# 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 115.82 5.38 20.03 26.21 117.66 -144.61 -95.61 134.63 99.64 0.36 0.00 99.63 0.07 0.01 0.00 0.00 0.00 0.27 0.01 1 I C C 44.71 18.42 12.05 29.91 117.38 -147.54 -100.49 128.96 59.37 40.54 0.09 58.83 0.40 0.16 0.02 0.05 0.00 39.89 0.66 2 V E E 68.93 7.09 19.91 27.99 119.12 -164.52 -112.93 130.44 17.35 82.52 0.14 15.89 1.19 0.23 0.04 0.09 0.00 81.73 0.82 3 M E E 47.25 18.53 13.60 31.71 120.13 -159.17 -108.74 130.51 10.66 89.24 0.10 9.74 0.79 0.18 0.03 0.07 0.00 88.52 0.66 4 T E E 68.38 7.46 20.29 28.55 125.53 -170.73 -121.24 139.28 16.83 83.03 0.15 15.01 1.44 0.28 0.04 0.10 0.00 82.00 1.14 5 Q E E 69.25 14.14 14.99 29.15 126.30 -160.66 -123.83 140.56 45.78 54.01 0.21 35.21 9.87 0.87 0.04 0.19 0.00 52.63 1.18 6 S C C 59.50 7.51 18.06 26.50 120.96 -133.18 -97.84 147.02 79.10 20.76 0.14 47.64 29.83 1.29 0.02 0.15 0.00 20.33 0.75 7 P C C 68.36 8.42 16.89 26.20 113.78 -28.69 -68.99 148.50 87.74 11.96 0.30 58.78 24.53 3.24 0.03 0.34 0.00 12.64 0.45 8 A C E 46.47 13.46 15.33 28.80 100.44 -151.22 -85.04 -15.24 53.33 46.29 0.38 39.44 11.86 1.80 0.04 0.40 0.00 45.64 0.82 9 T E E 76.99 7.00 19.98 28.12 127.74 12.70 -127.70 139.74 17.22 82.69 0.09 15.25 1.56 0.19 0.01 0.07 0.00 82.52 0.41 10 L E E 29.82 19.56 14.44 33.57 128.39 -174.39 -131.83 140.07 3.16 96.84 0.01 2.91 0.17 0.01 0.00 0.00 0.00 96.79 0.12 11 S E E 65.51 6.12 23.33 30.52 122.24 -156.50 -114.56 135.08 2.07 97.93 0.00 1.91 0.10 0.01 0.00 0.00 0.00 97.93 0.06 12 V E E 15.46 20.88 13.59 34.31 132.94 173.44 -137.57 151.28 9.52 90.47 0.01 9.21 0.36 0.01 0.00 0.00 0.00 89.38 1.03 13 S C C 52.77 4.75 23.39 27.83 122.20 -123.83 -85.89 157.83 92.77 7.20 0.02 91.99 1.02 0.08 0.00 0.01 0.00 6.44 0.45 14 P C T 59.87 13.83 14.27 28.23 109.51 -81.39 -59.67 135.71 99.35 0.29 0.37 0.21 2.34 97.00 0.02 0.23 0.00 0.15 0.04 15 G C T 47.59 3.94 19.46 24.14 95.71 22.70 88.17 -6.23 99.42 0.24 0.34 0.38 2.72 96.47 0.02 0.23 0.00 0.16 0.02 16 E C C 82.31 8.32 17.47 26.96 122.12 120.34 -83.02 150.08 92.27 7.50 0.23 75.17 16.66 0.45 0.04 0.20 0.00 6.79 0.69 17 R E E 128.01 8.78 18.68 28.75 123.65 -135.66 -109.32 140.97 44.98 54.99 0.04 44.46 0.71 0.06 0.01 0.02 0.00 53.77 0.96 18 A E E 10.95 20.95 15.36 36.19 131.96 -173.31 -133.33 149.32 1.71 98.29 0.00 1.59 0.05 0.00 0.00 0.00 0.00 98.27 0.08 19 T E E 66.30 8.47 24.42 33.50 121.66 -146.93 -113.78 132.49 0.72 99.28 0.00 0.65 0.03 0.00 0.00 0.00 0.00 99.30 0.02 20 L E E 7.00 25.07 16.78 42.19 122.68 -168.72 -116.29 134.14 3.68 96.32 0.00 3.21 0.24 0.01 0.00 0.00 0.00 96.47 0.06 21 S E E 37.03 9.99 26.57 