# 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 92.16 5.33 21.22 26.83 108.69 -148.62 -84.75 100.46 99.77 0.23 0.00 99.66 0.13 0.03 0.00 0.00 0.00 0.17 0.01 1 I E E 34.44 20.41 12.00 31.51 117.71 -156.52 -101.64 129.47 46.40 53.53 0.07 45.66 0.53 0.11 0.01 0.04 0.00 52.89 0.76 2 V E E 66.72 7.41 21.62 29.81 121.07 -165.47 -115.53 132.50 9.98 89.96 0.06 9.22 0.61 0.08 0.02 0.03 0.00 89.46 0.57 3 L E E 36.72 20.11 14.53 34.09 119.10 -155.52 -105.70 130.71 7.98 91.96 0.06 7.46 0.43 0.07 0.02 0.03 0.00 91.53 0.47 4 T E E 61.70 8.40 21.39 30.39 124.17 -171.69 -119.85 139.80 20.48 79.39 0.13 17.57 2.17 0.31 0.03 0.09 0.00 78.96 0.87 5 Q C E 62.01 15.68 15.01 30.33 127.96 -170.61 -128.50 141.69 50.53 49.25 0.22 38.61 11.08 0.99 0.04 0.21 0.00 47.85 1.22 6 S C C 64.37 7.48 18.86 27.14 118.18 -132.26 -93.43 141.31 83.55 16.27 0.18 50.25 31.27 1.79 0.02 0.20 0.00 15.69 0.78 7 P C C 55.81 9.55 16.34 26.76 115.92 28.03 -75.38 151.93 92.00 7.37 0.62 49.90 35.21 6.61 0.06 0.71 0.00 6.99 0.53 8 T C S 78.80 9.53 17.08 27.22 97.61 -149.14 -86.11 -21.11 84.65 14.97 0.38 25.51 53.56 4.27 0.03 0.40 0.00 15.70 0.54 9 S E E 51.91 7.81 20.81 29.62 138.24 19.99 -148.49 150.48 18.51 81.10 0.39 14.57 3.49 0.71 0.06 0.31 0.00 80.43 0.43 10 L E E 23.85 20.82 15.66 36.05 129.61 -171.44 -136.04 140.36 2.53 97.45 0.01 2.28 0.16 0.01 0.00 0.01 0.00 97.43 0.11 11 A E E 56.22 8.65 24.28 33.41 120.88 -150.07 -111.30 133.65 1.41 98.59 0.01 1.30 0.09 0.01 0.00 0.00 0.00 98.55 0.05 12 V E E 14.80 20.60 15.14 35.68 135.38 174.33 -141.09 155.34 4.87 95.11 0.02 4.57 0.21 0.02 0.00 0.01 0.00 94.98 0.20 13 S E E 48.47 6.10 23.59 29.73 120.43 -117.21 -83.06 155.43 34.93 64.94 0.13 32.67 1.63 0.25 0.04 0.09 0.00 62.67 2.65 14 L C T 65.12 15.51 14.42 29.69 108.94 -83.40 -60.14 134.61 98.25 1.16 0.59 0.73 4.03 93.89 0.03 0.44 0.00 0.74 0.13 15 G C T 46.34 4.33 19.83 24.93 96.00 22.29 88.36 -6.43 99.17 0.42 0.42 0.77 4.49 94.03 0.02 0.36 0.00 0.28 0.06 16 Q C C 80.94 7.77 18.33 27.20 124.13 113.39 -90.40 154.83 94.82 4.90 0.29 55.19 39.21 0.81 0.05 0.25 0.00 3.81 0.68 17 R C C 128.14 8.86 18.83 28.88 122.27 -126.83 -102.48 141.80 76.82 23.16 0.02 77.05 0.59 0.04 0.00 0.01 0.00 21.63 0.67 18 A E E 9.91 21.54 15.16 36.61 130.56 -171.33 -130.52 