# 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 M C C 118.09 5.63 14.01 21.04 117.85 -152.03 -104.04 127.51 98.77 1.22 0.02 98.88 0.15 0.05 0.00 0.01 0.00 0.83 0.08 1 V C C 66.95 10.03 10.15 21.24 123.41 -168.77 -116.31 135.52 74.10 25.68 0.21 73.97 0.79 0.40 0.09 0.09 0.00 21.16 3.49 2 N C C 117.98 2.17 15.14 18.05 112.07 -137.12 -91.91 120.12 72.19 27.58 0.23 61.64 8.24 1.47 0.06 0.22 0.00 24.46 3.90 3 V C C 57.89 13.54 9.46 23.16 119.09 -163.05 -106.37 133.43 82.37 17.59 0.04 74.10 8.50 0.18 0.01 0.04 0.00 15.72 1.45 4 P C C 54.53 8.03 12.80 22.73 114.27 -108.10 -65.96 149.49 85.68 13.75 0.57 83.21 1.95 0.79 0.11 0.40 0.00 12.33 1.21 5 K C S 153.06 2.70 14.30 18.39 95.74 -132.74 -73.38 -25.78 84.63 13.50 1.87 15.60 59.49 9.45 0.16 1.64 0.00 12.65 1.00 6 T E E 77.03 4.64 15.21 21.15 128.65 25.90 -129.91 146.46 45.87 51.85 2.28 22.16 17.58 8.00 0.21 2.04 0.00 49.04 0.96 7 R E E 102.79 11.28 12.73 24.78 125.62 -169.98 -126.63 139.07 27.68 71.09 1.23 23.24 3.95 1.02 0.26 0.86 0.00 69.81 0.85 8 K E E 102.57 8.37 16.11 25.61 120.97 -151.38 -110.58 136.12 14.23 85.51 0.26 12.91 1.03 0.22 0.10 0.13 0.00 84.89 0.72 9 T E E 52.57 11.06 15.47 27.57 125.14 -163.66 -120.81 141.43 11.37 88.48 0.15 10.07 1.03 0.18 0.04 0.08 0.00 87.99 0.62 10 F E E 87.06 9.67 16.02 26.69 116.96 -143.13 -97.20 135.03 23.29 76.16 0.55 18.78 4.43 1.02 0.17 0.37 0.00 73.91 1.32 11 C C C 32.37 12.35 11.64 25.33 122.91 -161.21 -115.25 140.22 60.65 38.69 0.66 50.90 7.42 1.50 0.18 0.53 0.00 37.80 1.67 12 K C C 134.14 3.53 15.32 19.87 113.80 -141.35 -94.01 135.79 75.29 21.09 3.62 44.41 22.84 9.37 0.99 2.66 0.02 16.43 3.28 13 G C T 41.91 4.12 13.04 18.26 118.39 5.20 79.28 -164.27 78.63 2.81 18.56 7.68 30.53 42.31 2.77 13.68 0.04 1.54 1.45 14 K C T 161.78 1.82 12.60 15.13 95.68 -36.65 -71.50 -21.21 74.87 0.76 24.36 4.45 16.83 54.10 3.54 20.08 0.02 0.40 0.58 15 D C T 109.17 2.08 13.01 15.64 98.68 54.29 -86.19 -3.08 73.20 2.83 23.98 7.73 15.64 49.85 4.30 19.24 0.06 1.74 1.44 16 C C C 47.34 11.61 8.29 20.08 101.53 98.16 -83.04 16.74 64.11 16.50 19.39 33.19 13.29 19.48 5.25 13.29 0.14 10.68 4.68 17 Q C C 121.81 3.36 14.50 18.93 99.26 120.24 -78.49 -20.08 68.99 21.33 9.68 32.73 19.77 18.49 2.30 7.01 0.04 17.51 2.15 18 K C C 130.28 3.09 16.91 20.73 115.11 59.20 -95.28 134.06 60.74 30.75 8.51 29.65 18.44 14.33 1.48 6.61 0.03 27.76 1.70 19 H C E 65.30 16.82 9.84 25.58 123.49 -157.73 -104.09 141.12 49.49 48.97 1.54 41.83 6.13 1.37 0.51 0.99 0.00 47.75 1.42 20 T E E 69.70 5.27 19.71 25.84 123.30 -158.37 -118.62 137.16 19.35 80.30 0.35 18.03 1.21 0.23 0.18 0.16 0.00 