# 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 94.50 10.15 15.53 26.08 117.71 -161.81 -101.32 137.16 99.62 0.36 0.02 99.66 0.06 0.03 0.01 0.00 0.00 0.22 0.02 1 A C C 55.35 10.08 12.85 23.74 118.78 -155.67 -104.91 138.96 69.18 29.28 1.53 65.42 1.20 1.86 0.70 0.62 0.00 27.32 2.89 2 Q C E 111.94 5.64 14.51 21.72 117.50 -152.67 -102.86 130.47 51.39 46.44 2.16 40.07 7.16 3.56 0.87 1.45 0.01 42.58 4.30 3 I C C 81.49 11.35 12.46 24.36 116.09 -161.17 -101.16 129.20 57.44 39.55 3.00 39.65 10.02 7.78 1.00 2.24 0.01 35.64 3.66 4 G C C 33.65 8.51 16.05 25.33 122.76 110.50 132.88 -173.35 68.11 29.00 2.89 38.44 18.89 11.87 0.65 2.37 0.01 25.43 2.35 5 N C C 94.83 6.58 16.35 23.96 115.92 -87.79 -104.02 133.24 71.42 24.44 4.14 43.65 17.79 10.74 1.01 3.36 0.01 19.83 3.61 6 C C C 52.90 12.36 12.42 25.15 111.17 -152.57 -95.41 117.96 72.45 22.07 5.47 36.52 21.15 16.71 1.35 4.16 0.07 15.24 4.81 7 C C C 60.70 9.23 12.64 22.78 117.43 -0.88 -106.16 139.09 78.40 16.45 5.15 41.26 21.98 16.29 1.37 3.88 0.03 10.49 4.69 8 T C C 98.82 3.57 13.01 17.61 103.65 -134.96 -88.54 11.18 87.03 5.27 7.70 30.96 29.55 27.35 1.98 5.31 0.01 3.17 1.67 9 E C T 129.81 3.46 11.63 16.59 108.62 73.85 -88.81 94.16 84.51 3.13 12.36 24.93 29.13 31.56 3.95 7.40 0.02 1.80 1.23 10 Q C C 129.50 3.32 12.73 17.26 105.72 -13.47 -85.00 67.22 77.54 8.50 13.97 30.81 23.63 24.78 4.53 8.43 0.04 5.61 2.15 11 L C C 93.38 7.40 12.11 20.62 111.96 59.11 -98.13 118.79 69.40 21.38 9.22 42.44 13.51 14.01 3.34 5.70 0.02 18.03 2.94 12 C C C 64.36 9.20 13.24 23.43 117.13 -166.32 -107.19 131.30 56.80 37.13 6.07 37.01 12.15 8.90 2.65 3.53 0.03 32.76 2.97 13 C E E 67.82 8.22 15.37 24.53 119.45 -163.10 -111.32 133.54 43.65 52.72 3.64 30.94 8.74 5.22 1.85 2.14 0.02 47.30 3.79 14 V E E 56.54 13.15 13.02 26.62 117.80 -159.95 -107.67 127.08 44.52 53.59 1.89 34.95 6.28 2.64 1.08 1.06 0.01 49.22 4.76 15 N C C 90.36 6.92 17.06 24.73 113.73 -171.43 -105.67 123.73 69.45 28.70 1.85 45.65 16.64 6.68 0.65 1.16 0.00 27.75 1.48 16 D C S 82.66 9.35 16.76 26.27 101.02 -62.66 -85.65 36.87 75.61 21.24 3.14 29.59 34.59 11.89 0.80 2.06 0.02 19.75 1.30 17 A C E 43.75 11.01 17.65 29.35 120.79 117.47 -106.41 137.67 50.49 45.29 4.22 29.07 15.51 6.98 1.28 2.50 0.02 43.37 1.26 18 V E E 45.97 15.75 16.94 32.54 114.68 -153.77 -98.06 123.04 22.91 73.76 3.32 