# 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 102.33 3.72 20.70 24.57 103.41 -129.57 -69.91 61.99 99.86 0.13 0.00 99.76 0.12 0.02 0.00 0.00 0.00 0.09 0.00 1 I C C 36.45 20.75 10.35 29.71 117.67 -152.92 -97.34 130.88 71.29 28.57 0.14 69.86 0.64 0.30 0.03 0.08 0.00 28.36 0.74 2 Q E E 101.25 4.69 21.55 27.09 123.69 -169.47 -118.79 137.94 28.32 71.48 0.20 24.87 2.74 0.44 0.05 0.14 0.00 70.97 0.79 3 M E E 49.44 20.11 12.81 31.90 122.02 -157.77 -111.08 134.54 11.29 88.62 0.09 10.49 0.73 0.13 0.03 0.05 0.00 87.65 0.93 4 T E E 65.32 7.37 20.71 28.81 125.19 -172.69 -122.36 142.48 13.33 86.55 0.12 11.85 1.23 0.19 0.05 0.06 0.00 84.70 1.91 5 Q E E 77.02 13.96 15.84 29.60 126.08 -158.86 -123.54 139.13 44.18 55.65 0.17 34.21 9.57 0.71 0.04 0.15 0.00 54.05 1.26 6 S C C 52.34 10.10 17.07 27.84 122.16 -139.44 -99.05 149.08 81.93 17.93 0.14 54.92 25.37 1.10 0.02 0.14 0.00 17.76 0.69 7 P C C 57.40 9.48 16.68 27.03 115.25 -8.85 -70.95 150.16 89.07 10.39 0.54 65.87 18.82 3.39 0.06 0.61 0.00 10.67 0.57 8 A C S 62.94 9.69 16.63 26.98 97.07 -152.90 -84.35 -23.55 78.03 21.55 0.42 28.60 45.59 2.72 0.03 0.42 0.00 22.00 0.63 9 S E E 57.01 7.05 20.01 28.28 137.08 11.84 -147.27 151.13 18.68 81.03 0.29 14.62 3.81 0.65 0.04 0.27 0.00 80.12 0.50 10 Q E E 46.22 17.88 15.36 32.72 134.28 -174.74 -141.75 150.22 3.69 96.28 0.03 3.23 0.34 0.04 0.01 0.02 0.00 96.13 0.23 11 S E E 66.37 6.52 22.41 30.30 124.63 -154.93 -119.96 140.36 3.82 96.16 0.02 3.30 0.42 0.03 0.00 0.01 0.00 96.01 0.22 12 A E E 13.96 18.71 14.50 33.40 138.21 170.75 -146.95 159.83 19.25 80.70 0.06 16.93 1.51 0.11 0.01 0.04 0.00 80.92 0.48 13 S E E 55.36 4.77 23.44 27.97 123.08 -114.56 -87.60 157.75 41.82 57.95 0.23 37.48 3.17 0.49 0.10 0.17 0.00 51.77 6.83 14 L C T 68.69 15.00 13.86 28.73 109.31 -83.52 -60.16 134.35 98.67 0.91 0.42 0.42 3.75 94.87 0.02 0.29 0.00 0.54 0.12 15 G C T 46.81 4.06 19.71 24.49 95.57 22.24 88.54 -6.18 99.45 0.29 0.26 0.59 4.64 94.31 0.01 0.21 0.00 0.20 0.03 16 E C C 79.50 8.46 17.14 26.86 122.28 118.87 -81.74 152.98 95.94 3.91 0.15 58.39 37.38 0.57 0.03 0.13 0.00 2.97 0.53 17 S C C 62.72 8.41 19.24 28.60 122.06 -125.97 -99.35 141.52 77.90 22.09 0.01 77.87 0.65 0.03 0.00 0.01 0.00 20.87 0.56 18 V E E 11.41 22.27 14.64 36.95 128.76 -169.81 -128.50 143.24 1.69 98.31 0.00 1.78 0.03 0.00 0.00 0.00 0.00 98.01 0.19 19 T E E 63.51 7.89 25.05 33.42 118.40 -145.49 -107.84 129.24 0.43 99.57 0.00 0.44 0.01 0.00 0.00 0.00 0.00 99.54 0.01 20 I E E 4.38 25.75 16.61 43.24 120.79 -167.33 -114.22 130.15 1.19 98.81 0.00 1.11 0.04 0.00 0.00 0.00 0.00 98.84 0.01 21 T E E 41.99 9.91 27.02 