147.89 1.53 98.46 0.00 1.50 0.04 0.00 0.00 0.00 0.00 98.30 0.16 19 T E E 66.29 8.12 24.88 33.63 120.35 -146.94 -113.47 130.94 0.60 99.40 0.00 0.58 0.02 0.00 0.00 0.00 0.00 99.38 0.01 20 I E E 5.76 25.45 16.63 42.73 121.40 -168.10 -117.51 130.60 3.48 96.51 0.00 3.36 0.10 0.01 0.00 0.00 0.00 96.47 0.06 21 S E E 40.66 9.47 26.70 36.64 122.76 -164.52 -110.83 138.58 16.76 83.22 0.02 15.19 0.67 0.04 0.00 0.01 0.00 83.98 0.11 22 C E E 5.53 25.06 17.17 42.35 132.94 171.87 -136.88 148.27 17.21 82.72 0.07 15.63 1.26 0.11 0.02 0.04 0.00 82.51 0.42 23 R E E 100.99 8.15 27.16 36.13 122.78 -153.50 -113.48 134.37 8.54 91.28 0.18 7.84 0.60 0.11 0.12 0.08 0.00 86.49 4.76 24 A E E 8.49 24.25 14.79 38.81 118.95 -151.69 -94.52 140.60 42.59 55.91 1.49 38.97 2.56 0.61 0.83 0.74 0.00 53.55 2.73 25 S C C 46.04 9.08 20.68 30.09 114.18 -131.38 -83.22 155.28 74.63 17.41 7.97 57.00 13.73 3.97 3.68 4.08 0.01 15.53 2.01 26 E C S 115.33 6.31 18.33 25.24 102.90 -100.04 -77.23 -19.24 62.56 5.66 31.77 22.23 24.31 17.88 17.82 12.32 0.24 3.40 1.80 27 S C C 56.95 6.97 18.52 26.01 106.40 57.67 -84.56 68.35 65.61 5.51 28.87 39.68 11.02 15.07 15.94 12.95 0.04 3.51 1.79 28 V C C 32.82 19.22 12.64 30.55 98.76 79.61 -78.91 -21.09 49.01 7.42 43.57 26.63 11.93 12.16 26.29 15.75 0.31 4.02 2.90 29 D C C 81.27 8.24 16.07 24.93 98.77 67.25 -78.13 -17.63 54.32 5.54 40.14 28.83 10.19 16.11 24.11 15.24 0.18 3.28 2.06 30 N C T 107.69 3.93 16.42 21.20 97.74 57.58 -82.59 -10.35 58.66 3.57 37.77 15.22 13.95 29.91 21.28 15.64 0.32 1.96 1.72 31 F C T 105.57 8.67 15.65 24.94 100.24 49.71 -92.44 -0.27 71.77 2.21 26.02 11.30 17.51 42.78 14.88 10.92 0.13 1.17 1.31 32 G C S 32.07 7.80 18.44 27.05 104.09 -106.07 84.37 3.72 90.15 6.54 3.31 20.03 38.96 31.71 0.60 2.50 0.00 5.03 1.17 33 I C C 55.88 13.10 18.79 32.19 118.15 96.48 -103.60 132.67 69.82 28.94 1.24 53.00 12.05 4.07 0.29 1.05 0.00 27.24 2.30 34 S E E 16.38 19.73 19.20 38.27 118.80 -166.24 -111.96 140.65 43.48 56.06 0.46 34.98 7.15 1.19 0.10 0.37 0.00 55.10 1.11 35 F E E 44.41 14.84 25.83 40.63 130.58 -161.10 -129.20 144.98 13.17 86.76 0.08 11.22 1.68 0.16 0.02 0.05 0.00 86.51 0.37 36 M E E 4.61 25.86 20.75 46.87 125.01 -162.95 -120.49 136.50 2.55 97.44 0.01 2.25 0.16 0.01 0.00 0.00 0.00 97.52 0.05 37 N E