# 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 90.94 10.17 14.78 25.54 117.64 -161.10 -103.25 131.80 99.37 0.61 0.02 99.36 0.15 0.06 0.00 0.00 0.00 0.36 0.06 1 F C C 120.99 7.72 11.93 20.60 113.81 -156.53 -97.56 126.29 79.41 18.38 2.20 72.15 2.98 3.33 0.96 1.19 0.00 10.69 8.69 2 G C C 41.41 5.93 12.24 19.35 123.56 115.49 -109.36 170.59 81.91 10.50 7.60 47.43 19.62 14.91 1.30 6.91 0.00 7.06 2.77 3 A C C 72.10 5.38 12.34 18.82 110.45 -55.24 -77.24 134.54 81.71 6.41 11.88 32.95 24.39 24.77 1.43 10.73 0.01 4.13 1.58 4 F C C 118.30 8.67 10.49 19.92 112.51 -118.87 -91.07 122.47 78.36 9.96 11.69 41.33 18.82 18.43 1.81 10.37 0.01 6.03 3.20 5 R C C 136.25 5.54 13.05 20.14 119.91 -157.60 -105.94 137.63 83.65 11.93 4.42 60.15 18.16 4.82 1.38 3.25 0.00 7.47 4.76 6 F C C 134.59 5.83 12.95 20.37 113.88 -120.82 -80.74 136.17 86.69 10.96 2.35 70.97 10.77 4.21 0.74 1.76 0.00 7.54 4.02 7 T C C 63.02 10.17 10.25 21.18 121.56 -153.09 -106.21 150.90 85.47 13.30 1.22 65.08 17.53 2.18 0.46 0.83 0.00 7.09 6.83 8 N C C 84.78 4.81 13.41 19.57 116.68 -114.41 -95.48 138.45 89.51 9.80 0.69 69.06 19.16 0.82 0.33 0.38 0.00 4.23 6.02 9 P H G 94.67 6.10 10.99 18.70 93.33 -125.64 -61.71 -27.69 46.01 0.33 53.66 2.60 4.12 36.04 1.95 54.96 0.00 0.18 0.15 10 L H G 125.28 2.60 12.97 16.37 94.67 55.29 -81.01 -13.74 44.11 0.40 55.49 2.22 3.70 35.30 2.45 55.91 0.01 0.23 0.17 11 S H G 62.95 6.02 12.23 19.54 105.78 53.55 -100.40 28.58 37.51 2.40 60.09 8.49 9.09 20.95 2.88 56.30 0.02 1.39 0.86 12 G C C 39.06 7.31 12.76 21.19 111.53 -146.78 74.29 0.57 79.96 6.24 13.80 39.74 15.99 25.07 3.91 9.07 0.02 3.09 3.12 13 G C C 37.22 8.19 13.93 22.91 113.33 -60.67 83.06 -153.94 69.43 11.04 19.52 34.31 16.81 19.22 5.72 12.98 0.09 6.84 4.02 14 L C C 86.17 8.53 13.98 23.29 110.12 -57.19 -89.11 121.84 55.64 18.79 25.56 32.99 11.65 12.31 8.86 16.07 0.21 11.93 5.99 15 L C C 82.86 9.51 12.88 23.16 109.45 -152.20 -91.75 102.02 51.58 19.31 29.11 27.06 12.17 14.84 8.89 18.56 0.31 13.70 4.46 16 W C C 136.46 7.35 12.82 21.33 113.83 61.64 -97.70 119.44 59.37 17.59 23.03 30.56 14.01 16.49 7.43 14.68 0.27 12.12 4.43 17 K C C 119.12 6.55 11.92 19.87 110.12 -157.42 -90.83 111.15 75.67 11.32 13.01 41.12 21.78 13.48 4.46 8.22 0.06 7.43 3.45 18 I C C 94.01 5.04 11.98 18.74 116.39 -124.21 -103.23 129.00 89.63 6.66 3.71 56.95 30.01 3.01 1.93 1.73 0.00 3.41 2.96 19 P C C 79.00 6.96 10.20 18.66 101.74 -125.23 -65.58 -8.23 66.79 2.84 30.37 34.52 10.53 21.29 3.82 27.27 0.01 1.64 0.93 20 W C T 184.66 2.97 11.32 15.68 98.79 60.15 -77.94 -6.34 64.87 1.81 33.32 17.75 14.96 32.56 3.59 29.36 0.01 0.95 0.81 21 R C G 156.81 2.83 12.34 16.44 105.31 