# 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 96.09 4.58 21.01 25.81 105.29 -138.79 -85.38 70.75 99.83 0.16 0.00 99.67 0.16 0.04 0.00 0.00 0.00 0.12 0.00 1 I C C 35.75 20.00 11.63 30.79 117.59 -160.17 -100.67 129.62 50.78 49.15 0.07 49.64 0.62 0.13 0.01 0.04 0.00 48.89 0.66 2 V E E 67.86 6.99 21.51 29.33 120.97 -165.35 -115.25 130.99 10.21 89.74 0.05 9.29 0.72 0.09 0.02 0.03 0.00 89.38 0.48 3 L E E 35.77 20.04 14.56 34.17 119.44 -156.28 -106.68 129.29 5.57 94.40 0.03 5.18 0.30 0.05 0.01 0.01 0.00 94.16 0.29 4 T E E 59.77 8.39 21.66 30.65 125.44 -172.14 -122.40 141.14 11.18 88.74 0.08 9.96 0.92 0.14 0.03 0.04 0.00 88.18 0.73 5 Q E E 65.30 15.99 15.45 30.91 126.19 -164.74 -122.20 139.96 37.34 62.52 0.14 30.57 6.22 0.53 0.03 0.13 0.00 61.38 1.14 6 S C C 57.17 8.77 18.37 27.80 120.38 -137.98 -94.92 146.91 79.96 19.91 0.13 56.66 21.58 0.99 0.02 0.14 0.00 19.88 0.73 7 P C C 58.78 8.74 16.97 26.57 115.83 17.18 -72.87 152.57 90.06 9.55 0.39 61.96 24.38 3.04 0.04 0.44 0.00 9.61 0.53 8 A C S 61.10 10.10 16.65 27.33 96.18 -145.73 -78.95 -25.13 85.02 14.80 0.18 22.17 59.60 1.90 0.01 0.18 0.00 15.74 0.40 9 S E E 53.18 7.71 20.60 29.37 138.44 15.12 -149.56 150.44 14.85 84.99 0.15 11.96 2.45 0.28 0.02 0.13 0.00 84.82 0.34 10 L E E 29.30 19.65 15.73 34.95 129.95 -173.03 -137.60 140.02 1.57 98.42 0.01 1.45 0.08 0.01 0.00 0.00 0.00 98.38 0.08 11 A E E 58.72 7.92 23.91 32.36 119.37 -146.61 -104.32 132.17 1.16 98.84 0.00 1.09 0.06 0.01 0.00 0.00 0.00 98.80 0.04 12 V E E 14.42 21.03 14.45 35.30 134.21 176.37 -138.11 153.83 6.68 93.30 0.02 6.28 0.28 0.02 0.00 0.01 0.00 93.17 0.24 13 S E E 49.33 5.81 23.50 29.28 121.44 -118.62 -85.26 156.70 42.78 57.09 0.14 40.07 2.03 0.28 0.04 0.10 0.00 54.41 3.06 14 L C T 68.30 14.87 14.43 29.15 108.80 -83.21 -60.17 134.53 98.52 0.92 0.56 0.55 3.90 94.40 0.03 0.42 0.00 0.57 0.12 15 G C T 46.34 4.30 19.73 24.79 95.82 22.10 88.02 -6.31 99.25 0.37 0.38 0.65 4.02 94.70 0.02 0.31 0.00 0.25 0.05 16 Q C C 79.03 8.23 17.95 27.24 124.41 113.42 -90.85 154.55 93.61 6.08 0.31 55.27 37.70 0.96 0.06 0.27 0.00 4.87 0.87 17 R C C 126.67 8.92 18.85 28.97 124.34 -131.85 -110.72 142.53 76.70 23.27 0.03 76.60 0.69 0.05 0.00 0.02 0.00 21.90 0.73 18 A E E 9.87 21.47 15.16 36.56 131.33 -172.32 -131.08 148.16 