79.12 1.08 21 L E E 84.94 10.83 15.71 27.11 115.07 -114.85 -74.79 139.41 11.89 87.84 0.28 10.81 0.90 0.17 0.15 0.12 0.00 86.47 1.38 22 H E E 51.27 14.57 13.56 28.66 124.75 -161.56 -114.24 145.83 31.39 68.15 0.46 27.33 3.02 0.42 0.20 0.22 0.00 68.16 0.66 23 K E E 130.52 3.82 20.21 24.83 117.94 -135.46 -97.67 135.02 31.38 68.08 0.54 27.90 2.49 0.36 0.27 0.26 0.00 67.53 1.20 24 V E E 41.67 17.87 10.57 27.77 115.56 -138.33 -92.46 130.01 27.58 71.01 1.41 25.87 1.32 0.32 0.97 0.53 0.00 69.02 1.97 25 T E E 79.01 4.26 18.18 23.02 107.28 -166.99 -104.34 -21.02 32.16 66.07 1.78 22.80 8.56 1.13 0.91 0.81 0.00 65.04 0.74 26 Q E E 107.31 4.96 16.92 23.07 126.93 -0.24 -131.19 135.75 19.65 78.39 1.96 15.52 3.64 1.04 0.98 0.90 0.00 76.73 1.19 27 Y E E 87.46 14.82 10.61 25.02 122.13 -165.46 -115.63 136.73 22.66 75.69 1.65 20.07 1.81 0.58 1.22 0.66 0.00 72.79 2.87 28 K C C 112.74 4.96 15.08 21.22 116.74 -132.43 -90.12 141.60 60.04 37.13 2.83 43.90 11.90 4.45 1.26 1.66 0.01 34.90 1.92 29 A C T 76.66 5.00 12.26 18.87 110.68 -107.70 -70.36 140.22 78.57 14.60 6.83 26.01 25.64 28.13 2.02 4.35 0.03 11.97 1.86 30 G C T 50.22 3.77 13.49 18.42 111.15 44.63 93.85 -57.18 83.51 7.21 9.29 26.78 29.09 29.14 2.50 5.89 0.02 4.83 1.74 31 K C C 134.23 4.10 13.08 18.41 108.09 34.56 -87.50 100.36 75.38 9.48 15.14 43.88 20.31 11.62 7.41 7.60 0.06 5.75 3.38 32 A C C 60.86 7.59 11.80 20.49 108.01 65.39 -83.70 109.21 72.16 8.43 19.41 46.92 15.49 9.34 12.35 7.74 0.03 5.38 2.75 33 S C C 50.62 7.38 12.80 21.56 116.80 -118.94 -96.33 148.43 63.50 8.79 27.70 44.64 10.76 7.83 19.31 8.87 0.03 5.66 2.90 34 A H H 68.65 6.00 14.07 21.16 94.50 -116.16 -66.87 -27.33 43.84 6.88 49.27 15.09 10.64 19.13 31.33 16.62 0.59 4.69 1.91 35 F H H 115.92 6.77 14.39 22.07 97.84 54.42 -84.09 -14.11 41.99 10.11 47.89 13.86 9.47 19.37 30.90 15.88 0.76 7.39 2.38 36 A C H 48.67 9.41 12.60 23.03 100.35 79.77 -82.80 -2.59 45.21 10.76 44.03 21.42 10.24 14.85 29.35 13.63 0.40 7.39 2.72 37 Q C C 108.87 5.69 14.24 21.05 109.63 75.63 -91.67 90.20 58.60 10.22 31.18 26.30 13.38 19.71 24.16 6.74 0.25 6.70 2.77 38 G C C 36.13 7.87 12.54 21.56 121.52 -130.21 -112.96 174.78 71.62 9.54 18.84 34.97 17.44 19.44 13.06 6.08 0.11 6.66 2.23 39 K C C 137.41 4.12 13.96 19.42 114.82 -98.94 -92.53 133.77 61.01 15.10 23.88 37.94 12.94 9.62 16.99 7.56 0.12 11.91 2.93 40 R C C 130.64 7.41 11.62 20.33 116.61 -139.21 -95.08 133.60 50.73 21.84 27.44 32.39 10.15 8.05 18.92 8.98 0.13 18.27 3.11 41 R C C 137.07 5.71 13.05 20.27 115.40 -153.44 -97.06 132.24 45.51 27.40 27.10 29.57 8.37 7.75 18.61 8.92 0.14 23.21 3.44 42 Y C C 