# 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 Q C C 105.33 5.87 20.05 26.65 115.79 -148.81 -96.93 125.95 99.37 0.63 0.00 99.40 0.07 0.01 0.00 0.00 0.00 0.50 0.01 1 V E E 34.90 20.00 11.47 30.49 121.48 -160.62 -108.69 133.95 49.87 50.07 0.06 49.31 0.47 0.10 0.01 0.03 0.00 49.54 0.55 2 Q E E 93.09 5.35 22.25 28.25 122.00 -162.37 -114.73 135.95 13.38 86.54 0.09 12.09 1.01 0.22 0.03 0.06 0.00 86.20 0.38 3 L E E 42.28 20.55 13.76 33.57 119.03 -148.72 -103.18 130.65 8.12 91.79 0.08 7.65 0.44 0.10 0.02 0.05 0.00 91.45 0.30 4 V E E 60.67 8.83 21.68 31.21 123.20 -169.55 -119.80 135.00 10.02 89.85 0.13 9.20 0.67 0.13 0.04 0.07 0.00 89.33 0.56 5 Q E E 80.53 14.74 16.06 30.32 117.74 -142.98 -97.85 131.62 28.14 71.62 0.25 24.60 2.53 0.46 0.06 0.17 0.00 71.53 0.65 6 S C C 49.56 10.99 17.04 28.46 110.48 -163.09 -95.30 147.70 66.13 33.49 0.38 49.81 12.70 2.02 0.05 0.36 0.00 34.45 0.61 7 G C C 34.85 6.64 19.96 26.91 124.63 -96.66 108.64 -175.68 70.69 29.01 0.29 40.35 27.74 2.67 0.03 0.31 0.00 28.17 0.73 8 A C C 49.63 13.46 16.81 29.99 121.60 -64.27 -97.43 144.22 56.12 43.68 0.20 47.26 6.69 0.74 0.03 0.18 0.00 44.52 0.59 9 E E E 55.83 14.81 18.27 33.07 127.48 -166.88 -125.51 141.67 15.42 84.51 0.07 13.72 1.44 0.13 0.02 0.05 0.00 83.88 0.78 10 V E E 69.52 12.17 20.93 33.07 121.22 -154.31 -113.99 130.08 7.29 92.68 0.02 6.80 0.42 0.03 0.01 0.01 0.00 92.27 0.45 11 K E E 46.86 16.34 16.52 32.77 133.23 172.48 -132.03 151.56 13.92 86.06 0.02 13.61 0.52 0.02 0.01 0.01 0.00 82.68 3.14 12 K C C 107.25 5.05 22.50 27.63 119.37 -114.16 -78.63 151.38 95.37 4.61 0.02 94.18 1.34 0.07 0.01 0.01 0.00 4.00 0.39 13 P C T 63.81 13.13 13.88 27.33 110.16 -82.50 -59.04 138.03 99.58 0.27 0.16 0.22 2.21 97.26 0.00 0.11 0.00 0.16 0.03 14 G C T 50.41 3.26 19.30 23.20 95.50 23.34 88.16 -6.09 99.71 0.18 0.11 0.34 2.43 97.00 0.00 0.08 0.00 0.13 0.01 15 S C C 40.06 9.41 16.15 26.88 124.10 118.53 -86.48 160.40 92.72 7.22 0.06 77.84 14.98 0.23 0.01 0.07 0.00 6.08 0.79 16 S C C 57.47 9.41 19.64 29.86 127.95 -130.65 -121.02 148.23 59.50 40.49 0.01 59.21 0.73 0.03 0.00 0.01 0.00 39.27 0.75 17 V E E 11.75 22.71 15.46 38.27 126.79 -163.97 -126.06 139.25 2.68 97.32 0.00 2.63 0.06 0.00 0.00 0.00 0.00 97.22 0.09 18 K E E 107.40 6.91 25.26 33.01 116.75 -143.95 -100.15 129.99 0.62 99.38 0.00 0.60 0.01 0.00 0.00 0.00 0.00 99.37 0.01 19 V E E 3.91 26.30 15.93 43.11 122.58 -168.32 -117.87 132.83 1.92 98.07 0.00 1.87 0.05 0.00 0.00 