# 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 Q C C 115.21 4.88 16.25 22.50 118.23 -158.71 -96.96 132.87 99.91 0.09 0.00 99.88 0.06 0.01 0.00 0.00 0.00 0.05 0.00 1 P C C 77.38 9.03 12.70 22.77 113.88 -116.80 -72.71 143.88 90.67 9.02 0.30 89.01 1.19 0.77 0.06 0.14 0.00 8.11 0.72 2 V C E 74.55 9.37 14.24 24.67 112.84 -151.27 -100.26 122.00 51.67 47.85 0.48 41.37 9.08 1.21 0.14 0.40 0.00 45.35 2.45 3 L E E 60.43 14.28 13.56 28.01 117.84 -147.52 -100.79 129.72 31.77 67.83 0.40 27.57 3.24 0.54 0.15 0.29 0.00 64.46 3.75 4 T E E 67.13 9.65 17.80 28.20 122.24 -168.82 -115.77 138.30 38.52 61.27 0.21 32.66 4.18 0.43 0.08 0.17 0.00 57.10 5.38 5 Q C C 84.35 11.64 15.81 27.97 122.52 -151.09 -113.87 135.59 72.15 27.81 0.04 59.17 12.77 0.22 0.01 0.04 0.00 26.31 1.47 6 P C C 60.63 10.41 16.85 27.94 117.07 -100.86 -68.09 153.85 96.28 3.69 0.03 84.35 11.29 0.44 0.00 0.03 0.00 3.67 0.23 7 P C C 65.47 11.68 16.55 28.39 107.72 -101.26 -68.00 147.32 95.25 4.65 0.10 67.96 24.93 2.08 0.01 0.13 0.00 4.58 0.30 8 S E E 63.08 8.89 18.99 28.72 129.23 -114.84 -123.74 149.13 40.74 59.11 0.15 32.83 6.94 0.85 0.02 0.16 0.00 58.30 0.91 9 A E E 22.20 18.49 15.30 33.55 133.63 -176.70 -137.81 150.41 6.48 93.49 0.03 5.84 0.54 0.05 0.01 0.02 0.00 93.06 0.49 10 S E E 61.01 7.85 22.15 31.42 133.94 -171.24 -135.34 152.36 3.47 96.52 0.01 3.20 0.22 0.02 0.00 0.00 0.00 96.09 0.46 11 G E E 13.75 14.43 17.71 32.83 143.49 143.08 -169.00 174.15 22.68 77.31 0.02 19.73 2.89 0.08 0.00 0.01 0.00 76.13 1.15 12 P C C 66.21 5.58 23.11 28.60 123.26 -83.80 -93.03 156.31 93.81 6.16 0.03 90.31 3.61 0.14 0.01 0.02 0.00 5.25 0.66 13 P C T 63.85 13.39 14.35 27.89 109.96 -83.19 -59.88 138.34 99.13 0.55 0.32 0.67 4.11 94.56 0.01 0.24 0.00 0.31 0.10 14 G C T 49.43 3.70 19.41 23.93 95.14 21.77 87.25 -5.58 99.44 0.34 0.22 0.93 4.35 94.26 0.01 0.18 0.00 0.24 0.03 15 Q C C 81.08 7.85 17.67 26.69 124.11 120.59 -86.00 151.60 91.83 8.03 0.14 68.29 23.51 0.40 0.02 0.13 0.00 6.89 0.75 16 S C C 63.79 8.72 18.64 28.44 122.10 -127.06 -96.97 144.41 54.54 45.45 0.01 54.10 0.64 0.03 0.00 0.01 0.00 44.57 0.64 17 V E E 13.98 21.90 14.76 36.75 127.79 -166.17 -129.04 142.40 0.74 99.26 0.00 0.74 0.01 0.00 0.00 0.00 0.00 99.18 0.06 18 S E E 56.67 7.38 24.78 32.79 119.07 -145.52 -106.54 133.43 0.32 99.68 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.67 0.01 19 I E E 6.69 25.66 15.63 41.93 121.15 -166.92 -116.15 130.17 2.32 97.68 0.00 2.23 0.07 0.00 0.00 0.00 0.00 97.64 0.06 20 S E E 48.58 7.87 26.39 34.86 122.81 -161.72 -110.54 140.93 14.81 85.17 0.02 13.27 0.80 0.06 0.00 0.01 0.00 85.71 0.15 21 C E E 9.62 24.79 15.41 40.08 131.38 -176.05 -134.43 148.79 20.20 79.76 