# 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 S C C 61.84 7.71 17.28 26.01 128.89 149.17 -128.11 148.56 99.45 0.55 0.00 99.48 0.06 0.01 0.00 0.00 0.00 0.43 0.01 1 Y E E 85.00 14.27 12.57 26.80 127.02 -167.57 -128.76 144.30 40.61 59.20 0.19 39.06 0.89 0.26 0.06 0.10 0.00 58.07 1.56 2 E E E 121.06 4.19 18.46 23.89 119.88 -151.05 -110.23 132.35 20.00 79.73 0.28 18.32 1.40 0.30 0.10 0.17 0.00 78.08 1.63 3 L E E 45.93 18.54 10.64 28.14 116.65 -143.90 -93.77 130.63 26.53 73.16 0.31 24.63 1.42 0.29 0.12 0.19 0.00 70.49 2.86 4 T C E 73.63 6.73 18.97 26.39 111.64 -168.33 -104.48 99.02 53.52 46.26 0.23 41.19 11.41 0.76 0.06 0.20 0.00 43.94 2.44 5 Q C S 89.01 9.89 15.86 26.53 122.33 -35.47 -111.25 136.23 77.70 22.25 0.05 35.69 42.42 0.55 0.01 0.04 0.00 20.28 1.01 6 P C C 60.18 10.01 16.01 26.88 116.13 -77.43 -68.37 152.57 96.04 3.93 0.03 82.36 13.04 0.51 0.00 0.03 0.00 3.84 0.22 7 P C C 68.90 11.19 15.58 27.14 98.59 -111.41 -67.90 -16.57 94.40 5.53 0.07 63.36 29.36 1.35 0.01 0.09 0.00 5.56 0.27 8 S E E 61.75 7.96 18.85 27.75 131.45 10.45 -134.64 148.90 29.90 70.01 0.09 24.58 4.62 0.44 0.01 0.09 0.00 69.62 0.64 9 V E E 32.00 17.97 14.50 32.34 129.55 -172.69 -134.14 142.00 3.51 96.48 0.00 3.22 0.23 0.01 0.00 0.00 0.00 96.40 0.14 10 S E E 65.79 6.50 22.49 30.23 122.57 -152.71 -113.51 136.30 1.20 98.80 0.00 1.13 0.06 0.00 0.00 0.00 0.00 98.77 0.04 11 V E E 17.38 20.57 13.42 33.79 131.73 -177.81 -134.84 148.63 3.91 96.09 0.00 3.89 0.11 0.00 0.00 0.00 0.00 95.38 0.61 12 S C C 53.52 4.75 23.04 27.46 121.03 -120.59 -82.31 155.68 90.19 9.79 0.02 89.82 0.76 0.06 0.00 0.01 0.00 8.91 0.44 13 P C T 63.43 13.13 14.27 27.64 109.65 -81.00 -59.62 136.22 99.56 0.24 0.20 0.16 2.24 97.31 0.01 0.12 0.00 0.12 0.04 14 G C T 49.17 3.57 19.26 23.56 95.66 22.30 87.65 -5.84 99.69 0.15 0.16 0.25 2.44 97.10 0.01 0.11 0.00 0.09 0.01 15 Q C C 77.15 8.09 17.73 26.94 126.08 109.67 -97.84 155.22 90.04 9.87 0.09 67.76 22.17 0.34 0.02 0.08 0.00 8.81 0.82 16 T C C 69.55 10.05 18.93 29.73 126.44 -136.38 -116.47 144.91 56.62 43.37 0.01 56.96 0.44 0.02 0.00 0.00 0.00 42.06 0.50 17 A E E 9.37 21.86 15.74 37.60 129.97 -167.97 -128.70 145.73 0.77 99.23 0.00 0.76 0.01 0.00 0.00 0.00 0.00 99.17 0.05 18 R E E 118.40 7.52 24.89 33.23 121.08 -149.97 -112.86 132.14 0.31 99.69 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.69 0.01 19 I E E 5.15 25.78 16.24 42.77 121.27 -168.86 -116.96 131.66 2.64 97.36 0.00 2.43 0.08 0.00 0.00 0.00 0.00 97.46 0.02 20 T E E 52.63 8.14 27.18 36.08 123.07 -161.78 -111.45 138.15 10.49 89.50 0.01 9.74 0.32 0.02 0.00 0.00 0.00 89.78 0.13 21 