37.64 122.15 -164.73 -114.89 135.49 3.20 96.80 0.00 2.87 0.10 0.00 0.00 0.00 0.00 97.00 0.03 22 C E E 3.57 25.83 17.56 43.93 126.93 -172.46 -125.73 140.83 3.60 96.39 0.00 3.23 0.12 0.00 0.00 0.00 0.00 96.59 0.05 23 L E E 64.95 8.69 27.60 37.08 120.78 -162.23 -114.88 131.68 3.44 96.55 0.01 3.13 0.16 0.01 0.00 0.00 0.00 96.38 0.30 24 A E E 8.05 24.07 14.63 38.51 124.04 -163.99 -111.11 143.60 31.25 68.57 0.18 29.39 1.58 0.24 0.05 0.12 0.00 67.18 1.45 25 S C C 49.63 7.93 21.01 29.34 114.20 -148.91 -91.92 150.38 77.45 21.88 0.66 51.69 22.98 2.56 0.11 0.63 0.00 20.86 1.18 26 Q C S 105.79 6.39 18.58 25.50 107.79 -35.61 -95.03 -11.81 89.69 7.11 3.20 20.65 53.61 15.95 0.39 2.70 0.00 5.66 1.05 27 T C C 80.93 6.09 19.65 26.38 112.98 33.06 -94.38 127.55 91.18 5.56 3.26 48.63 26.03 16.38 0.42 3.32 0.00 4.20 1.01 28 I C C 49.39 17.39 15.82 32.35 112.12 -132.97 -87.31 123.66 85.58 9.36 5.06 48.11 21.38 16.24 0.82 4.65 0.00 6.35 2.44 29 G C C 21.23 13.91 20.02 33.59 120.21 -129.97 -102.45 151.82 87.18 8.61 4.20 49.60 22.68 14.92 0.50 4.19 0.00 6.91 1.20 30 T C S 55.95 12.35 21.73 33.71 103.40 -122.79 -95.54 -12.75 83.41 13.60 3.00 28.51 46.69 7.96 0.30 2.64 0.00 13.00 0.90 31 W E E 70.21 13.71 23.77 37.43 126.60 41.29 -122.61 140.66 34.28 64.14 1.58 27.02 5.40 1.86 0.25 1.34 0.00 63.30 0.84 32 L E E 4.25 25.85 19.71 45.84 125.39 -166.83 -121.85 137.60 6.71 93.27 0.03 5.97 0.46 0.04 0.01 0.01 0.00 93.33 0.18 33 A E E 13.55 16.93 27.60 44.45 127.10 -168.47 -122.84 144.83 1.00 98.99 0.00 0.89 0.04 0.00 0.00 0.00 0.00 99.05 0.02 34 W E E 8.21 24.66 22.18 46.75 124.67 -156.55 -114.57 140.89 0.65 99.35 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.38 0.01 35 Y E E 25.78 16.66 23.99 40.71 132.64 -174.39 -130.81 151.65 0.65 99.35 0.00 0.56 0.03 0.00 0.00 0.00 0.00 99.38 0.03 36 Q E E 39.61 15.21 21.26 36.59 123.72 -147.96 -115.05 138.28 2.67 97.33 0.00 2.21 0.22 0.01 0.00 0.00 0.00 97.48 0.08 37 Q E E 53.71 13.81 15.90 30.28 119.67 -152.03 -106.34 135.24 27.85 72.12 0.02 25.08 1.81 0.08 0.00 0.02 0.00 71.95 1.07 38 K C C 97.37 6.45 15.66 23.41 119.66 -138.70 -94.09 145.05 97.74 2.22 0.03 95.60 2.22 0.19 0.01 0.02 0.00 1.61 0.35 39 P C T 101.09 4.34 11.31 17.65 109.46 -86.97 -58.64 134.00 99.61 0.12 0.27 0.41 3.62 95.61 0.01 0.25 0.00 0.08 0.02 40 G C T 69.16 0.29 12.90 10.52 96.27 17.53 83.24 -2.78 99.64 0.09 0.27 0.51 3.58 95.54 0.01 0.28 0.00 0.06 0.01 41 K C S 109.58 4.36 10.62 17.10 129.44 91.20 -116.71 160.70 94.55 5.10 0.35 32.42 61.09 1.28 0.07 0.28 0.00 1.89 2.96 42 S C C 76.56 2.27 17.18 19.42 117.49 -95.89 -74.44 151.79 97.51 2.47 0.03 