# 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 73.43 4.78 13.69 20.02 118.79 -163.95 -102.41 139.28 99.81 0.17 0.02 99.74 0.10 0.04 0.01 0.00 0.00 0.08 0.02 1 T C C 88.01 5.62 10.49 17.73 112.66 -151.36 -101.45 125.33 89.71 5.28 5.01 83.43 1.95 4.94 2.19 2.03 0.00 3.37 2.10 2 S C C 77.83 4.07 10.32 16.12 110.40 -157.61 -92.39 117.91 83.98 8.05 7.97 50.58 17.35 16.53 2.95 4.76 0.01 4.82 3.00 3 N C C 107.15 4.43 11.90 17.79 106.65 94.56 -94.38 66.63 84.86 5.71 9.43 36.95 24.53 24.54 3.27 5.46 0.01 3.16 2.07 4 G C C 40.79 7.07 11.82 20.09 111.75 -109.64 79.32 8.40 84.51 4.94 10.54 41.60 24.08 19.74 4.35 5.65 0.01 2.70 1.87 5 R C C 132.48 5.97 12.37 19.73 114.06 -127.95 -91.68 132.28 73.59 9.18 17.23 48.95 15.02 9.43 10.79 6.56 0.03 4.89 4.34 6 D C C 87.65 5.75 12.39 19.46 108.13 -131.00 -85.69 109.81 72.50 5.36 22.15 50.46 12.03 9.94 13.40 8.88 0.01 3.13 2.15 7 S C C 67.91 6.63 12.00 19.83 100.55 -155.02 -76.51 -16.34 58.35 2.69 38.96 27.05 13.37 18.96 18.25 19.75 0.05 1.44 1.13 8 E C T 129.87 3.77 14.41 19.23 98.70 66.01 -79.63 -13.14 55.84 2.76 41.40 18.79 13.98 24.36 18.41 21.61 0.14 1.49 1.22 9 S C C 55.93 8.60 13.41 23.04 106.69 74.29 -84.56 47.02 59.38 4.24 36.39 28.48 14.97 17.40 15.06 20.09 0.07 2.45 1.49 10 K C C 99.25 10.20 15.99 26.59 112.05 94.21 -94.44 118.14 69.89 12.77 17.34 44.76 15.51 10.10 7.69 9.48 0.03 9.84 2.59 11 R C C 109.37 11.10 19.15 30.24 118.55 -140.40 -95.07 133.41 58.58 36.70 4.72 45.62 8.59 3.58 2.47 2.51 0.01 30.80 6.42 12 L E E 41.67 18.45 18.08 35.73 119.94 -149.36 -101.58 139.02 49.14 49.91 0.94 40.25 6.51 1.53 0.39 0.58 0.00 48.40 2.34 13 G E E 15.60 14.48 22.75 36.75 141.59 160.30 -136.48 176.67 25.70 73.64 0.66 20.32 4.86 1.22 0.25 0.44 0.00 71.26 1.66 14 A E E 27.40 19.40 18.22 36.72 122.53 -83.23 -103.70 142.70 18.76 79.19 2.06 15.84 2.37 0.81 1.44 0.70 0.02 76.83 2.00 15 K E E 108.10 8.89 21.94 31.21 108.66 -156.66 -97.14 84.55 23.00 72.64 4.36 17.80 4.29 1.75 3.24 1.14 0.01 68.98 2.78 16 S C C 32.24 13.60 16.13 30.08 128.85 11.69 -121.31 150.54 61.46 35.08 3.46 54.70 4.30 1.75 2.22 1.32 0.00 33.17 2.53 17 A C C 50.96 9.24 16.14 26.10 119.54 -142.22 -93.07 153.32 79.08 10.68 10.23 56.01 10.80 11.95 2.52 7.94 0.00 8.62 2.15 18 D C T 107.89 4.37 15.49 20.94 102.75 -38.97 -43.87 91.35 88.71 2.34 8.95 1.87 9.69 