# 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 K C C 134.22 3.61 15.81 20.29 110.15 -144.62 -89.89 115.29 99.61 0.28 0.11 99.28 0.29 0.14 0.04 0.02 0.00 0.13 0.09 1 M C C 88.20 11.55 9.55 21.02 98.69 -156.62 -74.50 -16.76 64.97 2.14 32.88 55.43 2.29 8.28 5.35 26.59 0.00 1.31 0.75 2 A C G 74.64 4.04 11.63 17.13 97.76 74.30 -71.00 -21.06 59.99 2.28 37.74 17.26 11.20 31.70 4.46 33.19 0.02 1.30 0.88 3 S C G 87.15 1.85 13.97 16.07 99.12 54.59 -91.05 1.72 55.43 4.43 40.14 18.09 11.82 26.78 4.01 35.25 0.05 2.75 1.25 4 A C C 34.35 13.22 7.25 20.27 119.22 111.85 -83.25 147.68 90.23 7.94 1.82 51.89 37.45 0.72 1.09 0.61 0.00 1.94 6.32 5 T C C 69.59 3.30 14.92 18.74 117.63 -107.14 -73.85 159.37 97.15 2.35 0.50 94.61 2.50 0.11 0.38 0.08 0.00 0.82 1.49 6 R H H 161.84 3.28 13.16 18.04 92.01 -107.15 -59.13 -38.00 2.63 0.04 97.33 0.35 0.56 1.80 96.81 0.45 0.01 0.01 0.01 7 L H H 101.01 3.82 15.11 19.58 91.94 51.85 -64.67 -41.14 1.71 0.03 98.26 0.12 0.19 1.45 97.61 0.60 0.01 0.02 0.00 8 I H H 65.55 7.34 15.59 24.14 92.51 47.47 -65.94 -41.34 0.68 0.05 99.26 0.07 0.09 0.55 98.62 0.62 0.01 0.05 0.01 9 Q H H 66.86 8.56 16.26 25.96 91.66 51.43 -63.63 -41.93 0.21 0.02 99.77 0.03 0.03 0.15 99.57 0.20 0.00 0.02 0.00 10 G H H 27.34 6.44 17.56 25.36 91.49 50.73 -63.72 -42.05 0.35 0.05 99.60 0.04 0.04 0.29 99.38 0.20 0.00 0.04 0.01 11 L H H 72.28 6.13 19.18 25.75 91.82 49.74 -64.17 -42.05 0.42 0.06 99.52 0.05 0.05 0.37 99.21 0.27 0.01 0.05 0.01 12 R H H 82.79 8.79 18.22 27.83 91.96 50.57 -63.98 -41.60 0.68 0.04 99.27 0.08 0.07 0.58 98.94 0.29 0.01 0.03 0.01 13 N H H 50.96 8.00 16.88 26.34 91.93 50.46 -64.44 -41.39 2.30 0.09 97.61 0.31 0.21 1.91 96.83 0.61 0.03 0.07 0.03 14 W H H 119.00 6.75 16.75 24.41 92.14 50.27 -64.59 -41.60 3.24 0.06 96.70 0.25 0.25 2.96 95.47 0.97 0.04 0.04 0.03 15 A H H 60.69 6.76 15.79 23.53 91.57 51.59 -67.58 -31.68 9.73 0.07 90.21 0.35 0.51 9.19 88.36 1.44 0.08 0.03 0.05 16 S C T 60.54 5.54 14.78 21.64 93.16 50.80 -86.33 -5.34 57.99 0.21 41.80 1.49 3.17 51.82 41.38 1.86 0.04 0.07 0.16 17 G C T 50.15 3.58 14.60 19.47 95.94 -112.28 79.33 11.35 92.47 0.70 6.83 16.37 11.84 64.20 5.31 1.60 0.00 0.34 0.34 18 R C C 110.19 7.14 11.67 20.43 114.41 140.54 -90.68 140.70 74.39 2.52 23.09 53.42 13.22 7.27 19.11 4.37 0.01 1.14 1.45 19 D C