37.08 125.13 -164.85 -117.13 142.55 12.91 87.08 0.01 11.64 0.65 0.03 0.00 0.01 0.00 87.55 0.11 22 C E E 5.34 25.20 16.89 42.32 130.35 -175.42 -133.99 144.94 13.14 86.84 0.02 12.00 0.69 0.05 0.00 0.02 0.00 86.99 0.25 23 R E E 110.21 6.90 26.93 34.67 120.63 -155.60 -114.68 132.48 6.78 93.17 0.05 6.21 0.44 0.06 0.02 0.03 0.00 91.17 2.07 24 A E E 10.00 23.73 13.66 36.96 122.20 -157.83 -102.01 142.00 39.27 60.43 0.30 36.69 1.84 0.31 0.12 0.19 0.00 58.08 2.77 25 S C C 52.13 7.09 20.46 27.95 116.87 -147.86 -91.96 156.98 79.21 20.03 0.77 51.09 24.51 3.56 0.13 0.73 0.00 18.70 1.28 26 Q C S 118.14 5.22 17.71 23.66 107.19 -60.60 -88.98 -4.44 89.81 7.10 3.09 20.18 53.68 16.52 0.51 2.30 0.00 5.67 1.14 27 S C C 66.00 6.01 18.53 25.24 112.91 45.47 -93.85 120.96 90.01 6.08 3.91 42.35 30.47 17.43 0.65 3.49 0.00 4.22 1.38 28 I C C 55.84 16.76 14.87 30.75 109.39 -129.52 -91.89 117.71 83.81 9.69 6.50 41.56 25.27 17.47 1.22 5.48 0.01 6.19 2.79 29 S C C 38.51 12.43 18.81 31.45 122.03 139.71 -108.20 147.75 84.57 9.45 5.97 54.34 15.95 14.07 0.92 5.60 0.00 7.15 1.97 30 S C S 53.92 11.41 20.28 31.54 105.01 -144.72 -97.95 -0.89 83.69 12.53 3.78 27.44 39.25 17.77 0.42 3.36 0.00 10.58 1.17 31 N C C 65.14 10.81 23.48 34.33 111.75 56.17 -100.52 97.83 62.15 35.13 2.72 33.79 15.47 13.45 0.29 2.53 0.00 33.58 0.88 32 L E E 5.96 25.19 17.63 43.01 124.42 142.18 -112.47 140.37 19.41 80.52 0.07 17.20 1.63 0.16 0.01 0.05 0.00 80.54 0.40 33 A E E 12.80 16.44 27.53 44.07 132.48 -173.22 -130.72 149.97 1.53 98.46 0.01 1.43 0.06 0.01 0.00 0.00 0.00 98.46 0.05 34 W E E 10.09 24.40 22.56 46.85 124.78 -148.13 -114.17 138.79 0.57 99.43 0.00 0.51 0.02 0.00 0.00 0.00 0.00 99.45 0.01 35 Y E E 24.70 17.11 23.61 40.72 132.66 -174.53 -131.03 150.37 0.71 99.29 0.00 0.62 0.02 0.00 0.00 0.00 0.00 99.33 0.02 36 Q E E 44.44 14.35 21.39 35.96 121.90 -144.09 -110.70 134.34 3.02 96.98 0.00 2.55 0.21 0.01 0.00 0.00 0.00 97.14 0.08 37 Q E E 53.79 14.06 15.25 29.80 118.48 -148.52 -102.30 136.25 29.79 70.19 0.02 27.26 1.56 0.07 0.00 0.02 0.00 69.72 1.36 38 K C C 100.52 6.04 15.28 22.68 119.22 -139.60 -90.09 147.10 98.05 1.92 0.03 96.10 2.00 0.20 0.01 0.02 0.00 1.35 0.32 39 P C T 106.44 3.45 11.23 16.71 109.28 -83.87 -58.53 134.21 99.68 0.09 0.23 0.30 3.07 96.34 0.01 0.21 0.00 0.05 0.02 40 G C T 69.61 0.24 12.81 10.16 95.17 17.55 83.28 -2.96 99.69 0.06 0.25 0.40 3.03 96.26 0.00 0.25 0.00 0.04 0.01 41 Q C S 89.29 5.48 9.66 17.30 128.94 96.57 -114.90 158.37 94.00 5.67 0.33 40.05 52.97 1.08 0.06 0.27 0.00 1.93 3.64 42 A C C 77.48 2.06 17.19 19.13 116.76 -97.91 -69.31 149.96 97.47 2.50 0.03 86.79 