# 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 S C C 69.32 6.56 14.56 22.53 120.35 -166.17 -113.71 141.94 99.72 0.27 0.02 99.70 0.07 0.04 0.00 0.00 0.00 0.15 0.02 1 S C C 75.28 5.66 12.41 19.76 112.58 -159.49 -101.12 112.71 86.54 11.41 2.04 78.33 2.21 5.66 0.56 1.18 0.00 10.06 1.98 2 G C C 46.23 5.52 14.25 21.02 114.31 -118.51 19.51 160.54 76.14 21.75 2.10 48.04 19.54 8.70 0.37 1.93 0.00 19.76 1.66 3 L C C 72.16 12.88 11.78 24.78 119.14 -140.21 -100.39 133.07 60.28 37.82 1.90 49.29 7.64 2.47 0.59 1.47 0.00 34.02 4.53 4 T C C 77.58 7.37 16.06 24.87 122.55 -166.93 -116.36 137.07 56.31 42.61 1.08 47.29 6.10 1.43 0.45 0.77 0.00 36.95 7.01 5 Q C C 81.71 11.81 13.34 25.67 123.25 -164.20 -113.42 138.44 70.89 28.63 0.48 54.91 14.61 1.21 0.16 0.37 0.00 25.29 3.45 6 E C C 122.64 4.69 17.43 23.42 115.11 -116.77 -84.61 137.59 92.64 7.22 0.14 77.50 13.91 0.88 0.03 0.13 0.00 7.00 0.57 7 P C C 67.21 11.81 13.68 25.71 111.76 -103.21 -68.35 145.71 93.64 5.79 0.58 64.69 21.67 6.80 0.07 0.62 0.00 5.74 0.41 8 A C S 60.58 9.10 17.34 26.79 107.88 -147.55 -87.27 56.54 68.32 31.36 0.32 26.96 36.18 4.15 0.03 0.32 0.00 31.74 0.62 9 L E E 41.80 16.59 15.72 32.07 125.49 -144.14 -119.60 139.18 11.85 88.05 0.10 9.22 2.53 0.23 0.02 0.08 0.00 87.45 0.47 10 S E E 59.52 9.33 21.41 31.56 126.76 -164.74 -122.02 140.05 3.85 96.13 0.02 3.50 0.29 0.02 0.00 0.01 0.00 96.01 0.17 11 V E E 20.25 19.61 15.10 34.57 134.65 177.40 -140.15 152.67 4.16 95.83 0.01 4.13 0.12 0.01 0.00 0.00 0.00 95.06 0.68 12 A E E 49.37 6.04 22.92 29.02 119.20 -118.78 -83.09 152.24 43.72 56.19 0.09 41.85 1.18 0.18 0.03 0.06 0.00 54.37 2.33 13 L C T 73.45 13.94 14.09 28.10 110.03 -87.37 -59.45 134.60 98.66 1.08 0.26 0.37 2.62 96.13 0.01 0.16 0.00 0.62 0.09 14 G C T 47.12 3.85 19.49 24.19 95.09 22.38 87.90 -6.23 99.58 0.30 0.12 0.44 2.85 96.40 0.00 0.09 0.00 0.18 0.02 15 H C C 82.84 8.39 17.39 26.95 125.56 114.38 -92.36 153.71 95.57 4.39 0.04 71.12 24.24 0.24 0.00 0.04 0.00 4.07 0.29 16 T C C 74.29 9.08 18.82 28.89 122.52 -133.20 -107.82 138.84 63.41 36.59 0.00 64.28 0.28 0.01 0.00 0.00 0.00 35.03 0.40 17 V E E 13.44 21.56 15.32 36.97 127.31 -169.10 -125.99 139.86 0.30 99.70 0.00 0.31 0.00 0.00 0.00 0.00 0.00 99.65 0.04 18 S E E 55.57 7.86 24.53 32.92 119.48 -148.97 -108.27 131.36 0.19 99.81 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.81 0.00 19 M E E 7.73 25.01 16.12 41.48 123.29 -170.30 -119.13 135.72 3.02 96.98 0.00 2.78 0.09 0.00 0.00 0.00 0.00 97.10 0.02 20 T E E 48.94 8.48 26.73 35.97 123.25 -160.76 -114.84 138.33 13.66 86.33 0.01 12.41 0.52 0.02 0.00 0.00 0.00 86.92 0.12 21 C E E 5.56 25.48 