# 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 C C C 49.31 12.23 13.82 26.41 115.42 -131.82 -81.70 141.10 99.77 0.09 0.14 99.65 0.11 0.09 0.08 0.01 0.00 0.04 0.02 1 A C C 64.63 5.46 13.21 19.91 101.99 -111.09 -70.47 -31.66 65.60 0.83 33.58 51.89 2.10 10.97 30.76 3.46 0.00 0.38 0.44 2 S C H 72.13 3.31 13.14 17.46 100.07 48.80 -75.78 -28.78 58.40 0.80 40.80 32.45 11.83 14.22 36.29 4.44 0.01 0.32 0.44 3 H H H 100.75 7.64 13.56 22.11 97.42 56.66 -73.63 -28.97 38.52 0.53 60.95 23.19 8.27 7.85 56.36 3.88 0.01 0.22 0.24 4 N H H 70.12 11.36 14.10 25.66 95.61 60.89 -68.32 -33.88 27.01 0.33 72.66 18.89 3.78 5.05 69.44 2.55 0.00 0.14 0.13 5 E H H 115.87 3.44 18.47 22.27 93.04 56.88 -66.33 -37.86 14.38 0.19 85.42 9.39 2.10 3.50 83.18 1.67 0.00 0.09 0.07 6 N H H 80.37 5.35 20.46 26.11 92.67 50.12 -66.79 -38.70 7.31 0.09 92.61 4.44 1.07 2.14 91.30 0.98 0.00 0.04 0.03 7 A H H 11.83 18.68 16.54 35.28 91.96 51.84 -64.07 -42.08 2.23 0.01 97.76 1.01 0.29 0.85 97.46 0.37 0.00 0.01 0.00 8 S H H 34.58 13.12 20.25 33.36 91.87 51.72 -63.52 -41.11 1.32 0.01 98.67 0.52 0.13 0.56 98.54 0.24 0.00 0.00 0.00 9 L H H 84.84 3.21 24.84 27.18 91.53 50.14 -64.13 -41.94 0.78 0.00 99.22 0.24 0.07 0.37 99.19 0.13 0.00 0.00 0.00 10 L H H 50.01 9.56 23.10 33.20 91.68 49.50 -64.25 -42.47 0.49 0.00 99.51 0.13 0.04 0.24 99.53 0.06 0.00 0.00 0.00 11 A H H 5.38 22.77 17.47 40.29 91.57 50.04 -63.89 -42.44 0.35 0.00 99.65 0.08 0.03 0.17 99.68 0.04 0.00 0.00 0.00 12 K H H 98.86 9.36 23.24 32.72 91.54 51.01 -62.95 -41.76 0.21 0.00 99.79 0.04 0.01 0.10 99.83 0.02 0.00 0.00 0.00 13 K H H 115.81 2.41 26.08 27.23 91.48 48.85 -64.30 -42.03 0.19 0.00 99.80 0.03 0.01 0.11 99.84 0.02 0.00 0.00 0.00 14 Q H H 41.69 13.79 22.29 35.99 91.94 48.82 -64.87 -41.75 0.25 0.00 99.75 0.04 0.02 0.14 99.78 0.02 0.00 0.00 0.00 15 A H H 5.94 22.66 16.95 39.63 91.27 51.15 -63.07 -42.03 0.28 0.00 99.72 0.05 0.02 0.15 99.75 0.03 0.00 0.00 0.00 16 Q H H 99.46 4.43 24.07 28.76 91.55 50.64 -64.13 -40.86 0.45 0.00 99.55 0.06 0.02 0.28 99.58 0.05 0.00 0.00 0.00 17 N H H 78.22 3.71 23.84 26.99 91.94 49.60 -64.91 -41.21 1.01 0.00 98.99 0.09 0.05 0.71 98.99 0.14 0.00 0.00 0.00 18 I H H 15.79 19.11 16.96 36.13 92.14 49.36 -64.99 -41.80 1.33 0.00 98.67 0.15 0.09 0.91 98.33 0.51 0.00 0.00 0.00 19 S H H 35.16 16.51 16.12 32.04 91.38 54.89 -63.72 -34.83 4.84 0.01 95.15 0.36 0.25 3.91 92.85 2.62 0.01 0.00 0.00 20 Q H H 137.73 1.47 20.48 21.05 91.91 54.54 -70.82 -24.59 30.19 0.02 69.78 0.55 0.85 29.40 65.96 3.19 0.01 0.01 0.02 21 N C H 100.76 4.40 18.28 23.33 98.52 45.01 -98.74 -2.96 50.04 0.08 49.88 1.57 3.07 44.29 47.80 3.14 0.03 0.03 0.07 22 L C S 30.78 21.22 9.71 29.61 116.51 108.45 -79.94 137.37 99.09 