# 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 E C C 111.94 5.53 20.24 26.45 117.08 -143.63 -97.50 130.95 99.16 0.83 0.01 99.22 0.06 0.01 0.00 0.00 0.00 0.69 0.01 1 V E E 36.40 20.33 11.46 30.59 121.45 -158.89 -110.63 133.12 42.02 57.77 0.21 41.73 0.41 0.15 0.08 0.08 0.00 56.85 0.70 2 Q E E 89.78 5.54 21.85 28.07 123.82 -167.28 -118.30 137.07 17.08 82.47 0.45 15.76 1.06 0.32 0.22 0.22 0.00 81.76 0.66 3 L E E 54.67 18.95 14.20 32.18 119.46 -149.60 -103.05 131.10 16.77 82.63 0.60 15.58 0.89 0.33 0.28 0.30 0.00 82.06 0.56 4 V E E 54.72 10.22 19.83 30.92 124.23 -170.20 -119.77 138.47 22.64 76.68 0.69 20.31 1.67 0.43 0.31 0.33 0.00 76.16 0.80 5 E E E 104.58 10.35 18.23 29.09 115.87 -129.14 -88.01 133.94 40.25 58.51 1.24 32.81 5.51 1.57 0.35 0.83 0.00 58.04 0.88 6 S C C 43.04 14.87 15.12 29.42 108.96 -152.72 -94.03 61.00 69.24 28.90 1.86 49.54 13.42 5.23 0.32 1.64 0.00 28.87 0.98 7 G C C 42.67 7.40 18.92 26.74 111.54 -122.21 65.28 17.17 76.91 21.99 1.10 40.27 27.74 9.00 0.14 1.10 0.00 20.62 1.12 8 G C C 32.75 12.30 16.29 28.35 125.42 27.19 -108.32 171.36 68.42 30.98 0.59 40.74 22.90 5.09 0.07 0.65 0.00 29.53 1.02 9 D E E 64.67 11.37 19.33 30.72 127.86 -150.77 -125.46 153.93 38.03 61.84 0.13 29.16 8.55 0.75 0.02 0.14 0.00 60.52 0.85 10 S E E 56.30 11.34 21.00 32.08 121.51 -122.89 -102.24 138.56 11.91 88.03 0.05 9.94 1.92 0.14 0.01 0.04 0.00 87.16 0.79 11 V E E 19.31 20.63 14.74 35.06 126.91 -168.79 -123.28 140.22 6.63 93.34 0.03 5.93 0.47 0.02 0.03 0.01 0.00 86.19 7.35 12 Q C C 93.05 5.48 23.21 28.89 119.83 -129.34 -82.99 148.14 89.75 10.21 0.03 89.74 0.47 0.06 0.01 0.01 0.00 9.20 0.52 13 P C T 68.85 12.35 14.99 27.62 109.92 -85.59 -59.30 137.11 99.18 0.58 0.24 0.33 2.31 96.70 0.01 0.19 0.00 0.40 0.05 14 G C T 49.52 3.60 19.56 23.87 96.71 22.41 87.33 -5.75 99.34 0.44 0.22 0.46 2.80 96.18 0.01 0.18 0.00 0.34 0.02 15 G C C 23.25 9.35 16.54 27.20 127.69 115.30 -89.72 172.48 90.41 9.53 0.06 74.65 15.59 0.26 0.01 0.06 0.00 8.78 0.65 16 S E E 52.27 10.33 20.48 31.45 132.11 -124.92 -132.22 152.37 42.69 57.30 0.01 42.75 0.58 0.02 0.00 0.01 0.00 55.84 0.79 17 L E E 13.65 23.13 16.53 39.59 126.45 -157.79 -125.70 139.09 1.70 98.29 0.00 1.62 0.04 0.00 0.00 0.00 0.00 98.26 0.07 18 R E E 111.25 8.62 25.48 34.74 119.93 -155.68 -111.94 129.27 0.59 99.41 0.00 0.54 0.02 0.00 0.00 0.00 0.00 99.42 0.02 19 L E E 5.28 25.73 17.29 43.52 124.04 -170.26 -118.55 135.89 3.09 96.90 0.01 2.84 