# 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 Q C C 106.24 6.12 19.53 26.51 115.66 -160.48 -100.91 123.50 99.35 0.65 0.00 99.37 0.07 0.01 0.00 0.00 0.00 0.53 0.01 1 V E E 29.61 20.45 11.46 30.88 123.13 -166.01 -115.30 135.23 39.74 60.24 0.02 39.69 0.34 0.05 0.01 0.01 0.00 59.27 0.64 2 T E E 70.43 4.80 23.20 28.23 120.04 -160.27 -112.93 135.43 9.11 90.88 0.02 8.30 0.57 0.05 0.00 0.01 0.00 90.79 0.28 3 L E E 34.18 22.21 12.36 33.60 121.04 -155.27 -109.82 133.51 4.92 95.07 0.01 4.69 0.19 0.02 0.00 0.00 0.00 94.98 0.12 4 K E E 103.79 5.54 23.33 29.66 126.22 -171.93 -125.53 140.85 5.71 94.26 0.04 5.07 0.48 0.06 0.01 0.01 0.00 94.18 0.20 5 E E E 82.73 15.93 15.07 30.15 116.87 -124.38 -90.28 137.04 18.70 81.19 0.11 17.04 1.41 0.20 0.03 0.06 0.00 80.40 0.87 6 S C C 47.92 10.89 17.44 28.72 104.14 -166.33 -95.02 -4.69 65.58 34.28 0.14 55.13 8.71 0.67 0.03 0.13 0.00 34.34 0.99 7 G C S 30.00 6.28 20.06 27.06 135.31 -86.64 118.82 -175.07 83.15 16.80 0.05 31.71 50.18 1.11 0.00 0.06 0.00 16.43 0.50 8 P C C 77.41 8.50 17.34 26.61 114.29 -33.47 -69.22 145.97 86.39 13.56 0.05 57.93 26.35 1.11 0.00 0.07 0.00 14.19 0.35 9 G E E 22.72 13.32 17.79 31.02 134.44 165.79 -150.76 171.39 16.37 83.61 0.02 12.83 3.47 0.17 0.00 0.02 0.00 82.89 0.62 10 I E E 87.95 8.87 21.87 31.13 119.09 -73.38 -107.58 127.80 2.44 97.56 0.00 2.24 0.15 0.01 0.00 0.00 0.00 97.38 0.23 11 L E E 20.96 20.71 14.38 34.76 125.56 -172.03 -120.71 138.06 5.22 94.78 0.01 5.23 0.19 0.01 0.00 0.00 0.00 93.37 1.20 12 Q C C 94.95 4.59 23.62 28.17 120.22 -133.80 -90.69 148.46 93.24 6.75 0.01 92.80 0.79 0.04 0.00 0.01 0.00 5.86 0.49 13 P C T 50.47 15.13 14.02 29.08 110.30 -88.92 -60.63 138.85 99.76 0.12 0.11 0.20 2.56 97.07 0.00 0.08 0.00 0.07 0.02 14 S C T 73.26 5.44 19.81 26.06 95.00 17.97 80.11 -0.14 99.83 0.09 0.09 0.25 2.49 97.14 0.00 0.06 0.00 0.05 0.01 15 Q C C 74.96 8.30 17.33 26.83 125.85 115.46 -94.26 155.67 94.66 5.27 0.07 62.23 32.47 0.34 0.01 0.08 0.00 4.38 0.49 16 T C C 74.18 8.70 19.25 28.78 119.53 -124.62 -98.87 137.08 66.42 33.57 0.00 67.40 0.37 0.02 0.00 0.00 0.00 31.63 0.57 17 L E E 13.85 22.23 14.69 36.84 125.15 -167.40 -119.66 141.03 0.99 99.01 0.00 1.04 0.01 0.00 0.00 0.00 0.00 98.88 0.07 18 S E E 51.69 8.37 24.82 33.71 121.52 -158.03 -116.67 132.28 0.29 99.71 0.00 0.28 0.00 0.00 0.00 0.00 0.00 99.71 0.00 19 L E E 7.26 24.77 16.20 41.31 122.73 -169.40 -118.20 132.45 0.95 99.05 0.00 0.89 0.02 0.00 