# 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 94.13 5.10 19.42 25.13 110.77 -157.97 -92.58 105.41 99.81 0.19 0.00 99.75 0.10 0.02 0.00 0.00 0.00 0.13 0.00 1 V C C 43.45 17.07 12.27 28.87 118.67 -154.95 -106.02 129.54 50.36 49.54 0.09 49.29 0.58 0.18 0.02 0.05 0.00 49.03 0.85 2 V E E 70.23 7.65 19.13 27.84 119.47 -164.16 -112.73 130.55 17.96 81.95 0.09 16.27 1.24 0.18 0.03 0.06 0.00 81.59 0.62 3 M E E 48.86 18.13 14.34 32.05 121.28 -159.84 -110.47 133.23 10.10 89.85 0.06 9.36 0.59 0.09 0.02 0.03 0.00 89.40 0.51 4 T E E 64.79 8.27 20.60 29.66 126.25 -172.80 -122.95 141.40 14.38 85.52 0.10 13.14 0.98 0.15 0.03 0.06 0.00 84.42 1.22 5 Q E E 63.42 16.25 14.44 30.10 127.25 -166.03 -123.90 141.58 41.90 57.94 0.16 33.47 7.91 0.63 0.04 0.15 0.00 56.56 1.25 6 S C C 60.40 6.65 19.24 26.66 121.11 -127.88 -95.88 147.87 77.16 22.64 0.20 46.08 29.21 1.48 0.03 0.20 0.00 22.22 0.78 7 P C C 68.88 8.71 17.15 26.59 113.81 -23.64 -69.34 147.45 86.90 12.72 0.38 58.81 23.70 3.18 0.04 0.43 0.00 13.35 0.50 8 L C C 65.78 14.41 15.16 29.44 100.99 -155.17 -90.08 -6.28 63.47 36.09 0.44 44.71 16.40 2.05 0.05 0.46 0.00 35.43 0.89 9 S E E 59.80 8.05 20.02 29.09 134.21 25.55 -138.62 148.92 20.51 79.36 0.13 17.65 2.45 0.31 0.02 0.11 0.00 78.83 0.63 10 L E E 38.16 17.60 15.20 32.60 129.29 -173.61 -135.36 140.67 3.96 96.03 0.01 3.52 0.32 0.02 0.00 0.00 0.00 95.94 0.20 11 S E E 70.48 4.97 22.98 28.85 116.07 -128.40 -88.34 134.84 3.42 96.57 0.00 3.18 0.16 0.01 0.00 0.00 0.00 96.52 0.12 12 I E E 16.00 22.09 12.58 34.29 132.95 -178.31 -136.71 151.11 20.63 79.35 0.02 19.88 0.77 0.03 0.00 0.01 0.00 77.38 1.92 13 T C C 66.47 4.89 23.82 28.60 121.12 -129.10 -97.28 144.77 85.53 14.44 0.03 84.92 1.34 0.08 0.01 0.02 0.00 12.35 1.30 14 P C T 52.59 15.92 14.02 29.59 109.39 -91.60 -60.97 137.24 99.43 0.37 0.20 0.41 3.41 95.77 0.01 0.14 0.00 0.21 0.05 15 G C T 45.42 5.13 19.42 25.44 96.20 21.90 87.73 -5.57 99.71 0.17 0.12 0.57 3.86 95.34 0.00 0.10 0.00 0.11 0.02 16 Q C S 87.65 6.45 19.27 26.80 123.64 110.97 -96.58 146.26 96.30 3.66 0.04 45.92 51.08 0.17 0.01 0.03 0.00 2.16 0.64 17 P C C 75.84 8.61 19.19 28.42 116.22 -104.76 -68.10 147.91 93.72 6.27 0.01 93.41 0.87 0.04 0.00 0.01 0.00 5.38 0.30 18 A E E 9.15 22.94 14.50 37.27 127.18 -157.93 -120.34 