# 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 111.01 5.39 18.88 25.34 117.52 -155.52 -99.95 129.88 99.48 0.52 0.00 99.52 0.06 0.01 0.00 0.00 0.00 0.39 0.01 1 V C C 36.12 19.38 11.13 29.44 121.66 -164.39 -110.32 134.78 56.65 43.28 0.07 56.93 0.28 0.12 0.02 0.03 0.00 41.33 1.29 2 T E E 71.50 4.68 22.03 27.08 121.11 -162.84 -112.49 135.89 29.18 70.72 0.11 27.05 1.46 0.21 0.04 0.06 0.00 70.20 0.98 3 L E E 38.19 21.67 11.85 32.41 120.05 -153.78 -105.01 132.45 22.16 77.73 0.11 21.21 0.87 0.12 0.04 0.06 0.00 76.94 0.77 4 R E E 123.52 5.11 22.35 28.32 123.75 -169.52 -122.37 137.22 20.48 79.34 0.17 18.58 1.53 0.23 0.06 0.10 0.00 78.38 1.13 5 E E E 86.09 15.05 14.17 28.69 116.55 -133.45 -91.76 134.85 37.10 62.65 0.25 33.04 2.99 0.46 0.07 0.18 0.00 61.83 1.45 6 S C C 54.18 9.46 16.68 26.72 107.82 -162.68 -97.03 58.19 73.02 26.79 0.19 58.85 12.15 1.07 0.04 0.19 0.00 26.61 1.10 7 G C S 33.10 5.24 19.69 25.58 133.20 -84.36 115.64 -177.47 82.60 17.35 0.05 28.79 52.46 0.90 0.00 0.06 0.00 17.29 0.50 8 P C C 72.33 10.10 16.51 27.19 115.74 -34.59 -69.89 146.05 81.22 18.75 0.03 69.63 9.20 0.32 0.00 0.04 0.00 20.47 0.34 9 T E E 34.00 15.93 16.60 32.62 127.26 -168.70 -126.37 141.53 8.70 91.29 0.01 8.14 0.47 0.02 0.00 0.01 0.00 90.69 0.68 10 L E E 85.05 8.80 23.00 32.17 116.09 -132.72 -95.51 127.57 1.43 98.57 0.00 1.38 0.06 0.00 0.00 0.00 0.00 98.44 0.12 11 V E E 11.60 22.17 14.45 36.58 128.50 -174.95 -124.09 144.54 4.00 96.00 0.00 4.09 0.12 0.00 0.00 0.00 0.00 94.86 0.92 12 K C C 102.23 4.84 24.11 28.94 120.89 -128.28 -89.99 150.22 90.84 9.15 0.01 90.65 0.67 0.04 0.00 0.01 0.00 8.20 0.43 13 P C T 42.87 16.26 14.32 30.39 110.55 -88.55 -61.56 140.01 99.64 0.18 0.17 0.20 2.78 96.78 0.00 0.12 0.00 0.10 0.02 14 K C T 133.18 4.93 20.45 26.21 94.14 15.03 74.45 8.96 99.68 0.18 0.14 0.29 2.93 96.54 0.00 0.11 0.00 0.12 0.01 15 Q C C 71.69 9.16 17.49 27.72 125.99 119.91 -95.28 153.67 94.42 5.52 0.06 64.97 29.56 0.29 0.01 0.07 0.00 4.62 0.48 16 T C C 70.87 9.24 19.65 29.64 120.36 -128.54 -100.87 138.47 53.31 46.69 0.00 54.69 0.27 0.01 0.00 0.00 0.00 44.46 0.57 17 L E E 11.89 22.59 15.03 37.70 125.92 -168.40 -120.83 141.81 0.53 99.47 0.00 0.57 0.01 0.00 0.00 0.00 0.00 99.35 0.07 18 T E E 61.20 8.17 25.23 33.94 119.26 -153.47 -113.22 128.40 0.31 99.69 0.00 0.31 0.00 0.00 0.00 0.00 0.00 99.67 0.01 19 L E E 5.62 25.40 16.24 42.28 119.38 -166.46 -112.69 128.63 2.80 97.20 0.00 2.68 0.09 