77.01 1.15 8.13 0.00 1.64 0.52 19 G C T 53.86 3.48 15.76 20.01 95.91 -19.52 83.08 0.13 91.90 1.41 6.70 5.19 13.92 71.66 0.56 7.28 0.00 1.14 0.25 20 Q C C 83.12 7.59 14.96 24.27 121.62 127.47 -89.32 148.27 87.96 11.92 0.12 74.83 11.96 0.52 0.01 0.14 0.00 11.91 0.62 21 T E E 78.68 7.19 20.44 28.49 117.43 -124.64 -89.04 137.46 13.99 86.00 0.01 13.79 0.41 0.02 0.00 0.01 0.00 82.38 3.39 22 V E E 10.44 23.61 12.16 35.72 121.78 -161.82 -113.68 137.36 3.04 96.96 0.00 3.22 0.04 0.00 0.00 0.00 0.00 92.47 4.26 23 T C C 76.11 4.03 24.37 28.50 124.76 -150.95 -102.95 152.10 60.00 39.98 0.01 60.11 0.58 0.04 0.00 0.01 0.00 38.19 1.06 24 G C T 35.10 12.87 16.16 28.96 109.31 -82.64 -59.33 135.76 98.66 1.12 0.22 0.19 2.78 96.18 0.01 0.14 0.00 0.63 0.08 25 G C T 39.81 6.53 21.10 28.37 96.84 23.33 88.49 -5.05 99.36 0.48 0.16 0.38 3.56 95.52 0.00 0.14 0.00 0.37 0.02 26 S C C 32.55 12.13 19.86 32.81 117.92 127.35 -76.45 146.51 87.88 12.04 0.08 83.60 3.80 0.16 0.01 0.07 0.00 11.77 0.59 27 I E E 46.24 16.45 21.55 37.60 111.25 -119.31 -81.94 124.97 5.13 94.85 0.02 5.05 0.17 0.02 0.01 0.01 0.00 93.37 1.37 28 L E E 9.83 23.10 21.67 44.44 100.80 177.07 -92.80 -32.92 4.48 95.51 0.01 2.61 1.81 0.09 0.00 0.01 0.00 95.40 0.06 29 Y E E 22.04 19.91 23.21 42.58 140.11 2.79 -152.07 149.02 3.32 96.62 0.06 2.55 0.64 0.17 0.02 0.05 0.00 96.36 0.22 30 R E E 89.28 13.72 22.10 35.13 121.72 -152.51 -112.41 131.38 13.92 85.90 0.17 11.86 1.69 0.32 0.05 0.11 0.00 85.57 0.40 31 Q C E 49.96 16.02 16.03 31.87 116.00 -145.09 -97.23 129.40 49.84 49.27 0.90 36.92 10.02 2.88 0.17 0.81 0.00 47.88 1.31 32 R C C 135.14 6.78 16.77 24.75 112.51 -153.64 -90.94 130.95 75.41 22.85 1.74 34.38 23.24 18.83 0.21 1.69 0.00 19.95 1.70 33 G C S 47.90 4.02 17.23 21.88 104.81 13.75 90.71 -12.10 89.78 8.92 1.30 29.77 37.86 22.07 0.12 1.44 0.00 7.93 0.81 34 T C C 60.56 12.59 12.69 25.48 117.26 110.79 -96.70 137.48 84.63 13.62 1.76 61.96 18.10 4.20 0.22 1.80 0.00 12.33 1.39 35 K C C 134.09 4.35 20.34 25.43 112.63 -142.44 -96.08 118.66 70.70 28.02 1.28 53.93 13.49 2.62 0.23 1.17 0.00 25.76 2.80 36 I E C 31.32 20.63 11.94 31.84 119.80 -156.91 -106.98 132.30 49.05 50.43 0.52 40.52 6.67 0.83 0.23 0.33 0.00 35.85 15.56 37 Y C C 119.62 6.03 21.36 27.96 115.91 -147.58 -102.05 127.73 81.83 18.09 0.08 77.31 4.32 0.34 0.02 0.06 0.00 