# 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 115.93 5.36 19.61 25.82 118.15 -144.98 -95.59 135.65 99.54 0.45 0.00 99.55 0.07 0.01 0.00 0.00 0.00 0.35 0.01 1 I C C 49.37 17.54 11.99 29.09 116.50 -146.45 -99.89 128.87 55.57 44.33 0.11 55.04 0.39 0.17 0.02 0.06 0.00 43.68 0.64 2 V E E 70.44 7.01 19.09 27.19 119.72 -165.54 -113.96 130.65 17.67 82.12 0.20 16.17 1.21 0.29 0.06 0.14 0.00 81.39 0.75 3 M E E 54.03 17.25 13.43 30.40 119.99 -155.71 -109.56 131.20 10.90 88.96 0.14 9.96 0.81 0.21 0.04 0.10 0.00 88.26 0.62 4 T E E 70.78 7.31 19.23 27.50 124.00 -168.58 -118.85 137.55 16.08 83.77 0.16 14.36 1.37 0.28 0.05 0.11 0.00 82.71 1.13 5 Q E E 74.14 12.95 15.06 28.27 125.50 -163.16 -123.67 141.21 44.47 55.32 0.21 34.64 9.08 0.80 0.04 0.19 0.00 54.09 1.16 6 S C C 61.07 7.49 17.57 26.05 120.79 -134.67 -96.17 146.48 78.93 20.93 0.14 50.00 27.34 1.14 0.02 0.14 0.00 20.61 0.75 7 P C C 68.18 8.65 16.69 26.21 114.00 -30.60 -69.17 149.06 87.45 12.26 0.29 54.22 28.47 3.64 0.03 0.33 0.00 12.87 0.44 8 A C E 45.74 13.32 15.43 28.84 103.24 -147.49 -85.08 -1.44 51.83 47.79 0.38 38.01 11.55 1.98 0.04 0.40 0.00 47.28 0.74 9 T E E 76.47 7.39 19.83 28.32 127.90 -20.05 -127.35 140.17 15.20 84.74 0.06 13.71 1.15 0.12 0.01 0.05 0.00 84.56 0.40 10 L E E 29.78 19.61 14.45 33.64 127.55 -172.99 -130.29 139.53 2.70 97.29 0.00 2.53 0.12 0.01 0.00 0.00 0.00 97.23 0.10 11 S E E 65.65 6.08 23.34 30.50 122.44 -156.69 -115.22 134.79 2.04 97.96 0.00 1.87 0.11 0.01 0.00 0.00 0.00 97.97 0.05 12 V E E 15.95 20.81 13.52 34.14 133.16 175.21 -137.37 150.68 9.06 90.93 0.01 8.79 0.32 0.01 0.00 0.00 0.00 89.83 1.04 13 S C C 53.32 4.63 23.23 27.51 121.64 -123.36 -85.52 157.47 93.00 6.98 0.02 92.45 0.86 0.07 0.00 0.01 0.00 6.15 0.45 14 P C T 61.43 13.60 14.17 27.91 109.51 -82.36 -59.86 135.75 99.40 0.28 0.32 0.19 2.16 97.25 0.02 0.20 0.00 0.14 0.04 15 G C T 48.35 3.73 19.32 23.78 95.94 22.74 88.39 -6.22 99.48 0.22 0.30 0.34 2.61 96.67 0.02 0.20 0.00 0.14 0.02 16 E C C 83.81 8.04 17.54 26.79 121.85 118.04 -83.89 149.44 92.92 6.91 0.17 76.74 15.90 0.34 0.03 0.15 0.00 6.24 0.61 17 R E E 125.37 9.22 18.63 29.00 123.89 -136.64 -109.86 142.62 42.81 57.16 0.03 42.77 0.59 0.05 0.01 0.02 0.00 55.66 0.91 18 A E E 10.40 21.30 15.44 36.66 130.33 -171.12 -130.03 147.79 1.38 98.62 0.00 1.30 0.03 0.00 0.00 0.00 0.00 98.60 0.06 19 T E E 65.45 8.65 24.43 33.67 121.18 -148.87 -113.81 131.77 0.66 99.34 0.00 0.60 0.02 0.00 0.00 0.00 0.00 99.36 0.01 20 L E E 7.51 24.96 16.76 42.00 122.68 -168.57 -116.61 133.53 3.83 96.17 0.01 3.32 0.26 0.01 0.00 0.00 0.00 96.35 0.06 21 S E E 38.80 9.80 26.46 36.75 124.73 -164.33 -116.25 141.83 14.04 85.94 