145.30 7.48 92.51 0.01 7.24 0.23 0.01 0.00 0.01 0.00 91.69 0.81 19 S E E 55.10 8.54 25.23 34.35 124.28 -154.39 -118.05 136.87 1.39 98.61 0.00 1.35 0.05 0.00 0.00 0.00 0.00 98.48 0.11 20 I E E 6.82 25.45 16.58 42.48 124.77 -169.97 -124.01 133.99 5.22 94.77 0.01 4.93 0.26 0.02 0.00 0.01 0.00 94.57 0.20 21 S E E 42.38 9.50 26.65 36.55 124.84 -164.20 -111.25 143.54 21.63 78.33 0.04 20.12 0.90 0.07 0.01 0.02 0.00 78.66 0.22 22 C E E 5.91 25.33 16.88 42.37 132.82 -176.47 -136.71 148.52 27.94 71.92 0.14 25.92 1.53 0.17 0.04 0.08 0.00 71.50 0.77 23 R E E 102.10 8.61 26.86 36.19 125.14 -157.02 -120.77 138.59 17.70 81.80 0.50 15.60 1.48 0.33 0.35 0.24 0.00 72.88 9.12 24 S E E 11.67 23.49 15.86 38.77 121.29 -152.48 -96.74 145.66 47.35 50.26 2.39 43.02 2.90 0.84 1.41 1.12 0.01 47.17 3.54 25 S C C 41.53 9.90 21.37 31.60 112.43 -131.76 -88.96 153.21 70.55 16.31 13.14 53.91 11.80 4.87 6.91 6.09 0.01 14.11 2.29 26 Q H G 102.98 9.08 17.92 27.32 96.54 -111.51 -70.69 -23.76 45.81 5.39 48.80 15.22 12.67 18.97 21.88 25.99 0.23 3.65 1.38 27 S H G 62.99 6.40 19.72 26.53 97.94 63.68 -77.01 -15.64 43.09 7.28 49.63 16.12 9.38 18.30 22.28 26.96 0.15 5.45 1.35 28 L H G 34.39 18.15 15.97 33.27 97.90 61.57 -83.19 -16.21 38.99 13.79 47.22 18.57 9.63 12.32 22.49 24.03 0.26 10.54 2.17 29 V C C 40.74 16.73 16.15 32.33 110.34 70.90 -94.99 90.89 38.72 31.97 29.32 21.76 9.53 9.12 19.94 8.86 0.95 21.70 8.13 30 H C C 90.55 9.39 16.29 26.39 113.74 -152.34 -97.58 124.97 60.74 25.23 14.03 42.48 9.49 8.01 9.81 4.80 0.09 20.15 5.16 31 S C T 69.73 6.50 14.39 21.99 103.71 -143.98 -88.02 9.62 71.39 16.50 12.11 26.38 15.36 31.21 6.56 4.92 0.12 12.18 3.27 32 D C T 100.69 3.83 15.97 20.48 99.02 33.60 -87.81 10.79 90.25 2.52 7.23 12.85 22.23 55.64 2.65 4.10 0.01 1.74 0.79 33 G C S 39.22 7.97 15.17 23.99 97.61 -93.64 84.28 4.13 93.05 4.00 2.95 15.72 44.57 33.14 0.37 2.43 0.00 2.95 0.81 34 K C C 89.52 9.37 18.85 28.77 120.25 108.76 -101.20 135.45 72.35 26.68 0.98 48.35 19.23 5.01 0.19 0.91 0.00 24.01 2.29 35 T E E 21.17 19.98 17.43 36.92 120.03 -158.33 -108.47 133.26 39.83 59.87 0.30 33.03 5.48 0.87 0.08 0.25 0.00 58.67 1.62 36 Y E E 44.11 14.64 25.02 39.78 130.16 156.52 -127.89 147.12 13.85 86.10 0.06 12.17 1.39 0.12 0.01 0.03 0.00 85.62 0.66 37 L E E 4.14 25.79 