# 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 117.32 5.10 20.69 26.47 115.25 -139.45 -88.84 133.04 99.64 0.36 0.00 99.57 0.12 0.02 0.00 0.00 0.00 0.28 0.01 1 I C C 41.61 19.03 12.31 30.74 117.16 -146.54 -100.05 129.50 59.95 39.98 0.07 59.28 0.45 0.10 0.01 0.03 0.00 39.58 0.55 2 V E E 64.14 7.64 20.39 29.00 119.38 -165.31 -113.70 129.34 11.92 88.01 0.06 11.00 0.79 0.10 0.02 0.03 0.00 87.47 0.59 3 M E E 45.56 18.67 14.27 32.56 118.88 -155.97 -105.94 129.04 6.48 93.48 0.04 5.99 0.40 0.06 0.01 0.02 0.00 93.10 0.41 4 T E E 63.79 8.24 20.24 29.22 124.02 -171.14 -119.75 137.70 13.37 86.52 0.10 11.84 1.18 0.20 0.03 0.07 0.00 85.80 0.88 5 Q E E 73.66 13.57 15.75 29.33 126.83 -162.75 -125.35 140.93 45.36 54.46 0.18 35.03 9.65 0.78 0.03 0.17 0.00 53.32 1.01 6 S C C 56.79 8.86 17.45 27.16 121.89 -137.44 -101.71 146.87 80.92 18.94 0.14 53.99 25.22 1.09 0.02 0.14 0.00 18.82 0.72 7 P C C 63.79 8.49 16.91 26.32 114.27 -15.23 -68.03 150.47 87.91 11.48 0.60 54.61 28.06 4.36 0.06 0.66 0.00 11.76 0.50 8 A C E 53.71 11.87 15.86 27.99 98.39 -145.07 -83.52 -21.57 60.80 38.44 0.76 35.42 22.03 3.39 0.07 0.79 0.00 37.57 0.73 9 T E E 72.88 7.05 20.05 28.22 130.97 24.46 -135.95 141.60 18.30 81.49 0.21 15.78 1.99 0.33 0.03 0.18 0.00 81.26 0.43 10 L E E 28.65 19.59 14.69 33.92 127.63 -173.29 -131.04 140.53 3.32 96.67 0.01 3.03 0.18 0.01 0.00 0.00 0.00 96.62 0.14 11 S E E 65.10 6.33 23.39 30.74 121.46 -156.06 -112.98 134.65 2.47 97.52 0.00 2.25 0.13 0.01 0.00 0.00 0.00 97.53 0.07 12 L E E 16.84 20.88 13.64 34.34 133.70 173.71 -138.36 152.86 13.41 86.58 0.01 12.84 0.53 0.02 0.00 0.01 0.00 85.47 1.13 13 S C C 52.61 4.74 23.42 27.86 121.61 -121.55 -85.49 156.66 94.84 5.14 0.02 94.12 0.98 0.07 0.00 0.01 0.00 4.43 0.38 14 P C T 59.36 13.99 14.31 28.39 109.66 -82.27 -59.80 135.96 99.32 0.28 0.41 0.21 2.34 96.99 0.02 0.25 0.00 0.14 0.04 15 G C T 46.45 4.32 19.39 24.51 95.86 22.75 88.59 -6.33 99.36 0.25 0.39 0.39 2.77 96.37 0.03 0.26 0.00 0.16 0.02 16 E C C 84.04 8.03 17.79 26.99 121.79 120.03 -84.45 148.76 92.43 7.29 0.28 73.27 18.68 0.49 0.05 0.24 0.00 6.54 0.74 17 R E E 127.18 9.06 18.55 28.82 123.08 -134.34 -105.12 141.12 49.09 50.86 0.05 48.28 0.83 0.08 0.01 0.03 0.00 49.80 0.96 18 A E E 11.26 20.61 15.39 35.90 131.63 -172.76 -132.32 149.34 2.68 97.31 0.01 2.52 0.09 0.01 0.00 0.00 0.00 97.28 0.10 19 T E E 66.38 8.63 24.32 33.52 121.85 -145.34 -114.88 132.69 0.82 99.18 0.00 0.74 0.03 0.00 0.00 0.00 0.00 99.21 0.02 20 L E E 6.84 24.93 16.98 42.20 123.38 -168.95 -117.04 134.53 2.38 97.62 0.00 2.09 0.14 0.01 