# 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 L C C 92.28 7.94 11.44 20.40 109.66 -163.08 -89.20 115.41 99.82 0.09 0.09 99.66 0.13 0.10 0.05 0.01 0.00 0.04 0.02 1 G C C 47.70 3.37 11.12 15.87 113.28 -135.70 -68.57 -41.75 77.33 1.02 21.66 68.05 1.48 7.93 19.31 2.24 0.00 0.48 0.52 2 S C H 89.44 1.62 9.93 12.50 103.58 -50.44 -81.55 16.15 56.78 1.57 41.65 32.61 11.63 13.49 35.84 4.97 0.02 0.73 0.71 3 M H H 113.67 3.90 9.11 14.70 105.69 86.39 -84.04 32.25 47.64 1.38 50.98 26.83 12.00 10.35 45.32 4.27 0.03 0.64 0.56 4 D H H 84.42 3.18 12.01 16.32 107.29 -134.43 -82.82 127.03 47.07 0.94 51.98 36.84 5.17 5.34 49.08 2.78 0.00 0.41 0.37 5 A H H 58.47 4.54 11.40 17.55 94.63 -128.75 -64.60 -37.77 7.85 0.09 92.05 4.74 1.36 2.21 90.52 1.10 0.00 0.04 0.03 6 Q H H 108.44 2.32 13.85 16.69 92.88 52.31 -65.68 -40.49 3.87 0.05 96.08 1.75 0.59 1.63 95.14 0.84 0.00 0.02 0.01 7 T H H 69.41 2.24 14.28 16.84 92.54 50.07 -65.49 -41.14 2.99 0.04 96.96 1.37 0.45 1.30 96.11 0.73 0.00 0.02 0.01 8 R H H 120.32 2.67 14.68 17.84 92.40 50.28 -65.05 -40.98 1.77 0.02 98.21 0.77 0.24 0.76 97.86 0.35 0.00 0.01 0.00 9 R H H 115.89 3.73 14.62 19.36 92.06 50.83 -64.37 -41.65 1.16 0.01 98.82 0.44 0.14 0.53 98.68 0.20 0.00 0.00 0.00 10 R H H 130.17 2.60 15.57 18.62 91.92 50.29 -64.44 -40.87 0.97 0.01 99.02 0.30 0.10 0.49 98.93 0.17 0.00 0.00 0.00 11 E H H 108.12 1.88 16.72 18.00 91.88 50.00 -64.81 -41.32 1.16 0.00 98.84 0.29 0.10 0.64 98.78 0.18 0.00 0.00 0.00 12 R H H 124.49 2.66 16.52 19.32 92.01 49.66 -64.82 -41.33 2.13 0.01 97.86 0.45 0.18 1.30 97.84 0.22 0.00 0.00 0.00 13 R H H 108.81 5.09 15.53 21.60 92.11 50.05 -65.19 -40.40 2.45 0.01 97.54 0.59 0.24 1.40 97.58 0.18 0.00 0.00 0.00 14 A H H 54.33 2.97 16.17 19.70 91.84 51.59 -63.58 -41.54 0.88 0.00 99.12 0.26 0.08 0.41 99.15 0.11 0.00 0.00 0.00 15 E H H 113.22 1.69 18.07 18.58 91.92 49.55 -64.89 -40.91 0.61 0.00 99.39 0.13 0.04 0.33 99.40 0.10 0.00 0.00 0.00 16 K H H 102.10 4.21 16.60 21.48 92.02 49.54 -65.16 -40.85 0.57 0.00 99.43 0.11 0.04 0.31 99.46 0.09 0.00 0.00 0.00 17 Q H H 82.32 6.21 15.58 22.85 91.89 51.15 -63.65 -41.09 0.59 0.00 99.40 0.11 0.04 0.33 99.43 0.09 0.00 0.00 0.00 18 A H H 57.29 2.33 17.08 19.23 91.82 