0.13 0.01 0.00 0.00 0.00 96.91 0.11 20 S E E 38.92 10.38 27.12 37.93 127.06 -163.68 -114.88 145.32 16.52 83.44 0.04 14.81 0.91 0.08 0.01 0.02 0.00 84.01 0.16 21 C E E 5.33 25.15 17.90 43.20 133.49 171.52 -139.16 147.20 24.00 75.84 0.16 21.64 1.61 0.22 0.05 0.10 0.00 75.83 0.54 22 A E E 37.06 10.51 27.41 38.55 122.73 -147.49 -111.59 137.78 16.81 82.86 0.33 15.08 1.42 0.35 0.13 0.20 0.00 80.13 2.68 23 A E E 6.95 24.66 16.17 40.77 123.29 -171.17 -122.47 132.49 33.70 65.53 0.77 31.26 1.97 0.57 0.24 0.54 0.00 61.73 3.68 24 A C E 54.57 8.35 21.95 30.67 119.44 -160.11 -108.04 142.95 58.48 40.58 0.94 25.41 18.71 16.90 0.10 0.95 0.00 36.48 1.45 25 G C S 49.92 3.34 21.66 25.47 97.11 17.77 82.39 1.56 81.13 18.26 0.61 17.82 42.46 20.99 0.04 0.70 0.00 17.12 0.86 26 F C C 39.58 20.82 11.54 31.38 118.28 128.93 -91.59 138.03 82.52 16.94 0.54 69.24 10.97 1.95 0.11 0.56 0.00 14.18 3.00 27 T C C 80.23 5.20 22.13 27.68 109.17 -162.80 -105.07 58.51 86.40 12.97 0.63 72.50 10.31 3.04 0.14 0.59 0.00 9.48 3.94 28 F C C 57.38 17.22 14.01 30.48 120.15 102.84 -100.80 141.13 83.64 12.09 4.27 42.43 28.15 13.54 0.64 3.91 0.00 7.84 3.49 29 S C S 73.07 5.05 19.80 25.54 96.92 -143.07 -82.09 -16.84 87.43 9.23 3.34 13.10 43.86 30.91 0.24 3.23 0.00 7.56 1.10 30 S C C 49.73 8.44 20.47 29.39 111.63 35.08 -117.03 49.50 76.80 19.73 3.47 28.81 23.47 25.07 0.25 3.68 0.00 17.59 1.13 31 Y C E 26.93 21.26 16.61 37.24 132.51 116.81 -128.48 150.94 50.06 49.53 0.40 41.36 7.08 0.80 0.07 0.37 0.00 49.25 1.05 32 W E E 57.66 13.11 26.62 40.09 127.77 -158.52 -123.15 143.40 12.23 87.75 0.02 11.51 0.55 0.04 0.00 0.01 0.00 87.51 0.36 33 M E E 3.14 26.67 20.38 47.63 126.44 -162.18 -123.66 140.14 1.61 98.39 0.00 1.53 0.05 0.00 0.00 0.00 0.00 98.38 0.03 34 N E E 25.11 15.93 28.24 44.10 130.39 -172.56 -129.79 146.81 0.44 99.56 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.58 0.00 35 W E E 6.62 25.06 22.20 47.28 126.02 -158.25 -118.26 141.27 0.29 99.71 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.73 0.00 36 V E E 14.30 17.58 25.21 42.72 128.35 -170.35 -126.47 142.48 0.21 99.79 0.00 0.18 0.00 0.00 0.00 0.00 0.00 99.81 0.00 37 R E E 39.65 18.31 22.05 39.63 124.44 -161.71 -116.04 137.57 0.34 99.66 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.69 0.00 38 Q E E 51.36 13.10 19.47 33.12 117.18 -148.14 -103.99 129.58 4.05 95.95 0.00 3.66 0.17 0.01 0.00 0.00 0.00 96.03 0.12 39 A C C 26.01 11.48 14.57 27.63 119.03 -137.22 -82.16 151.32 70.83 29.00 0.17 67.31 2.13 0.36 0.02 0.13 0.00 29.38 0.66 40 P C T 92.67 5.54 13.21 20.53 109.07 -83.14 -59.03 135.79 93.54 0.33 6.13 0.46 3.60 88.60 0.07 7.00 0.00 0.19 0.07 41 G C T 69.17 0.32 13.60 11.37 95.74 15.24 81.64 -4.80 93.40 0.12 6.48 0.50 3.08 88.77 0.09 7.45 0.00 0.06 0.04 42 K C T 128.63 3.64 12.47 17.56 105.73 69.81 -105.65 -3.22 87.34 3.71 8.95 9.97 25.45 50.08 0.28 10.98 0.00 2.46 0.77 43 G C C 31.04 4.66 17.04 22.92 127.29 -120.09 90.83 -168.50 64.28 35.54 0.17 48.40 13.53 1.97 0.03 0.20 0.00 34.75 1.12 44 L E E 56.89 16.19 13.75 29.72 115.95 -28.94 -76.88 136.70 26.01 73.96 0.02 23.38 1.15 0.07 0.00 0.02 0.00 75.24 0.14 45 E E E 69.31 10.40 21.43 32.43 127.94 -172.25 -127.38 141.05 1.09 98.90 0.00 0.92 0.06 0.00 0.00 0.00 0.00 99.00 0.02 46 W E E 83.91 15.99 19.78 35.40 110.56 -114.36 -73.56 127.98 0.16 99.84 0.00 0.14 0.00 0.00 0.00 0.00 0.00 99.85 0.00 47 V E E 11.08 20.19 21.21 41.77 101.74 175.91 -100.45 -32.07 1.11 98.89 0.00 0.72 0.24 0.01 0.00 0.00 0.00 99.02 0.00 48 A E E 3.90 21.23 22.12 43.78 143.01 -2.05 -158.76 155.13 0.31 99.69 0.00 0.22 0.02 0.00 0.00 0.00 0.00 99.75 0.00 49 N E E 34.42 15.33 24.27 39.44 127.57 -160.46 -129.89 138.28 0.99 99.01 0.00 0.84 0.04 0.00 0.00 0.00 0.00 99.10 0.02 50 I E E 13.16 19.68 17.79 38.12 118.93 -159.85 -115.22 126.34 4.08 95.87 0.05 3.56 0.38 0.05 0.02 0.03 0.00 95.41 0.54 51 K C E 76.10 8.24 19.89 28.81 121.15 -148.85 -88.45 154.59 51.56 48.10 0.34 46.83 2.63 0.75 0.07 0.26 0.00 48.39 1.08 52 Q C T 95.83 11.77 13.06 25.05 93.48 -111.54 -64.29 -24.82 91.18 5.50 3.32 5.67 13.26 71.76 0.19 3.60 0.00 4.89 0.63 53 D C T 109.93 1.74 16.12 17.49 94.82 57.17 -86.32 1.28 95.35 1.01 3.64 2.82 11.79 80.14 0.16 4.12 0.00 0.71 0.26 54 G C S 42.90 6.86 12.58 20.64 98.93 -99.56 88.98 3.39 94.48 1.70 3.82 14.50 62.59 17.07 0.25 3.95 0.00 1.09 0.55 55 S C C 60.10 4.24 14.72 20.45 116.66 129.68 -79.41 150.27 90.46 8.66 0.88 63.84 21.70 4.80 0.17 0.85 0.00 7.33 1.31 56 E C C 99.14 10.27 13.87 24.78 119.55 -138.21 -106.22 132.77 60.93 38.40 0.67 50.71 7.70 1.50 0.13 0.60 0.00 38.03 1.33 57 K E E 99.75 9.67 16.75 27.39 125.06 -173.60 -121.36 139.00 25.37 74.19 0.43 21.65 2.89 0.59 0.11 0.31 0.00 73.40 1.04 58 Y E E 87.12 12.87 17.46 30.62 126.37 -164.76 -127.50 140.07 11.66 88.08 0.27 9.96 1.38 0.30 0.10 0.17 0.00 86.21 1.88 59 Y E E 83.38 13.51 17.42 31.01 127.63 -173.22 -126.17 141.90 25.66 74.03 