10.68 0.19 0.01 0.03 0.00 1.97 0.34 43 P C C 48.96 17.09 11.48 27.96 114.85 -99.19 -65.59 143.98 92.80 7.17 0.03 90.49 2.13 0.14 0.00 0.03 0.00 6.99 0.22 44 R E E 100.91 8.80 21.00 30.52 124.89 -161.37 -122.90 139.14 7.62 92.33 0.05 6.78 0.66 0.06 0.02 0.03 0.00 91.67 0.77 45 L E E 59.46 16.07 18.75 34.33 110.84 -114.90 -75.15 127.07 1.23 98.75 0.01 1.10 0.06 0.01 0.00 0.00 0.00 98.78 0.05 46 L E E 19.32 19.33 21.41 40.51 101.42 176.17 -96.10 -33.09 2.77 97.21 0.03 1.89 0.69 0.04 0.01 0.01 0.00 97.33 0.03 47 I E E 11.55 21.68 21.81 43.22 135.40 5.42 -145.42 142.53 1.00 98.98 0.02 0.81 0.08 0.01 0.01 0.00 0.00 99.04 0.05 48 Y E E 64.40 16.62 23.46 38.99 128.74 -173.51 -131.47 138.57 8.12 91.70 0.18 6.61 1.05 0.27 0.06 0.09 0.00 91.63 0.29 49 G C E 12.54 18.16 20.77 37.84 126.90 143.52 -133.86 168.13 55.57 42.87 1.56 31.71 18.58 6.34 0.38 1.08 0.01 40.93 0.98 50 A C C 43.04 12.93 20.40 33.01 106.11 -103.79 -92.07 9.72 71.66 21.60 6.74 32.19 26.46 15.08 2.05 4.19 0.06 17.46 2.51 51 S C C 45.21 11.37 18.31 29.90 117.82 65.50 -106.01 142.90 75.06 13.50 11.43 32.81 25.94 18.32 3.76 6.83 0.08 9.22 3.03 52 T C C 76.63 9.67 17.02 26.93 103.31 -133.25 -90.42 5.20 67.16 16.73 16.11 32.56 20.68 15.76 6.81 8.43 0.17 11.49 4.10 53 R C C 129.85 7.10 16.83 24.88 110.21 79.02 -93.29 105.40 62.44 21.94 15.62 36.40 14.69 12.59 7.15 8.19 0.14 15.79 5.06 54 A C C 45.57 13.63 12.68 26.13 109.94 -148.14 -87.85 111.60 62.99 22.77 14.24 35.56 13.44 14.30 6.26 7.85 0.15 15.50 6.95 55 T C T 85.87 6.36 16.00 23.36 107.38 -92.06 -90.65 84.79 84.27 7.06 8.68 17.26 16.85 50.72 3.08 5.09 0.04 4.82 2.13 56 G C T 52.76 3.88 17.75 22.50 100.05 -32.55 83.76 -0.33 92.15 4.67 3.18 15.12 27.01 50.43 0.56 2.45 0.00 3.52 0.91 57 I C C 48.26 15.39 12.79 28.48 118.74 105.90 -103.47 130.12 70.80 28.48 0.72 41.30 29.31 1.77 0.32 0.48 0.01 16.21 10.60 58 P C C 62.50 8.11 19.57 28.43 112.19 -112.43 -67.40 144.76 75.04 22.99 1.98 61.55 8.68 3.61 0.69 1.45 0.00 19.34 4.69 59 A C C 39.08 17.09 15.07 31.30 105.72 -134.48 -77.14 44.57 80.24 15.87 3.89 53.07 18.05 9.41 0.68 3.33 0.00 14.12 1.33 60 R C C 115.67 7.79 22.99 31.21 121.83 62.05 -119.64 134.87 57.61 38.89 3.51 39.39 12.91 6.14 0.74 2.51 0.00 36.78 1.52 61 F E E 28.87 23.10 14.00 36.39 124.01 -170.02 -117.03 140.46 22.42 76.80 0.77 19.51 2.71 0.72 0.33 0.43 0.00 74.56 1.75 62 S E E 54.60 6.66 24.23 31.97 134.48 -175.98 -136.60 156.03 10.24 89.52 0.24 8.89 1.09 0.25 0.09 0.10 0.00 88.83 0.75 63 G E E 24.10 17.18 15.68 31.89 140.66 157.47 -159.46 169.06 12.25 87.60 0.15 10.13 1.72 0.33 0.04 0.08 0.00 87.10 0.60 64 S E E 