# 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 79.42 13.06 15.11 27.88 115.62 -163.01 -94.13 134.94 99.50 0.45 0.05 99.26 0.25 0.15 0.02 0.01 0.00 0.24 0.07 1 G C C 41.69 7.31 14.08 22.42 117.10 112.27 102.19 -46.49 93.16 4.99 1.85 83.07 3.14 7.04 0.52 1.13 0.00 2.92 2.17 2 G C C 46.71 5.57 12.08 19.04 114.46 107.63 85.60 -154.08 91.33 5.78 2.89 52.43 22.44 16.49 0.54 2.60 0.00 3.23 2.29 3 H C C 140.89 3.60 11.35 16.45 107.42 -89.67 -91.83 50.03 90.98 5.01 4.02 51.25 22.24 17.42 0.69 3.61 0.00 2.60 2.18 4 H C C 123.65 5.44 9.81 16.80 107.55 139.94 -91.96 66.92 91.72 4.50 3.77 50.90 24.29 16.41 0.70 3.26 0.00 2.10 2.33 5 G C C 48.52 3.74 11.91 17.18 115.79 -55.80 95.68 -172.77 95.85 2.57 1.59 48.25 38.21 9.43 0.27 1.41 0.00 1.28 1.16 6 E C C 136.26 2.46 12.93 16.53 115.91 -31.46 -87.99 139.48 97.27 2.19 0.53 60.18 35.53 1.81 0.12 0.40 0.00 1.05 0.91 7 P C C 93.86 5.13 13.05 19.97 111.86 -100.11 -68.42 141.83 96.96 2.38 0.66 80.68 12.30 3.89 0.12 0.61 0.00 1.55 0.86 8 Y C C 79.05 15.04 10.43 25.11 116.83 -125.32 -91.39 135.13 89.78 9.62 0.59 82.99 5.35 1.41 0.15 0.46 0.00 6.26 3.38 9 T C C 93.04 3.73 20.44 24.78 116.25 -142.72 -98.58 129.91 77.77 22.00 0.23 74.44 3.68 0.32 0.10 0.13 0.00 10.17 11.16 10 V C C 40.22 19.43 13.07 31.67 116.29 -141.31 -92.72 128.56 95.02 4.94 0.04 91.63 3.73 0.08 0.01 0.02 0.00 3.59 0.94 11 P C C 27.02 15.41 14.57 30.83 115.76 -109.42 -66.76 150.70 98.90 1.04 0.07 96.82 2.16 0.15 0.02 0.02 0.00 0.49 0.33 12 H C C 108.58 4.65 21.80 26.40 110.77 -112.34 -80.79 127.85 98.65 1.05 0.30 97.54 1.01 0.16 0.11 0.08 0.00 0.29 0.81 13 A H G 30.50 18.80 10.63 28.75 92.15 -136.82 -62.04 -26.04 29.12 0.41 70.47 5.59 3.49 18.71 4.07 67.77 0.00 0.26 0.10 14 S H G 81.80 3.08 16.79 21.03 90.62 67.55 -68.99 -16.48 28.53 0.40 71.07 3.39 3.36 20.24 3.85 68.80 0.00 0.26 0.10 15 T H G 79.54 5.10 16.72 22.70 95.53 60.50 -84.02 -16.07 26.52 0.94 72.54 5.79 5.66 15.08 3.46 69.21 0.00 0.60 0.19 16 Y C C 44.43 19.08 10.76 28.84 115.58 73.87 -101.73 124.13 75.72 6.75 17.53 52.21 17.58 6.12 3.79 13.88 0.01 4.06 2.36 17 K C C 124.10 4.61 20.80 26.55 118.30 -165.39 -113.27 127.80 84.35 13.82 1.83 79.80 3.26 1.12 0.74 0.96 0.00 8.70 5.41 18 V C C 27.69 19.68 10.72 29.63 113.27 -158.80 -102.74 115.97 82.42 15.72 1.86 79.13 2.06 1.18 0.85 0.88 0.00 10.79 5.12 19 E C T 125.01 3.70 16.37 21.36 114.62 -149.24 -85.23 137.85 91.71 6.83 1.45 36.63 10.75 45.13 0.41 0.88 0.00 5.00 1.18 20 S C T 94.50 1.42 17.27 18.18 94.84 6.80 58.07 25.56 97.32 1.82 0.87 14.44 28.55 54.54 0.13 0.75 0.00 1.22 0.37 21 V C C 23.57 16.98 8.58 25.39 111.13 114.91 -112.59 106.26 98.82 0.61 