0.04 18.37 1.19 0.11 0.01 0.03 0.00 79.77 0.53 22 S E E 50.49 7.80 25.67 34.05 131.03 -167.22 -126.90 152.84 15.81 84.10 0.09 13.71 1.51 0.20 0.03 0.06 0.00 80.92 3.57 23 G E E 19.96 18.17 16.82 33.68 137.38 153.03 -147.30 172.33 35.59 64.17 0.24 27.74 7.49 0.90 0.06 0.22 0.00 61.00 2.59 24 S C C 48.26 8.70 20.38 29.59 128.11 -110.14 -116.90 153.74 62.62 36.67 0.70 49.46 10.64 1.97 0.16 0.64 0.00 34.68 2.46 25 R C C 140.05 9.00 16.15 25.87 98.45 -129.44 -82.66 -3.39 75.50 14.29 10.21 46.07 17.68 12.50 1.74 8.73 0.02 10.77 2.50 26 S C C 68.40 5.28 17.76 23.89 109.45 92.25 -90.52 84.15 79.84 7.43 12.74 30.20 24.78 26.22 1.68 10.59 0.02 4.67 1.84 27 N C C 86.03 8.80 16.86 26.18 105.36 26.67 -92.95 73.36 81.34 7.61 11.05 38.92 19.51 23.57 1.50 9.71 0.01 4.87 1.92 28 I C C 47.51 17.86 13.18 30.03 106.34 157.31 -89.13 39.77 80.63 11.71 7.65 47.73 17.18 15.67 1.81 6.12 0.01 6.72 4.75 29 G C C 39.82 5.75 20.11 26.36 110.62 -145.30 71.82 -125.14 89.85 6.34 3.81 32.04 28.93 29.37 0.54 3.40 0.00 4.06 1.65 30 T C S 71.38 7.43 19.57 27.45 118.12 -1.13 -104.33 135.56 89.75 6.86 3.39 26.74 36.42 27.06 0.35 3.21 0.00 5.11 1.11 31 N C C 46.41 16.77 17.00 33.15 106.50 -139.83 -97.23 22.20 77.75 20.82 1.42 40.01 31.29 6.44 0.17 1.36 0.00 19.60 1.12 32 F E E 59.47 11.83 24.01 36.44 124.86 81.07 -114.98 140.20 23.59 76.26 0.15 20.77 2.28 0.35 0.03 0.12 0.00 75.74 0.71 33 V E E 3.54 25.83 18.93 45.37 124.84 -167.38 -123.19 135.85 2.86 97.14 0.01 2.62 0.12 0.01 0.00 0.00 0.00 97.15 0.09 34 Y E E 47.55 14.36 27.43 41.91 123.72 -162.03 -115.02 137.74 0.97 99.03 0.00 0.90 0.03 0.00 0.00 0.00 0.00 99.06 0.01 35 W E E 7.57 24.74 21.31 46.14 124.48 -159.89 -113.21 140.81 0.71 99.29 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.32 0.01 36 Y E E 26.69 16.50 24.36 40.91 132.65 -173.29 -130.59 148.96 0.42 99.58 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.59 0.02 37 Q E E 30.92 16.47 21.15 37.72 123.87 -158.08 -116.58 138.08 2.05 97.95 0.00 1.74 0.12 0.01 0.00 0.00 0.00 98.06 0.07 38 Q E E 60.46 12.43 17.69 30.80 116.76 -140.42 -100.06 127.63 29.52 70.46 0.02 27.13 1.46 0.06 0.00 0.01 0.00 70.50 0.82 39 L C C 54.05 10.39 13.54 25.47 118.70 -142.36 -91.27 145.95 95.17 4.79 0.04 91.35 3.83 0.28 0.01 0.03 0.00 3.80 0.70 40 P C T 104.76 3.48 12.39 17.74 109.16 -85.83 -58.54 135.35 99.63 0.12 0.26 0.28 3.32 96.07 0.01 0.23 0.00 0.07 0.02 41 G C T 69.50 0.25 13.21 10.49 95.20 17.69 83.11 -2.15 99.71 0.06 0.22 0.36 3.15 96.23 0.00 0.21 0.00 0.04 0.01 42 A C S 46.09 7.67 8.93 18.38 129.92 96.18 -114.43 160.95 91.53 8.12 0.35 40.60 49.12 1.83 0.07 0.30 0.00 2.74 5.33 43 A C C 75.25 2.23 17.69 19.63 117.07 -98.12 -69.72 