# 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 64.95 6.18 13.58 21.01 118.12 -169.52 -98.97 143.82 99.92 0.06 0.02 99.77 0.13 0.05 0.01 0.00 0.00 0.02 0.01 1 D C C 95.24 5.61 10.49 17.66 108.23 -152.27 -91.57 96.05 89.82 1.69 8.48 79.28 3.07 7.77 2.21 5.83 0.00 0.85 1.00 2 T C C 85.06 5.05 10.04 16.63 108.13 119.28 -90.24 79.17 78.76 2.24 19.00 47.50 13.10 16.74 2.30 18.13 0.00 1.15 1.07 3 A C T 80.08 3.57 10.46 15.65 99.57 86.25 -77.60 -10.28 77.05 1.96 21.00 22.88 16.44 37.58 1.89 19.33 0.00 1.07 0.81 4 N C T 120.93 2.34 12.79 16.09 101.36 49.22 -90.90 20.53 79.25 2.52 18.23 29.79 16.18 33.12 1.51 17.10 0.00 1.47 0.82 5 A C C 44.91 10.40 9.72 21.20 118.35 120.10 -85.04 145.16 92.48 6.71 0.82 59.09 32.57 1.46 0.24 0.55 0.00 4.37 1.70 6 P C C 84.85 5.12 16.71 22.88 115.49 -122.34 -86.52 139.25 84.66 14.64 0.71 77.12 6.03 1.17 0.20 0.49 0.00 12.70 2.28 7 F C C 100.81 12.51 15.02 27.58 113.20 -112.76 -77.64 130.86 60.74 38.22 1.04 56.70 2.82 0.84 0.39 0.63 0.00 24.48 14.15 8 L C C 47.76 14.78 17.39 32.32 98.90 -163.40 -83.56 -29.66 79.36 19.23 1.40 37.71 37.63 5.21 0.22 1.31 0.00 15.21 2.71 9 C C S 19.18 18.42 15.10 33.44 133.87 15.08 -136.28 151.65 76.90 22.12 0.97 23.11 48.62 5.24 0.10 1.04 0.00 19.96 1.93 10 E C C 116.00 3.98 22.37 26.42 112.82 -107.17 -72.60 138.22 66.56 32.74 0.70 59.41 4.83 1.11 0.06 0.82 0.00 33.00 0.76 11 S E E 34.88 19.93 10.88 29.12 129.64 -165.32 -122.17 150.68 20.25 79.67 0.07 18.65 1.45 0.12 0.02 0.06 0.00 79.10 0.60 12 E E E 96.97 5.54 20.03 26.57 125.38 -159.47 -124.63 140.35 2.41 97.58 0.01 2.18 0.17 0.01 0.00 0.00 0.00 97.56 0.07 13 Q E E 95.72 11.62 14.36 26.64 120.50 -145.45 -106.49 133.51 1.07 98.93 0.00 0.97 0.04 0.00 0.00 0.00 0.00 98.97 0.01 14 L E E 61.07 9.80 16.58 27.73 128.60 -175.27 -131.30 145.28 0.81 99.19 0.00 0.75 0.02 0.00 0.00 0.00 0.00 99.22 0.01 15 L E E 83.46 9.10 18.19 28.22 117.59 -135.20 -98.36 129.51 1.36 98.64 0.00 1.26 0.03 0.00 0.00 0.00 0.00 98.67 0.03 16 I E E 27.31 17.18 16.08 33.77 123.48 -169.57 -118.64 136.24 7.24 92.76 0.00 6.93 0.26 0.01 0.00 0.00 0.00 92.46 0.32 17 H E E 88.89 9.37 22.47 32.16 116.95 -148.51 -105.72 129.32 47.83 52.16 0.00 45.42 0.95 0.02 0.00 0.00 0.00 53.41 0.19 18 P C C 13.92 22.32 13.79 35.89 114.76 -113.29 -68.90 