# 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 92.27 8.47 13.95 23.20 117.17 -164.31 -104.07 140.12 99.02 0.62 0.36 98.83 0.25 0.16 0.27 0.03 0.00 0.30 0.15 1 A C C 64.14 6.08 12.35 19.49 102.84 -133.74 -77.35 -7.39 61.26 5.51 33.24 55.57 1.77 4.45 30.48 2.60 0.00 2.43 2.70 2 A H H 66.78 4.91 10.66 17.01 98.21 77.87 -75.01 -23.15 29.51 3.70 66.79 18.45 5.61 7.78 53.03 11.56 0.06 2.76 0.74 3 S H H 70.44 3.98 11.56 16.87 99.49 64.75 -77.43 -14.44 20.45 4.39 75.17 11.77 3.63 6.50 55.44 18.33 0.07 3.64 0.61 4 L H H 105.28 4.38 11.09 16.82 101.10 63.05 -81.94 -14.33 14.92 4.30 80.78 7.13 2.85 5.96 58.45 21.27 0.11 3.73 0.50 5 L H H 103.24 5.15 10.72 17.24 107.26 64.83 -90.46 46.03 19.72 6.79 73.48 9.38 3.84 7.96 56.87 14.97 0.28 5.67 1.02 6 L H H 103.80 5.19 10.63 17.41 111.66 97.38 -87.31 119.10 34.54 7.23 58.23 14.90 6.03 14.77 46.91 9.78 0.42 5.54 1.65 7 R C H 155.79 3.84 11.34 16.79 109.41 -160.53 -91.80 99.29 51.91 6.51 41.58 18.24 7.19 26.40 35.57 6.08 0.17 4.79 1.56 8 Q C T 124.18 3.88 10.64 16.19 113.05 -151.33 -93.66 126.89 68.46 6.74 24.81 21.35 13.22 33.40 21.03 4.53 0.15 4.35 1.97 9 G C C 50.97 3.75 11.66 16.82 114.52 -53.39 111.13 144.28 82.89 8.22 8.89 31.06 25.89 26.87 5.53 3.05 0.05 5.56 1.99 10 R C C 149.44 4.08 11.42 17.12 115.50 -118.22 -91.25 135.93 84.61 6.74 8.65 61.80 15.03 7.39 5.97 3.06 0.01 4.27 2.48 11 P C C 99.09 4.36 11.01 17.01 109.20 -116.40 -74.55 132.02 69.70 5.60 24.70 39.68 11.43 18.51 13.93 10.96 0.04 3.73 1.72 12 G C C 49.17 4.70 12.86 18.75 112.77 26.53 -88.45 10.91 60.82 8.13 31.06 28.26 13.79 19.24 17.46 13.44 0.18 5.45 2.18 13 T C C 87.39 5.24 12.71 19.27 111.75 -66.96 -96.15 118.01 53.71 13.25 33.04 34.15 10.22 9.41 20.70 12.68 0.09 10.47 2.29 14 L C C 88.99 9.08 11.95 22.03 116.20 -154.93 -98.31 133.04 47.17 21.23 31.60 33.85 7.88 5.33 24.82 7.02 0.07 18.47 2.57 15 K C C 119.68 6.35 14.92 22.53 117.69 -155.28 -103.09 134.17 42.28 27.79 29.93 31.67 5.71 3.80 26.17 4.28 0.03 26.86 1.49 16 T E E 67.99 10.14 13.25 24.18 119.60 -157.14 -106.22 135.79 33.40 36.28 30.32 24.22 4.61 2.86 27.79 3.39 0.02 35.92 1.20 17 V E E 74.24 8.80 14.23 24.18 119.08 -157.97 -107.39 133.27 25.31 42.02 32.67 17.23 3.90 2.11 30.94 2.76 0.01 42.14 0.90 18 L E E 87.58 8.43 15.28 24.66 116.01 -145.71 -96.15 131.92 25.80 43.05 31.15 17.87 3.48 2.26 29.36 2.92 0.01 43.12 0.97 19 L C E 81.48 9.83 14.03 24.58 114.34 -150.66 -94.77 128.53 33.62 33.45 32.93 22.13 5.55 4.28 30.07 3.92 0.04 32.64 1.38 20 E C H 101.42 7.92 14.75 23.48 113.82 -150.92 -97.54 125.19 44.13 23.60 32.27 27.75 8.03 7.50 27.91 4.82 0.10 22.07 1.82 21 A C H 57.02 8.03 13.78 22.77 111.62 -160.61 -92.48 126.01 53.99 11.90 34.11 25.54 11.05 17.59 26.73 6.97 0.21 10.10 1.80 22 G C H 38.30 7.54 14.31 22.53 108.72 -146.02 -90.33 79.14 57.10 8.30 34.60 22.98 11.62 22.89 24.72 9.37 0.25 6.25 1.91 23 V C H 80.27 8.38 12.02 21.10 106.59 81.03 -88.12 23.33 46.88 15.01 38.11 20.80 10.71 17.06 24.21 12.30 0.62 11.01 3.30 24 F C H 134.39 5.22 12.07 18.26 103.92 58.46 -87.77 7.41 45.99 17.35 36.66 17.47 10.67 19.66 22.71 12.23 0.94 12.35 3.98 25 R C T 156.48 3.71 12.52 17.34 104.01 52.97 -89.49 29.33 66.70 7.84 25.46 13.58 12.36 40.14 15.87 9.87 0.27 5.54 2.37 26 G C T 51.04 3.98 13.54 18.64 107.00 -75.10 82.56 6.60 86.90 5.09 8.01 20.80 19.34 47.54 3.57 3.88 0.02 3.66 1.18 27 L C C 99.65 6.78 12.70 20.60 112.34 105.50 -94.90 115.95 78.08 15.27 6.65 46.64 21.33 10.18 3.72 3.19 0.06 9.27 5.63 28 A C C 54.64 8.83 12.44 22.45 118.73 -150.91 -96.17 139.55 84.37 11.45 4.18 65.95 15.21 2.85 2.92 1.58 0.01 8.07 3.41 29 P C C 73.69 8.39 14.36 23.62 111.76 -111.01 -70.17 145.11 77.44 11.87 10.69 60.02 10.55 6.30 6.85 4.24 0.02 8.86 3.16 30 A C C 66.75 7.88 14.44 23.02 111.92 -131.37 -85.99 123.95 58.36 16.03 25.61 32.93 16.74 9.53 15.69 9.65 0.23 11.52 3.71 31 V C C 77.89 9.05 13.97 23.75 115.27 -157.84 -97.68 131.55 46.28 18.86 34.85 28.92 10.55 7.95 19.47 14.68 0.10 15.82 2.51 32 S C C 60.28 8.10 15.59 24.45 112.73 -129.77 -87.19 134.71 45.13 19.46 35.41 32.00 6.72 7.14 18.92 15.73 0.05 17.06 2.38 33 L C C 85.42 10.12 14.42 24.89 108.38 -146.75 -91.91 101.08 46.52 21.10 32.39 25.80 10.12 11.94 18.19 13.51 0.21 16.51 3.71 34 S C C 52.98 9.27 14.54 24.48 113.46 61.61 -100.99 129.63 54.49 21.12 24.39 30.87 12.34 11.69 15.96 8.46 0.28 15.08 5.32 35 A C C 57.86 8.68 13.42 22.92 107.88 -137.23 -86.49 80.58 62.09 15.00 22.91 32.92 17.68 12.56 15.29 7.22 0.29 9.70 4.33 36 E C C 123.02 4.55 14.48 20.09 109.32 63.58 -82.90 105.48 67.40 10.01 22.60 36.58 15.52 16.05 13.70 8.61 0.10 6.28 3.16 37 S C T 68.04 6.61 11.92 19.63 110.62 -106.15 -80.13 123.30 74.79 4.69 20.52 26.81 16.60 32.37 10.93 8.76 0.06 2.74 1.74 38 G C T 48.51 4.85 13.39 19.32 106.59 9.45 87.74 -3.39 79.89 4.73 15.39 28.56 21.58 30.94 6.39 8.08 0.04 2.60 1.80 39 K C C 122.14 5.29 12.36 19.05 109.66 100.55 -86.84 126.97 77.33 8.08 14.59 48.39 19.24 9.57 7.61 6.99 0.04 4.12 4.04 40 N C C 92.20 6.31 11.61 19.16 108.79 -122.29 -89.49 101.22 75.75 8.22 16.03 57.46 8.83 8.78 7.23 9.03 0.01 4.78 3.88 41 E C C 121.21 5.91 10.97 18.12 100.84 85.44 -80.44 5.76 75.05 6.64 18.32 45.05 14.67 15.84 6.15 11.66 0.02 3.72 2.89 42 K C C 146.55 2.59 12.30 16.15 105.84 85.46 -85.15 90.25 81.83 4.40 13.77 39.36 20.44 23.08 3.48 9.44 0.01 2.39 