C 95.28 4.08 16.49 21.30 106.61 -134.15 -85.91 101.47 65.30 2.02 32.68 47.83 8.01 8.90 28.02 5.32 0.01 1.09 0.83 20 L H H 50.66 13.74 11.95 26.00 98.54 168.58 -78.95 -20.37 39.08 2.30 58.63 27.93 5.47 7.75 48.30 8.41 0.02 1.36 0.77 21 Q H H 89.25 8.74 14.58 24.08 94.38 81.34 -65.58 -39.82 20.53 1.66 77.82 11.75 4.03 6.71 63.81 12.06 0.06 1.13 0.45 22 A H H 63.16 3.78 16.05 20.47 93.18 54.06 -68.05 -35.00 18.08 1.15 80.77 7.57 3.41 7.90 64.46 15.45 0.08 0.81 0.31 23 K H H 114.02 4.88 15.95 21.59 94.72 51.09 -74.70 -25.68 21.38 1.00 77.61 7.86 3.83 10.29 61.63 15.30 0.11 0.66 0.33 24 L H H 48.54 13.09 11.67 25.16 99.56 54.37 -80.72 -6.34 30.48 1.81 67.71 13.04 5.76 12.52 50.18 16.60 0.17 1.01 0.71 25 Q H H 97.09 6.91 13.58 21.75 96.96 92.40 -68.65 -27.35 40.91 2.90 56.19 14.77 6.38 18.91 36.21 20.65 0.23 1.71 1.13 26 L C H 101.93 4.75 13.85 19.53 96.92 62.26 -79.17 -1.51 49.53 3.77 46.70 16.51 8.56 23.95 25.70 21.36 0.23 2.16 1.53 27 R C C 123.37 6.80 13.02 20.93 101.56 84.33 -84.97 -19.89 58.54 6.75 34.71 28.74 13.34 16.96 18.27 16.00 0.23 3.52 2.95 28 Y C C 92.84 9.82 10.55 21.18 108.91 54.31 -99.38 88.21 74.01 6.85 19.13 49.03 15.96 8.47 13.48 5.85 0.05 2.90 4.26 29 Q C T 119.35 4.08 13.13 18.80 95.60 138.35 -64.17 -34.05 51.09 1.49 47.41 10.27 9.55 30.32 28.92 18.94 0.29 0.78 0.93 30 E C T 133.19 2.27 14.70 17.28 94.38 51.39 -70.84 -27.27 52.42 1.07 46.50 8.47 8.66 33.72 29.16 18.43 0.27 0.57 0.72 31 I C T 72.00 8.96 12.69 22.58 100.17 43.62 -88.04 -28.25 51.42 3.47 45.10 13.09 11.02 27.89 27.74 15.94 0.64 1.91 1.78 32 S C C 36.39 12.13 10.68 23.30 106.04 59.79 -89.27 22.58 66.27 8.91 24.82 41.51 16.76 8.45 18.65 5.59 0.12 3.68 5.25 33 K C C 122.18 4.24 15.49 20.76 106.52 69.73 -80.83 95.22 74.95 7.84 17.21 54.66 9.78 9.71 10.55 6.84 0.02 3.91 4.53 34 R C C 140.92 6.76 12.18 20.11 98.22 71.96 -75.05 -13.87 83.30 4.05 12.66 38.64 24.68 21.01 5.41 6.22 0.02 1.80 2.22 35 T C C 87.94 5.19 12.84 18.98 101.43 61.01 -91.36 2.20 90.04 3.35 6.62 48.56 23.41 18.29 2.15 4.04 0.00 1.36 2.19 36 Q C C 88.16 7.32 10.27 19.23 118.86 101.33 -90.05 142.36 97.91 1.79 0.29 59.75 37.80 0.53 0.12 0.13 0.00 0.59 1.09 37 P C C 95.41 2.69 14.09 17.67 116.72 -97.44 -66.38 150.57 99.32 0.60 0.07 91.39 7.74 0.21 0.03 0.03 0.00 0.24 0.36 38 P C C 94.19 