151.45 95.21 4.74 0.04 76.94 18.30 0.29 0.01 0.05 0.00 3.87 0.56 44 P C C 49.18 17.02 11.68 28.12 115.09 -98.21 -64.94 143.58 92.96 7.02 0.02 90.39 2.29 0.12 0.00 0.02 0.00 7.00 0.18 45 K E E 92.22 8.49 20.85 30.10 126.41 -162.31 -123.74 140.36 7.99 91.98 0.03 7.25 0.59 0.05 0.01 0.02 0.00 91.48 0.60 46 L E E 63.97 15.23 18.79 33.60 111.00 -114.47 -74.11 128.55 0.87 99.12 0.00 0.86 0.03 0.00 0.00 0.00 0.00 99.04 0.07 47 L E E 17.17 19.86 20.75 40.54 101.08 177.04 -94.37 -34.32 4.80 95.19 0.01 3.07 1.58 0.04 0.00 0.00 0.00 95.28 0.03 48 I E E 12.83 20.64 20.76 41.53 134.55 7.76 -144.88 141.79 0.91 99.08 0.00 0.75 0.07 0.00 0.00 0.00 0.00 99.15 0.02 49 Y E E 51.71 16.84 20.51 36.90 127.60 -172.51 -128.51 137.75 5.19 94.77 0.04 4.78 0.21 0.02 0.02 0.01 0.00 94.68 0.28 50 K E E 63.96 12.93 19.20 32.27 119.45 -174.36 -125.04 128.68 36.63 62.34 1.03 27.07 8.00 2.99 0.27 0.77 0.00 58.96 1.95 51 N C T 78.24 9.73 18.48 27.98 106.35 -27.74 60.33 -99.57 85.76 12.01 2.23 13.70 33.54 38.89 0.21 2.10 0.00 10.40 1.16 52 D C T 94.57 7.93 16.64 25.22 98.51 -30.93 -65.86 15.19 95.17 2.78 2.05 12.58 39.00 43.54 0.14 2.16 0.00 2.04 0.53 53 Q C S 95.68 6.17 17.41 24.92 122.36 103.93 -108.01 141.52 76.56 21.66 1.78 30.24 37.96 9.08 0.38 1.61 0.01 12.65 8.07 54 R C C 113.44 12.10 14.72 27.02 116.19 -130.02 -90.37 133.76 84.77 14.97 0.26 65.13 18.76 1.14 0.08 0.23 0.00 11.37 3.28 55 P C C 39.48 15.48 11.68 27.24 113.99 -109.36 -67.43 147.63 88.41 10.08 1.51 77.90 5.31 4.53 0.31 1.45 0.00 7.32 3.18 56 S C T 91.43 1.90 16.39 18.90 110.77 -107.92 -72.42 137.56 94.02 4.41 1.57 16.65 16.48 60.91 0.17 1.64 0.00 2.92 1.21 57 G C T 57.63 2.20 17.00 19.45 99.22 22.66 83.86 -1.99 94.98 3.78 1.24 16.96 19.28 58.81 0.10 1.47 0.00 2.71 0.66 58 V C C 29.20 20.52 8.68 27.63 117.01 121.55 -88.87 132.09 93.54 6.23 0.24 64.42 28.97 0.59 0.07 0.17 0.00 2.85 2.93 59 P C C 55.27 7.41 16.22 25.20 114.17 -108.10 -66.42 151.43 93.69 4.15 2.16 85.96 4.27 3.03 0.28 2.28 0.00 2.60 1.59 60 E C T 146.64 3.11 16.64 21.14 93.37 -109.04 -63.50 -25.00 90.14 2.34 7.51 6.70 27.37 55.37 0.39 7.98 0.00 1.65 0.53 61 R C T 114.23 8.84 17.87 27.21 95.66 61.37 -83.56 -2.63 83.19 8.47 8.34 9.83 19.99 52.89 0.47 8.57 0.01 7.49 0.74 62 F E E 28.70 22.03 13.46 34.57 116.21 99.46 -97.32 127.40 20.14 77.72 2.14 16.42 3.36 1.05 0.68 1.32 0.00 74.76 2.40 63 F E E 96.70 8.00 23.24 32.15 131.73 166.05 -132.30 149.81 8.02 91.85 0.13 7.12 0.82 0.15 0.06 0.07 0.00 90.40 1.39 64 G E E 20.18 19.96 15.14 33.59 139.59 171.83 -148.30 164.84 12.15 87.76 0.09 10.23 1.55 0.25 0.02 0.05 0.00 87.67 0.23 65 S E E 55.17 6.64 23.07 30.84 135.49 -155.39 -142.42 153.03 14.20 85.69 0.11 12.30 