# 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 117.39 4.92 11.11 17.77 114.60 -159.38 -95.36 128.73 99.89 0.10 0.02 99.78 0.12 0.04 0.01 0.00 0.00 0.04 0.01 1 S C C 76.61 3.71 9.36 14.89 115.21 -153.88 -97.08 135.70 94.22 1.36 4.42 90.34 1.12 3.76 1.76 1.64 0.00 0.71 0.66 2 H C C 137.68 3.36 8.43 13.50 108.71 -155.49 -92.78 93.46 87.32 2.00 10.68 62.45 12.41 12.47 4.10 6.47 0.00 1.09 1.01 3 H C C 134.43 3.32 8.90 13.87 110.46 82.45 -92.58 111.70 82.29 1.92 15.79 54.75 13.85 13.57 6.02 9.83 0.00 1.01 0.97 4 H C C 129.11 3.91 9.14 14.74 111.20 77.96 -93.56 115.71 78.89 1.84 19.27 52.94 13.21 12.47 7.84 11.62 0.00 0.95 0.96 5 H C C 127.17 4.19 9.27 15.15 110.91 77.36 -93.92 116.57 78.18 1.80 20.02 52.30 12.83 12.72 8.69 11.56 0.00 0.92 0.97 6 H C C 128.93 4.04 9.72 15.38 110.45 78.37 -93.16 114.42 78.56 1.73 19.70 51.03 13.68 13.64 8.94 10.88 0.00 0.89 0.93 7 H C C 126.57 4.30 9.90 15.85 110.92 73.29 -95.17 117.26 80.33 1.84 17.83 53.39 13.66 13.11 8.55 9.34 0.00 0.95 0.99 8 H C C 124.98 4.61 10.02 16.29 111.56 -150.00 -94.95 118.63 82.00 2.14 15.86 57.51 13.19 11.14 8.42 7.48 0.00 1.12 1.15 9 H C C 122.03 5.15 9.96 16.72 110.48 -148.98 -94.26 108.08 81.55 1.86 16.60 56.96 12.77 11.65 9.32 7.33 0.00 0.95 1.02 10 S C C 69.12 5.48 10.43 17.47 110.53 94.17 -90.92 119.73 75.94 1.66 22.39 52.25 11.65 11.72 11.22 11.42 0.00 0.85 0.90 11 E C C 130.49 3.82 11.57 16.90 106.24 -149.32 -84.53 50.07 65.66 1.56 32.77 33.22 13.67 18.72 15.48 17.30 0.01 0.79 0.81 12 N C C 100.61 5.08 12.28 18.71 106.68 73.00 -90.02 76.57 63.69 2.42 33.89 36.48 10.67 16.44 15.86 18.16 0.01 1.39 1.00 13 L C C 81.97 9.18 11.24 21.44 108.94 150.45 -89.45 97.13 57.61 5.43 36.97 38.60 9.04 9.66 18.39 19.07 0.01 3.68 1.55 14 Y C C 123.90 7.62 13.42 22.17 111.70 132.11 -96.99 110.30 56.55 10.35 33.10 36.12 9.59 10.61 18.29 15.29 0.06 7.45 2.58 15 F C C 101.92 9.73 11.93 22.51 115.54 -156.90 -100.88 125.29 63.05 11.02 25.93 41.26 11.02 10.39 15.55 10.90 0.05 7.95 2.87 16 Q C C 110.10 6.15 13.15 20.77 114.12 -156.35 -98.25 127.21 74.93 8.40 16.67 51.91 11.86 10.53 11.31 5.88 0.01 6.16 2.34 17 S C C 73.74 5.51 12.86 19.88 113.14 -152.87 -95.35 126.87 80.99 5.64 13.37 43.43 16.80 21.26 7.79 5.28 0.01 3.92 1.51 18 G C C 47.38 5.21 13.94 20.33 112.29 13.93 88.45 3.21 84.12 4.43 11.45 38.53 24.37 22.20 5.22 5.57 0.01 2.66 1.45 19 S C C 56.63 7.58 13.06 21.77 112.91 82.78 -91.92 144.08 78.13 7.53 14.34 55.76 13.24 8.58 8.25 6.37 0.01 4.01 3.79 20 A C C 60.09 9.34 12.35 22.40 99.12 -124.65 -73.77 -14.82 53.26 4.74 42.00 28.06 11.63 14.92 16.94 23.90 0.07 2.65 1.84 21 S C G 74.09 4.63 14.35 20.17 99.10 69.97 -76.65 -15.54 47.77 5.45 46.78 19.84 10.97 18.76 17.37 27.79 0.16 3.34 1.79 22 H C G 121.55 5.64 13.65 20.43 101.87 55.02 -88.53 5.09 47.53 6.68 45.79 19.81 11.90 18.10 16.16 27.54 0.18 4.13 2.18 23 M C T 94.90 8.78 11.46 21.15 105.01 72.14 -89.84 23.72 63.76 7.16 29.09 24.10 16.53 24.84 12.19 15.19 0.19 3.68 3.29 24 G C C 50.85 4.27 13.79 19.37 108.27 -105.71 76.29 17.08 87.02 5.34 7.64 34.34 21.17 32.49 2.35 4.74 0.01 2.72 2.17 25 G C C 47.13 5.54 12.54 19.50 115.11 26.73 97.89 168.36 87.93 6.01 6.06 42.23 26.02 20.09 1.30 4.72 0.00 2.99 2.63 26 S C C 83.00 3.67 13.17 18.19 107.07 -72.97 -90.13 59.11 84.80 7.64 7.57 38.79 24.51 22.35 1.62 5.69 0.01 3.68 3.36 27 G C C 46.45 6.19 14.06 21.29 110.35 0.88 80.20 6.67 87.20 5.34 7.46 31.30 29.09 27.62 1.57 5.50 0.01 2.69 2.22 28 G C C 39.17 8.30 15.44 24.30 115.67 -144.04 66.27 170.89 85.32 7.33 7.35 45.30 26.06 14.55 2.47 4.56 0.01 3.64 3.42 29 L C C 58.89 14.39 12.97 27.14 116.49 -86.00 -91.82 137.88 81.46 11.33 7.21 58.32 17.93 4.44 5.02 2.46 0.02 4.96 6.84 30 N C C 77.62 6.14 18.81 25.32 115.39 -124.12 -82.83 154.65 88.65 3.47 7.88 78.19 7.29 2.68 7.23 1.25 0.00 1.65 1.71 31 D H H 74.95 12.11 14.55 26.62 94.15 -114.20 -62.44 -35.41 11.49 0.16 88.35 5.71 2.63 4.16 85.41 1.95 0.01 0.07 0.07 32 D H H 96.12 3.11 19.12 22.16 92.56 54.33 -65.78 -39.12 5.26 0.09 94.65 1.72 0.81 2.93 92.45 2.00 0.02 0.05 0.03 33 E H H 77.04 8.09 19.11 27.88 92.51 49.88 -66.29 -40.17 2.45 0.08 97.47 0.98 0.34 1.26 95.50 1.85 0.00 0.05 0.01 34 L H H 16.94 19.73 16.03 35.62 91.93 51.01 -64.15 -42.48 1.39 0.06 98.56 0.60 0.19 0.65 97.47 1.04 0.00 0.04 0.01 35 H H H 69.82 12.20 20.52 32.47 91.76 51.32 -63.50 -41.55 1.68 0.06 98.26 0.59 0.19 0.89 97.38 0.88 0.00 0.04 0.01 36 M H H 89.83 4.72 23.91 28.31 91.86 50.14 -64.65 -41.40 2.50 0.08 97.42 0.73 0.27 1.47 96.52 0.93 0.01 0.05 0.02 37 L H H 36.70 14.22 21.53 35.70 91.91 49.49 -65.05 -41.73 3.78 0.09 96.14 1.06 0.44 2.23 95.33 0.84 0.01 0.05 0.03 38 M H H 20.88 21.05 20.47 40.75 92.00 49.91 -65.76 -40.71 8.39 0.18 91.43 3.02 1.00 4.45 90.53 0.83 0.02 0.09 0.07 39 T H H 45.21 11.60 23.17 34.54 92.10 50.94 -64.95 -42.12 10.55 0.28 89.17 3.69 1.38 5.38 88.64 0.66 0.01 0.13 0.11 40 D H H 65.92 6.70 25.31 32.06 92.10 50.04 -65.84 -40.80 6.03 0.11 93.86 2.19 0.85 2.99 93.35 0.52 0.01 0.05 0.04 41 L H H 19.65 18.60 21.83 39.89 92.01 49.67 -64.97 -42.60 2.26 0.04 97.71 0.70 0.32 1.25 