# 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 106.76 7.13 12.39 20.56 113.33 -157.20 -90.22 131.43 99.90 0.06 0.03 99.83 0.08 0.04 0.01 0.00 0.00 0.02 0.01 1 S C C 73.13 4.55 9.90 16.00 111.27 -121.64 -83.14 127.28 83.87 0.86 15.27 79.15 1.00 4.08 13.73 1.25 0.00 0.39 0.40 2 T C C 94.46 3.44 9.61 14.79 110.53 -138.38 -87.19 122.67 71.46 1.28 27.27 52.53 8.86 8.15 26.61 2.71 0.00 0.61 0.53 3 K C H 131.96 3.80 10.50 15.94 110.86 -134.88 -87.59 125.15 52.81 1.41 45.78 37.82 8.84 6.38 42.55 3.22 0.01 0.70 0.50 4 V H H 86.37 5.64 10.70 17.74 107.51 -144.77 -82.10 119.89 33.73 1.11 65.16 24.55 5.84 4.76 60.88 3.04 0.01 0.57 0.34 5 A H H 64.03 5.34 12.08 18.70 101.25 -123.17 -73.15 -33.71 26.43 0.99 72.59 18.97 4.30 4.78 67.99 3.11 0.01 0.56 0.28 6 T H H 78.21 5.48 12.51 19.21 104.20 54.03 -83.15 -7.80 24.93 0.82 74.26 17.51 3.86 5.04 69.88 3.01 0.01 0.45 0.25 7 K H H 119.71 5.34 13.21 19.82 101.07 65.02 -76.02 -19.11 21.99 0.60 77.40 13.55 3.97 5.96 72.78 3.20 0.01 0.31 0.22 8 K H H 122.81 4.86 14.52 20.66 98.85 55.30 -73.90 -29.10 23.70 0.59 75.71 12.71 4.37 7.77 71.31 3.29 0.02 0.29 0.24 9 A H H 55.64 8.53 13.75 23.14 98.57 56.45 -75.75 -22.39 30.41 0.60 68.99 15.53 5.63 10.30 64.51 3.46 0.02 0.27 0.27 10 Q H H 98.85 8.03 15.55 24.19 99.65 56.29 -79.47 -15.55 40.85 0.62 58.53 20.84 8.00 12.48 55.12 2.98 0.01 0.25 0.31 11 D C H 79.11 7.57 17.16 25.33 103.21 66.49 -83.29 -8.91 53.95 0.53 45.52 30.25 10.01 11.91 45.26 2.11 0.00 0.19 0.26 12 S H H 44.61 9.24 19.58 29.19 106.93 50.37 -80.46 -36.88 41.97 0.57 57.46 24.89 9.12 7.60 56.27 1.63 0.00 0.19 0.27 13 I H H 17.26 22.43 17.64 39.02 93.86 27.64 -65.35 -40.93 10.71 0.12 89.17 4.20 2.13 4.81 87.39 1.34 0.02 0.05 0.06 14 S H H 33.26 15.61 20.26 35.15 92.04 52.53 -63.35 -41.30 6.65 0.06 93.29 2.52 1.03 3.19 92.08 1.10 0.01 0.03 0.03 15 L H H 87.14 3.60 24.68 27.70 91.85 49.73 -65.19 -41.07 4.52 0.04 95.44 1.65 0.67 2.23 94.55 0.86 0.01 0.02 0.02 16 T H H 28.92 14.94 21.70 36.39 92.20 49.90 -65.28 -42.66 2.10 0.02 97.88 0.72 0.28 1.06 97.56 0.35 0.00 0.01 0.01 17 L H H 3.07 26.16 18.10 44.50 91.49 49.99 -64.06 -42.41 0.72 0.00 99.27 0.23 0.08 0.35 99.21 0.13 0.00 0.00 0.00 18 T H H 56.15 9.40 23.06 32.66 91.29 52.25 -62.64 -41.86 0.43 0.00 99.57 0.12 0.04 0.22 99.54 0.09 0.00 0.00 0.00 19 L H H 71.41 4.86 24.03 28.94 91.66 50.60 -64.32 -41.91 0.40 0.01 99.60 0.09 0.03 0.23 99.53 0.11 0.00 0.00 0.00 20 V H H 9.55 19.74 17.09 37.22 91.70 49.82 -64.30 -42.71 0.64 0.03 99.33 0.15 0.06 0.38 99.20 0.19 0.01 0.01 0.00 21 V H H 37.06 18.07 15.99 33.26 92.07 50.10 -64.44 -41.30 1.48 0.05 98.47 