1.79 43 G C C 48.13 4.32 12.36 18.09 113.62 -90.22 87.58 155.73 90.90 3.90 5.20 58.47 17.89 14.39 0.96 4.48 0.00 2.03 1.78 44 L C C 87.10 8.54 9.60 19.14 117.93 -102.70 -90.06 138.33 95.33 4.42 0.26 76.62 18.37 0.41 0.11 0.13 0.00 1.71 2.66 45 P C C 88.60 3.56 12.58 17.63 115.47 -105.76 -68.05 148.74 98.70 1.21 0.09 95.37 3.21 0.21 0.03 0.04 0.00 0.56 0.59 46 P C C 103.52 3.69 10.55 16.18 111.74 -101.58 -66.93 145.93 98.24 1.37 0.39 89.50 7.40 1.16 0.12 0.26 0.00 0.50 1.07 47 N C C 103.94 4.73 9.28 15.70 113.56 -112.61 -88.07 129.63 98.72 1.00 0.29 88.19 9.83 0.62 0.10 0.17 0.00 0.40 0.68 48 P C C 101.45 2.91 10.04 14.66 112.01 -113.53 -68.93 144.82 96.83 1.38 1.79 90.85 4.06 1.94 0.43 1.28 0.00 0.63 0.80 49 K C C 152.80 2.40 9.27 13.32 111.16 -104.86 -80.75 133.43 94.44 3.20 2.36 83.58 7.16 3.24 0.68 1.70 0.00 1.42 2.23 50 K C C 145.85 3.15 8.28 13.28 111.91 -129.62 -88.41 128.91 93.16 4.71 2.13 79.91 9.22 3.44 0.63 1.56 0.00 2.06 3.19 51 Q C C 139.36 2.05 8.79 12.42 111.11 -141.20 -92.09 122.09 94.86 4.09 1.06 78.83 13.53 1.96 0.38 0.66 0.00 1.71 2.93 52 S C C 83.78 2.35 8.70 12.65 117.28 -118.01 -96.72 140.85 98.32 1.48 0.21 81.35 16.58 0.40 0.09 0.09 0.00 0.63 0.85 53 P C C 103.28 2.54 9.18 13.59 114.82 -103.38 -69.69 147.51 98.94 0.63 0.44 93.41 4.73 0.85 0.20 0.19 0.00 0.31 0.31 54 P C C 100.74 3.20 8.14 13.44 113.67 -103.71 -68.60 146.84 97.27 1.19 1.54 88.41 5.50 3.28 0.53 1.00 0.00 0.50 0.79 55 K C C 161.25 1.59 9.34 12.23 113.60 -114.41 -81.44 136.98 95.47 2.93 1.60 77.59 15.35 2.06 0.71 0.82 0.00 1.05 2.42 56 K C C 156.79 1.84 8.90 12.50 115.30 -109.47 -88.32 135.11 97.78 1.59 0.63 87.09 10.28 0.45 0.41 0.21 0.00 0.81 0.75 57 P C C 93.18 4.01 7.56 13.64 115.24 -109.80 -67.10 148.72 95.20 3.14 1.65 92.54 1.92 1.01 0.70 0.64 0.00 1.45 1.74 58 A C C 91.69 1.49 9.08 11.80 112.01 -104.01 -73.67 143.94 94.53 2.99 2.48 87.06 5.23 2.12 1.07 1.25 0.00 1.42 1.85 59 S C C 89.32 1.97 8.34 12.03 114.11 -103.81 -78.04 142.28 95.69 2.40 1.91 84.85 8.38 2.36 0.75 1.06 0.00 1.24 1.36 60 A C C 86.40 2.15 8.64 12.45 115.19 -105.89 -77.33 145.61 96.30 2.65 1.05 88.02 6.85 1.21 0.47 0.51 0.00 1.12 1.82 61 A C C 85.36 2.28 8.73 12.88 116.01 -104.87 -75.81 144.22 98.42 1.38 0.20 91.67 6.41 0.33 0.09 0.08 0.00 0.60 0.81 62 P C C 99.64 3.12 8.59 13.70 114.63 -102.79 -65.89 147.61 98.79 0.98 0.22 96.01 2.37 0.48 0.08 0.10 0.00 0.48 0.48 63 T C C 113.92 1.70 9.19 12.24 109.78 -111.29 -78.76 139.14 97.58 2.10 0.32 88.55 8.16 0.72 0.11 0.18 0.00 0.81 1.47 64 E C C 138.70 2.50 9.40 13.53 117.43 -111.80 -93.02 138.90 97.00 2.66 0.34 86.51 10.09 0.49 0.15 0.18 0.00 1.24 1.35 65 P C C 99.51 3.55 