0.57 80.49 17.74 0.50 0.43 0.14 0.00 0.20 0.49 22 P H H 86.21 2.86 18.28 21.41 93.62 -157.08 -61.20 -36.06 23.62 0.13 76.25 1.94 2.06 18.83 62.06 14.91 0.07 0.07 0.07 23 Q H H 80.11 9.44 17.62 27.67 92.06 53.57 -66.63 -32.18 18.46 0.11 81.43 1.08 1.23 15.80 67.05 14.64 0.08 0.06 0.06 24 L H H 11.03 21.77 13.27 34.79 93.76 49.65 -70.22 -33.68 8.76 0.24 91.00 2.20 0.94 5.30 75.35 15.96 0.03 0.17 0.05 25 V H H 64.97 7.54 19.32 27.70 91.98 58.25 -62.20 -42.10 1.46 0.03 98.51 0.61 0.20 0.62 98.01 0.54 0.00 0.01 0.00 26 E H H 105.53 2.81 23.38 25.27 91.69 49.80 -64.91 -41.34 0.55 0.01 99.44 0.16 0.05 0.27 99.33 0.18 0.00 0.00 0.00 27 V H H 15.46 17.68 18.82 36.77 92.01 49.18 -64.70 -43.09 0.24 0.00 99.76 0.04 0.02 0.13 99.71 0.10 0.00 0.00 0.00 28 K H H 49.79 17.12 18.91 35.24 91.82 51.99 -62.69 -42.06 0.13 0.00 99.87 0.01 0.01 0.08 99.86 0.04 0.00 0.00 0.00 29 E H H 106.17 2.78 24.26 26.14 91.59 49.71 -64.35 -41.34 0.19 0.00 99.81 0.02 0.01 0.12 99.81 0.04 0.00 0.00 0.00 30 A H H 31.39 6.91 20.39 28.72 91.59 50.12 -64.28 -41.48 0.45 0.00 99.54 0.03 0.02 0.34 99.51 0.09 0.00 0.00 0.00 31 L H H 10.61 18.58 13.93 33.28 91.75 50.68 -64.72 -41.33 1.53 0.01 98.46 0.12 0.12 1.16 98.09 0.51 0.00 0.00 0.00 32 G H H 30.41 9.12 15.58 25.73 92.19 53.33 -63.84 -39.72 4.84 0.02 95.14 0.37 0.25 3.95 91.83 3.58 0.01 0.01 0.01 33 R H H 180.64 1.02 17.81 17.69 90.90 53.11 -66.28 -29.09 15.40 0.06 84.53 0.54 0.74 14.52 80.48 3.60 0.06 0.03 0.04 34 Q C T 95.40 6.80 14.25 22.39 93.43 49.26 -89.90 0.50 72.58 0.11 27.31 0.74 2.73 68.59 24.60 3.15 0.02 0.04 0.13 35 G C T 51.12 2.84 18.95 21.87 96.85 -106.26 84.80 10.29 99.40 0.04 0.55 3.32 2.80 93.45 0.22 0.16 0.00 0.03 0.02 36 L C C 32.98 18.65 10.89 28.93 111.26 133.68 -93.06 117.27 98.41 0.65 0.94 94.30 2.53 1.69 0.33 0.43 0.00 0.26 0.46 37 K C C 124.48 6.50 20.03 27.19 101.14 173.78 -98.15 -7.56 98.60 0.70 0.69 81.93 14.42 2.11 0.27 0.37 0.00 0.26 0.64 38 D C C 35.91 14.19 16.67 31.52 108.26 109.38 -93.88 105.25 99.33 0.44 0.24 81.45 17.42 0.35 0.16 0.07 0.00 0.11 0.45 39 P H H 51.02 12.21 19.04 32.32 92.63 -162.78 -63.03 -31.21 26.84 0.14 73.02 2.84 2.83 19.26 43.02 31.83 0.08 0.07 0.09 40 W H H 72.65 14.63 20.36 34.76 92.09 61.01 -65.23 -38.20 18.51 0.11 81.37 1.06 1.32 14.79 44.37 38.27 0.06 0.06 0.06 41 L H H 23.80 18.59 19.36 37.58 92.80 49.78 -67.77 -37.74 13.32 0.19 86.49 1.39 1.43 9.20 47.58 40.17 0.04 0.11 0.08 42 R H H 60.63 16.38 20.86 36.45 91.82 53.26 -68.07 -34.14 18.23 0.57 81.20 3.61 2.72 10.51 48.43 34.05 0.10 0.30 0.27 43 N C T 39.24 15.31 21.58 36.71 95.77 52.27 -81.58 -17.52 49.94 1.85 48.21 10.03 7.71 30.75 27.14 