# 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 D C C 99.98 3.96 20.61 24.94 107.27 -138.42 -84.62 102.12 99.83 0.17 0.00 99.72 0.12 0.03 0.00 0.00 0.00 0.12 0.00 1 I C C 40.68 19.77 11.11 29.87 116.64 -157.48 -94.58 130.06 71.57 28.32 0.11 70.61 0.58 0.20 0.02 0.06 0.00 27.88 0.66 2 V E E 71.59 6.55 20.87 28.26 119.91 -164.31 -113.49 130.06 24.62 75.27 0.11 21.21 2.79 0.36 0.03 0.08 0.00 74.84 0.70 3 M E E 39.73 20.20 13.99 33.68 121.01 -160.26 -109.34 131.80 8.27 91.68 0.05 7.51 0.68 0.11 0.01 0.03 0.00 91.13 0.52 4 T E E 58.08 8.35 22.02 31.01 126.91 -172.80 -125.44 143.88 9.20 90.73 0.07 8.28 0.72 0.14 0.02 0.05 0.00 89.66 1.13 5 Q E E 61.64 17.23 15.61 32.07 126.01 -162.44 -122.22 138.27 34.70 65.17 0.13 29.04 5.04 0.42 0.03 0.11 0.00 64.08 1.28 6 T C C 64.08 9.29 18.75 28.74 121.65 -152.24 -106.93 139.58 80.32 19.60 0.09 62.91 15.64 0.56 0.01 0.09 0.00 20.14 0.65 7 P C C 56.86 9.18 16.80 26.96 115.83 12.37 -72.46 152.55 89.53 10.15 0.32 70.28 16.46 1.90 0.03 0.35 0.00 10.46 0.52 8 A C S 64.63 9.26 16.42 26.46 97.37 -145.83 -78.39 -23.40 82.43 17.35 0.21 35.95 44.13 1.71 0.02 0.22 0.00 17.42 0.54 9 S E E 59.25 6.66 20.37 28.07 135.05 15.04 -142.11 149.38 30.37 69.51 0.13 24.74 4.49 0.45 0.01 0.12 0.00 69.78 0.40 10 V E E 29.39 19.37 14.36 33.36 131.84 -174.31 -137.29 143.36 2.76 97.23 0.01 2.50 0.17 0.01 0.00 0.00 0.00 97.14 0.18 11 S E E 63.13 7.49 22.35 31.13 126.03 -161.10 -122.30 140.66 1.80 98.19 0.00 1.67 0.10 0.00 0.00 0.00 0.00 98.10 0.13 12 E E E 35.30 17.54 15.47 33.09 136.73 171.25 -145.16 154.30 17.28 82.69 0.02 16.07 0.65 0.04 0.00 0.02 0.00 82.84 0.38 13 P C E 65.72 5.91 22.62 28.63 117.48 -104.79 -71.76 153.70 50.19 48.74 1.07 38.75 6.11 5.27 0.18 1.01 0.00 45.97 2.70 14 V C T 57.01 15.94 14.34 30.06 109.83 -85.11 -60.70 135.52 97.42 1.36 1.22 0.69 4.72 92.24 0.05 1.24 0.00 0.88 0.18 15 G C T 45.87 4.41 20.04 25.17 97.26 22.55 88.48 -6.39 98.14 0.57 1.28 1.00 5.87 91.10 0.05 1.51 0.00 0.40 0.07 16 G C C 23.43 8.97 16.80 27.14 127.55 118.39 -86.48 169.91 96.10 3.73 0.17 59.63 35.88 0.83 0.02 0.18 0.00 3.03 0.43 17 T C C 75.39 8.01 20.13 29.45 126.90 -117.42 -120.71 143.78 74.49 25.50 0.01 74.61 0.52 0.02 0.00 0.00 0.00 24.42 0.43 18 V E E 11.44 22.76 14.69 37.59 126.32 -166.68 -126.03 138.31 1.02 98.98 0.00 1.08 0.02 0.00 0.00 0.00 0.00 98.82 0.09 19 T E E 64.55 7.52 25.20 33.28 118.37 -152.16 -108.24 127.94 0.30 99.70 0.00 0.31 0.00 0.00 0.00 0.00 0.00 99.68 0.01 20 I E E 5.38 25.47 16.11 42.37 119.88 -166.69 -114.76 127.67 1.82 98.17 0.00 1.66 0.05 0.00 0.00 0.00 0.00 98.27 0.02 21 N E E 67.75 7.91 26.93 35.44 117.97 -159.91 -106.65 129.61 9.57 90.42 0.00 8.59 0.37 0.01 0.00 0.00 0.00 90.97 0.06 22 C E E 4.19 25.97 16.14 42.58 127.17 -174.79 -127.63 141.28 11.66 88.33 0.01 11.02 0.33 0.02 0.00 0.01 0.00 88.37 0.25 23 Q E E 77.36 7.89 27.48 36.25 123.02 -166.31 -121.24 134.37 6.04 93.92 0.04 5.56 0.33 0.04 0.02 0.02 0.00 91.65 2.37 24 A E E 8.45 24.05 14.54 38.34 121.56 -157.07 -103.56 140.85 39.91 59.56 0.53 36.45 2.49 0.48 0.15 0.37 0.00 58.35 1.70 25 S C C 53.02 7.66 21.60 29.55 110.74 -150.37 -95.33 137.57 81.82 16.91 1.26 54.45 22.84 4.46 0.19 1.23 0.00 15.52 1.31 26 Q C C 95.10 8.61 16.88 26.02 112.53 22.99 -99.07 128.96 86.37 8.28 5.35 35.96 33.89 17.33 0.74 4.72 0.01 5.51 1.85 27 S C C 68.94 6.52 16.91 24.39 107.07 -16.70 -86.48 100.72 90.73 4.50 4.77 45.82 24.71 19.87 0.58 4.84 0.00 2.90 1.28 28 R C C 107.03 11.94 14.81 26.64 108.75 -160.34 -90.61 105.80 87.87 6.48 5.66 30.70 30.17 27.43 0.73 5.13 0.00 3.67 2.17 29 G C C 41.76 6.89 19.01 26.27 109.74 -83.90 84.85 2.61 91.82 5.19 2.98 33.11 30.84 28.00 0.31 3.06 0.00 3.52 1.17 30 N C C 58.95 13.04 17.20 30.27 115.93 23.86 -103.75 127.43 86.99 10.47 2.55 54.61 20.39 11.77 0.30 2.82 0.00 8.24 1.85 31 N C C 53.66 15.39 19.17 34.05 104.26 -164.62 -101.40 4.61 76.95 21.88 1.17 43.12 29.51 4.41 0.14 1.14 0.00 20.52 1.16 32 Y E E 65.61 13.02 24.92 38.27 126.05 94.06 -118.82 142.02 26.27 73.32 0.41 21.18 4.54 0.83 0.06 0.38 0.00 72.34 0.67 33 L E E 2.89 26.62 19.91 47.12 126.90 -168.22 -124.08 139.83 3.60 96.38 0.02 3.21 0.27 0.03 0.00 0.01 0.00 96.35 0.13 34 S E E 13.97 16.71 28.04 44.74 130.00 -168.28 -124.99 145.95 0.79 99.21 0.00 0.70 0.03 0.00 0.00 0.00 0.00 99.25 0.01 35 W E E 7.04 25.15 22.15 47.34 126.31 -156.38 -118.11 141.92 0.73 99.26 0.00 0.66 0.03 0.00 0.00 0.00 0.00 99.30 0.01 36 Y E E 27.06 16.57 24.64 41.18 132.60 -173.35 -131.39 150.38 0.83 99.17 0.00 0.71 0.04 0.00 0.00 0.00 0.00 99.22 0.03 37 Q E E 37.98 