97.22 0.46 0.01 0.02 0.01 42 V H H 15.86 20.75 20.99 41.16 91.73 49.82 -64.17 -43.01 1.06 0.02 98.92 0.26 0.12 0.63 98.51 0.44 0.01 0.01 0.00 43 Y H H 98.06 7.81 25.03 32.96 91.75 49.63 -64.08 -42.22 1.00 0.02 98.99 0.19 0.10 0.65 98.46 0.59 0.01 0.01 0.00 44 E H H 70.17 8.36 24.65 33.28 91.93 49.31 -65.10 -41.23 1.87 0.01 98.11 0.23 0.14 1.44 97.14 1.03 0.01 0.01 0.00 45 A H H 6.66 21.22 18.26 39.67 91.79 50.62 -64.53 -41.09 4.14 0.02 95.84 0.34 0.27 3.44 93.91 2.01 0.01 0.01 0.00 46 L H H 44.98 15.59 19.98 35.12 92.04 51.44 -65.69 -35.05 11.40 0.06 88.55 0.90 0.81 9.47 82.68 6.05 0.03 0.03 0.03 47 H H H 115.76 4.12 23.31 27.21 92.87 51.36 -70.30 -30.62 29.42 0.19 70.40 2.23 2.32 24.48 63.75 6.92 0.09 0.09 0.11 48 F H H 70.75 10.96 18.27 29.85 98.45 42.96 -92.32 -9.15 46.59 0.59 52.82 8.16 5.19 32.76 42.45 10.66 0.09 0.27 0.41 49 A C T 19.10 19.97 11.20 30.26 102.64 100.97 -70.20 62.01 74.08 0.73 25.19 27.65 5.27 41.63 16.92 7.70 0.01 0.36 0.46 50 K C T 146.65 2.70 18.83 21.83 96.64 132.23 -85.50 -11.31 82.83 0.56 16.61 17.50 13.79 52.06 7.46 8.52 0.00 0.26 0.40 51 D C S 58.40 8.00 12.45 22.28 114.78 89.60 -88.57 128.42 96.67 1.08 2.25 44.59 50.87 1.17 1.69 0.45 0.00 0.22 1.01 52 E H H 136.90 2.44 14.97 18.67 92.41 -140.02 -61.52 -35.86 6.68 0.01 93.30 0.59 1.19 4.97 91.92 1.30 0.01 0.00 0.01 53 E H H 114.86 2.88 17.78 20.98 91.87 53.99 -64.91 -39.93 5.08 0.01 94.91 0.31 0.38 4.55 93.35 1.39 0.01 0.00 0.01 54 I H H 16.73 18.10 13.58 32.00 92.60 46.90 -67.24 -41.30 2.40 0.02 97.58 0.25 0.19 1.92 96.32 1.30 0.01 0.01 0.00 55 K H H 73.07 13.39 17.26 30.50 91.55 52.89 -61.44 -42.31 0.42 0.00 99.58 0.10 0.04 0.21 99.47 0.18 0.00 0.00 0.00 56 K H H 118.64 2.25 24.00 24.96 91.60 50.05 -64.53 -41.41 0.28 0.00 99.72 0.05 0.02 0.16 99.70 0.07 0.00 0.00 0.00 57 R H H 77.15 11.10 21.95 33.09 91.90 49.07 -65.17 -41.51 0.21 0.00 99.79 0.04 0.01 0.12 99.78 0.05 0.00 0.00 0.00 58 V H H 6.61 23.15 17.80 41.04 91.37 50.27 -63.91 -43.17 0.16 0.00 99.84 0.03 0.01 0.08 99.85 0.03 0.00 0.00 0.00 59 F H H 83.56 8.26 24.08 32.54 91.51 50.28 -63.62 -42.01 0.17 0.00 99.83 0.03 0.01 0.10 99.84 0.02 0.00 0.00 0.00 60 Q H H 83.18 5.00 25.61 30.69 91.55 50.52 -63.91 -41.90 0.21 0.00 99.79 0.02 0.01 0.14 99.79 0.03 0.00 0.00 0.00 61 L H H 10.82 20.96 20.45 41.15 91.47 50.00 -64.24 -42.50 0.19 0.00 99.81 0.01 0.01 0.14 99.80 0.04 0.00 0.00 0.00 62 F H H 37.02 17.97 21.89 39.01 91.55 49.97 -64.24 -42.27 0.21 0.00 99.79 0.02 0.01 0.14 99.79 0.04 0.00 0.00 0.00 63 E H H 98.88 3.68 26.70 