16.86 4.53 2.88 1.80 1.64 0.02 69.05 3.23 19 C E E 48.69 12.84 19.53 32.24 108.36 164.10 -101.22 56.30 27.08 70.95 1.97 20.17 5.43 2.63 0.87 1.04 0.01 67.89 1.95 20 C E E 29.39 14.23 19.20 33.74 139.28 51.09 -149.97 159.87 35.84 63.55 0.61 23.48 10.94 1.78 0.16 0.41 0.00 62.32 0.90 21 T E E 62.47 9.17 22.90 32.24 117.63 -112.36 -97.61 133.52 35.33 64.37 0.30 30.46 2.88 0.42 0.09 0.15 0.00 65.55 0.45 22 I E E 14.43 22.57 14.78 37.59 119.73 -157.50 -109.83 131.28 14.94 84.89 0.17 13.84 0.75 0.12 0.08 0.07 0.00 84.74 0.40 23 I E E 67.71 7.99 23.19 31.85 120.32 -160.34 -112.74 130.54 3.05 96.88 0.08 2.80 0.20 0.05 0.04 0.02 0.00 96.37 0.52 24 L E E 29.59 18.43 14.05 32.48 121.18 -165.53 -111.44 133.55 8.44 91.44 0.11 7.50 0.69 0.13 0.04 0.05 0.00 91.12 0.47 25 D E E 81.17 5.91 18.22 25.04 117.13 -152.38 -104.10 130.26 33.65 65.97 0.37 27.02 5.40 1.08 0.09 0.30 0.00 65.37 0.74 26 D C C 60.50 11.39 10.64 22.59 119.57 -161.47 -105.91 146.01 74.73 24.27 1.00 53.79 14.32 5.42 0.16 0.98 0.00 23.96 1.37 27 T C T 107.39 2.60 12.31 16.06 98.26 -120.92 -79.17 -4.67 89.11 8.01 2.89 17.77 28.89 42.78 0.27 2.80 0.00 6.26 1.23 28 G C T 58.91 1.50 12.19 14.03 99.87 38.93 -83.64 1.94 95.45 1.62 2.93 10.87 32.71 51.74 0.21 2.97 0.00 1.07 0.43 29 G C S 51.05 3.37 11.35 16.12 103.22 -93.92 85.66 3.18 94.46 3.34 2.20 18.41 56.92 19.10 0.17 2.24 0.00 2.43 0.73 30 T C C 92.19 2.32 14.67 17.77 117.14 119.34 -92.29 137.45 83.30 16.13 0.57 51.00 28.72 3.51 0.09 0.59 0.00 14.69 1.40 31 A C C 52.37 12.82 11.04 24.09 116.19 -118.27 -77.90 138.66 56.90 42.89 0.21 50.97 3.77 0.54 0.04 0.18 0.00 43.50 1.00 32 L E E 62.96 9.34 17.03 27.87 120.64 -161.22 -115.23 130.68 7.78 92.19 0.03 6.78 0.77 0.06 0.01 0.02 0.00 91.85 0.52 33 P E E 70.39 10.20 18.92 29.60 110.98 -117.87 -71.57 129.99 3.51 96.46 0.03 3.25 0.14 0.02 0.01 0.01 0.00 96.39 0.18 34 I E E 23.03 19.55 17.30 36.84 101.20 176.68 -96.12 -33.21 8.90 90.95 0.15 6.50 2.34 0.36 0.04 0.08 0.00 90.48 0.20 35 W E E 29.53 18.90 17.75 36.77 140.09 2.87 -151.37 150.62 6.58 93.26 0.16 5.64 0.82 0.22 0.06 0.07 0.00 92.52 0.66 36 D E E 68.81 11.08 19.50 31.14 128.30 -171.37 -137.33 137.84 28.44 71.22 0.34 24.83 2.69 0.51 0.13 0.20 0.00 70.55 1.08 37 D C C 53.61 14.39 14.23 28.59 108.24 -159.13 -101.28 86.27 77.41 21.80 0.79 52.85 19.17 4.67 0.14 0.76 0.00 