 2.79 88.29 4.66 0.01 0.16 0.06 5 L H H 85.43 4.65 12.98 18.76 93.00 51.73 -65.58 -40.11 5.28 0.20 94.52 2.40 0.82 2.42 91.14 3.04 0.01 0.13 0.04 6 F H H 121.74 2.73 14.66 17.91 93.16 50.06 -66.57 -39.29 6.47 0.18 93.35 2.58 0.94 3.16 90.51 2.63 0.01 0.11 0.05 7 R H H 137.85 2.43 15.65 18.28 93.31 50.81 -67.12 -39.37 10.12 0.17 89.71 2.73 1.25 6.26 87.12 2.45 0.03 0.09 0.06 8 L H H 78.05 5.52 15.04 21.52 93.70 49.65 -67.68 -39.16 10.93 0.14 88.94 3.06 1.56 6.43 86.91 1.90 0.02 0.07 0.06 9 S H H 48.98 6.27 14.91 22.47 93.03 53.56 -64.81 -40.50 6.81 0.11 93.08 3.37 0.95 2.44 92.24 0.92 0.00 0.05 0.03 10 S H H 60.43 3.03 17.07 20.38 92.56 51.54 -65.79 -39.70 4.40 0.09 95.51 1.56 0.61 2.25 94.54 0.96 0.01 0.05 0.02 11 V H H 78.75 3.81 17.17 21.43 92.40 49.69 -65.78 -41.15 3.17 0.11 96.72 1.12 0.44 1.65 95.85 0.83 0.01 0.07 0.02 12 V H H 60.96 7.98 15.51 24.58 92.29 50.07 -64.92 -41.86 2.31 0.08 97.61 0.85 0.33 1.14 96.82 0.79 0.01 0.05 0.01 13 Q H H 97.30 5.39 17.03 23.30 92.13 51.49 -64.24 -39.88 3.26 0.08 96.66 0.96 0.35 1.90 95.64 1.07 0.01 0.05 0.01 14 S H H 65.03 2.71 17.87 20.50 92.41 50.46 -66.68 -38.10 6.69 0.08 93.22 1.22 0.63 4.71 91.97 1.37 0.02 0.05 0.02 15 A H H 48.25 6.31 15.97 23.46 94.28 52.11 -67.58 -38.77 10.12 0.18 89.69 3.07 1.49 5.66 87.82 1.77 0.03 0.10 0.06 16 I H H 68.73 9.17 15.06 24.99 95.19 52.54 -67.55 -38.61 15.34 0.71 83.95 6.99 2.63 6.49 80.48 2.75 0.04 0.42 0.20 17 S H H 57.70 5.22 16.19 22.23 95.06 54.05 -67.25 -38.12 17.89 0.91 81.20 9.21 2.41 7.25 75.88 4.32 0.03 0.70 0.20 18 V H H 85.14 3.32 16.39 20.07 94.39 52.23 -68.15 -38.49 14.48 1.15 84.37 6.08 2.61 6.93 75.38 7.68 0.09 0.99 0.24 19 S H H 54.60 6.51 15.37 22.81 94.11 52.08 -68.74 -37.60 17.29 1.42 81.29 6.57 2.90 8.78 72.05 8.04 0.11 1.23 0.32 20 L H H 73.36 9.77 13.14 23.46 95.57 53.72 -73.84 -27.76 26.33 2.17 71.50 10.71 4.78 12.47 60.89 8.72 0.17 1.65 0.61 21 R H H 141.28 4.90 14.86 20.88 96.83 64.42 -74.65 -24.99 38.58 3.36 58.06 18.57 7.10 15.13 49.47 6.34 0.16 2.17 1.08 22 R C H 148.02 3.79 15.05 19.81 98.53 60.76 -80.84 -17.67 55.68 2.96 41.36 21.01 13.62 21.85 35.30 5.33 0.17 1.66 1.05 23 N C C 76.81 8.10 13.04 22.13 108.84 51.18 -102.64 88.98 73.08 2.70 24.22 42.30 11.49 18.47 20.67 4.53 0.02 1.52 1.01 24 I C C 88.50 9.30 13.03 23.09 97.70 130.29 -76.15 -14.13 58.91 4.59 36.51 29.05 11.23 19.39 27.45 8.38 0.13 2.64 1.73 25 G C H 42.13 5.84 15.42 22.16 97.06 61.46 -69.06 -36.42 56.97 4.09 