# 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 T C C 83.52 6.60 16.69 24.27 109.21 47.46 -101.65 87.95 99.85 0.15 0.00 99.67 0.22 0.02 0.00 0.00 0.00 0.06 0.03 1 Q C C 102.31 7.33 14.24 23.13 119.91 -122.55 -98.51 136.60 96.62 3.35 0.03 94.69 2.10 0.14 0.01 0.02 0.00 1.96 1.09 2 P C C 58.87 10.82 13.43 25.26 115.78 -102.98 -66.57 151.26 92.68 6.69 0.63 85.90 4.88 1.88 0.08 0.61 0.00 5.75 0.89 3 A C S 60.80 8.91 15.75 25.43 97.63 -120.97 -71.18 -28.04 82.97 16.58 0.44 37.67 42.00 2.82 0.03 0.48 0.00 16.32 0.68 4 S E E 59.46 8.04 18.81 27.87 132.97 1.12 -139.03 147.76 30.17 69.15 0.68 21.71 7.63 1.57 0.08 0.66 0.00 67.73 0.62 5 V E E 33.92 18.56 14.61 32.82 130.01 -171.66 -134.65 140.49 5.98 93.97 0.05 5.43 0.49 0.04 0.01 0.03 0.00 93.61 0.38 6 S E E 63.96 6.77 22.15 30.40 129.65 -167.49 -127.23 147.37 3.81 96.17 0.01 3.53 0.23 0.02 0.00 0.01 0.00 95.90 0.31 7 G E E 15.64 14.09 16.92 31.69 142.78 141.65 -167.35 175.99 23.05 76.92 0.02 19.30 3.22 0.11 0.00 0.02 0.00 76.35 1.00 8 S C C 56.41 4.97 22.96 27.99 126.26 -89.21 -109.15 154.08 90.22 9.75 0.03 86.36 3.96 0.14 0.01 0.02 0.00 8.56 0.96 9 P C T 64.89 13.50 14.17 27.73 109.80 -83.18 -60.28 136.50 98.95 0.80 0.25 1.09 4.82 93.25 0.01 0.20 0.00 0.51 0.13 10 G C T 49.28 3.77 19.23 23.79 95.40 22.20 87.77 -5.48 99.56 0.31 0.14 0.97 5.26 93.39 0.00 0.13 0.00 0.21 0.04 11 Q C C 83.18 7.24 17.52 26.01 122.53 117.78 -87.96 148.22 94.83 5.12 0.05 61.95 33.54 0.22 0.01 0.04 0.00 3.47 0.76 12 P C C 80.89 7.60 18.95 27.54 118.04 -117.97 -80.42 144.84 87.04 12.95 0.01 87.07 0.70 0.03 0.00 0.00 0.00 11.85 0.35 13 I E E 14.89 22.81 13.67 36.49 125.81 -161.45 -122.54 138.60 2.66 97.34 0.00 2.65 0.06 0.00 0.00 0.00 0.00 97.11 0.18 14 T E E 69.46 6.82 24.91 32.38 118.97 -150.58 -112.09 129.15 0.47 99.53 0.00 0.46 0.01 0.00 0.00 0.00 0.00 99.51 0.01 15 I E E 7.60 25.26 15.51 41.35 120.71 -166.83 -114.79 129.21 1.86 98.14 0.00 1.71 0.06 0.00 0.00 0.00 0.00 98.17 0.06 16 S E E 49.18 7.35 26.36 34.25 123.37 -165.92 -112.00 141.27 13.08 86.91 0.01 12.11 0.46 0.03 0.00 0.01 0.00 87.27 0.12 17 C E E 9.86 25.00 14.96 39.86 126.25 -166.04 -126.77 138.53 21.17 78.79 0.04 19.54 0.97 0.09 0.01 0.03 0.00 78.86 0.50 18 T E E 66.31 6.80 25.34 32.69 127.58 -166.91 -124.91 145.66 15.78 84.15 0.07 13.96 1.49 0.17 0.03 0.05 0.00 82.35 1.96 19 G E E 20.03 16.00 17.59 33.12 141.47 131.05 -117.28 167.16 27.04 72.83 0.13 21.59 5.47 0.52 0.04 0.11 0.00 70.40 1.86 20 T C E 70.19 7.61 22.43 30.70 128.71 -100.55 -122.47 151.23 51.98 47.65 0.37 43.46 6.81 0.95 0.09 0.33 0.00 46.29 2.06 