21.09 47.29 121.75 -155.00 -113.09 132.63 5.07 94.92 0.01 4.51 0.36 0.02 0.00 0.01 0.00 94.98 0.11 38 S E E 14.77 16.96 27.11 43.78 127.33 -169.64 -122.21 143.89 1.61 98.39 0.00 1.52 0.06 0.00 0.00 0.00 0.00 98.39 0.03 39 W E E 9.86 24.08 21.79 45.75 127.28 -161.47 -121.15 143.79 0.68 99.32 0.00 0.65 0.02 0.00 0.00 0.00 0.00 99.32 0.01 40 Y E E 26.12 16.82 24.34 41.13 132.72 -172.45 -131.88 149.33 0.45 99.54 0.00 0.40 0.02 0.00 0.00 0.00 0.00 99.56 0.02 41 Q E E 35.64 15.71 21.64 37.43 121.46 -143.35 -110.86 134.84 2.46 97.54 0.00 2.02 0.22 0.01 0.00 0.00 0.00 97.66 0.09 42 Q E E 45.43 14.67 16.50 31.66 121.30 -153.95 -108.59 135.85 28.01 71.97 0.02 25.49 1.69 0.06 0.00 0.01 0.00 71.63 1.12 43 K C C 89.76 7.38 16.20 24.79 120.06 -139.70 -91.96 146.16 97.51 2.47 0.02 95.48 2.18 0.16 0.01 0.01 0.00 1.80 0.35 44 P C T 95.58 5.42 11.94 19.25 109.49 -86.51 -59.06 134.91 99.81 0.07 0.12 0.28 3.46 96.09 0.00 0.11 0.00 0.04 0.01 45 G C T 68.84 0.31 13.57 11.13 94.37 18.04 83.52 -3.24 99.83 0.05 0.12 0.38 3.45 96.01 0.00 0.12 0.00 0.03 0.01 46 Q C S 83.52 6.37 9.62 18.07 127.62 99.38 -111.86 154.61 96.48 3.44 0.08 33.62 63.06 0.27 0.02 0.05 0.00 1.12 1.85 47 P C C 100.93 1.65 17.59 18.67 116.41 -96.95 -65.10 149.66 98.65 1.33 0.02 92.36 6.30 0.12 0.00 0.02 0.00 1.02 0.19 48 P C C 48.99 17.53 11.07 27.81 115.06 -100.31 -64.66 144.64 94.99 4.98 0.02 93.10 1.78 0.12 0.00 0.02 0.00 4.81 0.17 49 R E E 99.66 8.90 20.58 30.21 124.55 -159.71 -120.15 138.17 9.69 90.25 0.05 8.55 1.00 0.09 0.02 0.03 0.00 89.64 0.67 50 L E E 65.32 14.50 19.17 33.42 110.99 -116.05 -75.61 127.12 1.04 98.95 0.01 0.94 0.04 0.00 0.00 0.00 0.00 98.97 0.03 51 L E E 15.58 20.23 20.27 40.48 101.42 174.93 -95.92 -34.82 2.86 97.10 0.03 1.96 0.71 0.04 0.01 0.01 0.00 97.26 0.02 52 I E E 15.11 20.01 21.41 41.29 136.52 6.04 -148.04 143.74 0.68 99.30 0.01 0.56 0.05 0.01 0.00 0.00 0.00 99.37 0.01 53 Y E E 49.10 17.72 21.39 38.38 125.38 -170.13 -126.88 132.83 2.87 97.06 0.06 2.51 0.14 0.02 0.03 0.01 0.00 97.22 0.06 54 Q E E 53.16 13.86 22.05 35.64 117.78 -169.17 -114.26 122.83 17.80 81.61 0.59 14.04 2.94 0.72 0.23 0.29 0.00 81.29 0.48 55 V E E 36.37 15.78 17.48 33.27 116.72 -168.80 -109.81 130.46 45.69 49.23 5.08 30.12 11.24 6.23 1.63 3.21 0.01 46.09 1.48 56 S C C 