0.01 12.53 0.75 0.04 0.00 0.01 0.00 86.56 0.11 22 C E E 6.00 25.06 16.83 42.03 130.69 -174.42 -133.33 146.19 12.88 87.10 0.02 11.67 0.64 0.05 0.00 0.01 0.00 87.36 0.27 23 R E E 109.62 6.99 26.94 34.74 120.23 -156.35 -114.16 131.23 6.48 93.47 0.05 5.94 0.41 0.05 0.03 0.03 0.00 91.53 2.01 24 A E E 10.03 23.78 13.77 37.09 123.19 -163.03 -108.20 142.28 38.68 60.98 0.33 36.18 1.83 0.32 0.13 0.21 0.00 58.81 2.52 25 S C C 51.29 7.29 20.44 28.16 116.37 -141.78 -94.10 155.79 79.57 19.44 0.99 50.84 24.84 3.83 0.17 0.92 0.00 18.06 1.33 26 Q C S 117.52 5.29 17.75 23.82 104.99 -66.93 -76.43 -10.42 89.74 6.46 3.80 18.39 53.20 18.85 0.64 2.75 0.00 5.06 1.10 27 S C C 67.69 5.68 18.72 25.14 112.34 53.87 -93.71 123.73 89.98 5.92 4.10 43.67 28.15 18.34 0.68 3.66 0.00 4.22 1.27 28 V C C 48.28 17.19 14.32 30.59 112.16 -138.22 -92.53 124.30 83.44 10.89 5.66 47.65 22.53 13.43 1.27 4.71 0.01 6.99 3.42 29 S C C 38.27 12.18 18.51 31.00 123.97 -161.79 -109.05 150.61 84.83 10.67 4.51 59.52 14.29 10.70 0.84 4.10 0.00 7.91 2.64 30 S C S 60.69 10.12 20.28 30.40 101.19 -132.91 -95.37 -7.86 85.11 12.13 2.76 22.47 44.25 18.99 0.29 2.46 0.00 10.43 1.11 31 D C C 62.74 10.63 22.94 33.57 109.08 61.83 -99.29 84.54 66.01 32.02 1.97 31.46 19.80 15.18 0.20 1.88 0.00 30.59 0.88 32 L E E 6.40 24.94 17.50 42.60 124.40 135.71 -111.30 140.37 22.27 77.63 0.10 19.27 2.27 0.25 0.01 0.08 0.00 77.71 0.42 33 A E E 12.50 16.47 27.21 43.76 132.12 -173.15 -130.52 149.13 1.68 98.31 0.01 1.57 0.07 0.01 0.00 0.00 0.00 98.30 0.05 34 W E E 10.93 24.10 22.46 46.39 124.87 -148.68 -114.13 139.01 0.55 99.45 0.00 0.50 0.02 0.00 0.00 0.00 0.00 99.47 0.01 35 Y E E 25.49 17.06 23.27 40.35 131.72 -173.95 -130.19 149.59 0.82 99.18 0.00 0.73 0.03 0.00 0.00 0.00 0.00 99.22 0.02 36 Q E E 45.95 14.12 21.24 35.61 121.88 -150.11 -111.92 134.79 3.11 96.89 0.00 2.65 0.21 0.01 0.00 0.00 0.00 97.05 0.08 37 Q E E 56.65 13.80 15.30 29.59 118.37 -149.72 -103.49 134.11 30.52 69.46 0.02 28.19 1.41 0.06 0.00 0.02 0.00 69.01 1.30 38 K C C 100.02 6.11 15.17 22.65 119.07 -139.76 -91.08 146.78 98.41 1.56 0.03 96.85 1.68 0.14 0.01 0.01 0.00 1.04 0.26 39 P C T 105.47 3.58 11.17 16.77 109.48 -84.60 -58.61 133.93 99.65 0.10 0.25 0.34 3.13 96.22 0.01 0.23 0.00 0.06 0.02 40 G C T 69.42 0.26 12.81 10.28 95.38 17.71 83.23 -3.07 99.68 0.06 0.26 0.40 3.03 96.25 0.00 0.26 0.00 0.04 0.01 41 Q C S 89.00 5.54 9.71 17.37 128.92 97.34 -114.73 159.33 94.27 5.36 0.37 37.93 55.35 1.11 0.07 0.31 0.00 1.83 3.39 42 A C C 76.84 2.15 17.22 19.28 116.58 -97.95 -70.83 149.82 97.41 2.56 0.03 86.16 11.28 0.18 0.00 0.03 0.00 1.99 0.35 43 P C C 48.84 17.01 11.60 28.01 115.07 -100.05 -65.69 144.12 