0.00 0.00 0.00 0.00 97.17 0.05 20 T E E 54.16 8.39 26.73 35.65 121.84 -164.83 -113.50 134.48 19.68 80.31 0.01 18.84 0.42 0.01 0.00 0.00 0.00 80.62 0.11 21 C E E 5.38 25.35 15.89 41.58 127.51 -172.84 -127.56 140.37 24.10 75.88 0.02 23.35 0.66 0.04 0.00 0.01 0.00 75.70 0.24 22 T E E 55.52 8.10 26.94 35.78 125.28 -167.72 -123.27 135.74 8.65 91.31 0.04 8.40 0.38 0.03 0.02 0.02 0.00 89.57 1.59 23 F E E 17.95 24.07 14.85 38.55 122.07 -168.12 -118.76 131.45 15.68 84.21 0.11 14.86 0.82 0.10 0.06 0.06 0.00 81.22 2.89 24 S E E 59.90 6.61 22.31 29.51 121.92 -161.93 -106.92 143.42 48.54 50.83 0.63 26.51 14.71 9.45 0.07 0.67 0.00 47.49 1.09 25 G C S 47.65 4.31 21.35 26.19 99.83 18.73 84.79 -0.72 76.15 23.06 0.78 21.60 40.64 14.19 0.07 0.81 0.00 21.50 1.19 26 F C C 39.05 20.85 12.74 32.62 120.33 125.73 -93.82 142.59 74.42 24.37 1.21 61.23 9.93 2.33 0.37 1.06 0.00 19.22 5.87 27 S C C 46.62 7.63 22.79 30.78 122.25 -152.64 -112.38 140.97 83.38 15.44 1.18 77.00 3.93 1.97 0.35 0.84 0.00 9.75 6.16 28 L C T 55.88 18.97 13.60 31.56 95.39 -137.27 -72.97 -12.14 94.19 3.41 2.39 24.45 17.45 52.44 0.43 2.02 0.00 2.26 0.96 29 S C T 84.65 2.48 19.75 22.35 96.49 65.41 -86.28 -3.29 96.11 1.87 2.01 17.82 24.66 53.57 0.27 1.94 0.00 1.23 0.51 30 T C S 49.99 11.50 13.68 26.16 119.99 91.68 -92.55 144.56 95.80 3.34 0.87 34.43 57.83 3.59 0.23 0.58 0.00 1.41 1.93 31 P C T 95.85 4.54 19.47 24.74 108.42 -104.60 -71.39 133.19 94.93 3.37 1.70 15.75 35.13 44.31 0.23 1.50 0.00 2.27 0.81 32 G C T 27.20 11.36 20.14 31.51 106.28 27.62 90.90 -4.32 87.31 11.68 1.01 20.79 26.78 40.01 0.10 1.00 0.00 10.40 0.92 33 G C C 8.36 19.54 19.41 38.29 122.60 155.32 -93.11 166.28 56.84 42.88 0.28 47.64 6.90 1.06 0.05 0.28 0.00 42.72 1.36 34 G E E 6.38 18.76 26.40 44.48 140.51 159.48 -160.77 172.02 10.46 89.49 0.05 9.21 1.12 0.12 0.01 0.04 0.00 88.95 0.55 35 V E E 2.12 26.71 23.82 50.86 125.76 -129.50 -123.77 138.15 2.03 97.96 0.01 1.81 0.13 0.01 0.00 0.00 0.00 97.97 0.08 36 G E E 4.06 20.47 28.08 47.99 138.22 169.01 -140.25 164.50 0.91 99.09 0.00 0.80 0.04 0.00 0.00 0.00 0.00 99.14 0.02 37 W E E 7.71 24.80 24.22 48.68 128.90 -141.41 -125.99 143.48 0.79 99.20 0.00 0.70 0.04 0.00 0.00 0.00 0.00 99.25 0.01 38 I E E 14.29 19.27 25.03 43.87 128.07 -167.61 -125.26 141.67 0.85 99.14 0.00 0.75 0.04 0.00 0.00 0.00 0.00 99.17 0.04 39 R E E 53.14 16.77 22.09 38.20 121.97 -154.07 -107.89 134.07 3.06 96.93 0.00 2.67 0.22 0.01 0.00 0.00 