# 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 S C C 71.17 4.56 13.47 19.37 115.98 -155.21 -100.24 138.82 99.71 0.14 0.15 99.53 0.16 0.12 0.08 0.01 0.00 0.07 0.03 1 L C C 101.17 6.38 9.18 16.81 105.79 -155.82 -90.05 48.36 61.66 1.93 36.41 52.66 1.96 8.05 28.56 6.82 0.00 1.21 0.73 2 E C C 130.37 2.81 10.84 15.09 105.61 114.49 -83.73 78.60 54.02 4.68 41.30 34.78 8.72 10.83 30.32 10.85 0.03 3.19 1.27 3 V H H 87.40 5.60 9.52 16.52 106.19 117.60 -87.35 66.65 44.20 7.95 47.85 29.17 7.48 8.09 33.44 14.12 0.06 6.09 1.56 4 L H H 104.95 4.07 11.38 16.80 104.73 114.77 -84.38 19.32 45.12 9.36 45.51 30.51 6.99 8.09 32.92 12.38 0.06 7.23 1.83 5 F C C 122.69 5.74 9.87 16.84 103.01 83.08 -83.98 -1.53 53.36 7.82 38.81 33.49 10.03 10.58 29.51 8.90 0.08 5.32 2.07 6 Q C C 122.40 2.93 11.78 16.03 103.30 81.94 -85.27 -2.60 64.83 3.58 31.59 38.74 14.59 11.21 27.85 4.39 0.04 1.96 1.22 7 G C H 39.40 4.00 12.54 17.72 119.84 57.46 -62.59 -158.68 64.48 1.05 34.47 31.11 21.18 11.19 33.05 2.56 0.01 0.43 0.46 8 P H H 90.62 2.72 13.45 16.78 103.01 -27.34 -68.43 20.25 48.41 0.69 50.90 29.64 7.53 10.63 48.94 2.67 0.01 0.31 0.27 9 H H H 107.30 5.61 12.23 19.00 95.24 53.32 -67.72 -34.30 20.05 0.45 79.50 12.86 3.03 5.35 75.95 2.44 0.01 0.22 0.15 10 M H H 95.57 4.10 14.14 19.36 93.10 55.84 -65.74 -39.50 7.76 0.22 92.02 4.66 1.22 2.57 89.44 1.91 0.01 0.13 0.05 11 A H H 53.17 2.70 15.43 18.58 92.27 51.73 -64.42 -40.64 4.27 0.13 95.60 2.42 0.60 1.60 93.87 1.40 0.00 0.08 0.03 12 L H H 78.44 4.21 15.30 20.65 92.35 50.29 -65.52 -40.65 2.83 0.08 97.09 1.46 0.38 1.15 95.98 0.96 0.00 0.05 0.02 13 R H H 109.95 6.38 15.44 22.73 92.24 50.68 -64.81 -40.47 2.16 0.05 97.79 1.05 0.27 0.91 97.17 0.56 0.00 0.03 0.01 14 K H H 111.88 2.87 17.58 20.55 91.95 50.91 -64.54 -41.64 1.55 0.02 98.43 0.68 0.19 0.67 98.12 0.32 0.00 0.01 0.00 15 E H H 104.01 2.14 18.63 19.97 91.81 49.39 -64.88 -41.07 1.07 0.01 98.92 0.42 0.11 0.47 98.80 0.19 0.00 0.00 0.00 16 A H H 37.24 6.69 15.69 24.15 92.02 50.49 -64.64 -41.16 0.76 0.00 99.23 0.25 0.06 0.35 99.21 0.12 0.00 0.00 0.00 17 E H H 89.31 7.37 16.96 25.06 92.01 50.78 -64.31 -40.72 0.49 0.00 99.51 0.11 0.03 0.25 99.53 0.07 0.00 0.00 0.00 18 R H H 139.94 2.08 19.30 20.69 91.80 49.78 -64.48 -40.99 0.33 0.00 99.66 0.06 0.02 0.18 99.69 0.05 0.00 0.00 0.00 19 Q H H 102.39 2.48 19.85 21.76 91.89 48.91 -65.05 -41.10 0.27 0.00 99.73 0.04 0.02 0.15 99.75 0.04 0.00 0.00 0.00 20 A H H 30.37 10.09 16.00 27.44 91.97 50.45 -64.37 -41.80 0.30 0.00 99.70 0.04 0.02 0.17 99.73 0.04 0.00 0.00 0.00 21 L H H 74.24 6.57 