C E E 6.45 25.41 14.81 40.51 125.09 -165.60 -119.06 143.87 19.19 80.77 0.04 18.15 0.73 0.07 0.01 0.02 0.00 80.06 0.96 22 S E E 48.35 7.49 24.32 32.19 133.22 -173.50 -132.99 156.93 32.25 67.52 0.23 27.19 4.36 0.55 0.09 0.18 0.00 64.68 2.95 23 G C S 30.40 8.08 20.29 29.17 131.12 54.36 123.99 -169.00 67.57 30.15 2.28 30.20 33.40 5.73 0.46 1.74 0.02 26.04 2.41 24 D C C 90.04 5.75 21.48 27.70 112.55 -41.71 -94.09 123.69 80.40 15.97 3.63 52.44 20.63 7.46 0.79 3.08 0.00 12.83 2.78 25 A C C 35.63 17.22 15.06 31.42 108.90 -152.33 -87.19 111.09 84.65 8.47 6.88 62.97 12.77 8.64 1.61 5.58 0.00 5.73 2.69 26 L C C 50.68 14.94 15.63 30.33 115.16 -140.08 -92.01 137.52 86.55 5.81 7.64 64.32 11.26 10.12 1.52 6.76 0.00 3.35 2.66 27 S C T 73.28 4.73 19.04 24.32 99.58 -121.55 -71.07 -10.75 90.68 2.77 6.55 15.87 26.80 48.17 0.84 5.63 0.00 1.78 0.91 28 K C T 112.72 7.81 18.36 26.63 102.02 41.67 -91.30 27.92 88.98 5.44 5.59 15.42 27.50 46.33 0.61 4.90 0.00 4.41 0.83 29 H C C 58.75 16.12 17.29 32.81 123.17 107.33 -106.73 140.90 71.56 26.66 1.78 43.33 23.73 4.72 0.26 1.69 0.00 24.51 1.77 30 Y E E 56.25 13.75 24.30 38.13 129.26 -142.54 -124.79 147.45 28.88 70.96 0.16 24.09 4.17 0.53 0.04 0.13 0.00 70.02 1.03 31 G E E 1.89 25.20 19.88 45.32 133.36 -167.64 -131.83 152.25 6.43 93.55 0.02 5.56 0.61 0.05 0.00 0.01 0.00 93.59 0.17 32 Y E E 39.17 16.38 27.81 44.01 133.62 -167.17 -136.08 149.22 1.12 98.87 0.00 1.05 0.05 0.00 0.00 0.00 0.00 98.87 0.03 33 W E E 8.52 24.47 22.42 46.89 120.99 -142.36 -108.87 138.41 0.67 99.33 0.00 0.63 0.03 0.00 0.00 0.00 0.00 99.33 0.01 34 Y E E 23.86 17.32 24.30 41.49 134.05 -176.03 -134.43 152.67 0.46 99.54 0.00 0.42 0.02 0.00 0.00 0.00 0.00 99.55 0.01 35 Q E E 38.00 15.53 21.46 37.02 123.77 -150.56 -115.16 137.94 1.82 98.18 0.00 1.53 0.11 0.00 0.00 0.00 0.00 98.29 0.05 36 Q E E 53.03 13.83 15.80 30.22 118.72 -141.08 -97.03 136.29 24.41 75.58 0.01 22.29 1.36 0.05 0.00 0.01 0.00 75.02 1.27 37 K C C 98.83 6.34 15.28 22.93 118.72 -130.75 -84.71 150.38 98.15 1.82 0.03 96.68 1.55 0.20 0.01 0.02 0.00 1.25 0.29 38 P C T 108.88 3.10 11.47 16.54 109.34 -84.45 -58.76 134.36 99.60 0.08 0.31 0.25 2.57 96.82 0.01 0.29 0.00 0.05 0.02 39 G C T 69.26 0.27 12.91 10.41 94.92 19.27 83.53 -2.70 99.61 0.06 0.33 0.36 2.58 96.67 0.01 0.34 0.00 0.04 0.01 40 Q C S 85.65 6.26 9.73 18.01 128.42 98.90 -110.68 159.49 94.98 4.65 0.37 44.67 48.87 1.34 0.07 0.32 0.00 1.54 3.19 41 A C C 75.93 2.31 17.86 20.06 117.22 -98.29 -71.48 150.94 97.50 2.48 0.02 83.29 14.30 0.16 0.00 0.02 0.00 1.89 0.34 42 P C C 48.68 16.98 12.76 29.19 115.07 -96.15 -65.18 143.85 92.21 