145.62 57.77 42.21 0.02 55.67 1.12 0.06 0.00 0.02 0.00 42.80 0.31 19 K C S 105.56 6.41 21.85 28.83 97.45 -157.33 -84.65 -30.01 65.45 34.54 0.02 14.69 50.02 0.38 0.00 0.01 0.00 34.72 0.18 20 E E E 73.48 8.15 21.59 30.59 141.60 3.07 -152.43 155.78 1.66 98.34 0.00 1.32 0.21 0.01 0.00 0.00 0.00 98.39 0.07 21 E E E 29.00 18.24 15.00 33.27 138.09 177.63 -148.17 158.00 0.22 99.78 0.00 0.19 0.01 0.00 0.00 0.00 0.00 99.80 0.00 22 L E E 81.35 6.42 18.90 26.39 118.01 -117.57 -102.78 132.06 0.62 99.38 0.00 0.60 0.01 0.00 0.00 0.00 0.00 99.23 0.15 23 S C C 23.05 13.35 10.35 24.57 124.36 -139.97 -84.10 174.40 90.85 9.13 0.02 91.33 0.34 0.05 0.00 0.01 0.00 7.73 0.53 24 R C T 181.15 2.36 12.05 15.99 91.47 -94.13 -63.78 -21.13 99.20 0.31 0.49 0.50 3.59 95.11 0.01 0.51 0.00 0.21 0.06 25 N C T 122.50 1.13 12.07 12.89 93.76 53.02 -89.22 5.31 99.41 0.06 0.52 0.29 3.41 95.68 0.01 0.56 0.00 0.03 0.01 26 N C S 110.56 3.87 11.68 17.41 94.14 -105.85 73.60 17.40 99.23 0.30 0.48 15.98 81.25 2.11 0.05 0.34 0.00 0.14 0.13 27 S C C 52.81 4.63 14.19 20.52 120.24 138.62 -88.06 149.00 94.18 5.80 0.02 93.10 1.49 0.07 0.00 0.01 0.00 4.76 0.56 28 M E E 77.14 10.47 14.69 26.37 115.44 -113.31 -79.99 135.99 1.12 98.88 0.00 1.16 0.03 0.00 0.00 0.00 0.00 98.53 0.28 29 V E E 27.66 15.55 16.64 33.00 128.61 -172.53 -126.39 144.51 0.35 99.65 0.00 0.31 0.02 0.00 0.00 0.00 0.00 99.67 0.00 30 W E E 74.01 12.95 21.64 35.04 115.69 -124.80 -89.27 131.69 0.42 99.58 0.00 0.38 0.03 0.00 0.00 0.00 0.00 99.58 0.02 31 I E E 12.12 21.77 18.80 40.74 115.41 -153.20 -101.51 123.87 3.12 96.87 0.01 2.91 0.12 0.01 0.00 0.00 0.00 96.60 0.34 32 V E E 23.13 15.88 21.07 37.40 118.45 -158.68 -105.70 130.78 27.46 72.50 0.04 25.50 1.27 0.13 0.01 0.03 0.00 72.20 0.85 33 N C C 52.13 14.74 16.97 31.41 115.38 -150.04 -103.17 122.42 72.83 27.04 0.13 57.61 13.34 0.84 0.03 0.13 0.00 26.96 1.09 34 T C C 45.19 8.90 14.47 25.03 128.93 163.58 -126.72 158.92 81.43 18.06 0.52 57.67 22.25 2.07 0.19 0.41 0.00 11.75 5.66 35 K C T 164.84 1.54 14.97 16.77 95.60 -89.71 -61.43 -31.91 94.48 1.87 3.65 5.78 28.06 60.71 0.25 3.45 0.00 1.18 0.57 36 D C T 112.44 2.20 15.35 17.71 99.26 31.85 -97.54 -3.09 95.21 1.76 3.03 7.51 27.00 60.59 0.17 3.08 0.00 1.30 0.36 37 Y C C 59.78 14.54 11.77 26.66 131.52 51.96 -132.81 147.94 59.97 37.75 2.29 37.38 18.60 4.17 0.52 2.06 0.02 29.64 7.61 38 K C C 100.09 7.55 20.77 29.22 122.70 -156.54 -116.21 138.03 53.17 46.58 0.25 49.68 2.08 0.43 0.11 0.15 0.00 43.98 3.57 39 Q C E 24.36 21.19 16.16 36.91 121.43 -148.03 -105.01 137.04 51.40 48.49 0.11 46.20 3.23 0.34 0.03 0.08 0.00 48.86 1.27 40 G E E 12.69 12.42 23.74 36.69 132.12 -168.93 -123.23 162.84 21.36 78.60 0.04 18.19 2.06 0.16 0.01 0.03 0.00 79.17 0.38 41 V E E 20.47 21.48 18.45 39.62 126.09 -148.47 -124.41 136.30 2.23 97.77 0.00 2.22 0.08 0.00 0.00 0.00 0.00 97.60 0.10 42 R E E 65.57 12.81 23.85 36.68 122.97 -166.11 -117.51 134.94 0.33 99.67 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.67 0.01 43 I E E 31.73 17.61 20.13 37.73 121.77 -159.38 -114.32 131.00 0.37 99.63 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.64 0.00 44 E E E 28.72 16.15 20.68 37.20 127.51 -172.44 -121.89 143.49 0.77 99.23 0.00 0.69 0.04 0.00 0.00 0.00 0.00 99.25 0.01 45 K E E 81.81 10.82 23.68 34.51 120.62 -149.55 -106.20 134.01 2.52 97.46 0.02 2.37 0.14 0.02 0.00 0.01 0.00 97.29 0.17 46 C E E 11.24 21.67 12.78 34.67 113.05 -125.27 -80.94 131.89 30.10 69.59 0.30 27.69 1.63 0.31 0.10 0.22 0.00 68.80 1.25 47 L C C 87.59 6.19 19.90 26.65 100.25 -156.35 -84.45 -24.28 78.52 19.69 1.78 43.89 32.09 2.85 0.53 1.24 0.00 18.24 1.14 48 K C C 113.17 5.53 17.60 23.91 114.26 27.36 -102.17 122.59 79.89 13.67 6.44 40.29 33.99 6.47 1.57 4.67 0.00 10.81 2.19 49 R C C 124.07 10.64 13.25 24.30 106.58 -153.86 -85.80 43.02 83.03 9.64 7.33 49.61 25.16 8.88 1.72 5.43 0.00 6.95 2.24 50 Q C C 103.98 4.96 17.13 22.88 108.07 84.42 -104.63 89.93 87.08 7.13 5.79 63.88 14.89 8.09 1.28 4.68 0.00 4.55 2.62 51 L C T 78.09 12.46 11.69 24.35 111.32 -143.81 -69.95 131.31 93.27 5.21 1.53 14.41 12.57 66.41 0.40 1.14 0.00 3.74 1.34 52 G C T 48.86 4.88 17.01 22.95 98.05 17.36 84.34 -2.48 95.71 3.70 0.59 11.25 18.30 65.80 0.06 0.62 0.00 3.66 0.31 53 K C C 110.14 4.67 17.10 23.21 122.15 114.27 -100.79 143.43 82.30 17.50 0.20 46.27 36.99 0.92 0.05 0.17 0.00 13.09 2.51 54 P E C 78.35 7.70 16.86 25.58 115.48 -104.67 -66.46 147.95 49.64 49.64 0.71 44.77 2.68 0.67 0.41 0.38 0.00 25.53 25.56 55 C C C 20.38 20.09 10.74 30.29 115.97 -127.06 -92.17 134.03 72.99 25.41 1.60 60.40 8.44 3.03 0.46 