# 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 110.22 6.16 12.73 20.26 114.75 -146.64 -90.16 130.85 99.92 0.07 0.02 99.82 0.09 0.04 0.01 0.00 0.00 0.03 0.01 1 W C C 143.98 6.60 10.67 18.87 117.72 -149.31 -93.04 139.42 91.90 3.58 4.52 88.82 1.25 2.13 3.55 0.75 0.00 1.72 1.77 2 S C C 49.25 5.89 11.42 19.12 119.18 -134.27 -88.09 158.67 86.84 4.80 8.36 72.15 10.10 4.02 6.77 1.97 0.00 2.27 2.71 3 K H H 126.63 4.80 12.62 18.90 94.45 -110.93 -64.39 -33.48 38.39 1.72 59.88 13.98 12.25 14.41 43.43 14.05 0.24 0.89 0.75 4 I H H 82.85 8.35 12.24 21.71 94.06 56.07 -68.28 -33.64 31.83 1.62 66.56 8.32 7.38 16.40 46.18 19.72 0.40 0.96 0.63 5 E H H 108.86 5.62 14.05 20.92 94.56 52.81 -74.76 -21.95 31.67 2.49 65.83 11.03 6.81 14.49 44.95 19.97 0.32 1.61 0.81 6 E H H 106.55 5.64 14.40 21.26 97.56 63.25 -79.08 -15.19 45.67 4.70 49.63 20.82 11.40 15.39 36.07 11.67 0.28 2.90 1.48 7 N C C 77.25 10.48 13.64 24.60 109.77 77.26 -86.67 97.08 66.54 19.67 13.79 42.78 13.24 10.17 9.29 4.66 0.04 17.44 2.38 8 Q E E 79.42 9.17 16.19 26.27 118.44 143.33 -102.90 133.53 43.32 55.12 1.56 36.54 4.94 1.31 0.79 0.71 0.00 54.18 1.53 9 T E E 63.75 12.98 15.27 28.30 122.82 -157.80 -108.94 139.06 19.33 80.47 0.20 18.04 1.06 0.16 0.08 0.08 0.00 80.09 0.48 10 V E E 42.77 12.81 17.04 30.93 125.03 -165.93 -122.62 137.91 4.44 95.51 0.05 4.18 0.23 0.03 0.02 0.01 0.00 95.33 0.20 11 E E E 100.85 9.58 18.62 29.13 120.07 -151.18 -107.96 129.87 2.63 97.33 0.03 2.52 0.10 0.01 0.01 0.01 0.00 97.27 0.09 12 M E E 31.57 17.08 16.58 33.94 127.77 -175.54 -127.37 141.50 4.00 95.94 0.06 3.83 0.14 0.02 0.02 0.01 0.00 95.90 0.07 13 T E E 63.25 10.05 22.04 32.51 119.86 -152.33 -111.09 130.55 6.84 93.10 0.07 6.27 0.43 0.05 0.03 0.02 0.00 93.03 0.17 14 V E E 10.28 22.25 15.98 38.58 119.48 -164.60 -114.44 126.95 11.42 88.49 0.09 10.50 0.85 0.10 0.05 0.04 0.00 88.04 0.43 15 N E E 61.57 7.10 24.42 32.38 107.02 -136.69 -87.92 108.29 25.97 73.90 0.14 25.57 0.52 0.08 0.07 0.05 0.00 72.78 0.93 16 L H H 7.57 24.59 14.93 40.13 95.50 -176.35 -75.56 -20.84 48.20 2.84 48.96 37.00 5.00 6.83 38.49 9.95 0.01 2.08 0.66 17 R H H 101.18 12.95 17.41 30.32 91.95 75.78 -61.45 -35.17 15.72 0.33 83.96 2.82 2.20 9.70 63.54 21.32 0.10 0.20 0.11 18 