0.00 0.00 0.00 99.08 0.01 20 T E E 55.55 8.15 26.48 35.19 122.03 -161.90 -113.06 134.51 5.48 94.52 0.00 5.20 0.10 0.00 0.00 0.00 0.00 94.65 0.04 21 C E E 5.68 25.18 15.63 41.12 128.17 -172.28 -127.88 142.44 7.73 92.27 0.01 7.45 0.19 0.01 0.00 0.00 0.00 92.24 0.10 22 S E E 44.51 8.15 26.33 35.10 126.92 -168.00 -125.51 141.86 3.33 96.66 0.01 3.22 0.15 0.01 0.01 0.00 0.00 95.89 0.72 23 F E E 26.17 22.76 14.22 36.27 126.49 -169.28 -127.20 136.80 20.10 79.78 0.12 18.85 1.12 0.15 0.05 0.07 0.00 78.13 1.62 24 S C E 63.37 6.10 20.43 27.18 118.99 -159.33 -103.89 143.79 61.94 36.86 1.19 29.96 19.05 14.86 0.14 1.18 0.00 33.62 1.20 25 G C S 51.22 3.49 19.61 23.58 100.47 15.08 84.77 -1.08 81.33 16.73 1.94 18.46 42.67 20.64 0.20 1.71 0.00 14.89 1.43 26 F C C 65.67 17.05 12.50 28.72 120.74 116.47 -98.37 141.36 73.84 22.37 3.79 50.57 17.44 6.16 0.90 3.23 0.01 17.30 4.39 27 S C C 61.41 6.66 20.15 27.46 120.62 -157.68 -106.77 140.36 78.26 18.56 3.17 63.08 9.14 5.24 0.86 2.52 0.00 14.68 4.47 28 L C C 64.38 16.99 13.72 29.64 103.95 -151.85 -90.77 19.37 77.60 16.67 5.72 48.15 17.49 12.58 1.31 4.56 0.01 11.78 4.12 29 S C C 66.71 6.01 18.54 25.43 111.66 143.24 -97.84 111.58 81.98 13.55 4.46 49.66 19.78 13.18 0.93 3.71 0.01 9.74 3.00 30 T C C 64.03 11.93 14.66 26.67 106.91 73.97 -101.10 19.34 82.07 12.72 5.21 35.16 31.53 16.61 1.10 3.98 0.01 8.43 3.17 31 S C S 69.83 6.17 18.34 25.40 108.56 109.64 -86.03 105.99 85.03 11.89 3.09 19.32 36.10 30.72 0.45 2.49 0.01 9.21 1.71 32 G C S 30.69 9.96 19.21 29.56 100.39 -0.39 85.17 4.07 76.52 22.13 1.35 25.97 27.78 23.03 0.13 1.33 0.00 20.68 1.07 33 M E E 36.16 18.03 18.52 36.35 121.84 128.08 -103.59 140.98 40.46 59.36 0.18 34.10 5.21 0.62 0.04 0.16 0.00 58.84 1.02 34 G E E 7.20 17.78 25.25 42.59 135.19 -163.36 -132.13 160.53 8.00 91.98 0.03 7.01 0.75 0.08 0.01 0.02 0.00 91.83 0.30 35 V E E 3.20 26.14 22.89 49.29 125.26 -141.97 -121.77 136.72 1.74 98.26 0.00 1.57 0.08 0.01 0.00 0.00 0.00 98.28 0.05 36 S E E 9.75 19.32 27.65 46.34 134.00 -175.63 -133.58 152.89 0.87 99.13 0.00 0.76 0.03 0.00 0.00 0.00 0.00 99.19 0.01 37 W E E 10.30 23.90 23.49 47.03 125.14 -146.43 -119.43 138.53 0.77 99.22 0.00 0.66 0.03 0.00 0.00 0.00 0.00 99.29 0.01 38 I E E 16.28 18.20 23.95 42.07 127.38 -167.32 -123.75 140.16 0.66 99.34 0.00 0.57 0.03 0.00 0.00 0.00 0.00 99.37 0.03 39 R E E 59.24 15.32 21.34 36.39 121.50 -156.21 -110.28 134.18 3.28 96.72 0.00 2.92 0.20 0.01 0.00 0.00 