# 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 102.29 4.26 17.29 22.40 105.29 47.45 -86.81 65.27 99.93 0.06 0.00 99.85 0.08 0.03 0.00 0.00 0.00 0.03 0.00 1 A C C 57.34 9.09 15.44 25.10 113.79 -130.69 -89.62 137.34 89.12 10.57 0.31 85.85 1.77 1.04 0.06 0.18 0.00 10.46 0.64 2 I C C 37.63 19.14 11.76 30.08 118.29 -136.33 -97.64 131.26 54.31 45.38 0.31 48.07 3.86 0.59 0.07 0.22 0.00 46.34 0.86 3 R E E 127.75 5.63 21.53 28.36 122.27 -164.32 -115.70 134.27 18.62 81.15 0.23 17.44 0.93 0.20 0.10 0.12 0.00 79.77 1.44 4 M E E 44.00 20.57 13.36 33.00 120.84 -159.44 -109.60 131.55 18.43 81.34 0.23 17.20 0.95 0.21 0.10 0.12 0.00 79.96 1.47 5 T E E 67.44 7.35 21.21 29.20 124.53 -170.67 -117.18 139.54 34.68 65.03 0.29 29.85 3.66 0.55 0.09 0.20 0.00 64.36 1.28 6 Q C C 72.22 14.22 15.66 29.70 125.50 -160.83 -121.58 140.28 63.48 36.18 0.34 44.04 18.51 1.48 0.07 0.30 0.00 34.23 1.37 7 S C C 56.01 9.94 17.60 28.11 119.21 -142.98 -101.13 143.15 88.46 11.34 0.21 57.71 29.22 1.57 0.03 0.21 0.00 10.49 0.76 8 P C C 54.75 9.90 16.49 27.19 115.79 18.83 -74.82 151.22 90.40 7.03 2.57 56.94 23.19 9.70 0.25 2.87 0.00 6.40 0.65 9 S C S 69.13 8.42 16.83 26.13 97.71 -148.32 -83.87 -20.40 79.02 18.77 2.22 28.85 40.39 9.42 0.19 2.16 0.00 18.05 0.94 10 S E E 57.93 6.51 20.16 27.87 135.08 17.76 -144.82 149.03 30.21 66.78 3.01 21.63 6.96 3.40 0.41 2.39 0.00 64.32 0.88 11 L E E 34.76 19.75 14.52 33.49 131.28 -175.27 -137.43 143.95 11.35 88.29 0.35 9.84 1.46 0.30 0.13 0.19 0.00 87.39 0.69 12 S E E 65.29 6.48 23.01 30.76 125.86 -158.04 -119.41 142.18 7.78 92.03 0.19 6.76 0.90 0.20 0.07 0.10 0.00 91.30 0.67 13 A E E 13.91 19.67 14.39 33.95 138.01 171.39 -146.53 159.19 20.80 78.89 0.32 17.59 2.62 0.47 0.09 0.21 0.00 78.28 0.74 14 S E E 55.79 4.90 23.64 28.43 123.66 -118.86 -93.20 155.26 39.03 60.34 0.62 32.11 5.49 1.37 0.22 0.50 0.00 56.53 3.79 15 V C T 60.52 15.34 14.12 29.28 109.28 -86.48 -61.10 134.40 90.22 8.05 1.73 3.80 11.12 76.18 0.19 1.44 0.00 6.31 0.96 16 G C T 44.74 4.93 19.96 25.60 96.56 23.05 88.67 -6.35 96.67 2.18 1.15 4.49 15.76 76.40 0.09 1.13 0.00 1.85 0.28 17 D C S 62.21 8.94 17.67 27.52 124.01 113.45 -86.41 156.50 92.36 6.76 0.88 37.09 51.18 4.42 0.12 0.79 0.00 5.58 0.84 18 R C C 125.95 8.29 19.74 28.91 118.15 -116.37 -87.97 136.20 68.57 31.34 0.09 64.00 2.71 0.27 0.01 0.07 0.00 32.42 0.52 19 V E E 11.45 22.52 14.65 37.26 126.52 -168.92 -123.18 140.87 3.20 96.80 0.00 3.06 0.09 0.00 0.00 0.00 0.00 96.69 0.16 20 T E E 60.65 8.44 25.21 34.13 118.65 -150.23 -109.08 129.01 0.71 99.29 0.00 0.66 0.02 0.00 0.00 0.00 0.00 99.30 0.02 21 I E E 4.96 25.50 17.01 43.26 120.67 -167.62 -116.04 129.49 1.82 98.18 0.00 1.65 0.06 0.00 0.00 0.00 0.00 98.26 0.02 22 T E E 42.78 9.71 26.98 37.45 121.15 -163.42 -111.00 133.76 8.74 91.25 0.01 7.97 0.25 0.01 0.00 0.00 0.00 91.70 0.06 23 C E E 4.02 25.78 17.01 43.30 125.64 -172.54 -124.18 138.50 11.27 88.70 0.02 10.34 0.54 0.03 0.00 0.01 0.00 88.88 0.20 24 R E E 104.82 7.27 27.34 35.40 118.95 -160.67 -114.75 131.30 9.74 90.17 0.08 9.10 0.55 0.08 0.04 0.04 0.00 88.32 1.87 25 A E E 10.26 23.66 13.78 37.02 120.52 -155.27 -97.22 142.45 48.46 50.94 0.60 45.04 2.26 0.48 0.25 0.36 0.00 48.75 2.87 26 S C C 51.11 7.43 20.16 28.02 114.34 -153.68 -88.88 163.19 82.67 15.86 1.47 52.35 25.69 4.66 0.28 1.34 0.00 14.21 1.48 27 Q C S 121.40 4.55 18.02 23.19 101.40 -50.01 -81.75 -17.62 90.82 4.67 4.52 15.88 53.49 22.22 0.81 3.22 0.00 3.41 0.97 28 S C C 65.80 5.88 18.93 25.49 115.09 40.90 -100.02 129.42 90.77 4.57 4.65 39.57 29.43 21.98 0.74 4.13 0.00 3.01 1.15 29 I C C 51.27 17.59 15.92 32.49 107.85 -133.83 -89.52 103.94 82.33 9.38 8.29 42.57 24.31 16.02 1.60 6.79 0.01 5.66 3.06 30 S C C 31.60 14.69 19.21 33.64 121.70 -133.67 -107.08 145.69 81.99 8.95 9.07 54.49 14.78 12.38 1.15 8.50 0.00 7.29 1.40 31 S C S 49.62 11.77 21.90 33.38 100.39 -155.35 -93.81 -13.52 81.60 12.84 5.56 24.44 46.37 10.73 0.45 4.95 0.00 12.08 0.97 32 Y E E 68.41 12.98 23.73 36.81 125.15 44.57 -124.76 138.02 32.97 63.09 3.94 22.46 7.30 4.32 0.59 3.24 0.00 61.11 0.97 33 L E E 4.31 25.86 18.74 44.95 126.93 -169.74 -120.38 138.78 9.23 90.72 0.05 8.33 0.73 0.06 0.01 0.03 0.00 90.62 0.22 34 N E E 29.34 14.97 27.74 42.76 126.44 -167.04 -118.94 142.65 1.35 98.65 0.00 1.21 0.06 0.00 0.00 0.00 0.00 98.71 0.02 35 W E E 9.84 24.34 21.53 45.84 124.74 -156.81 -114.22 140.12 0.81 99.19 0.00 0.74 0.03 0.00 0.00 0.00 0.00 99.22 0.01 36 Y E E 27.62 15.96 23.48 39.71 132.19 -174.30 -131.46 150.80 0.72 99.28 0.00 0.64 0.03 0.00 0.00 0.00 0.00 99.30 0.04 37 Q E E 44.91 14.28 20.99 35.56 121.36 -143.63 -108.88 134.85 3.58 96.42 0.00 2.95 0.33 0.02 0.00 0.00 0.00 96.61 0.09 38 Q E E 55.15 13.73 15.23 29.51 120.29 -153.08 -106.42 135.62 32.63 67.34 0.03 29.58 2.03 0.09 0.01 0.02 0.00 67.04 1.23 39 K C C 101.14 5.90 15.18 22.43 119.17 -137.24 -92.28 144.64 97.54 2.42 0.04 95.57 2.10 0.19 0.01 0.02 0.00 1.70 0.42 40 P C T 105.64 3.53 11.21 16.76 109.63 -85.10 -58.87 133.97 99.57 0.12 0.31 0.44 3.75 95.41 0.01 0.29 0.00 0.08 0.02 41 G C T 69.10 0.30 12.82 10.58 95.96 17.35 83.18 -2.94 99.58 0.10 0.32 0.53 3.76 95.28 0.01 0.34 0.00 0.07 0.02 42 K C S 110.63 4.15 10.90 17.21 128.92 92.25 -116.30 159.28 92.34 7.29 0.36 33.20 57.86 1.27 0.08 0.29 0.00 2.57 4.74 43 A