0.76 0.15 35.09 63.85 0.40 0.08 0.04 0.00 0.33 0.22 23 P C C 70.28 7.08 18.87 26.64 108.93 -113.95 -68.84 140.43 94.39 5.21 0.40 87.96 5.48 1.09 0.12 0.24 0.00 4.35 0.76 24 I E E 82.11 11.88 13.97 26.29 118.84 -140.28 -105.03 130.08 41.64 56.91 1.45 33.11 6.03 1.22 0.89 0.79 0.01 43.25 14.68 25 K E E 123.43 6.98 14.30 23.00 116.07 -165.23 -106.03 132.44 44.71 53.94 1.35 37.97 5.17 1.66 0.48 0.93 0.00 50.62 3.15 26 S E E 64.99 6.62 13.05 21.25 122.69 165.48 -130.90 137.10 39.27 52.62 8.11 10.66 12.71 21.24 1.28 6.61 0.12 41.78 5.60 27 A C T 87.24 2.84 17.14 20.69 97.62 -9.65 47.69 37.99 91.46 2.02 6.52 3.25 11.40 76.04 0.27 7.09 0.00 1.42 0.53 28 G C T 35.11 9.91 17.06 27.15 97.72 -41.66 83.42 1.51 95.14 1.45 3.41 4.46 17.16 72.80 0.11 4.13 0.00 1.10 0.24 29 Y E E 21.07 22.20 12.34 34.26 125.17 99.09 -112.61 141.66 19.06 80.77 0.18 14.31 4.35 0.97 0.03 0.18 0.00 79.03 1.12 30 T E E 49.51 8.11 25.05 33.72 124.02 -162.21 -120.61 137.11 6.36 93.59 0.05 5.49 0.59 0.07 0.01 0.04 0.00 93.56 0.24 31 L E E 21.79 22.00 15.90 37.93 109.42 -125.10 -80.07 121.85 1.82 98.18 0.00 1.72 0.05 0.00 0.00 0.00 0.00 98.19 0.03 32 V E E 58.82 8.58 22.05 31.57 101.28 175.25 -96.70 -33.27 1.84 98.16 0.00 1.26 0.33 0.01 0.00 0.00 0.00 98.39 0.01 33 L E E 66.88 6.88 25.26 33.11 139.85 -1.08 -155.57 149.97 0.28 99.72 0.00 0.23 0.01 0.00 0.00 0.00 0.00 99.75 0.00 34 A E E 15.93 24.26 13.28 36.94 128.85 -171.71 -136.36 137.73 0.28 99.72 0.00 0.27 0.00 0.00 0.00 0.00 0.00 99.73 0.00 35 Q E E 84.64 4.95 26.56 32.38 130.07 -174.51 -137.43 142.94 0.34 99.66 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.69 0.01 36 S E E 31.64 21.20 11.95 31.69 125.53 -166.16 -124.66 137.45 5.48 94.51 0.01 4.66 0.37 0.03 0.00 0.00 0.00 94.85 0.09 37 S E E 72.18 2.65 21.01 23.51 113.15 176.49 -125.02 101.46 40.89 59.01 0.10 35.38 3.78 0.61 0.01 0.09 0.00 59.56 0.57 38 G C T 45.76 3.65 18.97 23.37 111.01 -54.10 64.01 -130.11 99.30 0.53 0.18 1.30 45.32 52.74 0.00 0.18 0.00 0.42 0.05 39 T C T 57.47 13.39 16.21 29.93 97.39 -14.52 -99.24 3.88 99.54 0.33 0.13 1.07 45.21 53.26 0.00 0.14 0.00 0.29 0.03 40 T E E 37.54 11.49 21.56 34.36 124.26 85.38 -111.97 136.51 10.28 89.72 0.00 7.78 1.82 0.07 0.00 0.00 0.00 90.09 0.24 41 V E E 3.28 25.23 17.56 44.01 119.25 -160.03 -112.18 127.29 0.44 99.56 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.59 0.01 42 K E E 52.02 10.73 27.54 39.31 116.86 -158.55 -106.24 125.32 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.91 0.00 43 M E E 3.16 26.08 19.95 46.81 120.58 -167.39 -114.68 128.78 0.08 99.92 0.00 0.07 0.00 0.00 0.00 0.00 0.00 99.93 0.00 44 T E E 21.89 12.67 27.54 41.33 118.63 -162.93 -111.63 126.98 0.09 99.91 