15.42 41.34 124.38 -167.57 -120.47 136.30 18.37 81.61 0.02 17.31 0.72 0.05 0.00 0.02 0.00 81.20 0.70 22 Q E E 84.89 7.02 25.11 32.67 127.98 -173.58 -126.18 146.03 19.83 80.10 0.07 18.05 1.40 0.14 0.03 0.04 0.00 76.55 3.79 23 G C C 22.17 13.95 17.68 31.50 137.68 93.12 136.26 -172.21 59.83 39.85 0.32 45.87 12.42 1.46 0.07 0.34 0.00 37.42 2.43 24 D C C 85.00 6.42 20.47 27.18 120.48 -73.39 -100.70 145.85 80.26 18.99 0.76 46.00 29.33 5.36 0.10 0.83 0.00 16.72 1.66 25 S C C 60.24 9.01 17.93 27.31 114.69 -108.65 -99.51 132.08 89.73 8.60 1.66 63.97 18.07 7.51 0.26 1.78 0.00 6.61 1.80 26 L C C 46.33 16.94 12.57 28.98 112.07 -158.91 -96.14 120.50 88.08 7.69 4.23 69.82 10.34 7.08 0.78 4.03 0.00 4.64 3.31 27 E C S 131.07 3.77 18.66 23.12 99.52 -147.88 -78.20 -24.51 92.63 4.00 3.37 23.55 38.64 30.65 0.35 3.19 0.00 2.60 1.02 28 T C S 71.91 7.01 18.54 26.09 113.68 36.13 -114.91 66.13 88.11 8.95 2.95 25.34 33.45 29.77 0.26 2.86 0.00 7.44 0.88 29 Y C C 51.13 18.06 15.77 33.12 124.25 81.91 -114.34 147.66 67.71 31.61 0.68 44.97 21.21 2.31 0.11 0.65 0.00 29.23 1.52 30 Y E E 66.90 11.60 24.67 36.70 125.40 -137.13 -119.16 139.82 23.75 76.13 0.12 20.86 2.21 0.28 0.03 0.09 0.00 75.63 0.91 31 V E E 3.26 26.18 18.69 45.54 125.59 -161.31 -121.58 136.69 7.55 92.44 0.02 6.89 0.40 0.03 0.00 0.01 0.00 92.51 0.16 32 N E E 30.19 14.87 27.94 42.86 129.45 -171.98 -127.08 146.94 1.54 98.46 0.00 1.44 0.06 0.00 0.00 0.00 0.00 98.47 0.03 33 W E E 8.67 24.63 21.71 46.30 123.94 -152.32 -112.67 140.68 0.74 99.26 0.00 0.69 0.02 0.00 0.00 0.00 0.00 99.27 0.01 34 F E E 22.50 16.83 24.33 41.16 133.73 -174.69 -134.17 150.95 0.42 99.58 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.58 0.02 35 Q E E 33.85 16.06 21.40 37.51 123.63 -152.67 -116.73 137.95 1.87 98.13 0.00 1.60 0.10 0.00 0.00 0.00 0.00 98.23 0.05 36 Q E E 54.16 13.80 16.47 30.82 118.34 -148.96 -101.75 133.01 28.28 71.71 0.01 25.86 1.44 0.06 0.00 0.01 0.00 71.50 1.13 37 R C C 107.16 7.05 15.47 23.86 120.75 -144.91 -96.57 146.95 98.01 1.97 0.02 96.62 1.52 0.12 0.00 0.01 0.00 1.42 0.30 38 P C T 102.88 4.01 11.76 17.75 109.59 -83.99 -58.96 135.05 99.64 0.10 0.26 0.32 2.75 96.59 0.00 0.24 0.00 0.06 0.02 39 G C T 68.64 0.31 13.25 10.99 95.35 19.06 83.68 -2.62 99.67 0.07 0.26 0.40 2.69 96.57 0.00 0.28 0.00 0.04 0.01 40 Q C S 85.03 6.32 10.04 18.36 128.32 99.31 -110.46 160.35 94.55 5.10 0.35 41.74 51.64 1.36 0.07 0.30 0.00 1.82 3.08 41 V C C 105.82 2.37 17.75 20.22 115.87 -98.49 -75.64 143.39 97.19 2.79 0.02 88.60 8.65 0.12 0.00 0.01 0.00 2.30 0.31 42 P C C 43.62 18.19 12.16 29.66 114.83 -102.99 -65.57 144.64 89.22 10.77 0.01 87.17 