0.31 23.23 1.85 0.38 0.13 0.20 0.00 71.01 3.20 60 V C C 31.86 15.96 13.93 30.21 119.81 -149.86 -102.40 141.35 83.55 16.09 0.36 78.20 4.60 0.45 0.13 0.20 0.00 14.91 1.52 61 D C G 108.21 2.87 18.29 21.98 93.71 -117.47 -61.16 -37.16 51.84 0.93 47.23 2.99 7.62 40.57 2.86 45.00 0.01 0.60 0.35 62 S C T 59.24 7.72 17.23 25.97 91.87 57.95 -70.23 -19.71 53.81 0.36 45.82 1.20 4.52 47.31 2.32 44.25 0.01 0.22 0.18 63 V C T 10.66 21.93 11.11 33.01 98.29 44.21 -102.79 -1.56 54.12 1.61 44.27 2.70 6.01 45.06 2.82 41.69 0.02 1.05 0.64 64 K C T 122.06 7.00 14.91 24.32 110.62 124.29 -60.19 130.38 92.38 3.59 4.04 2.83 4.28 86.04 1.18 2.03 0.01 2.06 1.57 65 G C T 60.98 1.48 18.66 19.41 93.80 13.66 81.51 -2.92 96.59 0.56 2.85 1.02 4.18 91.98 0.38 1.89 0.00 0.42 0.14 66 R C T 88.25 11.81 17.33 29.48 100.50 77.59 -101.31 -21.53 95.34 2.27 2.39 7.65 21.64 65.97 0.32 1.92 0.00 2.21 0.28 67 F E E 9.60 23.65 13.04 37.06 136.66 31.46 -139.60 153.97 12.99 86.97 0.05 9.57 3.53 0.20 0.01 0.04 0.00 84.72 1.93 68 T E E 60.38 6.92 26.48 34.08 125.66 -153.89 -124.29 138.08 2.33 97.66 0.01 2.19 0.08 0.00 0.00 0.00 0.00 97.65 0.07 69 I E E 17.29 24.38 15.39 39.68 122.27 -158.90 -117.66 130.10 1.82 98.17 0.01 1.74 0.04 0.00 0.00 0.00 0.00 98.17 0.04 70 S E E 44.42 7.78 25.67 33.76 132.23 -175.79 -130.75 150.17 3.32 96.67 0.01 2.94 0.19 0.02 0.00 0.00 0.00 96.78 0.07 71 R E E 79.09 18.96 14.55 32.33 125.04 -156.97 -123.33 135.31 7.36 92.58 0.06 6.37 0.88 0.11 0.02 0.03 0.00 92.09 0.50 72 D E E 54.71 7.54 17.68 26.77 108.95 -152.17 -103.87 106.28 31.92 67.92 0.16 30.18 1.31 0.24 0.05 0.11 0.00 66.20 1.90 73 N C T 91.72 8.76 13.37 23.69 93.70 -166.42 -68.25 -25.61 87.40 0.60 12.00 2.48 11.73 71.49 0.38 13.32 0.00 0.40 0.19 74 A C T 87.40 1.40 16.07 16.94 92.97 57.31 -70.24 -34.16 86.91 0.78 12.32 1.46 11.13 72.63 0.35 13.65 0.00 0.51 0.27 75 K C T 112.16 4.44 16.42 21.56 98.36 31.29 -98.18 -3.57 89.12 0.28 10.60 2.38 13.27 71.40 0.30 12.36 0.00 0.17 0.12 76 N C T 59.00 13.18 15.93 29.86 95.46 -128.21 56.58 41.92 99.25 0.33 0.42 8.91 11.42 78.98 0.05 0.34 0.00 0.25 0.05 77 S E E 20.39 12.49 21.90 35.51 136.24 124.77 -136.10 157.57 23.12 76.84 0.04 19.04 3.50 0.20 0.01 0.04 0.00 74.48 2.73 78 L E E 5.33 24.80 18.69 44.05 122.79 -150.48 -117.85 134.60 4.66 95.34 0.00 4.50 0.13 0.01 0.00 0.00 0.00 95.07 0.28 79 Y E E 53.25 12.79 27.13 40.40 121.96 -162.97 -115.31 133.50 3.97 96.03 0.00 3.47 0.14 0.00 0.00 0.00 0.00 