0.00 96.93 0.17 40 Q E E 48.95 13.76 17.75 32.06 117.41 -156.18 -109.00 125.94 44.96 55.04 0.01 41.85 1.85 0.04 0.00 0.01 0.00 55.59 0.67 41 P C C 46.84 8.58 15.51 25.79 117.23 -120.85 -70.06 155.32 98.23 1.70 0.07 95.13 2.47 0.71 0.01 0.05 0.00 1.36 0.26 42 P C T 96.67 5.19 12.43 19.48 109.77 -78.87 -59.35 135.63 99.36 0.11 0.53 0.51 4.25 94.56 0.01 0.57 0.00 0.07 0.03 43 G C T 67.41 0.44 13.49 11.92 96.65 18.44 83.11 -3.01 99.29 0.11 0.61 0.77 4.34 94.09 0.02 0.70 0.00 0.07 0.02 44 K C S 113.58 4.73 10.87 17.65 126.85 96.67 -111.07 164.01 95.30 3.95 0.75 45.12 48.54 1.84 0.14 0.59 0.00 1.65 2.12 45 A C C 71.80 2.91 17.11 20.30 117.38 -93.48 -74.63 152.92 94.28 5.61 0.12 83.58 10.38 0.41 0.02 0.10 0.00 4.78 0.72 46 L C C 51.30 18.80 12.11 29.91 114.32 -105.18 -74.32 138.25 65.26 34.68 0.07 62.83 1.62 0.10 0.01 0.05 0.00 34.92 0.47 47 E E E 74.65 9.76 21.83 32.08 125.94 -166.35 -122.15 139.28 4.95 94.99 0.06 4.45 0.39 0.04 0.02 0.03 0.00 94.86 0.22 48 W E E 85.03 16.33 19.71 35.50 110.53 -113.91 -75.00 127.54 1.28 98.71 0.02 1.21 0.06 0.01 0.00 0.01 0.00 98.66 0.05 49 L E E 11.41 21.02 21.37 42.53 100.64 176.98 -95.48 -33.36 5.24 94.71 0.04 3.00 1.95 0.12 0.00 0.03 0.00 94.87 0.03 50 A E E 3.20 21.90 23.19 45.48 143.04 -3.99 -158.23 155.66 0.91 99.08 0.02 0.68 0.09 0.01 0.00 0.01 0.00 99.19 0.01 51 L E E 25.70 17.34 25.58 42.43 124.52 -148.88 -122.12 133.52 0.97 99.02 0.01 0.86 0.04 0.01 0.00 0.00 0.00 99.06 0.03 52 I E E 7.07 22.73 20.77 43.80 118.81 -160.49 -112.46 126.27 2.83 97.13 0.04 2.29 0.37 0.05 0.01 0.02 0.00 97.12 0.14 53 Y E E 47.16 12.92 22.26 35.89 119.98 -167.42 -114.23 131.00 14.28 85.52 0.20 10.75 2.73 0.69 0.04 0.16 0.00 85.20 0.44 54 W C E 61.49 16.77 16.28 32.65 103.84 -159.05 -90.58 -3.40 59.07 39.18 1.75 17.83 20.12 22.27 0.19 1.61 0.01 36.95 1.01 55 D C T 76.55 6.56 17.26 24.39 107.07 47.58 -99.89 56.41 87.80 9.85 2.35 17.73 31.86 38.22 0.23 2.26 0.00 8.80 0.91 56 D C T 95.78 6.09 14.81 21.84 100.28 -79.70 -63.08 -0.32 94.03 2.81 3.17 16.88 37.91 39.28 0.31 3.02 0.00 2.01 0.59 57 D C C 96.65 4.69 15.42 21.14 103.11 78.35 -92.59 19.46 80.50 17.00 2.50 32.34 26.73 21.94 0.29 2.29 0.00 15.19 1.21 58 K C E 95.13 11.21 13.95 25.59 114.60 137.22 -95.61 126.53 50.71 47.75 1.53 40.44 7.39 2.63 0.32 1.20 0.00 46.48 1.53 59 R E E 110.77 8.73 19.08 28.61 126.51 -176.56 -123.61 141.94 28.69 70.43 0.88 23.20 4.23 1.33 0.39 0.58 0.00 65.46 4.80 60 Y E