2.02 0.06 0.00 0.01 0.00 10.48 0.26 43 V E E 47.34 11.03 20.89 32.85 122.64 -156.79 -118.90 134.05 3.09 96.90 0.01 2.86 0.17 0.01 0.00 0.00 0.00 96.53 0.43 44 L E E 51.70 16.16 19.75 35.64 110.64 -119.80 -76.89 124.34 0.61 99.39 0.00 0.58 0.01 0.00 0.00 0.00 0.00 99.39 0.02 45 V E E 15.16 19.51 21.56 41.02 101.68 176.19 -99.25 -31.33 2.03 97.97 0.01 1.43 0.40 0.01 0.00 0.00 0.00 98.13 0.02 46 V E E 13.24 19.91 21.59 41.28 133.64 7.16 -143.54 141.61 0.73 99.26 0.00 0.60 0.05 0.00 0.00 0.00 0.00 99.30 0.04 47 Y E E 61.72 16.40 20.17 35.93 129.97 -174.05 -134.77 139.82 8.38 91.55 0.07 7.15 0.80 0.11 0.02 0.03 0.00 91.47 0.42 48 G C C 20.80 12.32 19.21 31.61 134.35 123.32 134.98 -171.72 64.80 34.02 1.18 31.98 22.51 11.50 0.15 1.11 0.00 31.55 1.19 49 N C S 102.37 5.99 17.92 24.49 99.66 -54.42 -82.59 4.08 89.49 8.36 2.15 18.07 37.74 34.05 0.18 2.16 0.00 6.57 1.23 50 N C S 88.61 7.50 16.65 24.88 107.68 29.94 -107.20 53.31 92.72 5.12 2.16 20.75 38.66 33.46 0.18 2.33 0.00 3.52 1.10 51 Y C S 121.16 10.27 16.38 26.83 110.28 74.00 -97.36 90.40 81.83 16.42 1.75 32.11 39.14 11.17 0.32 1.68 0.01 10.79 4.77 52 R C C 111.45 9.62 16.69 27.04 119.42 114.37 -99.92 134.99 83.43 16.15 0.42 51.14 31.48 1.66 0.12 0.36 0.00 10.90 4.34 53 P C C 48.71 14.33 12.81 27.27 113.83 -108.74 -67.72 147.87 86.43 11.89 1.69 75.02 5.61 5.04 0.35 1.59 0.00 8.10 4.30 54 S C T 82.74 3.62 16.21 21.28 110.87 -104.09 -71.33 138.98 93.60 4.67 1.73 14.18 15.68 63.67 0.20 1.78 0.00 3.19 1.30 55 G C T 56.33 2.60 18.00 20.96 98.72 21.76 83.44 -1.49 94.56 4.14 1.30 15.45 18.30 60.83 0.12 1.46 0.00 3.08 0.76 56 I C C 30.54 20.98 9.29 28.91 116.41 119.72 -87.27 132.62 92.86 6.91 0.23 62.87 29.87 0.58 0.07 0.16 0.00 3.31 3.15 57 P C C 52.58 7.89 16.95 26.35 114.16 -106.92 -65.85 150.83 94.15 4.06 1.79 88.56 3.30 2.22 0.28 1.68 0.00 2.42 1.56 58 E C T 145.57 3.22 17.42 22.16 92.81 -109.83 -62.39 -27.24 82.16 1.98 15.86 6.69 22.30 51.68 0.58 16.94 0.00 1.32 0.50 59 R C T 107.30 10.12 18.37 28.82 93.75 64.08 -79.67 -10.01 77.44 5.10 17.45 6.21 20.76 49.49 0.58 18.20 0.00 4.22 0.53 60 F E E 17.98 23.21 14.01 36.62 112.85 68.29 -101.57 103.85 24.39 65.05 10.56 16.93 6.33 3.69 1.35 8.32 0.02 61.37 1.99 61 S E E 45.78 9.60 23.41 33.60 131.70 142.44 -126.63 151.65 12.30 87.55 0.15 10.70 1.51 0.21 0.06 0.09 0.00 86.08 1.34 62 G E E 17.39 19.82 15.89 34.57 141.53 168.70 -155.22 166.92 9.01 90.95 0.04 7.84 0.91 0.11 0.01 0.03 0.00 90.90 0.20 63 S E E 54.98 5.95 24.39 31.53 135.42 -149.98 -143.35 155.41 6.48 93.47 0.05 5.43 0.81 0.12 0.01 0.03 0.00 93.46 0.15 64 W E E 92.01 19.11 13.00 30.89 126.76 -154.71 -128.28 