29.88 91.50 50.62 -63.75 -41.82 0.36 0.00 99.64 0.03 0.02 0.26 99.63 0.05 0.00 0.00 0.00 64 L H H 36.40 11.78 23.16 35.48 91.76 49.42 -64.60 -41.91 0.45 0.00 99.55 0.04 0.03 0.31 99.51 0.10 0.00 0.00 0.00 65 A H H 4.62 22.67 17.65 40.68 91.25 50.96 -63.32 -42.43 0.66 0.00 99.34 0.09 0.05 0.42 99.25 0.19 0.00 0.00 0.00 66 D H H 61.81 8.04 23.57 31.80 91.55 50.56 -63.65 -41.17 1.96 0.01 98.04 0.25 0.14 1.40 97.59 0.61 0.00 0.00 0.00 67 K H H 102.36 3.02 24.43 26.48 91.92 50.01 -64.98 -41.09 3.91 0.01 96.08 0.41 0.31 3.04 95.05 1.16 0.01 0.01 0.00 68 A H H 9.58 15.69 15.63 32.75 91.97 50.85 -64.58 -41.09 8.10 0.06 91.84 1.43 0.98 5.58 90.07 1.87 0.02 0.03 0.03 69 Y H H 69.31 14.96 15.32 29.96 92.78 51.04 -66.98 -38.36 22.93 0.46 76.60 7.29 3.09 13.21 73.08 2.81 0.04 0.20 0.27 70 K H H 149.03 1.66 18.44 19.68 92.20 54.72 -67.75 -30.80 32.86 0.35 66.79 5.03 4.68 23.44 63.90 2.53 0.08 0.14 0.21 71 N C T 105.88 2.59 16.17 18.96 98.41 38.26 -96.63 3.55 60.77 0.29 38.94 6.21 9.74 43.11 38.49 2.12 0.03 0.10 0.20 72 N C C 87.36 10.63 12.16 23.35 98.57 -127.94 57.33 44.30 84.72 0.77 14.52 34.88 16.59 32.79 13.19 1.83 0.01 0.29 0.44 73 D C C 70.61 4.90 16.58 22.51 112.86 170.10 -87.74 131.00 79.04 0.86 20.10 69.42 4.98 3.13 20.67 1.04 0.00 0.29 0.48 74 R H H 126.93 9.81 14.06 24.61 94.05 -138.25 -62.40 -35.36 5.77 0.03 94.20 1.55 0.92 3.28 92.28 1.93 0.01 0.01 0.01 75 Q H H 119.80 1.59 19.99 20.32 92.06 53.67 -64.41 -40.35 3.56 0.02 96.42 0.62 0.38 2.43 94.46 2.08 0.01 0.01 0.01 76 K H H 70.11 8.84 18.43 28.28 92.11 49.42 -65.92 -40.18 1.92 0.02 98.06 0.53 0.22 1.13 96.12 1.99 0.00 0.01 0.00 77 L H H 9.76 21.97 14.07 36.11 91.64 51.71 -63.69 -42.50 0.83 0.00 99.17 0.23 0.08 0.43 98.73 0.53 0.00 0.00 0.00 78 E H H 91.07 6.20 22.63 29.18 91.50 51.76 -63.25 -41.45 0.39 0.00 99.60 0.09 0.03 0.21 99.56 0.11 0.00 0.00 0.00 79 K H H 108.66 2.84 24.71 26.56 91.66 50.14 -64.42 -41.81 0.25 0.00 99.74 0.04 0.02 0.15 99.73 0.06 0.00 0.00 0.00 80 V H H 10.86 19.10 19.47 38.85 91.65 49.29 -63.99 -43.36 0.18 0.00 99.82 0.02 0.01 0.11 99.81 0.04 0.00 0.00 0.00 81 V H H 19.57 18.68 20.15 38.49 91.47 49.81 -62.99 -42.98 0.13 0.00 99.87 0.02 0.01 0.07 99.88 0.02 0.00 0.00 0.00 82 E H H 101.68 2.93 25.30 27.32 91.46 50.20 -63.76 -41.96 0.13 0.00 99.87 0.01 0.01 0.08 99.88 0.02 0.00 0.00 0.00 83 E H H 70.93 8.22 23.11 31.71 91.79 49.41 -64.92 -41.53 0.17 0.00 99.83 0.01 0.01 0.11 99.84 0.02 0.00 0.00 0.00 84 L H H 8.14 23.34 17.55 40.99 91.56 50.03 -64.07 -42.17 0.16 0.00 99.84 0.01 0.01 