R H H 150.35 2.41 21.51 23.47 92.78 52.62 -69.89 -31.86 11.36 0.31 88.32 1.73 1.45 7.31 66.57 22.57 0.08 0.22 0.08 19 I H H 47.13 13.56 16.80 30.63 96.82 45.05 -82.15 -27.66 13.53 0.33 86.14 1.97 1.83 9.13 69.18 17.45 0.11 0.21 0.11 20 C H H 14.89 20.30 12.35 32.28 99.90 44.37 -101.15 1.28 40.12 1.43 58.45 7.31 6.94 26.42 47.59 9.53 0.56 0.63 1.03 21 S C T 59.19 8.24 14.69 24.03 108.38 113.14 -73.27 128.33 87.58 0.53 11.90 5.83 5.72 75.38 9.69 2.67 0.01 0.23 0.46 22 R C T 194.07 0.93 17.52 17.02 95.88 14.02 47.79 9.01 94.75 0.15 5.10 4.22 10.04 80.87 2.80 1.89 0.00 0.08 0.10 23 L C S 48.55 12.49 9.29 22.57 123.19 108.63 -98.64 147.12 99.44 0.39 0.17 14.15 84.96 0.42 0.08 0.04 0.00 0.10 0.25 24 P C C 72.45 2.56 18.84 20.80 115.33 -102.74 -65.35 150.85 99.43 0.39 0.18 98.30 1.00 0.19 0.10 0.03 0.00 0.10 0.28 25 W H H 104.66 15.20 11.40 26.25 91.66 -111.88 -58.20 -38.14 9.61 0.06 90.34 1.13 1.31 6.60 76.64 14.21 0.04 0.03 0.03 26 T H H 91.01 4.42 17.31 22.85 91.93 55.95 -65.25 -35.05 7.60 0.04 92.36 0.47 0.58 5.89 76.32 16.68 0.03 0.02 0.02 27 K H H 124.31 2.82 19.80 22.30 94.27 45.28 -77.05 -29.45 7.14 0.06 92.79 0.67 0.65 5.21 75.51 17.88 0.02 0.04 0.02 28 K H H 38.08 16.03 15.91 31.91 95.33 49.14 -79.01 -26.67 12.74 0.14 87.12 3.00 1.86 8.01 81.48 5.48 0.04 0.06 0.07 29 A H H 11.63 20.49 16.15 36.55 92.19 71.27 -59.89 -44.79 2.42 0.01 97.57 0.49 0.22 1.50 97.09 0.70 0.00 0.00 0.00 30 S H H 53.43 5.75 24.00 29.81 91.54 50.84 -63.88 -40.58 0.99 0.00 99.01 0.14 0.05 0.68 98.49 0.64 0.00 0.00 0.00 31 K H H 88.20 5.73 25.11 31.07 91.63 49.58 -65.24 -41.22 0.21 0.00 99.79 0.03 0.01 0.12 99.58 0.26 0.00 0.00 0.00 32 V H H 4.37 23.21 19.73 43.07 91.63 50.20 -63.52 -43.59 0.11 0.00 99.89 0.01 0.01 0.06 99.87 0.05 0.00 0.00 0.00 33 V H H 15.72 20.44 21.63 41.33 91.29 50.73 -62.96 -43.02 0.06 0.00 99.94 0.00 0.00 0.03 99.95 0.01 0.00 0.00 0.00 34 R H H 127.46 3.34 26.56 29.58 91.53 50.36 -63.75 -42.05 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 35 M H H 48.98 10.52 23.61 34.71 91.71 49.12 -64.80 -42.13 0.03 0.00 99.97 0.00 0.00 0.02 99.97 0.00 0.00 0.00 0.00 36 L H H 1.93 26.58 18.70 45.79 91.20 49.99 -63.75 -43.42 0.03 0.00 99.97 0.00 0.00 0.02 99.98 0.00 0.00 0.00 