18.22 25.63 92.03 50.63 -64.25 -41.10 0.30 0.00 99.70 0.03 0.01 0.18 99.71 0.05 0.00 0.00 0.00 22 A H H 54.03 2.38 19.62 21.26 91.22 50.74 -63.52 -41.64 0.43 0.00 99.57 0.05 0.02 0.29 99.57 0.08 0.00 0.00 0.00 23 Q H H 82.66 5.85 18.62 25.13 92.03 49.53 -65.29 -40.58 0.79 0.00 99.20 0.08 0.05 0.56 99.16 0.15 0.00 0.00 0.00 24 L H H 49.83 11.99 15.04 27.83 92.27 50.96 -65.11 -40.60 1.04 0.00 98.96 0.15 0.07 0.68 98.76 0.34 0.00 0.00 0.00 25 E H H 107.07 3.15 19.02 22.23 91.78 51.69 -64.62 -40.48 2.58 0.01 97.42 0.32 0.17 1.86 97.03 0.62 0.00 0.00 0.00 26 K H H 121.19 2.23 18.59 20.34 91.80 50.65 -66.06 -37.00 8.78 0.03 91.19 0.82 0.63 7.04 90.33 1.15 0.01 0.01 0.02 27 A H H 28.67 12.79 11.61 25.45 92.29 56.17 -70.14 -26.01 24.85 0.24 74.92 5.73 2.80 16.36 72.29 2.55 0.04 0.10 0.14 28 K C H 122.04 7.15 14.49 22.81 92.66 68.31 -69.54 -22.06 52.02 0.66 47.32 9.56 6.13 35.97 44.22 3.40 0.07 0.28 0.37 29 T C T 109.43 1.21 16.12 16.41 98.40 47.03 -94.39 -8.89 66.08 0.91 33.00 11.55 14.14 39.95 29.97 3.45 0.05 0.38 0.51 30 K C S 106.62 5.99 13.21 20.91 122.21 74.63 -108.30 144.76 98.46 1.12 0.42 27.19 70.39 1.19 0.22 0.13 0.00 0.52 0.34 31 P C C 86.19 5.05 16.79 22.78 112.52 -102.97 -67.28 145.25 95.18 4.37 0.45 74.01 18.48 2.73 0.10 0.38 0.00 3.62 0.68 32 V E E 51.54 16.43 12.17 28.18 114.67 -125.17 -90.23 128.19 44.41 54.98 0.61 38.48 4.85 0.90 0.19 0.45 0.00 52.54 2.59 33 A E E 49.42 9.05 19.75 29.39 101.79 -173.31 -91.63 -31.63 34.34 65.30 0.36 21.71 13.13 1.10 0.06 0.25 0.00 63.16 0.58 34 F E E 56.94 13.51 19.69 33.54 137.04 0.41 -148.07 150.18 6.35 93.46 0.19 5.07 1.12 0.20 0.04 0.10 0.00 93.24 0.23 35 A E E 37.60 15.82 20.16 35.35 127.03 -159.95 -125.98 138.13 3.19 96.72 0.08 2.83 0.26 0.04 0.03 0.03 0.00 96.62 0.19 36 V E E 30.67 17.57 19.09 36.49 123.10 -162.03 -119.74 133.31 6.88 93.01 0.11 6.26 0.50 0.08 0.04 0.05 0.00 92.65 0.42 37 R E E 111.50 10.13 21.61 31.85 117.50 -151.08 -100.32 130.53 24.60 75.08 0.32 20.93 3.22 0.52 0.10 0.20 0.00 74.16 0.86 38 T C C 32.98 18.91 13.79 31.95 116.87 -155.97 -99.00 143.47 61.53 37.26 1.21 45.01 12.77 3.30 0.25 0.99 0.00 36.33 1.35 39 N C C 104.61 5.08 19.95 25.70 100.67 -143.23 -93.24 16.55 76.10 22.53 1.38 36.83 32.11 7.91 0.22 1.23 0.00 19.90 1.80 40 V C C 53.34 13.26 14.49 28.18 118.38 99.22 -100.48 136.31 69.53 28.69 1.78 33.25 26.12 11.80 0.32 1.64 0.01 23.70 3.17 41 G C C 36.66 8.24 18.44 27.25 117.62 -138.99 -96.30 147.02 69.01 30.01 0.98 48.06 13.70 7.41 0.18 1.03 0.00 26.57 3.04 42 Y C C 81.92 15.63 14.10 29.29 127.59 -160.25 -125.70 