0.10 99.86 0.02 0.00 0.00 0.00 85 K H H 86.87 10.98 22.45 33.09 91.33 51.63 -62.72 -41.63 0.16 0.00 99.84 0.02 0.01 0.10 99.86 0.02 0.00 0.00 0.00 86 E H H 100.35 2.69 25.09 26.61 91.60 50.15 -64.26 -41.92 0.20 0.00 99.80 0.02 0.01 0.13 99.80 0.03 0.00 0.00 0.00 87 L H H 24.56 15.63 20.16 36.13 91.92 49.49 -64.23 -42.50 0.21 0.00 99.79 0.02 0.01 0.13 99.78 0.06 0.00 0.00 0.00 88 L H H 22.66 19.37 18.81 37.79 91.60 50.31 -63.37 -42.02 0.33 0.00 99.67 0.04 0.02 0.22 99.61 0.12 0.00 0.00 0.00 89 E H H 98.92 4.49 22.76 27.34 91.67 50.92 -63.77 -41.17 0.86 0.00 99.14 0.08 0.05 0.65 98.90 0.32 0.00 0.00 0.00 90 R H H 106.15 5.91 21.25 27.54 92.12 49.84 -65.61 -40.82 2.34 0.01 97.66 0.23 0.16 1.83 96.96 0.81 0.00 0.00 0.00 91 L H H 30.13 18.02 16.10 33.85 92.27 48.92 -66.37 -39.69 5.63 0.03 94.34 0.55 0.45 4.52 93.29 1.15 0.01 0.01 0.01 92 L H H 67.41 12.63 17.38 29.84 93.78 48.17 -73.15 -29.19 19.14 0.18 80.68 2.19 2.15 14.89 79.07 1.47 0.06 0.07 0.10 93 S C H 74.57 3.06 18.06 21.17 95.87 57.40 -83.14 -10.01 52.87 1.21 45.92 9.67 10.53 32.80 43.63 2.10 0.13 0.45 0.70 94 G C C 46.25 7.25 13.48 21.83 101.20 -111.61 77.34 12.91 89.42 2.23 8.35 34.67 21.63 33.93 4.77 2.91 0.01 1.04 1.03 95 S C C 70.44 5.17 13.84 20.43 108.45 129.07 -88.78 84.82 90.17 4.30 5.53 50.07 22.26 18.19 1.91 3.34 0.00 2.04 2.20 96 G C C 47.28 6.50 14.17 21.65 109.68 -97.49 83.44 12.93 90.19 4.07 5.74 41.20 25.76 23.72 1.36 4.12 0.00 2.00 1.83 97 G C C 42.15 7.84 13.73 22.42 113.32 -110.70 64.56 85.50 88.10 4.47 7.44 41.29 25.43 21.78 1.57 5.69 0.00 2.21 2.02 98 S C C 74.15 5.52 14.31 20.94 106.10 -96.42 -89.71 29.27 82.53 6.42 11.05 40.02 20.91 22.48 2.67 7.88 0.01 3.37 2.67 99 G C C 44.96 6.75 13.53 21.20 107.71 -42.46 68.43 -5.52 81.10 7.01 11.89 39.75 20.52 21.89 3.08 8.22 0.02 3.87 2.65 100 L C C 103.34 6.81 12.32 20.12 105.07 69.18 -83.51 38.66 75.39 10.78 13.82 45.88 16.28 13.71 4.33 9.24 0.03 6.46 4.06 101 E C C 133.42 3.59 12.64 17.67 106.43 88.33 -85.32 59.40 76.94 11.34 11.72 39.76 17.33 20.93 3.73 7.42 0.04 6.82 3.98 102 G C C 51.43 4.38 11.79 17.72 108.05 -40.20 77.08 15.41 85.80 6.90 7.30 40.33 20.75 25.57 1.65 5.38 0.01 3.95 2.37 103 G C C 51.81 4.04 11.08 16.92 112.32 -100.97 91.28 164.69 88.91 6.75 4.33 50.79 19.14 19.26 0.93 3.47 0.00 3.99 2.41 104 G C C 53.12 3.42 11.26 16.40 114.56 -47.27 94.56 172.66 92.85 5.15 2.00 75.03 6.75 11.12 0.48 1.39 0.00 3.27 1.96 105 S C C 84.68 3.24 13.16 17.95 111.50 -81.99 -91.08 129.30 98.69 1.24 0.07 97.90 0.63 0.20 0.03 0.03 0.00 0.81 0.40