# 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 78.44 12.67 15.60 28.21 116.82 -158.36 -92.92 130.01 99.44 0.46 0.10 99.33 0.19 0.09 0.06 0.01 0.00 0.26 0.06 1 R C C 124.44 8.13 14.67 23.70 114.23 -158.02 -95.05 129.49 65.36 13.70 20.94 60.29 1.79 3.23 19.65 1.81 0.00 9.79 3.43 2 R C C 119.57 9.19 13.82 23.76 113.95 -152.41 -93.66 129.85 53.02 16.91 30.07 39.25 7.19 5.31 27.59 3.51 0.03 15.01 2.11 3 T C H 63.78 10.28 15.98 26.77 114.53 -162.46 -102.17 132.41 41.33 22.50 36.17 29.93 5.71 4.45 31.96 4.30 0.04 21.83 1.78 4 V H H 41.76 15.83 15.44 31.25 122.12 -160.86 -111.07 135.81 30.52 28.55 40.93 21.61 4.24 3.87 35.28 5.34 0.05 28.01 1.59 5 R H H 94.78 11.70 20.02 31.69 117.89 -156.00 -103.09 131.41 24.91 32.17 42.92 16.63 3.69 4.06 36.43 6.24 0.07 31.26 1.61 6 A H H 28.34 16.42 18.56 34.82 118.82 -156.20 -103.98 133.12 25.48 34.14 40.37 16.35 4.09 5.03 33.77 6.60 0.12 32.11 1.94 7 L E E 41.90 15.87 19.19 34.99 116.19 -158.98 -103.87 129.49 29.99 35.77 34.24 18.01 5.36 7.17 28.88 5.95 0.22 31.51 2.90 8 Y C E 69.18 13.99 18.68 32.79 120.53 -159.42 -110.54 134.39 44.57 33.08 22.35 26.38 9.63 8.88 19.03 4.40 0.35 26.81 4.53 9 N C C 42.88 13.61 16.20 30.31 117.09 -151.34 -102.50 141.03 74.88 16.96 8.15 51.25 14.99 8.04 6.03 2.57 0.02 14.30 2.80 10 S C T 56.11 8.82 16.16 25.80 100.57 -138.51 -76.64 -10.49 76.89 6.28 16.82 28.78 19.18 30.30 8.49 7.24 0.07 4.24 1.71 11 F C T 116.13 7.54 14.76 23.03 102.06 60.95 -84.06 -7.80 76.65 3.76 19.59 19.59 21.03 36.99 9.03 9.44 0.09 2.10 1.73 12 E C C 97.07 8.94 13.31 22.93 105.98 73.49 -86.48 58.78 75.01 4.56 20.43 28.43 20.71 27.26 8.00 11.04 0.07 2.37 2.12 13 R C T 142.24 5.23 14.76 21.23 108.85 95.41 -88.18 107.47 77.19 5.62 17.18 25.03 20.09 33.45 6.31 9.62 0.06 3.29 2.15 14 G C C 39.00 7.14 15.96 23.93 106.92 18.03 88.61 -0.95 80.18 8.31 11.51 35.91 18.33 27.51 3.44 7.20 0.02 5.36 2.24 15 W C C 76.32 15.61 11.03 26.00 108.77 109.40 -90.43 88.57 70.19 13.49 16.32 52.18 8.43 9.15 4.92 11.64 0.01 9.70 3.97 16 K C C 114.72 6.59 15.72 23.28 114.43 96.04 -94.77 138.65 67.14 13.33 19.53 27.85 14.88 26.63 5.47 12.78 0.09 9.36 2.96 17 D C T 102.05 5.50 15.33 21.74 102.35 -47.72 -82.28 37.58 69.78 11.00 19.21 25.06 18.69 28.20 4.44 13.28 0.06 8.25 2.02 18 K C C 91.63 9.73 13.35 24.00 119.92 132.47 -100.47 141.41 76.29 15.06 8.65 49.86 20.61 6.24 3.09 5.44 0.02 11.13 3.63 19 T C C 84.00 6.05 17.30 24.38 114.47 -125.13 -85.14 136.63 71.88 24.70 3.42 60.88 6.86 2.54 1.80 1.79 0.01 16.41 9.72 20 V C C 47.27 16.67 11.69 27.93 114.18 -133.72 -92.11 129.79 81.48 16.54 1.98 65.65 12.92 2.06 0.99 1.10 0.00 10.68 6.60 21 H C C 85.02 8.10 15.60 24.75 