2.30 97.70 0.00 2.19 0.07 0.01 0.00 0.00 0.00 97.59 0.13 19 T E E 65.72 8.02 24.87 33.52 120.80 -146.46 -114.80 131.44 0.52 99.47 0.00 0.50 0.01 0.00 0.00 0.00 0.00 99.47 0.01 20 I E E 5.73 25.50 16.49 42.67 121.59 -168.20 -117.35 130.37 2.16 97.83 0.00 2.02 0.06 0.00 0.00 0.00 0.00 97.87 0.03 21 S E E 42.23 9.00 26.83 36.33 123.22 -163.23 -111.00 137.92 12.26 87.73 0.01 11.09 0.42 0.02 0.00 0.01 0.00 88.39 0.07 22 C E E 4.87 25.46 16.90 42.65 133.45 -171.47 -138.21 150.65 12.83 87.14 0.03 11.67 0.76 0.06 0.01 0.02 0.00 87.23 0.26 23 R E E 98.06 8.30 27.52 36.72 123.50 -155.67 -115.47 138.73 6.26 93.67 0.07 5.76 0.40 0.06 0.04 0.03 0.00 91.24 2.48 24 A E E 8.20 24.39 15.42 39.60 117.79 -142.28 -89.03 143.81 33.02 66.04 0.94 29.99 2.30 0.47 0.47 0.50 0.00 64.05 2.22 25 S C C 38.25 10.44 20.37 31.26 117.78 -123.25 -79.50 158.06 71.31 23.80 4.89 56.99 11.07 2.82 1.76 3.03 0.00 22.44 1.87 26 E C S 119.36 6.22 18.63 25.59 99.65 -103.86 -76.37 -17.60 68.34 7.94 23.72 22.80 27.54 20.48 9.54 12.09 0.19 5.33 2.04 27 S C C 57.52 7.46 18.57 26.54 107.17 61.57 -87.12 79.19 71.50 7.68 20.82 39.46 14.48 18.71 7.68 12.41 0.05 5.09 2.13 28 V C C 37.62 18.42 13.12 30.40 102.61 98.41 -88.69 -3.48 59.32 11.30 29.38 34.49 13.66 11.91 14.01 14.83 0.23 6.37 4.49 29 D C C 78.50 8.38 16.78 25.76 105.57 77.92 -86.37 20.93 69.13 8.58 22.29 41.79 12.33 15.75 9.75 11.95 0.06 5.51 2.86 30 N C T 94.63 6.95 15.89 23.59 101.33 60.49 -88.61 4.83 71.25 6.78 21.98 23.94 19.19 30.12 8.27 11.93 0.12 3.93 2.50 31 Y C T 130.46 6.98 16.62 24.25 102.83 48.41 -91.41 12.86 82.73 3.61 13.66 15.93 24.03 43.57 4.94 7.82 0.03 2.17 1.51 32 G C S 30.78 9.00 18.00 27.59 109.04 -91.52 89.51 -7.39 87.81 9.26 2.93 17.95 41.65 28.57 0.40 2.41 0.00 7.82 1.19 33 I C C 58.84 12.18 19.55 32.15 118.99 79.77 -104.47 132.74 60.74 38.34 0.92 46.28 11.27 3.04 0.22 0.79 0.00 36.13 2.26 34 S E E 13.00 20.80 18.72 38.99 122.01 -172.01 -114.46 139.54 32.86 66.81 0.33 26.98 4.99 0.88 0.08 0.25 0.00 65.77 1.05 35 F E E 40.36 15.19 26.15 41.27 129.40 -170.59 -127.89 145.03 10.27 89.68 0.05 8.68 1.29 0.11 0.01 0.03 0.00 89.59 0.28 36 L E E 3.83 25.99 21.14 47.45 123.38 -158.47 -116.88 133.97 2.39 97.60 0.01 2.10 0.15 0.01 0.00 0.00 0.00 97.69 0.05 37 N E E 26.21 16.13 27.34 43.19 