15.71 21.53 37.23 121.47 -144.01 -109.72 136.72 3.32 96.68 0.01 2.76 0.32 0.02 0.00 0.00 0.00 96.76 0.14 38 Q E E 48.03 14.45 16.22 31.15 120.92 -153.79 -108.08 137.31 31.19 68.79 0.02 28.21 2.10 0.08 0.00 0.02 0.00 68.37 1.22 39 K C C 95.90 6.58 16.17 23.97 119.76 -139.71 -91.36 145.84 97.58 2.39 0.02 95.16 2.51 0.17 0.01 0.02 0.00 1.74 0.40 40 P C T 98.62 4.93 11.60 18.51 109.61 -87.10 -58.75 134.33 99.73 0.10 0.17 0.35 3.81 95.59 0.00 0.17 0.00 0.06 0.02 41 G C T 69.16 0.28 13.31 10.84 95.15 18.09 84.00 -3.08 99.76 0.07 0.17 0.46 3.74 95.55 0.00 0.18 0.00 0.04 0.01 42 Q C S 90.63 5.15 10.38 17.75 128.61 97.18 -113.68 156.18 95.82 4.01 0.18 28.37 67.27 0.54 0.04 0.12 0.00 1.32 2.35 43 S C C 80.41 1.83 17.92 19.37 116.49 -95.54 -67.29 150.65 98.34 1.65 0.02 90.70 7.65 0.13 0.00 0.01 0.00 1.27 0.23 44 P C C 44.31 18.48 11.45 29.11 115.29 -99.79 -65.26 145.03 93.56 6.42 0.02 91.82 1.76 0.13 0.00 0.02 0.00 6.06 0.22 45 S E E 46.05 9.14 21.61 31.23 126.11 -160.58 -122.49 143.66 11.48 88.48 0.04 9.94 1.34 0.11 0.01 0.02 0.00 87.95 0.63 46 L E E 60.55 15.90 19.04 34.41 110.75 -115.18 -76.47 126.25 0.80 99.20 0.00 0.73 0.03 0.00 0.00 0.00 0.00 99.21 0.03 47 L E E 18.58 19.39 21.06 40.34 101.26 176.16 -96.44 -33.61 1.97 98.03 0.00 1.40 0.45 0.01 0.00 0.00 0.00 98.13 0.01 48 I E E 14.03 20.47 22.29 42.46 136.67 5.85 -147.80 142.47 0.31 99.69 0.00 0.26 0.02 0.00 0.00 0.00 0.00 99.71 0.01 49 Y E E 46.01 19.19 21.24 39.33 127.58 -171.90 -131.52 137.37 1.41 98.58 0.01 1.23 0.05 0.00 0.00 0.00 0.00 98.65 0.04 50 R E E 79.23 13.56 23.24 36.02 118.13 -171.94 -117.22 127.10 22.46 76.94 0.61 17.34 4.31 0.90 0.24 0.32 0.00 76.37 0.52 51 T C C 37.11 14.88 18.38 33.15 121.26 92.59 -115.98 143.51 55.22 31.10 13.67 33.79 14.90 8.24 5.13 7.73 0.05 28.40 1.75 52 S C C 57.84 9.66 18.78 28.49 99.77 -136.31 -84.32 -7.17 66.48 8.54 24.98 27.43 23.25 17.42 11.70 12.26 0.13 5.81 2.01 53 T C C 68.05 7.56 19.44 27.45 112.15 49.21 -106.16 115.01 61.40 7.92 30.68 31.41 15.76 15.23 16.41 13.65 0.16 4.61 2.78 54 L C C 47.79 18.14 12.49 29.34 100.66 -133.62 -73.88 -15.62 52.46 6.43 41.12 29.10 10.87 13.28 20.73 19.85 0.11 3.78 2.27 55 A C C 68.91 6.28 16.26 23.62 101.62 65.42 -77.02 -0.58 54.13 6.71 39.16 23.92 11.22 20.17 18.10 19.91 0.18 