0.00 37 K H H 68.46 15.55 22.35 36.63 91.36 51.61 -61.95 -42.41 0.04 0.00 99.96 0.00 0.00 0.03 99.97 0.00 0.00 0.00 0.00 38 R H H 130.33 2.56 26.02 27.63 91.44 49.81 -63.97 -41.82 0.09 0.00 99.91 0.00 0.00 0.06 99.93 0.01 0.00 0.00 0.00 39 E H H 31.53 12.82 21.51 35.10 91.95 49.02 -64.72 -42.70 0.13 0.00 99.87 0.01 0.00 0.08 99.88 0.02 0.00 0.00 0.00 40 I H H 4.49 24.00 16.26 40.69 91.75 49.47 -64.15 -42.59 0.26 0.00 99.74 0.02 0.01 0.18 99.70 0.09 0.00 0.00 0.00 41 Q H H 70.94 10.46 18.90 29.81 91.71 51.83 -63.75 -40.42 0.98 0.00 99.02 0.08 0.05 0.75 98.76 0.36 0.00 0.00 0.00 42 K H H 127.94 2.36 20.98 22.79 92.38 50.32 -66.46 -39.15 4.81 0.01 95.18 0.21 0.21 4.29 94.59 0.68 0.01 0.00 0.00 43 H H H 71.18 11.85 16.95 29.09 94.91 45.37 -76.30 -34.37 12.08 0.06 87.86 0.71 0.88 10.23 87.46 0.65 0.03 0.02 0.03 44 F C H 37.95 17.63 12.27 29.44 100.51 45.24 -92.75 -5.05 52.14 1.00 46.86 21.10 9.61 21.86 44.86 1.60 0.03 0.33 0.62 45 R C C 165.11 3.40 16.60 21.26 98.57 -144.21 28.88 23.66 91.35 1.30 7.36 55.37 11.88 24.52 4.45 2.49 0.00 0.65 0.66 46 E C C 99.76 6.99 13.20 21.55 116.07 90.75 -103.21 150.04 91.33 1.46 7.21 46.94 24.30 20.46 2.94 3.94 0.00 0.74 0.68 47 E C C 130.87 5.09 14.96 21.33 100.43 -120.46 -79.19 -3.38 89.07 1.68 9.25 55.57 20.07 13.49 2.54 6.66 0.00 0.96 0.70 48 I C C 83.62 9.45 15.61 25.75 109.28 81.52 -93.10 94.06 90.47 2.58 6.95 35.82 34.56 20.59 1.51 5.14 0.00 1.67 0.70 49 G C C 28.95 9.76 20.35 30.42 104.85 -81.55 78.81 36.43 79.98 15.58 4.44 44.42 19.44 15.92 0.65 3.75 0.00 14.87 0.95 50 V E E 10.68 23.86 13.96 37.78 119.47 136.14 -105.14 130.99 36.19 63.40 0.41 33.50 2.29 0.32 0.22 0.21 0.00 61.49 1.97 51 V E E 58.94 9.00 26.75 36.31 122.11 -164.74 -116.99 133.11 13.72 86.06 0.21 13.23 0.63 0.10 0.17 0.08 0.00 83.23 2.57 52 V E E 17.12 23.31 15.62 38.74 117.04 -152.40 -101.77 127.04 27.63 72.18 0.20 27.15 0.87 0.09 0.15 0.07 0.00 68.56 3.11 53 T C C 36.05 11.64 18.39 31.03 115.47 -123.42 -76.97 148.25 91.12 8.49 0.38 90.55 1.04 0.13 0.30 0.05 0.00 7.48 0.45 54 N H H 103.95 4.91 18.02 24.36 92.65 -121.48 -62.54 -33.34 6.24 0.05 93.71 1.46 1.17 3.58 92.79 0.95 0.01 0.03 0.02 55 D H H 88.68 3.02 21.08 23.94 91.79 55.08 -64.69 -40.01 3.07 0.04 