1.36 0.00 21.36 4.95 56 N C C 99.36 4.52 19.34 24.58 114.46 -153.06 -103.71 123.41 63.76 34.22 2.02 44.01 15.49 5.41 0.58 1.74 0.01 26.92 5.84 57 F C C 76.74 13.67 10.72 24.34 113.83 -166.47 -97.86 134.15 64.58 30.87 4.56 35.59 18.77 12.93 1.12 3.56 0.08 20.42 7.55 58 C C T 90.62 3.62 13.66 18.37 101.19 -82.09 -75.15 -25.46 90.28 6.07 3.65 24.94 18.35 47.36 0.60 3.01 0.00 4.51 1.23 59 D C T 115.06 2.13 14.35 16.75 100.46 6.73 -89.20 5.55 94.05 2.72 3.23 27.24 19.22 47.82 0.45 2.79 0.00 1.89 0.60 60 A C C 41.88 10.78 11.34 22.98 127.09 63.22 -123.01 156.79 80.45 17.86 1.69 50.46 21.55 8.00 0.34 1.49 0.00 15.65 2.51 61 D C C 82.92 5.57 18.61 24.89 115.28 -118.64 -94.31 129.87 65.44 34.18 0.38 57.99 4.27 1.22 0.08 0.30 0.00 34.69 1.47 62 T E E 23.12 18.98 13.03 31.82 127.69 -166.34 -120.84 144.70 32.73 67.16 0.11 29.78 2.07 0.22 0.03 0.07 0.00 66.58 1.25 63 E E E 69.82 8.81 23.54 32.87 127.42 -164.90 -122.91 141.70 9.24 90.70 0.06 8.08 0.82 0.10 0.02 0.03 0.00 90.46 0.50 64 C E E 12.11 22.35 15.27 37.60 120.73 -147.35 -105.09 135.18 7.85 92.13 0.01 7.18 0.29 0.02 0.00 0.01 0.00 92.37 0.12 65 K E E 79.82 8.15 24.09 32.65 123.58 -169.72 -120.82 135.21 3.50 96.49 0.01 3.27 0.14 0.01 0.00 0.00 0.00 96.51 0.07 66 Q E E 43.85 18.43 15.73 33.67 116.58 -132.25 -90.42 132.78 2.73 97.27 0.00 2.49 0.10 0.00 0.00 0.00 0.00 97.36 0.04 67 L E E 53.81 9.53 19.98 30.69 122.00 -168.26 -113.91 135.01 3.14 96.86 0.00 2.62 0.20 0.01 0.00 0.00 0.00 97.13 0.03 68 F E E 73.35 13.79 16.02 30.10 123.68 -154.98 -113.93 138.18 1.34 98.66 0.00 1.18 0.03 0.00 0.00 0.00 0.00 98.78 0.01 69 H E E 59.19 10.81 17.84 29.99 124.39 -171.27 -123.91 135.76 0.53 99.47 0.00 0.46 0.01 0.00 0.00 0.00 0.00 99.53 0.00 70 Y E E 95.65 10.50 17.44 28.91 118.87 -150.56 -104.97 131.40 0.56 99.44 0.00 0.47 0.01 0.00 0.00 0.00 0.00 99.51 0.00 71 R E E 58.44 13.91 16.48 31.13 126.29 -174.12 -125.24 139.47 0.58 99.42 0.00 0.48 0.02 0.00 0.00 0.00 0.00 99.49 0.00 72 T E E 55.71 8.94 21.36 31.02 118.53 -142.23 -102.83 133.47 0.70 99.30 0.00 0.62 0.02 0.00 0.00 0.00 0.00 99.36 0.00 73 L E E 10.35 21.91 15.74 37.85 125.04 -164.54 -117.06 141.88 0.64 99.35 0.00 0.57 0.01 0.00 0.00 0.00 0.00 99.41 0.00 74 V E E 33.89 10.58 23.28 35.13 119.99 -142.82 -106.01 133.96 0.25 99.75 