66.93 4.79 21.38 27.75 134.29 -151.06 -142.57 155.01 18.44 81.41 0.15 15.58 2.30 0.45 0.03 0.11 0.00 80.88 0.64 65 G E E 30.03 11.25 15.36 27.30 139.86 127.67 104.99 164.33 34.87 64.89 0.23 23.03 11.21 1.98 0.03 0.24 0.00 62.51 1.00 66 S C E 77.85 3.08 20.91 24.35 113.26 -109.35 -115.25 95.97 55.86 43.56 0.58 34.08 18.27 5.40 0.10 0.64 0.00 37.97 3.53 67 G C S 32.34 10.47 18.91 29.35 108.69 -53.34 66.67 -121.63 98.27 1.20 0.53 2.29 52.36 43.79 0.02 0.52 0.00 0.88 0.14 68 T C S 52.28 15.03 16.77 31.57 98.04 -7.96 -99.40 -1.17 98.21 1.38 0.41 2.26 53.18 42.91 0.01 0.39 0.00 1.13 0.12 69 E E E 77.17 8.83 22.66 32.70 122.01 84.33 -110.95 133.77 26.24 73.66 0.09 18.78 7.17 0.63 0.02 0.11 0.00 70.61 2.69 70 F E E 7.14 24.77 16.11 41.40 128.39 -174.27 -127.72 141.61 9.12 90.88 0.00 8.77 0.23 0.01 0.00 0.00 0.00 90.67 0.31 71 T E E 35.26 10.34 27.19 38.63 122.15 -159.34 -117.95 133.34 3.79 96.21 0.00 3.34 0.14 0.00 0.00 0.00 0.00 96.45 0.06 72 L E E 2.83 26.33 18.93 46.22 120.17 -164.37 -114.07 128.47 0.56 99.44 0.00 0.61 0.01 0.00 0.00 0.00 0.00 99.38 0.00 73 T E E 40.91 10.07 27.30 38.20 120.35 -165.32 -115.90 128.82 0.16 99.84 0.00 0.18 0.00 0.00 0.00 0.00 0.00 99.81 0.01 74 I E E 7.59 24.17 16.05 40.80 117.04 -164.36 -111.06 123.88 2.32 97.68 0.00 2.41 0.03 0.00 0.00 0.00 0.00 97.07 0.49 75 S C C 51.43 6.74 22.91 29.89 115.75 -166.67 -100.12 161.87 93.37 6.57 0.06 46.25 41.11 4.81 0.00 0.10 0.00 7.50 0.22 76 S C S 63.61 4.52 24.07 28.50 108.78 10.31 57.64 85.13 99.02 0.95 0.03 11.23 82.21 5.64 0.00 0.04 0.00 0.79 0.09 77 L C C 21.63 23.48 10.89 33.77 111.96 -139.64 -74.46 129.09 99.37 0.62 0.01 98.31 1.16 0.03 0.00 0.00 0.00 0.23 0.28 78 Q C C 79.56 4.34 23.76 27.94 132.56 164.24 -128.60 162.31 99.46 0.51 0.02 98.64 0.80 0.01 0.01 0.00 0.00 0.07 0.47 79 S H G 61.49 11.76 15.45 27.51 90.80 -101.91 -59.64 -31.45 3.48 0.02 96.50 0.18 0.23 2.26 0.28 97.04 0.00 0.01 0.00 80 E H G 121.82 4.43 21.40 26.62 90.82 63.15 -71.82 -15.73 2.95 0.03 97.02 0.10 0.17 2.04 0.19 97.49 0.00 0.02 0.00 81 D H G 13.46 20.92 16.54 37.79 94.34 59.28 -89.29 -3.92 3.74 0.05 96.22 0.41 0.36 1.86 0.26 97.08 0.00 0.04 0.00 82 F C C 42.40 18.04 20.81 38.66 118.17 101.29 -84.40 136.93 86.48 13.08 0.44 83.48 3.06 0.12 0.04 0.36 0.00 12.64 0.31 83 A E E 11.94 18.15 23.50 41.07 142.47 157.88 -153.58 170.13 3.93 96.06 0.01 3.69 0.23 0.01 0.00 0.00 0.00 95.78 0.28 84 V E E 29.66 16.03 25.67 41.53 118.72 -97.92 -105.49 130.69 0.34 99.66 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.67 0.01 85 Y E E 6.92 25.04 21.13 46.17 123.90 -166.26 -115.61 136.92 0.25 99.75 0.00 