0.00 0.00 98.01 0.07 20 S E E 37.30 9.18 27.20 37.10 127.11 -167.47 -119.25 144.29 14.54 85.43 0.03 13.46 0.60 0.05 0.00 0.01 0.00 85.75 0.12 21 C E E 5.21 26.02 15.90 42.35 130.99 -172.66 -133.99 145.18 21.89 78.04 0.07 20.66 0.90 0.09 0.02 0.04 0.00 78.00 0.30 22 K E E 99.32 6.56 27.22 34.83 124.57 -166.05 -122.43 137.09 9.76 90.10 0.14 8.91 0.87 0.16 0.07 0.07 0.00 88.10 1.82 23 A E E 11.31 23.99 13.98 37.49 123.64 -160.08 -110.51 138.86 27.00 72.77 0.23 25.36 1.36 0.25 0.10 0.14 0.00 70.25 2.54 24 S C C 58.29 6.84 21.95 29.23 124.52 -169.38 -117.75 147.75 59.54 40.01 0.45 39.90 15.40 4.83 0.07 0.48 0.00 37.92 1.39 25 G C S 47.67 3.82 19.74 24.17 113.32 13.46 96.45 -148.88 79.78 19.70 0.52 16.82 51.66 11.26 0.05 0.57 0.00 18.39 1.26 26 G C S 32.94 8.22 18.09 27.06 131.44 70.28 124.18 -174.45 81.76 17.55 0.69 33.54 42.45 6.67 0.09 0.76 0.00 14.41 2.08 27 T C C 72.99 7.72 20.98 29.24 121.87 -75.84 -110.21 139.92 82.63 16.28 1.10 59.13 17.56 5.67 0.21 1.18 0.00 12.18 4.07 28 F C C 32.95 21.99 12.94 33.90 107.30 -149.77 -92.72 52.87 79.18 14.97 5.85 57.23 12.83 8.48 1.34 5.02 0.01 9.84 5.25 29 S C C 70.17 5.99 21.08 27.68 97.43 106.51 -82.30 -17.19 82.72 8.19 9.09 28.97 27.44 27.24 1.13 7.90 0.01 5.66 1.64 30 S C S 58.48 8.13 21.06 29.35 102.36 41.68 -100.30 2.69 80.40 10.13 9.47 17.12 34.41 30.20 1.06 7.85 0.01 8.00 1.35 31 Y C C 45.97 18.74 18.42 36.31 124.19 85.18 -107.89 149.10 66.15 29.62 4.23 35.75 24.73 6.55 0.61 3.60 0.00 27.18 1.56 32 G E E 8.62 16.14 25.78 41.92 130.12 -144.42 -121.09 157.42 26.83 72.95 0.23 22.92 2.94 0.47 0.04 0.18 0.00 72.79 0.66 33 I E E 2.43 27.05 22.00 49.73 124.29 -148.56 -122.38 135.73 3.07 96.92 0.00 2.91 0.12 0.01 0.00 0.00 0.00 96.87 0.10 34 S E E 12.70 18.06 28.37 46.04 130.71 -174.21 -129.63 149.25 0.86 99.13 0.00 0.78 0.03 0.00 0.00 0.00 0.00 99.18 0.01 35 W E E 6.66 25.20 23.35 48.44 124.14 -155.35 -116.18 135.90 0.58 99.42 0.00 0.51 0.02 0.00 0.00 0.00 0.00 99.46 0.00 36 V E E 12.96 18.90 24.98 43.59 130.00 -171.41 -128.65 143.46 0.26 99.74 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.76 0.00 37 R E E 48.24 17.21 22.42 38.90 123.57 -156.16 -114.78 137.79 0.29 99.71 0.00 0.25 0.01 0.00 0.00 0.00 0.00 99.74 0.00 38 Q E E 58.72 13.23 18.57 32.19 116.93 -145.65 -101.83 128.88 3.07 96.93 0.00 2.75 0.13 0.01 0.00 0.00 0.00 96.95 0.15 39 A C C 27.69 11.31 14.08 26.97 118.31 -135.54 -80.40 153.05 79.90 19.97 0.13 77.55 1.28 0.25 