16.20 1.76 38 P C T 67.99 12.73 14.58 27.33 111.72 -110.45 -65.78 140.84 87.56 11.05 1.39 27.31 20.97 39.80 0.18 1.36 0.00 9.03 1.34 39 G C T 36.57 6.99 17.80 25.74 122.26 47.06 103.63 -159.75 91.65 6.51 1.84 21.59 29.82 40.60 0.17 1.97 0.00 4.46 1.39 40 V C T 99.07 4.57 20.03 24.82 102.19 -24.07 -81.61 -15.50 91.15 7.09 1.75 5.88 36.20 49.88 0.10 1.70 0.00 5.04 1.19 41 N C T 54.03 14.26 17.79 31.70 98.58 37.78 -95.84 8.24 86.03 13.33 0.64 11.71 25.30 48.95 0.04 0.74 0.00 12.77 0.49 42 V E E 19.31 21.81 14.32 35.70 124.79 92.96 -108.66 139.62 14.32 85.66 0.03 12.27 1.37 0.08 0.01 0.02 0.00 85.85 0.41 43 G E E 22.32 7.92 23.84 32.54 141.64 165.06 -151.86 175.15 0.73 99.27 0.00 0.64 0.04 0.00 0.00 0.00 0.00 99.28 0.04 44 I E E 89.17 11.27 16.88 28.64 120.69 -101.28 -107.16 135.23 1.31 98.68 0.00 1.30 0.04 0.00 0.00 0.00 0.00 98.36 0.29 45 G C C 21.64 11.84 11.90 24.58 125.29 -145.13 -87.76 176.15 81.53 18.41 0.06 79.74 1.01 0.16 0.01 0.04 0.00 18.55 0.49 46 G C T 63.71 0.93 15.49 15.52 93.70 -87.79 -62.74 -28.84 94.13 2.36 3.50 1.74 14.36 77.41 0.06 4.33 0.00 1.73 0.37 47 D C T 102.45 2.97 15.72 19.26 95.64 48.17 -90.65 9.18 96.65 0.21 3.15 0.77 10.87 84.12 0.04 4.03 0.00 0.12 0.05 48 D C S 62.51 11.85 15.54 27.87 94.20 -103.80 71.41 20.33 95.01 1.61 3.38 10.45 54.86 28.62 0.10 4.47 0.00 1.23 0.27 49 T C C 23.66 13.03 19.95 34.27 122.32 136.46 -92.16 144.97 50.94 49.04 0.02 50.01 0.99 0.07 0.00 0.01 0.00 48.18 0.73 50 L E E 4.59 24.58 19.44 44.85 116.17 -128.27 -91.19 132.09 0.22 99.78 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.76 0.02 51 F E E 44.50 12.80 26.82 40.07 129.18 -171.78 -125.47 144.78 0.08 99.92 0.00 0.07 0.00 0.00 0.00 0.00 0.00 99.92 0.01 52 A E E 5.41 23.83 15.05 39.54 112.38 -114.24 -76.81 133.74 6.56 93.43 0.00 6.72 0.09 0.00 0.00 0.00 0.00 92.90 0.29 53 K C S 105.53 6.14 23.43 30.34 95.68 -160.12 -87.90 -17.19 93.05 6.88 0.07 19.24 70.23 2.98 0.00 0.08 0.00 7.26 0.20 54 V C S 53.48 7.62 21.23 29.89 135.42 33.74 -134.41 157.08 92.15 7.76 0.09 3.23 85.43 3.56 0.00 0.08 0.00 7.39 0.31 55 D C C 85.14 6.93 21.61 29.13 113.42 -96.70 -67.90 139.74 92.72 7.19 0.08 58.69 30.53 2.79 0.01 0.12 0.00 7.63 0.24 56 G E E 10.63 10.51 20.89 33.60 143.63 94.31 165.92 -171.90 15.75 84.24 0.01 13.77 1.95 0.09 0.00 0.01 0.00 83.68 0.51 57 V E E 