68.75 -93.75 26.49 61.48 4.09 34.43 27.40 14.59 21.44 4.37 28.43 0.02 2.16 1.60 22 M C C 57.53 13.75 7.30 20.56 118.23 104.55 -89.21 142.02 90.82 3.70 5.48 63.62 24.60 2.21 2.42 3.11 0.00 1.18 2.86 23 S C C 56.77 3.04 14.10 18.06 117.13 -109.73 -70.70 157.33 97.74 0.94 1.32 95.30 2.19 0.35 1.15 0.14 0.00 0.30 0.57 24 K H H 152.11 2.11 12.21 15.67 92.18 -107.07 -58.72 -36.86 3.76 0.02 96.22 0.71 0.63 2.23 95.88 0.53 0.00 0.00 0.01 25 F H H 135.35 1.50 14.84 15.89 92.25 53.03 -65.27 -39.55 2.83 0.01 97.16 0.46 0.32 1.93 96.60 0.67 0.00 0.01 0.00 26 Q H H 59.48 8.22 13.60 23.48 92.37 49.46 -66.16 -40.39 1.25 0.01 98.74 0.35 0.14 0.68 98.24 0.58 0.00 0.01 0.00 27 K H H 64.91 10.35 14.00 25.46 92.00 51.65 -63.93 -41.39 0.82 0.01 99.17 0.22 0.08 0.42 99.00 0.28 0.00 0.00 0.00 28 L H H 84.36 2.64 18.42 20.82 91.77 50.30 -63.94 -41.24 0.69 0.00 99.31 0.14 0.06 0.38 99.27 0.15 0.00 0.00 0.00 29 R H H 115.37 3.38 18.90 22.41 92.15 49.81 -65.03 -40.63 0.59 0.00 99.41 0.10 0.04 0.34 99.42 0.10 0.00 0.00 0.00 30 Q H H 43.22 12.79 15.97 29.59 92.13 50.87 -64.52 -41.59 0.40 0.00 99.59 0.07 0.03 0.22 99.61 0.07 0.00 0.00 0.00 31 R H H 102.52 7.78 18.74 27.02 91.95 51.26 -63.77 -41.14 0.37 0.00 99.63 0.06 0.02 0.21 99.66 0.06 0.00 0.00 0.00 32 R H H 135.00 2.21 21.44 22.68 91.55 50.30 -64.88 -40.78 0.31 0.00 99.69 0.05 0.02 0.18 99.71 0.05 0.00 0.00 0.00 33 R H H 87.71 9.09 19.28 28.96 91.92 50.47 -64.67 -41.05 0.41 0.00 99.59 0.05 0.02 0.26 99.61 0.07 0.00 0.00 0.00 34 L H H 38.70 15.08 17.13 32.46 91.95 51.27 -64.85 -39.89 0.50 0.00 99.50 0.06 0.02 0.32 99.52 0.07 0.00 0.00 0.00 35 R H H 123.50 4.34 22.35 26.73 91.64 51.78 -63.78 -41.35 0.25 0.00 99.75 0.03 0.01 0.15 99.78 0.03 0.00 0.00 0.00 36 A H H 47.45 5.29 22.10 27.61 91.77 50.33 -64.55 -41.05 0.27 0.00 99.73 0.03 0.01 0.17 99.76 0.03 0.00 0.00 0.00 37 V H H 22.78 16.33 18.53 35.27 91.75 50.17 -64.08 -42.65 0.15 0.00 99.85 0.02 0.01 0.09 99.87 0.02 0.00 0.00 0.00 38 D H H 47.13 11.66 20.39 32.37 91.81 51.18 -63.71 -41.00 0.07 0.00 99.93 0.01 0.00 0.04 99.94 0.01 0.00 0.00 0.00 39 N H H 93.48 2.62 24.30 26.10 91.88 50.18 -64.88 -41.13 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 40 V H H 38.55 11.75 21.15 33.42 91.76 49.48 -64.24 -43.01 0.07 0.00 99.93 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 41 V H H 17.82 18.41 18.66 37.24 91.61 49.46 -63.80 -42.88 0.04 0.00 99.95 0.00 0.00 0.03 99.96 0.00 0.00 0.00 0.00 42 A H H 47.70 5.36 22.62 28.43 91.29 51.38 -63.15 -41.65 0.05 0.00 99.95 0.00 0.00 0.03 99.96 0.00 0.00 0.00 0.00 43 T H H 60.32 4.77 22.99 27.66 91.71 50.05 -64.57 -42.30 0.06 0.00 99.94 0.00 0.00 