# 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 K C C 121.86 5.52 15.18 21.88 111.12 -154.30 -85.59 129.25 99.60 0.09 0.31 99.38 0.15 0.14 0.25 0.01 0.00 0.04 0.02 1 T H H 71.26 6.88 12.75 20.63 109.02 -128.04 -78.18 145.12 48.69 0.95 50.36 44.13 1.27 4.32 47.19 2.26 0.00 0.49 0.33 2 R H H 129.03 7.50 12.58 21.10 96.32 -95.33 -66.92 -36.28 28.06 0.96 70.98 19.16 4.48 6.47 64.52 4.50 0.01 0.54 0.32 3 A H H 58.49 4.51 14.08 19.93 94.00 55.97 -65.75 -38.55 20.67 0.86 78.47 12.94 3.64 5.84 70.66 6.11 0.02 0.54 0.25 4 K H H 113.29 4.23 16.75 21.74 93.84 51.78 -67.87 -36.34 20.12 0.94 78.95 12.33 3.67 5.85 71.52 5.75 0.02 0.57 0.28 5 A H H 32.27 12.39 12.99 26.21 94.69 55.55 -68.85 -34.65 25.49 1.03 73.48 15.98 4.67 6.69 67.49 4.24 0.02 0.56 0.35 6 K H H 112.15 6.81 17.41 24.93 96.24 57.77 -71.67 -32.01 33.25 1.53 65.22 21.24 5.84 7.77 60.39 3.42 0.02 0.83 0.48 7 T H H 70.45 5.73 17.35 23.73 100.51 58.49 -75.96 -27.44 39.79 2.22 57.99 26.48 6.26 8.30 53.34 3.66 0.02 1.28 0.67 8 R H H 105.37 10.07 16.47 26.84 98.53 60.42 -74.14 -26.77 38.29 3.30 58.41 24.67 7.19 8.53 52.28 4.36 0.05 1.94 0.98 9 S H H 34.76 13.84 13.42 27.29 99.90 62.60 -74.46 -29.27 42.27 3.82 53.91 27.89 6.76 9.59 46.86 5.34 0.04 2.37 1.14 10 S H H 69.00 5.73 16.11 22.78 97.28 61.84 -71.20 -29.75 44.43 3.84 51.73 26.10 7.92 12.40 42.24 7.66 0.07 2.37 1.24 11 R H H 146.96 4.60 16.21 21.88 95.11 61.42 -73.00 -21.74 46.81 4.18 49.01 18.07 10.71 20.27 37.05 9.49 0.32 2.44 1.64 12 A C T 40.92 13.10 14.02 27.23 96.71 54.62 -85.47 0.67 68.49 1.48 30.03 10.79 12.05 44.60 21.35 9.41 0.10 0.78 0.92 13 G C T 48.11 4.42 20.11 24.99 97.74 -106.65 82.93 8.04 89.99 1.40 8.61 20.06 16.25 54.22 3.90 4.18 0.00 0.82 0.57 14 L C C 29.16 19.65 11.87 30.93 115.59 129.85 -92.74 131.18 85.33 9.59 5.08 67.56 11.03 6.11 2.57 2.60 0.00 5.77 4.36 15 Q C C 113.45 5.59 21.90 28.13 110.35 -163.71 -99.92 91.03 84.73 11.35 3.91 59.72 20.54 4.32 2.69 1.53 0.01 6.87 4.32 16 F C C 37.03 19.56 15.00 33.89 120.66 127.83 -104.21 133.37 90.45 7.07 2.47 57.07 32.48 1.51 2.40 0.51 0.00 4.21 1.82 17 P C C 50.85 8.90 23.24 32.57 110.62 -112.13 -67.98 138.27 91.30 4.61 4.09 87.23 2.57 1.58 3.68 0.63 0.00 2.75 