10.57 15.65 113.16 -107.00 -67.69 146.67 94.15 4.13 1.72 86.00 4.92 3.05 0.54 1.16 0.00 1.99 2.34 66 F C C 110.00 8.77 7.88 17.59 114.43 -112.41 -85.69 134.79 90.46 6.86 2.68 76.71 8.62 3.89 1.00 1.66 0.00 2.60 5.51 67 D C C 96.97 3.51 12.07 16.88 111.84 -149.52 -101.03 118.88 92.18 4.73 3.09 80.14 8.14 3.22 1.54 1.51 0.00 1.95 3.50 68 N C C 92.99 7.19 8.56 17.06 101.01 -173.56 -93.91 12.45 82.46 2.36 15.17 43.31 14.68 24.92 5.57 9.02 0.00 1.15 1.35 69 T C T 108.84 1.75 11.58 13.93 95.96 96.54 -81.43 -12.10 80.82 1.40 17.77 19.82 18.47 42.98 6.70 10.48 0.01 0.73 0.81 70 T C T 98.36 2.34 11.78 14.79 102.69 52.50 -98.03 -2.59 76.79 3.44 19.77 22.59 20.89 34.27 8.17 10.57 0.04 1.79 1.68 71 Y C C 109.52 8.68 8.05 17.74 115.29 87.46 -96.85 128.76 73.22 8.22 18.56 48.95 14.51 9.15 10.74 7.82 0.02 4.25 4.57 72 K C C 132.70 3.41 13.25 18.09 116.50 -166.16 -97.54 138.72 69.82 11.54 18.64 51.55 10.32 7.06 11.61 7.01 0.02 6.65 5.78 73 N C C 78.56 7.75 11.88 20.89 110.67 -113.18 -80.63 127.59 67.58 10.35 22.07 50.25 9.83 7.01 10.38 11.85 0.02 6.25 4.40 74 L H G 86.16 8.48 12.07 21.65 95.82 -147.73 -71.38 -15.45 35.59 3.48 60.93 18.45 6.28 11.42 9.51 51.18 0.00 2.65 0.52 75 Q H G 105.10 6.17 12.97 20.39 95.35 72.74 -74.90 -13.66 35.28 4.11 60.60 12.46 7.34 17.25 8.24 50.81 0.01 3.26 0.63 76 H H G 118.04 5.05 13.33 19.48 101.02 55.77 -95.66 10.65 40.72 5.65 53.62 20.41 8.86 14.18 5.94 45.35 0.01 4.05 1.20 77 H C C 80.63 9.94 9.85 20.89 117.81 109.69 -96.52 132.55 80.15 12.56 7.30 58.15 15.73 5.37 3.38 4.01 0.04 6.37 6.94 78 D C C 99.73 3.80 13.62 18.75 108.86 -148.86 -97.64 106.97 79.48 16.23 4.30 63.03 9.29 6.47 1.96 2.36 0.01 7.91 8.97 79 Y C C 120.08 8.16 10.09 19.32 104.09 171.36 -96.49 10.35 85.20 9.04 5.76 46.24 20.22 19.44 2.09 3.27 0.02 4.84 3.87 80 S C S 70.61 4.52 11.60 17.37 105.49 101.70 -85.65 8.68 92.59 2.56 4.84 22.28 38.22 32.71 1.56 2.78 0.00 1.50 0.95 81 T C S 100.43 2.84 13.90 16.99 99.50 27.77 -92.27 -13.75 88.66 4.76 6.57 17.96 42.43 29.23 2.54 3.21 0.03 2.94 1.65 82 Y C C 94.56 8.40 11.20 21.03 122.35 64.24 -111.41 140.15 73.90 19.32 6.78 37.30 28.05 9.08 4.06 2.76 0.18 11.14 7.43 83 T C C 49.82 7.17 14.28 22.91 122.68 -144.32 -93.68 160.75 73.88 18.78 7.34 63.65 6.87 2.38 6.35 1.61 0.01 9.83 9.30 84 F H H 104.27 8.65 13.56 23.35 92.59 -108.79 -60.36 -35.14 30.41 3.26 66.33 8.57 5.57 16.47 50.49 15.16 0.48 2.38 0.88 85 L H H 88.26 5.28 15.05 21.19 91.94 56.21 -65.85 -35.97 24.69 2.51 72.80 5.88 3.98 14.18 55.57 17.51 0.29 2.04 0.55 86 D H H 63.15 6.98 14.04 22.40 92.83 53.18 -70.38 -29.08 18.64 2.26 79.10 6.73 3.26 8.45 56.57 22.73 0.13 1.70 0.45 87 L H H 68.87 9.42 