0.00 96.71 0.16 40 K E E 68.41 12.65 17.06 30.28 114.66 -149.43 -103.61 124.57 45.34 54.64 0.02 42.02 1.72 0.07 0.00 0.02 0.00 55.67 0.49 41 P C C 48.21 8.85 13.63 24.23 116.57 -122.98 -69.54 155.62 93.48 5.44 1.08 85.03 4.43 3.66 0.14 1.14 0.00 4.75 0.85 42 S C T 88.21 2.70 11.92 16.44 108.46 -78.14 -59.89 134.85 96.24 0.34 3.43 1.45 7.39 86.27 0.09 4.46 0.00 0.21 0.13 43 G C T 69.18 0.31 12.40 10.44 95.89 14.80 82.61 -2.65 95.68 0.22 4.09 1.58 7.84 84.75 0.11 5.50 0.00 0.14 0.09 44 K C S 129.44 3.33 11.20 16.29 119.12 83.50 -112.80 152.80 93.02 3.56 3.43 27.87 55.96 9.00 0.38 3.36 0.00 1.88 1.55 45 G C C 36.16 4.40 16.23 21.58 127.44 -108.21 94.85 -178.69 91.86 7.94 0.20 71.56 19.52 1.01 0.03 0.21 0.00 6.62 1.06 46 L C C 57.08 16.85 13.20 29.38 115.58 -60.72 -77.47 137.90 60.63 39.32 0.05 57.46 1.78 0.10 0.00 0.04 0.00 40.19 0.42 47 E E E 70.05 10.54 21.16 32.24 125.53 -166.27 -121.36 138.96 3.57 96.41 0.02 3.06 0.28 0.02 0.00 0.01 0.00 96.50 0.12 48 W E E 82.72 16.06 19.84 35.50 110.13 -115.50 -75.20 127.10 0.50 99.50 0.00 0.46 0.02 0.00 0.00 0.00 0.00 99.51 0.01 49 L E E 10.87 21.08 21.26 42.63 100.54 176.58 -95.86 -33.96 2.51 97.48 0.01 1.50 0.77 0.03 0.00 0.00 0.00 97.68 0.01 50 A E E 3.03 22.10 22.81 45.40 143.08 -3.78 -157.82 154.73 0.48 99.52 0.00 0.34 0.04 0.00 0.00 0.00 0.00 99.60 0.00 51 H E E 38.82 16.16 25.60 41.32 124.27 -153.07 -122.26 132.91 0.75 99.25 0.01 0.64 0.03 0.00 0.00 0.00 0.00 99.30 0.02 52 I E E 7.61 22.43 20.27 43.05 118.97 -160.74 -113.49 125.98 4.18 95.79 0.03 3.41 0.54 0.06 0.01 0.02 0.00 95.78 0.18 53 F E E 46.39 12.58 21.99 35.28 119.71 -166.92 -112.12 134.19 19.88 79.86 0.27 14.47 4.36 1.09 0.06 0.20 0.00 79.36 0.46 54 W C E 71.64 15.34 16.49 31.55 101.87 -148.80 -84.45 1.68 64.05 34.02 1.93 20.73 22.33 22.47 0.28 1.66 0.01 31.21 1.31 55 D C T 76.05 6.69 16.81 24.21 108.85 60.42 -101.01 46.61 90.08 7.57 2.35 18.52 33.56 38.18 0.27 2.20 0.00 6.33 0.93 56 D C S 96.27 6.09 14.95 22.02 100.41 -92.74 -80.41 6.38 93.52 3.43 3.05 20.20 38.10 35.31 0.33 2.90 0.00 2.42 0.73 57 D C C 82.48 6.47 14.91 22.47 108.35 100.45 -93.96 91.85 79.52 17.29 3.19 42.60 22.89 14.82 0.49 2.82 0.00 14.57 1.80 58 K C C 104.50 11.26 14.03 25.43 108.91 -145.80 -89.86 94.46 60.46 36.61 2.93 44.94 11.27 4.71 0.63 2.26 0.00 34.21 1.97 59 R E E 118.70 6.67 19.22 26.76 119.88 146.56 -107.40 137.45 45.16 52.57 2.27 33.46 9.15 3.48 0.85 1.49 0.01 47.20 4.36 60 Y