5.08 12.80 19.81 114.16 -93.20 -64.42 144.20 99.49 0.44 0.06 97.50 1.91 0.14 0.02 0.02 0.00 0.18 0.23 39 P C C 54.27 13.55 9.70 23.40 114.13 -107.67 -67.36 148.61 98.47 1.34 0.19 95.96 2.16 0.44 0.06 0.08 0.00 0.53 0.77 40 K C C 159.96 1.50 18.49 19.55 112.18 -125.95 -94.33 125.95 90.01 9.78 0.21 80.02 8.57 0.41 0.10 0.10 0.00 2.20 8.60 41 L C C 60.46 16.25 9.98 25.54 118.13 -139.45 -84.38 140.15 97.73 2.13 0.13 89.36 8.27 0.27 0.05 0.07 0.00 0.97 1.00 42 P C C 54.12 8.40 14.09 24.09 115.63 -106.89 -65.80 151.70 98.71 0.93 0.37 93.90 3.66 1.20 0.11 0.19 0.00 0.41 0.53 43 V C C 113.95 3.10 15.41 19.65 115.93 -109.30 -82.62 143.55 96.93 2.30 0.77 61.89 32.24 2.08 0.30 0.42 0.00 0.63 2.44 44 G C S 30.34 6.78 14.95 22.90 131.04 49.15 98.68 -168.66 78.76 1.94 19.29 27.35 39.56 12.14 5.37 13.14 0.02 0.71 1.72 45 P H G 77.29 6.70 15.43 23.18 92.56 -44.63 -66.26 -22.84 46.11 0.50 53.38 4.53 5.34 34.54 7.34 47.68 0.01 0.28 0.29 46 S H G 35.63 12.55 13.37 26.68 92.21 62.59 -74.92 -15.07 37.03 0.62 62.34 4.83 4.05 26.60 9.50 54.36 0.01 0.36 0.29 47 H H G 76.52 11.82 13.71 26.11 93.25 76.63 -70.86 -20.10 36.89 1.36 61.74 13.64 6.83 17.18 12.51 48.54 0.01 0.75 0.54 48 R C G 148.16 4.21 17.27 21.92 97.32 63.98 -80.97 -14.59 51.84 2.77 45.39 14.46 10.52 27.22 11.35 33.54 0.08 1.46 1.37 49 L C S 74.17 9.88 13.84 24.38 105.82 72.61 -86.83 1.64 60.26 11.86 27.88 20.50 23.66 16.67 9.27 16.55 0.30 4.16 8.90 50 S C T 56.26 8.51 14.61 23.80 108.40 30.39 -80.05 111.49 77.76 2.44 19.80 8.55 11.24 57.46 5.58 14.25 0.05 1.45 1.40 51 N C T 102.11 5.86 17.00 23.73 97.44 -51.84 43.73 28.13 82.59 1.81 15.60 14.62 13.64 54.14 3.46 12.16 0.01 1.05 0.92 52 N C C 42.87 12.23 13.27 26.65 107.72 138.23 -93.82 90.31 81.87 7.48 10.64 62.25 13.24 5.19 5.99 4.68 0.01 2.99 5.65 53 Y C C 95.20 8.98 17.05 27.06 95.65 -155.00 -71.89 -25.64 56.46 7.59 35.95 31.73 10.29 15.18 22.44 11.95 0.31 3.32 4.77 54 Y H H 87.18 12.25 15.44 27.87 93.45 61.03 -70.13 -25.82 43.69 1.77 54.54 6.05 6.71 28.58 30.66 25.52 0.41 1.02 1.05 55 C H H 61.42 9.19 15.34 25.10 99.29 47.53 -88.86 -22.55 42.44 1.61 55.95 5.16 6.60 28.26 30.84 26.85 0.47 0.94 0.88 56 A H H 64.74 5.16 17.15 22.85 102.10 42.77 -97.12 -9.45 47.79 3.62 48.59 11.95 11.32 24.45 26.01 21.86 0.65 1.86 1.91 57 R C C 98.50 10.08 12.67 