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.92 0.00 45 I E E 4.30 24.86 21.39 46.60 119.04 -163.98 -111.50 127.32 0.15 99.85 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.87 0.00 46 I E E 28.74 13.34 25.73 39.78 118.39 -163.61 -111.16 126.64 1.42 98.58 0.00 1.32 0.04 0.00 0.00 0.00 0.00 98.59 0.04 47 S E E 12.04 19.51 16.70 36.09 128.14 -167.78 -118.84 150.60 22.57 77.34 0.08 20.36 1.43 0.19 0.02 0.06 0.00 77.41 0.53 48 E C C 91.81 8.12 18.54 27.33 103.83 -130.69 -83.57 9.48 81.67 16.74 1.60 36.62 30.24 15.46 0.20 1.56 0.00 14.69 1.23 49 A C T 67.17 6.39 15.04 22.41 108.58 -27.70 -86.76 118.48 93.76 2.06 4.19 10.13 33.20 50.54 0.47 3.68 0.00 1.23 0.75 50 G C T 53.14 3.07 15.15 19.24 108.04 4.59 88.35 -20.85 94.78 1.13 4.08 15.00 36.04 43.61 0.48 3.77 0.00 0.62 0.47 51 T C S 91.01 4.10 13.72 19.33 114.94 90.57 -93.82 136.68 91.90 3.32 4.77 40.11 41.36 10.59 1.08 3.61 0.00 1.64 1.61 52 Q C C 114.68 5.90 14.35 21.84 112.76 -110.57 -83.91 131.01 87.74 4.76 7.50 60.09 19.66 7.86 2.18 5.41 0.00 2.62 2.17 53 T C C 50.61 14.20 11.13 25.16 114.12 -126.48 -81.60 140.33 86.45 5.44 8.11 69.19 10.19 6.83 2.30 5.97 0.00 3.39 2.13 54 T C C 102.94 3.30 17.01 21.41 100.82 -153.55 -88.96 -5.97 86.77 5.83 7.41 52.85 28.06 6.22 2.80 4.31 0.00 2.94 2.82 55 Q C S 74.64 9.78 13.88 24.84 119.10 89.11 -96.98 141.26 94.02 3.92 2.06 38.94 54.63 0.92 1.59 0.44 0.00 1.27 2.22 56 T C C 66.81 5.34 21.53 26.85 115.23 -102.63 -71.46 148.80 98.81 0.30 0.89 97.40 1.34 0.19 0.79 0.07 0.00 0.10 0.12 57 P H H 23.85 21.48 13.12 33.92 92.28 -118.00 -58.82 -37.54 8.03 0.03 91.94 1.96 0.95 4.83 90.63 1.61 0.01 0.01 0.01 58 D H H 85.64 7.34 20.54 28.77 91.78 55.51 -63.85 -38.19 4.06 0.01 95.93 0.55 0.36 2.88 94.66 1.53 0.01 0.00 0.00 59 A H H 50.74 4.12 22.67 26.61 91.99 50.84 -65.78 -40.55 1.69 0.01 98.30 0.46 0.18 0.96 96.94 1.44 0.00 0.00 0.00 60 F H H 19.99 18.76 18.82 37.48 92.05 50.09 -64.24 -43.57 0.81 0.00 99.19 0.26 0.09 0.41 98.92 0.32 0.00 0.00 0.00 61 L H H 12.64 22.08 19.04 40.56 91.69 49.27 -64.04 -42.20 0.44 0.00 99.56 0.12 0.03 0.22 99.51 0.11 0.00 0.00 0.00 62 T H H 65.32 6.87 23.58 30.69 91.79 50.09 -64.64 -41.58 0.38 0.00 99.62 0.07 0.02 0.21 99.63 0.06 0.00 0.00 0.00 63 S H H 43.01 6.03 23.66 30.16 91.79 49.55 -64.66 -41.50 0.55 0.00 99.45 0.08 0.03 0.33 99.49 0.06 0.00 0.00 0.00 64 Y H H 19.29 20.03 20.43 40.04 92.02 49.65 -64.71 -42.82 0.42 0.00 99.58 0.07 0.03 0.23 99.63 0.04 0.00 0.00 0.00 65 Q H H 29.32 20.44 20.26 39.54 91.36 51.55 -62.25 -42.78 0.20 0.00 99.80 0.03 0.01 0.12 99.81 0.03 0.00 0.00 0.00 66 R H H 129.12 4.99 24.35 29.89 91.75 49.53 -64.36 -41.25 0.21 0.00 99.79 0.02 0.01 0.14 99.79 0.04 0.00 0.00 0.00 67 Q H H 76.86 7.20 24.40 31.84 