105.68 9.22 10.57 20.95 119.17 -156.62 -105.58 136.05 46.37 27.03 26.60 29.71 9.40 7.48 19.55 7.61 0.14 22.33 3.78 43 D C C 86.12 4.97 12.63 19.14 111.83 -151.13 -96.07 121.19 58.58 18.81 22.61 40.86 9.69 7.45 17.24 6.30 0.05 16.01 2.40 44 R C C 144.78 5.76 10.84 18.12 107.00 -155.30 -87.62 86.98 57.06 16.18 26.76 35.44 11.34 10.35 18.36 8.93 0.11 12.84 2.64 45 K C C 144.60 2.43 11.84 15.48 104.35 64.94 -84.53 30.23 57.35 18.29 24.36 35.80 10.69 10.81 15.93 8.96 0.13 14.21 3.47 46 Q C C 112.37 4.93 9.51 16.08 107.94 76.84 -90.27 94.39 61.91 19.77 18.32 40.76 11.19 9.39 11.98 6.95 0.13 13.47 6.15 47 S C C 76.16 4.10 10.35 15.85 110.11 126.71 -97.11 111.11 76.79 12.13 11.08 43.20 16.26 17.74 5.80 5.07 0.03 8.20 3.69 48 G C T 49.48 3.20 10.70 15.40 115.93 11.09 102.08 -7.49 85.01 5.91 9.08 29.19 27.45 29.45 2.33 6.10 0.02 3.42 2.04 49 Y C T 163.99 3.30 9.61 14.33 108.67 -48.46 -91.44 111.72 79.84 7.35 12.81 21.26 23.26 36.20 2.73 9.23 0.05 4.03 3.25 50 G C T 58.55 1.93 11.26 14.08 105.33 -9.34 75.52 8.21 85.54 4.32 10.15 18.72 23.21 43.74 1.60 8.44 0.01 2.64 1.64 51 G C C 51.74 3.68 10.46 15.71 109.65 -49.12 81.06 10.03 85.41 7.15 7.44 34.70 27.54 23.69 1.10 6.48 0.01 4.32 2.16 52 Q C C 113.68 4.31 10.63 16.60 115.55 124.86 -90.64 134.98 81.36 15.58 3.06 56.29 19.44 5.26 0.96 2.35 0.00 9.53 6.16 53 T C C 93.17 4.71 10.90 17.28 112.72 -152.80 -93.85 118.24 78.50 20.12 1.37 58.06 17.29 2.63 0.54 1.01 0.00 14.31 6.17 54 K C C 124.57 4.72 11.80 18.10 118.35 -153.27 -102.46 135.30 80.18 19.41 0.40 63.54 15.95 0.74 0.21 0.25 0.00 17.02 2.28 55 P C C 82.84 6.16 11.59 19.40 113.79 -109.14 -67.97 145.46 71.10 27.63 1.27 65.82 3.73 1.08 0.78 0.59 0.00 22.00 5.99 56 V C C 86.00 7.14 10.78 19.42 115.42 -138.51 -96.43 132.68 71.17 25.30 3.53 53.15 14.98 2.74 2.50 1.28 0.01 20.53 4.81 57 F C C 123.58 5.93 10.89 18.40 119.02 -149.13 -105.74 135.10 63.20 32.18 4.62 47.30 12.95 2.61 3.20 1.68 0.02 25.47 6.76 58 H C C 122.37 5.39 10.86 18.03 117.89 -157.06 -102.32 133.10 70.75 23.62 5.63 59.21 8.07 2.96 3.61 2.23 0.01 20.17 3.75 59 K C C 131.84 4.67 10.96 17.35 116.14 -145.44 -94.47 137.95 73.95 13.98 12.07 50.35 15.39 8.33 6.80 5.25 0.02 10.83 3.02 60 K C C 139.88 3.81 11.91 17.52 114.09 -126.22 -89.10 134.02 73.74 11.02 15.24 46.93 17.06 10.18 7.71 7.35 0.03 7.57 3.17 61 A C C 61.08 7.84 9.95 19.09 114.47 -125.28 -81.58 142.54 74.54 8.71 16.75 52.39 13.74 8.79 7.60 8.97 0.01 5.80 2.70 62 K C C 134.48 4.25 13.11 18.82 110.84 -129.74 -88.68 122.09 76.17 9.77 14.06 53.65 13.46 9.16 6.25 7.71 0.02 6.45 3.30 63 T C C 78.33 7.57 12.02 20.77 113.96 -152.58 -97.24 127.28 77.84 11.38 10.78 48.81 17.28 11.98 4.76 5.96 0.04 7.16 4.02 64 T C C 77.59 6.98 13.56 21.68 110.72 -167.68 -99.27 99.71 80.91 13.32 5.77 49.85 20.80 10.50 2.40 3.45 0.02 8.98 4.00 65 K C C 104.32 8.12 15.38 24.47 117.52 86.59 -97.54 134.93 82.34 16.52 1.15 49.98 29.53 3.49 0.30 0.86 0.00 14.18 1.67 66 K C C 91.84 10.35 17.15 27.98 119.89 -133.41 -97.93 138.60 58.91 40.84 0.25 49.35 7.57 0.74 0.05 0.20 0.00 41.07 1.02 67 I E E 26.24 16.90 16.32 33.88 120.42 -149.86 -109.70 133.03 12.01 87.97 0.01 11.65 0.43 0.02 0.00 0.01 0.00 87.45 0.44 68 V E E 33.76 11.74 21.50 34.52 119.24 -156.40 -110.00 129.41 2.94 97.06 0.00 2.74 0.10 0.00 0.00 0.00 0.00 97.12 0.04 69 L E E 14.54 20.14 17.81 38.39 120.55 -162.01 -109.17 132.64 0.71 99.29 0.00 0.62 0.03 0.00 0.00 0.00 0.00 99.35 0.00 70 R E E 75.37 10.50 23.41 34.44 117.88 -158.53 -108.93 127.31 0.45 99.55 0.00 0.38 0.02 0.00 0.00 0.00 0.00 99.60 0.00 71 L E E 12.60 21.09 16.83 38.05 124.36 -167.81 -116.13 138.34 0.52 99.48 0.00 0.41 0.04 0.00 0.00 0.00 0.00 99.54 0.00 72 E E E 70.88 7.47 22.32 30.68 117.60 -149.30 -108.71 128.16 1.48 98.52 0.00 1.36 0.10 0.00 0.00 0.00 0.00 98.43 0.10 73 C E E 11.08 17.91 11.00 30.05 110.19 -136.08 -82.66 121.06 31.72 68.25 0.03 29.63 1.35 0.11 0.00 0.03 0.00 68.30 0.57 74 S C T 67.45 4.20 16.89 22.27 94.43 -158.22 -72.31 -27.26 98.77 0.78 0.45 1.50 15.86 81.42 0.01 0.50 0.00 0.58 0.13 75 V C T 97.28 3.46 14.92 19.30 99.00 45.24 -80.27 -41.34 99.32 0.18 0.49 0.42 9.09 89.82 0.02 0.48 0.00 0.09 0.07 76 C C T 65.99 4.98 12.61 19.13 101.36 21.07 -105.26 -9.80 99.24 0.40 0.35 2.13 10.85 86.26 0.02 0.40 0.00 0.26 0.08 77 K C C 150.44 3.05 13.32 18.12 95.00 -127.29 63.49 23.79 95.50 4.17 0.34 64.67 8.45 22.23 0.06 0.33 0.00 3.55 0.71 78 T C C 65.30 4.80 13.85 20.40 122.07 136.07 -95.54 151.22 71.18 28.78 0.04 68.40 1.60 0.17 0.01 0.03 0.00 29.37 0.43 79 K E E 113.38 9.70 12.98 24.04 122.22 -141.31 -111.18 138.27 4.24 95.76 0.01 4.11 0.15 0.01 0.00 0.00 0.00 95.47 0.25 80 K E E 86.17 8.20 16.87 26.60 131.20 -177.27 -135.09 149.45 1.12 98.88 0.00 1.10 0.04 0.00 0.00 0.00 0.00 98.79 0.07 81 Q E E 95.69 10.68 15.74 27.15 119.85 -131.19 -99.05 135.31 6.37 93.61 0.01 5.99 0.34 0.03 0.00 0.01 0.00 93.32 0.31 82 L E E 40.50 13.84 14.79 29.61 122.01 -167.48 -117.33 134.51 48.42 51.55 0.04 46.29 1.16 0.06 0.01 0.02 0.00 52.18 0.28 83 P C C 79.33 5.20 20.52 26.16 113.47 -109.74 -68.30 143.18 54.45 45.37 0.19 49.80 3.28 0.37 0.04 0.14 0.00 45.59 0.78 84 L C C 33.83 20.72 11.70 31.43 120.20 -150.62 -103.53 141.24 64.42 35.21 0.37 57.43 5.88 0.67 