21 S C C 40.95 17.11 13.95 30.18 120.07 -145.46 -99.93 133.45 71.36 22.32 6.31 50.83 13.57 6.92 1.57 4.95 0.01 19.26 2.87 22 S C C 72.52 4.84 19.35 24.65 106.39 63.54 -98.51 10.55 74.69 14.44 10.87 37.19 23.70 15.60 2.27 8.19 0.05 10.03 2.97 23 D C C 81.99 7.27 17.94 25.90 110.42 41.22 -96.20 106.80 75.62 13.52 10.86 42.87 18.06 15.58 2.28 8.60 0.02 9.29 3.30 24 V C C 38.34 18.58 11.66 29.18 102.82 128.44 -92.77 11.70 68.90 17.97 13.13 35.14 15.59 19.46 3.41 9.31 0.15 9.72 7.23 25 G C T 44.90 4.73 18.39 24.02 109.70 -56.80 67.56 -120.20 87.29 3.54 9.17 11.93 19.76 55.15 1.44 7.95 0.01 2.23 1.53 26 N C T 115.98 2.94 19.26 22.46 98.47 -7.69 -94.60 1.00 88.25 3.41 8.33 11.74 23.09 53.42 1.08 7.28 0.01 2.38 1.00 27 Y C C 47.45 18.17 14.05 31.83 122.82 85.58 -108.00 143.22 65.05 31.50 3.45 37.51 19.68 9.13 0.92 2.89 0.04 21.68 8.15 28 D C C 58.99 11.67 22.26 34.13 100.43 -167.39 -95.29 -6.34 67.92 31.13 0.95 39.73 23.25 4.95 0.15 0.88 0.00 29.89 1.15 29 L E E 28.49 16.03 23.56 39.53 130.82 43.11 -135.94 143.28 22.40 77.21 0.39 17.73 4.15 0.88 0.08 0.32 0.00 76.02 0.83 30 V E E 3.95 25.64 21.80 47.57 124.41 -167.85 -121.80 134.25 4.45 95.52 0.03 3.92 0.34 0.04 0.01 0.01 0.00 95.50 0.17 31 S E E 12.24 17.92 27.33 44.86 129.74 -170.87 -124.21 145.90 1.71 98.28 0.01 1.57 0.07 0.01 0.00 0.00 0.00 98.32 0.03 32 W E E 9.40 24.14 22.53 46.42 128.47 -160.63 -122.56 142.79 1.23 98.77 0.00 1.11 0.05 0.00 0.00 0.00 0.00 98.81 0.02 33 Y E E 28.17 16.85 23.83 40.64 131.91 -172.91 -131.63 148.55 1.03 98.97 0.00 0.90 0.05 0.00 0.00 0.00 0.00 99.00 0.05 34 Q E E 37.16 15.26 21.08 36.51 123.19 -150.59 -115.22 135.29 4.06 95.93 0.01 3.38 0.37 0.03 0.00 0.00 0.00 96.07 0.15 35 Q E E 62.41 12.45 16.85 29.98 116.50 -142.89 -100.21 129.05 30.39 69.57 0.03 26.93 2.53 0.14 0.01 0.03 0.00 69.15 1.21 36 H C C 73.49 8.81 13.70 24.08 119.98 -154.88 -97.93 146.61 96.72 3.26 0.03 94.68 2.19 0.16 0.01 0.02 0.00 2.41 0.53 37 P C T 106.34 3.22 12.11 17.05 108.99 -85.42 -59.26 134.03 99.62 0.10 0.28 0.49 4.23 94.92 0.01 0.27 0.00 0.06 0.02 38 G C T 68.46 0.35 12.78 10.77 96.31 17.46 83.57 -2.43 99.63 0.07 0.29 0.51 4.21 94.91 0.01 0.30 0.00 0.05 0.01 39 N C S 82.95 5.15 10.37 17.59 129.67 90.34 -116.10 161.03 92.97 6.74 0.29 29.80 62.40 1.04 0.06 0.22 0.00 2.30 4.18 40 A C C 73.20 2.63 17.08 19.90 117.19 -94.27 -69.83 150.66 96.99 2.98 0.02 84.42 12.64 0.15 0.00 0.02 0.00 2.44 0.33 41 P C C 46.14 17.45 11.46 28.31 115.34 -98.76 -65.38 144.83 92.04 7.94 0.01 90.44 1.60 0.08 0.00 0.01 0.00 7.63 0.23 42 K E E 92.48 8.18 20.76 29.76 125.95 -161.87 -122.65 140.54 7.20 92.78 0.02 6.34 0.64 0.05 0.01 0.01 0.00 92.55 0.39 43 Y E E 88.82 15.34 18.14 33.02 110.90 -114.88 -75.98 127.18 0.70 99.30 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.31 0.02 44 M E E 25.37 18.32 20.38 38.69 101.82 175.08 -98.10 -33.67 1.90 98.09 0.00 1.43 0.36 0.01 0.00 0.00 0.00 98.19 0.01 45 I E E 20.73 18.91 21.16 40.02 135.91 5.85 -146.64 142.63 0.45 99.55 0.00 0.39 0.02 0.00 0.00 0.00 0.00 99.58 0.01 46 Y E E 50.46 17.95 20.87 38.10 126.02 -170.84 -129.18 133.39 1.84 98.15 0.01 1.59 0.08 0.01 0.00 0.00 0.00 98.25 0.05 47 E E E 61.93 11.64 22.76 34.56 115.57 -161.67 -110.71 119.16 15.53 84.15 0.32 12.91 1.91 0.46 0.09 0.19 0.00 83.95 0.49 48 V C E 29.69 18.23 14.94 32.93 113.58 -169.34 -106.00 115.23 52.54 43.50 3.96 37.11 11.35 4.94 0.82 2.95 0.00 41.66 1.17 49 T C S 82.93 5.77 19.34 25.61 101.44 132.56 -92.89 -17.39 77.55 19.20 3.25 31.30 34.69 12.36 0.41 2.86 0.01 17.05 1.32 50 K C C 128.45 3.42 19.69 23.70 122.87 36.58 -121.77 132.11 82.00 15.08 2.92 42.16 30.71 9.82 0.40 2.81 0.00 11.49 2.61 51 R C C 93.27 16.23 12.06 27.33 118.73 -140.82 -93.58 134.92 93.74 6.09 0.17 76.69 16.84 0.54 0.05 0.13 0.00 4.26 1.49 52 P C C 42.15 11.67 12.54 25.54 115.30 -108.94 -65.99 151.64 94.74 3.02 2.23 85.42 4.04 5.03 0.40 2.08 0.00 2.01 1.02 53 A C T 93.10 1.67 15.14 17.27 109.70 -94.60 -64.29 138.89 92.80 1.77 5.43 8.63 13.65 69.74 0.61 5.42 0.00 1.11 0.83 54 G C T 58.72 1.85 15.90 17.82 97.69 21.94 83.67 -2.74 92.40 2.46 5.15 12.88 14.14 64.94 0.56 5.11 0.00 1.69 0.67 55 I C C 37.28 18.47 8.78 25.92 110.66 108.29 -98.85 108.04 86.76 7.53 5.71 68.93 11.19 5.57 1.52 4.59 0.00 3.89 4.30 56 S C C 67.58 5.94 16.38 23.34 111.95 109.78 -83.74 142.40 83.34 6.60 10.06 44.39 14.54 24.43 1.69 8.65 0.01 4.02 2.27 57 N C T 112.22 4.81 18.26 23.89 97.61 13.62 -63.47 17.49 82.37 4.46 13.17 25.77 23.21 34.15 1.57 11.25 0.01 2.85 1.19 58 R C S 81.09 13.54 17.59 30.88 99.03 93.61 -88.82 -9.83 80.87 9.95 9.18 30.24 34.19 17.24 1.13 7.70 0.01 8.41 1.08 59 F E E 20.98 22.94 14.09 36.48 128.06 50.81 -125.09 139.68 23.24 75.16 1.59 17.44 5.60 1.87 0.63 1.00 0.01 70.17 3.29 60 S E E 53.09 6.97 24.05 32.02 134.29 170.92 -137.61 154.18 10.35 89.53 0.12 9.31 0.90 0.15 0.05 0.06 0.00 88.60 0.93 61 G E E 21.63 19.77 14.61 32.92 140.58 176.45 -151.85 163.86 11.93 88.01 0.06 10.54 1.04 0.13 0.01 0.03 0.00 88.03 0.21 62 S E E 58.65 5.09 23.46 29.65 135.69 -161.67 -143.37 156.18 8.95 90.99 0.06 7.52 1.12 0.15 0.01 0.04 0.00 90.93 0.22 63 K E E 88.78 16.88 12.61 28.59 126.91 -155.74 -128.17 139.06 