86.78 10.76 0.17 0.00 0.02 0.00 1.92 0.34 43 P C C 43.87 18.21 11.28 28.62 115.07 -99.52 -66.67 145.00 87.59 12.38 0.03 85.89 1.77 0.13 0.00 0.03 0.00 11.71 0.46 44 Q E E 84.12 7.83 21.34 29.88 123.90 -157.40 -119.51 138.05 9.39 90.55 0.06 8.16 1.07 0.10 0.02 0.03 0.00 89.98 0.63 45 L E E 62.16 15.79 18.30 33.62 110.83 -116.46 -75.46 126.72 1.11 98.88 0.01 0.99 0.05 0.00 0.00 0.00 0.00 98.92 0.04 46 L E E 21.14 18.57 21.01 39.54 100.79 175.35 -94.66 -35.81 2.44 97.53 0.03 1.64 0.64 0.03 0.01 0.01 0.00 97.66 0.02 47 I E E 11.10 21.36 21.61 42.86 136.77 4.72 -150.01 144.50 0.48 99.50 0.01 0.39 0.04 0.00 0.00 0.00 0.00 99.55 0.01 48 Y E E 59.56 17.22 23.32 39.39 128.17 -171.56 -131.40 137.26 2.20 97.76 0.04 1.92 0.11 0.02 0.02 0.01 0.00 97.84 0.09 49 A E E 17.48 18.19 21.10 38.82 119.08 -168.23 -114.76 130.01 28.50 70.08 1.42 21.16 6.43 1.46 0.69 0.69 0.00 68.93 0.64 50 A C C 29.10 14.46 19.10 33.65 126.82 108.95 -127.55 150.91 59.91 27.37 12.72 33.20 18.20 10.34 3.51 8.38 0.04 24.56 1.78 51 T C T 78.65 8.64 19.07 27.80 99.89 -129.71 -84.38 -15.88 69.30 8.28 22.42 22.83 23.32 25.26 6.77 13.95 0.10 5.84 1.92 52 S C C 63.78 6.08 19.46 26.05 111.18 33.57 -112.17 89.55 67.94 7.49 24.58 28.57 17.50 23.72 8.09 15.06 0.09 4.62 2.35 53 L C C 52.45 17.42 12.16 28.46 110.15 -120.75 -88.46 114.72 67.95 9.09 22.96 44.02 13.05 10.92 10.49 12.58 0.04 5.68 3.22 54 A C C 62.58 7.73 15.87 24.46 110.24 -146.37 -87.78 123.55 72.08 8.01 19.90 40.95 13.62 18.28 7.97 11.23 0.04 4.92 2.98 55 D C T 107.19 3.83 16.51 21.69 111.24 -76.57 -81.59 122.03 80.22 4.60 15.18 18.90 18.19 43.80 5.25 9.18 0.06 2.80 1.83 56 G C T 46.29 6.16 17.38 24.34 101.75 8.12 86.92 -0.77 91.09 3.93 4.98 25.78 25.47 40.40 0.93 3.85 0.00 2.45 1.11 57 V C C 32.34 18.73 11.66 29.77 117.01 120.23 -95.90 131.60 88.17 11.15 0.68 57.71 29.69 1.43 0.27 0.42 0.00 5.47 5.01 58 P C C 55.69 9.49 17.66 28.13 110.63 -110.74 -66.48 147.08 88.45 7.29 4.26 67.62 11.44 8.84 0.86 3.88 0.00 5.56 1.80 59 S C C 71.08 8.61 17.04 26.29 100.03 -116.29 -71.06 -5.43 82.57 8.35 9.08 42.01 21.81 19.20 0.94 8.73 0.01 6.12 1.21 60 R C C 113.94 9.19 19.69 28.98 100.79 72.13 -92.68 5.51 68.70 22.72 8.58 33.94 22.56 13.52 0.96 7.20 0.01 20.54 1.27 61 F E E 25.33 22.95 12.80 34.95 122.23 108.90 -109.65 136.24 25.50 73.10 1.40 20.90 4.45 1.26 0.44 0.89 0.00 70.76 1.29 62 S E E 55.79 6.27 24.02 31.48 134.68 175.15 -137.29 153.61 8.66 91.17 0.18 7.57 0.93 0.18 0.07 0.08 0.00 90.61 0.55 63 G E E 22.46 18.87 15.20 32.71 141.22 168.65 -155.30 165.26 6.78 93.15 0.07 5.73 0.75 0.12 0.02 0.03 0.00 93.05 0.28 64 S E E 64.42 4.85 