1.55 18 V H H 35.97 20.32 16.21 35.32 94.25 -124.18 -61.99 -36.12 23.78 0.51 75.71 9.01 4.09 11.88 71.55 2.91 0.06 0.25 0.26 19 G H H 31.23 6.93 21.81 29.33 92.86 56.82 -61.51 -39.67 15.49 0.27 84.24 4.04 2.34 9.57 81.18 2.56 0.06 0.13 0.12 20 R H H 96.95 8.34 23.00 31.41 92.41 51.34 -67.35 -38.68 5.36 0.19 94.45 2.45 0.89 2.42 91.96 2.10 0.01 0.12 0.05 21 V H H 3.93 24.67 17.24 42.04 91.63 52.00 -63.36 -43.65 2.07 0.11 97.82 0.92 0.32 0.98 96.76 0.92 0.01 0.08 0.02 22 H H H 52.69 15.12 20.92 35.53 91.51 51.09 -62.73 -41.96 1.54 0.08 98.38 0.57 0.21 0.81 97.57 0.76 0.01 0.06 0.01 23 R H H 120.49 2.93 24.35 26.40 91.58 50.71 -64.04 -42.20 1.81 0.08 98.11 0.50 0.24 1.11 97.29 0.79 0.02 0.05 0.01 24 L H H 24.10 13.32 18.54 33.06 92.00 49.68 -64.68 -41.97 2.47 0.10 97.42 0.65 0.34 1.56 96.37 0.98 0.02 0.07 0.02 25 L H H 15.08 21.48 14.07 35.17 92.08 50.16 -66.00 -38.78 5.07 0.14 94.79 1.06 0.58 3.50 92.95 1.74 0.04 0.08 0.04 26 R H H 143.64 5.22 18.04 24.40 92.02 52.33 -67.70 -31.99 14.41 0.17 85.42 1.41 1.29 11.83 83.57 1.66 0.08 0.08 0.08 27 K C T 140.18 2.09 17.62 19.43 95.09 48.60 -85.83 -8.45 55.79 0.28 43.93 2.35 4.70 47.21 43.44 1.94 0.07 0.10 0.19 28 G C T 37.80 9.08 14.56 24.27 105.93 -95.41 81.18 12.13 91.91 0.37 7.72 8.01 16.19 67.68 6.11 1.60 0.00 0.16 0.25 29 N C C 78.79 6.45 17.80 25.26 101.87 126.72 -91.21 58.28 84.85 1.04 14.11 55.98 14.66 13.83 11.18 3.22 0.00 0.44 0.69 30 Y H H 33.51 18.81 13.70 32.29 94.89 136.88 -71.53 -30.21 33.55 1.21 65.24 19.19 6.38 10.31 53.47 9.37 0.07 0.60 0.61 31 A H H 32.91 14.92 14.16 29.17 92.07 67.81 -62.78 -34.47 13.60 0.40 86.00 3.88 2.23 7.39 69.50 16.54 0.07 0.25 0.13 32 E H H 146.42 1.41 19.99 20.42 92.63 52.35 -70.00 -30.18 11.30 0.31 88.39 2.06 1.58 7.24 71.78 16.96 0.09 0.20 0.09 33 R H H 120.63 7.55 17.69 25.81 97.00 47.91 -80.08 -31.77 15.18 0.31 84.51 2.11 2.40 10.71 72.62 11.67 0.18 0.16 0.14 34 V H H 31.07 18.20 12.24 29.58 103.19 36.36 -101.98 -13.90 32.66 1.85 65.49 7.76 12.60 16.59 57.00 3.58 0.44 0.58 1.45 35 G C G 34.58 4.57 19.04 24.50 123.04 -131.91 82.80 -167.45 58.40 1.04 40.57 34.90 6.70 14.65 6.28 36.36 0.00 0.52 0.59 36 A C G 82.88 4.52 17.13 22.99 94.87 -35.37 -68.23 -16.84 51.03 0.24 48.73 1.57 4.29 44.32 4.80 44.69 0.01 0.12 0.21 37 G H G 29.78 10.56 18.75 29.78 94.07 53.91 -76.69 -7.99 46.47 0.17 53.36 3.67 3.65 37.83 8.69 45.92 0.01 0.09 0.15 38 A H H 10.69 19.66 17.28 37.32 92.99 100.52 -61.16 -41.71 6.08 0.02 93.89 4.00 1.16 1.27 92.64 0.90 0.00 0.01 0.01 39 P H H 29.47 18.57 21.17 38.69 91.85 52.98 -63.66 -39.49 1.21 0.01 98.78 0.31 0.11 0.65 98.43 0.50 0.00 0.00 0.00 40 V H H 63.28 9.05 26.11 35.28 91.88 50.21 -64.93 -41.81 0.26 0.00 99.74 0.05 0.02 0.14 99.52 0.26 0.00 0.00 0.00 41 Y H H 58.28 14.85 25.46 39.74 91.80 49.33 -64.88 -42.60 0.12 0.00 99.88 0.02 0.01 0.06 99.82 0.08 0.00 0.00 0.00 42 L H H 6.50 24.51 23.50 47.31 91.53 49.62 -64.26 -42.78 0.12 0.00 99.88 0.02 0.01 0.07 99.89 0.02 0.00 0.00 0.00 43 A H H 18.46 16.85 24.56 41.05 91.31 51.45 -62.81 -41.92 0.07 0.00 99.93 0.01 0.00 0.04 99.94 0.01 0.00 0.00 0.00 44 A H H 34.69 8.30 26.81 36.10 91.40 50.74 -63.90 -42.14 0.09 0.00 99.91 0.01 0.00 0.06 99.92 0.01 0.00 0.00 0.00 45 V H H 13.60 19.74 24.11 43.38 91.44 49.64 -64.63 -42.87 0.09 0.00 99.91 0.00 0.00 0.06 99.92 0.01 0.00 0.00 0.00 46 L H H 7.99 23.94 22.32 45.61 91.40 50.75 -63.53 -41.97 0.06 0.00 99.94 0.01 0.00 0.04 99.94 0.01 0.00 0.00 0.00 47 E H H 82.70 10.67 25.39 35.97 91.39 51.47 -63.19 -41.42 0.08 0.00 99.92 0.00 0.00 0.06 99.92 0.02 0.00 0.00 0.00 48 Y H H 87.20 9.33 25.77 35.27 91.84 49.17 -64.96 -41.63 0.10 0.00 99.90 0.00 0.00 0.07 99.90 0.02 0.00 0.00 0.00 49 L H H 11.40 21.42 22.08 43.00 91.31 49.18 -65.27 -42.29 0.20 0.00 99.80 0.01 0.01 0.13 99.82 0.03 0.00 0.00 0.00 50 T H H 20.20 19.53 22.06 40.67 91.69 51.00 -63.43 -41.83 0.37 0.00 99.63 0.04 0.02 0.24 99.65 0.05 0.00 0.00 0.00 51 A H H 42.65 6.79 24.64 31.96 91.50 51.77 -63.71 -41.48 0.33 0.00 99.67 0.03 0.02 0.22 99.65 0.08 0.00 0.00 0.00 52 E H H 66.97 10.06 24.60 34.81 91.67 49.54 -65.51 -41.24 0.47 0.00 99.53 0.05 0.02 0.32 99.48 0.12 0.00 0.00 0.00 53 I H H 6.07 23.97 19.86 43.71 91.28 50.02 -64.18 -43.26 0.51 0.00 99.48 0.08 0.03 0.32 99.40 0.16 0.00 0.00 0.00 54 L H H 46.46 15.34 22.14 36.81 91.55 50.61 -63.28 -41.69 0.90 0.01 99.09 0.15 0.06 0.58 98.86 0.34 0.00 0.01 0.00 55 E H H 111.86 3.35 