23.53 115.78 96.90 -94.01 140.62 77.25 7.93 14.82 35.74 29.29 12.64 9.34 4.75 0.15 2.95 5.15 58 D C C 58.18 7.61 14.62 23.71 115.32 -144.20 -99.31 132.05 89.44 6.46 4.09 68.39 15.29 4.80 2.38 1.74 0.00 2.60 4.80 59 G C T 32.65 10.08 12.90 24.23 93.17 -139.27 -65.33 -24.35 50.26 1.62 48.12 12.35 10.66 26.67 23.88 24.39 0.20 0.82 1.03 60 R H G 126.74 7.34 14.40 22.45 93.05 64.29 -71.01 -22.80 42.64 1.27 56.09 6.47 7.02 26.84 28.75 29.21 0.26 0.73 0.71 61 R H H 132.59 5.94 14.64 21.47 95.27 57.71 -76.96 -19.93 38.95 3.11 57.94 9.51 7.99 20.44 29.73 28.82 0.35 2.03 1.13 62 E C H 112.11 5.52 14.37 20.93 98.32 56.20 -88.05 -1.41 47.07 7.66 45.27 18.73 10.62 18.83 25.08 18.83 0.56 4.69 2.65 63 A C C 50.11 10.56 10.78 22.16 110.67 98.48 -87.57 122.40 70.81 16.12 13.07 41.92 21.56 7.16 8.37 4.51 0.16 6.67 9.65 64 M C C 116.66 4.16 14.80 20.38 121.48 -153.40 -108.81 135.10 89.59 9.79 0.62 53.99 35.96 0.85 0.34 0.28 0.00 5.03 3.55 65 P C C 83.05 6.32 13.53 21.19 116.55 -100.96 -66.63 150.26 97.60 2.07 0.33 89.24 7.94 0.62 0.13 0.15 0.00 1.38 0.55 66 P C C 68.10 10.93 10.88 22.63 113.43 -103.16 -65.89 147.24 92.40 4.81 2.80 80.77 8.56 3.16 1.25 1.40 0.00 3.65 1.20 67 S E E 72.88 4.66 14.37 20.32 116.85 -143.79 -101.11 135.40 45.55 47.03 7.42 34.24 8.87 3.60 4.75 3.35 0.11 38.94 6.13 68 I E E 100.39 7.59 12.09 20.95 114.06 -135.97 -92.61 126.62 30.56 60.83 8.61 25.62 3.47 1.92 6.61 2.74 0.02 55.71 3.91 69 V E E 81.71 7.14 12.54 20.81 104.78 -170.69 -95.76 -12.54 38.02 49.85 12.14 28.40 6.48 4.26 8.41 3.94 0.06 46.24 2.20 70 M C C 92.32 7.14 12.23 20.61 124.44 2.43 -124.10 141.88 52.50 36.39 11.12 36.41 10.07 6.60 7.36 3.82 0.07 33.50 2.17 71 S C C 66.83 5.09 12.55 18.91 117.60 -144.73 -94.39 151.88 71.43 15.65 12.92 48.34 13.77 8.73 8.92 4.35 0.03 14.01 1.85 72 S C C 77.21 4.91 12.23 18.30 99.27 -110.04 -72.69 -15.99 58.90 7.36 33.74 28.46 15.75 15.25 23.92 9.49 0.22 5.22 1.69 73 Q C H 115.10 4.25 13.00 18.46 101.49 64.62 -85.15 -4.10 47.18 14.17 38.64 25.05 10.99 11.75 27.90 10.38 0.34 11.47 2.11 74 K H H 109.95 7.32 12.94 21.15 105.11 66.36 -81.56 62.38 36.44 25.77 37.79 24.48 6.03 6.37 28.53 9.29 0.15 22.73 2.41 75 V H H 69.94 9.02 13.45 23.36 110.71 87.24 -90.67 110.43 29.28 33.55 37.17 20.47 4.43 4.45 31.45 6.14 0.13 30.09 2.85 76 L H