0.28 0.11 0.98 98.07 0.51 0.01 0.03 0.01 22 K H H 150.84 1.90 19.92 21.72 91.43 52.21 -65.79 -30.85 6.48 0.04 93.49 0.37 0.32 5.63 93.10 0.53 0.02 0.02 0.01 23 S H H 63.49 5.25 17.23 23.38 92.96 50.21 -84.10 -9.82 47.30 0.07 52.62 0.84 2.02 43.09 53.10 0.85 0.02 0.02 0.05 24 G C T 34.63 10.19 16.87 27.53 98.69 -109.87 81.67 9.24 99.38 0.33 0.30 4.64 19.89 74.93 0.09 0.13 0.00 0.27 0.05 25 K C C 98.88 9.46 21.30 30.87 106.51 110.49 -96.26 16.78 79.13 20.65 0.23 54.86 21.38 1.45 0.03 0.21 0.00 21.63 0.43 26 Y E E 33.91 21.93 16.82 37.95 129.46 67.15 -123.96 143.03 12.55 87.29 0.16 10.60 1.99 0.21 0.07 0.10 0.00 86.00 1.04 27 T E E 27.84 15.14 23.97 39.10 124.78 -165.25 -121.20 136.86 4.91 95.05 0.04 4.98 0.17 0.02 0.02 0.01 0.00 93.63 1.16 28 L E E 45.73 17.88 22.62 39.18 123.04 -163.10 -121.24 133.01 17.24 82.73 0.03 15.22 1.60 0.07 0.01 0.02 0.00 82.42 0.66 29 G C S 14.89 11.36 25.48 37.80 124.14 19.60 95.63 161.64 94.44 3.21 2.35 21.16 71.36 2.10 2.65 0.26 0.00 1.79 0.69 30 T H H 25.19 21.67 17.00 37.75 92.12 -90.09 -61.07 -39.73 2.29 0.01 97.71 0.24 0.51 1.33 97.67 0.24 0.00 0.00 0.00 31 D H H 97.00 3.94 24.04 28.64 91.64 51.32 -63.69 -41.30 0.96 0.00 99.03 0.08 0.08 0.70 98.91 0.23 0.00 0.00 0.00 32 Q H H 76.28 6.98 23.88 31.11 91.79 47.68 -66.37 -40.07 0.29 0.00 99.70 0.03 0.02 0.19 99.57 0.19 0.00 0.00 0.00 33 A H H 1.37 26.43 16.69 43.82 91.12 50.98 -63.50 -43.67 0.12 0.00 99.88 0.01 0.00 0.06 99.88 0.04 0.00 0.00 0.00 34 I H H 26.24 18.48 21.93 39.66 91.29 49.59 -63.41 -42.52 0.08 0.00 99.92 0.01 0.00 0.05 99.93 0.02 0.00 0.00 0.00 35 R H H 128.58 2.47 26.45 27.82 91.57 50.36 -63.58 -42.10 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.02 0.00 0.00 0.00 36 N H H 24.09 12.88 20.32 34.24 91.57 49.59 -64.33 -41.90 0.15 0.00 99.85 0.01 0.01 0.10 99.82 0.06 0.00 0.00 0.00 37 I H H 3.91 25.72 14.75 40.77 91.39 49.43 -63.96 -42.82 0.34 0.00 99.66 0.02 0.01 0.27 99.49 0.21 0.00 0.00 0.00 38 R H H 122.69 9.39 19.61 29.46 91.31 50.92 -64.48 -34.89 2.40 0.00 97.60 0.04 0.05 2.37 97.31 0.23 0.00 0.00 0.00 39 D C T 98.68 2.27 20.68 22.15 92.10 51.80 -83.75 -6.93 70.45 0.01 29.54 0.21 0.92 68.65 29.73 0.48 0.00 0.00 0.01 40 G C T 37.30 11.86 15.16 27.18 95.01 -114.32 79.24 11.69 99.66 0.01 0.34 0.75 2.64 96.40 0.15 0.05 0.00 0.00 0.00 41 K C S 115.62 5.25 22.05 28.05 94.84 122.27 -83.60 -15.68 99.65 0.25 0.10 43.80 54.29 1.59 0.03 0.07 0.00 0.10 0.13 42 A C C 5.36 24.65 13.05 37.59 122.16 72.01 -101.31 142.65 94.11 5.81 0.08 84.16 9.11 0.59 0.01 0.10 0.00 5.72 0.31 43 Q C S 75.37 10.21 26.49 37.66 99.97 -166.75 -95.11 -27.38 93.19 6.79 