# 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 128.55 3.64 12.27 17.58 113.49 -149.54 -92.82 128.25 99.87 0.12 0.01 99.71 0.19 0.03 0.00 0.00 0.00 0.05 0.03 1 A C C 66.85 6.02 9.07 16.80 117.71 -122.64 -83.43 144.73 99.27 0.57 0.17 98.23 0.83 0.30 0.05 0.05 0.00 0.20 0.33 2 P C C 85.00 5.28 9.74 16.77 113.05 -104.17 -67.09 151.27 97.10 0.84 2.06 78.44 9.64 8.85 0.43 1.74 0.00 0.44 0.45 3 S C C 92.72 1.65 11.98 14.51 107.05 -107.68 -79.06 131.94 93.20 3.33 3.47 59.34 24.40 9.14 0.76 2.94 0.00 1.55 1.87 4 Q C C 118.45 4.68 10.71 17.26 117.50 -99.05 -93.31 138.29 93.14 4.96 1.91 58.25 33.12 2.05 0.82 1.00 0.00 2.37 2.38 5 P C C 64.27 9.79 9.40 20.19 113.33 -106.78 -66.66 147.19 89.55 4.91 5.54 74.77 7.53 7.13 1.54 3.98 0.00 3.11 1.93 6 K C C 159.46 2.18 13.23 16.29 103.46 -139.92 -87.39 26.36 80.61 12.17 7.23 47.13 19.10 14.24 1.72 5.58 0.01 6.29 5.91 7 S C C 65.58 5.27 11.91 18.59 119.92 79.57 -112.66 152.93 78.43 13.51 8.07 32.76 26.02 20.95 1.82 5.85 0.06 7.41 5.13 8 G C C 48.49 5.04 12.95 19.18 108.59 -115.08 72.96 31.66 82.86 9.02 8.12 34.68 27.86 21.40 1.93 5.83 0.02 5.67 2.60 9 L C C 97.20 6.41 12.01 19.72 117.57 108.33 -98.55 137.03 71.28 18.49 10.23 37.10 21.89 13.12 4.12 5.89 0.16 11.15 6.57 10 F C C 116.47 6.77 11.30 19.57 114.93 -139.52 -95.98 128.67 62.24 26.49 11.27 33.21 17.42 12.49 5.28 5.95 0.32 16.45 8.88 11 V C T 89.92 5.67 11.21 18.49 118.35 -161.46 -107.03 133.20 60.83 23.16 16.01 20.45 19.67 22.78 6.67 8.16 0.79 13.57 7.91 12 G C T 49.44 3.09 13.41 17.48 111.29 7.72 75.17 -124.43 70.31 9.55 20.14 17.53 22.05 32.36 5.40 12.94 0.25 6.36 3.11 13 I C T 118.47 3.63 12.14 16.95 97.28 4.40 -77.19 -17.33 67.69 9.44 22.87 13.77 18.19 37.10 5.96 15.36 0.29 5.94 3.39 14 N C T 82.11 7.66 9.95 18.79 101.55 59.61 -94.62 21.51 65.11 14.68 20.21 20.30 17.25 29.56 5.39 13.28 0.29 8.77 5.16 15 K C T 147.20 2.99 11.80 16.78 108.97 138.32 -69.37 122.27 81.93 9.65 8.42 10.90 12.74 58.32 2.76 5.44 0.05 6.78 3.01 16 G C T 55.73 2.58 14.16 17.54 97.21 15.40 83.99 -0.96 88.12 7.76 4.12 13.37 16.60 58.48 0.88 3.13 0.00 6.49 1.06 17 H C C 90.67 8.30 11.12 20.97 116.84 119.93 -93.38 135.90 72.89 24.60 2.51 53.48 14.31 4.39 1.01 1.71 0.01 19.01 6.10 18 V C C 88.45 