# 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 A C C 70.96 4.45 11.00 17.11 114.41 -133.19 -83.74 136.88 99.96 0.03 0.01 99.90 0.05 0.02 0.01 0.00 0.00 0.01 0.00 1 R C C 164.58 2.84 8.94 13.62 111.74 -136.72 -88.79 129.56 83.99 1.66 14.35 76.35 1.58 7.57 2.81 10.07 0.00 1.00 0.62 2 N C C 119.98 2.44 9.07 13.06 108.25 -138.14 -89.19 87.44 78.14 3.09 18.76 41.73 15.93 20.02 1.94 17.57 0.00 1.85 0.97 3 E C C 131.53 3.15 10.01 14.79 109.88 103.13 -92.42 115.77 74.91 5.67 19.43 43.46 16.90 14.36 2.22 17.91 0.00 3.80 1.35 4 I C C 104.31 5.45 10.38 17.63 115.04 -148.54 -94.44 129.42 79.69 11.26 9.06 56.61 15.81 6.88 2.15 7.27 0.01 7.54 3.73 5 R C C 121.39 7.35 13.06 21.89 118.93 -159.37 -104.89 131.29 87.64 12.10 0.26 63.55 23.77 0.72 0.07 0.20 0.00 10.28 1.40 6 P C C 58.61 9.17 14.85 25.32 113.65 -112.54 -69.78 145.45 82.46 17.39 0.15 72.96 7.23 0.54 0.03 0.12 0.00 18.59 0.54 7 I E E 74.48 10.39 16.51 27.74 118.89 -146.54 -105.59 132.09 18.60 81.36 0.05 16.42 1.54 0.09 0.01 0.03 0.00 81.39 0.51 8 V E E 29.08 15.78 15.55 32.06 122.74 -164.25 -117.05 134.46 2.09 97.90 0.00 1.91 0.09 0.01 0.00 0.00 0.00 97.94 0.05 9 K E E 95.53 7.93 22.10 30.58 117.34 -145.98 -102.02 129.00 0.83 99.17 0.00 0.73 0.02 0.00 0.00 0.00 0.00 99.23 0.01 10 L E E 15.68 21.50 15.25 36.58 123.17 -167.57 -116.12 137.00 0.82 99.18 0.00 0.74 0.02 0.00 0.00 0.00 0.00 99.22 0.02 11 R E E 110.52 6.51 22.35 29.53 123.27 -162.35 -115.65 137.39 2.00 97.99 0.01 1.88 0.09 0.01 0.00 0.00 0.00 97.77 0.24 12 S E E 16.45 17.69 11.11 28.97 114.54 -115.78 -73.70 141.26 38.32 61.56 0.11 36.64 1.09 0.14 0.02 0.07 0.00 61.10 0.94 13 T C T 93.85 3.86 16.92 21.92 94.74 -143.28 -75.39 -17.48 96.56 1.99 1.45 5.02 36.86 54.70 0.07 1.44 0.00 1.63 0.27 14 A C T 68.12 4.86 13.52 19.69 102.32 65.87 -82.61 16.75 97.12 1.03 1.85 2.16 32.42 62.78 0.07 1.70 0.00 0.59 0.28 15 G C S 54.12 2.58 14.06 17.63 105.50 -71.48 90.85 2.62 97.13 1.29 1.58 12.37 53.06 31.53 0.09 1.78 0.00 0.82 0.37 16 T C C 87.29 4.01 13.91 19.05 101.94 109.09 -91.29 4.00 96.59 2.80 0.61 37.78 37.36 21.53 0.06 0.73 0.00 2.06 0.48 17 G C S 43.99 5.09 15.00 21.28 100.07 -110.84 83.88 3.02 81.23 18.53 0.24 36.94 39.64 4.95 0.03 0.28 0.00 17.31 0.85 18 Y E E 92.62 9.44 14.61 25.39 120.52 119.37 -99.77 139.59 31.44 68.53 0.02 29.11 1.53 0.08 0.00 0.01 0.00 68.68 0.60 19 T E E 58.44 11.89 16.04 28.55 129.39 -169.52 -126.66 147.01 1.75 98.25 0.00 1.51 0.08 0.00 0.00 0.00 0.00 98.37 0.04 20 Y E E 57.50 13.71 17.03 31.67 128.13 -167.98 -128.54 142.59 0.19 99.81 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.83 0.00 21 V E E 62.01 9.91 19.32 30.15 121.86 -152.75 -114.34 133.39 0.34 99.66 0.00 0.30 0.00 0.00 0.00 0.00 0.00 99.69 0.00 22 T E E 28.12 14.82 15.80 31.58 129.09 -174.64 -127.94 148.34 1.13 98.87 0.00 1.05 0.02 0.00 0.00 0.00 0.00 98.90 0.02 23 R E E 117.42 7.66 19.64 28.32 123.22 -152.06 -117.11 135.37 5.22 94.77 0.02 4.83 0.28 0.02 0.00 0.01 0.00 94.57 0.27 24 K E E 66.97 12.62 14.04 27.43 122.53 -156.98 -109.78 141.33 42.10 57.74 0.16 39.95 1.64 0.17 0.07 0.09 0.00 56.23 1.86 25 N C C 52.90 7.54 13.64 23.25 112.85 -118.45 -76.84 138.62 82.91 16.73 0.36 79.82 2.56 0.59 0.10 0.21 0.00 14.66 2.06 26 R C T 147.76 5.24 11.56 18.41 