0.01 14.60 78.30 0.25 0.00 0.01 0.00 6.75 0.09 44 L E E 9.94 21.33 26.44 47.07 136.57 14.96 -145.01 145.49 2.33 97.66 0.01 1.68 0.57 0.03 0.00 0.00 0.00 97.67 0.05 45 V E E 1.04 27.26 26.92 54.12 121.47 -161.36 -119.13 128.64 0.14 99.86 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.87 0.00 46 F E E 2.79 25.63 29.21 54.14 117.92 -162.50 -109.71 125.95 0.03 99.97 0.00 0.02 0.00 0.00 0.00 0.00 0.00 99.98 0.00 47 M E E 5.20 24.52 26.62 50.01 130.90 -176.69 -127.63 146.90 0.18 99.82 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.01 48 A E E 5.16 22.05 20.93 43.28 114.85 -113.92 -75.49 143.91 21.48 78.51 0.01 20.58 0.52 0.04 0.00 0.01 0.00 78.63 0.22 49 N C T 72.31 11.10 22.24 33.69 93.76 -124.58 -66.33 -24.28 92.21 7.44 0.35 3.54 23.35 65.84 0.01 0.40 0.00 6.54 0.32 50 N C T 93.95 5.61 22.63 29.15 95.31 57.67 -91.97 8.26 98.12 1.65 0.24 7.30 29.59 61.25 0.01 0.32 0.00 1.36 0.17 51 C C S 9.89 23.91 9.26 32.25 118.57 118.92 -76.58 144.18 98.60 1.32 0.08 44.71 53.90 0.17 0.03 0.03 0.00 0.37 0.79 52 P C C 57.55 5.24 18.61 24.91 114.62 -101.44 -63.53 148.03 99.89 0.04 0.07 99.51 0.37 0.04 0.04 0.00 0.00 0.01 0.02 53 P H H 100.44 3.55 14.89 20.16 91.57 -110.88 -57.60 -37.36 5.20 0.01 94.79 0.71 0.67 3.52 93.40 1.69 0.00 0.00 0.00 54 L H H 108.47 2.20 18.33 20.32 91.68 54.35 -64.23 -38.40 3.16 0.01 96.83 0.42 0.32 2.26 95.08 1.92 0.00 0.00 0.00 55 V H H 26.38 16.97 15.28 32.14 92.50 47.70 -67.61 -40.27 1.82 0.02 98.15 0.52 0.22 0.99 96.20 2.05 0.00 0.01 0.00 56 K H H 64.60 16.60 16.77 32.49 91.47 53.29 -61.69 -42.42 1.39 0.01 98.60 0.33 0.15 0.73 98.23 0.55 0.00 0.00 0.00 57 S H H 61.82 2.33 23.84 24.65 91.57 51.02 -64.22 -41.06 3.41 0.01 96.58 0.28 0.19 2.60 96.51 0.40 0.00 0.00 0.00 58 Q H H 69.26 8.97 22.51 31.75 91.72 49.85 -64.90 -41.28 2.47 0.00 97.53 0.20 0.13 1.99 97.46 0.21 0.00 0.00 0.00 59 V H H 1.59 27.05 15.99 43.86 91.20 49.69 -63.92 -43.18 0.32 0.00 99.68 0.05 0.02 0.16 99.71 0.06 0.00 0.00 0.00 60 D H H 62.12 12.04 22.22 33.76 91.45 52.07 -62.19 -41.98 0.12 0.00 99.88 0.01 0.00 0.06 99.90 0.02 0.00 0.00 0.00 61 Y H H 124.93 2.34 25.15 25.84 91.61 49.89 -63.70 -42.43 0.11 0.00 99.89 0.01 0.00 0.07 99.89 0.03 0.00 0.00 0.00 62 L H H 24.25 15.09 20.13 35.66 92.07 49.34 -64.59 -42.62 0.11 0.00 99.89 0.00 0.00 0.07 99.87 0.05 0.00 0.00 0.00 63 C H H 6.61 22.06 14.35 36.53 91.62 50.60 -63.48 -42.15 0.39 0.00 99.61 0.03 0.02 0.29 99.53 0.13 0.00 0.00 0.00 64 H H H 129.41 3.07 20.08 23.73 92.03 49.34 -64.75 -40.04 1.44 0.00 98.56 0.06 0.06 1.26 98.28 0.34 0.00 0.00 0.00 65 L H H 103.91 3.77 18.93 23.23 92.08 49.87 -66.91 -34.39 