118.14 -129.47 -90.45 142.03 92.64 4.82 2.54 77.84 12.29 2.52 0.85 1.66 0.00 2.89 1.94 22 P C T 85.10 7.04 15.08 23.06 97.42 -108.10 -63.80 -25.94 83.31 2.03 14.67 17.08 12.07 54.22 3.18 11.32 0.01 1.23 0.88 23 L C T 93.88 8.18 14.74 23.51 99.42 54.50 -87.07 2.43 81.92 2.30 15.78 14.49 13.23 54.19 3.44 12.16 0.01 1.36 1.12 24 D C C 47.89 12.75 12.63 25.99 110.16 108.57 -86.45 113.26 79.87 5.94 14.19 54.86 16.09 8.39 4.25 10.09 0.01 2.83 3.48 25 R C C 132.29 8.48 16.09 25.32 99.00 -168.56 -81.93 -8.29 81.23 4.23 14.54 33.48 17.29 31.66 4.60 8.78 0.02 2.18 2.01 26 R C T 124.25 7.91 17.65 26.11 103.97 78.22 -90.19 17.13 80.16 7.20 12.64 24.55 20.76 36.04 3.98 7.73 0.05 4.17 2.74 27 G C C 22.67 13.94 16.53 30.30 117.67 -132.98 93.48 25.60 79.94 13.70 6.36 36.80 27.54 17.12 1.67 4.51 0.02 9.32 3.03 28 R C C 115.20 9.86 20.89 30.83 119.31 -95.92 -105.37 137.04 69.09 28.12 2.79 50.22 12.78 5.08 1.11 2.00 0.01 21.33 7.48 29 F C C 34.95 19.80 15.65 34.97 121.87 -161.38 -110.47 137.34 64.36 34.83 0.81 54.41 7.74 0.77 0.51 0.43 0.00 24.93 11.21 30 N C C 62.08 8.12 23.73 32.22 112.26 -141.69 -95.05 129.11 80.74 18.58 0.68 78.03 2.57 0.38 0.50 0.22 0.00 13.49 4.82 31 L H H 32.16 20.52 15.22 35.16 93.63 -151.75 -63.09 -35.91 4.09 0.12 95.80 1.72 1.00 1.76 94.68 0.75 0.01 0.06 0.03 32 D H H 85.63 5.51 21.30 27.38 91.99 54.47 -64.17 -40.89 1.74 0.07 98.19 0.37 0.27 1.08 97.49 0.71 0.01 0.05 0.01 33 E H H 85.79 4.40 21.91 26.33 92.18 48.09 -66.55 -40.54 0.81 0.12 99.07 0.21 0.12 0.49 98.22 0.82 0.00 0.11 0.01 34 A H H 7.21 17.79 15.53 34.42 91.97 50.91 -64.41 -42.67 0.49 0.10 99.41 0.12 0.07 0.30 98.84 0.57 0.00 0.09 0.01 35 A H H 15.55 13.89 15.27 30.55 91.75 50.93 -63.29 -41.84 1.07 0.07 98.86 0.19 0.10 0.79 98.24 0.60 0.01 0.06 0.01 36 A H H 71.26 2.00 19.42 20.58 92.11 50.59 -64.76 -40.32 3.01 0.03 96.96 0.23 0.17 2.54 96.29 0.73 0.01 0.02 0.01 37 E H H 104.84 6.07 16.86 23.95 91.72 51.38 -67.44 -34.03 10.15 0.03 89.82 0.31 0.39 9.57 88.93 0.76 0.02 0.01 0.01 38 L C T 47.87 13.67 12.39 26.64 96.15 43.78 -91.73 1.81 68.63 0.15 31.23 2.20 3.86 59.50 33.15 1.12 0.00 0.04 0.12 39 Q C T 156.84 0.77 18.46 17.51 94.04 -124.63 56.17 42.40 97.61 0.12 2.26 11.17 4.42 81.98 2.05 0.26 0.00 0.05 0.06 40 L C C 37.62 17.41 7.54 23.57 123.99 155.97 -97.38 152.76 98.21 1.39 0.40 83.56 13.41 1.09 0.23 0.14 0.00 0.42 1.13 41 D C C 95.00 2.01 19.38 20.10 113.11 -101.90 -70.03 143.53 99.27 0.47 0.25 98.22 1.02 0.09 0.18 0.02 0.00 0.13 0.33 42 E H H 114.66 8.95 12.74 22.85 92.27 -116.85 -58.21 -36.52 2.76 0.01 97.23 0.31 0.28 1.99 94.62 2.79 0.00 0.00 0.00 43 A H H 68.86 2.76 18.24 21.07 91.74 55.40 -64.86 -38.86 