96.51 -131.46 -70.79 -22.09 93.25 3.69 3.06 9.02 35.70 48.87 0.33 2.63 0.00 2.26 1.19 27 R C T 177.31 1.26 12.23 13.60 97.23 56.29 -74.40 -26.11 96.94 0.78 2.28 2.96 31.34 62.64 0.17 2.11 0.00 0.45 0.33 28 N C S 121.54 2.15 12.01 14.87 101.11 20.49 -90.08 3.00 96.50 1.83 1.66 13.78 44.95 37.59 0.14 1.81 0.00 1.15 0.58 29 D C C 67.15 6.07 10.53 18.53 109.96 54.21 -122.45 87.97 93.70 6.15 0.15 77.77 14.88 1.27 0.03 0.15 0.00 4.07 1.83 30 P C T 77.49 7.23 11.25 20.35 95.77 -159.73 -66.78 -18.72 87.05 9.66 3.29 12.09 12.89 61.58 0.12 4.48 0.00 8.03 0.82 31 D C T 104.84 3.38 16.00 20.15 95.18 61.33 -85.17 -4.72 87.26 9.82 2.91 10.88 16.12 59.14 0.07 4.07 0.00 9.30 0.43 32 R C C 87.23 9.39 16.07 26.62 121.45 74.03 -109.76 138.17 68.21 28.26 3.53 50.12 13.26 3.95 0.22 3.84 0.00 27.69 0.92 33 I E E 24.72 18.18 14.63 33.08 119.15 -155.87 -103.85 133.85 14.78 85.19 0.03 14.07 0.53 0.04 0.01 0.02 0.00 84.37 0.96 34 V E E 42.85 10.28 22.01 33.32 122.67 -160.59 -116.10 134.61 2.51 97.49 0.00 2.45 0.06 0.00 0.00 0.00 0.00 97.45 0.03 35 L E E 21.09 18.32 16.55 35.28 121.46 -159.70 -112.24 133.29 1.19 98.81 0.00 1.04 0.06 0.00 0.00 0.00 0.00 98.89 0.01 36 R E E 94.93 9.94 20.39 30.84 123.00 -165.47 -116.51 135.74 0.44 99.56 0.00 0.37 0.02 0.00 0.00 0.00 0.00 99.61 0.00 37 K E E 58.23 12.67 17.35 30.85 131.52 -172.67 -133.73 147.37 0.46 99.54 0.00 0.36 0.03 0.00 0.00 0.00 0.00 99.61 0.00 38 Y E E 87.61 8.85 17.11 27.46 117.49 -140.66 -104.95 132.76 1.10 98.90 0.00 0.97 0.06 0.00 0.00 0.00 0.00 98.88 0.09 39 D E E 24.13 11.72 11.46 25.57 109.60 -145.65 -100.95 111.42 41.82 58.15 0.02 40.99 0.54 0.05 0.00 0.01 0.00 58.04 0.36 40 P C T 86.94 3.85 14.00 19.67 92.89 -161.57 -66.40 -25.34 98.14 0.10 1.76 0.26 2.98 94.85 0.03 1.79 0.00 0.06 0.03 41 V C T 110.69 1.67 13.15 15.21 95.68 49.97 -74.19 -39.54 98.07 0.14 1.80 0.27 3.10 94.74 0.04 1.73 0.00 0.07 0.06 42 L C T 87.74 3.83 11.18 16.59 98.37 30.28 -97.41 -11.38 98.45 0.19 1.36 1.50 3.56 93.29 0.06 1.43 0.00 0.12 0.05 43 R C T 177.44 2.11 12.25 16.08 93.96 -130.43 57.40 35.37 99.00 0.63 0.37 20.36 4.11 74.59 0.08 0.22 0.00 0.58 0.06 44 R E E 119.75 3.15 14.87 19.59 131.44 116.61 -130.07 156.57 26.81 73.15 0.04 21.25 3.44 0.55 0.00 0.03 0.00 74.40 0.32 45 H E E 104.54 8.41 13.32 23.09 116.09 -109.88 -82.52 135.86 0.83 99.17 0.00 0.73 0.02 0.00 0.00 0.00 0.00 99.23 0.02 46 V E E 36.30 12.50 13.94 28.04 126.67 -171.06 -126.27 141.44 0.12 99.88 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.89 0.00 47 E E E 100.27 6.70 18.48 26.27 116.53 -130.97 -91.15 132.60 0.19 99.81 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.83 0.00 48 F E E 38.09 16.61 13.19 30.15 129.12 -173.63 -125.24 148.73 0.83 99.17 0.00 0.75 0.02 0.00 0.00 0.00 0.00 99.23 0.00 49 R E E 120.62 6.20 18.20 25.86 125.50 -158.02 -122.66 141.35 1.58 98.41 0.00 1.35 0.06 0.01 0.00 0.00 0.00 98.56 0.02 50 E E E 69.34 13.31 11.41 25.08 121.57 -150.17 -107.20 137.46 5.62 94.33 0.04 5.12 0.27 0.06 0.01 0.02 0.00 94.37 0.15 51 E E E 116.65 4.21 13.23 19.27 121.21 -157.45 -110.49 138.86 32.65 67.21 0.15 32.21 0.48 0.14 0.04 0.09 0.00 66.21 0.83 52 R C C 159.32 4.07 12.53 18.51 113.09 -119.53 -84.91 130.29 99.07 0.93 0.00 99.08 0.07 0.01 0.00 0.00 0.00 0.83 0.01