51.32 9.51 18.32 28.09 110.29 -127.07 -94.71 95.20 73.22 18.99 7.79 28.71 21.76 24.20 1.84 5.39 0.04 16.35 1.72 57 N C C 90.15 7.74 17.67 25.93 106.03 36.53 -101.46 44.02 77.20 14.05 8.74 31.78 21.28 25.75 2.00 6.06 0.03 11.17 1.92 58 W C C 106.61 12.33 15.04 27.48 112.61 138.31 -99.21 121.96 64.93 27.04 8.02 37.86 15.37 13.45 2.62 5.25 0.06 21.14 4.25 59 Y C C 100.36 12.06 14.72 27.01 115.45 151.80 -105.80 121.35 67.08 27.03 5.90 42.78 13.94 11.65 1.85 4.03 0.03 21.80 3.92 60 S C C 66.09 7.30 16.73 25.08 114.49 -164.53 -102.35 129.32 74.83 21.42 3.76 33.02 17.44 26.32 0.88 2.66 0.02 17.28 2.38 61 G C C 42.38 7.11 18.08 25.92 107.65 15.13 92.87 3.33 83.93 14.28 1.79 35.58 24.90 24.53 0.26 1.66 0.00 11.31 1.75 62 V C C 35.56 18.51 12.02 29.80 116.00 122.10 -95.21 130.18 87.27 12.37 0.36 67.66 18.52 1.23 0.11 0.29 0.00 8.89 3.29 63 P C C 57.48 9.43 16.34 26.79 110.37 -115.31 -66.47 149.63 89.33 6.98 3.70 61.03 13.32 14.61 0.66 3.44 0.00 5.63 1.31 64 D C C 107.55 4.68 17.71 23.56 97.75 -106.63 -69.98 -9.24 87.37 5.84 6.79 31.80 28.78 27.04 0.67 6.57 0.01 4.14 0.99 65 R C C 101.20 10.90 17.73 28.67 100.36 64.44 -90.35 -1.87 77.19 16.43 6.38 31.90 30.03 15.89 0.69 5.67 0.01 14.63 1.18 66 F E E 27.75 22.29 13.28 34.74 122.57 93.20 -112.76 135.73 23.47 75.18 1.36 18.58 4.62 1.47 0.47 0.82 0.00 72.50 1.54 67 S E E 53.87 7.11 23.48 31.68 133.80 169.49 -135.82 153.90 8.07 91.76 0.17 7.10 0.83 0.16 0.08 0.07 0.00 91.08 0.67 68 G E E 21.67 18.79 15.54 33.08 141.12 165.85 -158.14 166.07 8.17 91.75 0.08 6.97 0.98 0.19 0.02 0.04 0.00 91.47 0.33 69 S E E 61.59 5.40 22.26 29.33 136.99 -169.85 -147.80 158.15 13.48 86.43 0.09 11.46 1.64 0.26 0.02 0.05 0.00 86.09 0.46 70 G E E 29.17 11.98 15.73 28.19 138.89 144.36 -156.03 166.29 30.42 69.43 0.15 22.23 7.90 1.03 0.02 0.15 0.00 67.71 0.96 71 T C E 92.57 3.45 21.22 25.30 118.36 -134.42 -123.78 119.70 50.63 48.78 0.58 34.61 13.73 4.04 0.12 0.62 0.00 43.37 3.52 72 G C S 33.50 9.45 19.54 29.26 109.99 -44.40 64.66 -130.81 98.12 1.14 0.74 2.37 49.50 46.43 0.02 0.74 0.00 0.78 0.15 73 T C S 50.06 15.34 16.32 31.65 97.24 -12.10 -96.88 1.10 98.09 1.29 0.62 2.37 49.77 46.15 0.02 0.59 0.00 0.95 0.15 74 N E E 67.41 8.66 22.70 32.50 120.77 85.54 -106.41 130.57 38.85 60.94 0.21 26.57 12.16 1.38 