96.88 0.59 0.45 2.08 95.96 0.85 0.03 0.02 0.01 56 L H H 9.96 21.01 15.90 37.04 92.15 49.41 -65.27 -42.52 1.12 0.03 98.86 0.27 0.17 0.67 98.07 0.78 0.02 0.01 0.01 57 N H H 30.62 17.80 17.30 34.67 91.68 52.53 -62.74 -42.14 0.78 0.01 99.20 0.17 0.09 0.46 98.90 0.36 0.01 0.01 0.00 58 N H H 92.40 2.26 23.45 24.25 91.85 50.09 -64.76 -40.77 1.08 0.02 98.90 0.16 0.10 0.75 98.66 0.32 0.01 0.01 0.00 59 F H H 66.36 8.07 20.40 29.52 91.75 49.46 -64.93 -42.24 1.57 0.02 98.41 0.14 0.13 1.25 98.04 0.41 0.01 0.01 0.00 60 L H H 6.65 23.22 13.68 36.98 91.76 49.32 -64.59 -42.62 3.89 0.05 96.06 0.41 0.39 3.04 95.31 0.79 0.03 0.02 0.02 61 Y H H 100.43 10.88 16.79 27.99 92.48 49.41 -65.87 -38.38 10.56 0.12 89.31 1.30 0.94 8.30 85.95 3.32 0.07 0.07 0.05 62 S H H 82.83 1.60 18.68 19.48 92.36 54.28 -68.59 -31.15 22.73 0.18 77.10 1.39 2.01 19.50 73.37 3.42 0.12 0.08 0.10 63 R C T 123.09 5.60 15.77 22.40 97.15 41.00 -94.63 -7.71 55.74 0.48 43.78 2.74 8.98 43.32 40.32 3.87 0.18 0.18 0.40 64 G C T 18.75 6.74 17.66 26.38 125.99 -113.33 95.06 170.48 83.39 1.07 15.54 27.84 11.31 44.98 8.46 6.26 0.01 0.46 0.68 65 I H G 52.72 18.64 11.91 29.68 92.71 -75.09 -64.63 -26.76 43.35 1.09 55.56 9.46 7.56 25.99 3.80 52.04 0.03 0.55 0.58 66 K H G 152.50 2.26 19.01 21.54 91.66 62.98 -69.84 -18.95 45.55 0.63 53.82 3.50 7.00 33.16 3.13 52.47 0.03 0.33 0.38 67 K H G 125.44 4.37 19.77 24.76 99.41 46.11 -102.16 8.40 45.05 0.96 54.00 9.23 10.22 24.64 2.79 52.14 0.02 0.48 0.48 68 I C S 16.65 23.58 11.47 34.48 116.02 117.81 -78.46 135.68 98.61 1.29 0.09 46.78 51.95 0.23 0.03 0.04 0.00 0.45 0.52 69 P C C 26.59 14.15 19.27 34.41 115.10 -108.63 -65.80 148.05 96.31 3.59 0.10 95.06 1.57 0.23 0.02 0.06 0.00 2.51 0.53 70 N C S 78.95 10.87 20.57 31.51 96.02 -143.81 -80.43 -28.66 91.22 8.68 0.10 14.33 75.35 1.54 0.00 0.10 0.00 8.31 0.36 71 K E E 81.36 8.66 23.84 33.27 135.72 20.02 -144.49 148.13 20.12 79.54 0.34 14.12 5.74 1.05 0.03 0.33 0.00 78.31 0.42 72 V E E 6.16 24.98 16.39 41.88 125.90 -164.63 -126.49 136.10 7.18 92.75 0.07 6.67 0.48 0.05 0.01 0.05 0.00 92.61 0.14 73 R E E 79.71 9.80 26.40 36.78 116.38 -148.91 -101.70 128.60 2.59 97.40 0.01 2.44 0.10 0.01 0.00 0.00 0.00 97.40 0.04 74 V E E 4.52 25.47 16.91 43.02 125.90 -170.93 -123.79 137.66 0.96 99.03 0.00 0.93 0.03 0.00 0.00 0.00 0.00 99.03 0.01 75 R E E 78.45 9.40 26.49 36.43 118.72 -155.69 -108.08 128.69 0.61 99.39 0.00 0.57 0.02 0.00 0.00 0.00 0.00 99.40 0.01 76 V E E 7.86 24.38 16.28 40.95 122.36 -164.87 -114.63 134.59 1.29 98.70 0.00 1.20 0.05 0.00 0.00 0.00 0.00 98.71 0.03 77 T E E 38.96 8.81 23.90 33.40 127.85 -171.86 -124.01 147.71 3.03 96.94 0.02 2.64 0.20 0.03 0.00 0.01 0.00 97.04 0.07 78 K E E 69.42 16.31 15.39 31.18 121.46 -143.64 -109.95 134.42 7.48 92.44 0.08 6.33 0.84 0.14 0.02 0.04 0.00 92.34 0.30 79 E E E 80.85 8.08 17.31 26.58 121.98 -162.25 -112.52 137.52 21.14 78.63 0.23 19.08 1.60 0.31 0.07 0.13 0.00 78.13 0.67 80 T E E 72.20 7.17 13.65 22.24 117.62 -134.69 -94.13 138.16 41.06 58.05 0.88 34.85 5.19 1.29 0.35 0.59 0.00 54.69 3.04 81 S C C 35.94 8.84 9.52 20.26 112.82 -144.82 -99.83 122.31 76.12 22.68 1.20 66.53 6.56 2.04 0.43 0.79 0.00 20.53 3.11 82 L C T 130.61 1.91 10.92 14.11 95.90 -154.31 -71.42 -24.71 87.36 4.03 8.61 13.39 32.62 42.25 1.22 6.67 0.01 2.85 1.00 83 K C T 165.95 0.71 10.91 10.96 99.13 46.85 -86.01 -14.33 90.09 1.48 8.43 7.82 32.08 50.56 1.07 6.93 0.00 0.86 0.66 84 N C S 92.36 4.46 8.47 14.59 110.72 35.46 -112.99 96.38 88.38 2.73 8.88 17.40 35.98 34.97 0.93 8.13 0.00 1.53 1.06 85 A C T 85.65 2.51 9.94 13.98 98.26 -157.76 -71.40 -6.23 91.68 3.89 4.44 30.83 26.64 34.30 0.57 4.17 0.00 2.58 0.92 86 E C C 112.82 4.09 10.63 16.47 112.34 95.82 -86.64 137.11 75.31 16.36 8.33 45.01 22.28 8.47 0.81 8.41 0.01 12.39 2.63 87 E C S 123.34 3.87 13.21 18.45 108.71 -107.20 -78.74 123.98 68.66 25.05 6.29 18.50 25.64 25.43 0.36 6.46 0.00 22.48 1.13 88 N C E 71.28 11.04 13.47 24.91 106.73 -96.87 -80.67 95.98 53.30 41.12 5.59 22.62 13.36 17.85 0.39 5.47 0.00 39.71 0.60 89 V E E 46.28 11.18 16.50 29.08 121.42 125.08 -111.11 136.69 23.45 75.47 1.09 20.05 2.72 0.59 0.31 0.72 0.00 74.69 0.91 90 L E E 31.03 18.00 16.05 34.32 119.94 -151.03 -106.70 132.92 7.98 91.91 0.11 7.45 0.42 0.07 0.05 0.05 0.00 91.66 0.30 91 K E E 78.08 10.09 22.42 33.00 121.81 -158.28 -109.19 133.96 4.57 95.40 0.03 4.37 0.18 0.02 0.01 0.01 0.00 95.16 0.25 92 T E E 16.99 21.98 14.95 36.75 127.64 -168.45 -123.10 143.67 9.51 90.44 0.05 9.01 0.32 0.04 