E 56.01 19.65 13.55 32.10 120.21 -138.63 -96.42 141.73 36.57 62.92 0.50 31.38 3.78 0.53 0.37 0.27 0.00 54.13 9.55 61 S C C 28.53 11.62 15.29 28.28 114.38 -114.25 -76.08 139.81 98.15 1.74 0.11 97.02 1.34 0.11 0.05 0.03 0.00 1.25 0.21 62 P H G 97.81 3.50 16.27 20.93 91.99 -120.58 -59.58 -31.43 31.64 0.31 68.05 2.77 3.03 24.32 21.45 48.09 0.01 0.20 0.13 63 S H G 69.54 4.13 17.33 22.50 90.90 62.58 -68.15 -21.17 31.26 0.24 68.50 1.44 2.30 26.46 21.76 47.74 0.02 0.14 0.12 64 L H G 12.94 21.60 11.00 32.34 97.19 46.35 -95.91 -6.15 26.25 0.44 73.31 3.27 3.18 18.79 22.96 51.34 0.02 0.26 0.18 65 K H T 107.23 12.24 14.82 27.36 93.06 93.55 -60.19 -34.97 46.37 1.25 52.37 5.10 4.08 35.28 24.86 29.02 0.13 0.68 0.86 66 S C T 93.23 1.05 20.59 19.92 91.96 52.37 -76.73 -12.89 64.38 0.34 35.28 1.50 3.27 60.51 12.07 22.17 0.02 0.20 0.26 67 S C T 37.01 13.38 16.60 30.21 99.94 46.38 -99.52 -13.71 72.37 0.80 26.82 3.19 8.79 61.53 6.84 18.70 0.02 0.57 0.34 68 L E E 7.35 24.88 12.12 37.03 131.53 48.58 -129.31 148.30 23.76 75.95 0.29 18.53 5.78 0.46 0.13 0.16 0.00 74.02 0.92 69 T E E 62.67 6.10 26.56 33.15 124.26 -163.83 -121.80 137.83 3.03 96.94 0.03 2.73 0.18 0.02 0.01 0.01 0.00 96.94 0.11 70 I E E 24.43 23.77 14.06 37.42 122.11 -159.00 -116.84 130.31 2.07 97.91 0.02 1.91 0.07 0.01 0.00 0.01 0.00 97.94 0.05 71 T E E 62.84 5.98 24.99 31.26 128.04 -175.74 -126.99 143.92 2.89 97.10 0.01 2.51 0.17 0.01 0.00 0.01 0.00 97.24 0.05 72 K E E 82.88 17.04 13.90 30.02 120.15 -148.67 -108.03 131.50 5.77 94.18 0.05 4.86 0.71 0.08 0.01 0.03 0.00 94.10 0.20 73 D E E 54.41 7.30 16.39 25.56 109.21 -157.99 -109.38 107.71 28.75 71.13 0.12 27.20 1.16 0.17 0.03 0.08 0.00 70.06 1.30 74 T C T 84.50 7.27 12.74 22.07 93.67 -169.59 -67.75 -26.92 85.03 1.09 13.88 2.86 10.42 69.03 0.28 16.37 0.00 0.80 0.24 75 S C T 92.41 0.90 15.39 15.20 93.47 56.56 -70.20 -33.41 83.92 1.31 14.77 1.71 10.22 69.82 0.29 16.69 0.01 0.91 0.35 76 K C T 108.22 4.77 15.51 21.28 97.49 34.16 -96.06 -3.44 86.39 0.32 13.29 2.63 15.22 66.09 0.23 15.52 0.00 0.19 0.11 77 N C T 60.42 12.74 15.81 29.46 95.24 -128.25 56.72 42.29 99.19 0.44 0.37 8.00 13.19 77.96 0.03 0.37 0.00 0.38 0.06 78 Q E E 41.04 12.35 21.96 35.13 135.42 123.79 -134.28 153.96 13.04 86.94 0.02 11.36 1.39 0.11 0.00 0.02 0.00 86.02 1.10 79 V E E 3.79 24.71 18.73 44.29 122.39 -148.91 -116.00 134.26 1.52 98.48 0.00 1.50 0.03 0.00 0.00 0.00 0.00 98.44 0.04 80 V E E 26.05 12.62 26.88 