E E 68.57 18.72 12.61 30.14 122.20 -146.47 -102.67 142.58 43.57 55.61 0.82 36.68 4.66 0.64 0.65 0.37 0.00 38.60 18.40 61 N C C 39.49 12.43 13.99 27.72 111.54 -111.53 -75.75 128.91 98.92 1.00 0.08 98.05 1.06 0.08 0.04 0.02 0.00 0.60 0.15 62 P H G 100.48 2.85 16.40 20.23 91.79 -133.47 -59.62 -31.60 29.38 0.21 70.42 2.12 2.34 23.00 34.96 37.33 0.03 0.12 0.09 63 S H G 66.94 4.38 17.09 22.50 90.89 62.08 -68.24 -23.04 28.29 0.15 71.56 0.96 1.68 24.62 33.46 39.08 0.04 0.08 0.09 64 L H G 11.41 22.05 10.95 32.64 96.93 45.15 -92.49 -7.76 23.21 0.28 76.51 1.93 2.14 17.70 35.38 42.54 0.04 0.16 0.12 65 K H H 106.72 12.01 15.00 27.36 93.20 91.38 -60.35 -34.68 37.98 0.84 61.18 3.27 2.91 29.79 32.29 30.59 0.14 0.47 0.54 66 S C T 91.40 1.17 20.65 20.24 91.88 53.43 -75.56 -14.30 63.90 0.20 35.90 1.03 2.39 63.15 11.79 21.34 0.01 0.12 0.17 67 R C T 79.57 13.33 16.83 30.23 99.78 46.68 -101.42 -11.83 72.90 0.48 26.61 2.22 6.48 66.20 6.03 18.52 0.01 0.33 0.21 68 L E E 7.11 25.20 12.04 37.24 129.45 58.58 -123.59 143.58 16.06 83.83 0.12 12.98 3.46 0.17 0.05 0.06 0.00 82.40 0.86 69 T E E 62.04 6.33 26.54 33.34 125.51 -167.55 -123.33 139.09 2.13 97.84 0.02 1.94 0.10 0.01 0.01 0.01 0.00 97.87 0.07 70 I E E 29.68 23.39 14.23 36.96 122.71 -160.85 -117.79 131.59 1.96 98.02 0.03 1.82 0.07 0.01 0.01 0.01 0.00 98.04 0.04 71 S E E 49.83 6.31 24.54 31.19 130.95 -176.20 -130.08 151.00 2.93 97.06 0.01 2.56 0.17 0.01 0.00 0.01 0.00 97.19 0.06 72 K E E 88.30 16.51 13.89 29.56 122.03 -148.64 -114.29 133.22 6.11 93.83 0.05 5.22 0.71 0.08 0.01 0.03 0.00 93.63 0.31 73 D E E 57.25 7.32 16.15 25.24 109.04 -157.42 -107.28 107.12 38.86 61.04 0.10 37.25 1.19 0.17 0.02 0.07 0.00 60.07 1.21 74 T C T 87.46 6.68 12.79 21.61 93.85 -168.03 -68.58 -24.73 89.62 0.86 9.52 2.97 14.51 70.30 0.21 11.21 0.00 0.62 0.18 75 S C T 93.45 0.83 15.57 15.10 93.73 55.71 -71.71 -33.94 87.65 1.21 11.15 1.72 14.91 69.16 0.21 12.86 0.00 0.83 0.31 76 S C T 56.58 5.54 15.38 22.01 98.86 31.53 -99.28 -5.53 88.96 0.31 10.74 3.67 24.13 58.76 0.20 12.94 0.00 0.19 0.11 77 N C T 56.18 13.34 15.94 30.04 95.38 -128.70 57.57 41.25 99.20 0.45 0.35 12.21 20.61 66.36 0.03 0.35 0.00 0.37 0.06 78 Q E E 40.67 12.48 21.96 35.20 133.66 129.58 -129.40 152.72 20.65 79.33 0.02 17.67 2.58 0.13 0.00 0.02 0.00 77.90 1.69 79 V E E 4.07 24.47 18.88 44.14 122.09 -147.90 -115.73 133.84 2.06 97.94 0.00 2.06 0.04 0.00 0.00 0.00 0.00 97.81 0.09 80 F E E 40.26 12.52 26.83 