0.09 0.28 0.00 34.21 1.43 85 K E E 107.30 5.85 21.50 27.84 120.88 -141.29 -101.92 140.39 46.57 53.02 0.41 38.95 6.89 0.72 0.13 0.30 0.00 51.15 1.85 86 R E E 112.16 11.50 17.33 28.92 117.49 -122.10 -85.15 138.00 29.75 69.54 0.71 25.55 3.21 0.59 0.34 0.44 0.00 60.03 9.85 87 C E E 27.85 16.54 12.02 28.71 123.50 -150.61 -106.77 146.12 42.91 56.21 0.88 40.65 1.78 0.44 0.37 0.53 0.00 51.40 4.82 88 K C S 134.47 3.58 18.10 22.67 98.61 -158.13 -86.27 -29.30 67.37 31.50 1.12 18.40 43.01 6.28 0.14 0.88 0.00 30.39 0.90 89 H C E 103.13 5.14 19.19 25.35 133.41 8.35 -143.86 143.73 51.30 47.68 1.03 25.61 22.56 4.71 0.14 0.85 0.00 45.16 0.98 90 F E E 59.38 18.16 12.22 29.65 126.36 -167.94 -127.95 136.28 42.21 56.43 1.36 39.05 2.49 0.65 0.56 0.81 0.00 52.29 4.15 91 E E E 97.99 5.89 18.79 25.61 117.23 -158.70 -109.11 125.17 48.26 50.69 1.04 45.24 2.02 0.79 0.45 0.62 0.00 46.72 4.17 92 L C C 80.17 11.73 12.84 24.89 113.39 -153.09 -90.66 132.35 64.69 32.81 2.50 30.35 13.74 22.93 0.54 1.98 0.01 28.29 2.15 93 G C T 46.87 4.53 15.22 20.58 107.82 18.68 92.77 -11.44 81.79 15.15 3.05 24.17 27.75 30.86 0.52 2.44 0.01 12.58 1.67 94 G C S 39.17 6.35 12.61 20.20 119.59 96.37 95.09 -170.78 84.42 7.77 7.81 31.32 39.68 13.99 2.77 4.64 0.02 5.54 2.04 95 D C C 98.28 3.68 13.27 18.15 109.19 -52.60 -89.01 111.90 77.41 7.37 15.22 47.37 18.16 12.07 6.72 8.47 0.02 4.75 2.45 96 K C C 126.46 6.25 10.41 18.04 100.19 -154.42 -76.20 -8.42 62.77 7.44 29.79 35.87 14.73 12.75 13.49 16.01 0.05 4.80 2.30 97 K C C 149.77 2.22 12.48 15.62 96.90 80.68 -76.56 -15.43 62.86 7.31 29.83 35.57 14.51 13.33 14.25 15.30 0.06 4.82 2.15 98 T C C 83.23 4.84 10.69 16.98 103.65 57.47 -91.58 14.16 65.66 7.04 27.31 39.74 14.22 11.89 13.94 13.36 0.04 4.34 2.47 99 K C T 137.24 4.23 10.47 16.33 107.38 97.63 -78.94 114.42 72.88 4.70 22.43 23.73 13.42 36.32 13.02 8.73 0.09 2.72 1.97 100 G C T 52.35 3.50 11.71 16.49 103.08 16.49 75.17 -4.02 77.10 2.55 20.35 21.89 15.42 40.62 9.73 9.73 0.03 1.50 1.09 101 A C C 69.54 4.60 10.39 16.65 109.58 118.42 -79.72 134.41 71.63 6.57 21.80 43.73 14.85 13.40 8.97 12.73 0.02 4.23 2.06 102 A C C 76.33 4.03 10.20 15.79 108.48 -125.30 -82.39 118.38 66.50 15.01 18.49 39.70 15.17 12.91 7.46 10.54 0.07 11.33 2.83 103 L C C 103.12 6.54 8.37 16.17 112.53 -141.92 -92.10 125.07 64.44 22.13 13.43 45.48 10.76 8.88 5.15 7.93 0.03 18.74 3.02 104 V C C 109.67 2.95 10.13 14.82 116.05 -161.13 -103.50 130.65 69.48 24.67 5.84 61.03 2.92 4.56 3.18 2.48 0.01 20.76 5.06 105 F C C 132.22 6.11 11.15 18.66 115.52 -152.67 -97.51 129.71 99.18 0.79 0.03 99.12 0.16 0.07 0.01 0.00 0.00 0.58 0.05