91.74 8.23 0.03 89.56 2.09 0.13 0.00 0.03 0.00 7.94 0.25 44 R E E 98.73 9.11 20.91 30.71 125.11 -160.91 -122.62 139.23 6.90 93.05 0.05 6.12 0.63 0.06 0.02 0.02 0.00 92.53 0.62 45 L E E 58.25 16.12 18.74 34.37 110.85 -115.33 -75.52 126.21 0.96 99.03 0.01 0.85 0.04 0.00 0.00 0.00 0.00 99.06 0.03 46 L E E 19.26 19.38 21.47 40.63 101.37 176.24 -96.17 -33.07 2.04 97.94 0.02 1.47 0.42 0.02 0.01 0.00 0.00 98.06 0.02 47 I E E 12.40 21.51 21.84 43.08 134.60 5.75 -144.89 140.71 0.87 99.12 0.01 0.70 0.07 0.01 0.01 0.00 0.00 99.18 0.03 48 Y E E 61.19 16.97 23.26 39.11 128.45 -172.74 -131.77 137.77 7.69 92.15 0.17 6.18 1.07 0.29 0.05 0.09 0.00 92.07 0.26 49 G C E 15.20 16.84 22.03 37.93 125.92 120.53 -112.25 169.25 53.02 45.53 1.45 31.24 17.50 5.23 0.38 1.00 0.01 43.74 0.92 50 A C C 35.31 14.76 19.77 34.09 114.15 -119.24 -98.56 134.03 68.62 22.28 9.11 35.67 22.04 12.89 3.02 5.49 0.07 18.25 2.57 51 S C C 45.78 11.81 18.77 30.62 115.86 -142.05 -103.17 139.20 72.22 13.32 14.46 34.10 22.39 17.62 5.17 8.41 0.12 9.06 3.12 52 T C C 73.21 10.29 16.93 27.34 104.08 -156.19 -94.38 11.03 66.03 14.97 19.00 32.38 19.42 16.08 8.06 9.97 0.21 9.78 4.10 53 R C C 133.50 6.56 16.74 24.29 107.94 75.80 -92.15 71.11 65.11 17.63 17.26 36.83 15.65 13.91 7.63 9.16 0.14 12.11 4.58 54 A C C 48.74 12.83 12.57 25.37 109.13 99.34 -88.65 100.71 69.41 17.25 13.34 41.43 14.35 13.69 5.95 7.35 0.08 11.55 5.61 55 T C T 85.55 6.24 15.62 22.93 108.62 -113.97 -93.67 83.07 83.19 8.37 8.43 21.63 18.22 44.28 3.02 4.75 0.04 5.42 2.64 56 G C T 53.00 3.91 17.38 22.21 100.55 -33.70 82.86 1.92 92.21 4.64 3.15 18.83 29.01 44.89 0.57 2.41 0.00 3.29 1.00 57 I C C 48.73 15.41 12.21 27.86 117.87 107.87 -102.72 128.11 78.87 20.24 0.88 47.07 31.32 1.97 0.39 0.55 0.00 10.65 8.03 58 P C C 67.55 7.11 19.73 27.53 111.31 -114.06 -68.05 143.63 80.86 16.00 3.13 63.28 11.26 5.53 1.14 2.21 0.00 12.80 3.79 59 A C C 41.89 16.61 14.89 30.64 110.33 -130.34 -79.38 129.55 78.61 14.02 7.37 54.54 15.30 8.86 1.58 6.10 0.01 11.84 1.78 60 R C C 115.86 8.01 22.19 30.57 117.05 121.56 -110.59 127.59 62.78 30.26 6.96 42.07 15.27 6.51 1.71 4.89 0.01 27.24 2.30 61 F E E 33.87 22.61 13.91 35.63 122.69 -157.42 -110.73 137.97 34.15 62.83 3.01 26.85 5.77 2.34 1.21 1.86 0.00 58.68 3.28 62 S E E 54.57 6.97 23.55 31.52 134.63 -178.25 -136.82 155.98 23.47 75.77 0.76 19.60 2.98 0.87 0.30 0.40 0.00 73.92 1.93 63 G E E 25.58 17.00 15.62 31.57 139.91 163.63 -157.96 166.71 21.67 77.90 0.43 17.21 3.93 0.98 0.12 0.28 0.00 75.46 2.01 64 S E E 67.08 5.15 20.95 27.62 131.52 -154.56 -135.43 153.93 28.50 71.16 0.34 23.93 3.84 0.96 0.10 0.26 0.00 69.23 1.69 65 G C E 31.84 12.53 14.81 27.42 