0.04 0.25 0.00 57.15 2.47 75 F E E 7.23 24.83 15.84 41.17 129.57 -176.62 -130.02 145.61 18.57 81.42 0.01 17.78 0.46 0.03 0.00 0.00 0.00 81.34 0.39 76 T E E 35.58 10.04 27.33 38.53 122.35 -158.20 -118.62 134.73 6.15 93.85 0.00 5.52 0.15 0.00 0.00 0.00 0.00 94.27 0.05 77 L E E 2.85 26.47 18.49 45.97 119.18 -163.12 -112.85 128.17 0.45 99.55 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.54 0.00 78 K E E 78.49 9.24 27.50 37.30 119.17 -163.98 -113.91 127.18 0.17 99.83 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.79 0.01 79 I E E 7.17 24.71 16.10 41.40 117.27 -168.05 -113.61 123.28 3.60 96.40 0.00 3.80 0.03 0.00 0.00 0.00 0.00 95.63 0.54 80 S C S 44.90 7.39 23.33 30.91 128.14 -174.58 -110.87 155.05 90.21 9.77 0.02 41.98 44.47 2.14 0.00 0.03 0.00 11.19 0.18 81 R C S 146.50 3.61 23.98 27.54 95.02 10.40 57.44 52.16 98.15 1.84 0.01 5.93 89.98 2.23 0.00 0.01 0.00 1.77 0.08 82 V C C 13.33 24.45 10.48 34.56 115.11 -157.26 -78.84 135.16 98.31 1.68 0.01 97.60 1.14 0.01 0.00 0.00 0.00 0.87 0.37 83 E C C 84.95 4.57 24.92 29.18 132.41 -171.34 -126.27 162.87 95.52 4.45 0.03 96.50 0.18 0.01 0.01 0.01 0.00 0.74 2.56 84 A H G 53.56 13.94 15.55 29.35 91.05 -100.91 -58.41 -32.89 2.61 0.02 97.37 0.17 0.19 1.63 0.28 97.72 0.00 0.01 0.00 85 A H G 71.28 4.46 21.89 27.16 89.52 62.98 -70.38 -16.58 2.17 0.02 97.80 0.10 0.14 1.44 0.21 98.09 0.00 0.02 0.00 86 D H G 10.62 22.09 16.73 39.15 93.26 63.93 -84.81 -3.88 3.11 0.04 96.85 0.40 0.30 1.43 0.28 97.56 0.00 0.03 0.00 87 V C C 36.95 17.56 20.26 37.74 114.64 111.01 -71.25 136.99 96.77 3.14 0.09 93.19 3.66 0.12 0.01 0.08 0.00 2.74 0.20 88 G E E 12.74 11.67 24.68 37.68 138.72 70.03 139.53 -167.66 14.44 85.54 0.02 10.89 3.70 0.13 0.00 0.02 0.00 84.57 0.69 89 V E E 34.39 15.54 25.47 40.90 119.35 -34.75 -103.14 132.71 1.07 98.93 0.00 0.99 0.06 0.00 0.00 0.00 0.00 98.92 0.04 90 Y E E 5.65 25.57 22.00 47.60 123.87 -166.59 -116.27 138.04 0.39 99.61 0.00 0.34 0.02 0.00 0.00 0.00 0.00 99.62 0.01 91 Y E E 22.27 19.86 28.36 47.33 128.37 -166.07 -124.60 142.61 0.70 99.30 0.00 0.61 0.03 0.00 0.00 0.00 0.00 99.34 0.02 92 C E E 2.33 25.86 24.87 50.34 127.06 -168.53 -122.86 140.80 6.08 93.88 0.04 5.12 0.54 0.07 0.01 0.02 0.00 94.12 0.13 93 G E E 4.89 20.45 26.08 45.68 132.93 -170.88 -129.90 