# 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 P C C 56.95 13.76 14.44 28.08 114.98 -108.80 -67.86 147.78 99.96 0.03 0.01 99.86 0.09 0.03 0.00 0.00 0.00 0.02 0.00 1 K C C 124.56 5.55 17.43 24.32 117.12 -140.46 -96.83 138.15 78.94 19.99 1.07 74.24 3.01 1.91 0.38 0.60 0.00 15.84 4.01 2 Q C C 100.74 8.41 16.40 25.82 116.45 -118.57 -83.83 134.57 65.79 32.88 1.33 55.57 7.60 1.67 0.53 0.90 0.00 23.77 9.96 3 I C C 22.76 18.83 11.37 30.23 117.04 -154.02 -105.40 124.85 82.82 16.22 0.96 81.44 1.67 0.56 0.45 0.41 0.00 12.21 3.27 4 T C C 92.70 4.44 19.76 25.23 99.85 174.74 -104.70 -9.01 98.37 1.05 0.58 59.34 38.36 0.95 0.25 0.25 0.00 0.55 0.28 5 D C S 70.61 4.85 21.09 26.45 116.47 79.12 -106.97 125.14 95.14 3.16 1.70 36.45 58.54 0.45 1.58 0.16 0.00 0.56 2.26 6 I H H 34.06 20.75 12.89 33.11 92.37 -142.32 -60.93 -37.02 1.74 0.00 98.25 0.24 0.23 1.13 97.44 0.95 0.00 0.00 0.00 7 R H H 138.04 4.30 20.18 25.46 91.11 56.46 -62.28 -40.04 0.73 0.00 99.27 0.07 0.05 0.55 98.08 1.24 0.00 0.00 0.00 8 K H H 91.25 5.75 21.36 27.53 91.68 49.77 -65.70 -39.77 0.23 0.00 99.77 0.03 0.02 0.16 98.53 1.27 0.00 0.00 0.00 9 F H H 4.53 25.02 15.78 41.18 91.18 51.42 -63.09 -43.74 0.12 0.00 99.88 0.01 0.01 0.07 99.65 0.25 0.00 0.00 0.00 10 L H H 30.64 17.48 20.43 37.35 91.34 50.63 -63.28 -41.57 0.17 0.00 99.83 0.01 0.01 0.13 99.41 0.45 0.00 0.00 0.00 11 K H H 118.59 2.61 25.48 27.33 91.64 51.20 -64.06 -41.45 0.58 0.00 99.42 0.02 0.02 0.53 98.83 0.60 0.00 0.00 0.00 12 I H H 26.87 15.23 20.23 35.82 91.91 49.66 -65.86 -39.50 2.67 0.00 97.33 0.08 0.12 2.45 96.72 0.63 0.00 0.00 0.00 13 S H H 4.31 24.58 14.96 39.80 91.44 57.09 -71.83 -20.89 32.45 0.12 67.43 4.22 2.53 25.16 66.52 1.42 0.02 0.03 0.09 14 R C T 134.14 7.44 21.33 29.38 93.48 66.72 -82.30 -7.96 84.72 0.33 14.95 20.07 9.71 54.84 12.42 2.56 0.00 0.11 0.28 15 K C S 69.61 11.45 12.77 25.58 114.42 111.93 -72.70 136.87 98.79 0.69 0.52 27.72 69.93 0.98 0.34 0.12 0.00 0.15 0.78 16 P C T 114.48 1.87 16.59 19.19 91.13 -122.50 -62.02 -27.97 99.02 0.04 0.94 0.38 3.06 95.70 0.06 0.76 0.00 0.01 0.03 17 D C T 89.67 5.57 17.05 23.75 93.93 55.17 -86.24 -1.57 99.41 0.04 0.55 0.89 2.68 95.85 0.04 0.50 0.00 0.02 0.01 18 T C C 14.28 22.26 9.94 31.49 113.47 108.82 -78.36 129.42 79.37 19.90 0.73 75.91 3.34 0.41 0.13 0.62 0.00 18.51 1.10 19 T C