40.20 118.73 -156.20 -110.40 128.01 1.18 98.82 0.00 1.06 0.03 0.00 0.00 0.00 0.00 98.91 0.01 81 L E E 2.60 26.27 19.31 46.57 119.36 -164.37 -109.44 127.97 0.21 99.79 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.80 0.00 82 M E E 51.14 10.65 27.41 38.85 118.78 -161.84 -110.84 128.13 0.08 99.92 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.92 0.00 83 I E E 6.82 24.55 16.94 42.13 116.23 -162.30 -108.15 124.72 3.26 96.74 0.00 3.34 0.02 0.00 0.00 0.00 0.00 96.35 0.29 84 T C C 52.13 8.34 22.59 31.35 124.80 -168.90 -111.40 153.90 91.53 8.45 0.03 61.19 27.56 1.36 0.00 0.05 0.00 9.63 0.20 85 S C S 69.09 4.08 24.02 28.21 96.07 11.05 58.86 54.09 98.93 1.05 0.02 9.83 86.90 2.30 0.00 0.02 0.00 0.86 0.09 86 I C C 19.92 23.92 10.36 33.49 115.30 -158.44 -80.11 134.56 98.96 1.02 0.01 97.78 1.34 0.02 0.00 0.00 0.00 0.34 0.52 87 D C C 67.80 5.08 23.41 28.36 128.88 -173.54 -117.01 159.98 99.75 0.23 0.02 99.51 0.29 0.01 0.00 0.00 0.00 0.05 0.13 88 T H G 78.95 10.55 16.15 27.22 91.28 -102.62 -60.77 -26.24 8.91 0.05 91.04 0.34 0.50 6.67 0.42 92.03 0.00 0.03 0.00 89 A H G 64.05 5.80 20.70 27.37 90.32 64.06 -72.39 -16.22 8.36 0.07 91.56 0.26 0.46 6.34 0.34 92.55 0.00 0.05 0.00 90 D H G 12.73 21.69 15.59 37.42 94.57 66.45 -84.90 -1.07 9.78 0.20 90.03 3.33 1.31 2.58 0.58 92.05 0.00 0.13 0.01 91 T C C 43.06 15.40 20.86 36.04 114.40 109.76 -79.85 133.87 94.77 4.96 0.27 91.79 3.02 0.20 0.05 0.18 0.00 4.43 0.32 92 A E E 17.23 15.09 23.26 38.46 144.83 121.92 -159.70 170.40 9.05 90.89 0.06 8.46 0.57 0.05 0.02 0.04 0.00 89.91 0.95 93 T E E 35.42 14.21 24.85 39.13 118.67 -93.74 -95.47 136.19 1.93 98.03 0.03 1.83 0.11 0.02 0.01 0.02 0.00 97.93 0.08 94 Y E E 7.61 24.84 20.26 45.13 126.11 -168.63 -121.61 141.38 1.00 98.93 0.07 0.90 0.07 0.02 0.01 0.03 0.00 98.94 0.04 95 Y E E 27.31 18.13 27.23 44.80 128.12 -163.45 -121.15 144.43 1.37 98.54 0.09 1.15 0.09 0.02 0.02 0.03 0.00 98.63 0.05 96 C E E 2.76 25.22 23.29 48.32 129.35 -168.41 -126.22 145.49 6.96 92.65 0.40 5.51 0.72 0.18 0.22 0.12 0.00 93.01 0.24 97 A E E 7.28 19.28 25.21 44.30 127.70 -157.51 -119.56 143.60 8.23 90.55 1.22 6.52 1.03 0.44 0.68 0.38 0.00 90.58 0.37 98 R E E 36.54 19.23 21.28 39.75 126.03 -162.79 -119.79 140.60 10.42 87.85 1.73 8.28 1.61 0.69 1.07 0.60 0.00 86.89 0.86 99 R E E 70.22 12.48 20.11 33.00 123.10 -159.55 -116.61 136.82 20.69 76.72 2.59 16.85 3.05 1.16 1.32 1.03 0.00 75.68 0.92 100 T E E 48.77 10.61 15.51 