40.53 118.42 -157.13 -111.83 126.82 0.75 99.25 0.00 0.66 0.02 0.00 0.00 0.00 0.00 99.32 0.00 81 L E E 2.76 26.11 19.65 46.64 120.14 -165.97 -110.70 129.37 0.13 99.87 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.88 0.00 82 T E E 33.47 11.30 27.42 39.58 119.83 -163.27 -112.99 129.45 0.06 99.94 0.00 0.06 0.00 0.00 0.00 0.00 0.00 99.94 0.00 83 M E E 6.43 24.69 18.06 43.21 119.48 -166.50 -113.87 126.86 3.13 96.87 0.00 3.16 0.03 0.00 0.00 0.00 0.00 96.59 0.22 84 T C C 47.68 8.81 23.53 32.73 130.25 -171.29 -120.51 154.90 80.61 19.32 0.07 49.36 25.39 4.19 0.00 0.12 0.00 20.61 0.33 85 N C S 99.27 3.98 23.96 28.45 93.34 12.57 58.74 45.35 97.41 2.55 0.04 14.29 75.77 7.07 0.00 0.06 0.00 2.64 0.17 86 M C C 14.20 24.40 10.75 34.69 117.18 -165.64 -78.32 140.35 97.11 2.86 0.03 95.04 2.17 0.05 0.01 0.01 0.00 1.15 1.56 87 D C C 67.86 5.95 23.89 29.71 124.79 -160.81 -111.27 158.87 99.73 0.23 0.03 99.07 0.68 0.02 0.01 0.01 0.00 0.05 0.16 88 P H G 70.81 12.02 16.94 29.15 91.72 -103.17 -60.74 -26.86 32.05 0.10 67.85 0.76 1.52 27.36 0.83 69.44 0.00 0.06 0.02 89 V H G 79.68 7.21 20.99 28.87 91.74 63.17 -75.71 -13.85 31.25 0.23 68.52 0.79 1.72 26.50 0.85 69.96 0.00 0.14 0.04 90 D H G 15.18 21.88 15.73 37.38 98.55 80.70 -77.15 13.90 29.03 1.10 69.87 15.98 5.16 5.04 1.58 71.33 0.00 0.72 0.18 91 T C C 53.06 13.33 22.51 35.53 110.72 117.72 -94.63 104.43 90.63 8.00 1.37 84.81 5.11 0.80 0.60 0.76 0.00 6.88 1.04 92 A E E 18.34 15.85 22.40 38.06 138.33 107.97 -140.22 170.77 23.12 75.82 1.06 20.52 2.01 0.43 0.78 0.51 0.00 73.21 2.55 93 T E E 37.38 13.77 25.19 39.08 119.09 -97.45 -98.02 136.41 6.95 92.08 0.97 6.23 0.64 0.28 0.66 0.43 0.00 91.18 0.57 94 Y E E 6.62 25.42 20.26 45.83 125.71 -166.60 -118.68 140.97 4.50 94.16 1.33 3.79 0.58 0.36 0.89 0.52 0.00 93.55 0.31 95 Y E E 30.91 18.07 27.79 45.13 130.59 -170.25 -126.67 147.15 6.29 92.40 1.31 5.17 0.75 0.41 0.83 0.51 0.00 92.01 0.32 96 C E E 3.13 25.23 23.43 48.41 126.75 -160.37 -120.12 143.48 15.13 83.10 1.77 12.42 1.75 0.67 1.06 0.65 0.00 82.83 0.62 97 A E E 8.19 19.67 25.13 44.39 127.26 -158.53 -120.74 145.17 15.31 82.44 2.25 12.65 1.91 0.92 1.19 0.88 0.00 81.60 0.84 98 R E E 46.26 17.61 22.15 39.16 123.40 -157.41 -114.96 136.16 15.36 82.69 1.96 12.28 2.57 1.16 1.04 0.88 0.00 80.66 1.43 99 L E E 41.50 14.29 18.38 33.18 119.96 -153.15 -107.45 133.72 26.43 71.71 1.86 21.28 4.23 1.60 0.85 0.98 0.00 69.60 1.45 100 T C E 59.76 9.13 15.95 