E 27.34 15.91 27.31 42.98 126.98 -170.36 -123.11 141.99 0.69 99.31 0.00 0.61 0.03 0.00 0.00 0.00 0.00 99.35 0.01 38 W E E 10.02 24.15 21.45 45.51 126.55 -162.45 -119.05 139.91 0.53 99.47 0.00 0.48 0.02 0.00 0.00 0.00 0.00 99.49 0.01 39 F E E 26.37 15.83 24.21 40.21 132.13 -174.26 -131.73 149.62 0.62 99.38 0.00 0.53 0.03 0.00 0.00 0.00 0.00 99.42 0.02 40 Q E E 40.73 15.04 21.02 36.23 120.45 -143.25 -106.09 134.74 4.04 95.95 0.01 3.34 0.37 0.02 0.00 0.00 0.00 96.15 0.13 41 Q E E 49.82 14.19 15.75 30.45 120.70 -148.32 -105.85 137.11 36.99 62.99 0.02 33.89 2.09 0.07 0.00 0.02 0.00 62.74 1.20 42 K C C 98.13 6.26 15.76 23.27 119.34 -134.85 -90.47 146.58 97.73 2.24 0.03 95.60 2.21 0.18 0.01 0.02 0.00 1.63 0.35 43 P C T 101.24 4.40 11.50 17.88 109.71 -85.21 -59.00 134.76 99.81 0.07 0.11 0.25 3.20 96.40 0.00 0.10 0.00 0.04 0.01 44 G C T 69.03 0.29 13.29 10.81 94.77 18.59 83.95 -3.25 99.84 0.05 0.11 0.35 3.21 96.29 0.00 0.11 0.00 0.03 0.01 45 Q C S 85.10 6.12 9.63 17.87 126.55 101.07 -109.65 151.82 96.27 3.68 0.05 30.47 66.23 0.17 0.01 0.03 0.00 1.12 1.97 46 P C C 99.83 1.75 17.33 18.69 116.19 -96.52 -64.72 149.65 98.60 1.39 0.01 92.22 6.37 0.12 0.00 0.01 0.00 1.11 0.17 47 P C C 47.91 17.70 10.89 27.83 115.08 -101.40 -64.21 144.37 95.11 4.87 0.01 93.52 1.54 0.11 0.00 0.01 0.00 4.67 0.16 48 K E E 92.88 8.03 21.27 30.07 125.44 -159.97 -122.64 139.41 9.77 90.21 0.03 8.63 0.87 0.06 0.01 0.02 0.00 89.76 0.66 49 L E E 62.89 15.47 18.65 33.73 110.79 -114.28 -74.63 127.59 0.87 99.13 0.00 0.78 0.03 0.00 0.00 0.00 0.00 99.16 0.02 50 L E E 18.23 19.29 20.84 40.14 101.43 176.25 -96.60 -35.86 2.33 97.66 0.01 1.53 0.66 0.01 0.00 0.00 0.00 97.77 0.01 51 I E E 11.62 21.08 21.62 42.64 136.77 3.40 -148.89 144.43 0.32 99.68 0.00 0.26 0.02 0.00 0.00 0.00 0.00 99.71 0.00 52 Y E E 61.93 17.34 23.59 39.73 128.10 -170.36 -130.13 136.43 0.97 99.01 0.02 0.85 0.04 0.01 0.01 0.00 0.00 99.07 0.03 53 A E E 16.96 18.69 22.03 40.06 123.10 -169.49 -118.50 133.83 12.71 86.75 0.54 10.53 1.64 0.37 0.23 0.21 0.00 86.57 0.44 54 A C E 26.51 15.86 20.70 36.34 123.30 -170.59 -116.35 142.45 45.63 44.67 9.71 32.42 9.39 5.42 2.36 6.71 0.01 42.31 1.39 55 S C C 42.99 12.28 19.09 31.29 118.96 -145.93 -109.22 146.83 67.54 17.52 14.94 27.32 21.35 21.55 3.08 