0.21 0.01 0.00 0.00 0.00 0.00 99.78 0.00 86 Y E E 30.66 16.85 27.31 43.88 129.56 -170.92 -124.99 144.96 1.03 98.96 0.00 0.86 0.06 0.00 0.00 0.00 0.00 99.04 0.02 87 C E E 3.07 25.41 21.28 46.94 123.11 -155.55 -116.04 135.32 6.66 93.29 0.04 5.58 0.80 0.07 0.01 0.02 0.00 93.35 0.16 88 Q E E 39.45 14.16 26.08 40.19 128.04 -170.20 -124.31 143.63 10.77 89.11 0.11 9.79 0.77 0.13 0.03 0.06 0.00 88.64 0.58 89 Q E E 36.57 18.33 18.67 36.43 118.22 -144.07 -97.48 136.63 28.58 71.04 0.38 24.04 4.09 0.92 0.10 0.28 0.00 69.44 1.13 90 S C C 40.40 11.43 17.23 29.39 117.06 -162.83 -109.59 133.11 57.99 41.31 0.70 43.50 11.53 3.20 0.14 0.66 0.00 39.05 1.92 91 N C C 85.68 7.74 13.75 22.60 117.82 162.05 -114.93 150.55 83.93 14.89 1.18 35.21 32.86 16.49 0.13 1.21 0.00 12.51 1.58 92 S C S 89.34 2.26 15.10 17.80 100.37 -34.67 -85.80 2.35 95.87 3.00 1.13 18.98 54.12 22.88 0.10 1.16 0.00 2.15 0.62 93 W C S 125.08 6.84 11.64 20.25 121.99 67.24 -112.82 137.77 92.80 6.17 1.03 22.27 61.66 9.07 0.16 0.89 0.00 4.44 1.50 94 P C C 85.62 4.40 16.46 21.66 113.73 -86.22 -68.99 148.90 88.32 10.41 1.27 54.01 24.81 9.41 0.18 1.29 0.00 9.24 1.05 95 L C C 64.40 15.48 12.96 27.99 114.18 -109.95 -76.30 136.33 70.47 28.18 1.36 57.34 8.27 3.58 0.25 1.19 0.00 27.65 1.71 96 T E E 57.27 10.13 19.55 30.25 123.36 -165.52 -116.18 139.14 38.20 60.88 0.92 32.64 3.57 1.24 0.39 0.61 0.00 55.66 5.88 97 F E E 70.10 17.37 16.44 32.77 118.44 -152.11 -101.88 134.56 34.13 65.04 0.83 25.10 7.26 2.41 0.33 0.64 0.01 57.10 7.14 98 G C C 25.52 13.21 19.17 31.84 118.35 -154.33 -84.37 -166.52 64.40 35.23 0.37 42.08 18.39 4.05 0.06 0.36 0.00 33.63 1.43 99 G C C 39.54 8.57 22.08 30.33 106.75 -76.49 -79.07 2.10 75.09 24.67 0.23 59.67 12.12 1.94 0.03 0.24 0.00 25.34 0.66 100 G C C 18.57 17.91 16.18 32.84 128.64 -137.11 90.83 174.03 60.31 39.59 0.11 52.96 4.81 0.46 0.01 0.09 0.00 41.08 0.58 101 T E E 36.45 14.67 20.06 34.86 128.11 -117.15 -124.18 145.25 7.39 92.59 0.02 6.68 0.40 0.02 0.00 0.01 0.00 92.66 0.22 102 K E E 102.69 10.08 22.37 32.72 119.96 -137.54 -101.77 134.56 1.05 98.94 0.00 0.90 0.06 0.00 0.00 0.00 0.00 99.01 0.03 103 V E E 11.85 22.51 14.87 37.32 121.95 -165.45 -116.86 132.54 0.80 99.19 0.00 0.76 0.02 0.00 0.00 0.00 0.00 99.21 0.01 104 E E E 96.26 5.68 23.51 29.62 117.48 -152.37 -103.42 129.26 1.58 98.41 0.00 1.57 0.04 0.00 0.00 0.00 0.00 98.32 0.07 105 I E E 26.50 20.76 10.96 31.01 115.27 -153.37 -98.86 126.86 15.88 84.08 0.04 16.07 0.22 0.03 0.01 0.01 0.00 83.03 0.62 106 K C C 131.63 3.77 19.78 24.32 112.89 -151.61 -92.65 127.27 99.31 0.68 0.00 99.37 0.06 0.01 0.00 0.00 0.00 0.55 0.01