1.40 0.23 0.02 0.08 0.00 85.63 0.34 66 K E E 91.68 16.22 14.27 29.71 126.66 -154.17 -125.85 138.68 19.53 80.24 0.24 15.59 3.69 0.75 0.05 0.20 0.00 77.73 1.99 67 S C E 67.82 4.40 19.73 24.98 118.55 -170.02 -128.06 117.91 52.23 47.36 0.40 41.01 8.80 2.33 0.08 0.39 0.00 45.45 1.94 68 G C S 44.20 4.90 19.30 24.92 110.09 -50.18 63.30 -128.22 98.52 0.99 0.49 2.81 50.67 45.17 0.02 0.48 0.00 0.73 0.12 69 T C S 59.25 13.36 16.05 29.70 97.33 -13.82 -99.16 0.24 98.29 1.32 0.39 2.41 52.67 43.42 0.02 0.34 0.00 1.03 0.12 70 S E E 34.25 11.10 21.88 34.08 128.12 80.95 -115.41 146.07 33.10 66.81 0.09 23.94 9.11 0.79 0.02 0.10 0.00 63.86 2.19 71 A E E 3.27 24.88 17.28 42.86 130.70 -171.10 -133.47 144.24 10.94 89.05 0.01 10.19 0.42 0.03 0.00 0.01 0.00 89.02 0.33 72 S E E 26.00 12.04 27.64 40.53 126.86 -164.43 -123.78 142.29 4.29 95.70 0.00 3.58 0.40 0.01 0.00 0.00 0.00 95.95 0.05 73 L E E 2.61 26.63 20.00 47.41 123.08 -166.20 -121.73 132.04 0.51 99.49 0.00 0.52 0.01 0.00 0.00 0.00 0.00 99.47 0.00 74 A E E 27.32 11.29 27.51 39.67 119.77 -162.14 -114.53 130.99 0.22 99.78 0.00 0.24 0.00 0.00 0.00 0.00 0.00 99.75 0.01 75 I E E 5.23 25.20 17.58 43.48 118.00 -164.47 -114.26 123.60 2.14 97.86 0.00 2.25 0.02 0.00 0.00 0.00 0.00 97.31 0.42 76 S C C 48.95 7.88 23.42 31.60 127.16 -169.49 -112.95 150.32 81.77 18.13 0.10 45.25 23.89 10.53 0.01 0.13 0.00 19.75 0.44 77 G C S 45.68 3.44 23.83 27.70 93.53 17.88 69.21 28.43 99.00 0.97 0.04 5.65 81.53 11.76 0.00 0.04 0.00 0.95 0.07 78 L C C 17.11 24.01 9.71 32.89 116.08 -156.97 -72.91 139.59 99.27 0.72 0.01 98.44 1.00 0.03 0.00 0.00 0.00 0.28 0.25 79 R C C 112.33 4.11 23.08 27.06 129.10 -166.36 -120.03 157.80 99.59 0.37 0.04 99.41 0.27 0.01 0.01 0.01 0.00 0.07 0.23 80 S H G 65.83 10.30 14.72 25.72 91.40 -106.30 -59.13 -32.43 3.57 0.02 96.40 0.21 0.23 2.13 0.31 97.11 0.00 0.01 0.00 81 E H G 135.69 2.41 20.44 22.90 90.59 62.07 -71.83 -15.48 3.02 0.03 96.95 0.12 0.18 1.91 0.22 97.54 0.00 0.02 0.00 82 D H G 19.64 19.42 14.20 33.83 94.36 67.12 -83.87 -2.29 4.44 0.05 95.51 0.73 0.48 1.64 0.33 96.79 0.00 0.04 0.00 83 E C C 73.73 13.15 19.62 32.97 114.43 119.27 -72.87 134.90 97.94 1.94 0.12 94.85 3.23 0.10 0.01 0.09 0.00 1.58 0.14 84 V E E 23.68 17.03 19.58 36.47 139.90 155.13 -147.47 164.19 15.86 84.13 0.02 15.40 0.51 0.02 0.00 0.01 0.00 83.04 1.00 85 D E E 55.16 10.58 24.82 35.76 116.17 -107.61 -94.49 132.41 0.95 99.05 0.00 0.90 0.05 0.00 0.00 0.00 0.00 99.01 0.04 86 Y E E 8.77 24.92 18.20 43.27 127.47 -169.65 -121.84 143.57 0.62 99.38 0.00 0.55 0.03 0.00 0.00 0.00 0.00 99.40 0.01 87 Y E E 42.29 15.09 27.59 42.74 128.42 -168.23 -125.20 142.66 1.34 98.65 0.00 1.13 0.08 0.01 0.00 0.00 0.00 