38.94 21.74 12.26 23.84 27.49 10.55 0.23 2.54 1.35 26 V C H 83.73 5.93 15.18 22.03 99.30 49.35 -80.78 -25.19 52.09 5.66 42.25 24.24 12.72 16.84 30.69 10.01 0.24 3.54 1.71 27 T H H 58.61 8.67 14.03 23.79 100.88 60.10 -77.34 -33.30 43.55 5.20 51.25 26.03 10.23 9.73 41.21 7.89 0.12 3.24 1.55 28 A H H 48.25 7.71 13.77 22.86 95.60 58.64 -67.56 -38.63 19.52 1.79 78.69 8.93 4.38 7.83 62.37 14.59 0.12 1.35 0.42 29 V H H 76.32 5.68 14.70 21.61 94.88 53.80 -68.03 -36.17 15.19 1.52 83.29 5.42 2.68 7.28 63.89 19.05 0.11 1.27 0.29 30 A H H 54.62 6.77 13.74 21.76 94.16 54.51 -70.49 -29.70 16.77 0.99 82.24 4.71 2.71 8.91 62.34 20.24 0.13 0.72 0.25 31 F H H 114.19 6.61 12.82 20.66 98.10 52.79 -84.61 -8.14 33.81 1.23 64.96 9.36 7.00 18.60 50.29 13.28 0.24 0.63 0.61 32 N C C 88.16 6.91 11.52 19.74 102.59 76.32 -87.82 41.93 68.30 1.37 30.33 35.90 10.54 22.61 23.47 6.02 0.01 0.57 0.87 33 K C T 136.96 3.72 12.15 17.55 104.76 117.97 -82.33 26.58 81.57 0.97 17.46 26.75 27.02 28.31 10.15 6.71 0.01 0.38 0.67 34 E C C 150.92 1.56 14.12 16.08 106.93 22.94 -86.66 85.04 86.70 1.51 11.79 47.83 17.13 21.97 5.86 5.63 0.00 0.74 0.85 35 L C C 58.87 13.93 7.82 21.24 119.91 105.45 -93.69 145.69 94.63 1.50 3.86 67.04 24.28 3.05 2.48 1.29 0.00 0.47 1.40 36 D C C 70.66 5.01 14.89 21.21 114.16 -106.57 -71.17 144.68 99.21 0.27 0.52 96.31 2.76 0.17 0.44 0.04 0.00 0.08 0.20 37 P H H 85.44 4.67 15.33 21.39 92.06 -116.16 -58.33 -36.79 2.70 0.01 97.29 0.48 0.28 1.67 97.01 0.55 0.00 0.00 0.00 38 V H H 62.66 8.67 16.71 25.98 92.31 52.61 -64.98 -40.48 1.15 0.00 98.85 0.14 0.09 0.78 98.42 0.56 0.00 0.00 0.00 39 Q H H 49.01 13.11 16.32 29.90 91.93 49.49 -65.49 -40.50 0.36 0.00 99.64 0.08 0.03 0.19 99.27 0.43 0.00 0.00 0.00 40 K H H 91.96 7.86 18.80 27.42 91.71 51.59 -63.71 -41.01 0.26 0.00 99.73 0.06 0.02 0.14 99.63 0.15 0.00 0.00 0.00 41 L H H 69.56 5.58 20.56 26.50 91.85 50.08 -64.72 -41.90 0.34 0.00 99.66 0.05 0.02 0.21 99.64 0.07 0.00 0.00 0.00 42 F H H 50.62 12.40 19.48 32.40 91.97 49.29 -64.33 -43.15 0.30 0.00 99.70 0.04 0.01 0.19 99.71 0.05 0.00 0.00 0.00 43 V H H 28.64 13.81 18.31 32.85 91.79 49.50 -64.01 -42.61 0.17 0.00 99.83 0.02 0.01 0.10 99.84 0.03 0.00 0.00 0.00 44 D H H 69.19 4.30 22.05 26.33 91.41 50.50 -63.75 -41.15 0.20 0.00 99.80 0.02 0.01 0.12 99.82 0.03 0.00 0.00 0.00 45 K H H 87.14 6.42 21.05 27.86 91.94 50.03 -64.99 -41.31 0.33 0.00 99.66 0.03 0.02 0.23 99.68 0.04 0.00 0.00 0.00 46 I H H 26.91 15.34 17.01 32.98 