0.04 99.94 0.01 0.00 0.00 0.00 44 I H H 28.96 16.37 19.14 35.80 91.93 48.88 -64.47 -42.64 0.06 0.00 99.94 0.00 0.00 0.04 99.95 0.01 0.00 0.00 0.00 45 E H H 64.71 13.18 19.51 32.48 91.55 50.90 -63.32 -41.75 0.11 0.00 99.89 0.01 0.00 0.07 99.91 0.01 0.00 0.00 0.00 46 N H H 89.24 2.23 23.26 24.09 91.55 50.06 -64.40 -41.27 0.29 0.00 99.71 0.02 0.01 0.19 99.75 0.03 0.00 0.00 0.00 47 A H H 29.77 6.37 18.23 26.30 91.41 51.03 -63.95 -41.60 0.57 0.00 99.43 0.05 0.03 0.39 99.45 0.08 0.00 0.00 0.00 48 L H H 19.90 13.25 12.85 27.90 91.89 50.42 -64.46 -41.43 1.08 0.01 98.91 0.16 0.09 0.70 98.82 0.23 0.00 0.00 0.00 49 A H H 62.73 4.55 14.29 20.20 91.79 51.51 -63.98 -39.96 1.88 0.01 98.11 0.24 0.13 1.35 97.68 0.60 0.00 0.00 0.00 50 K H H 159.56 0.99 14.73 15.13 90.79 52.71 -66.35 -29.05 10.78 0.03 89.19 0.45 0.45 9.89 88.39 0.77 0.02 0.01 0.02 51 K C T 126.51 3.23 11.94 16.50 93.61 48.08 -91.44 3.02 78.16 0.03 21.81 0.46 1.18 75.85 21.69 0.78 0.00 0.01 0.03 52 G C T 65.62 0.59 14.25 13.30 94.04 -109.45 77.83 14.98 99.84 0.01 0.16 1.40 1.39 97.12 0.05 0.03 0.00 0.01 0.00 53 E C C 87.95 7.11 9.66 18.65 122.28 132.72 -101.15 144.89 99.26 0.60 0.13 97.29 1.89 0.20 0.06 0.03 0.00 0.24 0.28 54 T C C 99.22 2.76 15.78 19.66 113.93 -134.20 -92.93 129.40 98.68 1.08 0.23 95.28 3.13 0.45 0.12 0.07 0.00 0.45 0.51 55 V C C 36.93 15.55 9.95 25.34 123.15 -170.43 -112.97 140.42 91.30 5.24 3.46 87.89 2.83 0.41 3.42 0.25 0.00 1.19 4.01 56 K H H 140.72 1.65 18.84 19.66 93.92 -137.13 -64.59 -36.86 3.29 0.03 96.69 1.14 0.50 1.55 95.82 0.96 0.00 0.01 0.01 57 A H H 33.09 8.81 16.68 27.01 92.40 54.02 -64.68 -40.15 1.39 0.02 98.59 0.36 0.13 0.77 97.70 1.01 0.00 0.01 0.00 58 V H H 13.92 18.79 13.21 32.38 92.21 50.24 -65.54 -41.15 0.51 0.01 99.48 0.13 0.05 0.27 98.76 0.79 0.00 0.01 0.00 59 E H H 91.07 4.76 18.67 24.23 91.40 51.91 -63.12 -41.09 0.34 0.00 99.66 0.07 0.03 0.18 99.51 0.22 0.00 0.00 0.00 60 R H H 128.83 2.37 19.69 21.37 91.94 49.94 -64.86 -41.34 0.42 0.00 99.58 0.06 0.02 0.25 99.47 0.19 0.00 0.00 0.00 61 W H H 50.19 15.13 14.62 30.24 92.15 50.15 -65.19 -40.93 0.44 0.00 99.56 0.05 0.02 0.30 99.30 0.34 0.00 0.00 0.00 62 R H H 93.15 14.01 15.16 28.80 91.62 53.26 -63.63 -37.39 1.02 0.00 98.98 0.07 0.05 0.82 98.11 0.96 0.00 0.00 0.00 63 A H H 81.87 1.86 18.75 20.19 91.99 53.41 -70.49 -25.83 9.18 0.01 90.81 0.22 0.33 8.85 89.53 1.06 0.01 0.00 0.01 64 E H H 116.18 4.51 17.83 22.99 97.90 44.84 -96.58 -6.55 33.72 0.05 66.23 1.31 2.35 29.11 65.87 1.28 0.02 0.01 0.04 65 M C S 30.02 20.87 10.37 30.45 116.93 104.63 -76.25 139.36 99.63 0.26 0.11 40.51 58.89 0.29 0.08 0.02 0.00 0.06 0.16 66 P C C 32.62 11.41 16.86 