0.02 0.09 0.00 20.27 0.54 40 P C T 97.73 4.61 13.02 19.49 109.44 -83.96 -58.73 135.08 95.32 0.21 4.47 0.28 2.90 91.86 0.05 4.76 0.00 0.11 0.05 41 G C T 69.54 0.29 13.30 10.92 95.70 14.71 82.13 -3.34 95.32 0.09 4.60 0.33 2.66 91.97 0.06 4.92 0.00 0.05 0.03 42 Q C S 107.21 4.81 11.64 18.06 107.04 79.36 -107.09 -1.95 87.89 4.79 7.32 14.74 37.47 34.46 0.32 8.85 0.00 3.16 1.01 43 G C C 32.88 4.43 16.97 22.55 126.69 -124.15 89.12 -168.11 72.98 26.88 0.14 55.61 16.07 1.22 0.02 0.16 0.00 25.83 1.08 44 L E E 59.81 15.49 13.82 29.30 116.37 -30.07 -75.46 137.52 25.61 74.37 0.02 22.59 1.40 0.08 0.00 0.02 0.00 75.75 0.17 45 E E E 73.36 10.50 21.52 32.47 127.78 -169.93 -126.25 141.02 0.96 99.04 0.00 0.79 0.06 0.00 0.00 0.00 0.00 99.12 0.02 46 W E E 84.88 16.65 20.31 36.48 111.42 -112.38 -73.37 128.63 0.29 99.71 0.00 0.24 0.01 0.00 0.00 0.00 0.00 99.73 0.01 47 M E E 14.86 20.48 22.44 42.98 101.22 176.23 -102.04 -21.72 3.63 96.34 0.03 2.39 0.83 0.17 0.00 0.02 0.00 96.55 0.03 48 G E E 2.44 19.37 24.42 44.13 144.71 -49.24 163.26 176.12 4.81 95.13 0.06 2.84 1.18 0.33 0.01 0.03 0.00 95.54 0.06 49 G E E 6.23 19.94 25.02 44.12 143.13 -132.79 -150.39 166.18 6.39 93.54 0.07 5.44 0.60 0.10 0.01 0.03 0.00 93.66 0.15 50 I E E 16.64 20.95 22.46 43.09 122.52 -101.81 -115.55 134.49 5.43 94.42 0.15 4.56 0.67 0.14 0.07 0.07 0.00 93.56 0.94 51 I E E 33.49 14.54 21.88 36.90 118.09 -162.52 -110.95 128.81 20.21 79.01 0.78 16.41 3.15 0.97 0.28 0.46 0.00 77.70 1.04 52 G C E 18.46 13.96 17.49 31.63 117.04 -129.43 -82.54 152.22 56.45 38.84 4.71 36.88 10.68 8.21 0.85 3.59 0.00 38.82 0.98 53 M C T 84.27 12.05 15.83 27.72 102.95 -128.79 -88.05 -0.80 64.85 26.03 9.12 11.16 17.24 38.64 1.30 7.37 0.08 21.59 2.62 54 F C T 137.21 4.61 15.43 20.92 100.99 32.86 -90.63 35.37 84.42 6.27 9.31 8.03 15.51 60.42 0.95 8.79 0.01 5.09 1.21 55 G C T 52.53 3.44 14.77 19.18 101.75 -45.55 84.90 -0.82 87.07 8.62 4.31 17.66 34.01 35.78 0.44 3.97 0.00 6.92 1.21 56 T C C 71.86 6.64 14.61 22.62 119.02 118.01 -99.80 137.40 63.34 34.91 1.75 45.53 13.88 4.27 0.63 1.28 0.01 30.26 4.14 57 T E E 69.47 11.65 14.76 26.68 116.56 -142.72 -99.80 133.40 43.90 53.42 2.68 32.35 9.16 3.34 1.21 1.63 0.01 48.78 3.53 58 N E E 65.06 11.48 18.42 30.14 119.54 -169.26 -117.24 127.65 36.73 58.65 4.63 25.16 8.99 4.37 2.18 2.62 0.01 54.40 2.26 59 Y E E 80.64 15.25 17.93 32.65 117.16 -170.95 -106.13 132.15 30.91 58.14 10.95 20.31 7.52 5.38 6.13 5.20 0.05 50.62 4.80 60 A