27.34 115.99 -142.21 -95.94 133.32 36.06 59.82 4.12 27.35 6.91 2.91 1.71 2.08 0.01 57.82 1.22 101 W C C 128.35 7.80 12.89 22.00 107.61 -151.68 -91.88 46.43 56.00 33.27 10.73 30.26 16.68 11.81 3.64 6.30 0.09 28.95 2.28 102 L C T 108.14 3.52 12.14 16.89 109.66 46.12 -94.07 92.48 72.93 10.92 16.16 26.63 20.27 28.04 4.51 10.20 0.06 8.48 1.82 103 L C T 118.71 2.92 11.59 15.62 104.88 0.11 -79.91 44.30 81.24 2.67 16.09 23.82 18.82 39.53 3.97 11.24 0.01 1.72 0.89 104 H C T 129.23 4.48 12.43 18.29 103.48 -11.19 -76.96 54.71 79.12 7.96 12.93 27.09 20.21 33.43 2.80 9.07 0.03 5.84 1.53 105 A C C 51.10 8.64 13.45 23.27 115.01 130.46 -99.16 131.71 65.26 27.91 6.83 35.38 17.09 14.44 1.29 5.32 0.02 24.41 2.05 106 M C E 67.27 12.39 15.37 28.33 120.77 -142.26 -105.54 138.64 52.30 44.99 2.70 39.83 7.73 4.68 0.57 2.26 0.00 42.97 1.97 107 D E E 41.32 14.86 17.87 32.91 120.08 -154.58 -107.47 134.78 36.45 62.73 0.82 29.01 5.74 1.90 0.19 0.63 0.00 61.43 1.08 108 Y E E 79.75 14.50 20.72 34.84 122.25 -156.21 -113.83 133.21 18.52 81.07 0.41 15.38 2.60 0.80 0.14 0.28 0.00 78.60 2.20 109 W E E 49.69 19.23 18.57 36.94 117.90 -160.10 -103.76 134.51 25.47 74.15 0.37 21.09 3.18 1.00 0.15 0.25 0.00 69.18 5.14 110 G C C 16.21 16.23 19.29 34.76 123.78 -139.46 -86.49 170.82 64.20 35.54 0.26 46.79 14.12 2.75 0.04 0.27 0.00 34.88 1.14 111 Q C C 102.94 8.49 22.69 31.13 100.92 -85.62 -78.77 2.67 76.00 23.61 0.39 41.97 28.20 5.95 0.04 0.44 0.00 22.39 1.01 112 G C C 18.55 17.40 17.77 33.80 124.36 -122.00 84.41 173.86 74.60 25.20 0.20 52.37 17.28 3.59 0.02 0.24 0.00 25.89 0.61 113 T E E 32.66 16.11 20.08 36.00 125.25 -105.64 -115.47 140.01 17.57 82.38 0.05 15.55 1.57 0.15 0.01 0.04 0.00 81.96 0.71 114 S E E 54.38 10.26 23.21 33.49 117.80 -132.27 -90.16 134.40 3.16 96.83 0.01 2.79 0.23 0.03 0.00 0.01 0.00 96.83 0.11 115 V E E 12.57 22.90 15.46 38.29 123.48 -168.50 -119.58 133.76 1.22 98.77 0.01 1.13 0.09 0.01 0.00 0.00 0.00 98.72 0.04 116 T E E 64.13 6.69 24.62 31.61 118.74 -152.76 -105.17 132.62 2.01 97.98 0.01 1.88 0.11 0.02 0.00 0.00 0.00 97.80 0.19 117 V E E 23.74 21.23 12.15 32.61 119.25 -157.10 -104.43 132.08 14.61 85.34 0.06 13.27 0.97 0.13 0.02 0.04 0.00 84.57 1.01 118 S C C 57.51 5.73 17.06 23.72 124.71 -163.50 -108.56 157.25 56.68 43.24 0.08 54.18 1.17 0.24 0.02 0.05 0.00 43.17 1.17 119 S C C 80.87 4.68 15.16 21.28 104.91 -96.86 -75.41 74.12 99.72 0.27 0.01 99.62 0.15 0.04 0.00 0.00 0.00 0.18 0.01