E 84.67 8.59 13.18 22.64 108.69 -140.14 -84.87 106.97 33.18 32.81 34.01 21.89 5.63 5.82 28.81 5.76 0.16 29.27 2.66 77 V C C 87.35 6.07 13.86 20.92 110.96 69.05 -91.56 111.44 45.96 25.16 28.88 28.90 7.56 8.98 24.42 5.40 0.23 21.55 2.96 78 A C T 67.49 6.76 11.88 19.75 107.76 -108.67 -77.43 121.64 75.27 10.20 14.53 25.89 12.61 36.83 11.33 3.69 0.08 7.71 1.86 79 G C T 52.98 3.47 13.26 17.90 106.48 12.43 86.37 -0.29 90.87 4.64 4.48 27.26 22.36 42.18 1.86 2.12 0.00 3.31 0.91 80 K C C 117.45 5.08 11.16 18.04 118.04 117.76 -92.26 140.24 92.77 5.84 1.39 58.98 32.45 1.91 0.77 0.61 0.00 3.25 2.02 81 P C C 86.76 4.36 11.88 17.71 111.64 -105.45 -67.65 149.17 85.11 6.48 8.40 68.81 8.49 7.19 4.02 4.58 0.00 3.98 2.93 82 A C C 75.96 5.06 9.93 16.56 101.67 -109.93 -71.22 -17.13 72.87 3.45 23.68 34.79 16.22 22.50 10.25 12.92 0.02 1.86 1.42 83 E C C 137.78 2.62 12.06 15.71 103.20 58.41 -82.69 22.50 68.88 3.82 27.30 33.22 14.34 21.90 13.29 13.55 0.05 2.06 1.59 84 S C C 65.97 6.16 10.26 17.74 105.68 85.73 -85.04 52.53 62.52 2.80 34.68 38.95 12.94 10.58 21.45 13.42 0.02 1.50 1.14 85 S C C 77.56 3.51 12.69 17.45 103.86 60.98 -82.79 12.71 56.16 3.79 40.05 34.71 11.33 10.65 29.06 10.69 0.04 2.29 1.23 86 A C H 63.47 5.64 12.22 19.28 106.76 66.03 -82.32 70.56 47.92 8.05 44.04 31.47 9.24 8.22 33.61 9.78 0.09 5.79 1.80 87 V H H 74.34 8.72 11.03 20.68 108.67 64.76 -85.71 110.79 42.45 14.56 42.99 30.76 6.80 5.99 35.19 6.94 0.11 11.52 2.69 88 A C H 65.72 5.08 13.41 19.72 107.78 -133.17 -81.55 120.52 44.83 15.91 39.26 32.24 6.91 6.39 32.89 5.84 0.12 12.80 2.80 89 A C C 69.88 5.13 12.21 18.68 104.43 59.70 -80.62 18.16 50.08 14.91 35.02 33.07 8.83 8.64 29.03 5.86 0.16 11.63 2.79 90 S C C 66.74 6.54 11.18 18.93 104.84 70.24 -85.34 21.94 64.70 10.93 24.37 38.84 13.71 11.92 19.65 5.43 0.10 8.01 2.34 91 E C C 126.73 4.08 12.90 18.36 107.44 77.13 -86.67 88.53 73.82 10.81 15.37 46.49 16.26 10.72 11.36 4.73 0.04 7.82 2.57 92 K C C 126.39 5.86 11.59 19.01 111.60 75.72 -88.20 121.86 80.13 11.87 8.00 58.61 14.65 6.27 5.28 3.12 0.01 8.02 4.04 93 K C C 120.49 6.19 12.59 20.24 116.59 -150.71 -97.26 134.35 83.74 12.47 3.79 66.63 13.08 3.35 2.20 1.76 0.00 8.59 4.38 94 A C C 64.90 6.65 13.56 21.48 114.45 -114.81 -74.59 145.44 87.98 10.07 1.95 78.38 7.23 2.04 0.96 0.95 0.00 7.42 