10.64 0.08 13.64 2.35 56 N C C 96.25 6.74 18.97 26.28 101.80 12.21 -85.89 59.93 75.22 10.07 14.71 34.18 19.87 23.04 3.19 10.61 0.04 6.45 2.63 57 L C C 66.55 13.74 12.89 26.41 104.19 155.52 -84.81 21.17 79.37 7.70 12.93 36.68 21.46 22.69 3.63 8.36 0.03 4.09 3.05 58 G C C 49.29 4.70 16.31 22.25 107.38 -119.25 55.20 7.88 86.94 4.48 8.57 35.46 23.08 29.13 1.75 6.41 0.01 2.35 1.82 59 S C T 73.94 5.56 14.84 21.52 107.48 50.65 -91.79 67.97 88.40 3.79 7.81 24.86 25.33 38.77 1.41 6.00 0.00 1.98 1.66 60 G C T 47.48 5.72 16.33 23.15 104.27 -67.82 84.77 4.42 92.34 4.71 2.95 31.30 29.16 32.23 0.40 2.73 0.00 2.84 1.34 61 V C C 46.22 15.18 12.94 28.31 117.85 122.31 -98.78 132.81 85.74 13.33 0.93 54.71 29.90 1.87 0.34 0.62 0.00 6.34 6.23 62 P C C 59.77 9.24 18.50 28.48 112.31 -110.04 -67.25 147.98 86.73 9.27 4.00 66.65 12.43 7.16 0.84 3.55 0.00 6.87 2.50 63 A C C 50.78 13.53 16.49 29.63 100.01 -113.33 -72.02 1.70 83.50 10.96 5.54 48.03 22.94 12.66 0.66 5.44 0.00 8.97 1.30 64 R C C 108.82 9.44 21.28 30.94 119.24 58.10 -112.19 128.37 61.45 33.41 5.15 38.63 16.50 7.45 0.84 4.08 0.00 31.02 1.47 65 F E E 28.03 22.83 14.09 36.21 125.29 135.70 -117.10 140.53 19.90 79.60 0.50 17.48 2.27 0.51 0.23 0.28 0.00 77.64 1.58 66 S E E 55.18 6.78 24.19 32.16 134.79 -175.17 -136.67 154.87 8.33 91.55 0.12 7.44 0.75 0.13 0.05 0.05 0.00 90.94 0.65 67 G E E 21.37 18.77 15.13 32.77 140.47 164.16 -156.28 167.88 10.70 89.21 0.09 9.08 1.31 0.22 0.02 0.05 0.00 88.88 0.44 68 S E E 63.90 5.08 22.11 28.79 135.33 -160.80 -144.72 157.84 15.47 84.43 0.10 13.35 1.70 0.28 0.02 0.06 0.00 83.92 0.65 69 G E E 29.94 11.36 15.46 27.43 139.08 132.85 100.86 166.40 32.15 67.68 0.16 23.51 8.49 1.13 0.03 0.16 0.00 65.49 1.19 70 S C C 76.16 3.36 20.50 24.46 116.86 -107.31 -120.08 125.62 57.11 42.46 0.43 42.82 12.12 2.90 0.09 0.46 0.00 37.96 3.65 71 G C S 35.43 9.63 18.69 28.42 107.95 -50.14 65.03 -123.46 98.66 0.80 0.54 2.00 53.42 43.41 0.02 0.52 0.00 0.54 0.11 72 T C S 59.09 13.74 16.59 30.22 99.12 -9.87 -98.57 -1.37 98.55 1.00 0.44 1.97 53.97 42.80 0.01 0.41 0.00 0.72 0.11 73 D E E 64.06 8.53 22.23 31.83 121.01 83.44 -109.73 133.65 42.88 56.94 0.18 26.79 16.03 1.60 0.03 0.22 0.00 52.56 2.78 74 F E E 9.58 24.44 15.71 40.39 128.58 -174.19 -126.94 142.93 18.50 81.49 