25.87 29.04 91.66 50.16 -64.48 -40.69 3.29 0.03 96.68 0.41 0.22 2.47 96.14 0.73 0.01 0.01 0.01 56 L H H 34.99 14.28 21.30 35.68 92.18 48.72 -66.80 -39.08 7.96 0.07 91.97 0.99 0.69 6.07 91.15 1.02 0.02 0.03 0.02 57 A H H 12.05 20.26 17.62 37.39 92.72 51.78 -67.71 -34.78 20.59 0.35 79.06 4.07 2.87 13.93 76.66 2.04 0.08 0.15 0.18 58 G H H 30.00 9.98 20.78 30.68 97.98 56.56 -60.03 -41.27 40.41 0.95 58.64 9.93 6.14 25.52 52.33 5.02 0.12 0.48 0.46 59 N H H 95.06 4.80 21.55 26.36 97.54 41.57 -80.24 -18.27 43.02 2.22 54.77 14.08 8.76 21.83 44.09 8.85 0.18 1.44 0.78 60 A H H 33.50 11.54 16.21 28.61 97.22 67.23 -74.57 -25.04 41.94 6.19 51.86 19.12 8.49 16.35 39.96 9.99 0.20 4.48 1.41 61 A C H 32.63 13.31 13.08 26.82 101.30 66.21 -78.74 -4.48 47.13 9.64 43.23 26.57 8.46 14.03 33.37 8.31 0.17 6.90 2.19 62 R C H 142.84 4.69 14.68 20.59 103.64 87.21 -82.92 5.82 55.01 9.99 35.00 26.39 11.66 18.32 27.62 6.42 0.42 6.50 2.67 63 D C T 103.59 3.28 13.50 17.76 102.92 47.63 -85.74 38.06 72.48 3.66 23.85 26.85 16.95 29.14 18.05 5.51 0.07 2.16 1.26 64 N C T 96.58 5.72 11.47 18.56 103.46 39.73 -83.08 45.81 82.22 1.24 16.54 29.64 19.57 33.42 10.38 5.75 0.01 0.57 0.67 65 K C C 141.15 3.92 12.73 18.01 99.22 126.09 -74.68 3.57 76.95 1.97 21.08 30.22 21.07 26.18 12.53 8.03 0.02 0.96 0.98 66 K C C 119.74 5.94 14.07 21.17 104.44 83.96 -89.08 32.71 69.36 5.74 24.90 35.09 17.90 16.91 15.46 9.15 0.06 3.48 1.95 67 T C C 62.66 11.10 14.37 25.89 109.11 97.21 -94.10 85.72 65.41 10.63 23.96 42.05 13.01 10.22 15.89 8.56 0.05 7.84 2.39 68 R C C 111.72 9.48 20.01 29.50 114.01 87.46 -96.56 127.67 61.90 16.51 21.59 38.56 15.28 8.23 15.25 6.92 0.08 12.42 3.27 69 I C C 25.63 20.98 15.05 35.40 112.39 -128.63 -91.75 118.50 62.65 21.04 16.30 45.63 12.46 3.95 13.13 3.99 0.05 12.23 8.56 70 I C C 53.02 10.62 21.85 32.85 118.68 -152.78 -91.83 144.61 83.03 2.34 14.63 74.10 6.29 1.28 15.81 0.66 0.00 1.29 0.57 71 P H H 51.08 14.38 16.83 31.12 92.82 -115.46 -58.22 -38.22 9.44 0.21 90.35 4.40 1.34 4.00 88.36 1.71 0.01 0.13 0.06 72 R H H 136.60 3.89 22.65 26.79 91.85 53.23 -64.13 -38.56 4.30 0.07 95.63 1.21 0.50 2.55 93.85 1.81 0.01 0.05 0.02 73 H H H 45.00 15.17 20.32 35.19 92.28 49.57 -66.21 -40.59 1.92 0.04 98.03 0.69 0.24 1.00 96.11 1.93 0.00 0.03 0.00 74 L H H 6.49 24.06 17.95 41.97 91.59 50.74 -64.20 -42.50 1.17 0.03 98.80 0.44 0.14 0.57 98.00 0.82 0.00 0.01 0.00 75 Q H H 73.48 10.52 23.61 34.00 91.50 51.66 -63.10 -41.74 1.30 0.03 98.68 0.35 0.13 0.77 98.14 0.59 0.00 0.02 0.00 76 L H H 53.33 6.49 24.17 31.34 91.50 50.52 -63.90 -42.22 1.51 0.03 98.45 0.32 0.16 0.97 97.77 0.74 0.00 0.02 0.00 77 A H H 7.09 18.03 18.16 37.09 91.67 50.62 -64.03 -42.03 2.25 0.06 97.70 0.58 0.25 1.36 96.75 1.01 0.01 0.03 0.01 78 V H H 22.40 18.67 17.63 35.92 92.81 47.90 -67.26 -38.73 4.85 0.08 95.08 0.70 0.46 3.60 93.43 1.73 0.02 0.04 0.02 79 R H H 140.76 4.58 20.89 25.91 92.99 51.10 -69.31 -29.79 15.31 0.07 84.62 0.81 1.11 13.31 83.36 1.30 0.05 0.03 0.04 80 N C T 88.73 5.63 17.70 23.86 101.94 31.17 -106.19 13.44 65.25 0.26 34.49 12.73 7.44 43.36 34.49 1.71 0.02 0.09 0.17 81 D H H 51.53 15.90 11.19 26.11 101.49 150.74 -70.94 53.53 49.15 0.37 50.48 41.40 4.56 3.15 48.69 1.87 0.00 0.11 0.21 82 E H H 134.31 1.98 18.60 20.47 93.60 66.97 -65.23 -38.88 6.03 0.05 93.92 1.30 0.81 3.85 90.25 3.74 0.01 0.02 0.02 83 E H H 87.67 6.01 18.76 25.56 92.38 50.35 -65.80 -40.36 3.35 0.06 96.59 0.86 0.36 2.13 93.08 3.50 0.01 0.04 0.01 84 L H H 6.93 22.69 12.49 35.25 91.73 50.70 -64.01 -42.07 1.89 0.05 98.06 0.57 0.23 1.07 95.16 2.91 0.00 0.04 0.01 85 N H H 64.03 11.56 17.19 29.13 91.23 53.17 -63.61 -37.68 2.58 0.05 97.37 0.61 0.26 1.64 94.71 2.71 0.01 0.04 0.01 86 K H H 141.46 1.59 21.86 22.25 92.08 52.58 -66.13 -38.35 4.78 0.06 95.16 0.42 0.35 4.07 91.67 3.40 0.02 0.04 0.02 87 L H H 43.57 14.55 17.64 32.07 94.66 45.16 -72.25 -38.53 7.47 0.10 92.43 0.46 0.62 6.65 90.06 2.06 0.06 0.05 0.04 88 L H H 18.32 21.11 14.45 34.93 97.88 37.79 -91.59 -15.03 28.16 1.39 70.44 4.96 5.17 19.67 66.14 2.43 0.30 0.62 0.71 89 G C T 37.53 5.30 19.99 26.13 111.21 -144.21 69.53 -134.75 78.63 3.26 18.12 18.56 15.00 45.01 12.55 5.68 0.06 2.08 1.06 90 R C T 152.22 4.31 20.27 25.24 116.17 -6.46 -96.95 119.46 72.16 10.92 16.93 22.70 16.92 33.85 9.19 6.93 0.13 8.67 1.61 91 V C C 30.24 20.43 12.35 31.87 118.65 127.69 -105.67 132.35 66.89 22.32 10.80 54.98 7.91 3.12 7.71 3.51 0.02 20.45 