5.77 14.02 21.23 114.99 -144.48 -95.36 128.20 54.59 43.72 1.69 43.99 6.93 1.70 1.16 0.81 0.01 31.70 13.71 19 V C C 70.82 9.84 10.97 21.87 115.87 -160.70 -101.40 130.93 64.93 32.80 2.27 52.80 8.38 2.39 1.46 1.15 0.01 26.55 7.27 20 T C C 67.52 6.77 12.16 20.39 119.86 -158.58 -106.58 154.80 77.47 19.46 3.07 62.29 10.85 3.66 1.60 1.64 0.00 15.46 4.49 21 K C C 148.53 3.48 12.03 16.90 101.01 -119.63 -79.74 -4.30 88.13 6.61 5.26 40.79 35.04 13.06 1.53 3.45 0.01 4.42 1.70 22 R C C 150.00 3.80 11.15 16.63 112.94 91.88 -89.14 128.18 92.17 3.70 4.13 39.15 39.13 14.16 0.81 3.25 0.00 2.32 1.18 23 E C C 137.12 3.52 12.17 17.18 112.26 -125.84 -87.26 125.80 92.34 4.71 2.95 63.16 21.72 7.22 0.62 2.50 0.00 2.65 2.12 24 L C C 79.40 9.37 9.03 19.47 118.15 -130.50 -95.08 136.08 96.48 3.19 0.33 74.20 21.67 0.68 0.12 0.19 0.00 1.37 1.78 25 P C C 81.10 3.94 14.41 19.55 116.77 -108.25 -67.37 151.70 99.48 0.47 0.06 92.50 6.75 0.30 0.01 0.03 0.00 0.22 0.19 26 P C C 83.48 6.96 11.84 20.40 113.74 -100.36 -64.01 145.87 98.90 0.86 0.23 89.76 8.43 0.59 0.08 0.13 0.00 0.27 0.75 27 R C C 106.93 7.78 11.05 20.39 114.98 -121.78 -89.49 136.51 99.01 0.63 0.36 91.21 7.30 0.38 0.16 0.15 0.00 0.17 0.64 28 P H G 85.42 5.48 11.66 18.64 94.55 -116.13 -59.82 -31.29 44.11 0.59 55.30 16.98 6.06 19.63 5.50 51.28 0.00 0.34 0.22 29 S H G 83.85 2.71 12.34 16.16 94.96 60.01 -72.98 -14.54 38.91 0.44 60.65 7.05 5.61 24.65 6.87 55.40 0.00 0.25 0.17 30 D H G 92.68 4.70 11.90 18.00 98.30 59.24 -91.00 0.27 36.47 0.90 62.63 12.72 8.35 16.13 7.16 54.79 0.00 0.48 0.36 31 R C C 111.05 9.38 9.66 19.91 110.39 98.49 -88.30 111.45 73.25 1.66 25.09 45.95 15.17 11.93 8.63 16.37 0.00 0.69 1.27 32 K C C 146.05 2.77 12.71 16.94 111.87 -164.38 -90.29 123.27 85.58 2.21 12.21 41.04 16.70 28.45 5.60 5.79 0.01 0.91 1.50 33 G C C 46.33 4.72 12.29 18.42 115.98 5.80 94.42 -178.02 87.85 1.49 10.66 32.41 24.22 31.85 3.42 6.51 0.00 0.64 0.95 34 K C C 144.05 3.47 13.39 18.08 106.20 -56.47 -82.18 76.66 85.03 2.38 12.58 47.32 20.00 17.95 5.11 7.04 0.01 1.04 1.53 35 G C C 39.85 8.59 10.97 20.24 107.72 62.44 -84.68 86.07 87.28 2.36 10.36 54.38 20.49 12.41 5.04 5.11 0.00 0.98 1.60 36 T C C 66.58 5.65 12.72 19.68 116.26 -106.49 -83.24 160.27 87.78 2.10 