# 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 D C C 97.26 4.39 20.95 25.50 103.01 -136.79 -84.68 61.16 99.81 0.19 0.00 99.72 0.11 0.03 0.00 0.00 0.00 0.14 0.00 1 I C C 32.05 20.95 11.07 30.95 117.87 -158.69 -101.32 130.55 53.76 46.16 0.08 52.68 0.65 0.14 0.02 0.04 0.00 45.74 0.73 2 Q E E 96.24 5.39 22.12 28.33 122.70 -168.04 -117.16 135.94 13.90 86.02 0.08 12.58 1.04 0.14 0.03 0.04 0.00 85.66 0.52 3 M E E 43.61 20.73 13.51 33.30 123.40 -162.20 -114.53 134.72 6.49 93.46 0.05 6.13 0.34 0.06 0.02 0.02 0.00 93.01 0.43 4 T E E 61.13 8.04 21.66 30.26 125.24 -171.15 -124.05 142.15 11.88 88.02 0.10 10.69 0.97 0.15 0.03 0.05 0.00 86.95 1.16 5 Q E E 67.56 15.69 15.64 30.80 126.35 -160.59 -123.89 138.91 43.22 56.63 0.15 33.39 9.43 0.67 0.03 0.14 0.00 55.18 1.15 6 S C C 52.21 9.57 18.15 28.35 122.85 -141.93 -103.54 148.42 81.18 18.71 0.11 51.26 28.50 1.01 0.01 0.11 0.00 18.44 0.65 7 P C C 59.35 9.23 17.41 27.36 114.99 -3.15 -70.66 150.19 89.22 10.45 0.32 66.85 19.06 2.33 0.04 0.36 0.00 10.84 0.53 8 A C S 57.71 10.88 16.39 27.75 97.26 -149.33 -81.10 -26.41 80.08 19.70 0.22 28.50 48.93 1.72 0.02 0.22 0.00 20.10 0.52 9 S E E 56.71 6.77 20.86 28.73 135.96 12.69 -147.73 148.59 16.02 83.84 0.14 12.90 2.67 0.31 0.02 0.13 0.00 83.61 0.36 10 L E E 34.31 19.67 14.88 33.86 130.52 -175.45 -139.10 145.26 2.17 97.82 0.01 1.97 0.12 0.01 0.00 0.00 0.00 97.79 0.10 11 S E E 64.00 6.63 23.40 31.24 125.93 -161.95 -120.63 140.73 1.79 98.21 0.00 1.62 0.10 0.01 0.00 0.00 0.00 98.19 0.08 12 A E E 11.79 19.58 14.55 34.34 138.03 169.41 -147.02 158.94 12.02 87.96 0.02 10.93 0.57 0.03 0.00 0.01 0.00 88.17 0.28 13 S E E 54.66 4.85 23.74 28.37 121.99 -111.48 -86.19 156.67 38.06 61.81 0.13 34.96 2.26 0.31 0.05 0.10 0.00 57.71 4.62 14 V C T 59.46 15.43 13.95 29.23 109.33 -84.41 -60.44 134.86 98.88 0.77 0.36 0.38 3.54 95.28 0.01 0.25 0.00 0.44 0.09 15 G C T 46.16 4.21 19.77 24.76 95.60 22.30 88.62 -6.07 99.56 0.23 0.21 0.54 4.06 95.04 0.01 0.17 0.00 0.15 0.03 16 E C C 80.65 8.26 17.35 26.85 122.95 121.74 -83.53 153.99 96.29 3.59 0.12 61.46 34.62 0.51 0.02 0.10 0.00 2.85 0.43 17 T C C 77.81 8.16 18.95 28.27 121.28 -127.59 -101.68 137.80 75.56 24.43 0.01 76.27 0.38 0.01 0.00 0.00 0.00 22.93 0.39 18 V E E 12.73 21.65 14.59 36.32 127.47 -170.10 -126.41 140.71 0.85 99.15 0.00 0.87 0.01 0.00 0.00 0.00 0.00 99.04 0.08 19 T E E 64.64 7.51 24.90 32.90 117.72 -146.31 -106.65 127.76 0.24 99.76 0.00 0.26 0.00 0.00 0.00 0.00 0.00 99.73 0.00 20 I E E 4.86 25.55 16.40 42.75 119.98 -167.29 -113.96 128.86 0.92 99.08 0.00 0.88 0.02 0.00 0.00 0.00 0.00 99.09 0.00 21 T E E 41.46 9.54 