29.85 117.45 -109.44 -67.02 154.86 99.43 0.52 0.04 98.21 1.22 0.07 0.01 0.01 0.00 0.16 0.30 67 T C C 63.53 5.51 22.38 27.88 121.43 -108.34 -77.42 161.59 86.85 12.93 0.21 84.72 0.84 0.06 0.11 0.05 0.00 1.82 12.39 68 E H G 47.78 19.20 11.49 30.15 90.83 -109.43 -57.57 -37.05 8.88 0.11 91.01 1.24 1.01 5.40 1.54 90.71 0.00 0.08 0.01 69 A H G 85.53 2.23 18.01 20.97 89.79 61.42 -66.51 -21.03 8.07 0.06 91.87 0.44 0.64 6.04 1.42 91.40 0.00 0.04 0.00 70 E H G 117.35 4.24 17.69 22.65 93.06 56.61 -85.15 -9.96 8.58 0.10 91.32 0.91 1.02 5.37 1.33 91.30 0.00 0.06 0.01 71 M C S 23.16 21.42 7.75 27.43 118.83 95.79 -83.45 144.00 95.41 1.04 3.54 40.79 53.40 1.28 1.51 1.44 0.00 0.21 1.36 72 L C C 83.70 4.08 19.10 23.46 116.17 -109.36 -68.70 149.69 97.92 0.37 1.71 90.93 6.17 0.91 0.94 0.55 0.00 0.10 0.38 73 P H G 77.27 9.56 14.56 25.08 91.85 -109.57 -58.22 -35.07 28.29 0.26 71.44 3.83 3.15 19.70 4.37 68.72 0.00 0.16 0.08 74 K H G 105.09 8.69 18.31 27.65 91.34 62.22 -67.92 -19.31 26.83 0.28 72.88 1.92 2.60 21.11 4.52 69.60 0.00 0.18 0.08 75 D H G 30.49 16.65 16.44 33.18 95.36 58.42 -84.42 -6.12 24.23 1.27 74.50 8.30 4.44 11.57 4.78 69.82 0.00 0.76 0.33 76 K C T 56.37 15.93 19.66 35.14 93.51 78.76 -70.91 -21.38 82.56 5.48 11.96 19.50 17.82 45.21 3.61 8.26 0.06 2.87 2.66 77 Y C T 65.11 14.42 20.89 35.28 101.91 45.43 -105.43 10.25 87.54 8.49 3.97 15.43 24.68 47.78 0.79 3.03 0.01 7.02 1.26 78 T C E 22.85 16.15 19.56 36.27 125.85 105.05 -104.98 148.24 50.28 48.91 0.80 31.80 16.51 3.39 0.21 0.67 0.00 43.95 3.48 79 I E E 42.05 14.03 20.98 35.54 120.92 -145.61 -113.34 133.21 17.72 82.02 0.25 13.50 4.16 0.63 0.14 0.17 0.00 77.22 4.17 80 F E E 43.56 14.96 15.78 31.52 123.92 -161.94 -112.24 142.55 15.25 84.59 0.16 12.06 2.56 0.22 0.13 0.09 0.00 76.11 8.84 81 D C C 45.11 8.23 16.01 26.21 114.07 -134.82 -95.38 125.52 61.76 38.18 0.06 59.24 2.01 0.15 0.02 0.04 0.00 36.09 2.44 82 R C T 135.47 7.84 12.31 21.73 92.46 -145.97 -67.87 -20.83 98.96 0.63 0.41 1.30 16.50 81.19 0.02 0.39 0.00 0.50 0.10 83 K C T 162.59 0.88 13.89 13.77 96.21 52.67 -85.77 -16.86 99.34 0.38 0.28 1.24 20.17 77.95 0.01 0.29 0.00 0.26 0.07 84 E C C 86.22 5.70 9.30 17.02 117.43 57.55 -113.38 122.20 79.78 19.85 0.37 39.87 39.50 1.83 0.07 0.38 0.00 15.24 3.11 85 K C T 153.31 2.34 11.11 15.25 97.40 -142.45 -66.85 -22.08 83.47 15.24 1.30 5.12 15.11 63.96 0.07 1.37 0.00 13.61 0.76 86 R C T 175.26 2.04 14.28 16.92 95.24 39.89 -70.89 6.66 81.66 17.36 0.99 5.82 17.03 59.04 0.04 1.14 0.00 16.41 0.52 87 Y E E 82.87 9.35 11.75 22.83 120.96 102.22 -97.76 141.88 47.54 52.03 0.43 34.02 12.77 1.70 0.10 0.45 0.00 48.07 2.89 88 R E E 102.59 9.96 14.46 