21.25 1.16 38 A C C 78.97 3.61 17.90 22.25 100.04 147.43 -85.91 3.60 91.38 7.67 0.95 42.83 38.48 10.30 0.11 0.99 0.00 6.30 0.98 39 T C C 55.70 9.62 13.07 23.96 122.51 96.28 -102.48 153.05 91.95 7.01 1.04 42.90 38.69 10.62 0.12 1.12 0.00 5.29 1.26 40 T C C 91.34 4.95 17.86 23.74 109.82 -123.24 -87.72 119.46 90.14 9.17 0.69 54.22 28.74 7.06 0.09 0.81 0.00 7.88 1.20 41 F C C 51.45 16.96 13.57 30.37 122.01 89.53 -110.32 137.74 76.33 23.19 0.48 46.28 28.02 2.45 0.11 0.44 0.00 19.93 2.77 42 V C C 70.33 8.03 22.80 31.25 116.93 -148.23 -102.23 126.36 65.14 34.66 0.20 56.58 6.67 0.88 0.05 0.18 0.00 33.31 2.33 43 I E E 12.24 23.59 15.35 39.03 118.30 -161.24 -108.14 127.94 46.19 53.70 0.11 41.70 3.31 0.40 0.03 0.10 0.00 50.57 3.87 44 N E E 69.09 8.50 25.02 33.76 126.68 -170.62 -120.22 142.45 37.71 62.25 0.04 31.79 5.00 0.35 0.01 0.04 0.00 61.42 1.39 45 G E E 9.93 14.25 21.55 36.48 145.86 99.60 172.66 -176.49 15.10 84.88 0.01 10.46 4.67 0.20 0.00 0.01 0.00 84.35 0.30 46 T E E 42.35 10.41 25.45 36.81 127.67 -85.19 -123.02 145.09 4.22 95.78 0.00 3.65 0.25 0.01 0.00 0.00 0.00 96.04 0.06 47 I E E 2.98 26.58 18.07 45.63 124.92 -163.11 -121.89 136.89 0.31 99.69 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.71 0.00 48 M E E 46.48 10.52 28.28 40.08 118.84 -160.04 -113.23 127.47 0.08 99.92 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.92 0.00 49 V E E 1.62 27.27 19.64 48.10 119.76 -166.01 -115.49 127.10 0.06 99.94 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.94 0.00 50 E E E 59.15 9.66 28.31 38.99 119.71 -166.68 -115.20 127.14 0.28 99.72 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.75 0.01 51 N E E 7.84 24.45 15.28 40.11 112.41 -157.15 -98.08 118.61 11.35 88.63 0.01 10.35 0.49 0.04 0.00 0.01 0.00 88.86 0.25 52 N C C 86.01 5.83 24.10 30.27 100.49 -172.05 -96.57 10.78 67.15 32.48 0.37 38.84 21.64 6.26 0.03 0.41 0.00 32.18 0.64 53 G C S 24.74 11.88 17.48 29.47 127.33 63.46 -110.00 174.97 83.75 15.55 0.70 17.77 51.48 14.43 0.06 0.73 0.00 14.30 1.24 54 T C C 83.91 5.83 18.69 25.46 114.98 -91.32 -95.09 130.64 87.20 11.50 1.30 56.36 22.50 8.40 0.25 1.29 0.00 8.18 3.02 55 V C T 86.44 9.22 14.09 24.15 111.71 -103.57 -87.75 131.20 89.19 8.78 2.03 30.54 26.97 32.77 0.26 1.90 0.00 5.56 2.00 56 G C S 54.75 3.16 18.36 21.69 100.44 17.63 81.07 -2.87 93.41 5.40 