1.48 0.01 98.51 0.12 0.11 1.19 95.34 3.22 0.00 0.01 0.00 44 Y H H 74.08 9.78 17.60 28.31 92.73 47.77 -67.32 -40.15 0.77 0.03 99.21 0.12 0.08 0.55 95.89 3.33 0.00 0.02 0.00 45 V H H 14.07 19.31 15.14 34.72 92.05 51.20 -64.00 -43.34 1.03 0.03 98.94 0.18 0.11 0.72 96.84 2.12 0.00 0.02 0.00 46 A H H 40.35 9.67 20.09 30.49 91.70 52.12 -63.97 -39.22 5.00 0.04 94.96 0.38 0.24 4.28 87.37 7.68 0.01 0.03 0.01 47 S H H 49.93 7.60 22.17 30.23 91.71 54.24 -68.20 -30.26 21.34 0.05 78.61 0.56 0.58 20.29 69.83 8.66 0.02 0.03 0.03 48 L H H 28.21 19.01 19.22 37.69 94.11 54.45 -79.35 -20.83 41.22 0.34 58.44 2.32 2.65 35.20 52.16 7.22 0.09 0.18 0.18 49 Y C C 40.03 19.59 19.22 38.10 100.43 54.69 -98.10 7.97 60.02 14.00 25.98 26.41 15.51 19.65 18.97 5.84 0.49 6.96 6.17 50 K C C 85.23 10.75 22.37 33.31 119.18 114.17 -94.88 136.46 81.68 16.40 1.93 45.81 33.37 3.05 1.07 0.98 0.01 11.76 3.96 51 P C C 46.21 15.25 18.74 33.53 112.55 -105.89 -67.03 145.30 75.85 17.82 6.33 56.04 10.78 8.35 2.08 4.45 0.01 13.93 4.36 52 L C C 53.77 16.05 17.99 33.21 105.07 -138.31 -80.56 36.03 72.10 17.66 10.24 28.63 24.38 21.11 2.01 7.62 0.04 13.70 2.52 53 H C C 84.27 11.41 20.54 31.58 106.53 56.91 -94.97 68.68 61.59 28.37 10.05 25.23 19.61 19.59 1.63 7.71 0.06 24.14 2.02 54 Y C E 54.18 16.22 18.10 34.06 121.34 117.39 -110.36 138.46 51.98 40.59 7.43 32.99 14.02 6.84 1.75 5.38 0.03 36.75 2.23 55 T E E 37.44 14.08 20.07 34.43 122.63 -157.50 -113.17 137.92 34.97 62.99 2.04 26.92 6.43 2.10 0.65 1.26 0.01 61.24 1.39 56 Y E E 41.76 16.67 17.61 34.58 127.29 -170.89 -122.37 145.69 12.76 86.26 0.99 9.82 2.88 1.00 0.43 0.53 0.00 84.21 1.12 57 S E E 37.62 10.61 18.11 29.79 121.03 -144.17 -109.32 137.23 9.50 89.96 0.54 7.62 1.58 0.67 0.20 0.30 0.00 89.05 0.59 58 M E E 55.64 14.03 12.85 27.21 117.93 -171.65 -124.61 119.42 16.50 82.00 1.50 7.17 5.52 6.31 0.39 1.05 0.00 77.40 2.16 59 K C T 152.31 3.11 14.38 18.71 93.51 -14.40 53.80 41.07 96.00 2.91 1.09 3.00 8.33 84.81 0.10 0.93 0.00 2.53 0.30 60 G C T 56.92 2.83 13.70 17.40 96.27 -54.78 80.60 1.87 97.51 1.52 0.96 4.33 11.05 82.16 0.09 0.86 0.00 1.32 0.17 61 Q E E 96.38 5.51 13.81 21.00 122.82 112.66 -107.78 143.87 18.53 80.97 0.49 12.29 5.32 2.14 0.16 0.37 0.00 77.57 2.15 62 R E E 123.41 8.96 15.34 25.22 116.40 -123.73 -91.78 132.13 13.28 86.41 0.31 10.68 2.37 0.70 0.12 0.22 0.00 83.68 2.23 63 Y C E 57.50 14.27 14.40 29.42 121.31 -162.63 -110.46 135.41 49.92 49.50 0.58 42.61 5.46 0.86 0.26 0.34 0.00 49.18 1.29 64 P C C 55.95 8.97 18.53 28.26 113.03 -108.28 -68.80 147.59 59.52 34.35 6.14 44.64 9.51 5.65 2.47 3.79 0.02 31.14 2.79 65 A C C 40.48 14.21 13.86 27.89 109.38 -116.68 -78.78 129.65 