12.20 87.66 0.14 9.40 2.64 0.49 0.03 0.12 0.00 86.66 0.67 64 S E E 71.82 3.14 18.97 22.78 117.33 -174.88 -130.13 114.76 30.65 69.11 0.24 24.03 5.82 1.38 0.05 0.24 0.00 66.83 1.65 65 G C T 49.35 2.93 18.51 21.98 109.69 -47.76 60.93 -131.01 98.97 0.71 0.31 1.25 30.32 67.50 0.01 0.31 0.00 0.54 0.07 66 N C T 66.05 14.12 15.04 29.37 96.58 -17.23 -96.64 7.80 99.21 0.55 0.24 1.13 31.16 66.99 0.01 0.24 0.00 0.42 0.05 67 T E E 45.66 10.20 21.72 33.30 125.05 87.20 -113.47 139.00 16.64 83.34 0.02 13.06 3.46 0.18 0.00 0.02 0.00 82.07 1.21 68 A E E 3.64 24.61 16.61 41.86 127.71 -171.66 -127.33 142.22 4.02 95.98 0.00 3.76 0.12 0.01 0.00 0.00 0.00 95.97 0.15 69 S E E 29.95 10.49 27.30 38.77 126.94 -163.05 -123.45 140.12 3.41 96.59 0.00 2.89 0.17 0.00 0.00 0.00 0.00 96.90 0.03 70 L E E 3.72 26.10 18.30 45.16 123.49 -168.49 -121.96 131.59 0.75 99.25 0.00 0.70 0.01 0.00 0.00 0.00 0.00 99.28 0.01 71 T E E 47.86 9.25 27.36 37.32 119.49 -162.93 -115.05 128.31 0.21 99.79 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.76 0.01 72 I E E 5.79 25.08 16.44 42.23 118.04 -167.96 -116.53 123.79 1.58 98.42 0.00 1.64 0.02 0.00 0.00 0.00 0.00 98.03 0.31 73 S C C 52.25 6.57 23.61 30.66 128.94 -173.71 -123.51 151.21 73.82 26.08 0.10 38.69 22.21 10.51 0.01 0.12 0.00 28.05 0.43 74 G C S 45.00 3.45 23.84 27.77 94.54 18.10 70.80 23.20 98.40 1.56 0.04 6.39 78.84 13.01 0.00 0.05 0.00 1.62 0.08 75 L C C 13.50 24.52 10.05 34.00 116.22 154.88 -74.29 139.50 98.84 1.14 0.01 98.15 0.97 0.03 0.00 0.00 0.00 0.55 0.29 76 Q C C 84.11 4.55 24.31 28.65 130.82 -169.21 -121.94 158.81 98.10 1.83 0.06 98.37 0.27 0.01 0.02 0.01 0.00 0.32 1.00 77 A H G 52.71 13.45 15.06 28.51 91.40 -102.20 -58.74 -34.64 3.17 0.02 96.81 0.20 0.21 2.09 0.71 96.79 0.00 0.01 0.00 78 E H G 132.75 2.79 21.33 24.32 90.24 61.70 -69.84 -18.17 2.65 0.02 97.33 0.12 0.17 1.85 0.61 97.23 0.00 0.02 0.00 79 D H G 20.58 19.61 15.40 35.08 93.33 64.56 -82.83 -3.91 3.76 0.03 96.21 0.61 0.40 1.66 0.88 96.41 0.00 0.03 0.00 80 A C C 40.26 14.57 19.30 33.80 113.16 114.20 -72.54 133.81 98.27 1.15 0.58 93.93 4.16 0.33 0.08 0.48 0.00 0.87 0.16 81 A E E 24.93 13.26 22.25 35.63 144.75 112.22 -162.15 170.32 30.06 69.78 0.16 26.60 2.59 0.24 0.05 0.12 0.00 66.67 3.73 82 D E E 59.32 10.51 25.09 35.79 115.91 -80.61 -90.60 134.05 5.64 94.31 0.05 5.02 0.61 0.06 0.01 0.03 0.00 94.00 0.27 83 Y E E 8.71 25.36 18.08 43.67 127.53 -169.63 -121.98 142.00 2.08 97.88 0.04 1.80 0.23 0.03 0.01 0.02 0.00 97.82 0.10 84 Y E E 42.37 15.25 28.07 43.39 127.28 -167.56 -123.91 143.15 2.82 97.11 0.07 2.34 0.29 0.07 0.01 