7.78 0.01 89.97 2.12 0.07 0.00 0.01 0.00 7.61 0.22 43 V E E 44.29 12.06 20.18 33.13 122.55 -155.78 -117.42 134.31 3.99 96.00 0.01 3.69 0.23 0.01 0.00 0.00 0.00 95.61 0.44 44 L E E 51.27 16.01 19.97 35.68 111.39 -120.54 -79.16 125.26 0.62 99.38 0.00 0.59 0.01 0.00 0.00 0.00 0.00 99.37 0.02 45 V E E 15.35 19.80 21.43 40.89 102.87 177.43 -98.39 -30.59 1.92 98.06 0.01 1.58 0.19 0.01 0.00 0.00 0.00 98.20 0.01 46 I E E 17.87 19.76 21.43 40.76 130.30 11.09 -137.02 137.47 0.82 99.17 0.01 0.70 0.05 0.00 0.00 0.00 0.00 99.21 0.03 47 F E E 37.25 16.72 19.88 36.60 125.40 -170.53 -125.35 135.99 4.75 95.20 0.04 4.34 0.22 0.03 0.02 0.01 0.00 95.00 0.37 48 K E E 80.78 11.35 19.18 30.72 115.82 -164.50 -109.17 127.55 47.62 51.45 0.93 26.21 16.84 6.55 0.17 0.76 0.00 48.47 1.00 49 D C S 77.36 8.67 17.61 26.45 105.89 -0.11 -75.30 60.60 84.43 13.96 1.60 22.01 38.06 24.76 0.15 1.57 0.00 12.18 1.27 50 S C S 63.14 9.20 14.40 24.00 105.62 -19.88 -97.53 9.81 95.08 3.11 1.81 18.78 48.17 28.19 0.16 1.84 0.00 2.15 0.72 51 E C S 124.12 4.17 15.67 21.06 113.15 109.11 -93.07 130.23 93.37 5.26 1.38 20.28 56.84 16.38 0.16 1.32 0.00 3.61 1.41 52 R C S 130.79 7.21 14.79 23.35 118.05 -111.79 -101.34 124.61 88.87 10.80 0.32 40.07 47.96 1.72 0.08 0.28 0.00 7.31 2.59 53 P C C 55.84 14.04 12.06 26.09 111.97 -113.56 -68.80 145.79 88.71 9.74 1.55 73.37 7.64 7.07 0.26 1.64 0.00 7.73 2.28 54 S C C 74.62 5.16 16.49 23.03 114.58 -138.09 -92.11 138.40 87.28 10.63 2.08 42.87 22.52 22.23 0.29 2.21 0.00 7.25 2.62 55 G C C 45.81 5.00 18.21 24.13 106.45 16.52 91.41 -2.87 83.58 14.83 1.59 37.20 30.59 16.56 0.23 1.69 0.00 10.06 3.67 56 I C C 41.83 19.85 11.19 29.90 116.86 118.48 -92.43 131.93 84.12 15.59 0.29 60.04 23.82 0.72 0.11 0.22 0.00 9.95 5.15 57 P C C 44.37 9.89 15.48 26.95 114.84 -110.08 -66.78 151.05 90.33 8.32 1.35 85.55 3.30 1.45 0.35 0.98 0.00 5.73 2.64 58 E C T 154.40 1.93 17.39 19.94 92.38 -110.88 -61.64 -27.84 71.09 2.04 26.88 4.66 14.86 50.86 1.64 26.05 0.01 1.34 0.57 59 R C T 115.49 9.12 17.41 27.07 93.40 60.09 -79.39 -11.33 67.21 5.06 27.73 4.96 13.85 47.89 1.62 26.81 0.02 4.12 0.73 60 F E E 24.49 22.38 13.17 34.68 111.92 60.17 -111.91 91.69 27.65 49.18 23.17 14.60 8.72 8.86 2.91 18.51 0.07 43.76 2.58 61 S E E 51.42 9.48 21.71 31.81 129.49 135.26 -122.54 151.72 28.33 70.79 0.88 22.18 5.22 1.34 0.41 0.56 0.00 65.95 4.34 62 G E E 24.62 15.65 17.07 32.12 142.05 160.97 -162.29 168.62 27.81 71.82 0.38 22.16 5.47 1.26 0.12 0.29 0.00 69.32 1.37 63 S E E 57.73 7.20 21.45 29.79 132.29 -137.93 -136.58 153.80 33.97 65.66 0.37 27.87 5.21 1.16 0.09 0.32 0.00 64.23 1.11 64 S E