98.74 0.04 88 C E E 2.15 26.41 22.04 48.69 128.99 -167.85 -127.16 144.87 3.13 96.86 0.01 2.53 0.33 0.03 0.00 0.01 0.00 97.06 0.04 89 A E E 10.24 17.86 27.59 45.29 132.33 -171.74 -129.71 149.09 1.74 98.25 0.01 1.45 0.12 0.01 0.00 0.00 0.00 98.39 0.02 90 A E E 5.38 23.59 22.08 45.37 128.53 -165.74 -125.45 143.18 0.97 99.03 0.00 0.85 0.04 0.00 0.00 0.00 0.00 99.07 0.03 91 W E E 57.10 13.74 22.97 36.97 128.17 -164.84 -123.88 144.14 3.55 96.44 0.01 3.19 0.22 0.02 0.00 0.00 0.00 96.22 0.34 92 D E E 30.98 14.43 15.90 31.12 120.66 -145.15 -103.52 145.07 43.32 56.57 0.11 37.62 3.55 0.47 0.02 0.10 0.00 57.68 0.57 93 D C S 96.41 6.08 16.53 23.88 95.90 -135.41 -81.39 -4.59 94.17 4.80 1.04 11.34 55.02 27.52 0.06 1.09 0.00 4.52 0.45 94 S C S 64.39 4.51 14.43 20.02 108.31 75.99 -92.01 -2.26 93.78 4.24 1.98 10.87 52.38 30.83 0.16 1.91 0.00 2.80 1.04 95 L C T 109.19 6.75 12.49 20.13 97.46 -98.93 -68.10 -13.43 96.29 0.97 2.74 5.33 35.11 55.71 0.14 2.81 0.00 0.58 0.32 96 S C T 81.14 2.95 15.22 18.94 100.69 54.06 -90.86 3.33 96.37 1.68 1.96 7.70 33.69 54.75 0.09 2.19 0.00 1.23 0.35 97 G C C 27.60 7.53 16.79 25.40 130.35 -80.06 123.90 176.85 74.72 24.53 0.75 43.15 27.86 4.37 0.10 0.81 0.00 21.84 1.88 98 H C E 79.90 13.82 16.04 29.63 120.19 -69.29 -95.43 140.42 50.06 49.90 0.04 47.30 1.64 0.14 0.01 0.03 0.00 50.31 0.57 99 V E E 42.35 14.39 19.71 34.37 123.66 -163.54 -118.99 134.36 4.37 95.62 0.01 4.03 0.26 0.02 0.01 0.01 0.00 94.10 1.58 100 F E E 66.14 17.25 19.87 36.11 118.36 -140.01 -94.98 135.46 8.42 91.55 0.03 7.26 0.86 0.12 0.01 0.02 0.00 90.45 1.28 101 G C C 12.25 19.01 17.89 36.05 120.37 -136.67 -84.47 166.01 67.52 32.34 0.15 50.14 13.89 1.80 0.02 0.15 0.00 33.33 0.67 102 A C C 62.53 7.72 23.80 31.57 98.39 -97.01 -79.66 -4.89 76.13 23.64 0.23 47.24 25.54 2.98 0.03 0.26 0.00 22.94 1.00 103 G C C 15.41 16.55 20.03 35.60 124.58 -114.81 88.69 175.42 74.76 25.10 0.14 58.94 12.61 1.43 0.02 0.16 0.00 26.22 0.63 104 T E E 17.18 21.37 18.72 39.42 124.75 -104.41 -113.02 141.16 19.30 80.65 0.04 17.28 1.42 0.12 0.01 0.03 0.00 80.35 0.80 105 K E E 94.27 8.89 25.85 35.15 117.57 -138.33 -100.29 129.20 2.79 97.19 0.01 2.48 0.24 0.03 0.00 0.01 0.00 97.07 0.17 106 V E E 6.45 25.46 15.35 41.39 121.72 -164.80 -113.23 132.68 2.31 97.68 0.01 2.18 0.15 0.03 0.00 0.01 0.00 97.55 0.08 107 T E E 52.89 7.39 24.95 32.79 121.53 -163.65 -113.74 133.17 2.42 97.57 0.01 2.42 0.08 0.01 0.00 0.01 0.00 97.28 0.19 108 V E E 30.23 19.57 13.36 32.62 115.58 -146.24 -99.41 125.43 9.91 90.07 0.02 10.02 0.19 0.03 0.01 0.01 0.00 88.82 0.92 109 L C C 78.12 8.54 18.93 28.01 111.94 -156.29 -91.19 125.57 99.17 0.83 0.00 99.27 0.05 0.01 0.00 0.00 0.00 0.67 0.01