4.02 2.48 56 S C T 73.11 4.95 16.14 22.09 101.52 58.02 -85.72 10.29 67.11 3.15 29.74 12.12 13.70 41.38 11.22 18.05 0.10 1.85 1.58 57 G C T 48.79 5.25 17.28 23.47 100.25 -82.23 86.32 4.42 91.11 2.91 5.98 20.53 22.60 48.56 1.43 4.15 0.00 1.81 0.92 58 V C C 32.13 18.16 11.65 29.52 116.07 128.25 -93.40 131.77 85.41 13.71 0.89 56.57 27.83 1.76 0.38 0.53 0.00 6.23 6.70 59 P C C 57.67 8.94 18.32 28.21 111.60 -108.82 -66.67 147.20 89.36 7.58 3.06 71.11 10.77 7.01 0.76 2.59 0.00 5.68 2.07 60 S C C 63.18 11.42 16.91 28.22 99.29 -118.65 -73.96 -1.81 85.91 6.95 7.14 49.17 19.83 16.85 0.89 6.91 0.00 5.16 1.19 61 R C C 103.28 10.32 20.07 30.32 101.49 75.68 -95.56 5.37 75.09 18.65 6.26 34.94 28.32 12.64 0.79 5.38 0.01 16.59 1.33 62 F E E 25.15 23.00 12.86 35.11 120.72 117.50 -104.25 135.79 28.85 69.48 1.67 23.53 4.91 1.52 0.49 1.09 0.00 67.08 1.37 63 K E E 113.57 4.97 23.83 30.25 129.68 -174.54 -131.95 145.69 9.54 90.28 0.19 8.47 0.93 0.19 0.08 0.08 0.00 89.64 0.62 64 G E E 23.03 18.65 14.71 32.05 140.08 159.09 -152.95 166.66 6.95 92.98 0.06 5.93 0.70 0.12 0.02 0.03 0.00 92.89 0.30 65 S E E 63.35 4.96 21.67 28.16 135.05 -167.20 -146.19 156.01 10.49 89.44 0.07 9.14 1.01 0.16 0.01 0.04 0.00 89.23 0.41 66 G E E 31.69 10.83 15.41 27.06 139.44 130.09 106.18 -171.02 26.59 73.28 0.13 19.16 7.26 0.96 0.02 0.13 0.00 71.85 0.63 67 S C C 77.08 3.24 20.67 24.43 117.84 -105.09 -121.59 127.75 56.15 43.51 0.34 41.96 12.02 2.59 0.06 0.37 0.00 40.66 2.34 68 G C S 33.64 10.20 19.01 29.26 108.20 -52.03 65.78 -124.79 98.52 0.98 0.49 2.05 52.60 44.05 0.02 0.48 0.00 0.70 0.11 69 T C S 52.91 14.89 16.51 31.28 97.74 -9.69 -98.66 0.18 98.46 1.14 0.40 1.98 52.82 43.82 0.01 0.36 0.00 0.90 0.10 70 Q E E 74.83 8.88 22.59 32.63 122.83 83.36 -112.08 133.84 32.99 66.89 0.12 23.98 8.93 0.85 0.02 0.14 0.00 64.49 1.58 71 F E E 6.95 24.88 16.22 41.63 129.31 -174.45 -128.75 143.08 10.66 89.34 0.00 10.32 0.21 0.01 0.00 0.00 0.00 89.23 0.22 72 T E E 33.96 10.49 27.28 38.87 121.62 -158.07 -117.27 133.55 2.80 97.20 0.00 2.45 0.08 0.00 0.00 0.00 0.00 97.45 0.03 73 L E E 2.57 26.51 19.15 46.64 119.45 -164.51 -112.60 128.34 0.22 99.78 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.00 74 T E E 38.18 10.50 27.53 38.88 120.14 -166.17 -116.67 128.88 0.10 99.90 