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.00 75 A E E 8.50 19.96 18.10 38.33 126.78 -166.95 -117.52 143.04 0.39 99.61 0.00 0.33 0.01 0.00 0.00 0.00 0.00 99.65 0.01 76 V E E 33.24 10.74 18.94 31.63 119.11 -150.45 -110.43 129.77 2.16 97.83 0.00 1.94 0.14 0.01 0.00 0.00 0.00 97.56 0.35 77 D C E 31.92 9.96 13.93 26.43 109.37 -134.02 -85.43 120.25 50.21 49.72 0.07 46.48 1.86 0.21 0.01 0.05 0.00 50.72 0.67 78 K C T 120.25 6.04 13.20 21.07 93.75 -152.90 -67.21 -26.39 98.36 0.45 1.19 1.10 9.98 87.27 0.05 1.19 0.00 0.31 0.11 79 V C T 121.27 0.96 13.34 13.70 97.44 48.20 -76.33 -38.97 98.32 0.23 1.45 0.80 8.05 89.41 0.05 1.47 0.00 0.13 0.09 80 T C T 84.41 2.27 12.15 15.06 99.67 24.48 -101.16 -10.06 98.30 0.53 1.16 5.12 10.74 82.20 0.06 1.39 0.00 0.38 0.12 81 K C C 137.13 5.18 10.94 18.37 94.84 -130.15 59.37 31.59 97.54 1.87 0.59 43.75 14.92 38.97 0.09 0.53 0.00 1.42 0.32 82 K C C 120.98 2.22 17.36 19.93 125.95 124.40 -118.21 148.18 69.97 29.93 0.10 48.09 21.08 0.81 0.01 0.11 0.00 29.00 0.89 83 P E E 63.16 14.16 10.78 24.72 114.99 -107.88 -70.35 142.10 24.90 75.09 0.01 23.88 0.68 0.04 0.00 0.01 0.00 74.90 0.49 84 Y E E 98.45 7.20 17.06 25.71 127.13 -170.10 -124.33 145.97 1.37 98.63 0.00 1.20 0.06 0.00 0.00 0.00 0.00 98.63 0.10 85 K E E 119.39 9.21 14.38 25.07 118.92 -133.00 -98.17 135.92 1.55 98.45 0.00 1.29 0.09 0.01 0.00 0.00 0.00 98.60 0.01 86 E E E 65.76 9.97 16.04 27.39 131.85 172.94 -136.18 150.64 2.62 97.37 0.00 2.22 0.17 0.01 0.00 0.00 0.00 97.59 0.01 87 Q E E 106.53 7.22 17.60 26.40 118.99 -131.06 -100.16 134.09 2.70 97.30 0.00 2.42 0.11 0.00 0.00 0.00 0.00 97.44 0.03 88 V E E 20.09 18.44 14.86 33.56 129.17 -174.23 -131.13 144.43 1.39 98.61 0.00 1.24 0.04 0.00 0.00 0.00 0.00 98.65 0.06 89 L E E 82.92 8.00 23.66 31.97 113.50 -122.57 -86.39 129.85 3.69 96.31 0.00 3.35 0.12 0.00 0.00 0.00 0.00 96.42 0.10 90 L E E 10.44 24.03 16.59 40.54 122.27 -161.53 -111.79 135.92 26.58 73.42 0.01 24.79 1.03 0.03 0.00 0.00 0.00 73.81 0.33 91 P E E 32.51 13.43 23.65 37.44 114.50 -110.16 -68.53 144.84 41.01 58.92 0.07 37.28 2.57 0.17 0.02 0.05 0.00 59.13 0.77 92 S E E 18.55 20.31 20.26 39.66 112.66 -167.41 -108.58 13.94 49.39 50.21 0.41 34.52 14.10 1.63 0.07 0.40 0.00 47.17 2.11 93 C E E 34.88 13.40 25.46 38.55 124.05 50.37 -135.54 138.19 31.17 68.50 0.33 22.40 8.17 1.37 0.05 0.32 0.00 66.41 1.27 94 C E E 7.39 24.54 18.27 42.57 128.02 -163.02 -120.73 144.20 10.63 89.26 0.10 9.59 0.91 0.12 0.03 0.07 0.00 88.38 0.89 95 K E E 60.63 12.33 27.19 39.65 130.26 -170.01 -130.20 145.86 4.69 95.28 0.03 4.15 0.37 0.05 0.01 0.02 0.00 95.14 0.26 96 C E E 9.63 24.12 18.42 42.46 123.10 -156.10 -116.00 136.10 4.61 95.36 0.03 3.93 0.35 0.04 0.01 0.01 0.00 95.55 0.10 97 A E E 28.51 11.79 24.77 36.92 126.43 -169.13 -122.99 143.97 3.68 96.23 0.09 3.19 0.28 0.06 0.03 0.03 0.00 96.23 0.18 98 K E E 56.32 16.98 18.05 34.67 117.22 -139.85 -99.79 130.31 7.31 92.49 0.20 6.50 0.60 0.11 0.09 0.08 0.00 92.26 0.36 99 I E E 57.12 10.90 18.21 30.14 119.84 -164.12 -111.07 131.85 20.68 78.83 0.49 18.91 1.50 0.35 0.20 0.26 0.00 77.85 0.93 100 L C C 81.89 9.04 15.38 25.45 114.06 -137.01 -89.09 130.39 53.42 44.15 2.42 43.42 7.41 2.47 0.74 1.62 0.00 42.78 1.56 101 S C C 53.68 9.36 11.61 22.01 111.67 -153.49 -94.18 126.93 76.60 15.85 7.54 49.18 17.49 10.28 1.61 6.08 0.01 13.09 2.26 102 T C T 102.17 2.86 12.52 16.61 104.18 -129.99 -87.89 34.09 82.12 5.45 12.43 23.78 21.67 37.31 2.27 9.88 0.01 3.38 1.70 103 G C T 57.66 2.23 13.39 16.26 101.15 -29.18 81.17 0.93 84.99 2.71 12.30 21.39 24.19 39.66 2.03 10.12 0.00 1.60 1.00 104 W C C 126.03 8.67 9.43 19.17 113.96 108.33 -96.63 128.15 82.83 5.79 11.38 40.96 24.50 17.62 2.32 9.10 0.01 3.32 2.18 105 S C C 74.59 4.35 12.83 18.75 114.63 -162.14 -98.09 129.48 86.22 5.71 8.07 49.21 23.87 13.37 1.91 6.27 0.00 3.48 1.90 106 H C C 100.91 8.54 11.14 20.93 118.78 -147.78 -101.99 134.22 91.30 3.85 4.85 58.38 29.81 3.52 1.95 2.64 0.00 1.86 1.84 107 P C C 71.83 7.07 11.88 20.52 112.54 -111.45 -69.18 148.32 75.67 2.26 22.08 54.44 7.61 12.36 3.91 19.55 0.00 1.43 0.71 108 Q C C 114.82 5.12 12.14 18.73 107.66 -120.35 -81.74 112.45 66.33 3.82 29.85 32.37 13.34 21.09 4.53 25.22 0.01 2.14 1.30 109 F C C 112.12 8.21 8.62 17.79 110.63 -135.04 -92.02 114.39 61.99 8.28 29.73 33.06 13.27 17.43 4.80 23.98 0.03 4.92 2.52 110 E C C 129.37 3.57 9.54 14.88 113.36 -150.01 -91.70 128.75 78.85 6.61 14.53 67.48 3.15 9.43 4.44 8.82 0.00 4.24 2.44 111 K C C 149.08 3.01 11.21 16.00 109.73 -130.29 -82.66 122.19 99.83 0.14 0.02 99.74 0.10 0.05 0.01 0.00 0.00 0.08 0.02