26.91 37.22 121.46 -163.84 -114.76 134.79 4.59 95.41 0.00 4.18 0.09 0.00 0.00 0.00 0.00 95.69 0.02 22 C E E 3.95 25.81 16.94 43.24 125.33 -171.47 -125.59 137.11 6.59 93.40 0.00 5.99 0.19 0.00 0.00 0.00 0.00 93.75 0.06 23 R E E 100.03 7.56 27.66 35.99 120.47 -165.22 -116.75 129.44 3.51 96.48 0.01 3.26 0.16 0.01 0.00 0.00 0.00 96.12 0.44 24 A E E 9.48 24.14 13.61 37.31 122.49 -164.91 -102.72 142.67 26.90 72.99 0.11 25.79 1.02 0.14 0.03 0.07 0.00 71.35 1.59 25 S C C 56.66 6.47 21.01 28.00 125.24 -163.21 -116.84 154.81 72.27 26.83 0.90 53.83 14.23 3.75 0.15 0.94 0.00 25.29 1.82 26 G C S 50.32 2.70 20.17 22.77 112.53 7.93 74.62 -143.26 91.63 4.41 3.96 7.56 44.13 40.58 0.34 3.32 0.00 3.27 0.80 27 N C T 92.03 7.80 19.81 27.98 106.37 -9.37 -86.84 93.29 92.39 3.56 4.04 24.52 31.09 36.95 0.44 3.81 0.00 2.41 0.78 28 I C C 25.82 21.19 15.82 36.28 107.93 136.01 -89.90 99.47 81.44 11.18 7.38 53.82 17.37 9.73 1.39 6.51 0.00 7.26 3.91 29 H C C 52.41 16.82 20.32 36.14 112.93 99.49 -93.44 136.13 76.86 11.16 11.98 59.55 8.53 7.62 1.12 12.11 0.00 9.40 1.66 30 N C S 80.55 9.34 24.16 33.54 96.43 27.28 -86.66 -14.17 75.30 13.79 10.92 17.50 36.25 22.01 0.57 10.33 0.00 12.30 1.03 31 Y E E 66.57 14.09 23.38 37.30 108.56 46.82 -108.01 56.91 41.19 48.59 10.23 17.25 10.21 15.68 0.68 9.29 0.00 46.15 0.75 32 L E E 3.85 26.12 19.19 45.72 124.72 104.37 -112.56 139.20 12.79 87.16 0.05 11.46 1.03 0.07 0.01 0.03 0.00 87.16 0.24 33 A E E 11.52 17.21 27.91 45.05 130.75 -173.07 -127.97 148.25 0.88 99.12 0.00 0.83 0.03 0.00 0.00 0.00 0.00 99.12 0.02 34 W E E 8.63 24.51 23.02 47.33 124.36 -152.69 -113.78 137.95 0.42 99.58 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.60 0.01 35 Y E E 24.45 17.38 23.93 41.15 132.23 -174.41 -130.20 149.62 0.64 99.36 0.00 0.54 0.02 0.00 0.00 0.00 0.00 99.41 0.02 36 Q E E 35.24 15.37 21.09 36.72 124.32 -156.23 -115.99 138.78 2.64 97.35 0.01 2.31 0.16 0.01 0.00 0.00 0.00 97.41 0.11 37 Q E E 52.36 13.39 16.09 30.22 118.90 -145.77 -105.16 133.58 31.93 68.03 0.05 29.15 1.59 0.11 0.01 0.03 0.00 68.45 0.66 38 K C C 92.60 7.06 14.71 23.16 119.36 -144.56 -94.56 147.78 87.97 11.76 0.26 81.18 5.62 1.29 0.06 0.21 0.00 9.04 2.59 39 Q C T 140.15 2.69 11.34 15.91 108.51 -83.73 -59.05 131.02 99.16 0.35 0.49 0.90 6.95 91.34 0.02 0.46 0.00 0.23 0.08 40 G C T 69.09 0.30 12.68 10.35 95.72 17.01 83.44 -3.05 99.47 0.13 0.40 1.12 6.64 91.66 0.01 0.44 0.00 0.09 0.03 41 K C S 110.31 4.40 10.12 16.61 129.37 92.43 -113.68 159.83 93.13 6.58 0.30 32.86 59.58 0.94 0.07 0.19 0.00 2.14 4.22 42 S C C 79.49 1.97 17.00 18.82 116.99 -95.51 -71.92 150.28 97.51 2.46 