50.92 -63.57 -41.36 0.61 0.00 99.39 0.11 0.04 0.34 99.41 0.10 0.00 0.00 0.00 19 Q H H 104.92 2.21 17.46 19.29 92.20 49.89 -65.19 -40.39 0.74 0.00 99.26 0.11 0.05 0.46 99.23 0.15 0.00 0.00 0.00 20 W H H 95.61 7.90 13.67 22.90 92.56 50.37 -65.10 -41.32 0.89 0.00 99.11 0.14 0.06 0.56 98.97 0.27 0.00 0.00 0.00 21 K H H 120.90 4.20 15.47 20.86 92.27 51.64 -64.42 -38.46 2.44 0.01 97.56 0.28 0.16 1.77 97.29 0.50 0.00 0.00 0.00 22 A H H 76.78 1.88 15.51 17.29 93.05 52.32 -68.83 -30.11 10.05 0.02 89.92 0.62 0.61 8.44 89.60 0.71 0.01 0.01 0.01 23 A H H 62.53 5.32 13.55 19.92 96.55 53.23 -81.55 -15.48 31.11 0.28 68.61 4.13 4.90 22.36 67.13 1.13 0.07 0.09 0.19 24 N C C 77.58 8.37 12.26 21.61 108.07 91.65 -96.78 99.10 70.16 1.21 28.63 45.98 16.04 7.98 21.02 7.82 0.01 0.50 0.66 25 P C H 80.71 6.77 13.61 21.72 100.65 -170.62 -69.89 -7.31 48.96 2.36 48.69 26.01 7.60 14.91 31.10 18.08 0.03 1.49 0.78 26 L H H 97.87 6.24 14.15 21.36 101.61 63.28 -84.31 1.64 35.72 11.37 52.91 19.60 6.30 10.50 34.47 17.95 0.22 9.11 1.84 27 L H H 78.17 9.68 13.15 23.50 109.08 58.73 -85.20 110.18 33.52 16.27 50.21 20.90 6.34 7.69 34.49 15.06 0.22 12.63 2.68 28 V C H 78.21 8.26 13.34 22.48 110.39 64.85 -91.64 115.20 46.20 12.72 41.08 24.59 9.23 13.79 31.43 8.54 0.30 9.60 2.54 29 G C C 39.95 6.65 14.34 21.78 105.92 24.52 -51.91 4.04 67.84 4.95 27.21 32.18 12.28 23.72 19.79 7.38 0.07 3.12 1.48 30 V C C 91.34 7.07 12.04 20.00 100.24 55.76 -78.96 -16.38 72.39 4.44 23.16 30.49 15.03 27.72 14.76 7.83 0.06 2.49 1.63 31 S C C 82.73 2.99 13.55 17.43 101.07 58.21 -86.60 2.52 79.57 3.93 16.50 33.13 16.67 30.69 8.92 6.86 0.03 2.15 1.55 32 A C C 59.44 8.08 9.52 18.73 113.14 108.50 -86.06 139.95 87.86 3.90 8.24 45.63 33.11 9.62 3.82 4.12 0.00 2.12 1.57 33 K C C 141.46 2.52 13.58 17.31 116.21 -119.02 -91.27 136.69 92.25 6.46 1.29 58.96 32.30 1.61 0.69 0.60 0.00 4.13 1.71 34 P C C 89.67 5.70 11.60 19.06 112.72 -103.93 -65.67 143.20 87.23 10.13 2.65 80.89 4.08 2.06 1.31 1.21 0.00 6.04 4.40 35 V C C 72.63 10.02 8.60 19.35 112.58 -128.50 -89.14 129.43 90.36 5.08 4.57 74.29 9.21 6.59 2.09 2.39 0.00 2.97 2.46 36 N C C 132.33 1.47 13.16 15.00 101.07 -162.67 -93.92 10.30 91.89 2.84 5.27 55.28 28.87 8.03 2.66 