0.00 0.00 0.00 97.72 0.03 21 S E E 34.84 10.38 26.52 37.40 125.77 -163.49 -116.58 144.24 7.06 92.93 0.01 6.12 0.42 0.02 0.00 0.00 0.00 93.36 0.07 22 C E E 4.94 25.28 17.25 42.81 131.56 -175.75 -135.45 146.08 7.69 92.29 0.02 6.80 0.49 0.04 0.00 0.01 0.00 92.45 0.20 23 R E E 104.27 7.79 26.90 35.46 121.83 -156.32 -116.30 134.09 5.93 94.03 0.04 5.30 0.44 0.06 0.02 0.02 0.00 93.12 1.05 24 A E E 9.88 23.49 14.23 37.34 121.30 -163.43 -102.63 141.64 41.65 57.99 0.35 38.61 2.12 0.41 0.11 0.24 0.00 56.65 1.85 25 S C C 50.87 7.74 20.19 28.36 113.84 -141.81 -90.23 154.72 80.67 18.52 0.81 46.59 29.38 4.81 0.10 0.84 0.00 17.19 1.08 26 Q C S 116.21 5.67 17.57 24.03 101.58 -68.55 -82.87 17.06 91.15 7.02 1.83 20.15 55.07 16.26 0.20 1.64 0.00 5.65 1.03 27 S C C 62.96 7.18 17.49 25.47 113.78 66.14 -97.65 128.05 92.22 5.35 2.43 48.36 28.61 15.22 0.31 2.54 0.00 3.69 1.26 28 V C C 62.81 13.31 16.47 29.50 106.41 -117.18 -88.45 27.22 88.89 7.65 3.46 37.46 31.97 19.94 0.50 3.20 0.00 4.73 2.18 29 S C C 34.92 13.89 18.29 32.15 118.93 78.29 -96.10 134.54 89.01 8.10 2.89 49.90 22.43 16.64 0.33 3.02 0.00 6.36 1.32 30 S C S 42.36 13.03 20.90 33.64 104.56 -150.45 -98.04 -7.20 85.37 13.12 1.51 33.25 45.44 6.48 0.15 1.42 0.00 12.35 0.90 31 Y E E 63.43 13.76 24.23 37.98 126.67 45.11 -121.79 141.70 35.33 63.76 0.91 27.16 6.54 1.94 0.15 0.76 0.00 62.45 1.00 32 L E E 3.83 25.98 20.28 46.57 125.62 -165.42 -121.11 138.30 8.71 91.25 0.04 7.77 0.73 0.08 0.01 0.02 0.00 91.15 0.24 33 A E E 10.55 18.12 27.61 45.46 129.94 -170.55 -126.64 147.28 1.23 98.76 0.01 1.12 0.05 0.00 0.00 0.00 0.00 98.79 0.03 34 W E E 8.23 24.56 22.82 47.25 124.44 -152.87 -112.76 141.39 0.68 99.32 0.00 0.61 0.03 0.00 0.00 0.00 0.00 99.35 0.01 35 Y E E 24.61 17.34 23.85 41.11 132.47 -173.71 -130.77 149.53 0.71 99.29 0.00 0.62 0.03 0.00 0.00 0.00 0.00 99.32 0.03 36 Q E E 42.26 14.53 21.45 36.20 121.60 -143.72 -110.94 135.77 3.41 96.59 0.01 2.80 0.34 0.02 0.00 0.00 0.00 96.72 0.12 37 Q E E 55.09 14.13 15.62 30.16 119.30 -152.95 -103.64 136.97 31.71 68.26 0.02 28.51 2.15 0.09 0.01 0.02 0.00 67.97 1.25 38 K C C 100.23 6.16 15.69 23.15 120.58 -146.19 -96.60 146.62 97.45 2.52 0.03 94.86 2.69 0.20 0.01 0.02 0.00 1.80 0.43 39 P C T 104.78 3.78 11.44 17.28 109.51 -85.27 -58.42 133.99 99.67 0.10 0.23 0.29 3.13 96.28 0.01 0.21 0.00 0.06 0.02 40 G C T 69.13 0.29 13.14 10.75 95.10 18.05 83.55 -3.24 99.71 0.07 0.22 0.38 3.08 96.26 0.00 0.22 0.00 0.04 0.01 41 Q C S 89.92 5.45 10.53 18.14 128.88 96.45 -113.24 157.17 92.98 6.69 0.33 37.55 54.40 1.10 0.07 0.26 0.00 