3.02 95 V C C 88.44 8.13 12.29 21.48 113.65 -118.10 -87.98 129.76 85.67 12.50 1.83 68.20 13.69 2.84 0.89 0.99 0.00 6.81 6.58 96 S C C 56.75 7.58 12.02 21.00 125.25 -158.22 -110.43 154.37 90.51 8.84 0.66 64.14 23.93 2.47 0.26 0.42 0.00 4.04 4.75 97 P C C 93.66 5.24 12.78 19.23 108.49 -91.43 -73.22 135.28 96.60 2.74 0.66 45.02 44.34 7.47 0.15 0.51 0.00 1.42 1.10 98 A C S 58.78 6.68 10.70 18.80 122.00 -98.14 -90.81 159.72 97.04 2.42 0.54 37.08 57.14 3.01 0.14 0.35 0.00 1.06 1.23 99 P C C 100.09 2.65 14.62 17.98 115.01 -82.06 -68.12 147.72 97.57 1.74 0.70 71.43 24.12 2.06 0.29 0.39 0.00 0.87 0.84 100 P C C 86.39 6.42 10.96 19.06 114.41 -104.06 -67.61 146.53 93.92 3.72 2.36 84.46 6.67 2.64 1.17 1.09 0.00 1.78 2.20 101 I C C 81.68 9.51 8.70 19.24 112.61 -111.82 -79.90 135.25 85.02 7.80 7.18 74.13 6.54 3.55 3.95 3.24 0.00 4.00 4.60 102 K C C 144.47 2.54 12.71 16.53 111.49 -130.38 -84.12 130.24 72.46 6.19 21.35 56.94 8.64 6.56 8.38 13.20 0.00 3.95 2.31 103 R C G 158.79 3.90 11.65 16.95 99.37 -111.55 -74.96 -8.49 50.69 4.68 44.63 30.53 10.43 10.98 12.04 31.67 0.02 3.14 1.18 104 W C G 137.38 7.88 9.57 18.53 107.19 56.71 -87.27 91.82 48.64 5.41 45.95 29.86 9.49 10.57 11.70 33.43 0.02 3.73 1.21 105 E C C 124.74 3.67 13.89 18.80 108.36 98.16 -89.05 97.19 52.87 9.56 37.57 37.44 8.25 8.08 12.24 24.92 0.02 6.67 2.39 106 L C C 74.17 10.40 9.99 21.19 117.25 141.95 -89.45 139.30 69.64 13.19 17.17 48.40 13.31 6.86 10.34 7.29 0.05 7.33 6.42 107 S C C 46.54 7.05 10.70 19.64 115.17 -113.14 -81.86 145.69 83.43 8.47 8.09 69.74 6.53 6.41 4.23 3.83 0.00 4.80 4.45 108 Q C T 138.92 2.71 11.78 15.98 95.73 -136.04 -73.95 -18.93 93.14 2.76 4.10 16.78 23.35 53.41 1.43 2.30 0.01 1.54 1.17 109 D C T 111.60 1.95 11.40 14.19 97.21 61.06 -87.63 -3.75 95.67 1.81 2.52 17.44 25.99 52.45 0.56 1.82 0.00 1.07 0.66 110 E C C 79.35 8.23 7.64 17.24 114.51 99.32 -88.15 128.33 94.39 3.44 2.18 50.95 38.80 4.58 0.41 1.90 0.00 1.42 1.94 111 P C T 99.64 2.70 11.67 15.72 97.44 -135.48 -66.82 -17.76 93.64 1.94 4.42 30.86 16.70 45.98 0.62 4.06 0.00 1.17 0.62 112 Y C C 126.42 6.86 9.83 17.98 103.73 64.95 -85.91 5.54 90.31 4.61 5.08 51.26 5.63 33.97 1.06 3.47 0.00 2.92 1.69 113 L C C 74.43 10.47 11.57 22.67 103.23 71.16 -85.38 17.05 98.19 1.58 0.22 97.50 0.57 0.31 0.08 0.08 0.00 1.12 0.35