0.04 0.00 97.14 0.11 85 C E E 3.07 25.90 22.35 48.28 123.07 -158.98 -114.80 137.35 6.08 93.77 0.15 4.97 0.74 0.16 0.03 0.09 0.00 93.82 0.18 86 C E E 15.56 17.47 26.31 43.37 131.27 -175.55 -129.62 150.52 6.14 93.58 0.28 5.09 0.76 0.22 0.06 0.14 0.00 93.52 0.22 87 S E E 15.45 19.94 20.81 40.13 127.62 -160.33 -122.89 144.92 8.09 91.46 0.46 6.40 1.31 0.43 0.10 0.27 0.00 91.13 0.36 88 Y E E 74.25 12.25 19.65 32.39 119.58 -151.56 -111.88 130.12 16.83 82.51 0.65 13.54 2.90 0.92 0.18 0.47 0.00 80.73 1.25 89 A C E 53.35 10.55 14.98 26.14 112.70 -162.05 -98.54 118.09 53.38 43.84 2.78 23.40 15.91 15.15 0.20 2.57 0.00 41.93 0.84 90 G C T 52.41 2.81 15.62 18.88 112.66 -5.73 89.93 -141.41 87.11 9.59 3.30 15.71 28.87 42.41 0.19 3.53 0.00 8.43 0.86 91 S C T 78.43 3.59 13.49 18.36 108.56 -7.35 -94.27 105.18 94.84 1.92 3.24 16.77 33.14 44.58 0.21 3.57 0.00 1.32 0.42 92 S C S 77.28 5.50 14.18 20.87 102.66 -99.68 -95.25 15.45 88.95 9.29 1.77 17.35 40.17 31.77 0.13 1.80 0.00 7.96 0.82 93 T E E 59.78 9.62 16.02 26.68 121.32 114.23 -106.48 136.74 48.61 51.09 0.30 36.70 9.23 1.62 0.04 0.28 0.00 51.30 0.83 94 V E E 45.12 15.27 16.88 32.36 120.05 -154.88 -108.99 131.62 15.44 84.49 0.07 13.70 1.11 0.16 0.02 0.04 0.00 84.44 0.54 95 I E E 52.60 13.21 20.83 34.45 118.17 -158.99 -109.45 125.95 5.28 94.69 0.04 4.67 0.41 0.07 0.02 0.02 0.00 94.03 0.79 96 F E E 51.75 18.26 18.42 35.73 119.10 -161.16 -103.97 135.50 19.14 80.63 0.23 15.52 2.77 0.84 0.06 0.17 0.00 79.68 0.95 97 G C E 26.23 14.38 20.01 33.20 114.91 -106.28 -55.24 -126.97 69.98 28.56 1.46 23.44 24.27 22.89 0.13 1.46 0.00 26.83 0.99 98 G C T 40.66 9.19 21.87 30.64 100.28 6.21 -60.05 2.77 77.86 20.07 2.08 13.98 30.76 33.92 0.14 2.05 0.00 17.95 1.21 99 G C C 20.59 14.42 19.52 33.31 118.94 -101.89 94.26 2.72 69.08 29.82 1.11 30.74 24.41 13.80 0.09 1.20 0.00 28.97 0.80 100 T E E 21.63 20.82 17.62 37.63 119.09 -83.79 -99.70 135.97 38.15 61.78 0.07 34.77 1.75 0.20 0.01 0.05 0.00 62.83 0.38 101 K E E 96.77 8.92 24.79 34.14 121.07 -157.87 -110.29 131.21 3.50 96.48 0.02 3.15 0.24 0.03 0.00 0.01 0.00 96.40 0.18 102 V E E 12.64 23.67 15.90 39.56 121.79 -167.01 -116.01 131.50 1.79 98.21 0.01 1.70 0.06 0.01 0.00 0.00 0.00 98.17 0.06 103 T E E 57.74 6.99 24.37 31.87 119.06 -159.00 -110.17 129.65 3.20 96.79 0.01 3.12 0.12 0.02 0.00 0.00 0.00 96.54 0.19 104 V E E 24.48 20.31 12.97 33.10 115.35 -152.95 -98.60 125.22 13.17 86.79 0.03 13.37 0.20 0.04 0.01 0.01 0.00 85.22 1.14 105 L C C 76.97 8.41 19.50 28.40 112.18 -156.05 -90.65 124.79 99.16 0.84 0.00 99.23 0.04 0.01 0.00 0.00 0.00 0.71 0.01