12.29 22.77 93.29 60.66 -68.03 -31.79 25.69 2.57 71.74 9.43 4.72 11.99 53.85 17.35 0.21 1.73 0.71 88 N H H 96.34 4.73 14.68 20.16 95.77 55.51 -79.83 -11.58 39.13 3.85 57.02 16.66 6.16 17.12 43.71 12.39 0.19 2.51 1.26 89 L H H 84.62 6.06 12.16 19.69 102.04 80.89 -77.17 -15.71 42.56 5.06 52.38 21.97 8.34 13.53 39.72 11.49 0.17 3.26 1.52 90 D H H 84.05 4.39 14.60 19.94 101.98 50.66 -81.22 55.12 45.97 5.92 48.12 27.73 6.23 12.70 35.31 12.22 0.06 3.98 1.77 91 L H H 68.42 11.11 10.32 21.99 95.03 118.59 -72.68 -19.73 31.98 2.81 65.21 17.90 5.25 8.93 36.09 29.14 0.04 1.93 0.72 92 S H G 71.11 4.40 12.45 18.57 92.20 70.78 -66.49 -24.86 26.56 1.80 71.64 9.60 4.19 12.44 30.99 41.04 0.06 1.24 0.44 93 K H G 149.91 1.72 15.01 16.69 94.15 58.11 -77.39 -15.71 36.69 1.33 61.98 6.48 5.77 22.92 23.86 39.39 0.18 0.78 0.62 94 F C G 95.63 9.00 11.69 21.68 103.90 51.45 -102.56 24.19 52.56 3.34 44.10 16.76 11.34 24.89 14.98 28.52 0.14 1.95 1.41 95 R C C 125.80 7.32 13.71 22.56 117.74 125.99 -85.81 138.48 78.22 19.97 1.82 63.34 11.88 1.76 1.06 0.85 0.00 9.97 11.14 96 M C C 84.42 9.67 12.78 23.61 118.42 -140.46 -101.79 136.22 76.68 22.98 0.33 68.63 7.43 0.55 0.14 0.22 0.00 18.41 4.63 97 P C C 74.86 6.37 14.51 22.18 114.30 -106.81 -66.66 147.24 67.60 31.87 0.53 60.36 5.72 0.65 0.28 0.30 0.00 19.45 13.24 98 Q C C 88.99 8.24 11.23 20.93 113.76 -127.86 -93.31 133.72 87.68 11.79 0.53 80.16 6.37 0.62 0.24 0.29 0.00 6.10 6.22 99 P C T 76.90 6.27 10.49 18.41 104.02 -114.53 -65.53 152.83 75.36 2.99 21.65 25.08 12.31 35.73 1.31 22.88 0.00 1.83 0.86 100 S C T 93.07 1.86 10.78 13.47 97.73 -63.73 -73.96 -13.52 74.14 2.98 22.88 13.02 14.29 44.88 1.21 23.83 0.01 1.75 1.01 101 S C T 76.86 2.77 10.50 14.32 99.38 54.08 -87.24 -1.88 73.63 2.13 24.23 12.73 17.51 41.00 1.13 25.62 0.00 1.21 0.80 102 G C C 55.96 2.55 10.48 14.64 99.02 -110.56 80.66 6.48 91.36 3.88 4.77 35.07 28.51 27.69 0.60 4.60 0.00 2.17 1.35 103 R C C 134.46 3.46 10.32 15.75 118.67 130.65 -88.71 144.29 84.79 13.32 1.89 62.24 18.29 3.79 0.57 1.50 0.00 8.35 5.26 104 E C C 136.63 2.84 12.92 17.33 113.20 -108.10 -75.23 141.66 72.92 25.14 1.94 57.95 10.50 2.40 0.84 1.20 0.00 11.21 15.89 105 S C C 47.54 10.35 8.59 19.74 116.89 -117.06 -84.16 142.65 92.43 6.37 1.21 73.67 15.42 3.09 0.27 1.14 0.00 4.23 2.18 106 P C C 88.12 5.29 11.46 18.24 102.09 -116.36 -71.66 29.17 92.58 3.86 3.55 51.73 16.19 24.54 0.48 3.48 0.00 2.51 1.07 107 R C C 154.63 4.02 10.03 15.69 108.23 82.85 -90.67 91.26 93.15 3.75 3.09 69.81 4.33 19.27 0.70 2.04 0.00 2.46 1.39 108 H C C 123.12 5.70 10.93 18.07 111.73 -133.63 -93.81 119.79 99.09 0.81 0.10 98.72 0.35 0.20 0.03 0.03 0.00 0.48 0.18