135.30 149.15 -152.61 174.03 52.79 46.84 0.37 31.57 18.66 3.94 0.05 0.40 0.00 44.12 1.27 66 S C S 78.42 3.13 20.45 24.06 116.63 -127.84 -115.39 112.55 68.41 30.66 0.94 26.04 32.51 11.55 0.12 1.02 0.01 25.54 3.21 67 G C S 34.07 9.28 18.77 28.20 110.22 -48.55 69.47 -129.24 97.20 1.98 0.83 4.48 58.09 34.75 0.03 0.88 0.00 1.51 0.26 68 T C S 54.49 14.45 16.64 30.95 98.61 -10.22 -97.50 -2.79 96.24 3.17 0.59 4.70 60.11 31.49 0.02 0.60 0.00 2.81 0.27 69 E E E 77.50 8.83 22.34 32.29 121.81 85.50 -108.72 134.61 30.63 69.19 0.18 21.68 8.59 0.98 0.03 0.19 0.00 65.16 3.37 70 F E E 8.57 24.33 15.96 40.68 128.93 -174.12 -128.87 143.49 14.17 85.82 0.01 13.44 0.45 0.02 0.00 0.01 0.00 85.59 0.49 71 T E E 38.12 10.08 26.80 37.86 121.66 -158.28 -117.36 132.61 7.22 92.78 0.00 6.36 0.42 0.01 0.00 0.00 0.00 93.09 0.12 72 L E E 3.47 25.95 18.64 45.44 119.62 -164.18 -113.30 128.64 0.82 99.18 0.00 0.84 0.01 0.00 0.00 0.00 0.00 99.14 0.01 73 T E E 42.97 9.78 26.99 37.51 120.24 -165.21 -115.83 128.98 0.23 99.77 0.00 0.25 0.00 0.00 0.00 0.00 0.00 99.73 0.02 74 I E E 8.24 23.97 15.80 40.32 117.66 -163.36 -111.23 124.95 3.84 96.16 0.00 3.95 0.04 0.00 0.00 0.00 0.00 95.47 0.53 75 S C C 51.59 6.57 22.67 29.40 121.48 -164.96 -103.48 159.80 91.82 8.06 0.11 45.32 38.16 7.11 0.01 0.17 0.00 8.94 0.30 76 S C S 68.82 4.13 23.65 27.72 100.51 10.12 59.92 67.39 98.79 1.15 0.06 9.38 80.85 8.58 0.00 0.08 0.00 1.00 0.10 77 L C C 21.72 23.43 10.59 33.36 111.72 -136.25 -73.98 131.80 99.25 0.74 0.01 97.74 1.62 0.04 0.00 0.00 0.00 0.29 0.30 78 Q C C 80.30 4.34 23.67 27.84 132.59 170.48 -127.95 161.70 98.82 1.14 0.04 97.41 1.24 0.01 0.01 0.01 0.00 0.15 1.16 79 S H G 62.00 11.64 15.43 27.36 91.08 -101.24 -60.47 -31.60 3.90 0.02 96.08 0.17 0.24 2.68 0.53 96.37 0.00 0.01 0.00 80 E H G 126.91 3.77 21.41 25.78 90.84 62.80 -72.29 -15.90 3.30 0.03 96.67 0.11 0.18 2.36 0.40 96.93 0.00 0.02 0.00 81 D H G 16.33 20.33 16.53 37.06 94.25 60.46 -88.57 -2.16 4.49 0.06 95.45 0.65 0.51 2.07 0.48 96.25 0.00 0.05 0.00 82 S C C 23.10 17.46 20.44 37.86 116.03 108.01 -76.15 139.55 94.78 5.02 0.19 91.37 3.50 0.15 0.02 0.16 0.00 4.54 0.26 83 A E E 11.94 18.52 23.29 41.16 143.03 150.61 -156.22 169.30 6.17 93.82 0.01 5.58 0.48 0.03 0.00 0.01 0.00 93.54 0.36 84 V E E 31.54 15.45 25.84 41.23 119.12 -103.70 -105.71 131.00 0.40 99.60 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.58 0.01 85 Y E E 6.58 25.21 21.01 46.29 122.92 -164.49 -113.34 135.80 0.21 99.79 0.00 0.19 0.01 0.00 0.00 0.00 0.00 99.80 0.00 86 Y E E 31.27 16.73 27.44 43.90 128.83 -170.57 -124.56 143.93 0.62 99.38 0.00 0.52 0.02 0.00 0.00 0.00 0.00 99.44 0.01 87 C E E 3.04 25.44 21.68 