25.37 120.87 -151.02 -107.53 138.97 18.41 81.28 0.31 15.36 1.53 0.26 0.23 0.15 0.00 66.15 16.32 89 K E E 86.68 11.66 15.25 27.39 115.85 -138.31 -97.80 141.66 49.08 50.33 0.59 41.11 5.08 1.76 0.21 0.44 0.00 49.06 2.34 90 G C C 29.79 10.32 15.14 26.13 116.83 -131.92 -91.28 157.66 69.70 29.53 0.77 49.22 16.40 3.95 0.21 0.67 0.00 27.38 2.17 91 I C C 90.74 9.68 14.54 24.84 114.49 -115.12 -98.56 125.08 67.43 31.68 0.88 49.27 15.00 3.62 0.26 0.78 0.00 27.50 3.57 92 H C C 92.91 8.60 14.28 24.02 122.78 108.07 -113.09 140.23 67.71 31.57 0.72 50.32 14.18 3.36 0.20 0.65 0.00 28.21 3.08 93 K C C 134.57 4.79 15.53 22.09 116.84 -131.17 -98.32 129.37 72.79 26.69 0.52 54.27 15.86 2.12 0.16 0.45 0.00 22.54 4.60 94 L C C 62.68 12.56 10.84 23.99 120.02 -160.42 -106.30 135.81 85.25 14.59 0.16 69.84 14.99 0.55 0.05 0.12 0.00 12.33 2.12 95 P C C 70.13 6.22 14.16 21.88 113.07 -107.91 -66.70 148.06 92.42 6.25 1.33 80.65 8.74 3.00 0.39 0.90 0.00 5.14 1.18 96 K C C 132.83 5.35 13.39 20.15 102.98 -116.82 -72.94 16.09 78.10 4.58 17.32 41.37 21.45 16.09 5.74 10.88 0.02 2.61 1.85 97 W C C 140.83 6.11 13.23 20.47 100.53 57.37 -83.10 1.01 70.17 7.57 22.25 41.09 14.70 14.98 8.08 13.67 0.06 4.41 3.01 98 T C C 50.36 11.23 10.98 22.91 106.56 94.20 -86.08 53.01 67.92 9.73 22.36 46.89 11.84 8.94 10.79 11.88 0.03 6.18 3.45 99 R C C 128.68 6.34 13.46 20.84 102.76 75.35 -80.57 12.97 69.12 9.49 21.39 46.12 13.95 8.94 12.71 8.88 0.05 5.89 3.47 100 V C C 90.85 5.52 12.76 19.46 98.38 72.23 -77.55 -27.44 67.65 5.61 26.74 41.04 15.26 11.63 13.89 12.78 0.03 3.37 2.02 101 S C C 65.04 5.78 12.20 19.29 101.04 56.91 -83.90 -15.94 73.31 4.06 22.63 42.14 17.26 14.58 9.46 12.68 0.01 2.39 1.48 102 Q C C 106.37 6.02 11.84 19.14 101.85 62.60 -90.27 13.12 77.50 5.17 17.33 47.51 17.22 13.15 5.47 11.67 0.01 3.14 1.83 103 R C C 136.76 6.51 10.79 18.70 104.51 110.38 -83.86 31.96 83.99 8.64 7.38 66.13 11.22 6.17 3.04 4.43 0.00 5.47 3.54 104 V C C 99.30 3.66 12.78 17.95 114.08 91.91 -101.27 124.71 89.13 8.95 1.92 70.73 15.16 2.61 0.99 0.97 0.00 4.50 5.03 105 N C C 98.30 6.50 10.24 18.29 113.11 -125.05 -92.15 124.23 97.79 2.11 0.10 80.86 16.82 0.37 0.03 0.06 0.00 1.03 0.82 106 P C C 60.91 8.21 8.47 18.20 115.15 -112.13 -68.26 152.65 99.48 0.29 0.24 93.54 4.46 1.48 0.05 0.17 0.00 0.13 0.15 107 P C T 121.28 1.01 11.92 13.13 109.53 -95.46 -63.45 137.79 98.39 0.26 1.35 13.26 9.82 75.15 0.19 1.28 0.00 0.15 0.15 108 G C T 60.22 1.50 11.51 13.44 99.32 17.56 85.01 -3.11 98.06 0.34 1.60 23.52 4.78 69.83 0.25 1.27 0.00 0.20 0.15 109 Y C C 108.11 10.13 9.29 19.85 108.64 110.01 -86.84 108.51 99.48 0.42 0.10 98.89 0.57 0.16 0.03 0.03 0.00 0.20 0.12