10.12 70.72 14.14 2.06 9.89 1.07 0.00 0.60 1.52 37 K H H 147.65 2.18 14.27 17.12 93.33 -106.27 -62.10 -36.57 6.63 0.05 93.32 1.62 1.59 3.34 92.55 0.86 0.01 0.02 0.02 38 R H H 131.67 4.11 15.55 20.27 92.48 52.18 -65.74 -39.63 5.13 0.05 94.81 1.17 0.70 3.16 93.94 0.98 0.01 0.03 0.01 39 V H H 38.82 11.63 13.65 26.34 92.79 50.03 -66.29 -40.89 2.13 0.04 97.83 0.75 0.29 1.03 97.19 0.70 0.00 0.02 0.01 40 H H H 88.50 6.89 16.74 24.64 91.79 51.47 -64.06 -41.28 0.74 0.01 99.25 0.24 0.09 0.33 99.08 0.25 0.00 0.01 0.00 41 F H H 110.55 3.19 19.12 22.17 92.15 50.18 -64.71 -42.22 0.66 0.01 99.33 0.16 0.06 0.36 99.17 0.24 0.00 0.00 0.00 42 V H H 53.89 8.90 18.22 27.73 92.11 48.93 -65.08 -42.08 0.51 0.01 99.49 0.09 0.05 0.31 99.35 0.20 0.00 0.00 0.00 43 R H H 72.59 13.49 16.84 30.34 91.84 50.68 -63.62 -41.09 0.68 0.00 99.31 0.08 0.06 0.49 99.17 0.20 0.00 0.00 0.00 44 N H H 75.63 5.34 19.57 25.53 91.99 50.53 -65.00 -39.92 1.95 0.01 98.04 0.14 0.11 1.63 97.79 0.32 0.00 0.00 0.00 45 L H H 76.91 4.67 19.77 24.65 92.07 50.07 -65.14 -41.99 3.72 0.02 96.26 0.24 0.30 3.21 95.75 0.48 0.01 0.01 0.00 46 I H H 38.44 12.88 15.95 29.76 92.69 49.16 -65.78 -41.86 6.08 0.07 93.85 0.66 0.85 4.65 93.10 0.63 0.04 0.02 0.03 47 R H H 90.79 10.99 15.68 27.11 92.06 51.24 -64.22 -40.84 5.24 0.07 94.68 0.95 0.75 3.51 93.61 1.09 0.02 0.03 0.03 48 E H H 123.13 2.91 17.69 21.00 93.52 48.49 -68.19 -37.85 6.18 0.08 93.75 0.74 0.74 4.84 91.92 1.64 0.05 0.04 0.03 49 V H H 86.79 5.51 16.74 22.53 98.14 40.37 -80.06 -36.92 11.49 0.08 88.43 0.60 1.15 10.03 86.66 1.41 0.09 0.03 0.04 50 A H H 42.05 10.67 14.39 25.72 99.51 31.79 -96.90 -10.95 25.75 0.22 74.03 1.85 5.35 19.12 72.14 1.20 0.13 0.06 0.16 51 G C S 41.40 5.20 18.18 24.27 99.04 -117.32 78.92 9.17 98.09 0.43 1.48 34.49 36.73 26.97 0.66 0.71 0.00 0.19 0.23 52 F C C 71.25 12.70 14.67 27.78 120.55 102.43 -110.01 139.69 94.80 2.24 2.97 67.82 22.49 3.90 2.01 0.91 0.00 0.69 2.18 53 A C C 29.68 11.13 16.82 29.19 118.11 -122.45 -78.70 154.02 80.36 0.36 19.28 68.70 7.58 2.31 20.33 0.75 0.00 0.10 0.23 54 P H H 60.12 8.59 19.05 28.70 93.22 -109.05 -60.91 -35.71 14.55 0.09 85.36 3.47 2.24 9.08 82.80 2.29 0.03 0.03 0.05 55 Y H H 72.55 13.82 19.16 32.69 92.88 53.27 -65.78 -38.73 