C C 72.64 3.08 16.26 20.01 116.17 -97.60 -70.62 149.74 97.19 2.79 0.03 87.36 9.88 0.17 0.00 0.02 0.00 2.17 0.39 44 P C C 44.07 17.71 11.47 28.44 115.01 -101.56 -65.87 146.07 92.30 7.67 0.03 89.84 2.31 0.17 0.01 0.03 0.00 7.35 0.30 45 N E E 76.37 7.61 21.59 29.78 124.16 -153.22 -116.60 139.47 14.30 85.62 0.08 12.37 1.81 0.17 0.02 0.05 0.00 84.78 0.79 46 L E E 59.33 16.41 17.89 33.77 110.92 -115.09 -76.73 126.11 1.32 98.67 0.01 1.21 0.06 0.00 0.00 0.00 0.00 98.67 0.05 47 L E E 23.79 17.81 21.36 39.12 101.37 175.34 -95.64 -35.67 2.49 97.50 0.01 1.87 0.51 0.02 0.00 0.00 0.00 97.58 0.02 48 I E E 11.98 21.46 21.61 42.80 136.20 3.57 -148.18 142.26 0.47 99.52 0.00 0.41 0.03 0.00 0.00 0.00 0.00 99.54 0.01 49 Y E E 58.11 17.01 23.55 39.53 127.71 -171.21 -129.87 137.03 2.25 97.71 0.04 1.99 0.11 0.02 0.02 0.01 0.00 97.75 0.10 50 A E E 16.07 18.68 20.84 39.05 116.53 -162.44 -107.41 129.30 25.04 71.72 3.23 20.34 4.00 1.28 1.51 1.41 0.00 70.63 0.84 51 A C C 30.96 14.90 19.21 33.96 117.48 -164.36 -105.90 142.66 47.52 22.74 29.74 29.58 11.35 8.71 9.18 18.75 0.07 20.71 1.65 52 S C C 61.17 8.73 19.15 28.07 104.12 -141.84 -90.83 -7.71 54.22 9.38 36.40 24.42 15.47 16.67 11.48 23.18 0.14 6.65 1.98 53 S C C 59.03 8.14 18.04 26.68 109.30 53.86 -99.10 86.08 55.46 7.66 36.88 28.93 13.01 15.33 12.76 22.87 0.10 4.71 2.29 54 L C C 62.76 15.04 12.32 26.72 108.41 101.85 -88.41 95.52 63.90 8.80 27.31 39.71 13.67 10.84 14.42 12.80 0.07 5.21 3.27 55 E C C 117.56 5.55 14.89 21.76 112.17 82.09 -95.21 118.86 66.94 11.97 21.09 38.26 14.05 15.32 11.18 9.28 0.12 6.65 5.16 56 S C T 77.57 4.88 13.90 20.14 108.23 -105.57 -82.98 111.72 84.98 3.17 11.85 16.28 17.79 51.16 5.36 6.06 0.03 1.83 1.49 57 G C T 56.55 2.97 15.71 19.50 99.58 -31.48 83.44 1.53 94.98 1.82 3.20 17.48 26.81 50.93 0.64 2.39 0.00 1.14 0.60 58 V C C 49.44 13.13 11.45 25.40 118.56 109.61 -101.46 133.26 84.06 15.19 0.75 48.23 35.34 1.63 0.32 0.43 0.00 5.69 8.35 59 P C C 67.47 7.37 17.82 26.16 111.55 -108.26 -66.91 147.13 89.33 8.04 2.63 68.82 12.65 7.42 0.73 2.14 0.00 6.13 2.11 60 S C C 51.62 14.21 15.52 29.11 105.08 -121.18 -81.07 48.21 86.60 9.20 4.20 58.80 16.67 11.02 0.80 3.81 0.00 7.46 1.42 61 R C C 104.41 10.05 20.93 31.01 110.79 105.82 -108.41 66.07 66.67 29.76 3.57 39.05 22.56 5.82 0.84 2.59 0.01 27.41 1.72 62 F E E 29.85 22.24 14.49 35.99 123.77 125.59 -112.76 138.26 21.39 77.73 0.88 17.87 3.41 0.86 0.46 0.51 0.00 74.75 2.14 63 S E E 52.62 7.74 23.64 32.42 134.89 -176.11 -137.29 155.80 11.43 88.33 0.24 9.98 1.21 0.26 0.10 0.11 0.00 87.41 0.92 64 G E E 23.30 16.99 16.70 32.73 140.96 160.56 -161.12 168.18 13.79 86.05 0.16 