E 51.98 16.00 14.79 29.82 126.26 -162.42 -128.66 136.32 41.81 57.51 0.68 27.49 13.16 3.51 0.11 0.68 0.00 52.95 2.09 65 S C E 68.91 4.61 21.25 26.21 108.25 169.48 -115.18 39.45 53.97 44.80 1.23 22.68 23.30 11.21 0.19 1.25 0.02 37.82 3.52 66 G C S 30.19 11.21 19.43 30.24 110.04 -78.28 69.39 -121.79 97.20 2.10 0.70 4.67 47.33 45.32 0.03 0.73 0.00 1.66 0.26 67 T C S 49.99 15.23 17.65 32.50 99.24 -5.46 -102.83 -3.11 96.48 3.08 0.44 4.37 48.87 43.30 0.02 0.46 0.00 2.75 0.22 68 T E E 44.32 10.26 22.89 34.60 122.68 81.04 -113.01 134.22 17.96 82.00 0.04 13.22 4.46 0.33 0.01 0.04 0.00 79.72 2.21 69 I E E 5.01 25.32 17.40 43.38 122.96 -168.76 -120.46 132.39 6.34 93.65 0.00 6.03 0.19 0.01 0.00 0.00 0.00 93.46 0.31 70 T E E 35.54 10.13 27.38 38.64 119.67 -161.94 -113.91 128.54 5.29 94.71 0.00 4.74 0.20 0.00 0.00 0.00 0.00 95.00 0.06 71 L E E 3.21 26.17 18.51 45.63 119.96 -166.91 -114.99 128.64 0.90 99.10 0.00 0.83 0.02 0.00 0.00 0.00 0.00 99.14 0.01 72 T E E 44.35 9.18 27.37 37.44 118.49 -163.09 -114.07 127.42 0.23 99.77 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.75 0.01 73 V E E 5.37 24.86 15.90 41.54 117.68 -166.23 -115.38 123.26 1.52 98.48 0.00 1.59 0.01 0.00 0.00 0.00 0.00 98.13 0.27 74 S C C 55.34 6.09 23.16 29.69 128.01 -172.46 -118.07 149.25 68.41 31.53 0.06 37.84 23.30 5.89 0.00 0.07 0.00 32.46 0.43 75 G C S 46.26 3.17 23.56 26.93 94.43 17.03 68.27 28.68 96.97 3.01 0.02 4.52 85.58 6.51 0.00 0.02 0.00 3.29 0.08 76 V C C 18.00 23.70 10.14 32.94 115.81 -158.21 -75.49 137.97 97.95 2.04 0.01 97.11 1.25 0.03 0.00 0.00 0.00 1.30 0.31 77 Q C C 85.28 4.55 23.96 28.34 129.85 -172.83 -125.23 156.44 96.52 3.41 0.07 96.90 0.29 0.01 0.03 0.02 0.00 0.71 2.05 78 A H G 53.47 13.45 15.00 28.41 91.67 -105.65 -59.02 -33.87 2.70 0.02 97.28 0.18 0.18 1.64 0.45 97.53 0.00 0.01 0.00 79 E H G 129.23 3.08 21.58 25.07 90.35 62.27 -71.08 -16.94 2.30 0.03 97.67 0.11 0.14 1.52 0.33 97.88 0.00 0.02 0.00 80 D H G 19.55 19.63 15.90 35.75 93.11 65.78 -84.13 -2.74 3.42 0.03 96.55 0.49 0.35 1.49 0.46 97.19 0.00 0.03 0.00 81 E C C 66.04 14.94 19.92 34.76 114.37 115.56 -71.69 134.81 95.96 3.85 0.19 92.27 3.53 0.17 0.02 0.14 0.00 3.64 0.21 82 A E E 19.34 14.66 22.77 37.49 146.00 127.80 -168.47 174.32 20.57 79.39 0.04 18.96 1.34 0.08 0.01 0.03 0.00 76.82 2.75 83 D E E 45.68 12.28 25.29 37.82 119.14 -93.60 -96.83 136.69 2.21 97.78 0.01 2.07 0.14 0.01 0.00 0.00 0.00 97.66 0.11 84 Y E E 6.57 25.70 19.22 45.23 127.43 -167.82 -121.54 143.03 1.13 98.87 0.01 0.98 0.10 0.01 0.00 0.00 0.00 98.86 0.04 85 Y E E 34.00 16.10 27.79 43.84 130.11 -168.95 -127.04 146.80 1.50 