2.45 0.00 1.46 1.24 37 R C C 130.62 4.66 11.16 17.60 119.44 102.62 -98.09 141.00 87.24 2.91 9.85 49.13 35.22 3.05 7.92 2.15 0.00 1.43 1.10 38 P C C 82.25 4.78 12.71 19.00 111.02 -106.63 -66.44 145.27 68.09 5.78 26.13 59.39 4.19 4.83 17.51 8.35 0.00 4.26 1.47 39 I H H 85.21 10.12 10.20 20.80 101.25 -124.60 -73.17 -16.31 39.96 15.09 44.95 25.23 7.79 7.77 26.15 18.85 0.13 11.53 2.55 40 L H H 98.88 5.85 11.86 18.94 103.34 65.38 -80.07 3.90 32.53 21.23 46.24 19.72 6.76 7.50 25.72 20.20 0.17 17.60 2.32 41 S H C 69.89 4.08 12.65 17.91 105.12 59.97 -91.68 40.44 39.98 17.73 42.29 25.90 6.83 8.00 22.41 19.87 0.09 14.70 2.20 42 L C C 89.36 8.62 9.12 18.55 101.45 80.42 -79.82 -3.38 61.85 11.14 27.01 37.85 12.73 11.44 18.09 9.23 0.08 7.96 2.61 43 N C C 119.84 2.71 11.95 15.67 103.54 72.83 -90.77 31.04 77.58 7.11 15.31 46.50 17.30 13.58 10.66 5.11 0.02 4.73 2.10 44 R C C 139.62 4.70 10.09 16.69 115.39 123.09 -95.39 139.10 88.70 4.63 6.67 51.01 31.86 5.94 4.75 2.12 0.00 2.52 1.79 45 K C C 144.35 2.67 12.29 16.50 115.17 -114.70 -84.03 137.53 95.95 2.24 1.81 74.86 19.82 1.31 1.46 0.47 0.00 1.25 0.83 46 P C C 74.70 8.07 9.51 18.89 111.93 -106.40 -65.75 146.01 85.93 2.60 11.47 78.19 3.80 4.19 8.51 2.70 0.00 1.38 1.23 47 K C C 131.41 4.90 11.61 17.80 104.74 -128.97 -76.23 21.50 63.33 1.79 34.87 42.08 9.81 10.95 27.19 8.19 0.01 0.87 0.90 48 S C H 72.38 3.55 12.40 17.02 107.26 -40.40 -83.59 -28.60 52.73 1.87 45.41 31.12 11.44 10.79 36.84 8.11 0.02 1.00 0.68 49 R H H 138.65 4.08 13.35 18.40 99.17 53.76 -76.88 -23.39 36.58 2.53 60.89 25.87 6.00 6.44 51.89 7.48 0.02 1.59 0.72 50 V H H 60.48 9.99 10.84 21.51 95.94 59.97 -69.68 -39.40 17.16 2.06 80.78 11.56 3.02 4.47 70.51 8.40 0.03 1.62 0.39 51 E H H 110.72 5.26 14.01 20.42 94.86 56.11 -67.30 -37.50 13.85 1.60 84.56 7.29 2.36 5.18 73.20 10.30 0.04 1.35 0.29 52 S H H 72.80 3.06 14.53 18.28 95.29 54.59 -71.16 -28.16 19.14 1.40 79.47 6.41 3.23 9.98 68.05 10.84 0.10 1.04 0.36 53 A H H 58.95 6.64 12.76 20.56 96.13 59.66 -77.61 -19.95 32.69 2.13 65.18 9.15 6.03 18.89 55.82 7.80 0.23 1.33 0.75 54 L C H 78.96 9.68 10.83 21.14 103.28 65.53 -89.26 17.83 61.01 6.70 32.29 26.40 23.73 12.62 27.57 3.30 0.21 2.64 3.52 55 N C C 91.34 