11.60 1.94 0.37 0.04 0.09 0.00 85.27 0.69 65 S E E 64.19 5.82 21.47 28.84 134.55 -155.02 -143.68 155.41 21.77 78.05 0.18 18.42 2.74 0.54 0.05 0.13 0.00 77.28 0.84 66 G E E 28.69 12.73 15.38 28.29 138.50 143.41 -167.86 173.98 41.42 58.31 0.28 27.30 13.04 2.35 0.04 0.29 0.00 55.64 1.34 67 S C E 75.97 3.60 21.00 25.16 118.79 -119.28 -118.24 114.99 59.29 39.73 0.97 27.69 24.17 9.50 0.14 1.04 0.01 34.26 3.20 68 G C S 32.29 10.71 18.88 29.44 109.25 -48.24 66.37 -126.47 97.47 1.69 0.84 3.36 51.18 43.10 0.03 0.86 0.00 1.25 0.21 69 T C S 55.65 14.26 17.09 31.16 97.98 -9.40 -99.48 -0.60 97.07 2.28 0.64 3.66 51.95 41.65 0.02 0.66 0.00 1.85 0.22 70 D E E 60.06 8.88 22.48 32.50 119.01 87.94 -104.67 130.06 34.89 64.90 0.21 24.33 9.96 1.36 0.04 0.24 0.00 60.83 3.24 71 F E E 7.95 24.65 16.16 41.22 129.19 -175.45 -127.53 142.79 14.92 85.07 0.01 14.06 0.50 0.03 0.00 0.00 0.00 84.93 0.47 72 T E E 35.22 10.65 27.32 39.00 124.80 -162.95 -120.29 135.61 4.77 95.23 0.00 4.27 0.20 0.00 0.00 0.00 0.00 95.40 0.13 73 L E E 2.82 26.26 19.18 46.37 119.89 -162.06 -113.38 128.58 0.72 99.28 0.00 0.79 0.01 0.00 0.00 0.00 0.00 99.19 0.01 74 T E E 39.27 10.31 27.33 38.46 119.84 -164.13 -114.91 128.72 0.22 99.78 0.00 0.25 0.00 0.00 0.00 0.00 0.00 99.73 0.01 75 I E E 7.13 24.20 16.39 41.20 117.40 -166.38 -113.32 124.95 2.70 97.30 0.00 2.80 0.02 0.00 0.00 0.00 0.00 96.64 0.53 76 S C C 49.10 7.10 23.05 30.31 118.78 -163.64 -102.33 161.04 93.24 6.69 0.06 50.93 37.44 3.73 0.00 0.12 0.00 7.52 0.25 77 S C S 66.63 4.56 24.12 28.68 100.75 9.95 59.45 65.44 99.08 0.89 0.03 9.44 85.48 4.19 0.00 0.04 0.00 0.77 0.08 78 L C C 18.30 23.86 10.56 33.96 112.93 -140.36 -75.85 129.72 99.25 0.74 0.01 97.41 1.92 0.03 0.00 0.00 0.00 0.26 0.36 79 Q C C 80.90 4.61 23.94 28.44 130.09 -175.05 -125.97 155.11 99.87 0.12 0.01 99.45 0.44 0.00 0.00 0.00 0.00 0.02 0.08 80 P H G 71.09 12.52 15.15 27.92 90.99 -106.43 -58.26 -32.05 3.18 0.02 96.80 0.16 0.18 2.01 0.23 97.39 0.00 0.01 0.00 81 E H G 126.99 3.55 21.25 25.46 89.77 62.87 -69.95 -16.46 2.58 0.02 97.40 0.08 0.13 1.77 0.15 97.85 0.00 0.02 0.00 82 D H G 15.19 20.38 16.11 36.89 93.84 60.88 -87.52 -3.75 3.33 0.04 96.63 0.37 0.30 1.55 0.21 97.54 0.00 0.03 0.00 83 F C C 50.13 17.30 19.78 37.00 116.77 105.37 -76.42 135.68 91.96 7.84 0.20 88.81 3.28 0.10 0.02 0.19 0.00 7.33 0.28 84 A E E 14.76 16.33 22.87 39.00 143.68 149.31 -159.89 175.13 6.11 93.88 0.01 5.77 0.30 0.02 0.00 0.00 0.00 93.49 0.41 85 T E E 37.40 13.16 25.44 38.90 120.22 -86.05 -105.38 135.85 0.81 99.19 0.00 0.73 0.03 0.00 0.00 0.00 0.00 99.20 0.02 86 Y E E 7.14 25.23 19.72 45.13 125.39 -164.28 -116.67 138.86 