1.19 19.37 38.54 35.77 0.10 1.29 0.00 3.98 0.94 57 V C S 67.19 9.66 16.62 27.14 117.40 97.43 -106.59 135.38 85.81 13.35 0.85 37.98 41.55 6.80 0.16 0.82 0.00 8.64 4.06 58 G C C 24.24 11.93 19.78 31.72 122.14 -123.99 -82.67 161.98 86.19 13.67 0.14 69.46 14.92 1.35 0.02 0.16 0.00 13.02 1.08 59 P C C 14.30 22.79 16.78 38.86 118.34 -110.65 -82.19 146.25 64.11 35.79 0.10 56.00 5.93 0.46 0.01 0.11 0.00 36.52 0.97 60 T E E 55.35 9.04 26.86 36.64 122.13 -143.71 -112.26 135.68 6.62 93.38 0.01 6.09 0.37 0.02 0.00 0.01 0.00 93.25 0.27 61 A E E 1.83 27.14 17.09 45.48 123.02 -161.73 -116.31 133.38 0.61 99.39 0.00 0.56 0.02 0.00 0.00 0.00 0.00 99.41 0.01 62 A E E 24.42 10.44 28.00 39.80 123.91 -167.81 -120.44 136.84 0.13 99.87 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.88 0.00 63 L E E 3.40 25.80 18.24 45.10 118.20 -155.15 -108.15 127.35 0.07 99.93 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.94 0.00 64 T E E 28.13 10.08 24.31 35.61 125.27 -169.77 -119.98 140.88 0.11 99.89 0.00 0.09 0.00 0.00 0.00 0.00 0.00 99.90 0.00 65 V E E 22.17 18.88 14.15 33.12 117.89 -167.33 -124.93 119.00 1.26 98.73 0.00 0.83 0.20 0.04 0.00 0.00 0.00 98.87 0.06 66 N C T 110.03 4.53 16.43 22.53 92.24 -14.72 53.87 41.51 99.66 0.27 0.07 0.18 2.67 96.88 0.00 0.06 0.00 0.20 0.01 67 G C T 57.33 2.82 14.96 18.99 94.53 -51.78 80.91 2.95 99.87 0.07 0.05 0.23 2.90 96.76 0.00 0.05 0.00 0.05 0.00 68 T E E 88.76 2.47 17.13 20.54 119.74 114.52 -104.40 133.07 3.25 96.74 0.01 1.96 1.01 0.08 0.00 0.00 0.00 96.64 0.31 69 A E E 62.19 9.94 12.82 23.99 110.82 -117.23 -70.60 127.09 2.01 97.99 0.00 1.65 0.12 0.01 0.00 0.00 0.00 98.15 0.07 70 V E E 63.11 9.99 15.15 26.37 102.15 176.97 -101.20 -14.79 11.93 88.01 0.06 9.71 1.29 0.20 0.01 0.06 0.00 88.61 0.13 71 G E E 33.35 5.42 20.85 27.02 137.24 -51.90 157.27 -176.36 20.60 79.24 0.16 12.05 6.61 1.29 0.01 0.18 0.00 79.66 0.19 72 G E E 36.30 11.47 17.45 29.12 133.99 -85.72 -147.92 167.63 29.11 70.77 0.11 22.69 4.23 0.54 0.01 0.13 0.00 72.26 0.14 73 F E E 41.20 18.53 16.06 34.33 127.69 -148.94 -131.33 142.45 9.25 90.75 0.01 8.62 0.37 0.02 0.00 0.00 0.00 90.86 0.13 74 V E E 82.11 6.73 24.64 32.12 115.76 -142.59 -102.90 125.92 1.45 98.55 0.00 1.43 0.04 0.00 0.00 0.00 0.00 98.39 0.13 75 V E E 5.45 24.66 12.84 38.28 117.02 -165.52 -112.65 123.22 8.39 91.61 0.00 8.24 