142.44 56.53 42.93 0.54 44.90 8.65 1.04 0.26 0.39 0.00 28.44 16.31 43 N C C 88.96 6.45 18.67 26.13 114.34 -162.09 -116.12 113.45 86.22 13.66 0.12 73.73 11.88 0.55 0.04 0.10 0.00 11.13 2.58 44 P C C 51.24 15.16 11.78 26.58 113.44 -139.66 -71.03 148.08 92.60 6.61 0.79 66.64 21.43 4.41 0.18 0.74 0.00 4.22 2.38 45 S C C 57.98 4.95 14.87 20.97 119.41 -118.42 -81.80 156.35 95.65 3.26 1.09 70.13 20.61 4.39 0.25 0.94 0.00 1.30 2.38 46 P C T 114.51 2.22 12.78 16.22 100.73 -93.54 -64.04 -1.29 90.76 1.45 7.79 13.39 13.73 62.73 0.90 7.70 0.00 0.82 0.74 47 G C T 57.18 2.29 12.61 15.65 100.79 45.39 -77.02 -1.31 91.14 1.52 7.34 14.31 14.98 61.12 0.90 7.13 0.00 0.89 0.68 48 D C C 73.03 9.72 10.40 20.85 109.97 108.20 -88.16 112.09 87.83 5.34 6.83 48.79 26.39 12.03 1.17 6.14 0.00 2.47 3.02 49 E C C 131.47 4.12 15.30 20.61 104.97 -157.02 -88.27 47.70 90.15 7.91 1.95 49.28 32.79 8.22 0.45 1.62 0.00 4.12 3.52 50 V C C 47.67 14.74 10.25 24.92 116.03 147.82 -92.94 128.59 88.29 11.08 0.63 49.37 38.33 1.63 0.22 0.41 0.00 5.67 4.35 51 P C C 85.92 5.03 17.29 23.16 96.60 -136.49 -71.85 -5.20 88.30 9.59 2.11 60.30 20.42 7.45 0.53 1.78 0.00 5.88 3.65 52 V C C 53.98 12.83 11.01 24.21 123.63 71.83 -111.12 140.15 75.78 17.74 6.48 42.24 22.28 11.37 1.79 4.65 0.05 7.77 9.85 53 E C T 145.16 2.46 16.44 19.69 110.42 -110.96 -74.10 129.17 81.40 7.80 10.80 12.93 20.06 48.53 1.60 8.98 0.04 4.84 3.02 54 G C T 42.72 5.77 16.94 23.60 114.00 16.40 92.66 -130.32 84.00 6.69 9.30 11.55 23.23 49.44 0.98 8.35 0.01 5.03 1.41 55 V C C 56.53 13.25 16.89 30.07 108.37 -17.88 -100.79 69.92 71.20 22.84 5.96 50.08 11.12 9.63 1.28 5.13 0.01 18.40 4.35 56 A C C 28.47 16.94 17.26 33.77 123.33 114.70 -104.35 144.31 58.16 40.69 1.15 43.89 11.87 2.35 0.39 0.93 0.00 35.14 5.42 57 I E E 26.16 18.56 19.50 37.86 121.26 -150.22 -112.49 132.45 39.10 60.46 0.44 33.78 4.58 0.66 0.19 0.31 0.00 55.77 4.72 58 T E E 59.60 11.14 23.86 34.85 117.61 -147.78 -101.53 129.94 45.03 54.78 0.19 41.41 2.73 0.32 0.07 0.13 0.00 51.67 3.67 59 F C C 17.71 22.31 14.20 36.26 128.10 -172.24 -119.34 146.62 54.33 45.59 0.08 52.96 2.02 0.07 0.05 0.04 0.00 33.14 11.70 60 E C C 92.42 5.00 24.19 28.89 119.09 -125.91 -89.59 147.42 97.17 2.80 0.03 96.55 1.12 0.04 0.01 0.01 0.00 1.93 0.34 61 P H G 51.07 17.04 14.00 30.62 91.54 -111.22 -58.40 -31.90 15.36 0.46 84.18 1.80 1.98 10.87 2.03 82.91 0.00 0.37 0.04 62 K H G 135.23 4.12 21.17 26.25 91.33 61.51 -72.32 -13.98 14.81 0.48 84.71 1.19 1.69 11.21 1.91 83.57 0.00 0.39 0.03 63 D H G 40.34 14.26 18.62 33.28 97.02 62.90 -90.92 0.30 14.28 1.43 