2.29 92 T E E 69.68 6.76 23.05 30.17 119.09 -167.89 -110.83 131.63 43.29 47.89 8.82 37.31 2.91 1.75 7.14 2.32 0.02 43.76 4.78 93 I E E 43.54 18.91 14.45 32.37 111.81 -155.63 -96.49 115.69 37.09 48.86 14.05 29.42 4.17 2.94 10.51 4.49 0.06 43.95 4.44 94 A C C 52.23 9.75 16.80 26.81 102.47 132.83 -80.17 -32.40 46.05 28.70 25.25 27.01 8.95 12.34 8.85 14.88 0.10 25.53 2.34 95 Q C T 127.10 4.02 17.82 22.33 103.59 27.02 -91.79 33.04 56.23 16.93 26.84 15.15 13.17 30.86 6.63 17.95 0.30 13.31 2.62 96 G C T 39.07 8.69 17.06 26.05 108.48 -35.46 87.99 2.48 73.20 6.08 20.71 16.06 17.91 40.44 4.03 15.61 0.05 4.23 1.67 97 G C C 26.63 12.88 17.39 29.98 115.99 -91.29 94.60 36.90 77.41 16.20 6.39 31.90 23.47 23.90 1.67 4.29 0.03 12.22 2.52 98 V C C 51.22 15.23 17.39 32.28 121.08 -88.79 -106.71 135.95 58.20 37.87 3.92 38.30 15.11 3.72 2.51 1.90 0.09 19.81 18.57 99 L C C 35.67 16.66 15.37 32.16 112.23 -127.39 -87.82 123.81 83.78 11.87 4.35 71.74 9.39 2.25 3.15 1.47 0.00 9.24 2.76 100 P C T 76.54 7.18 17.76 25.79 103.99 -123.07 -62.91 139.47 64.68 5.35 29.97 16.04 8.82 39.32 19.93 10.38 0.16 4.06 1.30 101 N C T 104.13 4.69 19.24 24.52 95.59 25.46 -7.64 13.76 63.53 3.22 33.25 15.65 7.81 39.51 22.78 10.87 0.12 2.21 1.04 102 I H H 20.51 20.81 13.48 33.58 95.93 96.04 -75.99 -25.78 34.78 5.22 60.00 21.16 5.66 9.03 39.66 19.37 0.07 3.88 1.17 103 Q H H 76.90 14.48 15.74 29.61 92.72 71.57 -62.89 -36.76 18.24 3.92 77.84 9.02 3.14 6.55 48.61 28.77 0.06 3.35 0.51 104 S H H 70.06 3.96 18.67 23.32 92.44 59.13 -69.40 -24.18 15.58 2.39 82.02 5.12 2.49 7.34 48.27 34.32 0.09 2.09 0.28 105 V H H 60.35 11.15 16.95 28.47 95.12 54.15 -78.89 -25.08 22.88 3.19 73.93 5.60 3.63 12.37 45.53 29.47 0.24 2.63 0.53 106 L H H 39.62 18.06 14.53 31.60 99.08 50.89 -89.11 -15.48 40.95 7.27 51.78 11.02 10.10 21.38 32.72 16.48 1.17 4.64 2.49 107 L C S 60.26 12.86 12.81 26.24 116.25 82.41 -96.99 127.97 94.68 4.26 1.06 27.89 65.51 1.79 0.66 0.36 0.00 2.52 1.29 108 P C C 75.35 7.06 12.05 20.79 113.17 -116.81 -67.75 147.68 96.19 3.06 0.75 93.29 1.19 2.02 0.31 0.27 0.00 2.00 0.92 109 K C C 155.02 2.88 13.79 18.47 108.88 -112.93 -77.09 127.03 99.86 0.11 0.03 99.74 0.11 0.06 0.01 0.00 0.00 0.05 0.02