0.18 0.00 0.00 0.00 0.00 89.90 1.66 76 A C C 49.80 4.29 23.98 28.00 121.52 -138.04 -80.90 157.08 94.58 5.40 0.01 94.18 0.68 0.05 0.00 0.01 0.00 4.81 0.27 77 P C T 69.63 11.06 15.04 26.88 109.80 -73.53 -58.57 135.42 98.50 1.08 0.42 0.59 5.40 92.76 0.02 0.34 0.00 0.75 0.14 78 G C T 47.83 4.09 18.71 23.73 94.72 20.01 86.43 -5.45 98.46 1.26 0.29 1.06 5.29 92.21 0.01 0.27 0.00 1.10 0.06 79 E C C 87.82 6.94 18.84 26.93 127.43 109.28 -110.37 147.87 62.57 37.27 0.17 54.28 6.06 0.83 0.02 0.19 0.00 37.48 1.15 80 C E E 56.17 16.58 14.74 30.64 131.38 -164.86 -132.63 147.18 8.27 91.73 0.01 7.88 0.25 0.02 0.00 0.00 0.00 91.47 0.37 81 R E E 80.45 11.63 20.30 32.48 131.65 -174.32 -138.57 144.28 1.26 98.73 0.00 1.11 0.08 0.00 0.00 0.00 0.00 98.78 0.02 82 S E E 54.80 11.89 19.10 31.31 124.12 -151.38 -113.90 138.28 0.82 99.18 0.00 0.70 0.03 0.00 0.00 0.00 0.00 99.26 0.00 83 I E E 27.98 17.70 17.90 35.76 128.48 -173.10 -131.94 138.02 0.57 99.43 0.00 0.49 0.02 0.00 0.00 0.00 0.00 99.49 0.00 84 T E E 63.08 9.29 23.20 32.85 121.56 -152.33 -111.59 132.16 1.00 99.00 0.00 0.89 0.03 0.00 0.00 0.00 0.00 99.05 0.03 85 M E E 14.14 22.33 15.61 37.98 122.31 -169.33 -120.73 129.35 6.72 93.23 0.04 6.29 0.28 0.04 0.01 0.02 0.00 93.05 0.31 86 N E E 82.78 6.08 23.30 29.68 123.59 -168.13 -112.51 145.30 35.11 64.55 0.33 13.09 15.67 6.79 0.02 0.37 0.00 63.63 0.43 87 D C E 83.45 5.71 23.41 29.60 94.88 13.56 59.41 39.32 62.86 36.80 0.34 18.53 32.89 10.12 0.02 0.39 0.00 37.62 0.43 88 I E E 7.59 25.44 12.17 37.74 113.05 165.84 -83.58 125.51 38.59 60.79 0.62 36.17 1.78 0.37 0.17 0.35 0.00 59.99 1.17 89 N E E 79.63 6.14 24.40 31.03 101.46 174.44 -100.89 -27.78 40.45 59.28 0.27 18.32 21.05 1.44 0.03 0.22 0.00 58.60 0.32 90 S E E 36.35 9.31 25.35 35.44 136.64 12.00 -148.76 147.01 5.97 93.84 0.19 4.25 1.21 0.37 0.03 0.12 0.00 93.92 0.11 91 I E E 4.64 26.66 17.00 44.48 124.64 -169.19 -129.59 131.53 1.44 98.55 0.01 1.32 0.06 0.01 0.00 0.00 0.00 98.56 0.04 92 A E E 27.50 10.67 28.22 40.06 126.13 -172.08 -127.76 138.76 0.69 99.30 0.01 0.66 0.02 0.00 0.00 0.00 0.00 99.29 0.02 93 I E E 4.11 26.33 18.96 46.10 119.94 -162.27 -116.52 126.72 1.16 98.83 0.00 1.14 0.04 0.00 0.00 0.00 0.00 98.79 0.03 94 V E E 55.25 8.90 27.40 36.90 122.82 -171.78 -121.14 132.39 5.05 94.92 0.03 4.38 0.43 0.07 0.01 0.02 0.00 94.91 0.19 95 G