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.89 0.00 75 I E E 6.28 24.64 16.97 42.25 117.12 -166.19 -115.21 123.33 2.18 97.82 0.00 2.27 0.02 0.00 0.00 0.00 0.00 97.44 0.27 76 S C C 42.31 8.02 22.62 31.06 127.98 -171.27 -118.32 156.43 87.18 12.75 0.07 44.57 33.10 7.19 0.00 0.10 0.00 14.74 0.29 77 D C S 105.83 2.61 23.10 25.65 93.21 9.70 57.78 44.72 98.57 1.40 0.03 7.18 82.11 9.22 0.00 0.04 0.00 1.38 0.07 78 L C C 14.59 24.20 9.85 33.45 115.28 -158.01 -73.92 137.63 98.31 1.68 0.01 97.40 1.26 0.03 0.00 0.00 0.00 0.78 0.53 79 E C C 93.24 3.98 24.67 28.33 128.25 -168.30 -118.77 156.05 99.29 0.65 0.06 99.28 0.23 0.01 0.02 0.01 0.00 0.13 0.33 80 C H G 56.24 15.54 14.82 29.89 91.77 -103.64 -58.71 -33.80 3.13 0.01 96.85 0.15 0.18 2.19 0.98 96.48 0.00 0.01 0.00 81 A H G 71.90 4.41 21.61 26.68 89.71 62.48 -69.58 -17.85 2.54 0.02 97.44 0.08 0.13 1.91 0.80 97.07 0.00 0.01 0.00 82 D H G 22.01 18.74 17.47 36.48 93.54 62.80 -85.67 -2.88 3.70 0.03 96.27 0.51 0.37 1.73 0.88 96.48 0.00 0.02 0.00 83 A C C 24.00 18.00 19.08 37.12 115.75 110.17 -72.53 138.85 97.87 1.91 0.23 94.23 3.60 0.29 0.04 0.17 0.00 1.50 0.17 84 A E E 15.76 16.20 23.93 39.84 145.84 135.85 -166.23 175.53 13.76 86.20 0.04 12.41 1.30 0.09 0.01 0.03 0.00 85.26 0.90 85 T E E 35.32 14.41 25.73 40.10 120.01 -92.91 -103.55 135.33 1.32 98.68 0.00 1.32 0.06 0.00 0.00 0.00 0.00 98.59 0.04 86 Y E E 6.27 25.57 20.54 46.17 125.88 -166.14 -118.72 140.27 0.32 99.68 0.00 0.28 0.02 0.00 0.00 0.00 0.00 99.69 0.01 87 Y E E 34.20 17.18 27.71 44.39 126.79 -166.12 -122.17 140.60 0.91 99.08 0.00 0.77 0.05 0.00 0.00 0.00 0.00 99.15 0.02 88 C E E 3.40 25.38 22.69 48.03 122.23 -158.57 -112.47 134.25 5.11 94.86 0.04 4.15 0.51 0.07 0.00 0.03 0.00 95.12 0.12 89 L E E 24.13 17.82 26.17 43.25 123.68 -166.34 -115.02 138.19 6.31 93.55 0.14 5.03 0.88 0.23 0.02 0.09 0.00 93.58 0.17 90 Y E E 38.56 19.55 23.09 41.50 129.90 -168.14 -124.63 144.90 7.87 91.94 0.18 6.19 1.37 0.38 0.04 0.12 0.00 91.66 0.24 91 G E E 9.20 17.59 22.36 39.62 138.41 169.11 -147.61 162.05 8.39 91.46 0.15 6.64 1.49 0.38 0.03 0.10 0.00 91.06 0.30 92 Y E E 59.58 14.54 21.48 36.08 130.57 -149.12 -131.36 145.86 12.88 86.93 0.19 10.42 2.41 0.50 0.05 0.14 0.00 85.68 0.81 93 Y E E 84.67 12.33 17.61 30.38 122.14 -142.04 -110.92 138.64 34.82 64.84 0.34 27.40 6.94 1.29 0.07 0.30 0.00 62.58 1.42 94 S C C 30.30 10.40 13.00 25.14 121.84 -156.14 -108.47 149.04 72.15 27.31 0.54 57.15 11.16 2.78 0.10 0.53 0.00 26.56 1.72 95 S C S 87.46 2.75 12.75 16.95 94.16 -123.51 -68.35 -23.43 96.93 1.66 1.41 6.58 47.51 43.04 0.10 1.28 0.00 1.16 0.31 96 R C S 182.18 0.98 13.75 13.85 98.30 44.56 -86.79 -20.62 97.42 1.05 1.54 4.71 47.62 45.28 0.10 1.37 0.00 0.65 0.27 97 N C S 68.67 7.30 10.26 19.30 114.32 25.55 -131.96 96.78 79.36 19.17 1.47 31.40 41.07 7.67 0.23 1.47 0.00 14.89 3.27 98 P C T 90.25 5.78 12.19 19.89 95.59 -172.80 -67.34 -18.65 71.98 20.36 7.67 17.47 16.91 38.09 0.43 7.62 0.01 18.29 1.18 99 D C T 95.91 4.81 17.21 22.82 96.91 64.36 -82.39 -2.90 64.13 28.61 7.26 17.06 15.58 31.80 0.41 7.06 0.01 27.16 0.94 100 F E E 56.96 14.80 15.71 30.76 117.70 87.86 -99.03 130.67 45.52 50.32 4.16 35.96 5.87 3.37 0.45 3.85 0.00 49.66 0.85 101 A E E 26.33 15.84 19.94 35.73 126.77 -170.34 -118.86 145.34 9.28 90.50 0.22 7.96 1.14 0.32 0.09 0.13 0.00 88.40 1.96 102 F E E 47.13 18.79 21.82 39.39 123.03 -148.00 -109.36 140.77 8.86 91.02 0.12 7.42 1.06 0.26 0.06 0.07 0.00 88.66 2.48 103 G C E 12.19 19.41 20.58 38.59 119.76 -131.05 -85.85 160.75 52.12 47.75 0.13 42.33 7.08 1.09 0.02 0.12 0.00 48.58 0.79 104 G C C 29.13 12.54 24.34 36.04 107.39 -112.61 -81.20 -16.27 70.21 29.69 0.10 55.59 11.86 1.03 0.01 0.11 0.00 30.76 0.64 105 G C C 15.16 17.26 20.38 36.57 127.46 -124.82 102.59 -171.15 62.89 37.00 0.10 53.53 6.77 0.61 0.01 0.10 0.00 38.29 0.68 106 T E E 22.62 19.46 19.94 38.82 126.56 -97.36 -117.93 143.75 10.11 89.86 0.03 9.20 0.68 0.06 0.01 0.02 0.00 89.49 0.53 107 E E E 87.80 9.69 25.36 35.21 116.17 -132.53 -94.86 131.93 2.29 97.70 0.01 2.04 0.18 0.03 0.00 0.01 0.00 97.65 0.09 108 V E E 8.60 24.21 15.31 39.90 119.01 -160.40 -110.38 127.79 2.13 97.86 0.01 2.04 0.11 0.02 0.00 0.01 0.00 97.73 0.09 109 V E E 60.09 7.16 24.45 32.16 117.26 -160.59 -109.65 126.61 3.45 96.54 0.01 3.41 0.12 0.02 0.00 0.01 0.00 96.06 0.39 110 V E E 25.06 20.24 11.77 31.52 116.65 -156.16 -102.48 126.89 20.33 79.65 0.02 20.67 0.19 0.04 0.01 0.01 0.00 78.29 0.79 111 K C C 125.12 4.35 19.99 25.10 114.95 -156.39 -95.63 131.12 99.10 0.89 0.00 99.26 0.04 0.01 0.00 0.00 0.00 0.67 0.01