0.51 99.49 0.00 0.44 0.03 0.00 0.00 0.00 0.00 99.52 0.02 87 Y E E 36.67 15.45 27.31 42.78 129.23 -168.58 -124.64 145.27 1.96 98.03 0.01 1.67 0.12 0.01 0.00 0.01 0.00 98.11 0.07 88 C E E 3.03 25.46 21.11 46.85 122.99 -161.21 -116.57 135.50 9.74 90.01 0.25 8.23 1.00 0.22 0.09 0.12 0.00 90.06 0.27 89 Q E E 38.76 14.17 26.24 40.36 125.70 -170.15 -121.72 139.69 10.13 89.47 0.40 9.01 0.83 0.22 0.15 0.18 0.00 89.12 0.49 90 Q E E 29.60 19.74 18.73 37.73 121.71 -159.15 -110.06 137.16 17.66 81.75 0.59 14.35 2.97 0.77 0.20 0.33 0.00 80.61 0.77 91 S E E 39.90 10.66 19.37 30.66 124.75 -168.05 -123.02 142.98 32.60 66.81 0.59 25.44 6.24 1.54 0.15 0.42 0.00 64.74 1.47 92 Y C C 99.75 10.98 13.46 25.13 112.47 -170.85 -107.21 108.85 61.42 37.80 0.78 38.05 18.61 5.80 0.14 0.71 0.00 34.60 2.09 93 S C S 81.93 2.69 15.28 18.58 110.13 -34.99 -94.47 57.74 93.26 5.90 0.83 20.09 52.41 20.80 0.08 0.84 0.00 5.09 0.69 94 T C S 91.71 3.13 14.03 18.40 118.94 3.80 -106.05 134.37 95.34 3.77 0.90 21.16 56.07 18.17 0.10 0.89 0.00 2.99 0.62 95 P C C 78.08 6.26 15.28 22.73 114.38 -60.69 -71.00 148.83 82.09 17.00 0.91 46.40 26.24 9.03 0.12 0.91 0.00 16.29 1.00 96 L C C 60.06 14.78 13.96 28.78 115.38 -117.66 -83.11 134.92 54.57 44.97 0.46 46.74 4.77 1.44 0.09 0.37 0.00 45.53 1.07 97 T E E 55.71 10.95 19.80 31.19 123.51 -164.22 -117.22 137.57 19.80 79.95 0.26 17.15 1.89 0.43 0.10 0.16 0.00 76.61 3.66 98 F E E 57.29 18.12 16.48 33.80 118.14 -156.99 -104.62 130.48 22.22 77.48 0.30 17.81 3.62 0.93 0.11 0.22 0.00 73.47 3.83 99 G C E 25.47 12.45 19.78 31.88 118.37 -153.99 -72.05 -162.56 57.11 42.58 0.31 37.33 15.90 3.78 0.04 0.30 0.00 41.70 0.95 100 G C C 41.34 7.87 22.39 29.97 105.12 -47.52 -65.05 4.60 69.38 30.38 0.23 50.06 15.27 2.65 0.03 0.25 0.00 31.18 0.55 101 G C C 17.55 17.37 16.51 32.89 126.53 -136.75 95.33 174.42 58.92 40.98 0.10 51.52 4.81 0.44 0.01 0.08 0.00 42.64 0.48 102 T E E 33.79 15.70 19.75 35.45 128.40 -108.55 -125.29 144.35 8.19 91.80 0.01 7.55 0.34 0.02 0.00 0.00 0.00 91.88 0.20 103 K E E 101.20 9.82 22.82 32.95 119.48 -140.48 -101.26 133.89 0.97 99.03 0.00 0.84 0.05 0.00 0.00 0.00 0.00 99.08 0.02 104 V E E 11.66 22.80 14.81 37.58 120.99 -164.56 -116.17 130.90 0.80 99.20 0.00 0.76 0.02 0.00 0.00 0.00 0.00 99.20 0.02 105 E E E 96.33 5.42 23.98 29.69 116.99 -154.29 -105.58 129.10 1.85 98.14 0.00 1.83 0.05 0.00 0.00 0.00 0.00 98.04 0.07 106 I E E 26.97 21.09 11.04 31.32 115.84 -154.61 -99.28 126.55 16.28 83.68 0.04 16.47 0.21 0.03 0.02 0.01 0.00 82.56 0.69 107 K C C 126.67 4.10 20.13 25.01 116.04 -163.20 -104.09 131.49 99.15 0.85 0.00 99.22 0.05 0.01 0.00 0.00 0.00 0.70 0.01