47.30 124.02 -161.40 -117.28 137.18 3.61 96.36 0.03 2.99 0.33 0.03 0.00 0.01 0.00 96.58 0.06 88 Q E E 32.46 15.42 26.27 41.47 131.10 -173.30 -130.69 145.09 3.70 96.25 0.05 3.26 0.25 0.04 0.01 0.02 0.00 96.30 0.12 89 Q E E 36.02 18.49 20.49 38.34 120.30 -145.12 -103.41 135.32 10.16 89.74 0.10 9.13 0.80 0.14 0.02 0.05 0.00 89.50 0.36 90 Y E E 57.05 14.09 18.25 32.84 123.09 -163.03 -117.76 136.86 35.90 63.75 0.35 31.60 3.34 0.74 0.09 0.29 0.00 62.09 1.87 91 N C C 75.06 9.22 16.68 26.71 112.87 -168.70 -107.70 112.14 71.23 28.18 0.59 32.13 25.82 13.89 0.05 0.68 0.00 26.43 1.01 92 N C S 107.74 4.41 16.92 22.36 100.31 3.95 -90.55 38.77 90.54 8.87 0.60 25.12 44.33 20.99 0.04 0.77 0.00 7.91 0.84 93 W C S 94.59 12.03 10.19 22.77 119.91 128.23 -99.25 139.88 90.43 9.15 0.42 37.39 50.64 3.13 0.08 0.38 0.00 5.81 2.57 94 P C C 82.45 4.26 14.23 19.70 113.69 -81.51 -66.66 150.65 95.69 1.78 2.52 47.58 21.63 25.83 0.22 3.11 0.00 1.08 0.54 95 P C T 102.59 3.19 13.98 18.40 107.59 -44.71 -70.81 127.83 95.36 1.17 3.47 9.90 18.20 66.69 0.24 3.83 0.00 0.83 0.32 96 G C T 37.90 7.28 15.57 23.68 111.78 35.74 91.96 21.79 88.97 7.37 3.67 24.24 15.78 48.76 0.29 3.79 0.00 6.41 0.73 97 Y C C 70.96 15.95 13.92 29.67 122.00 -99.54 -106.19 136.63 64.74 34.48 0.78 57.36 4.84 1.17 0.12 0.71 0.00 34.59 1.20 98 T E E 58.93 10.11 21.19 31.77 126.39 -166.06 -119.77 140.47 17.70 82.05 0.25 15.97 1.32 0.28 0.13 0.14 0.00 78.88 3.29 99 F E E 52.32 19.46 16.31 34.81 119.53 -151.09 -105.56 137.06 18.47 81.21 0.32 15.81 2.20 0.58 0.16 0.20 0.00 77.13 3.91 100 G C C 20.19 13.27 18.39 31.67 121.92 -135.03 -82.72 173.45 68.30 31.23 0.47 46.25 17.94 3.70 0.07 0.46 0.00 30.56 1.02 101 Q C S 118.93 5.31 21.92 27.68 101.74 -69.89 -77.89 26.26 74.95 24.24 0.81 27.01 38.76 9.61 0.08 0.80 0.00 22.61 1.13 102 G C C 16.27 16.12 18.29 33.60 125.04 -110.26 96.56 176.43 73.27 26.33 0.41 46.77 20.38 4.99 0.03 0.47 0.00 26.66 0.68 103 T E E 19.92 20.34 18.04 37.83 121.67 -91.15 -109.02 138.88 23.00 76.93 0.07 20.60 1.59 0.14 0.01 0.05 0.00 77.14 0.47 104 K E E 95.67 9.49 24.89 34.61 122.30 -155.30 -111.33 133.82 2.39 97.60 0.01 2.12 0.16 0.01 0.00 0.00 0.00 97.60 0.11 105 L E E 10.97 23.88 15.56 39.48 122.18 -165.38 -116.47 131.97 1.27 98.72 0.00 1.22 0.05 0.00 0.00 0.00 0.00 98.68 0.05 106 E E E 86.25 6.44 24.57 31.33 118.34 -158.78 -106.92 128.27 2.59 97.40 0.01 2.59 0.08 0.01 0.00 0.00 0.00 97.11 0.20 107 I E E 24.59 21.31 11.59 32.28 116.15 -154.38 -101.24 126.95 26.21 73.75 0.04 26.39 0.26 0.05 0.01 0.02 0.00 72.31 0.94 108 K C C 123.91 4.37 20.49 25.58 115.28 -162.22 -99.11 130.57 99.50 0.50 0.00 99.55 0.05 0.01 0.00 0.00 0.00 0.38 0.01