137.49 9.60 90.29 0.11 7.46 1.93 0.37 0.02 0.09 0.00 89.39 0.74 65 S E E 69.73 3.43 20.38 24.22 115.65 176.14 -129.47 106.38 30.65 69.10 0.25 23.91 5.87 1.50 0.05 0.24 0.00 67.23 1.20 66 G C T 47.13 3.93 19.02 23.50 109.16 -52.73 61.90 -126.10 99.00 0.70 0.31 1.20 32.94 64.97 0.01 0.29 0.00 0.53 0.07 67 N C T 65.68 14.16 15.59 29.90 97.04 -13.12 -100.93 6.05 99.08 0.68 0.24 1.07 33.40 64.72 0.01 0.22 0.00 0.53 0.05 68 T E E 44.58 10.36 21.99 33.74 125.29 85.57 -114.42 139.21 14.43 85.55 0.02 11.24 2.99 0.18 0.00 0.02 0.00 84.76 0.81 69 G E E 2.55 24.09 17.04 41.49 131.36 -175.42 -131.36 149.38 2.81 97.19 0.00 2.55 0.08 0.00 0.00 0.00 0.00 97.29 0.08 70 T E E 36.46 10.56 27.80 39.52 123.62 -155.83 -121.86 135.04 1.72 98.28 0.00 1.43 0.06 0.00 0.00 0.00 0.00 98.50 0.01 71 L E E 2.37 26.76 18.96 46.77 120.62 -166.31 -115.38 130.02 0.32 99.68 0.00 0.30 0.00 0.00 0.00 0.00 0.00 99.69 0.00 72 T E E 40.26 9.95 27.75 38.70 120.27 -164.09 -116.04 128.65 0.13 99.87 0.00 0.14 0.00 0.00 0.00 0.00 0.00 99.86 0.00 73 I E E 6.38 24.68 17.04 42.40 115.96 -165.48 -112.87 121.55 1.91 98.09 0.00 2.02 0.02 0.00 0.00 0.00 0.00 97.70 0.26 74 T C C 56.86 7.31 23.68 31.27 125.72 -171.97 -113.10 152.08 89.39 10.55 0.07 46.75 34.86 5.86 0.00 0.09 0.00 12.19 0.25 75 A C S 69.88 3.90 24.11 28.22 94.50 12.56 59.86 45.34 98.67 1.29 0.04 4.51 85.79 8.37 0.00 0.04 0.00 1.22 0.08 76 A C C 10.72 24.04 10.02 33.64 116.04 -151.96 -69.80 140.61 99.26 0.73 0.01 98.27 1.18 0.02 0.00 0.00 0.00 0.35 0.18 77 Q C C 81.80 4.79 24.21 28.89 130.78 -171.71 -123.72 157.73 97.63 2.32 0.05 97.93 0.25 0.01 0.01 0.01 0.00 0.38 1.41 78 V H G 76.74 12.63 15.44 28.13 91.38 -107.19 -60.01 -33.06 2.78 0.02 97.20 0.19 0.18 1.65 0.34 97.62 0.00 0.02 0.00 79 E H G 130.12 2.93 21.50 24.79 90.72 62.39 -71.28 -15.79 2.23 0.03 97.73 0.10 0.14 1.43 0.26 98.05 0.00 0.02 0.00 80 D H G 17.69 20.20 15.34 35.69 93.47 66.72 -83.66 -3.55 3.51 0.03 96.45 0.57 0.36 1.37 0.39 97.28 0.00 0.03 0.00 81 E C C 68.19 14.55 20.06 34.52 114.33 117.05 -72.25 135.10 98.37 1.51 0.12 95.84 2.60 0.11 0.01 0.09 0.00 1.24 0.10 82 A E E 20.44 14.58 22.49 37.11 146.28 126.19 -163.64 170.29 9.19 90.80 0.02 8.60 0.54 0.04 0.00 0.01 0.00 89.52 1.29 83 D E E 47.43 11.88 24.98 37.20 117.21 -96.63 -93.96 134.80 1.13 98.87 0.00 1.09 0.04 0.00 0.00 0.00 0.00 98.82 0.04 84 Y E E 7.20 25.48 18.86 44.67 125.01 -166.46 -118.20 139.64 0.92 99.08 0.00 0.81 0.06 0.00 0.00 0.00 0.00 99.10 0.02 85 Y E E 37.80 15.24 27.45 42.79 129.65 -168.49 -126.09 146.33 1.61 98.39 0.00 1.42 0.08 0.00 0.00 0.00 0.00 98.42 0.07 86 C E E 2.63 25.93 21.05 47.38 124.59 -161.19 -118.73 139.61 3.45 96.54 0.01 3.03 0.21 0.02 0.00 0.01 0.00 96.68 0.06 87 N E E 28.47 14.43 26.97 41.52 132.28 -176.82 -132.30 148.67 1.52 98.47 0.00 1.30 0.09 0.01 0.00 0.00 0.00 98.57 0.02 88 S E E 8.07 21.59 19.31 40.67 135.79 -173.42 -137.13 154.22 1.13 98.86 0.00 0.96 0.07 0.00 0.00 0.00 0.00 98.95 0.02 89 W E E 90.20 10.27 20.77 31.85 125.05 -142.75 -119.12 138.92 2.37 97.62 0.00 2.12 0.15 0.01 0.00 0.00 0.00 97.05 0.67 90 D C C 33.46 12.41 12.63 26.17 124.72 -143.46 -88.39 174.74 87.70 12.27 0.03 87.51 0.59 0.08 0.00 0.02 0.00 11.13 0.66 91 S C T 91.69 2.68 12.90 17.06 90.63 -94.05 -65.16 -20.04 99.35 0.19 0.46 0.70 5.31 93.33 0.01 0.48 0.00 0.13 0.03 92 S C T 87.91 1.11 12.90 13.65 93.62 56.15 -87.86 -2.01 99.39 0.09 0.51 0.46 5.78 93.14 0.01 0.53 0.00 0.05 0.02 93 G C S 45.58 4.38 12.41 18.48 97.84 -103.08 87.51 4.51 98.85 0.74 0.41 15.80 81.73 1.54 0.04 0.30 0.00 0.35 0.26 94 T C C 68.60 5.19 14.95 21.81 117.03 137.52 -81.99 142.05 97.97 2.00 0.03 93.63 4.25 0.22 0.00 0.02 0.00 1.60 0.26 95 H E E 85.23 12.70 15.92 28.84 117.99 -132.16 -96.86 133.51 9.06 90.93 0.01 8.51 0.45 0.04 0.00 0.01 0.00 89.35 1.64 96 L E E 35.09 16.69 18.79 35.41 121.85 -163.94 -111.70 136.84 2.52 97.48 0.00 2.33 0.11 0.01 0.00 0.00 0.00 97.48 0.07 97 L E E 51.09 15.75 22.22 37.35 120.86 -151.55 -112.11 129.83 2.78 97.21 0.01 2.62 0.13 0.01 0.00 0.00 0.00 96.94 0.29 98 F E E 30.83 20.83 19.67 39.58 118.81 -158.90 -100.47 137.67 20.25 79.66 0.09 17.46 2.01 0.35 0.02 0.07 0.00 79.17 0.92 99 G C C 20.09 16.60 21.43 36.59 118.98 -124.88 -69.96 -159.44 66.17 33.56 0.27 46.12 15.68 3.04 0.03 0.30 0.00 34.03 0.80 100 G C C 35.32 10.52 23.26 33.09 103.41 -25.94 -79.73 -2.30 74.13 25.56 0.31 41.87 27.54 4.60 0.03 0.37 0.00 24.67 0.92 101 G C C 16.97 15.99 19.93 35.15 120.44 -123.93 90.79 174.00 68.68 31.16 0.17 54.38 11.00 1.40 0.02 0.19 0.00 32.41 0.61 102 T E E 20.55 20.65 18.96 38.77 125.00 -107.22 -112.28 141.24 13.87 86.11 0.02 12.67 0.80 0.06 0.00 0.01 0.00 85.93 0.52 103 R E E 109.84 8.81 25.50 34.74 118.70 -138.37 -103.65 132.42 1.71 98.29 0.00 1.54 0.11 0.01 0.00 0.00 0.00 98.27 0.08 104 L E E 8.22 25.10 15.39 40.89 121.56 -162.61 -109.65 134.24 1.53 98.46 0.00 1.47 0.07 0.01 0.00 0.00 0.00 98.42 0.03 105 T E E 53.24 7.51 24.69 32.64 122.92 -165.27 -115.63 135.87 1.98 98.02 0.00 1.98 0.05 0.00 0.00 0.00 0.00 97.83 0.13 106 V E E 34.81 18.73 13.28 31.70 115.09 -143.14 -96.44 125.72 9.84 90.15 0.01 10.13 0.16 0.02 0.00 0.01 0.00 88.81 0.87 107 L C C 80.23 8.27 18.32 27.26 111.20 -155.71 -89.34 123.65 99.57 0.43 0.00 99.61 0.04 0.01 0.00 0.00 0.00 0.33 0.01