0.01 17.34 0.67 0.05 0.00 0.01 0.00 81.10 0.83 75 S E E 30.37 10.44 27.07 38.33 126.49 -164.35 -122.38 140.59 7.20 92.80 0.00 6.52 0.24 0.01 0.00 0.00 0.00 93.13 0.10 76 L E E 3.78 26.06 17.90 44.79 121.66 -162.28 -117.13 130.91 0.80 99.20 0.00 0.80 0.02 0.00 0.00 0.00 0.00 99.17 0.01 77 N E E 59.33 8.96 27.18 36.75 119.21 -164.00 -114.74 128.66 0.22 99.78 0.00 0.24 0.00 0.00 0.00 0.00 0.00 99.74 0.02 78 I E E 8.94 24.33 15.30 40.16 118.61 -163.06 -111.22 125.86 2.65 97.35 0.00 2.76 0.03 0.00 0.00 0.00 0.00 96.66 0.54 79 H C C 87.23 7.10 22.77 30.09 121.53 -156.08 -102.89 144.37 89.77 10.21 0.02 67.76 19.58 0.70 0.00 0.04 0.00 11.67 0.26 80 P C S 77.29 5.29 22.67 27.85 109.67 -1.50 -65.78 136.69 98.99 0.99 0.02 12.42 84.60 2.03 0.00 0.02 0.00 0.83 0.08 81 M C C 26.65 22.98 10.00 32.04 113.92 -127.65 -76.70 135.22 99.12 0.87 0.01 98.53 0.79 0.02 0.00 0.00 0.00 0.32 0.34 82 E C C 89.90 3.89 22.10 25.83 130.16 -170.90 -119.92 161.28 99.58 0.39 0.03 99.38 0.31 0.01 0.01 0.01 0.00 0.07 0.22 83 D H G 100.74 6.56 15.23 23.54 91.15 -99.67 -58.88 -32.93 3.77 0.02 96.22 0.17 0.23 2.45 0.27 96.86 0.00 0.01 0.00 84 D H G 102.64 3.31 20.29 24.26 90.23 61.92 -72.47 -14.97 3.50 0.03 96.47 0.11 0.18 2.39 0.19 97.12 0.00 0.02 0.00 85 D H G 10.77 21.66 14.57 36.73 93.97 62.18 -87.52 -2.96 4.73 0.06 95.21 0.73 0.51 1.98 0.31 96.41 0.00 0.05 0.00 86 T C C 38.88 15.02 20.14 35.59 116.61 108.87 -76.79 137.99 95.70 4.23 0.07 93.01 2.85 0.08 0.01 0.05 0.00 3.80 0.21 87 A E E 14.39 16.21 22.28 38.49 145.51 138.49 -164.63 174.35 6.95 93.04 0.01 6.60 0.36 0.02 0.00 0.00 0.00 92.47 0.55 88 M E E 54.52 12.88 25.57 38.71 119.17 -92.08 -102.20 134.73 0.68 99.32 0.00 0.64 0.02 0.00 0.00 0.00 0.00 99.32 0.01 89 Y E E 6.47 25.47 19.75 45.52 124.40 -165.59 -116.03 138.89 0.28 99.72 0.00 0.25 0.01 0.00 0.00 0.00 0.00 99.74 0.00 90 F E E 24.51 17.07 27.52 44.36 128.65 -168.97 -124.10 144.46 0.57 99.43 0.00 0.50 0.02 0.00 0.00 0.00 0.00 99.46 0.01 91 C E E 2.59 25.61 22.35 48.18 123.85 -154.42 -116.60 137.92 2.79 97.20 0.01 2.48 0.13 0.01 0.00 0.00 0.00 97.30 0.07 92 Q E E 29.18 15.96 26.22 41.94 127.56 -169.35 -123.84 139.94 2.57 97.42 0.01 2.30 0.12 0.01 0.00 0.00 0.00 97.39 0.17 93 Q E E 28.56 18.79 19.53 37.91 124.18 -158.72 -115.22 