22.11 28.53 136.27 -170.75 -148.14 156.35 10.28 89.64 0.08 8.77 1.17 0.19 0.02 0.04 0.00 89.38 0.43 65 G E E 30.36 10.95 15.40 27.15 139.65 136.06 141.16 163.71 27.90 71.96 0.14 20.60 7.00 1.00 0.02 0.14 0.00 70.45 0.80 66 S C C 76.51 3.26 20.90 24.65 114.65 -125.47 -121.32 105.15 56.92 42.65 0.44 40.86 13.33 3.54 0.08 0.47 0.00 39.27 2.46 67 G C S 33.63 9.83 18.87 28.92 108.75 -48.53 65.60 -125.22 98.48 1.00 0.53 2.02 54.37 42.27 0.02 0.48 0.00 0.72 0.12 68 T C S 56.00 14.34 16.35 30.65 97.55 -6.90 -97.50 -1.72 98.44 1.13 0.43 2.03 55.26 41.33 0.01 0.38 0.00 0.88 0.10 69 K E E 91.64 7.76 22.35 31.31 119.82 84.08 -106.90 131.74 32.57 67.31 0.12 22.93 9.59 0.99 0.02 0.14 0.00 64.67 1.68 70 F E E 8.54 24.51 15.60 40.46 128.58 -175.14 -127.43 143.00 9.91 90.08 0.00 9.48 0.26 0.01 0.00 0.00 0.00 89.97 0.28 71 S E E 27.17 10.40 26.95 38.41 125.38 -165.42 -121.76 139.36 2.42 97.58 0.00 2.10 0.09 0.00 0.00 0.00 0.00 97.77 0.04 72 F E E 4.84 25.89 18.45 45.06 122.59 -165.05 -119.04 131.85 0.32 99.68 0.00 0.34 0.00 0.00 0.00 0.00 0.00 99.66 0.00 73 K E E 78.89 9.29 27.15 36.97 121.14 -164.69 -117.34 130.29 0.14 99.86 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.83 0.01 74 I E E 8.14 24.15 15.72 40.35 116.84 -165.32 -112.62 125.94 2.43 97.57 0.00 2.48 0.03 0.00 0.00 0.00 0.00 97.16 0.33 75 S C C 49.18 6.87 22.81 29.89 120.76 -170.88 -102.30 162.06 92.23 7.68 0.10 44.22 41.77 4.84 0.00 0.16 0.00 8.75 0.25 76 S C S 65.75 4.70 23.70 28.42 102.07 10.54 60.78 69.24 98.87 1.08 0.05 13.05 80.37 5.50 0.00 0.07 0.00 0.89 0.12 77 L C C 21.03 23.54 10.81 33.69 112.73 -146.63 -77.34 129.89 99.22 0.76 0.02 97.86 1.44 0.03 0.01 0.01 0.00 0.28 0.37 78 Q C C 82.90 4.12 23.95 27.83 131.12 158.03 -125.66 159.35 99.73 0.24 0.03 98.92 0.80 0.01 0.01 0.00 0.00 0.04 0.22 79 A H G 53.93 13.51 14.61 28.17 91.02 -105.37 -59.00 -33.38 3.64 0.02 96.34 0.19 0.24 2.41 0.46 96.69 0.00 0.01 0.00 80 E H G 129.18 3.35 20.73 24.71 90.12 62.24 -70.88 -16.86 2.84 0.02 97.14 0.10 0.15 1.99 0.37 97.38 0.00 0.01 0.00 81 D H G 21.12 18.93 16.06 35.19 94.10 61.84 -87.18 -3.08 3.59 0.03 96.38 0.42 0.34 1.78 0.53 96.90 0.00 0.03 0.00 82 F C C 48.54 17.67 19.07 36.52 115.42 101.16 -82.13 132.31 85.87 12.33 1.80 77.44 8.41 0.53 0.36 1.41 0.00 10.77 1.07 83 V E E 23.87 17.35 21.65 38.42 133.30 166.67 -133.36 161.16 40.20 59.60 0.20 35.29 4.09 0.31 0.06 0.14 0.00 58.64 1.47 84 S E E 30.84 13.18 25.13 38.51 121.07 -111.98 -104.46 138.79 5.07 94.86 0.07 4.44 0.60 0.07 0.02 0.04 0.00 94.55 0.27 85 Y E E 10.22 24.58 19.36 43.86 126.06 -166.29 -119.57 140.16 1.81 98.15 0.05 1.62 0.16 