0.02 85.99 11.58 0.16 0.01 0.02 0.00 1.93 0.31 43 P C C 44.18 18.20 10.98 28.28 115.13 -100.39 -65.91 144.82 94.17 5.81 0.02 91.68 2.26 0.12 0.00 0.02 0.00 5.73 0.18 44 Q E E 82.35 7.73 21.19 29.71 123.61 -157.92 -117.79 137.24 7.26 92.70 0.04 6.36 0.70 0.06 0.01 0.02 0.00 92.40 0.44 45 L E E 62.92 15.87 17.74 33.16 111.06 -117.26 -75.63 125.73 0.75 99.24 0.01 0.67 0.03 0.00 0.00 0.00 0.00 99.27 0.03 46 L E E 27.24 17.55 20.24 37.73 101.36 176.00 -96.44 -33.02 2.17 97.81 0.02 1.58 0.48 0.02 0.01 0.00 0.00 97.89 0.01 47 V E E 24.47 17.44 21.75 39.01 136.85 4.56 -148.68 142.88 0.79 99.19 0.01 0.67 0.06 0.01 0.00 0.00 0.00 99.24 0.02 48 Y E E 55.96 18.86 20.02 37.69 127.41 -172.94 -131.64 134.80 6.81 93.08 0.11 5.84 0.62 0.12 0.04 0.04 0.00 93.13 0.22 49 S E E 34.35 11.76 22.66 34.67 112.66 -171.09 -114.53 115.04 41.75 56.86 1.39 30.83 8.93 2.12 0.47 0.84 0.00 56.00 0.82 50 A C C 24.76 18.43 14.99 32.77 116.66 108.33 -97.56 131.09 62.11 21.20 16.68 39.23 15.34 8.84 5.36 10.36 0.04 18.87 1.97 51 K C C 135.64 4.37 19.90 25.17 99.82 -149.24 -86.21 -21.52 64.39 12.47 23.14 26.72 24.02 16.17 8.16 13.27 0.17 8.98 2.51 52 T C C 75.86 6.10 19.75 26.37 119.12 29.89 -119.82 124.17 60.16 15.85 23.99 32.87 15.34 13.63 8.97 14.15 0.17 11.07 3.79 53 L C C 45.03 18.96 11.56 29.24 116.07 -136.97 -93.57 132.61 70.12 13.46 16.42 54.81 8.90 5.49 9.44 7.54 0.02 9.10 4.72 54 A C C 51.20 9.18 15.07 25.25 112.95 -126.76 -78.15 144.95 74.49 11.35 14.16 47.93 11.78 14.84 6.66 7.13 0.04 6.33 5.30 55 D C T 117.46 2.43 16.13 19.57 105.86 -72.96 -70.64 117.20 87.01 3.59 9.40 10.17 14.70 62.08 3.44 5.77 0.02 2.43 1.39 56 G C T 53.38 3.56 16.91 21.46 98.86 8.79 85.51 -0.50 93.97 2.15 3.88 16.01 20.05 58.04 0.71 3.10 0.00 1.49 0.60 57 V C C 30.55 18.59 10.49 28.60 116.70 121.85 -96.22 131.16 84.72 14.78 0.50 57.44 27.31 1.10 0.21 0.31 0.00 5.94 7.68 58 P C C 63.86 7.45 19.02 27.39 111.00 -114.19 -67.48 145.90 89.65 8.51 1.84 69.96 12.71 6.58 0.46 1.60 0.00 6.63 2.06 59 S C C 55.79 13.63 16.30 29.34 105.44 -132.83 -84.70 34.30 87.67 9.02 3.31 60.29 16.41 10.66 0.51 3.33 0.00 7.50 1.30 60 R C C 109.11 9.84 20.87 30.69 108.25 115.21 -102.13 39.24 75.29 22.23 2.49 40.64 29.18 5.59 0.44 2.11 0.00 20.69 1.35 61 F E E 28.05 22.72 13.36 35.32 123.48 134.36 -112.73 138.77 24.96 74.35 0.69 20.39 4.41 0.96 0.22 0.48 0.00 72.20 1.33 62 S E E 55.90 6.51 23.85 31.62 133.79 176.35 -138.04 153.92 8.04 91.85 0.11 7.16 0.75 0.13 0.04 0.05 0.00 91.30 0.56 63 G E E 23.90 18.33 15.32 32.35 139.86 162.99 -157.56 167.50 6.98 92.97 0.05 5.96 0.77 0.12 0.01 0.03 0.00 92.78 0.34 64 S E