26.13 115.88 -158.73 -101.85 136.17 51.69 46.15 2.16 36.20 11.30 4.80 0.55 1.54 0.00 44.30 1.30 101 A C T 66.40 6.27 13.40 20.82 105.88 -107.57 -81.09 40.65 78.02 17.22 4.76 26.89 24.39 27.83 0.71 3.74 0.01 14.93 1.50 102 A C T 79.77 3.18 12.64 17.00 105.64 32.77 -85.77 13.94 90.93 3.98 5.08 22.94 27.60 40.78 0.72 4.28 0.00 2.85 0.81 103 D C S 96.37 4.88 12.85 19.09 108.28 27.96 -92.81 91.26 89.62 6.44 3.94 28.48 32.00 29.71 0.52 3.47 0.00 4.82 1.01 104 T C C 72.76 8.69 13.11 22.82 112.77 116.55 -97.45 118.89 73.48 23.59 2.93 39.00 22.59 12.95 0.62 2.30 0.00 20.59 1.94 105 I C E 75.74 9.80 16.42 27.02 116.83 -166.51 -105.73 134.67 54.20 42.98 2.81 35.86 13.40 6.58 0.80 2.09 0.01 38.45 2.81 106 F E E 56.33 16.93 15.19 31.81 120.36 -153.72 -108.58 134.48 40.62 56.46 2.92 29.92 8.13 4.25 1.21 1.86 0.01 50.55 4.07 107 D E E 53.57 12.21 19.86 32.39 116.71 -156.23 -105.30 126.62 44.90 52.41 2.69 33.99 7.81 4.02 0.95 1.66 0.00 49.68 1.89 108 C C E 48.97 15.38 18.48 33.26 111.35 -159.59 -96.32 111.71 48.98 46.96 4.06 27.78 13.15 11.41 1.20 2.69 0.03 41.29 2.45 109 W C E 82.96 15.10 18.52 33.02 109.20 54.03 -98.37 58.00 55.06 40.37 4.57 27.07 15.63 16.31 1.44 3.10 0.10 31.23 5.11 110 G C C 24.90 12.33 19.45 31.55 121.76 -99.85 89.78 -165.55 75.53 21.37 3.10 29.98 26.70 20.44 0.52 2.56 0.01 17.43 2.37 111 Q C S 101.78 8.91 20.97 29.87 100.84 -31.79 -80.14 5.91 79.61 17.09 3.29 22.36 31.23 26.97 0.46 2.71 0.01 14.34 1.93 112 G C C 17.46 16.95 18.41 34.13 123.57 -111.63 98.29 174.06 73.44 25.23 1.33 33.70 25.22 15.17 0.15 1.30 0.00 23.16 1.30 113 T E E 26.44 18.38 19.86 37.65 119.86 -99.61 -103.32 134.80 35.24 64.56 0.20 29.67 4.44 0.64 0.04 0.17 0.00 63.97 1.07 114 L E E 73.68 10.82 24.19 34.93 116.05 -132.97 -91.43 130.20 7.93 92.02 0.05 7.05 0.71 0.10 0.01 0.03 0.00 91.77 0.32 115 V E E 10.77 23.78 16.10 40.05 122.27 -168.28 -116.38 130.98 3.14 96.84 0.02 2.96 0.16 0.03 0.00 0.01 0.00 96.75 0.09 116 T E E 58.30 7.68 25.03 33.13 119.16 -156.01 -106.71 133.58 2.97 97.01 0.02 2.80 0.16 0.03 0.00 0.01 0.00 96.85 0.14 117 V E E 23.97 21.13 13.30 33.87 119.86 -159.88 -109.09 131.41 9.84 90.10 0.06 9.16 0.54 0.08 0.02 0.03 0.00 89.53 0.63 118 S E E 54.90 6.40 17.61 24.91 125.53 -167.52 -113.18 156.02 41.79 58.10 0.11 39.91 0.89 0.21 0.03 0.07 0.00 57.62 1.28 119 S C C 74.32 6.29 15.15 22.60 108.92 -99.86 -76.57 124.05 99.67 0.33 0.01 99.53 0.18 0.04 0.00 0.00 0.00 0.24 0.01