84.29 3.84 2.93 7.28 1.92 82.65 0.00 1.30 0.08 64 F E E 17.75 22.09 18.57 40.56 123.38 96.83 -103.41 141.42 27.88 65.01 7.11 21.95 5.30 2.35 4.17 3.46 0.04 57.84 4.91 65 L E E 13.78 20.75 22.54 42.95 120.16 -149.28 -105.91 134.38 16.31 81.69 2.00 13.90 1.86 0.72 1.16 0.73 0.00 80.71 0.92 66 H E E 48.28 14.74 25.46 39.94 120.15 -157.05 -108.64 132.83 9.34 88.88 1.77 7.67 1.15 0.55 0.97 0.57 0.00 88.53 0.56 67 I E E 14.74 22.02 16.20 38.36 113.22 -137.37 -92.56 123.57 13.74 83.23 3.04 12.17 1.11 0.58 1.97 0.92 0.00 82.10 1.13 68 K E E 95.90 8.18 21.38 29.91 100.70 -171.94 -91.10 -31.18 29.41 62.91 7.68 18.95 8.15 4.49 3.00 3.76 0.02 60.64 0.98 69 E E E 89.65 6.49 20.18 27.27 129.59 12.38 -136.17 144.60 35.60 56.37 8.02 20.28 11.69 6.50 2.45 4.36 0.03 53.59 1.10 70 K E E 93.16 13.17 13.47 26.45 116.15 -144.36 -99.80 130.05 43.79 46.99 9.22 31.79 8.28 5.93 2.61 5.84 0.02 43.94 1.58 71 Y C E 95.47 10.06 13.15 24.12 114.16 -166.10 -105.04 123.38 54.41 37.42 8.18 24.68 15.98 17.50 1.90 5.75 0.11 31.01 3.08 72 N C T 105.33 4.07 15.03 19.91 102.11 -10.26 2.09 48.07 81.16 12.16 6.68 22.08 24.51 35.53 1.01 5.38 0.01 9.94 1.53 73 N C T 108.62 6.11 14.21 21.42 97.17 -70.80 -11.58 8.57 90.70 2.98 6.33 18.77 30.40 41.95 1.16 4.93 0.00 2.08 0.71 74 D C S 73.41 8.76 17.19 26.45 104.03 95.80 -98.90 7.46 79.59 14.71 5.70 23.49 28.81 28.46 1.84 3.56 0.03 12.21 1.60 75 W E E 58.24 15.82 17.16 32.98 120.89 76.28 -108.39 138.38 45.13 50.27 4.59 27.00 14.32 6.66 2.55 2.21 0.02 45.09 2.15 76 W E E 40.71 17.46 20.93 38.12 121.20 -151.24 -108.59 136.93 22.65 73.58 3.77 16.96 4.47 2.49 2.66 1.45 0.00 69.74 2.23 77 I E E 23.29 18.73 22.52 40.78 118.34 -156.36 -108.41 132.77 16.88 78.85 4.27 12.59 3.22 1.92 3.43 1.39 0.00 74.77 2.69 78 G E E 8.07 20.74 20.12 39.86 114.02 -134.09 -83.70 139.60 34.86 56.16 8.97 23.51 8.42 5.06 5.41 3.46 0.02 52.63 1.50 79 R C E 82.59 13.50 23.63 36.50 120.38 -99.70 -106.93 142.90 46.26 40.66 13.08 26.18 15.46 7.00 7.64 4.95 0.05 36.93 1.79 80 L C E 59.04 14.32 21.03 34.87 110.75 -113.30 -82.18 123.90 43.56 42.30 14.14 30.88 8.45 5.15 9.30 5.13 0.07 36.02 5.00 81 V C C 28.99 19.65 13.87 32.79 116.56 -160.28 -99.15 132.87 54.88 34.95 10.17 44.13 6.45 2.92 7.53 3.35 0.03 28.87 6.72 82 K C C 112.51 5.98 17.87 24.84 120.68 -144.17 -99.56 148.24 70.24 20.60 9.15 52.02 10.99 6.50 5.69 3.76 0.02 16.05 4.96 83 E C T 145.22 3.13 14.69 19.44 109.01 -83.22 -63.00 130.49 89.89 5.18 4.92 5.43 9.42 75.18 2.07 2.69 0.01 4.00 1.20 84 G C T 58.61 1.90 16.78 18.78 97.30 16.64 86.48 -3.33 95.86 1.86 