E 64.54 5.01 21.76 28.31 135.90 -166.90 -146.08 156.45 12.12 87.82 0.06 10.44 1.30 0.19 0.01 0.04 0.00 87.55 0.47 65 G E E 30.00 11.62 15.11 27.37 140.05 133.57 123.83 161.45 30.27 69.60 0.14 21.91 8.01 1.12 0.02 0.15 0.00 67.99 0.80 66 S C E 78.38 2.93 20.71 24.09 116.90 -102.89 -120.35 126.90 55.11 44.49 0.41 39.03 13.71 3.32 0.07 0.45 0.00 40.58 2.83 67 G C S 36.35 8.46 19.33 28.17 108.00 -48.17 65.09 -122.61 98.58 0.86 0.56 1.91 51.12 45.71 0.02 0.53 0.00 0.61 0.10 68 T C S 50.40 15.32 16.24 31.53 97.48 -10.09 -98.64 2.33 98.53 1.01 0.46 2.04 50.70 45.94 0.01 0.42 0.00 0.78 0.09 69 Q E E 72.82 9.24 22.49 32.91 120.88 86.14 -107.43 132.91 30.42 69.45 0.13 21.37 9.16 0.88 0.02 0.15 0.00 66.07 2.36 70 Y E E 9.66 24.24 16.65 41.17 130.63 -175.58 -130.51 145.30 10.80 89.19 0.00 10.24 0.34 0.02 0.00 0.00 0.00 89.03 0.36 71 S E E 24.70 11.26 27.08 39.36 127.87 -166.91 -126.24 141.64 4.02 95.98 0.00 3.39 0.24 0.01 0.00 0.00 0.00 96.31 0.05 72 L E E 3.09 26.28 18.76 45.93 122.18 -164.90 -118.81 130.89 0.46 99.54 0.00 0.46 0.00 0.00 0.00 0.00 0.00 99.53 0.00 73 K E E 78.48 9.32 27.42 37.34 119.05 -162.39 -113.48 128.41 0.18 99.82 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.80 0.01 74 I E E 6.72 24.64 15.85 41.19 117.23 -164.01 -111.28 123.65 2.91 97.08 0.00 3.04 0.03 0.00 0.00 0.00 0.00 96.40 0.52 75 N C C 73.25 6.75 23.26 30.16 118.77 -167.19 -101.77 150.06 95.17 4.79 0.04 52.82 37.71 3.87 0.00 0.08 0.00 5.32 0.20 76 S C S 63.13 4.93 24.29 29.31 107.25 10.56 60.94 82.31 99.28 0.70 0.02 9.34 85.84 4.15 0.00 0.03 0.00 0.58 0.07 77 L C C 17.76 24.01 10.71 34.29 113.59 -140.03 -77.16 132.07 99.46 0.53 0.01 98.37 1.18 0.02 0.00 0.00 0.00 0.18 0.25 78 Q C C 78.15 4.99 23.68 28.64 130.92 -175.32 -125.38 157.73 99.90 0.08 0.01 99.68 0.25 0.00 0.00 0.00 0.00 0.02 0.05 79 P H G 78.16 10.85 15.62 27.04 90.89 -106.06 -58.65 -31.11 2.91 0.02 97.08 0.15 0.17 1.76 0.19 97.73 0.00 0.01 0.00 80 E H G 127.24 3.40 21.33 25.46 89.60 63.44 -70.02 -16.49 2.43 0.02 97.54 0.09 0.13 1.59 0.13 98.04 0.00 0.02 0.00 81 D H G 8.41 22.61 15.11 38.33 92.75 63.10 -83.96 -6.28 3.45 0.05 96.51 0.48 0.33 1.39 0.21 97.55 0.00 0.04 0.00 82 F C C 60.55 16.27 19.04 35.30 116.25 109.44 -70.48 139.49 95.12 4.83 0.05 91.94 3.15 0.08 0.00 0.04 0.00 4.60 0.18 83 G E E 15.43 8.37 23.74 34.31 140.56 74.45 142.95 -167.20 4.04 95.96 0.00 3.29 0.60 0.02 0.00 0.00 0.00 95.83 0.26 84 S E E 34.60 11.66 24.79 37.06 120.78 -38.87 -101.61 137.18 0.59 99.40 0.00 0.55 0.02 0.00 0.00 0.00 0.00 99.41 0.01 85 Y E E 7.82 25.19 19.20 44.65 125.14 -165.39 -118.57 139.74 0.58 99.42 0.00 