C C 24.16 17.57 15.74 33.11 116.87 -132.79 -92.43 139.73 46.42 32.29 21.28 33.84 7.66 5.73 6.52 13.15 0.01 31.38 1.72 61 Q C C 85.13 10.68 18.49 29.48 117.15 -153.60 -99.31 137.42 52.09 26.46 21.44 35.23 10.83 7.53 5.70 14.26 0.03 24.89 1.52 62 K C C 119.16 5.94 20.43 27.37 118.35 -115.36 -95.85 134.32 49.43 31.33 19.24 34.21 9.10 8.13 4.77 12.72 0.04 29.31 1.73 63 F C E 58.36 18.90 10.53 28.34 117.13 -134.97 -101.82 132.63 47.90 45.00 7.10 37.16 7.18 4.06 3.72 3.70 0.03 38.43 5.72 64 Q C E 119.52 3.58 17.50 22.45 118.90 -168.56 -125.15 119.43 55.07 41.48 3.45 23.08 13.85 21.01 1.59 2.03 0.07 30.65 7.72 65 G C T 52.03 2.16 18.02 20.40 113.74 -20.61 70.93 -138.40 94.17 4.68 1.14 4.86 31.68 57.80 0.15 0.89 0.00 4.16 0.45 66 R C T 107.07 11.48 16.62 28.22 97.83 -16.03 -84.58 -13.58 93.76 5.60 0.64 6.17 37.62 49.62 0.05 0.58 0.00 5.63 0.33 67 V E E 12.16 23.00 13.08 36.07 122.70 77.49 -111.97 134.12 13.23 86.71 0.06 9.31 3.55 0.39 0.01 0.05 0.00 85.77 0.92 68 T E E 54.38 7.68 25.83 34.13 124.66 -167.40 -121.93 137.03 2.67 97.32 0.01 2.29 0.18 0.01 0.00 0.00 0.00 97.43 0.09 69 I E E 12.63 24.66 15.78 40.52 121.66 -164.03 -118.91 131.46 1.76 98.23 0.01 1.58 0.06 0.01 0.00 0.00 0.00 98.30 0.05 70 T E E 62.73 6.44 26.84 33.84 125.62 -173.70 -127.17 138.53 3.90 96.06 0.04 3.36 0.34 0.06 0.01 0.01 0.00 96.07 0.15 71 A E E 21.12 22.34 12.92 34.33 125.26 -166.62 -118.93 140.74 26.46 73.29 0.25 23.35 2.81 0.41 0.08 0.16 0.00 72.16 1.03 72 D C C 63.93 6.75 19.78 27.20 115.50 -145.29 -101.13 127.82 83.21 16.44 0.35 78.87 2.95 0.78 0.09 0.25 0.00 15.84 1.22 73 E C T 120.07 8.32 14.90 24.48 93.17 -136.13 -64.72 -24.38 95.98 0.74 3.27 2.65 19.03 74.28 0.36 2.94 0.00 0.48 0.25 74 F C T 148.94 2.36 18.79 21.03 95.55 49.25 -88.15 -12.85 95.83 0.58 3.60 2.47 19.16 74.13 0.47 3.19 0.00 0.35 0.23 75 T C S 40.37 12.79 15.83 29.11 124.87 53.21 -119.02 143.58 92.23 3.90 3.87 24.95 47.29 20.09 0.53 3.43 0.00 2.33 1.37 76 S C S 39.34 15.14 18.18 33.26 97.77 -149.70 -87.58 2.24 95.96 3.46 0.58 15.29 66.03 14.57 0.06 0.56 0.00 3.05 0.43 77 T C E 40.71 11.39 23.52 35.87 126.15 89.57 -112.38 143.21 50.64 49.08 0.28 34.41 15.76 2.00 0.06 0.29 0.00 45.10 2.38 78 A E E 3.35 24.95 18.11 43.54 128.03 -170.45 -125.49 142.69 18.37 81.58 0.05 16.83 1.15 0.10 0.01 0.03 0.00 81.40 0.48 79 Y E E 60.05 12.71 27.13 40.24 124.96 -160.90 -120.44 137.28 3.19 96.81 0.01 2.76 0.19 0.02 0.00 0.00 0.00 96.98 0.05 80 M E E 4.46 