2.19 4.43 42 A C C 74.23 2.58 17.90 20.63 116.79 -98.52 -68.53 150.72 96.33 3.63 0.04 82.12 14.15 0.24 0.01 0.04 0.00 3.01 0.43 43 P C C 41.80 18.30 12.28 29.97 114.89 -96.04 -64.71 143.72 89.37 10.60 0.03 86.43 2.62 0.17 0.00 0.03 0.00 10.46 0.29 44 S E E 43.24 9.82 21.89 32.15 129.35 -167.51 -126.28 145.97 8.34 91.61 0.05 7.42 0.78 0.07 0.02 0.03 0.00 91.03 0.66 45 L E E 54.91 16.85 18.62 34.89 110.57 -113.85 -76.27 126.25 0.97 99.02 0.01 0.88 0.04 0.00 0.00 0.00 0.00 99.02 0.05 46 L E E 23.00 18.34 21.52 39.67 101.24 176.24 -95.65 -34.97 3.19 96.79 0.02 2.08 0.94 0.05 0.01 0.01 0.00 96.90 0.02 47 I E E 18.08 19.32 22.38 41.35 136.52 5.64 -147.48 143.77 1.13 98.85 0.01 0.88 0.12 0.01 0.00 0.00 0.00 98.96 0.03 48 Y E E 47.81 19.40 19.87 38.20 130.42 -173.95 -135.13 139.36 6.41 93.48 0.10 5.61 0.50 0.09 0.04 0.05 0.00 93.34 0.36 49 D E E 32.71 12.63 21.24 34.47 121.39 -162.70 -116.39 134.54 47.08 51.66 1.26 39.63 5.92 1.18 0.50 0.76 0.00 50.73 1.27 50 A C T 43.30 13.72 15.97 30.00 93.49 -131.38 -65.07 -25.99 59.17 3.92 36.90 11.33 12.35 36.40 8.08 27.86 0.07 2.72 1.19 51 S C T 75.51 3.38 19.13 22.91 93.52 61.14 -73.54 -20.81 59.42 1.76 38.81 8.46 11.23 39.64 9.37 29.19 0.07 1.05 0.98 52 N C G 62.33 11.65 14.55 26.57 100.47 49.94 -97.52 8.76 53.49 6.05 40.46 21.94 15.07 19.15 10.97 26.94 0.15 3.36 2.41 53 R C C 109.94 12.92 13.62 26.19 98.39 119.34 -69.28 -22.69 64.13 9.78 26.08 36.41 11.62 16.38 15.30 10.63 0.12 6.15 3.37 54 A C C 70.85 5.38 16.39 22.75 97.18 67.34 -77.02 -12.01 64.73 11.47 23.80 28.60 13.88 23.35 11.86 11.07 0.30 7.19 3.76 55 T C T 78.56 7.11 15.73 23.71 101.84 56.30 -91.09 6.12 75.12 6.84 18.04 18.37 17.81 39.58 8.15 9.07 0.15 4.25 2.62 56 G C T 46.84 5.52 17.74 24.26 100.10 -99.38 85.55 6.84 91.62 4.95 3.44 25.27 28.67 38.36 0.71 2.55 0.00 3.27 1.17 57 I C C 37.51 17.80 12.36 30.09 116.85 132.57 -94.17 130.31 85.45 14.08 0.47 58.27 27.14 1.13 0.20 0.30 0.00 7.57 5.39 58 P C C 62.23 7.83 20.75 29.20 111.92 -111.91 -67.34 145.86 86.84 11.71 1.46 75.05 8.79 2.65 0.50 0.98 0.00 9.28 2.76 59 A C C 43.71 16.49 15.67 31.23 102.86 -123.88 -73.55 35.18 82.49 14.14 3.37 57.50 18.50 6.69 0.67 2.84 0.01 12.43 1.36 60 R C C 117.01 7.65 22.50 30.75 123.71 72.52 -125.05 132.61 59.53 37.60 2.86 44.62 11.55 3.84 0.75 1.87 0.00 35.80 1.56 61 F E E 33.74 22.67 14.04 35.84 124.55 -168.23 -116.92 140.88 24.00 75.23 0.77 21.06 2.48 0.66 0.35 0.40 0.00 72.86 2.19 62 S E E 55.83 6.78 23.48 31.49 134.80 -175.89 -137.27 155.94 12.62 87.11 0.27 10.92 1.34 0.32 0.11 0.13 0.00 86.29 0.89 63 