96.37 0.01 80 L E E 3.31 26.05 19.73 46.54 120.04 -163.81 -112.56 128.83 0.29 99.71 0.00 0.27 0.00 0.00 0.00 0.00 0.00 99.73 0.00 81 Q E E 56.94 11.04 27.24 38.74 119.38 -162.79 -113.04 127.70 0.10 99.90 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.89 0.01 82 M E E 9.27 24.31 16.69 41.28 119.63 -167.18 -115.24 127.16 11.96 88.04 0.00 12.21 0.07 0.00 0.00 0.00 0.00 87.14 0.58 83 N C S 70.58 7.41 22.65 30.29 121.55 -157.15 -97.39 153.02 96.75 3.22 0.04 45.87 47.32 3.08 0.00 0.06 0.00 3.52 0.15 84 S C S 63.89 5.07 24.07 29.32 97.65 8.75 58.90 53.32 99.27 0.71 0.02 9.23 87.19 2.93 0.00 0.02 0.00 0.53 0.09 85 L C C 15.50 24.42 11.30 35.53 114.69 -155.27 -73.79 136.13 98.98 1.01 0.01 98.59 0.66 0.01 0.00 0.00 0.00 0.33 0.40 86 R C C 98.86 5.12 25.13 30.38 133.72 172.08 -131.14 162.71 98.46 1.50 0.04 98.38 0.35 0.01 0.01 0.01 0.00 0.28 0.96 87 A H G 45.49 15.61 15.95 31.18 91.05 -102.36 -59.75 -33.03 3.62 0.03 96.36 0.21 0.24 2.18 0.22 97.14 0.00 0.02 0.00 88 E H G 120.40 4.34 22.54 27.66 89.90 62.85 -71.35 -15.45 3.09 0.03 96.88 0.12 0.19 1.98 0.19 97.51 0.00 0.03 0.00 89 D H G 12.14 21.66 17.38 39.28 94.54 67.65 -84.29 1.28 4.90 0.06 95.04 1.04 0.53 1.58 0.28 96.52 0.00 0.04 0.00 90 T C C 31.88 17.48 22.24 39.31 114.75 110.32 -80.61 132.65 92.83 7.09 0.07 90.49 2.73 0.09 0.01 0.06 0.00 6.34 0.28 91 A E E 10.07 19.28 24.29 42.91 142.64 147.02 -152.31 167.56 3.33 96.67 0.00 3.19 0.14 0.01 0.00 0.00 0.00 96.36 0.30 92 V E E 23.22 18.27 26.24 43.96 118.97 -106.46 -104.40 132.77 0.43 99.57 0.00 0.44 0.01 0.00 0.00 0.00 0.00 99.54 0.01 93 Y E E 6.13 25.33 23.09 48.17 123.34 -164.88 -113.75 136.97 0.23 99.77 0.00 0.21 0.01 0.00 0.00 0.00 0.00 99.78 0.00 94 Y E E 23.40 20.15 28.08 47.15 129.81 -170.71 -126.72 146.05 1.00 98.99 0.01 0.86 0.04 0.00 0.00 0.00 0.00 99.07 0.02 95 C E E 2.57 25.57 24.49 49.76 129.19 -167.27 -129.41 144.87 8.09 91.80 0.11 6.92 0.65 0.10 0.03 0.05 0.00 92.02 0.23 96 A E E 9.64 19.12 26.27 44.87 128.09 -159.87 -122.22 144.72 13.58 86.07 0.34 12.26 1.06 0.23 0.16 0.18 0.00 84.89 1.23 97 L E E 25.53 19.65 21.46 40.36 120.02 -148.75 -105.88 136.95 39.11 60.10 0.79 32.08 6.30 1.25 0.28 0.56 0.00 56.68 2.84 98 S C C 38.88 12.70 20.29 32.92 116.18 -138.05 -98.50 135.50 67.74 30.20 2.06 45.94 17.26 5.35 0.44 1.69 0.00 27.28 2.04 99 S C C 59.36 9.84 17.06 27.16 107.02 -134.40 -91.57 63.88 79.57 14.03 6.39 37.58 23.92 19.61 1.20 5.14 0.02 10.09 2.44 100 G