92.01 49.97 -64.50 -42.07 0.34 0.00 99.66 0.03 0.02 0.23 99.66 0.07 0.00 0.00 0.00 47 R H H 105.59 6.84 20.01 27.49 91.76 51.34 -63.40 -41.51 0.68 0.00 99.32 0.07 0.04 0.49 99.18 0.23 0.00 0.00 0.00 48 E H H 100.63 2.52 21.09 22.63 91.54 49.83 -64.61 -41.16 1.83 0.00 98.16 0.18 0.11 1.40 97.84 0.47 0.00 0.00 0.00 49 Y H H 60.38 10.39 16.31 28.05 91.98 50.40 -65.24 -40.85 2.32 0.01 97.67 0.36 0.21 1.53 97.12 0.78 0.00 0.00 0.00 50 R H H 95.63 10.14 16.19 26.93 91.96 52.16 -64.87 -39.70 4.05 0.03 95.92 0.83 0.42 2.55 94.73 1.44 0.01 0.02 0.01 51 T H H 76.37 2.49 17.71 19.84 92.41 51.09 -66.25 -38.87 9.29 0.09 90.62 1.64 1.08 6.39 88.13 2.65 0.03 0.04 0.04 52 K H H 111.10 3.54 15.84 20.02 93.33 51.56 -68.84 -35.81 18.29 0.34 81.38 4.36 2.93 11.60 76.99 3.72 0.08 0.16 0.16 53 R H H 93.13 9.75 11.51 22.12 95.11 54.93 -70.93 -31.89 30.67 1.53 67.80 14.56 5.46 12.88 61.36 4.21 0.08 0.78 0.67 54 Q H H 120.95 3.56 13.13 18.03 95.38 59.93 -71.48 -29.33 41.66 2.16 56.17 21.63 7.23 14.95 49.79 4.31 0.07 1.12 0.89 55 T C H 105.97 1.66 12.48 14.50 98.76 56.95 -81.99 -19.37 53.10 2.31 44.60 16.95 12.60 25.37 37.65 5.03 0.19 1.08 1.13 56 S C T 76.16 3.32 10.93 15.53 101.19 44.64 -92.25 1.19 76.50 0.95 22.55 15.76 16.31 44.25 18.03 4.56 0.04 0.41 0.64 57 G C T 57.96 1.98 13.09 15.93 101.06 -102.25 83.27 5.47 96.29 0.66 3.04 24.34 31.31 40.93 0.90 1.85 0.00 0.33 0.33 58 G C C 30.61 7.69 12.28 21.29 127.63 126.70 -102.51 173.46 96.73 2.69 0.58 52.01 42.70 2.36 0.15 0.40 0.00 1.32 1.06 59 P C C 80.42 6.85 15.09 23.00 110.86 -65.59 -69.71 143.80 91.22 6.99 1.79 77.05 10.22 3.46 0.56 1.30 0.00 3.13 4.27 60 V C C 69.74 12.32 12.79 25.20 108.04 -151.79 -91.30 79.95 91.17 4.96 3.88 44.06 26.89 20.52 0.84 3.07 0.00 2.47 2.14 61 D C C 87.61 6.42 16.89 24.24 111.04 -120.92 -95.02 108.35 91.84 3.99 4.18 46.03 23.76 22.28 0.96 3.20 0.00 2.03 1.74 62 A C C 44.72 12.29 12.78 25.56 102.65 158.37 -92.67 11.26 93.50 2.42 4.08 69.12 18.26 5.73 1.67 2.32 0.00 0.96 1.95 63 G C C 24.70 7.28 15.02 23.71 124.79 132.97 -84.61 174.73 96.24 0.68 3.09 71.34 23.56 0.85 3.23 0.27 0.00 0.16 0.60 64 P H H 96.97 2.56 14.91 18.06 93.52 -74.28 -62.52 -35.43 6.81 0.03 93.16 1.54 1.10 4.10 91.71 1.51 0.01 0.01 0.01 65 E H H 123.20 1.96 16.61 18.41 92.16 53.50 -64.77 -39.35 3.67 0.02 96.31 0.72 0.38 2.41 95.02 1.45 0.01 0.01 0.01 66 Y H H 49.30 13.15 13.02 27.03 92.23 49.70 -66.20 -40.68 1.26 0.01 98.73 0.39 0.14 0.66 97.71 1.09 0.00 0.00 