G E E 24.40 15.77 16.27 31.50 140.52 157.99 -157.09 169.72 14.29 85.50 0.22 11.60 2.36 0.50 0.06 0.14 0.00 84.19 1.17 64 S E E 66.67 5.27 20.88 27.84 133.35 -144.37 -138.89 154.84 25.42 74.28 0.30 21.12 3.63 0.84 0.08 0.24 0.00 73.01 1.09 65 G C E 29.87 11.78 15.13 27.35 138.02 141.67 -151.38 169.02 52.79 46.71 0.49 35.07 14.86 3.75 0.06 0.53 0.00 44.43 1.29 66 S C S 76.80 3.60 20.43 24.56 109.07 -119.62 -116.68 51.50 68.63 29.63 1.74 22.03 29.56 18.63 0.18 1.79 0.01 24.92 2.88 67 G C S 33.35 10.48 18.18 28.50 108.07 -50.51 71.25 -116.01 96.21 1.99 1.79 5.63 48.73 41.95 0.07 1.87 0.00 1.41 0.35 68 T C S 65.42 12.14 17.24 29.38 99.21 -12.41 -98.05 -4.25 94.79 3.69 1.52 6.68 52.46 35.81 0.07 1.53 0.00 2.97 0.47 69 D E E 62.43 8.49 21.91 31.44 118.05 83.79 -103.99 129.64 43.72 55.77 0.52 27.33 14.90 2.97 0.09 0.55 0.00 50.37 3.79 70 F E E 10.15 24.15 15.77 40.09 127.71 -174.05 -125.52 141.99 21.95 78.03 0.02 20.46 0.91 0.06 0.00 0.01 0.00 77.78 0.76 71 T E E 37.48 10.35 27.03 38.31 123.60 -162.52 -120.30 134.32 7.43 92.57 0.00 6.65 0.39 0.01 0.00 0.00 0.00 92.73 0.22 72 L E E 3.38 26.06 18.90 45.80 119.51 -161.15 -112.59 128.89 0.88 99.12 0.00 0.93 0.01 0.00 0.00 0.00 0.00 99.05 0.01 73 T E E 42.00 10.21 27.18 38.08 120.83 -166.17 -116.87 129.51 0.22 99.78 0.00 0.25 0.00 0.00 0.00 0.00 0.00 99.74 0.01 74 I E E 8.45 23.95 16.20 40.60 116.37 -164.98 -113.45 124.99 2.10 97.90 0.00 2.18 0.02 0.00 0.00 0.00 0.00 97.41 0.39 75 S C C 49.14 7.13 22.50 29.96 121.18 -170.27 -102.97 153.19 90.18 9.77 0.05 48.07 36.46 3.94 0.00 0.09 0.00 11.15 0.28 76 S C S 68.06 4.26 23.79 28.13 97.01 11.03 57.40 54.10 98.73 1.25 0.02 10.74 83.28 4.67 0.00 0.03 0.00 1.19 0.09 77 L C C 19.30 23.78 10.56 33.69 113.76 -154.15 -78.57 132.90 98.56 1.42 0.01 96.99 1.80 0.02 0.00 0.00 0.00 0.56 0.61 78 E C C 88.49 4.33 24.44 28.54 129.41 -170.44 -124.08 154.97 99.85 0.14 0.01 99.48 0.40 0.00 0.00 0.00 0.00 0.03 0.08 79 P H G 62.95 14.70 14.75 29.34 91.09 -106.84 -58.72 -31.20 3.50 0.02 96.48 0.19 0.21 2.30 0.35 96.94 0.00 0.01 0.00 80 E H G 123.88 4.18 21.46 26.46 90.25 63.07 -71.03 -15.45 2.61 0.03 97.37 0.09 0.15 1.81 0.27 97.66 0.00 0.02 0.00 81 D H G 19.72 19.27 17.35 36.84 94.30 61.88 -87.93 -1.25 3.33 0.05 96.63 0.46 0.34 1.49 0.39 97.29 0.00 0.04 0.00 82 F C C 36.04 19.47 20.14 39.33 117.19 104.34 -84.20 135.18 74.96 23.50 1.53 70.26 4.99 0.45 0.27 1.23 0.00 21.44 1.36 83 A E E 11.99 18.98 23.53 41.55 137.06 163.06 -141.13 164.66 19.33 80.45 0.22 16.64 2.58 0.31 0.07 0.14 0.00 79.11 1.15 84 V E E 27.12 17.26 