0.01 0.02 0.00 90.38 0.22 93 D E E 62.58 8.46 23.91 32.70 124.75 -153.35 -114.08 141.16 12.54 87.37 0.10 10.85 1.15 0.10 0.03 0.05 0.00 87.51 0.32 94 L E E 53.36 17.72 17.14 34.12 116.25 -122.47 -89.93 132.37 12.00 87.88 0.12 10.09 1.78 0.14 0.04 0.06 0.00 87.39 0.51 95 V E E 34.28 14.31 18.18 33.34 120.88 -165.32 -114.64 130.04 8.80 91.14 0.06 8.36 0.37 0.04 0.02 0.02 0.00 90.76 0.42 96 V E E 83.02 7.44 21.13 29.20 112.19 -123.84 -79.43 128.44 13.27 86.60 0.12 12.71 0.63 0.09 0.06 0.06 0.00 85.33 1.12 97 V C C 28.25 19.48 11.23 29.96 117.55 -168.98 -111.89 128.51 73.49 20.26 6.25 66.34 4.57 2.31 1.71 4.35 0.00 18.69 2.03 98 G C C 48.45 3.37 18.82 22.43 99.14 -165.91 -80.93 -32.56 70.99 6.85 22.16 30.33 21.53 20.65 3.35 18.07 0.02 4.53 1.52 99 S C T 59.99 5.38 18.44 24.32 124.74 15.71 -130.31 141.99 67.88 4.94 27.18 24.93 19.55 25.34 4.14 21.50 0.03 2.85 1.66 100 F C C 46.92 19.73 9.71 28.07 100.81 99.27 -93.61 7.78 62.58 4.27 33.15 39.95 9.81 12.53 4.37 29.43 0.00 2.56 1.33 101 K C T 137.51 3.60 15.53 20.73 109.45 120.77 -71.34 124.23 71.27 3.11 25.62 11.13 10.88 48.89 3.63 22.16 0.03 1.94 1.35 102 N C T 124.88 1.84 17.01 18.80 95.73 17.39 60.89 19.76 72.76 3.23 24.01 12.52 11.62 48.38 2.97 21.27 0.02 2.26 0.96 103 L C C 52.22 17.46 8.43 24.46 115.27 146.99 -80.57 136.67 80.86 12.44 6.71 70.40 7.65 2.92 1.51 5.15 0.00 10.73 1.64 104 K C C 131.47 3.25 17.42 21.63 122.48 -162.57 -112.67 144.52 61.91 36.18 1.91 54.57 5.11 1.55 0.74 1.12 0.00 34.69 2.23 105 E E E 108.87 10.29 11.52 22.61 117.75 -130.25 -97.40 133.26 47.76 51.09 1.15 42.08 4.10 0.89 0.42 0.64 0.00 50.62 1.24 106 V E E 80.66 6.09 13.42 21.28 121.43 -167.41 -115.67 133.87 34.50 64.79 0.71 32.27 1.73 0.44 0.35 0.35 0.00 63.40 1.47 107 I E E 105.10 5.87 11.58 19.29 113.69 -138.49 -92.31 123.88 37.88 61.46 0.66 35.16 1.77 0.50 0.34 0.33 0.00 60.05 1.86 108 V C C 79.75 7.26 8.99 17.78 110.68 -168.26 -97.88 100.67 68.46 30.52 1.02 57.19 7.30 2.23 0.34 0.63 0.00 31.04 1.27 109 D C C 112.53 2.23 9.89 13.61 111.20 -63.40 -96.89 115.92 83.07 16.10 0.83 76.89 2.39 2.76 0.22 0.47 0.00 16.21 1.04 110 Q C C 131.66 3.10 11.47 16.31 109.92 -132.56 -90.96 116.16 99.57 0.41 0.02 99.49 0.12 0.05 0.00 0.00 0.00 0.31 0.02