C 77.95 5.00 23.05 28.58 100.85 176.66 -100.09 -21.68 77.39 22.29 0.32 58.81 17.32 0.55 0.07 0.24 0.00 22.56 0.45 20 A E E 31.09 9.87 24.75 35.51 142.07 6.50 -156.68 154.81 10.37 89.36 0.26 8.68 1.05 0.19 0.06 0.12 0.00 89.72 0.17 21 V E E 7.21 25.28 16.33 42.11 129.33 -165.81 -135.40 139.61 1.52 98.42 0.06 1.36 0.06 0.01 0.03 0.01 0.00 98.49 0.03 22 I E E 50.64 10.43 26.91 38.06 121.88 -161.81 -116.45 132.41 0.90 99.05 0.06 0.73 0.05 0.01 0.03 0.01 0.00 99.16 0.02 23 I E E 15.93 22.76 18.01 40.92 118.27 -154.89 -105.12 128.57 2.34 97.56 0.10 1.98 0.14 0.03 0.05 0.02 0.00 97.72 0.05 24 M E E 53.50 11.04 21.54 33.35 122.26 -163.29 -107.47 138.49 8.89 90.56 0.55 7.91 0.61 0.20 0.31 0.19 0.00 90.48 0.30 25 K E E 81.45 13.31 16.08 29.52 117.32 -145.42 -98.15 135.90 25.82 72.47 1.71 22.27 2.92 0.82 0.96 0.70 0.00 71.25 1.08 26 K C C 93.98 8.92 14.99 24.93 116.75 -152.41 -101.15 135.22 52.69 44.54 2.78 44.04 6.52 1.68 1.41 1.25 0.00 43.41 1.68 27 K C C 125.27 5.07 13.81 20.29 113.09 -129.84 -86.95 134.15 61.54 31.19 7.27 47.37 10.02 4.23 3.79 3.38 0.03 28.63 2.55 28 S C C 57.22 7.09 10.08 18.65 113.98 -131.64 -87.27 137.65 67.18 23.81 9.01 50.55 10.09 6.37 4.69 4.27 0.04 20.98 3.00 29 K C C 145.31 2.80 11.22 15.43 101.74 -151.53 -87.26 -0.43 70.54 17.92 11.53 40.75 18.85 12.18 5.95 5.38 0.15 13.41 3.32 30 T C C 87.48 3.71 9.49 14.85 112.39 75.21 -97.45 124.73 76.89 13.05 10.06 41.81 21.25 14.94 4.74 5.01 0.10 9.26 2.88 31 K C C 139.68 3.17 9.47 14.28 108.28 -131.89 -86.88 112.43 83.59 6.74 9.67 34.02 20.00 30.84 3.21 5.73 0.03 4.34 1.82 32 K C T 160.97 1.58 10.87 13.26 101.68 -44.68 -75.42 40.73 90.54 2.28 7.18 25.79 21.70 43.59 1.69 5.07 0.00 1.36 0.79 33 N C T 109.72 3.82 10.71 16.09 100.99 -25.78 -33.15 31.15 89.63 3.93 6.43 28.15 27.87 34.06 0.98 5.35 0.00 2.56 1.02 34 T C C 76.80 5.67 11.97 19.26 116.72 119.04 -101.30 137.18 78.45 16.68 4.87 42.24 23.21 13.97 0.96 3.93 0.01 13.41 2.27 35 V C C 66.15 9.39 13.87 24.52 116.89 -144.01 -99.68 130.26 66.34 29.88 3.78 48.10 12.12 5.80 0.98 2.92 0.01 27.44 2.63 36 I C C 55.32 11.66 16.87 29.58 117.77 -157.49 -104.17 128.90 56.69 42.01 1.30 44.30 9.50 2.05 0.44 0.87 0.00 40.86 1.98 37 T E E 24.14 16.40 17.41 34.19 118.04 -163.39 -109.08 131.93 33.65 66.11 0.24 29.18 3.04 0.46 0.06 0.16 0.00 66.48 0.61 38 K