0.03 0.01 0.02 0.00 98.06 0.11 86 Y E E 40.53 15.28 26.99 42.23 131.11 -170.70 -128.84 146.59 3.65 96.23 0.12 3.02 0.34 0.08 0.03 0.05 0.00 96.35 0.13 87 C E E 4.52 24.59 20.55 45.24 123.19 -158.33 -115.12 136.63 11.40 87.86 0.74 9.36 1.36 0.45 0.28 0.32 0.00 87.89 0.34 88 Q E E 41.17 13.73 25.00 38.73 125.88 -169.25 -121.37 138.52 12.89 85.89 1.22 10.71 1.66 0.64 0.46 0.52 0.00 85.45 0.56 89 Q E E 37.68 17.90 18.12 35.60 119.67 -149.72 -106.46 132.72 19.16 79.40 1.44 15.41 3.11 1.16 0.50 0.71 0.00 78.35 0.76 90 F E E 81.90 10.20 18.34 29.31 117.70 -163.49 -107.82 129.72 32.29 66.28 1.43 24.14 7.12 2.40 0.45 0.88 0.00 63.62 1.40 91 Y C C 106.46 9.68 13.84 24.45 116.10 -162.83 -109.17 129.15 60.61 38.26 1.13 37.52 17.46 6.64 0.22 0.90 0.00 35.74 1.51 92 S C S 75.49 4.09 14.73 19.92 110.21 -91.78 -98.03 93.61 90.77 8.57 0.66 25.14 48.97 16.32 0.07 0.68 0.00 8.07 0.74 93 T C S 81.29 4.74 14.17 20.38 121.53 13.68 -108.03 137.57 92.02 7.37 0.60 24.40 56.42 11.04 0.07 0.63 0.00 6.58 0.87 94 P C C 77.55 6.56 15.69 23.39 113.32 -68.41 -71.72 147.48 81.42 17.94 0.64 51.81 21.64 6.76 0.09 0.64 0.00 18.25 0.80 95 F E E 65.63 15.80 13.44 29.13 119.60 -137.57 -100.22 135.53 45.55 53.96 0.49 38.43 4.80 1.39 0.11 0.36 0.00 53.80 1.11 96 T E E 65.14 9.13 20.43 30.21 123.10 -159.74 -118.26 136.05 17.82 81.86 0.32 15.48 1.81 0.44 0.14 0.18 0.00 79.20 2.74 97 F E E 56.27 18.42 15.28 32.82 117.83 -154.34 -103.87 132.05 25.47 73.98 0.54 20.51 4.22 1.40 0.20 0.38 0.00 70.52 2.76 98 G C E 31.21 10.92 18.96 29.74 117.02 -133.88 -12.70 -165.80 64.13 34.86 1.00 29.81 21.53 13.69 0.12 0.92 0.00 32.80 1.13 99 G C S 45.10 7.21 20.17 27.42 102.84 -21.18 -47.01 4.08 73.59 25.26 1.15 23.39 32.13 18.20 0.10 1.11 0.00 24.01 1.06 100 G C C 22.04 14.84 16.63 30.85 121.44 -122.81 102.66 174.54 67.57 31.78 0.64 38.28 23.00 5.91 0.06 0.67 0.00 31.29 0.78 101 T E E 38.64 15.89 18.13 33.72 124.62 -104.87 -115.60 141.27 29.68 70.18 0.14 26.00 2.48 0.32 0.04 0.10 0.00 70.56 0.52 102 K E E 103.44 8.87 22.36 31.76 119.35 -144.19 -103.21 133.03 5.67 94.23 0.10 5.08 0.47 0.08 0.04 0.04 0.00 93.99 0.31 103 L E E 17.73 22.23 14.43 36.44 120.86 -164.06 -113.67 131.24 4.31 95.60 0.09 4.05 0.19 0.04 0.04 0.03 0.00 95.47 0.17 104 E E E 95.83 5.66 23.02 29.20 119.74 -160.76 -109.19 130.87 6.44 93.45 0.11 6.05 0.34 0.08 0.05 0.04 0.00 93.05 0.39 105 I E E 34.46 19.48 11.21 30.02 116.46 -154.70 -101.85 126.57 22.82 77.02 0.15 22.59 0.39 0.11 0.08 0.06 0.00 75.65 1.12 106 K C C 127.47 4.16 18.96 24.05 115.22 -157.88 -97.03 130.62 99.12 0.87 0.01 99.18 0.05 0.02 0.00 0.00 0.00 0.73 0.01