9.15 0.07 90.78 1.84 1.13 6.27 88.21 2.46 0.03 0.03 0.04 56 E H H 55.74 14.51 18.69 32.88 92.51 51.90 -65.59 -40.32 2.74 0.02 97.24 0.89 0.34 1.41 96.00 1.34 0.00 0.01 0.01 57 K H H 100.79 6.96 21.80 29.07 92.31 50.59 -65.29 -41.08 0.88 0.00 99.11 0.25 0.09 0.44 98.85 0.38 0.00 0.00 0.00 58 R H H 94.02 9.15 22.01 31.32 92.02 50.05 -64.94 -41.22 0.66 0.00 99.34 0.13 0.05 0.38 99.13 0.30 0.00 0.00 0.00 59 I H H 21.04 18.32 18.62 36.87 92.16 49.87 -64.55 -42.70 0.51 0.00 99.48 0.08 0.03 0.32 99.29 0.27 0.00 0.00 0.00 60 T H H 37.17 11.12 20.61 32.41 91.58 50.63 -63.30 -42.43 0.48 0.00 99.52 0.06 0.03 0.33 99.32 0.25 0.00 0.00 0.00 61 E H H 85.12 4.44 22.93 27.26 91.55 50.45 -63.91 -41.54 0.76 0.00 99.24 0.05 0.04 0.62 98.72 0.57 0.00 0.00 0.00 62 L H H 31.00 12.54 17.80 31.52 91.81 50.62 -64.80 -41.24 1.09 0.00 98.91 0.07 0.06 0.89 97.78 1.20 0.00 0.00 0.00 63 L H H 35.11 15.30 15.08 30.71 91.84 51.03 -65.51 -37.50 3.61 0.01 96.38 0.28 0.25 2.98 94.04 2.43 0.01 0.00 0.00 64 K H H 134.12 3.33 18.68 22.65 91.89 50.74 -67.66 -36.00 14.34 0.03 85.63 0.66 0.86 12.83 83.51 2.07 0.03 0.01 0.02 65 V H H 86.06 3.96 16.37 20.96 97.74 42.38 -89.18 -19.68 40.91 0.18 58.91 2.17 5.25 32.63 58.07 1.62 0.07 0.05 0.14 66 G C T 32.31 11.73 11.66 23.36 102.78 20.85 -67.59 17.66 90.24 0.47 9.28 29.89 18.30 42.26 7.27 1.77 0.00 0.17 0.34 67 K C C 158.60 1.97 16.59 18.96 96.88 -138.28 -72.11 -1.69 96.11 0.62 3.26 51.09 29.57 15.66 1.50 1.51 0.00 0.24 0.44 68 D C C 53.20 11.24 11.65 23.89 107.95 108.51 -93.28 102.95 95.47 0.78 3.74 83.56 8.94 3.04 2.67 0.92 0.00 0.26 0.62 69 K H H 132.71 4.63 15.99 22.59 94.37 -173.50 -67.26 -30.93 13.08 0.07 86.85 5.38 3.34 4.01 86.34 0.87 0.00 0.02 0.03 70 R H H 131.66 3.17 20.46 23.58 91.86 56.73 -64.64 -40.60 2.71 0.01 97.28 0.56 0.34 1.59 96.90 0.60 0.00 0.00 0.00 71 A H H 11.75 15.94 16.07 32.98 92.01 50.70 -64.06 -42.20 1.00 0.01 98.99 0.28 0.10 0.52 98.49 0.60 0.00 0.00 0.00 72 L H H 27.36 16.01 17.12 33.47 91.62 51.10 -63.24 -41.98 0.37 0.00 99.63 0.09 0.04 0.18 99.44 0.25 0.00 0.00 0.00 73 K H H 111.64 2.82 24.47 26.43 91.66 50.41 -64.44 -41.65 0.34 0.00 99.66 0.06 0.03 0.18 99.63 0.10 0.00 0.00 0.00 74 V H H 42.22 7.39 21.42 29.95 91.64 49.54 -64.24 -42.82 0.40 0.00 99.59 0.05 0.03 0.25 99.58 0.10 0.00 0.00 0.00 75 A H H 5.66 19.51 14.62 35.05 91.37 50.95 -63.01 -42.52 0.56 0.00 99.44 0.08 0.04 0.32 99.46 0.09 0.00 0.00 0.00 76 K H H 84.40 10.78 17.07 28.27 91.82 51.44 -63.40 -40.57 0.67 0.00 99.33 0.08 0.05 0.42 99.31 0.13 0.00 0.00 0.00 77 R H H 168.51 1.31 19.58 19.72 92.15 50.35 -65.78 -38.61 1.18 0.00 98.82 0.07 0.07 0.93 98.70 0.23 0.00 0.00 0.00 78 K H H 112.08 5.94 17.39 24.14 96.31 40.43 -79.52 -36.93 3.35 0.01 96.65 0.09 0.16 3.03 96.42 0.29 0.01 0.00 0.00 79 L H H 52.09 12.47 12.87 25.85 101.26 27.82 -101.55 -15.82 10.53 0.04 89.44 0.58 1.43 8.02 89.67 0.25 0.02 0.01 0.02 80 G C S 46.92 2.60 17.56 20.42 103.30 -123.91 81.37 -4.44 99.08 0.26 0.66 33.79 54.66 10.71 0.35 0.24 0.00 0.09 0.17 81 T C S 61.49 3.62 17.54 21.63 133.03 27.38 -136.69 162.67 97.21 1.51 1.28 41.19 54.76 1.05 1.18 0.17 0.00 0.26 1.41 82 H H H 106.76 9.08 13.02 23.17 92.29 -112.02 -61.93 -36.48 7.99 0.05 91.96 1.78 3.59 2.85 91.11 0.61 0.01 0.01 0.03 83 K H H 142.65 1.29 19.06 18.99 91.76 53.27 -63.54 -41.77 2.25 0.01 97.74 0.27 0.27 1.52 97.39 0.54 0.00 0.00 0.00 84 R H H 100.08 4.79 18.61 24.13 92.09 47.30 -65.83 -40.30 0.93 0.00 99.06 0.16 0.09 0.57 98.60 0.57 0.00 0.00 0.00 85 A H H 7.73 17.03 12.26 30.43 91.26 52.02 -62.53 -42.89 0.41 0.00 99.59 0.08 0.03 0.22 99.46 0.21 0.00 0.00 0.00 86 K H H 103.76 5.00 20.40 25.90 91.61 50.42 -63.99 -41.34 0.32 0.00 99.68 0.05 0.02 0.17 99.67 0.09 0.00 0.00 0.00 87 K H H 116.76 1.84 22.18 22.16 91.65 49.43 -64.53 -41.83 0.25 0.00 99.75 0.03 0.01 0.14 99.77 0.05 0.00 0.00 0.00 88 K H H 68.27 11.21 18.42 30.10 92.17 49.39 -65.31 -40.60 0.17 0.00 99.83 0.02 0.01 0.10 99.84 0.03 0.00 0.00 0.00 89 R H H 76.11 14.76 17.24 31.58 91.51 51.81 -62.97 -41.64 0.11 0.00 99.89 0.01 0.00 0.06 99.90 0.02 0.00 0.00 0.00 90 E H H 113.80 2.23 22.48 23.55 91.51 49.82 -64.14 -41.39 0.11 0.00 99.89 0.01 0.00 0.06 99.90 0.02 0.00 0.00 0.00 91 E H H 98.78 3.68 22.12 25.45 91.66 49.06 -64.85 -41.56 0.15 0.00 99.85 0.01 0.00 0.09 99.87 0.02 0.00 0.00 0.00 92 M H H 29.38 15.96 17.09 33.51 91.80 49.70 -64.77 -41.68 0.21 0.00 99.79 0.02 0.01 0.14 99.81 0.03 0.00 0.00 0.00 93 S H H 37.69 8.66 19.54 29.20 91.51 51.61 -63.19 -41.06 0.31 0.00 99.69 0.03 0.01 0.19 99.74 0.03 0.00 0.00 0.00 94 S H H 56.06 2.55 22.43 23.75 91.52 50.45 -64.42 -41.47 0.37 0.00 99.63 0.04 0.01 0.24 99.67 0.04 0.00 0.00 0.00 95 V H H 42.75 8.55 19.60 29.40 91.79 50.03 -64.23 -42.96 0.16 0.00 99.84 0.02 0.01 0.10 99.84 0.04 0.00 0.00 0.00 96 L H H 37.07 13.74 17.11 31.47 91.62 49.90 -63.69 -42.05 0.12 0.00 99.88 0.01 0.00 0.07 99.87 0.03 0.00 0.00 0.00 97 R H H 126.84 3.69 19.91 23.97 91.49 50.26 -63.81 -41.71 0.20 0.00 99.80 0.02 0.01 0.12 99.79 0.06 0.00 0.00 0.00 98 K H H 120.20 2.49 19.64 21.74 91.70 49.73 -65.06 -41.06 0.49 0.00 99.51 0.04 0.03 0.34 99.45 0.14 0.00 0.00 0.00 99 M H H 65.04 10.12 15.69 26.64 92.25 49.41 -65.58 -40.57 1.68 0.01 98.32 0.19 0.12 1.18 98.18 0.32 0.00 0.00 0.00 100 R H H 118.86 7.02 15.70 23.73 92.36 50.54 -65.76 -38.56 6.67 0.04 93.29 1.00 0.70 4.62 92.97 0.66 0.01 0.02 0.02 101 S H H 77.37 1.93 16.01 17.81 93.21 50.89 -69.75 -30.82 23.08 0.22 76.70 4.78 2.85 15.04 75.77 1.31 0.03 0.09 0.12 102 A H H 69.52 3.89 13.46 18.40 95.60 56.57 -74.90 -21.52 45.41 0.64 53.95 9.79 8.25 27.68 51.15 2.46 0.07 0.24 0.37 103 G C T 46.82 5.10 13.66 19.85 101.01 31.07 -39.04 -10.60 69.28 0.68 30.03 14.98 13.70 40.70 25.87 3.99 0.03 0.26 0.45 104 G C T 47.99 4.21 13.82 19.18 103.35 -11.49 59.24 -6.40 81.32 0.77 17.91 25.09 19.16 37.88 11.74 5.27 0.01 0.31 0.54 105 G C C 41.79 5.48 12.89 19.68 106.32 35.11 55.48 -11.05 83.66 1.16 15.18 41.51 20.43 22.24 8.44 6.11 0.00 0.46 0.83 106 A C C 67.45 4.93 12.05 18.33 101.98 82.96 -76.44 -14.91 69.98 1.38 28.64 40.89 17.21 12.55 17.56 10.32 0.01 0.56 0.91 107 G C C 46.63 3.85 11.64 16.82 101.41 46.71 -62.39 -27.63 62.29 1.29 36.42 33.75 13.55 15.29 18.86 17.23 0.01 0.60 0.70 108 D C C 104.22 2.85 10.17 14.45 100.35 62.68 -80.25 -8.07 56.92 1.49 41.58 30.50 11.98 14.84 21.07 20.15 0.02 0.71 0.74 109 K C C 145.01 2.44 8.94 12.96 102.62 71.57 -83.66 12.22 59.12 1.96 38.92 33.74 12.27 13.77 20.00 18.29 0.02 0.92 0.99 110 K C C 145.91 2.46 8.45 12.65 107.29 83.73 -85.55 98.13 74.26 1.39 24.36 63.14 2.59 10.34 14.67 7.77 0.00 0.74 0.75 111 K C C 150.36 2.50 10.55 14.72 108.87 -138.66 -85.54 114.43 99.82 0.04 0.14 99.54 0.13 0.21 0.07 0.01 0.00 0.02 0.01