E E 59.46 12.65 22.34 35.16 129.48 -158.66 -129.55 142.16 9.39 90.58 0.03 8.01 1.02 0.09 0.00 0.02 0.00 90.68 0.16 39 L E E 10.02 22.19 18.47 40.80 127.68 -168.28 -126.54 141.85 1.10 98.90 0.00 0.99 0.05 0.00 0.00 0.00 0.00 98.94 0.02 40 K E E 59.03 11.25 25.25 36.98 118.35 -149.73 -109.72 131.60 0.24 99.75 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.00 41 L E E 6.35 23.70 17.61 41.93 121.59 -166.30 -115.16 132.01 0.22 99.78 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.80 0.00 42 R E E 84.53 8.93 23.10 32.62 118.02 -159.49 -110.02 128.43 2.08 97.91 0.00 1.86 0.12 0.01 0.00 0.00 0.00 97.87 0.14 43 T C C 19.63 16.21 13.29 29.98 129.98 173.92 -123.57 172.64 74.33 25.64 0.03 71.08 1.77 0.11 0.00 0.02 0.00 26.56 0.45 44 K C S 144.18 3.05 17.20 20.82 93.87 -87.51 -63.04 -34.54 99.60 0.31 0.10 1.54 82.81 15.32 0.00 0.08 0.00 0.20 0.05 45 K C S 139.08 3.16 16.61 20.41 103.53 15.99 -106.03 -17.29 99.51 0.39 0.09 1.31 82.28 15.99 0.00 0.08 0.00 0.28 0.05 46 Y E E 81.22 9.62 16.82 27.66 137.43 24.92 -144.58 153.20 35.28 64.70 0.03 29.83 3.74 0.16 0.00 0.02 0.00 65.81 0.43 47 L E E 51.18 14.40 17.76 32.56 120.51 -139.08 -109.65 131.77 2.00 98.00 0.00 1.86 0.06 0.00 0.00 0.00 0.00 98.01 0.07 48 Y E E 27.98 17.32 20.27 37.94 129.22 -171.78 -126.57 145.87 0.48 99.52 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.56 0.00 49 T E E 27.99 15.14 23.38 38.71 121.77 -151.62 -111.62 133.63 0.16 99.84 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.85 0.00 50 M E E 8.27 23.17 21.04 44.15 120.96 -161.39 -111.12 131.51 0.08 99.92 0.00 0.07 0.00 0.00 0.00 0.00 0.00 99.92 0.00 51 V E E 32.15 12.40 25.42 38.68 118.78 -157.26 -109.03 127.91 0.31 99.69 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.70 0.01 52 F E E 13.14 21.37 14.83 36.56 122.68 -166.82 -114.63 140.72 14.28 85.71 0.01 14.29 0.23 0.01 0.00 0.00 0.00 84.98 0.48 53 A C S 68.92 5.07 20.59 26.50 95.34 -156.11 -81.12 -22.72 98.65 1.32 0.03 9.00 89.31 0.54 0.00 0.01 0.00 1.07 0.06 54 D C C 70.84 5.09 18.42 24.44 113.61 65.57 -109.10 113.25 99.18 0.49 0.33 67.70 30.64 0.94 0.21 0.09 0.00 0.19 0.22 55 R H H 122.54 10.70 13.15 24.80 92.76 -155.62 -62.60 -35.35 2.68 0.00 97.31 0.36 0.37 1.75 95.62 1.89 0.00 0.00 0.00 56 K H H 144.01 1.13 20.23 19.42 91.53 54.28 -63.79 -41.28 1.57 