64.95 12.28 22.76 41.60 12.07 11.75 5.56 17.30 0.02 8.52 3.18 66 E C C 109.80 7.72 15.90 24.13 103.44 65.34 -82.33 1.80 65.18 8.97 25.85 27.71 18.52 21.00 5.83 18.51 0.09 5.65 2.70 67 Q C T 115.82 5.08 15.78 21.84 104.68 51.57 -90.56 29.68 68.14 8.17 23.68 22.74 19.46 27.92 5.34 16.62 0.14 5.04 2.73 68 G C C 36.03 10.95 12.78 23.81 114.79 -136.80 -89.43 152.48 83.74 7.94 8.31 41.64 21.66 21.24 1.87 6.25 0.01 4.85 2.48 69 R C C 126.31 7.55 14.27 22.79 117.20 -124.99 -97.59 137.67 81.69 15.12 3.19 60.64 15.52 4.74 1.22 2.12 0.00 9.23 6.52 70 T C C 87.86 6.10 14.66 22.11 111.05 -134.88 -90.24 125.65 82.88 14.24 2.88 62.36 12.57 7.20 0.95 2.09 0.00 9.78 5.04 71 S C C 54.44 10.02 11.73 22.46 118.46 -145.39 -101.24 144.92 87.29 10.80 1.91 54.15 27.37 5.92 0.63 1.36 0.00 6.29 4.28 72 R C C 141.89 4.40 14.75 20.52 117.18 -117.01 -91.87 138.24 93.83 4.68 1.49 61.22 30.26 2.56 0.67 0.74 0.00 2.27 2.28 73 P C T 86.50 7.40 12.51 21.09 109.18 -100.73 -63.18 140.03 86.98 1.79 11.22 21.87 10.79 54.78 5.32 5.37 0.01 1.03 0.84 74 G C T 51.31 4.24 15.08 20.22 99.89 21.41 84.69 -4.24 85.13 1.47 13.40 20.06 11.49 54.03 7.00 5.83 0.01 0.79 0.77 75 S C C 49.61 8.22 12.66 22.21 112.17 117.86 -83.37 137.91 66.24 3.91 29.85 42.14 14.53 9.53 18.79 11.14 0.03 1.90 1.94 76 L H H 95.44 8.08 13.61 22.36 99.03 -129.92 -73.27 -23.47 43.50 6.50 50.01 21.48 10.23 12.90 30.68 18.45 0.25 4.08 1.94 77 A H H 61.11 6.36 14.98 22.34 98.86 67.63 -74.46 -22.38 37.57 8.31 54.12 18.36 8.15 12.02 32.26 21.09 0.24 6.09 1.78 78 A H H 51.24 8.45 13.64 23.14 100.52 68.13 -79.94 -12.75 40.68 8.73 50.59 21.17 8.75 11.55 30.62 19.48 0.17 6.28 1.98 79 S C C 50.52 9.63 13.17 23.54 102.32 68.18 -83.90 2.13 52.86 8.18 38.96 31.19 10.18 11.92 26.12 12.70 0.10 5.49 2.31 80 R C C 132.13 7.09 13.80 21.83 100.79 80.50 -81.70 -4.26 55.19 8.19 36.62 25.77 13.16 17.37 25.19 10.54 0.25 5.32 2.41 81 D C C 92.82 5.45 14.51 21.13 101.59 67.99 -85.18 7.06 63.10 5.52 31.38 27.76 12.93 22.81 19.30 11.86 0.09 3.66 1.60 82 R C C 132.10 7.11 14.42 22.37 103.71 85.54 -87.48 27.07 63.26 10.03 26.70 30.80 14.32 18.75 15.56 10.91 0.13 7.05 2.48 83 M C C 87.31 10.04 13.96 24.57 114.03 73.20 -94.76 124.73 60.22 18.49 21.28 31.59 16.50 13.39 13.17 7.81 0.34 11.97 5.25 84 F C C 77.17 11.46 13.57 25.76 117.00 -139.73 -99.19 132.73 79.02 12.74 8.24 52.41 23.45 3.39 6.17 2.36 0.04 8.63 3.55 85 P C C 66.27 7.62 16.40 25.05 106.46 -115.65 -69.90 140.18 64.93 9.66 25.40 42.42 8.14 14.08 13.68 11.93 0.02 7.83 1.90 86 L C C 77.82 10.68 13.84 24.84 107.03 -135.13 -83.33 85.27 55.39 11.64 32.97 26.94 11.72 18.08 15.20 16.95 0.17 8.29 2.64 87 Y C C 108.28 9.64 12.89 