92.15 47.81 -66.13 -41.19 0.44 0.00 99.56 0.03 0.02 0.34 99.47 0.14 0.00 0.00 0.00 68 M H H 7.78 22.95 18.77 41.46 92.77 47.35 -66.57 -41.06 1.45 0.00 98.55 0.05 0.06 1.29 97.93 0.66 0.00 0.00 0.00 69 C H H 14.72 19.99 17.03 37.14 92.11 50.60 -74.75 -20.05 19.55 0.01 80.44 0.43 0.50 18.77 79.22 1.05 0.01 0.00 0.01 70 A C T 70.04 4.46 21.53 26.33 93.89 59.83 -87.07 -8.07 65.57 0.05 34.38 2.06 3.44 58.09 34.58 1.76 0.00 0.02 0.05 71 D C S 43.21 12.48 11.90 25.76 110.80 102.75 -77.32 122.75 99.59 0.21 0.20 47.98 51.44 0.16 0.18 0.02 0.00 0.04 0.19 72 P H H 102.90 2.40 16.49 19.87 91.91 -145.36 -60.72 -34.70 6.38 0.00 93.61 0.25 0.69 5.45 92.90 0.69 0.01 0.00 0.00 73 T H H 81.10 4.19 18.55 23.30 91.97 54.33 -65.11 -39.45 5.73 0.00 94.27 0.11 0.27 5.74 92.96 0.90 0.01 0.00 0.00 74 V H H 7.50 22.15 13.39 35.52 92.99 47.16 -67.63 -41.98 2.78 0.00 97.21 0.12 0.16 2.47 96.40 0.83 0.01 0.00 0.00 75 K H H 73.63 13.09 17.47 30.51 91.37 53.36 -61.43 -42.43 0.67 0.00 99.33 0.09 0.05 0.42 98.95 0.49 0.00 0.00 0.00 76 L H H 92.45 2.20 22.86 23.47 91.75 50.30 -64.49 -41.07 1.92 0.01 98.07 0.17 0.10 1.53 97.56 0.63 0.00 0.00 0.00 77 M H H 37.94 13.82 18.49 32.79 92.17 50.15 -65.59 -41.03 2.77 0.03 97.20 0.38 0.22 2.07 96.17 1.13 0.01 0.01 0.01 78 L H H 12.17 23.37 14.03 36.97 91.86 51.95 -64.79 -39.07 3.28 0.04 96.68 0.50 0.28 2.32 94.06 2.79 0.01 0.03 0.01 79 T H H 89.54 5.10 20.04 26.03 90.77 56.38 -67.43 -24.44 12.80 0.05 87.15 0.63 0.65 11.56 84.46 2.63 0.03 0.03 0.03 80 E C T 112.23 4.64 19.62 24.70 93.97 59.11 -84.67 -3.41 71.08 0.20 28.72 0.57 2.16 67.35 27.21 2.44 0.03 0.10 0.12 81 G C T 29.82 8.68 20.64 30.08 102.23 -97.06 94.71 8.18 99.17 0.11 0.72 3.40 1.76 94.26 0.38 0.12 0.00 0.07 0.02 82 I C C 12.18 22.87 14.41 37.42 116.44 144.46 -86.21 132.81 73.31 26.66 0.03 71.04 1.19 0.09 0.00 0.01 0.00 27.39 0.27 83 N E E 56.92 9.63 26.04 36.03 119.88 -151.84 -106.91 135.29 8.73 91.26 0.01 8.22 0.34 0.02 0.00 0.00 0.00 91.25 0.15 84 Y E E 13.28 24.48 16.34 40.81 132.43 -174.81 -133.82 148.49 1.21 98.79 0.00 1.10 0.04 0.00 0.00 0.00 0.00 98.83 0.02 85 S E E 29.09 10.08 26.14 37.23 122.71 -157.42 -119.51 134.26 0.25 99.75 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.00 86 I E E 7.31 24.39 17.80 42.76 119.73 -159.40 -112.71 128.15 0.10 99.90 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 87 T E E 32.44 10.03 25.30 36.41 119.63 -165.62 -113.05 130.30 0.09 99.91 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.92 0.00 88 I E E 14.10 21.10 17.48 38.91 121.26 -166.75 -116.16 129.30 0.38 99.62 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.65 0.01 89 N E E 53.45 8.56 20.28 30.07 118.28 -159.33 -110.61 127.86 4.95 95.05 0.00 