41.60 10.14 24.45 35.94 123.15 -65.26 -115.79 137.61 0.54 99.46 0.00 0.50 0.02 0.00 0.00 0.00 0.00 99.44 0.04 58 V E E 4.70 25.46 16.26 42.60 117.51 -148.92 -101.79 129.79 0.31 99.69 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.70 0.00 59 R E E 82.52 8.96 26.16 35.43 122.70 -168.93 -116.69 135.21 0.45 99.55 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.59 0.00 60 F E E 26.08 21.91 15.00 36.46 124.66 -161.66 -115.95 138.30 0.91 99.09 0.00 0.81 0.02 0.00 0.00 0.00 0.00 99.14 0.03 61 E E E 84.61 6.12 20.94 27.76 126.70 -174.21 -125.49 142.65 1.50 98.49 0.00 1.29 0.07 0.01 0.00 0.00 0.00 98.58 0.04 62 R E E 117.93 9.63 12.09 22.81 114.07 -127.18 -88.69 127.10 9.46 90.49 0.05 8.27 0.75 0.11 0.01 0.04 0.00 90.57 0.26 63 K E E 116.43 4.75 12.22 18.51 107.67 -176.21 -106.17 37.17 45.49 54.06 0.46 31.49 9.33 3.74 0.05 0.48 0.00 54.42 0.49 64 G C T 45.53 1.93 12.88 15.19 128.49 -44.65 134.65 -174.23 68.02 29.80 2.17 11.69 28.00 30.18 0.12 2.25 0.00 26.49 1.25 65 R C T 194.67 0.85 11.01 11.72 100.97 -36.01 -65.13 -13.93 97.25 0.52 2.23 4.16 25.65 67.03 0.09 2.58 0.00 0.34 0.16 66 D C T 123.75 1.60 11.27 13.65 98.76 -0.10 -91.51 14.97 97.03 1.14 1.83 6.22 30.09 60.48 0.07 2.11 0.00 0.81 0.22 67 K E E 100.09 5.89 12.44 20.17 121.72 94.57 -115.32 140.31 45.96 53.75 0.29 33.74 9.60 2.32 0.04 0.30 0.00 53.00 1.00 68 K E E 73.64 12.41 12.88 26.11 124.83 -168.03 -118.76 141.71 21.08 78.90 0.02 19.57 0.71 0.07 0.00 0.01 0.00 79.46 0.18 69 Q E E 63.16 9.72 20.41 31.07 125.50 -160.67 -120.70 142.11 2.41 97.59 0.00 2.12 0.12 0.01 0.00 0.00 0.00 97.71 0.05 70 V E E 20.52 20.29 16.60 36.94 123.73 -161.25 -118.09 134.24 0.56 99.44 0.00 0.52 0.02 0.00 0.00 0.00 0.00 99.46 0.01 71 S E E 27.99 10.04 24.29 35.22 129.66 -170.86 -124.92 148.64 0.58 99.42 0.00 0.51 0.02 0.00 0.00 0.00 0.00 99.46 0.01 72 V E E 24.05 20.51 16.25 36.71 120.69 -151.85 -114.11 130.33 2.04 97.96 0.00 1.82 0.08 0.00 0.00 0.00 0.00 98.03 0.06 73 Y E E 82.41 8.88 19.51 29.45 124.18 -172.57 -121.99 136.91 14.79 85.21 0.00 13.68 0.52 0.02 0.00 0.00 0.00 85.58 0.20 74 P E E 76.28 7.12 16.66 24.67 113.29 -106.42 -66.23 145.58 34.32 65.64 0.03 32.26 0.91 0.14 0.00 0.02 0.00 66.10 0.56 75 V C C 66.34 12.81 13.06 25.92 111.28 -122.46 -85.29 127.76 99.66 0.33 0.01 99.65 0.09 0.03 0.00 0.00 0.00 0.22 0.01