5.71 12.37 19.56 112.51 123.97 -90.31 118.53 87.52 2.34 10.14 70.61 10.95 5.46 8.41 2.36 0.00 1.30 0.92 56 P C C 97.89 3.77 12.44 17.68 98.59 -139.73 -72.21 -9.25 59.89 2.35 37.76 30.62 10.84 18.56 26.00 11.73 0.03 1.33 0.88 57 I C H 91.09 7.54 10.46 19.19 112.30 73.23 -89.08 128.74 56.10 3.33 40.57 25.65 14.39 17.18 29.07 10.50 0.13 1.74 1.33 58 D C C 81.01 4.88 13.15 19.35 108.75 -116.11 -82.09 117.87 57.51 2.44 40.06 44.18 6.37 7.18 31.49 8.52 0.00 1.34 0.91 59 L H H 101.99 5.10 12.10 18.81 94.93 -156.99 -65.88 -32.70 8.31 0.18 91.51 5.13 1.43 2.13 89.94 1.23 0.00 0.09 0.05 60 T H H 89.75 1.65 15.78 16.89 92.89 56.44 -65.38 -40.46 3.93 0.14 95.93 1.81 0.57 1.72 94.66 1.12 0.01 0.10 0.02 61 V H H 57.98 5.81 14.99 22.34 92.54 49.87 -65.73 -41.55 2.14 0.09 97.78 1.00 0.29 0.94 96.76 0.93 0.00 0.06 0.01 62 L H H 48.90 10.34 13.97 25.59 92.29 51.55 -64.30 -41.53 1.15 0.03 98.82 0.55 0.14 0.47 98.38 0.44 0.00 0.02 0.00 63 A H H 50.48 3.41 17.36 21.43 91.47 51.35 -63.55 -41.17 0.92 0.01 99.07 0.38 0.09 0.41 98.87 0.24 0.00 0.01 0.00 64 E H H 101.57 2.46 18.78 20.75 91.87 50.09 -65.02 -40.75 0.79 0.01 99.20 0.25 0.07 0.40 99.09 0.18 0.00 0.00 0.00 65 Y H H 67.83 10.30 15.98 27.31 92.13 50.26 -64.56 -41.63 0.70 0.00 99.30 0.20 0.06 0.36 99.25 0.12 0.00 0.00 0.00 66 H H H 82.04 8.77 16.91 26.49 91.74 51.61 -63.75 -40.86 0.55 0.00 99.45 0.14 0.04 0.28 99.44 0.09 0.00 0.00 0.00 67 K H H 122.80 1.82 19.67 20.28 91.83 50.32 -64.72 -40.78 0.57 0.00 99.43 0.11 0.04 0.33 99.42 0.10 0.00 0.00 0.00 68 Q H H 87.62 3.95 18.64 23.01 92.03 49.44 -65.20 -40.92 0.90 0.01 99.09 0.17 0.07 0.55 99.08 0.13 0.00 0.00 0.00 69 I H H 41.37 12.37 14.81 28.04 92.24 49.95 -64.78 -42.10 1.32 0.01 98.67 0.32 0.12 0.74 98.59 0.22 0.00 0.00 0.00 70 E H H 96.84 4.81 17.93 23.60 91.78 50.80 -63.68 -40.74 2.29 0.02 97.69 0.48 0.21 1.40 97.46 0.44 0.00 0.01 0.00 71 S H H 62.89 1.93 19.11 19.74 92.36 49.92 -65.58 -39.91 7.02 0.04 92.94 0.98 0.57 5.13 92.55 0.73 0.01 0.02 0.01 72 N H H 63.30 7.10 16.62 24.91 93.86 49.32 -69.34 -37.38 12.45 0.11 87.44 3.00 1.33 7.89 86.46 1.20 0.02 0.05 0.04 73 L H H 51.52 11.44 13.74 26.07 92.75 55.82 -64.61 -40.42 9.56 0.26 90.19 4.68 1.46 3.95 86.81 