128.29 -171.31 -123.97 144.27 0.71 99.29 0.00 0.63 0.03 0.00 0.00 0.00 0.00 99.33 0.01 38 W E E 11.02 23.93 21.42 45.23 125.65 -160.73 -116.76 138.83 0.59 99.41 0.00 0.53 0.02 0.00 0.00 0.00 0.00 99.43 0.01 39 F E E 27.52 15.49 24.05 39.80 132.41 -174.81 -132.64 149.69 0.65 99.35 0.00 0.56 0.03 0.00 0.00 0.00 0.00 99.39 0.03 40 Q E E 42.12 14.81 20.78 35.81 120.13 -145.52 -106.62 135.90 3.96 96.03 0.00 3.33 0.30 0.02 0.00 0.00 0.00 96.23 0.13 41 Q E E 52.18 13.87 15.54 29.97 120.41 -151.31 -103.71 138.35 37.70 62.28 0.02 34.92 1.80 0.06 0.00 0.01 0.00 61.86 1.34 42 K C C 98.86 6.12 15.49 22.91 118.86 -131.44 -88.35 147.12 98.05 1.92 0.03 96.35 1.79 0.16 0.01 0.02 0.00 1.36 0.31 43 P C T 102.27 4.22 11.44 17.61 109.81 -84.96 -59.00 134.74 99.83 0.06 0.11 0.22 2.97 96.67 0.00 0.10 0.00 0.03 0.01 44 G C T 68.93 0.29 13.25 10.85 94.92 18.62 84.30 -3.41 99.85 0.04 0.11 0.32 3.01 96.52 0.00 0.11 0.00 0.03 0.00 45 Q C S 85.20 6.02 9.64 17.80 126.68 101.21 -109.04 152.56 96.48 3.47 0.06 29.32 67.59 0.19 0.01 0.03 0.00 1.10 1.76 46 P C C 99.29 1.80 17.25 18.70 116.36 -95.25 -64.67 149.63 98.60 1.39 0.01 91.08 7.48 0.15 0.00 0.01 0.00 1.09 0.18 47 P C C 47.91 17.64 10.79 27.67 115.10 -101.21 -64.11 144.76 94.74 5.25 0.01 93.07 1.61 0.11 0.00 0.01 0.00 5.03 0.17 48 K E E 95.28 7.56 21.18 29.56 124.44 -158.73 -121.72 139.06 12.53 87.45 0.02 11.04 1.15 0.07 0.00 0.02 0.00 87.01 0.71 49 L E E 63.92 15.51 18.07 33.21 110.42 -114.83 -74.86 127.24 0.92 99.08 0.00 0.83 0.03 0.00 0.00 0.00 0.00 99.12 0.03 50 L E E 24.30 17.74 20.60 38.45 101.61 175.53 -96.17 -35.74 2.34 97.66 0.00 1.39 0.80 0.01 0.00 0.00 0.00 97.80 0.01 51 I E E 13.68 20.27 21.50 41.79 137.64 3.57 -149.08 144.22 0.23 99.76 0.00 0.19 0.01 0.00 0.00 0.00 0.00 99.79 0.00 52 Y E E 62.97 18.18 22.75 39.50 128.38 -170.33 -131.29 137.07 0.49 99.51 0.01 0.43 0.01 0.00 0.00 0.00 0.00 99.53 0.01 53 A E E 15.66 18.87 22.84 41.01 126.94 -171.07 -126.55 140.28 8.18 91.65 0.17 6.95 0.75 0.14 0.07 0.07 0.00 91.74 0.28 54 A E E 26.06 16.65 22.23 38.33 127.15 -170.29 -122.51 143.62 34.93 62.11 2.96 27.59 5.93 2.27 0.83 1.93 0.00 60.39 1.05 55 S C C 24.83 16.41 18.91 34.97 128.36 -158.01 -129.98 153.82 65.74 29.05 5.21 43.31 15.42 7.96 1.30 3.90 0.01 25.92 2.17 56 N C C 86.98 9.05 