4.44 0.31 0.02 0.00 0.00 0.00 95.07 0.16 90 D C C 32.60 11.77 12.80 26.42 111.07 -150.26 -96.30 118.16 57.60 42.31 0.08 53.67 2.24 0.24 0.01 0.07 0.00 42.98 0.80 91 T C T 90.65 4.51 13.12 19.52 94.45 -151.45 -68.55 -24.72 98.41 0.49 1.10 1.84 11.79 84.74 0.06 1.09 0.00 0.36 0.12 92 R C T 179.53 1.00 13.23 13.69 98.07 47.89 -79.01 -37.92 98.77 0.17 1.07 0.80 8.23 89.74 0.05 1.02 0.00 0.10 0.06 93 T C T 86.72 2.79 12.09 15.73 101.82 22.12 -103.08 -11.46 99.00 0.23 0.77 3.09 10.54 85.24 0.04 0.86 0.00 0.16 0.06 94 G C C 48.95 3.65 12.14 17.47 97.92 -124.26 76.24 4.80 97.79 1.79 0.42 63.03 14.44 20.35 0.07 0.38 0.00 1.43 0.29 95 N C C 86.66 4.30 13.90 19.82 117.16 132.88 -83.56 140.31 81.38 18.52 0.10 75.63 4.23 0.47 0.02 0.09 0.00 18.97 0.60 96 Q E E 93.39 10.99 12.75 24.52 122.57 -157.38 -113.10 138.67 5.78 94.19 0.02 5.08 0.55 0.06 0.00 0.01 0.00 93.81 0.48 97 Y E E 79.19 10.29 16.52 28.26 125.92 -169.75 -125.83 139.18 0.95 99.04 0.01 0.83 0.08 0.01 0.00 0.00 0.00 99.04 0.03 98 Q E E 95.54 11.65 15.68 28.16 124.79 -164.42 -124.69 134.72 1.18 98.80 0.01 0.96 0.14 0.02 0.00 0.01 0.00 98.86 0.01 99 R E E 86.63 9.82 19.10 29.91 132.98 175.51 -139.29 148.58 1.71 98.27 0.01 1.33 0.29 0.03 0.00 0.01 0.00 98.33 0.02 100 K E E 109.40 8.18 21.70 30.45 115.38 -119.01 -81.23 134.08 2.07 97.92 0.01 1.91 0.10 0.01 0.00 0.00 0.00 97.88 0.08 101 L E E 6.62 24.65 12.73 37.87 118.93 -149.84 -102.56 133.80 11.49 88.47 0.04 11.38 0.30 0.03 0.02 0.01 0.00 87.43 0.83 102 D C C 55.66 5.76 24.89 30.41 132.15 -169.63 -119.83 168.26 53.25 46.64 0.11 50.88 1.93 0.11 0.05 0.05 0.00 45.47 1.51 103 R H H 104.69 14.65 14.40 28.71 90.93 -98.87 -59.42 -35.38 21.58 0.20 78.22 1.53 2.15 16.14 60.84 18.99 0.14 0.14 0.08 104 T H H 104.08 1.44 20.81 21.27 91.37 56.35 -66.12 -33.11 19.67 0.13 80.19 1.18 1.44 15.51 61.29 20.37 0.06 0.09 0.05 105 T H H 47.69 12.01 17.11 29.49 94.88 48.59 -74.31 -28.56 17.01 0.29 82.70 1.87 1.83 11.75 63.92 20.24 0.10 0.19 0.10 106 C H H 10.07 23.20 11.95 34.24 97.01 56.34 -81.94 -16.56 29.75 1.95 68.29 10.48 6.67 14.71 56.93 9.09 0.23 1.12 0.76 107 G C C 37.96 7.42 19.66 27.42 100.61 72.75 -69.45 1.11 67.59 6.21 26.20 29.43 11.94 26.32 21.58 5.02 0.09 3.78 1.83 108 I C C 86.95 9.63 13.89 24.22 110.40 75.45 -89.05 116.97 73.39 11.41 15.20 45.35 17.49 10.40 12.32 3.67 0.04 8.10 2.63 109 V C C 81.02 8.18 12.09 21.44 114.47 -162.08 -96.83 125.13 74.33 16.16 9.51 57.52 10.60 5.12 7.85 2.55 0.01 12.60 3.76 110 K C C 142.75 3.46 11.88 17.28 113.68 -132.02 -88.46 131.17 83.53 11.21 5.26 79.84 1.03 3.26 3.81 1.23 0.00 7.89 2.94 111 A C C 71.56 6.55 11.46 19.40 108.48 -131.32 -82.30 119.06 99.93 0.06 0.01 99.89 0.05 0.02 0.00 0.00 0.00 0.03 0.00