98.48 0.01 1.28 0.12 0.01 0.00 0.01 0.00 98.49 0.08 86 C E E 2.73 25.87 21.96 48.04 124.53 -163.36 -118.85 139.92 2.67 97.30 0.03 2.27 0.23 0.04 0.01 0.03 0.00 97.34 0.09 87 Q E E 31.34 15.78 26.81 42.31 131.13 -173.68 -132.10 146.48 1.46 98.52 0.02 1.25 0.09 0.01 0.00 0.01 0.00 98.57 0.07 88 S E E 10.72 20.84 20.43 40.83 132.02 -170.90 -130.03 150.15 2.88 97.09 0.03 2.42 0.27 0.04 0.00 0.01 0.00 97.14 0.10 89 A E E 29.66 11.98 19.86 32.85 126.76 -156.79 -122.29 144.08 12.41 87.50 0.10 10.53 1.65 0.23 0.02 0.08 0.00 86.53 0.96 90 D C C 41.16 11.07 13.85 26.10 123.50 -144.73 -92.27 171.25 80.03 19.74 0.22 74.31 3.56 0.71 0.04 0.18 0.00 20.25 0.94 91 S C T 90.63 2.76 13.28 17.28 92.37 -93.41 -67.21 -17.75 96.88 1.02 2.09 4.34 18.88 73.44 0.11 2.24 0.00 0.78 0.21 92 S C T 82.45 1.72 13.52 15.26 95.48 55.40 -89.39 -0.13 97.57 0.33 2.11 3.09 18.82 75.46 0.12 2.20 0.00 0.20 0.12 93 A C S 69.11 6.67 12.72 20.79 96.48 -106.47 75.11 13.72 95.31 2.68 2.01 19.99 65.13 10.30 0.21 1.82 0.00 1.79 0.75 94 T C C 67.85 5.99 15.92 23.25 113.63 141.19 -88.32 135.40 90.20 9.44 0.36 70.44 15.38 3.55 0.05 0.37 0.00 9.57 0.64 95 Y E E 84.93 14.34 15.76 29.98 122.12 -145.75 -108.51 136.09 25.36 74.57 0.07 21.67 2.76 0.28 0.01 0.06 0.00 74.47 0.75 96 W E E 71.76 14.82 19.94 34.74 125.55 -169.91 -120.24 137.88 3.64 96.35 0.01 3.26 0.27 0.02 0.00 0.01 0.00 96.29 0.15 97 V E E 38.13 17.34 20.74 37.57 119.21 -153.95 -111.50 128.45 1.98 98.01 0.01 1.83 0.10 0.01 0.00 0.00 0.00 97.79 0.26 98 F E E 38.72 18.69 19.92 37.86 119.23 -159.47 -102.12 137.27 17.40 82.50 0.10 14.59 2.09 0.42 0.02 0.08 0.00 82.13 0.66 99 G C C 21.97 16.31 20.26 35.10 122.78 -139.73 -74.65 -151.80 64.38 35.32 0.31 40.82 18.29 4.49 0.03 0.34 0.00 35.29 0.75 100 G C C 39.34 9.35 22.91 31.71 102.45 -7.63 -77.85 -2.09 76.41 23.28 0.31 42.80 27.96 4.85 0.03 0.38 0.00 23.19 0.79 101 G C C 18.67 15.81 18.37 33.42 121.57 -125.76 91.19 175.28 71.30 28.58 0.13 57.99 10.23 1.06 0.01 0.14 0.00 29.97 0.60 102 T E E 28.58 18.36 18.48 36.24 123.98 -94.92 -108.69 141.47 14.66 85.32 0.02 13.34 0.83 0.06 0.00 0.01 0.00 85.12 0.63 103 K E E 109.84 7.97 23.03 31.72 119.85 -145.66 -107.66 132.57 1.84 98.16 0.01 1.68 0.12 0.01 0.00 0.00 0.00 97.97 0.21 104 L E E 22.73 22.04 13.93 35.43 123.22 -167.00 -114.65 133.91 3.88 96.12 0.01 3.70 0.19 0.02 0.00 0.01 0.00 95.83 0.25 105 T E E 69.14 5.78 21.98 28.31 119.85 -156.29 -109.25 133.93 15.03 84.96 0.01 15.27 0.18 0.02 0.00 0.01 0.00 83.34 1.17 106 V C C 36.47 18.86 13.85 32.11 114.24 -146.86 -92.09 125.55 98.81 1.19 0.00 98.96 0.05 0.01 0.00 0.00 0.00 0.97 0.01