2.88 0.01 0.15 0.07 74 Q H H 106.11 2.53 17.69 20.06 92.47 51.81 -65.67 -38.43 10.71 0.47 88.82 5.39 1.47 4.42 84.99 3.28 0.02 0.34 0.09 75 R H H 128.57 2.97 16.86 20.04 93.09 51.57 -66.56 -38.73 13.08 0.80 86.12 6.31 1.98 5.47 82.15 3.31 0.03 0.59 0.17 76 I H H 54.72 10.44 12.18 23.76 95.86 51.94 -71.83 -35.37 17.22 1.29 81.49 9.63 2.79 5.69 78.04 2.67 0.03 0.86 0.29 77 E H H 106.84 5.09 14.31 20.56 97.35 57.64 -71.21 -30.77 26.45 1.39 72.16 14.28 3.75 9.04 69.23 2.45 0.03 0.85 0.38 78 R H H 151.39 2.62 13.47 16.84 99.53 59.65 -75.36 -22.46 36.49 1.16 62.35 15.17 6.12 16.12 58.25 3.25 0.05 0.61 0.43 79 K C H 125.55 4.26 12.72 18.23 100.94 58.43 -79.48 -16.29 51.54 1.24 47.21 15.11 9.06 28.27 41.64 4.65 0.09 0.61 0.56 80 N C T 94.62 6.19 12.67 19.96 102.27 50.12 -89.70 27.57 66.29 2.09 31.62 22.25 11.69 33.09 25.64 5.36 0.06 1.08 0.84 81 Q C C 98.69 7.26 12.57 21.09 107.54 140.71 -87.03 86.02 72.37 6.79 20.84 41.42 15.06 15.91 14.96 6.21 0.04 4.39 2.00 82 R C C 120.39 7.80 14.10 23.05 113.94 127.41 -94.89 129.00 69.70 15.18 15.13 44.65 15.76 9.28 9.58 5.68 0.03 12.94 2.08 83 T C C 62.61 9.69 15.03 25.65 115.28 -158.38 -100.62 130.23 55.65 32.85 11.50 35.77 13.14 7.07 6.36 4.68 0.05 31.24 1.70 84 W E E 95.48 11.84 14.21 26.83 120.36 -160.43 -107.79 135.47 29.05 63.75 7.20 20.43 6.32 4.11 3.90 3.02 0.02 60.70 1.50 85 Y E E 96.84 9.39 15.32 25.94 123.40 -164.36 -115.27 137.51 15.34 81.79 2.87 11.90 2.68 1.37 1.99 1.07 0.00 79.31 1.67 86 S E E 50.00 10.43 12.86 24.30 124.03 -163.36 -115.54 143.45 20.71 77.91 1.38 16.80 3.35 1.06 0.85 0.62 0.00 75.54 1.80 87 K C E 119.74 4.87 13.18 19.81 118.67 -147.93 -107.01 132.55 51.36 47.98 0.66 42.18 6.61 1.16 0.23 0.37 0.00 48.67 0.77 88 P C C 92.10 4.58 9.99 16.47 113.78 -113.16 -69.04 143.48 62.57 32.86 4.57 40.22 12.95 9.60 1.50 2.93 0.00 31.38 1.42 89 G C C 43.10 3.48 8.80 14.09 127.23 164.70 -130.83 -176.92 69.66 22.28 8.07 41.83 15.58 13.40 2.53 5.78 0.03 17.26 3.59 90 E C T 170.61 0.58 10.03 9.94 95.87 -76.16 -69.36 -21.97 83.71 3.02 13.28 11.15 27.36 46.35 3.83 8.36 0.02 1.96 0.96 91 R C T 178.56 1.64 9.70 11.92 100.54 33.68 -96.47 10.90 84.33 3.64 12.03 10.04 25.36 49.79 3.54 7.67 0.02 2.58 0.99 92 G C