C C 40.47 7.54 15.54 23.84 113.57 54.33 92.65 -13.06 84.22 7.23 8.55 33.43 26.53 25.20 1.56 6.81 0.01 4.07 2.40 101 Y C C 140.98 6.59 13.76 21.47 107.10 -34.50 -89.98 50.40 79.73 7.23 13.05 30.17 26.41 24.35 3.04 9.11 0.04 3.44 3.43 102 S C T 70.19 5.74 13.68 20.65 108.72 74.81 -93.34 81.54 82.51 3.22 14.26 22.45 25.50 35.28 3.54 9.92 0.02 1.57 1.74 103 G C T 43.82 6.17 14.63 21.83 106.21 -38.30 69.59 -37.09 81.86 2.70 15.44 23.39 26.55 32.62 4.01 10.60 0.02 1.25 1.56 104 Y C C 139.68 6.66 14.94 22.49 101.78 42.44 -78.76 -12.74 72.85 5.17 21.99 28.78 21.54 23.84 5.92 14.64 0.04 2.33 2.92 105 A C T 57.53 9.10 15.66 25.32 100.03 62.62 -76.81 -4.20 71.16 4.40 24.45 21.19 18.15 33.18 5.59 17.41 0.05 2.34 2.08 106 G C C 29.57 12.23 17.39 29.39 104.67 45.44 -54.36 -23.73 72.45 5.58 21.96 28.28 17.56 28.26 4.58 16.09 0.02 3.21 1.99 107 N C C 60.88 13.28 18.41 31.43 107.20 85.89 -89.69 78.71 70.57 13.01 16.42 42.83 15.57 12.96 4.33 12.08 0.03 8.93 3.29 108 Y C C 78.42 14.89 20.44 34.71 115.57 131.69 -98.50 126.21 55.89 36.45 7.66 35.59 11.92 8.09 3.27 4.79 0.12 24.47 11.74 109 W C C 52.49 19.87 19.22 37.74 107.94 -157.48 -96.47 45.41 49.15 47.86 2.99 34.02 9.23 6.15 1.49 1.86 0.05 29.96 17.24 110 G C C 18.63 16.14 21.12 35.96 122.81 -141.69 23.95 -151.69 74.84 23.79 1.36 44.98 21.05 9.56 0.33 1.19 0.00 19.57 3.31 111 Q C C 98.97 8.85 23.93 32.67 98.54 -53.96 -80.82 0.97 81.24 17.88 0.89 48.05 27.74 5.94 0.15 0.84 0.00 15.47 1.82 112 G C C 12.46 18.84 19.13 36.60 126.82 -122.58 89.52 177.47 67.22 32.54 0.23 51.61 12.34 1.98 0.03 0.25 0.00 32.92 0.88 113 T E E 21.11 18.92 21.39 39.91 125.36 -96.84 -116.71 140.44 11.46 88.52 0.02 10.43 0.77 0.04 0.00 0.01 0.00 88.30 0.44 114 L E E 67.98 12.21 24.83 36.80 116.45 -134.71 -94.70 129.65 1.28 98.72 0.00 1.17 0.04 0.00 0.00 0.00 0.00 98.75 0.04 115 V E E 7.36 24.30 16.95 41.57 121.54 -166.46 -114.99 130.86 0.55 99.45 0.00 0.54 0.01 0.00 0.00 0.00 0.00 99.44 0.01 116 T E E 56.64 8.06 25.56 33.99 119.33 -154.98 -104.15 131.92 1.07 98.93 0.00 1.03 0.03 0.00 0.00 0.00 0.00 98.88 0.06 117 V E E 18.51 22.27 12.86 34.51 119.97 -160.56 -108.33 133.43 14.90 85.07 0.03 13.85 0.72 0.06 0.01 0.02 0.00 84.66 0.69 118 S C C 56.97 6.13 17.99 24.85 123.94 -155.32 -102.53 156.28 60.97 38.94 0.09 58.83 1.02 0.25 0.02 0.06 0.00 38.60 1.22 119 S C C 75.65 5.93 15.74 22.89 108.11 -98.48 -77.08 128.60 99.82 0.17 0.01 99.74 0.11 0.03 0.00 0.00 0.00 0.11 0.01