2.28 7.42 10.94 77.50 0.58 1.61 0.00 1.67 0.29 85 C C C 32.73 16.30 10.64 26.74 120.22 128.55 -90.55 145.52 82.26 16.95 0.79 68.69 11.20 1.70 0.23 0.63 0.00 15.10 2.44 86 E C C 109.44 6.54 21.68 28.91 115.62 -135.81 -95.98 131.92 52.82 46.17 1.01 42.65 7.30 1.89 0.37 0.75 0.00 41.25 5.79 87 V E E 38.15 19.94 16.81 35.43 123.39 -159.62 -111.64 138.47 44.91 53.83 1.26 36.51 5.77 2.12 0.44 0.91 0.00 51.00 3.24 88 G E E 17.74 13.66 23.19 36.36 133.08 151.60 -134.72 -176.36 40.83 58.13 1.03 29.24 10.57 2.94 0.30 0.80 0.00 54.31 1.83 89 F E E 62.56 17.28 22.83 38.74 117.63 -59.21 -95.11 133.33 43.59 55.56 0.85 30.57 11.93 2.33 0.33 0.70 0.01 48.86 5.29 90 I C C 22.03 21.06 20.61 40.95 117.83 -156.97 -108.97 124.78 60.07 39.64 0.29 49.19 9.44 0.72 0.13 0.21 0.00 36.74 3.57 91 P C C 29.59 16.33 21.58 37.79 114.18 -122.04 -69.90 147.49 79.26 20.30 0.44 61.58 16.08 1.25 0.18 0.30 0.00 17.93 2.69 92 S C C 21.93 14.65 20.02 35.06 119.27 -119.67 -82.94 152.35 95.70 1.99 2.31 84.35 10.33 0.98 2.13 0.40 0.00 0.94 0.89 93 P H H 54.69 12.07 17.89 30.54 92.53 -114.04 -61.17 -31.85 14.59 0.29 85.12 5.23 2.94 7.48 79.93 4.10 0.04 0.16 0.11 94 V H H 70.22 6.53 19.69 26.85 92.99 55.05 -66.27 -39.46 9.96 0.31 89.73 3.21 1.64 5.69 84.13 4.99 0.05 0.21 0.09 95 K H H 80.10 9.89 18.55 28.90 93.27 49.84 -67.99 -38.17 7.71 0.39 91.90 3.77 1.25 3.34 85.67 5.58 0.02 0.29 0.09 96 L H H 38.42 13.90 15.58 30.02 92.67 52.51 -64.88 -42.14 3.39 0.11 96.50 1.65 0.56 1.41 94.85 1.43 0.01 0.07 0.02 97 D H H 76.45 4.27 18.86 23.64 92.17 50.70 -64.88 -40.54 3.06 0.08 96.86 1.16 0.39 1.57 95.96 0.85 0.00 0.05 0.02 98 S H H 52.68 3.85 17.31 21.89 92.07 50.13 -65.69 -40.03 3.90 0.08 96.02 1.26 0.44 2.22 95.06 0.95 0.01 0.04 0.02 99 L H H 50.45 7.92 14.32 24.22 92.16 51.13 -65.30 -40.55 3.26 0.08 96.65 1.26 0.43 1.65 95.69 0.90 0.01 0.05 0.02 100 R H H 111.65 4.51 14.80 20.51 91.98 51.30 -64.68 -40.13 3.25 0.13 96.61 1.37 0.42 1.59 95.42 1.08 0.01 0.09 0.03 101 L H H 92.82 2.13 13.33 15.98 92.16 50.80 -65.38 -40.21 3.98 0.15 95.87 1.47 0.48 2.09 94.17 1.64 0.01 0.10 0.03 102 L H H 102.81 2.40 11.59 15.03 92.84 50.12 -67.54 -36.24 7.06 0.13 92.81 1.93 0.86 4.21 91.00 1.87 0.02 0.07 0.04 103 Q H H 120.17 2.50 9.98 13.84 93.78 52.16 -70.93 -29.26 20.11 0.18 79.72 3.90 2.27 13.68 78.26 1.71 0.03 0.07 0.09 104 E H H 140.36 1.56 9.34 11.84 96.96 54.37 -79.27 -15.85 49.25 0.31 50.44 20.34 1.95 25.44 50.56 1.41 0.00 0.11 0.19 105 Q C C 131.24 2.46 10.66 14.52 102.17 78.59 -78.60 14.41 99.76 0.05 0.19 99.23 0.21 0.36 0.16 0.01 0.00 0.02 0.01