22.09 0.26 0.96 1.07 44 E C C 39.15 15.78 21.78 37.34 96.94 67.01 -79.85 -4.91 56.17 7.72 36.11 30.06 7.88 17.95 18.76 16.72 0.07 2.92 5.63 45 V H G 18.69 20.35 18.67 38.75 93.00 96.13 -61.76 -37.73 15.51 1.07 83.42 4.80 2.47 8.28 15.21 68.23 0.03 0.71 0.26 46 W H G 70.34 15.05 20.33 35.44 91.43 57.91 -70.54 -20.81 15.22 0.96 83.82 3.13 2.16 9.70 14.10 70.00 0.02 0.66 0.23 47 R H G 83.80 12.42 20.66 32.99 93.70 59.04 -80.32 -17.71 18.56 1.42 80.01 5.01 3.19 10.45 11.45 68.55 0.03 0.93 0.38 48 Y C C 58.15 16.38 16.19 32.23 103.21 63.77 -92.98 19.05 73.63 5.20 21.17 37.93 28.02 8.20 9.78 10.09 0.07 1.87 4.04 49 E C C 62.28 11.42 15.58 27.90 109.33 101.70 -98.37 105.92 97.16 1.25 1.59 80.85 14.39 1.71 0.96 0.57 0.00 0.46 1.06 50 P C C 71.38 9.92 13.49 24.49 95.97 -162.18 -66.20 -23.30 60.73 0.90 38.37 26.97 9.10 25.19 16.89 20.76 0.01 0.42 0.66 51 K C T 152.28 1.90 16.19 18.13 94.92 60.72 -71.16 -21.87 52.60 0.59 46.81 9.84 8.76 33.09 19.40 28.14 0.04 0.28 0.46 52 A C G 53.12 8.40 13.38 22.66 98.89 54.46 -79.88 -19.51 50.09 1.02 48.90 13.07 9.94 27.20 19.87 28.71 0.05 0.49 0.66 53 F C C 79.65 12.35 11.03 23.43 105.55 46.92 -98.67 14.34 62.14 1.96 35.90 28.49 13.47 21.52 17.32 16.95 0.05 0.84 1.36 54 G C C 39.73 5.67 14.51 21.37 114.64 -127.77 91.77 -163.66 90.51 1.57 7.92 49.29 28.47 13.09 4.31 3.05 0.00 0.56 1.24 55 T C C 75.01 3.49 15.03 19.22 117.24 -21.05 -99.33 152.29 92.74 1.48 5.77 57.33 31.11 4.12 4.57 1.25 0.00 0.45 1.17 56 H H H 121.46 5.84 12.40 19.85 93.85 -116.52 -61.85 -37.31 13.97 0.18 85.85 4.63 4.54 6.39 82.21 2.03 0.04 0.07 0.10 57 R H H 154.65 1.98 15.48 17.53 92.96 53.50 -65.42 -38.27 8.31 0.09 91.60 1.81 1.33 5.31 89.22 2.21 0.05 0.04 0.03 58 S H H 44.65 5.91 14.60 22.03 93.82 49.92 -68.02 -38.73 5.62 0.12 94.25 2.03 0.84 3.07 91.38 2.54 0.03 0.08 0.04 59 R H H 74.79 11.45 13.68 25.87 92.66 52.24 -64.33 -41.25 3.02 0.07 96.91 1.04 0.44 1.62 95.10 1.73 0.01 0.04 0.02 60 L H H 77.47 5.51 16.86 23.33 92.13 50.26 -64.72 -40.85 2.90 0.06 97.04 0.70 0.36 1.84 95.17 1.85 0.02 0.04 0.01 61 N H H 78.98 3.99 18.17 22.48 92.50 49.74 -65.84 -40.51 4.47 0.07 95.46 0.74 0.48 3.28 93.08 2.31 0.04 0.04 0.02 62 T H H 43.91 10.65 15.69 27.25 93.26 49.02 -67.62 -40.35 8.37 0.07 91.56 0.64 0.75 7.23 88.56 2.65 0.10 0.03 0.04 63 F H H 76.64 11.42 16.39 28.13 95.57 43.13 -72.78 -38.58 20.33 0.14 79.53 0.78 1.63 18.83 74.97 3.39 0.24 0.06 0.10 64 L H H 91.34 5.55 18.12 24.06 95.82 42.46 -76.55 -36.05 45.48 0.41 54.11 1.42 3.94 39.73 49.57 4.42 0.40 0.17 0.35 65 F C H 109.36 5.53 17.96 23.87 98.55 40.10 -88.02 -26.04 49.56 0.96 49.48 3.87 6.54 38.27 41.70 7.73 0.66 