0.00 67 Q H H 72.68 9.55 15.71 26.21 91.67 51.98 -63.23 -41.38 0.50 0.00 99.50 0.16 0.05 0.23 99.39 0.18 0.00 0.00 0.00 68 Q H H 102.90 1.82 20.32 20.59 91.73 50.15 -64.07 -41.86 0.32 0.00 99.68 0.06 0.02 0.17 99.69 0.06 0.00 0.00 0.00 69 D H H 65.48 4.99 19.03 24.80 91.86 49.06 -64.97 -41.00 0.30 0.00 99.70 0.05 0.02 0.17 99.73 0.04 0.00 0.00 0.00 70 L H H 26.03 16.22 14.79 31.41 91.90 50.51 -64.26 -41.36 0.18 0.00 99.82 0.03 0.01 0.10 99.84 0.03 0.00 0.00 0.00 71 D H H 75.11 5.38 19.48 25.59 91.58 51.37 -63.65 -40.90 0.13 0.00 99.87 0.01 0.00 0.07 99.89 0.02 0.00 0.00 0.00 72 R H H 135.64 1.68 21.39 21.21 91.88 49.60 -64.62 -41.62 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.01 0.00 0.00 0.00 73 E H H 56.31 10.18 18.15 29.36 92.08 49.68 -64.86 -41.68 0.11 0.00 99.89 0.01 0.00 0.07 99.90 0.02 0.00 0.00 0.00 74 L H H 35.31 14.73 16.09 31.26 91.97 50.43 -63.90 -41.76 0.34 0.00 99.66 0.02 0.01 0.25 99.68 0.04 0.00 0.00 0.00 75 F H H 108.06 2.78 20.77 22.91 91.53 50.67 -64.11 -41.29 0.66 0.00 99.34 0.06 0.03 0.46 99.37 0.08 0.00 0.00 0.00 76 K H H 101.77 3.22 20.28 23.27 91.77 50.33 -64.75 -41.66 0.37 0.00 99.63 0.04 0.02 0.26 99.48 0.20 0.00 0.00 0.00 77 L H H 23.46 14.85 14.02 29.92 92.03 50.55 -64.68 -41.53 0.31 0.00 99.69 0.03 0.02 0.22 99.32 0.41 0.00 0.00 0.00 78 K H H 90.67 9.01 15.20 25.11 91.77 52.32 -63.87 -39.15 0.39 0.00 99.61 0.04 0.02 0.28 99.24 0.43 0.00 0.00 0.00 79 Q H H 131.31 1.16 17.20 17.10 92.37 50.77 -66.32 -38.21 1.13 0.00 98.87 0.06 0.05 0.98 98.26 0.65 0.00 0.00 0.00 80 M H H 99.43 5.38 15.28 21.64 95.16 43.53 -73.59 -36.57 3.12 0.01 96.87 0.08 0.15 2.99 96.34 0.42 0.01 0.00 0.00 81 Y H H 74.19 11.61 10.36 22.70 101.36 33.56 -105.01 -4.57 25.02 0.22 74.76 1.72 3.90 19.83 73.26 0.93 0.11 0.06 0.18 82 G C T 48.49 2.67 13.63 17.51 109.40 -130.23 67.77 -128.08 90.70 0.34 8.96 14.26 11.82 64.32 2.42 6.79 0.00 0.18 0.21 83 K C T 174.10 1.00 13.70 14.22 98.39 -15.28 -78.79 9.18 87.96 0.54 11.50 9.12 27.07 51.10 1.37 10.75 0.00 0.27 0.33 84 A C S 50.28 7.52 9.32 18.57 119.43 110.41 -85.27 152.08 89.60 1.16 9.24 27.17 50.94 10.58 0.99 9.01 0.00 0.52 0.78 85 D C C 89.47 3.66 15.47 20.02 108.66 -113.03 -84.11 114.91 92.75 1.66 5.58 84.39 3.97 3.99 0.94 4.93 0.00 0.71 1.07 86 M C G 67.73 15.29 9.16 24.03 95.47 -167.58 -77.20 -9.00 55.55 0.90 43.55 17.83 7.36 25.88 1.25 46.93 0.00 0.48 0.26 87 N C G 115.95 2.96 15.01 18.96 93.39 71.62 -79.04 -10.01 56.20 0.56 43.24 