25.65 19.49 45.66 122.97 -167.16 -119.17 133.23 0.38 99.62 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.62 0.00 81 E E E 68.64 10.21 27.28 38.02 117.68 -158.74 -108.92 125.49 0.34 99.66 0.00 0.36 0.00 0.00 0.00 0.00 0.00 99.61 0.03 82 L E E 7.03 24.87 16.26 41.63 117.31 -167.25 -109.64 125.58 14.22 85.78 0.01 14.40 0.12 0.01 0.00 0.00 0.00 84.70 0.77 83 S C C 48.42 7.43 23.05 30.66 124.74 -165.96 -105.49 155.63 94.21 5.68 0.10 46.49 40.81 6.08 0.00 0.17 0.00 6.20 0.25 84 S C S 65.37 4.92 24.21 29.22 96.79 10.91 59.85 54.98 98.73 1.21 0.05 12.24 80.51 5.99 0.00 0.07 0.00 1.04 0.15 85 L C C 15.48 24.41 10.73 34.88 113.65 -150.74 -73.68 133.20 98.79 1.20 0.01 98.00 1.01 0.02 0.00 0.00 0.00 0.44 0.52 86 R C C 100.32 4.71 24.25 29.01 133.36 -177.25 -129.75 163.18 98.69 1.27 0.04 97.82 0.83 0.02 0.01 0.02 0.00 0.24 1.05 87 S H G 59.11 12.34 16.09 28.59 90.99 -98.64 -60.09 -30.77 5.95 0.04 94.01 0.31 0.43 3.79 0.27 95.17 0.00 0.03 0.00 88 E H G 121.42 4.21 21.89 26.87 90.35 62.75 -72.39 -15.64 4.97 0.06 94.97 0.22 0.34 3.25 0.28 95.87 0.00 0.04 0.00 89 D H G 11.13 22.03 16.47 38.73 94.81 64.97 -84.65 -0.31 7.02 0.12 92.86 2.03 0.91 2.02 0.42 94.54 0.00 0.08 0.01 90 T C C 33.89 17.14 22.03 38.84 114.79 108.37 -81.43 133.40 85.07 14.63 0.30 81.46 3.76 0.20 0.04 0.24 0.00 13.62 0.68 91 A E E 11.59 18.79 24.31 42.42 143.29 151.32 -156.92 170.96 6.40 93.57 0.03 5.95 0.45 0.04 0.01 0.02 0.00 93.07 0.48 92 V E E 23.37 18.36 25.98 43.78 119.77 -106.29 -104.56 133.02 0.99 99.00 0.00 0.98 0.04 0.00 0.00 0.00 0.00 98.94 0.03 93 Y E E 7.14 24.96 23.35 47.99 123.20 -163.05 -113.52 136.61 0.74 99.25 0.01 0.69 0.04 0.00 0.00 0.00 0.00 99.24 0.02 94 Y E E 23.51 20.39 27.65 46.90 130.80 -170.79 -127.54 146.62 3.67 96.21 0.12 3.11 0.32 0.08 0.04 0.05 0.00 96.27 0.13 95 C E E 5.13 24.06 24.17 47.71 123.38 -158.91 -118.40 136.01 24.01 75.24 0.76 18.83 3.86 1.07 0.17 0.45 0.00 74.95 0.65 96 A E E 11.94 19.40 23.20 42.04 121.96 -147.25 -97.66 140.89 37.41 60.71 1.88 30.49 5.57 1.94 0.64 1.19 0.00 58.23 1.92 97 R C E 86.65 14.08 21.09 34.50 115.21 -150.58 -101.79 129.00 58.26 39.10 2.65 32.88 18.14 10.18 0.64 2.05 0.02 33.53 2.56 98 G C C 35.30 8.10 20.01 28.50 120.62 11.62 104.22 158.08 77.69 19.79 2.52 31.43 30.14 17.52 0.38 2.23 0.01 16.36 1.93 99 G C C 38.76 9.17 16.92 26.44 115.38 -22.71 95.41 -147.65 85.88 10.34 3.78 35.89 31.05 19.68 0.57 3.39 0.00 7.71 1.71 100 S C C 61.95 8.35 16.61 25.62 