23.21 113.05 72.17 -95.77 122.10 51.74 15.01 33.25 29.49 11.39 12.23 16.17 16.59 0.19 10.40 3.55 88 R C C 136.57 5.84 13.56 20.60 113.46 -146.88 -94.06 127.81 60.44 13.13 26.43 37.25 12.92 10.75 16.26 10.16 0.07 9.41 3.18 89 R C C 139.87 6.31 12.04 19.64 110.60 -134.41 -83.69 120.24 72.96 8.44 18.60 43.11 21.00 9.21 13.10 5.55 0.03 5.36 2.63 90 N C C 79.00 6.88 10.81 19.16 109.84 -127.49 -98.25 103.84 85.52 3.04 11.44 70.23 9.13 5.97 8.17 3.44 0.00 1.84 1.22 91 Y C T 151.10 4.83 11.68 18.15 98.75 -172.98 -77.35 -10.32 66.49 1.72 31.79 21.65 10.61 34.25 17.96 13.70 0.04 0.93 0.86 92 K C T 139.73 2.54 13.43 16.87 103.53 72.36 -86.32 23.93 63.91 2.35 33.74 19.57 9.95 34.37 19.84 13.76 0.06 1.33 1.13 93 L C C 63.54 11.20 9.44 21.13 110.68 109.11 -85.15 121.06 61.88 3.83 34.30 38.69 14.08 9.27 23.48 10.79 0.03 1.87 1.79 94 N C C 76.57 6.03 12.58 20.05 108.50 -131.72 -85.39 120.16 68.85 1.55 29.60 57.53 5.89 5.30 25.91 3.90 0.00 0.75 0.71 95 R H H 153.60 3.35 13.06 17.72 95.06 -133.14 -67.03 -30.32 24.47 0.84 74.68 7.98 4.18 11.62 52.28 23.07 0.07 0.52 0.30 96 E H H 121.41 3.07 13.89 17.86 94.19 60.15 -69.71 -31.78 21.70 1.38 76.92 5.99 3.27 11.36 53.91 24.01 0.11 1.00 0.35 97 L H H 68.90 9.85 11.86 22.49 97.21 53.02 -81.64 -17.89 21.86 3.44 74.70 8.56 3.95 9.17 51.90 22.87 0.13 2.78 0.65 98 R H H 112.05 8.20 13.34 22.41 102.77 78.56 -81.65 2.35 36.31 11.57 52.12 22.65 7.07 8.32 42.81 7.78 0.16 9.02 2.20 99 V C H 81.85 5.26 14.55 20.92 105.30 71.09 -89.08 67.06 41.26 17.87 40.87 28.80 5.62 7.20 36.17 4.68 0.09 14.34 3.10 100 L C H 75.60 9.04 11.84 21.91 106.18 53.24 -83.55 85.10 48.31 11.29 40.41 33.69 7.04 7.72 35.95 4.55 0.05 9.01 1.99 101 D C C 78.41 5.53 13.34 20.13 105.16 59.42 -90.09 53.22 56.34 6.79 36.86 38.51 6.90 10.36 32.47 5.07 0.03 5.25 1.43 102 H C H 114.03 6.00 11.28 18.62 99.19 73.35 -79.59 -7.95 52.35 4.39 43.25 23.62 10.51 19.07 32.47 10.04 0.11 2.93 1.24 103 R C H 153.92 3.11 12.27 16.61 99.79 70.69 -81.66 -4.69 58.33 4.87 36.79 23.54 12.54 22.60 27.09 9.44 0.13 3.40 1.26 104 R C C 147.02 3.82 12.01 17.21 107.24 82.16 -89.52 68.07 60.92 11.06 28.02 33.20 11.60 16.62 19.81 8.14 0.10 8.32 2.21 105 I C C 93.50 7.40 9.48 18.07 110.47 125.68 -91.21 109.16 62.54 17.32 20.14 42.24 10.22 9.54 15.92 5.08 0.08 13.33 3.58 106 S C C 71.38 4.38 10.36 16.38 115.38 59.16 -101.18 139.19 65.99 17.35 16.66 43.36 10.23 12.02 12.55 4.65 0.06 13.80 3.31 107 T C C 98.23 3.61 8.96 14.28 108.80 -151.21 -94.13 80.79 77.93 12.85 9.22 64.17 4.19 9.50 5.95 2.86 0.00 10.40 2.92 108 D C C 110.17 2.69 11.44 15.60 107.89 -136.99 -87.00 103.66 99.64 0.30 0.06 99.38 0.21 0.14 0.03 0.01 0.00 0.20 0.03