E E 11.26 21.52 16.11 36.56 122.42 -158.17 -104.56 141.93 30.27 69.63 0.10 26.16 2.97 0.38 0.02 0.09 0.00 69.69 0.69 96 A C C 59.44 7.06 22.55 29.58 105.50 -160.19 -97.93 11.43 74.40 25.28 0.32 51.04 19.83 3.21 0.05 0.34 0.00 24.20 1.32 97 G C S 33.02 6.54 19.19 26.33 131.32 17.40 108.18 -168.91 89.04 10.27 0.70 17.10 56.22 15.67 0.05 0.75 0.00 9.05 1.16 98 T C S 101.12 3.21 19.03 23.01 109.09 -55.84 -94.07 83.63 93.08 6.25 0.67 17.96 58.39 16.74 0.05 0.73 0.00 5.28 0.85 99 G C S 30.34 7.18 19.58 27.36 132.55 52.48 116.91 -173.92 83.76 15.93 0.31 16.60 62.30 4.27 0.03 0.32 0.00 15.36 1.13 100 T C C 69.74 8.06 21.76 30.46 125.39 -69.51 -113.53 143.46 60.19 39.62 0.20 51.24 6.53 0.91 0.03 0.20 0.00 39.83 1.27 101 S E E 5.95 24.09 15.16 39.42 131.42 -173.67 -132.59 148.42 20.31 79.58 0.11 17.35 2.52 0.32 0.03 0.09 0.00 78.59 1.11 102 S E E 40.53 9.14 27.32 37.32 124.45 -157.00 -119.51 137.46 8.66 91.30 0.04 7.43 0.91 0.10 0.01 0.02 0.00 91.30 0.23 103 V E E 3.37 26.54 16.22 43.74 126.64 -170.93 -126.12 139.35 2.92 97.07 0.01 2.65 0.16 0.01 0.00 0.00 0.00 97.10 0.07 104 K E E 80.07 7.69 27.57 36.06 118.55 -157.09 -112.44 126.35 1.39 98.61 0.00 1.28 0.06 0.01 0.00 0.00 0.00 98.62 0.02 105 I E E 4.00 26.21 17.10 44.29 121.43 -166.73 -116.17 131.41 0.85 99.15 0.00 0.81 0.03 0.00 0.00 0.00 0.00 99.14 0.02 106 S E E 31.11 9.21 26.96 37.16 123.36 -169.44 -121.05 135.19 0.71 99.29 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.31 0.01 107 F E E 9.11 25.00 16.85 42.08 127.41 -172.11 -126.20 139.25 0.53 99.47 0.00 0.49 0.02 0.00 0.00 0.00 0.00 99.48 0.01 108 S E E 34.08 8.69 26.33 35.88 121.52 -163.75 -117.41 132.79 0.61 99.39 0.00 0.55 0.02 0.00 0.00 0.00 0.00 99.42 0.01 109 I E E 11.88 23.48 16.19 39.89 120.87 -163.92 -115.13 129.74 1.83 98.16 0.00 1.62 0.10 0.01 0.00 0.00 0.00 98.22 0.06 110 N E E 59.94 7.53 23.73 31.82 118.43 -165.38 -114.17 125.30 8.11 91.87 0.03 6.60 0.98 0.12 0.00 0.02 0.00 92.09 0.19 111 Y E E 52.40 17.96 13.20 30.73 124.64 -170.86 -116.02 138.15 28.29 71.62 0.10 24.67 2.51 0.34 0.02 0.08 0.00 71.64 0.74 112 K C C 123.36 4.24 17.36 22.69 115.31 -149.04 -101.24 125.22 66.80 33.12 0.08 65.32 0.71 0.22 0.02 0.04 0.00 32.70 0.99 113 F C C 94.86 11.79 12.80 24.89 112.54 -131.98 -81.57 129.70 99.84 0.16 0.00 99.84 0.05 0.01 0.00 0.00 0.00 0.09 0.01