115.32 -91.94 -101.83 137.70 83.99 10.68 5.32 37.92 26.60 20.53 1.02 4.34 0.01 7.20 2.38 101 Y C C 108.26 11.00 15.10 26.46 112.61 -153.34 -100.27 117.05 77.97 14.81 7.22 37.88 24.60 16.89 1.98 5.08 0.03 9.63 3.91 102 Y C C 99.79 10.19 14.92 25.89 114.86 -165.83 -100.99 126.25 77.31 14.51 8.19 45.19 19.95 12.77 2.92 5.23 0.03 9.58 4.34 103 V C C 73.23 10.34 13.84 24.83 106.33 -161.19 -90.66 11.79 74.99 9.42 15.60 35.40 19.11 21.97 5.65 9.12 0.05 5.76 2.95 104 D C C 91.34 5.21 16.91 22.84 101.97 61.01 -80.89 -11.66 71.23 5.01 23.76 27.50 18.55 26.87 8.07 14.17 0.07 2.70 2.08 105 Y C T 98.34 11.30 16.12 27.44 101.41 52.05 -81.89 -15.79 63.30 5.78 30.92 20.15 16.63 28.33 10.50 18.62 0.17 3.36 2.26 106 F C C 57.45 16.76 15.33 31.37 116.67 61.08 -101.70 127.23 57.25 12.93 29.82 25.37 14.98 19.24 10.86 17.38 0.23 8.58 3.35 107 H C C 77.38 11.95 19.52 31.54 115.57 -160.14 -100.91 122.70 57.66 20.20 22.14 33.99 14.04 11.45 8.69 12.70 0.12 15.53 3.48 108 H C C 75.93 14.09 19.34 32.91 114.61 -149.15 -98.16 123.80 52.69 32.52 14.80 34.34 9.89 9.55 6.46 8.36 0.13 25.83 5.44 109 W C C 64.97 17.44 17.62 34.27 111.73 -164.33 -101.82 105.85 55.83 38.05 6.12 37.02 9.99 8.85 3.24 3.28 0.11 25.15 12.35 110 G C C 23.73 12.74 19.55 31.94 121.91 -127.61 81.92 -167.15 79.81 17.32 2.87 37.95 22.92 20.17 0.69 2.08 0.01 13.48 2.68 111 Q C S 104.84 7.97 21.45 29.58 100.60 -42.41 -80.94 28.24 83.63 13.69 2.69 17.55 37.82 28.88 0.42 2.14 0.01 11.14 2.03 112 G C S 18.58 15.02 19.50 33.82 125.02 -91.19 99.79 -170.78 78.95 20.16 0.89 26.84 36.72 15.37 0.08 0.92 0.00 18.92 1.14 113 T E E 21.64 19.85 19.38 38.61 120.63 -86.75 -106.80 135.16 36.95 62.94 0.11 31.19 4.65 0.48 0.02 0.10 0.00 62.73 0.84 114 L E E 64.77 11.84 25.12 36.78 116.16 -141.21 -97.18 128.44 5.81 94.18 0.01 5.32 0.36 0.02 0.00 0.01 0.00 94.04 0.26 115 V E E 9.80 24.04 17.12 41.20 121.17 -166.17 -112.61 130.71 1.79 98.21 0.00 1.77 0.04 0.00 0.00 0.00 0.00 98.14 0.05 116 T E E 54.73 8.47 25.29 34.11 120.08 -158.88 -109.40 133.47 1.80 98.20 0.00 1.75 0.06 0.00 0.00 0.00 0.00 98.08 0.11 117 V E E 27.02 20.77 13.50 33.52 119.02 -156.60 -105.16 131.05 11.75 88.20 0.04 10.80 0.69 0.08 0.01 0.02 0.00 87.70 0.69 118 S C C 53.96 6.79 17.31 24.98 126.47 -167.73 -111.18 157.72 55.57 44.33 0.10 53.43 1.10 0.24 0.02 0.07 0.00 44.00 1.13 119 S C C 77.28 5.27 15.75 22.33 108.20 -97.09 -77.63 137.15 99.67 0.32 0.01 99.57 0.15 0.03 0.00 0.00 0.00 0.23 0.01