5.48 0.00 94.52 0.15 0.25 4.91 94.35 0.34 0.00 0.00 0.00 66 S H H 28.12 15.15 13.96 29.36 95.52 45.34 -88.79 -3.33 45.31 0.08 54.62 1.91 4.64 36.42 56.15 0.77 0.02 0.02 0.07 67 K C T 164.51 1.53 20.59 21.73 93.75 -125.10 58.63 37.41 99.69 0.04 0.27 14.69 4.82 80.27 0.12 0.07 0.00 0.02 0.01 68 T C C 16.54 21.16 12.12 32.91 122.74 142.81 -106.93 139.81 99.60 0.39 0.01 90.80 8.78 0.08 0.00 0.00 0.00 0.28 0.05 69 P C C 63.31 6.32 25.14 32.00 112.63 -107.88 -68.05 140.39 95.02 4.98 0.01 93.04 1.78 0.07 0.00 0.00 0.00 5.01 0.10 70 V E E 27.91 23.61 13.99 36.90 124.82 -159.36 -121.90 134.25 8.24 91.75 0.01 8.03 0.32 0.01 0.00 0.01 0.00 90.79 0.84 71 R E E 74.23 12.33 24.47 36.52 122.72 -166.45 -118.25 132.14 0.66 99.34 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.32 0.05 72 V E E 59.86 15.15 21.98 36.30 118.40 -152.11 -103.74 128.01 1.74 98.26 0.00 1.68 0.05 0.00 0.00 0.00 0.00 98.19 0.07 73 F E E 29.20 20.23 15.14 35.07 118.53 -162.52 -106.26 133.56 29.99 69.95 0.06 28.54 0.97 0.11 0.01 0.04 0.00 69.81 0.52 74 A C C 74.93 5.00 21.97 27.51 108.00 -163.02 -100.60 79.80 74.31 25.52 0.17 47.23 23.74 2.30 0.02 0.17 0.00 26.00 0.55 75 G C S 25.05 8.41 19.73 29.01 138.58 74.64 154.43 -175.27 92.10 7.54 0.35 19.77 69.11 3.40 0.07 0.26 0.00 6.58 0.82 76 S C C 47.28 6.29 23.75 30.12 124.46 -65.62 -93.27 160.57 96.64 2.31 1.06 88.92 7.15 0.69 0.85 0.22 0.00 1.08 1.09 77 S H H 23.36 21.54 14.60 35.51 92.25 -108.56 -60.85 -36.78 3.86 0.02 96.12 0.69 0.96 2.03 95.88 0.43 0.00 0.00 0.01 78 R H H 132.82 5.85 22.00 28.75 91.93 54.23 -63.66 -40.82 1.55 0.01 98.44 0.18 0.17 1.09 98.18 0.38 0.00 0.00 0.00 79 E H H 89.65 5.37 24.07 29.52 92.13 48.39 -65.73 -40.90 0.74 0.01 99.25 0.13 0.08 0.47 98.89 0.42 0.00 0.00 0.00 80 L H H 4.06 23.92 16.75 41.06 91.57 50.60 -63.68 -43.43 0.30 0.00 99.69 0.04 0.03 0.19 99.53 0.21 0.00 0.00 0.00 81 G H H 6.18 17.13 17.38 35.38 91.24 51.47 -62.46 -42.48 0.64 0.00 99.35 0.09 0.05 0.43 99.07 0.36 0.00 0.00 0.00 82 I H H 109.18 2.60 22.87 24.81 91.99 49.70 -65.07 -41.12 0.93 0.00 99.06 0.08 0.06 0.72 98.52 0.62 0.00 0.00 0.00 83 A H H 39.62 12.27 18.48 31.08 91.99 52.50 -66.12 -34.74 3.82 0.01 96.16 0.12 0.18 3.57 95.52 0.61 0.01 0.00 0.00 84 V C T 21.71 19.35 14.90 34.20 94.95 42.83 -89.84 -4.08 55.16 0.04 44.79 0.35 1.23 53.86 43.48 1.02 0.01 0.01 0.04 85 G C T 56.64 2.07 21.05 22.46 94.15 -114.27 77.81 15.82 99.41 0.01 0.58 1.57 2.55 95.46 0.30 0.09 0.00 0.00 0.01 86 R C C 78.87 12.67 11.29 24.54 128.89 119.70 -114.86 155.47 98.74 0.62 0.64 55.16 40.99 2.50 0.22 0.36 0.00 0.18 0.58 87 Q C S 140.73 2.02 18.45 20.67 96.08 -137.86 -81.21 -14.13 98.21 0.80 0.98 32.85 60.49 4.90 0.17 0.81 0.00 0.37 0.42 88 F C S 78.08 9.77 19.17 29.74 132.94 49.47 -126.28 156.79 96.82 1.88 1.31 21.01 68.85 7.06 0.20 1.15 0.00 1.13 0.59 89 N C C 62.55 12.56 23.39 35.55 111.41 -89.63 -70.70 131.34 92.77 6.02 1.21 71.00 16.36 5.14 0.17 1.34 0.00 4.79 1.21 90 V C C 7.23 24.55 19.30 43.92 120.75 -161.05 -110.14 132.08 65.53 34.27 0.20 63.29 2.47 0.22 0.08 0.13 0.00 30.44 3.38 91 S C S 16.74 18.09 26.40 44.07 100.33 176.12 -93.88 -31.02 69.72 30.18 0.10 29.78 40.22 0.42 0.02 0.06 0.00 29.20 0.30 92 I E E 9.90 22.00 27.36 48.79 134.36 12.68 -143.00 141.53 4.10 95.86 0.05 3.52 0.47 0.04 0.01 0.01 0.00 95.78 0.16 93 M E E 3.46 26.50 26.00 51.91 125.43 -167.22 -126.82 134.59 0.51 99.47 0.02 0.46 0.02 0.00 0.01 0.00 0.00 99.49 0.02 94 T E E 13.05 20.09 28.48 47.60 123.58 -164.77 -117.63 133.44 0.40 99.58 0.02 0.35 0.01 0.00 0.01 0.00 0.00 99.61 0.01 95 I E E 8.44 23.52 20.95 44.53 113.54 -153.86 -99.40 120.68 2.24 97.73 0.02 2.21 0.05 0.01 0.02 0.00 0.00 97.59 0.12 96 L C E 61.60 12.14 22.72 34.74 99.88 -171.82 -88.73 -29.02 54.31 45.08 0.61 30.74 22.36 1.61 0.20 0.36 0.00 44.17 0.56 97 E C S 93.68 6.65 22.52 29.49 121.88 29.27 -126.03 127.10 83.17 11.93 4.90 27.92 47.41 8.08 2.46 2.09 0.03 10.57 1.45 98 A C T 48.77 14.32 15.82 29.71 97.76 -140.36 -65.12 -26.63 61.11 2.44 36.45 18.34 13.55 29.30 24.69 11.57 0.12 1.53 0.92 99 G C H 32.86 8.31 19.50 28.26 95.99 58.31 -59.15 -34.98 57.06 1.17 41.77 17.11 11.14 29.25 30.67 10.54 0.07 0.62 0.59 100 D H H 53.04 13.42 17.21 30.49 94.87 53.34 -80.13 -14.82 38.43 0.86 60.71 23.46 6.21 9.68 49.33 10.50 0.01 0.44 0.36 101 A H H 27.33 15.67 14.87 30.53 94.31 77.37 -65.60 -39.23 21.27 0.49 78.24 10.06 4.20 8.09 69.33 7.84 0.03 0.26 0.19 102 D H H 91.90 3.36 22.39 25.49 93.22 54.16 -66.37 -36.92 18.56 0.47 80.97 8.60 3.41 7.56 72.83 7.13 0.03 0.27 0.18 103 L H H 50.26 12.02 17.04 29.63 93.33 53.49 -66.47 -40.20 14.18 0.60 85.22 6.81 2.74 5.75 78.09 6.00 0.03 0.39 0.18 104 T H H 31.55 16.86 14.50 30.94 92.81 51.99 -66.50 -39.41 13.12 0.88 86.00 6.41 2.65 5.12 79.08 5.82 0.04 0.65 0.23 105 S H H 69.24 4.87 17.25 23.09 93.30 54.07 -66.45 -35.45 19.65 1.43 78.93 9.06 3.24 8.17 71.33 6.73 0.04 1.10 0.34 106 I H H 110.02 3.90 15.44 20.21 94.43 52.69 -71.86 -27.83 28.98 1.63 69.39 11.54 4.20 14.09 63.12 5.39 0.06 1.10 0.50 107 L H H 77.75 10.90 11.54 22.78 99.28 59.76 -81.02 -11.80 47.42 0.99 51.59 27.90 2.23 17.42 49.04 2.43 0.01 0.43 0.54 108 G C C 45.82 6.06 15.85 22.83 107.09 -111.64 71.62 -1.66 99.91 0.02 0.07 99.54 0.10 0.28 0.06 0.00 0.00 0.01 0.00