6.35 7.70 37.34 1.11 47.00 0.00 0.31 0.18 88 T C G 92.83 2.69 15.10 18.55 109.23 69.83 -95.04 80.85 55.42 1.08 43.50 20.53 13.23 17.16 1.21 46.95 0.00 0.55 0.36 89 F C S 82.02 14.36 8.73 22.48 118.20 127.53 -88.80 139.10 97.52 1.24 1.24 41.04 55.21 1.39 0.32 0.72 0.00 0.40 0.93 90 P C C 62.23 8.58 12.32 22.29 114.30 -103.77 -68.62 149.41 98.16 0.65 1.19 84.07 9.34 4.59 0.18 1.15 0.00 0.36 0.31 91 N C C 127.82 1.73 15.31 17.64 110.56 -122.54 -85.25 125.71 96.36 2.74 0.91 86.27 6.50 3.46 0.15 0.89 0.00 1.52 1.22 92 F C C 82.35 13.28 8.37 21.45 124.33 -171.74 -115.21 142.57 92.49 7.28 0.24 90.26 2.67 0.30 0.07 0.14 0.00 4.56 2.01 93 T C C 101.95 2.03 15.59 18.42 118.96 -157.16 -113.83 131.49 90.45 9.33 0.22 89.30 1.84 0.28 0.07 0.12 0.00 5.68 2.71 94 F C C 84.70 12.80 7.73 20.44 118.50 -154.52 -102.93 132.00 86.45 12.54 1.02 82.07 3.58 0.91 0.36 0.58 0.00 6.06 6.43 95 E C C 144.33 1.58 13.53 15.53 114.65 -148.73 -90.66 143.08 96.61 2.77 0.62 60.62 33.88 2.33 0.14 0.51 0.00 1.69 0.84 96 D C S 117.93 2.14 13.48 16.45 105.48 -7.51 -72.57 92.02 98.35 1.45 0.20 44.61 52.91 1.08 0.03 0.16 0.00 0.83 0.37 97 P C C 55.66 13.09 7.61 20.62 115.87 -143.72 -69.72 146.06 97.81 1.39 0.79 93.20 2.98 1.83 0.16 0.56 0.00 0.93 0.34 98 K C C 155.31 1.63 14.80 16.82 114.15 -143.03 -99.94 126.22 90.42 8.75 0.84 81.32 6.70 2.22 0.24 0.63 0.00 5.27 3.61 99 F C C 108.81 10.19 7.81 18.50 120.15 -164.38 -107.63 137.54 87.68 11.35 0.98 77.40 8.79 1.38 0.32 0.67 0.00 8.52 2.92 100 E C C 136.25 2.07 12.34 15.48 117.58 -153.04 -102.91 134.43 85.03 13.18 1.79 76.97 6.25 1.57 0.54 1.14 0.00 11.65 1.88 101 V C C 101.39 5.06 9.29 16.27 113.72 -121.97 -83.34 131.00 77.44 16.26 6.30 68.50 5.21 3.48 1.82 4.32 0.00 13.65 3.02 102 V C C 94.64 4.78 8.42 14.94 110.84 -162.18 -97.86 122.83 86.09 7.45 6.45 64.29 13.40 7.98 1.34 5.50 0.00 5.89 1.59 103 E C C 150.50 1.48 10.43 12.93 114.38 -115.07 -94.02 130.13 89.30 5.29 5.41 63.61 17.25 8.13 0.97 4.85 0.00 3.69 1.50 104 K C C 136.00 4.15 7.83 14.11 116.22 -142.10 -95.00 132.08 97.61 1.90 0.49 69.06 27.65 1.12 0.16 0.31 0.00 1.06 0.64 105 P C C 96.01 3.47 8.21 13.68 110.07 -112.36 -67.76 146.35 97.82 0.95 1.24 86.44 5.84 5.59 0.30 0.88 0.00 0.59 0.35 106 Q C C 149.49 1.26 8.33 10.75 108.32 -117.06 -83.29 118.41 98.11 0.77 1.12 91.62 1.38 5.39 0.28 0.57 0.00 0.40 0.36 107 S C C 85.85 2.58 9.60 13.87 112.07 -127.75 -92.97 130.69 99.91 0.08 0.02 99.71 0.15 0.08 0.01 0.00 0.00 0.04 0.01