E 39.22 4.07 11.93 17.50 126.13 -86.06 120.41 -175.77 56.11 37.48 6.41 26.20 21.31 11.85 3.05 3.36 0.08 31.34 2.80 93 I E E 83.29 8.99 9.80 19.89 118.39 -44.65 -101.20 132.98 40.26 55.81 3.93 33.04 4.88 1.87 3.02 1.03 0.00 53.36 2.79 94 T E E 77.23 5.03 15.43 21.86 120.96 -162.53 -114.47 136.10 27.29 68.85 3.85 21.70 4.15 1.54 3.15 0.81 0.00 66.98 1.67 95 C E E 51.47 12.48 10.83 23.90 121.76 -158.01 -112.95 137.82 26.62 69.27 4.11 21.15 4.04 1.51 3.35 0.88 0.00 67.52 1.55 96 S E E 67.60 4.94 15.49 21.86 120.52 -171.11 -120.44 140.06 34.45 59.62 5.92 26.26 5.63 2.65 4.44 1.42 0.01 58.02 1.58 97 G C E 32.94 8.57 13.37 22.91 127.32 -137.34 -139.68 166.56 46.48 45.57 7.94 29.40 13.81 4.87 5.31 2.30 0.02 42.71 1.60 98 R C E 135.18 6.65 13.86 22.12 121.62 -131.58 -113.01 138.15 44.95 42.01 13.03 34.41 6.85 3.61 9.56 3.49 0.04 39.02 3.01 99 Q C C 90.76 8.51 12.31 22.11 118.29 -155.64 -103.87 134.88 46.17 37.65 16.18 35.51 6.47 4.11 11.75 4.53 0.08 34.60 2.95 100 K C C 122.47 5.35 12.99 19.91 117.43 -140.87 -98.84 135.69 51.53 32.78 15.69 40.13 6.63 4.67 10.89 4.77 0.06 29.90 2.96 101 I C C 86.91 7.81 9.31 18.60 116.92 -151.80 -103.40 132.05 57.36 25.67 16.97 37.26 11.26 9.51 11.00 5.90 0.16 20.79 4.11 102 K C T 151.22 3.00 11.06 15.24 106.55 -89.66 -73.86 103.14 76.29 10.24 13.46 22.64 15.63 38.85 7.33 5.58 0.06 7.84 2.08 103 G C T 58.26 2.21 11.25 14.20 105.41 -15.06 81.78 -7.71 86.30 4.66 9.04 20.21 20.81 45.84 3.60 5.04 0.01 3.53 0.95 104 K C C 139.21 2.97 10.21 14.85 116.48 86.04 -93.89 139.53 74.49 18.20 7.30 38.82 19.73 16.92 2.36 4.94 0.02 14.41 2.80 105 S C C 79.86 3.66 10.40 15.74 113.75 -123.33 -89.87 133.82 69.79 26.15 4.06 43.38 18.32 8.52 1.38 3.08 0.02 21.13 4.17 106 I C C 87.47 7.62 8.47 17.55 117.37 -143.72 -100.08 131.84 76.76 22.30 0.94 53.58 21.97 1.51 0.56 0.50 0.00 19.98 1.91 107 P C C 90.59 3.25 11.31 16.17 113.52 -111.85 -68.21 145.01 75.98 22.20 1.83 65.89 6.05 2.79 0.78 1.09 0.00 21.03 2.37 108 L C C 115.60 4.66 8.91 15.44 109.32 -120.79 -80.43 126.31 80.29 17.59 2.12 73.56 2.93 3.50 0.94 0.98 0.00 13.37 4.72 109 I C C 107.92 5.72 11.52 18.65 115.61 -160.56 -101.88 130.03 98.74 1.25 0.01 98.77 0.17 0.04 0.01 0.00 0.00 0.94 0.07