0.00 98.43 0.11 0.12 1.26 96.03 2.48 0.00 0.00 0.00 57 K H H 76.07 7.83 18.31 27.23 92.02 47.90 -66.17 -39.24 1.01 0.00 98.99 0.11 0.07 0.73 96.32 2.77 0.00 0.00 0.00 58 A H H 4.06 22.81 11.94 35.02 91.15 52.11 -62.87 -42.79 0.91 0.00 99.09 0.16 0.07 0.55 98.11 1.10 0.00 0.00 0.00 59 E H H 95.84 4.90 21.61 26.81 91.39 51.32 -63.53 -40.78 1.12 0.00 98.87 0.14 0.05 0.78 97.03 1.99 0.00 0.00 0.00 60 R H H 130.24 2.24 22.86 23.72 91.65 50.48 -64.19 -42.08 1.09 0.00 98.91 0.09 0.05 0.79 96.12 2.95 0.00 0.00 0.00 61 I H H 12.95 20.00 16.09 36.24 91.74 49.18 -64.79 -42.45 0.88 0.00 99.12 0.10 0.05 0.59 96.19 3.06 0.00 0.00 0.00 62 E H H 59.88 17.27 16.71 33.08 91.01 53.67 -62.34 -39.29 2.08 0.01 97.91 0.21 0.12 1.61 93.22 4.84 0.00 0.00 0.00 63 N H H 123.04 1.36 20.92 21.15 90.65 54.59 -69.50 -23.34 28.50 0.01 71.49 0.30 0.48 29.32 64.99 4.87 0.01 0.01 0.01 64 S C T 60.42 6.82 17.92 25.68 93.50 55.31 -88.78 -7.13 58.36 0.04 41.60 0.90 1.67 56.21 37.18 3.99 0.01 0.01 0.04 65 L C S 21.83 22.59 9.07 30.39 118.82 103.10 -78.24 144.84 98.66 0.72 0.62 17.43 80.68 0.50 0.46 0.08 0.00 0.11 0.74 66 L C C 59.57 8.58 16.05 26.20 114.38 -104.56 -66.52 147.67 99.84 0.10 0.06 98.52 1.10 0.24 0.01 0.02 0.00 0.04 0.06 67 P C T 103.99 3.60 14.97 20.10 95.78 -104.44 -60.35 -23.71 99.18 0.11 0.71 1.04 4.35 93.82 0.06 0.63 0.00 0.06 0.05 68 S C T 84.34 2.74 17.11 20.44 94.42 45.18 -81.39 0.05 98.89 0.19 0.92 1.14 3.91 93.83 0.05 0.90 0.00 0.12 0.04 69 L C C 29.34 20.04 8.74 27.56 118.32 114.44 -83.97 139.48 85.54 13.51 0.95 62.22 21.33 1.88 0.08 1.07 0.00 12.61 0.82 70 K E E 132.57 2.79 21.90 24.71 115.06 -137.66 -96.35 129.67 37.79 61.78 0.43 35.52 1.47 0.55 0.06 0.35 0.00 61.30 0.74 71 R E E 82.58 18.71 11.96 29.53 121.87 -158.29 -108.33 135.26 15.09 84.87 0.04 14.55 0.60 0.06 0.01 0.03 0.00 84.33 0.42 72 I E E 75.47 6.72 18.69 26.73 121.89 -168.19 -118.80 133.59 6.27 93.70 0.02 5.85 0.28 0.03 0.01 0.02 0.00 93.54 0.28 73 Y E E 126.35 9.26 14.64 25.15 117.01 -142.45 -98.29 128.65 12.33 87.66 0.01 11.96 0.30 0.02 0.00 0.01 0.00 86.81 0.90 74 Y C C 84.37 10.70 11.35 23.41 119.42 -164.24 -111.45 131.74 82.24 17.75 0.01 82.32 0.24 0.02 0.00 0.00 0.00 17.23 0.19 75 P C C 96.19 3.06 16.72 20.42 111.13 -103.52 -67.79 145.11 99.79 0.21 0.00 99.68 0.14 0.03 0.00 0.00 0.00 0.15 0.01