0.44 0.79 66 R C T 97.81 11.29 16.64 27.97 104.68 82.68 -73.21 101.02 65.57 0.59 33.83 3.16 4.98 55.65 28.57 6.68 0.16 0.28 0.53 67 G C T 22.04 13.85 17.21 30.67 98.37 28.52 77.18 -5.48 62.20 0.30 37.50 4.70 4.55 51.63 32.27 6.37 0.07 0.14 0.27 68 L H H 67.80 11.83 17.33 29.37 94.38 94.72 -64.19 -40.44 16.95 0.22 82.82 6.02 4.00 8.52 78.66 2.52 0.06 0.08 0.14 69 G H H 38.56 4.94 21.28 26.12 93.17 48.96 -64.91 -42.19 11.12 0.11 88.77 2.45 1.65 7.41 86.71 1.60 0.05 0.05 0.06 70 V H H 67.65 7.18 21.13 28.56 92.84 46.88 -66.71 -40.82 5.44 0.05 94.51 1.08 0.70 3.72 93.36 1.09 0.02 0.02 0.02 71 G H H 10.46 17.16 17.04 34.50 92.33 52.59 -64.15 -42.26 1.31 0.00 98.68 0.28 0.13 0.76 98.60 0.23 0.00 0.00 0.00 72 F H H 85.32 9.67 21.50 31.26 91.76 50.27 -63.63 -42.26 0.13 0.00 99.87 0.02 0.01 0.07 99.87 0.03 0.00 0.00 0.00 73 C H H 64.96 3.70 23.49 26.80 91.65 49.96 -64.08 -42.12 0.04 0.00 99.96 0.00 0.00 0.03 99.96 0.01 0.00 0.00 0.00 74 A H H 34.01 10.59 20.86 31.94 91.56 50.08 -64.78 -41.97 0.02 0.00 99.98 0.00 0.00 0.02 99.97 0.01 0.00 0.00 0.00 75 F H H 48.54 16.47 19.95 36.02 91.77 50.33 -63.56 -42.46 0.02 0.00 99.98 0.00 0.00 0.02 99.98 0.00 0.00 0.00 0.00 76 L H H 80.02 6.56 23.18 29.98 91.40 50.12 -63.65 -42.46 0.02 0.00 99.98 0.00 0.00 0.01 99.98 0.00 0.00 0.00 0.00 77 A H H 54.67 3.89 23.85 27.45 91.50 50.02 -64.18 -42.10 0.02 0.00 99.98 0.00 0.00 0.02 99.98 0.00 0.00 0.00 0.00 78 T H H 29.36 14.37 20.07 34.76 91.83 49.49 -64.68 -42.36 0.05 0.00 99.95 0.00 0.00 0.04 99.95 0.00 0.00 0.00 0.00 79 V H H 37.37 14.48 19.75 34.18 91.59 49.84 -63.44 -42.39 0.07 0.00 99.93 0.00 0.00 0.06 99.94 0.00 0.00 0.00 0.00 80 A H H 54.61 3.54 22.10 25.29 91.32 50.27 -63.28 -42.12 0.08 0.00 99.92 0.00 0.00 0.06 99.92 0.01 0.00 0.00 0.00 81 V H H 64.54 5.07 20.49 25.87 91.63 48.93 -64.83 -42.15 0.11 0.00 99.89 0.01 0.00 0.08 99.88 0.03 0.00 0.00 0.00 82 E H H 32.34 14.77 14.89 30.50 91.88 49.96 -64.75 -41.56 0.21 0.00 99.79 0.01 0.01 0.16 99.73 0.08 0.00 0.00 0.00 83 Y H H 109.47 8.37 15.88 25.19 91.54 50.02 -64.58 -39.80 0.73 0.00 99.27 0.04 0.03 0.62 99.05 0.27 0.00 0.00 0.00 84 A H H 80.68 2.07 16.34 18.44 91.48 52.50 -66.75 -30.24 4.69 0.01 95.30 0.12 0.17 4.44 94.84 0.42 0.01 0.00 0.00 85 L C H 100.18 4.32 13.78 19.30 94.72 50.25 -87.66 -4.72 50.07 0.12 49.81 1.08 2.64 44.98 49.95 1.17 0.04 0.03 0.10 86 G C T 51.53 3.32 14.91 19.50 98.89 -109.95 80.81 17.61 95.09 0.37 4.54 16.42 10.21 68.50 3.66 0.87 0.00 0.16 0.18 87 I C C 74.26 10.02 11.21 22.42 111.93 155.61 -85.68 125.91 93.31 1.86 4.83 66.57 16.30 10.43 1.93 2.73 0.00 0.91 1.14 88 G C C 42.49 6.52 15.39 22.99 115.92 -68.78 79.29 158.58 93.80 1.99 4.21 68.07 12.65 13.03 1.26 2.92 0.00 1.08 0.99 89 K C C 119.11 8.41 13.86 23.06 108.94 -123.57 -88.73 105.46 89.13 3.78 7.09 55.68 18.60 14.65 1.89 5.24 0.00 1.87 2.07 90 G C C 42.42 6.72 13.89 21.68 112.51 -11.03 88.26 161.25 89.17 3.25 7.58 51.33 19.80 17.85 1.62 6.16 0.00 1.60 1.65 91 Q C C 121.56 4.71 13.57 19.78 108.18 -101.94 -89.05 79.41 82.92 3.37 13.72 40.98 19.85 22.19 2.75 10.87 0.01 1.58 1.77 92 G C T 49.73 4.74 13.63 19.69 109.22 3.07 81.89 3.11 81.97 2.55 15.47 28.96 22.16 31.25 2.71 12.40 0.01 1.22 1.30 93 G C C 45.06 6.58 13.73 21.34 106.99 -36.96 76.59 6.51 79.75 3.30 16.95 35.25 22.30 22.47 3.24 13.47 0.01 1.57 1.70 94 H C C 112.45 7.03 13.43 21.59 108.35 112.37 -92.49 86.78 78.66 4.60 16.74 40.66 18.62 19.73 3.70 12.73 0.01 2.22 2.33 95 G C C 41.60 8.10 13.33 22.23 112.00 -140.99 69.71 132.69 83.74 4.08 12.18 43.08 19.32 21.46 2.60 9.55 0.01 2.06 1.91 96 H C C 114.66 6.97 14.05 21.99 108.59 113.60 -94.88 81.21 83.61 4.88 11.51 45.49 21.52 16.80 2.60 8.75 0.01 2.37 2.46 97 G C C 44.15 6.60 13.60 21.32 109.09 -113.09 83.57 61.21 87.36 3.96 8.68 45.99 22.77 18.81 1.90 6.69 0.00 1.96 1.88 98 H C C 118.57 6.16 12.89 20.35 111.56 134.91 -95.36 116.77 83.74 5.19 11.07 44.03 22.51 17.63 2.88 7.82 0.01 2.48 2.65 99 G C C 42.77 6.55 12.85 20.53 112.43 -60.04 74.80 149.59 81.67 4.39 13.94 43.03 21.03 18.36 3.95 9.34 0.01 2.17 2.10 100 H C C 118.75 6.63 11.85 19.53 106.36 -129.35 -89.22 44.87 73.35 5.02 21.63 45.23 15.47 12.93 8.13 13.21 0.02 2.59 2.42 101 E C C 120.96 4.69 11.75 17.89 106.69 114.31 -87.04 70.47 66.67 5.00 28.32 37.01 14.76 15.68 11.89 15.79 0.05 2.65 2.17 102 E C C 125.87 4.37 11.83 17.69 108.06 142.59 -90.29 87.04 65.76 4.98 29.26 34.47 14.90 17.23 13.33 15.18 0.05 2.69 2.14 103 H C C 115.87 6.25 10.58 18.15 110.50 100.85 -94.37 105.50 68.65 5.36 25.99 37.28 15.73 16.33 13.71 11.63 0.06 2.79 2.47 104 G C C 43.21 5.56 11.60 18.50 113.99 41.66 -106.98 160.94 74.12 4.27 21.61 39.42 18.37 17.25 10.30 10.45 0.03 2.10 2.08 105 D C C 100.02 4.40 10.18 16.11 105.64 -93.48 -85.13 60.07 73.24 3.67 23.10 40.67 16.49 16.76 9.40 13.03 0.02 1.81 1.82 106 K C C 145.25 2.83 10.17 14.57 103.78 132.21 -85.63 26.42 69.99 3.38 26.63 27.22 17.88 26.51 8.13 16.90 0.04 1.73 1.58 107 G C C 51.88 3.71 9.92 15.16 106.70 44.15 -66.18 11.30 74.34 4.17 21.49 33.02 16.95 25.99 4.97 15.15 0.02 2.20 1.69 108 H C C 131.72 4.01 8.49 14.18 108.09 94.32 -91.63 73.17 81.77 4.57 13.66 67.45 4.33 11.08 3.94 8.34 0.00 2.74 2.12 109 H C C 126.44 4.89 10.75 17.26 111.54 138.02 -94.53 115.55 99.63 0.29 0.07 99.35 0.25 0.16 0.03 0.01 0.00 0.15 0.05