25.41 42.21 120.64 -122.23 -110.25 132.54 3.24 96.68 0.07 2.96 0.24 0.05 0.02 0.03 0.00 96.49 0.20 85 Y E E 11.37 23.56 21.94 45.08 124.01 -167.01 -115.43 137.73 2.10 97.82 0.08 1.90 0.20 0.07 0.02 0.04 0.00 97.65 0.11 86 Y E E 33.41 17.02 25.89 42.51 126.60 -168.36 -123.97 142.14 4.51 95.36 0.12 4.02 0.40 0.11 0.04 0.07 0.00 95.13 0.23 87 C E E 8.63 22.20 20.32 42.39 119.63 -152.77 -107.16 131.32 23.03 76.60 0.36 19.78 2.44 0.44 0.11 0.18 0.00 76.41 0.64 88 Q C E 53.56 13.05 21.39 34.56 122.19 -167.43 -114.47 137.52 52.21 46.79 1.00 38.42 12.61 1.92 0.33 0.63 0.00 44.77 1.32 89 Q C C 69.06 11.88 17.23 29.49 117.53 -137.60 -99.59 134.98 72.16 20.95 6.89 46.37 19.17 7.04 3.16 3.61 0.01 18.61 2.02 90 P C C 73.47 7.64 16.58 24.89 108.49 -66.05 -73.77 139.46 72.20 6.83 20.97 37.04 16.97 19.18 6.94 13.26 0.02 5.21 1.39 91 L C C 97.37 8.19 14.23 23.15 104.42 -126.07 -82.45 20.17 66.31 8.66 25.03 28.95 17.60 21.63 8.38 15.22 0.09 6.03 2.11 92 T C C 76.87 7.03 15.26 23.28 114.25 76.58 -102.27 122.53 57.81 19.43 22.77 28.91 14.45 17.19 7.47 13.75 0.24 14.05 3.95 93 F C C 98.98 11.31 13.93 25.50 110.08 -137.13 -92.54 108.13 64.48 22.72 12.80 28.89 16.46 20.98 5.18 6.94 0.28 15.40 5.87 94 G C C 37.90 8.49 16.62 25.64 115.49 -2.20 91.78 -166.06 81.80 13.93 4.27 33.16 22.85 26.96 0.95 3.09 0.01 10.78 2.21 95 G C C 39.32 8.48 18.61 27.26 113.15 -77.19 -76.53 136.90 82.27 14.81 2.92 39.54 26.04 17.36 0.49 2.45 0.00 12.17 1.95 96 G C C 21.70 14.96 16.19 30.67 124.99 -143.14 122.97 175.77 73.68 25.34 0.97 51.55 16.10 5.39 0.15 0.95 0.00 24.40 1.46 97 T E E 38.07 15.21 18.93 34.10 124.78 -111.15 -117.19 140.76 35.43 64.27 0.31 30.76 3.94 0.61 0.09 0.22 0.00 62.98 1.40 98 K E E 99.36 10.54 21.95 32.65 121.40 -143.19 -103.56 135.51 13.06 86.76 0.19 11.46 1.24 0.23 0.06 0.09 0.00 86.31 0.61 99 V E E 13.57 22.25 15.66 37.86 121.11 -164.11 -115.69 131.41 9.89 89.99 0.12 9.42 0.36 0.06 0.04 0.04 0.00 89.94 0.14 100 E E E 86.67 7.02 25.08 32.51 118.29 -155.21 -107.14 129.13 4.24 95.66 0.10 4.01 0.19 0.05 0.03 0.03 0.00 95.53 0.16 101 I E E 14.89 22.75 13.24 35.92 118.03 -159.82 -106.57 127.68 5.93 93.94 0.13 5.61 0.28 0.07 0.06 0.04 0.00 93.51 0.43 102 K E E 104.30 5.51 20.35 26.59 122.43 -167.54 -113.01 140.55 25.13 74.69 0.19 22.62 1.75 0.31 0.07 0.11 0.00 74.15 0.98 103 R C C 118.93 10.56 11.87 22.98 113.61 -120.11 -82.07 133.68 72.92 26.94 0.14 69.38 1.92 0.39 0.03 0.10 0.00 27.37 0.81 104 T C C 89.90 4.61 14.90 20.78 111.81 -144.93 -90.84 130.57 99.82 0.17 0.00 99.74 0.10 0.03 0.00 0.00 0.00 0.12 0.01