0.49 0.03 0.00 0.00 0.00 0.00 99.46 0.02 86 Y E E 31.96 16.52 27.51 43.83 130.73 -169.17 -127.46 147.16 2.22 97.76 0.01 1.88 0.18 0.02 0.00 0.01 0.00 97.82 0.08 87 C E E 2.47 25.75 21.74 47.84 123.30 -157.52 -115.77 136.31 8.57 91.26 0.17 7.35 0.73 0.15 0.04 0.10 0.00 91.42 0.20 88 Q E E 32.32 15.15 26.37 41.42 125.95 -167.69 -121.45 137.59 6.94 92.70 0.36 6.03 0.59 0.18 0.13 0.17 0.00 92.62 0.28 89 H E E 20.32 20.62 19.19 39.49 122.15 -159.64 -114.98 134.15 7.24 92.34 0.42 5.69 1.21 0.42 0.12 0.23 0.00 92.02 0.31 90 F E E 67.31 10.95 20.18 31.95 116.64 -155.50 -108.04 124.13 13.31 86.31 0.38 10.52 2.22 0.64 0.09 0.25 0.00 85.56 0.73 91 W E E 84.03 12.98 13.13 26.59 117.03 175.55 -114.57 140.25 39.85 59.53 0.62 26.05 11.02 4.31 0.10 0.54 0.00 56.82 1.16 92 S C S 84.05 2.55 16.07 19.03 113.54 -47.84 -100.40 124.48 92.89 6.20 0.90 16.46 39.20 37.17 0.07 0.95 0.00 5.59 0.54 93 S C S 76.24 2.94 14.56 18.52 117.06 6.78 -92.75 140.98 96.15 2.94 0.92 16.76 44.20 35.20 0.06 1.01 0.00 2.36 0.40 94 P C C 72.27 7.76 14.76 23.65 114.12 -44.49 -72.52 148.10 65.04 34.44 0.52 36.15 20.71 7.66 0.06 0.54 0.00 34.02 0.86 95 R E E 83.91 14.20 15.26 29.58 118.45 -135.14 -96.85 135.33 30.75 69.11 0.14 26.79 2.46 0.51 0.03 0.11 0.00 69.50 0.61 96 T E E 49.39 12.89 19.98 33.00 125.01 -163.39 -119.87 140.10 8.31 91.64 0.05 7.38 0.64 0.09 0.02 0.03 0.00 90.45 1.40 97 F E E 49.67 18.32 17.87 35.51 119.82 -157.04 -105.49 134.60 13.98 85.93 0.09 11.70 1.72 0.33 0.03 0.07 0.00 84.53 1.62 98 G C E 22.15 13.84 20.52 33.77 121.17 -152.18 -78.57 -165.57 52.35 47.47 0.18 37.70 11.76 2.11 0.02 0.17 0.00 47.58 0.65 99 G C C 34.27 10.99 21.86 32.18 109.15 -80.49 -78.04 42.21 67.30 32.55 0.15 52.06 11.93 1.47 0.02 0.15 0.00 33.85 0.51 100 G C C 16.92 17.03 17.92 33.98 126.32 -139.31 98.86 175.45 55.49 44.43 0.08 48.13 5.04 0.41 0.01 0.07 0.00 45.83 0.50 101 T E E 34.47 16.36 19.54 35.58 127.08 -100.93 -118.32 143.13 13.61 86.37 0.01 12.59 0.49 0.03 0.00 0.01 0.00 86.66 0.22 102 K E E 98.59 9.80 23.21 33.23 120.81 -146.50 -106.64 133.53 1.31 98.69 0.00 1.12 0.09 0.00 0.00 0.00 0.00 98.75 0.04 103 L E E 13.68 22.92 15.00 37.82 120.39 -161.19 -111.21 131.29 0.96 99.03 0.00 0.91 0.02 0.00 0.00 0.00 0.00 99.04 0.02 104 E E E 91.95 6.10 23.54 30.10 119.88 -161.48 -111.65 130.58 2.29 97.70 0.01 2.27 0.06 0.01 0.00 0.00 0.00 97.52 0.13 105 I E E 32.26 19.73 11.26 30.32 115.78 -152.20 -99.18 127.28 21.08 78.88 0.04 21.32 0.22 0.04 0.01 0.01 0.00 77.65 0.74 106 K C C 129.62 4.00 19.13 24.01 114.51 -152.60 -93.24 130.22 99.52 0.47 0.00 99.59 0.04 0.01 0.00 0.00 0.00 0.35 0.01