154.85 14.32 85.53 0.14 12.03 1.95 0.32 0.03 0.09 0.00 84.98 0.60 94 Q E E 37.18 18.11 23.16 40.33 126.86 -152.83 -123.72 144.86 32.74 66.87 0.39 25.53 7.16 1.50 0.09 0.33 0.00 63.77 1.62 95 G C C 15.81 14.91 19.63 34.28 128.54 55.75 -131.95 164.39 64.85 34.36 0.79 45.52 15.70 4.31 0.14 0.79 0.00 31.25 2.29 96 V C S 81.38 9.36 18.21 27.75 101.56 -120.22 -87.43 -18.34 87.68 11.18 1.14 15.05 48.04 24.94 0.10 1.14 0.00 9.36 1.35 97 H C S 116.49 5.46 17.96 24.03 103.84 44.55 -98.72 0.30 92.77 6.14 1.09 14.71 50.71 27.65 0.10 1.13 0.00 4.69 1.02 98 L C S 65.11 11.87 13.06 25.58 119.65 44.22 -112.02 130.98 90.02 8.68 1.30 37.66 45.34 7.50 0.22 1.22 0.00 5.68 2.37 99 P C C 74.63 6.98 17.72 25.41 110.29 -101.85 -71.43 145.36 91.85 6.20 1.95 43.62 29.32 19.10 0.22 1.98 0.00 4.98 0.78 100 R C C 105.23 12.43 16.63 28.88 114.69 -109.10 -85.53 133.22 72.28 25.26 2.46 44.81 16.73 11.16 0.36 2.34 0.00 22.73 1.87 101 T E E 47.99 13.79 18.40 32.25 125.16 -165.89 -119.14 140.45 45.14 53.17 1.69 36.40 5.53 2.47 0.58 1.31 0.00 46.69 7.02 102 F E E 56.81 17.44 17.41 34.16 117.63 -154.49 -106.27 131.00 40.17 58.11 1.72 28.05 8.44 4.39 0.68 1.37 0.02 46.53 10.52 103 G C T 26.44 12.50 19.33 31.45 119.25 -135.90 71.86 -161.48 73.59 24.44 1.97 22.91 25.89 25.95 0.23 1.83 0.01 21.41 1.79 104 Q C S 114.36 6.36 21.37 28.10 101.18 -36.62 -83.40 7.94 78.79 18.62 2.60 20.14 30.24 29.15 0.27 2.37 0.01 16.29 1.54 105 G C C 17.33 16.35 17.78 33.21 125.51 -113.07 98.41 168.68 70.94 28.07 0.99 37.23 24.96 9.01 0.10 1.08 0.00 26.49 1.13 106 T E E 25.41 18.91 18.28 36.63 124.20 -92.15 -112.51 139.20 37.78 62.14 0.08 33.90 2.38 0.24 0.01 0.07 0.00 62.89 0.51 107 K E E 101.54 8.89 23.95 33.31 120.75 -147.74 -108.86 133.99 3.99 95.99 0.02 3.64 0.25 0.02 0.00 0.01 0.00 95.89 0.19 108 V E E 13.13 23.05 14.68 37.61 121.24 -165.82 -116.66 131.16 1.58 98.41 0.01 1.55 0.04 0.01 0.00 0.00 0.00 98.34 0.06 109 D E E 74.36 5.53 23.65 29.50 118.08 -158.26 -107.63 127.34 2.53 97.46 0.01 2.50 0.08 0.01 0.00 0.00 0.00 97.25 0.14 110 I E E 33.09 20.08 11.12 30.39 116.32 -158.40 -103.79 125.84 15.72 84.24 0.04 16.04 0.20 0.03 0.02 0.01 0.00 82.94 0.75 111 K C C 129.77 3.97 19.41 24.21 115.22 -161.50 -95.77 126.68 99.15 0.84 0.00 99.21 0.05 0.01 0.00 0.00 0.00 0.71 0.01