139.81 9.43 90.52 0.05 7.78 1.36 0.16 0.01 0.04 0.00 90.22 0.43 94 S E E 34.39 11.64 17.63 30.18 120.84 -159.32 -115.55 140.70 41.31 58.54 0.14 34.72 5.00 0.65 0.02 0.13 0.00 58.42 1.05 95 K C S 114.03 7.70 14.50 23.18 106.45 -171.01 -99.72 -8.83 82.48 16.88 0.64 31.35 39.82 11.32 0.07 0.66 0.00 15.58 1.19 96 E C S 139.89 2.04 15.46 17.64 107.12 23.31 -93.71 -29.16 97.37 2.01 0.63 13.92 64.26 19.24 0.05 0.64 0.00 1.52 0.37 97 V C S 94.91 3.94 14.00 19.37 119.00 -3.31 -110.85 132.26 95.93 3.48 0.60 19.09 65.71 11.19 0.05 0.62 0.00 2.77 0.56 98 P C C 71.05 6.92 16.34 24.28 114.62 -19.30 -70.34 149.14 83.33 16.17 0.51 53.76 22.45 5.97 0.06 0.56 0.00 16.40 0.81 99 L C E 47.44 16.99 14.44 31.13 114.71 -114.98 -79.07 136.07 50.22 49.61 0.17 44.78 3.00 0.62 0.03 0.14 0.00 50.84 0.58 100 T E E 45.25 12.01 22.01 34.26 127.88 -171.48 -124.91 144.15 8.67 91.28 0.05 7.75 0.60 0.08 0.02 0.03 0.00 89.33 2.19 101 F E E 46.45 20.19 17.82 36.98 118.13 -136.44 -100.06 132.78 11.91 88.02 0.07 10.29 1.15 0.18 0.03 0.05 0.00 85.50 2.81 102 G C C 18.08 14.33 19.83 33.94 118.77 -142.27 -81.90 -165.96 61.90 37.94 0.16 45.63 13.14 1.82 0.02 0.16 0.00 38.55 0.69 103 A C C 64.03 7.28 23.94 31.15 105.35 -69.20 -76.85 28.70 74.22 25.64 0.15 58.08 13.11 1.52 0.02 0.16 0.00 26.56 0.55 104 G C C 14.44 19.24 17.34 35.26 129.02 -125.74 32.27 174.87 68.63 31.31 0.06 61.69 4.53 0.35 0.01 0.06 0.00 32.96 0.41 105 T E E 25.44 17.02 20.24 37.27 127.40 -109.24 -119.62 144.29 10.01 89.98 0.01 9.37 0.42 0.02 0.00 0.00 0.00 89.77 0.41 106 K E E 100.05 9.55 23.94 33.77 117.76 -135.68 -95.83 133.36 1.37 98.62 0.00 1.24 0.06 0.00 0.00 0.00 0.00 98.64 0.05 107 L E E 10.19 23.84 15.03 39.01 121.50 -165.30 -115.10 132.73 1.17 98.82 0.00 1.14 0.03 0.00 0.00 0.00 0.00 98.80 0.02 108 E E E 87.62 6.31 24.86 31.52 119.54 -157.62 -108.70 130.10 1.64 98.36 0.01 1.58 0.08 0.01 0.00 0.00 0.00 98.22 0.10 109 L E E 23.19 21.37 11.61 32.48 117.28 -153.05 -101.33 129.07 11.81 88.13 0.05 11.26 0.48 0.07 0.02 0.03 0.00 87.45 0.69 110 K C C 117.26 4.40 17.21 22.83 121.80 -162.94 -110.59 143.34 52.89 47.04 0.06 51.88 0.63 0.13 0.02 0.03 0.00 46.29 1.02 111 R C C 153.20 5.51 14.50 21.63 110.16 -99.28 -69.71 135.04 99.80 0.19 0.00 99.65 0.17 0.03 0.00 0.00 0.00 0.13 0.01