19.50 28.83 104.70 -146.42 -97.63 61.77 76.13 17.72 6.15 45.61 19.09 12.36 1.59 4.66 0.02 12.99 3.68 57 Q C C 89.41 10.53 15.06 26.00 102.26 130.32 -84.34 5.41 81.04 11.22 7.75 41.30 21.76 19.21 1.87 5.63 0.02 6.77 3.46 58 G C C 50.31 4.50 16.36 22.06 106.78 -112.45 73.72 3.12 87.41 6.07 6.52 33.93 26.51 27.67 1.05 5.33 0.00 3.41 2.09 59 S C T 67.90 7.24 14.91 22.90 105.84 50.03 -90.66 46.18 89.96 3.95 6.09 23.99 28.55 37.79 0.92 5.02 0.00 2.12 1.62 60 G C S 47.50 5.86 17.56 24.24 100.16 -95.31 85.15 3.93 92.66 4.85 2.49 27.94 36.18 28.79 0.32 2.41 0.00 2.98 1.39 61 V C C 37.21 16.98 12.41 29.42 117.42 125.33 -95.04 131.39 85.41 13.68 0.90 51.87 32.47 1.90 0.33 0.60 0.00 6.46 6.38 62 P C C 53.05 9.47 17.89 28.44 112.99 -109.55 -66.66 148.09 86.09 9.59 4.32 71.46 8.31 5.72 1.01 3.67 0.00 6.94 2.90 63 A C C 61.25 10.78 16.99 27.90 96.82 -110.09 -67.84 -19.67 81.13 8.42 10.45 29.35 28.11 24.91 1.07 9.14 0.01 6.15 1.26 64 R C E 119.24 8.49 20.95 29.61 110.16 51.07 -106.48 83.68 61.35 27.89 10.76 24.70 18.62 20.43 1.22 8.77 0.02 24.83 1.41 65 F E E 27.04 22.62 13.90 35.82 124.44 117.34 -111.54 138.68 25.01 71.59 3.40 19.89 4.24 1.81 1.37 2.08 0.01 67.90 2.71 66 S E E 52.54 7.62 24.10 32.81 135.39 -177.18 -138.27 156.15 16.62 82.94 0.43 14.19 2.02 0.50 0.21 0.25 0.00 80.52 2.30 67 G E E 19.35 19.09 16.19 34.16 141.19 162.61 -159.11 167.89 21.97 77.84 0.19 18.69 2.81 0.55 0.06 0.13 0.00 76.62 1.14 68 S E E 60.59 6.11 22.70 30.28 135.56 -157.78 -143.50 156.29 29.82 69.98 0.21 25.28 3.65 0.77 0.06 0.17 0.00 68.52 1.56 69 G E E 27.81 13.28 15.83 29.16 137.78 146.62 -143.16 172.64 49.65 50.04 0.32 34.13 14.34 2.53 0.05 0.33 0.00 46.53 2.08 70 S C C 73.23 4.17 21.08 25.98 110.60 -126.59 -113.90 47.15 64.50 34.46 1.04 35.41 22.77 8.73 0.17 1.12 0.00 27.32 4.48 71 G C S 33.38 10.32 19.27 29.43 108.72 -49.29 68.62 -122.55 97.20 1.85 0.95 4.42 55.92 37.05 0.04 0.98 0.00 1.33 0.27 72 T C S 57.22 14.06 17.33 31.09 99.12 -15.66 -99.38 -3.45 95.36 3.92 0.73 4.68 58.14 32.69 0.03 0.71 0.00 3.37 0.38 73 Y E E 96.75 8.60 22.48 32.23 122.60 80.05 -113.53 134.21 42.58 57.14 0.28 26.20 15.24 2.20 0.05 0.31 0.00 50.93 5.06 74 F E E 9.30 24.67 16.19 41.09 127.88 -173.14 -126.56 141.22 25.96 74.02 0.02 23.89 1.21 0.10 0.00 0.02 0.00 73.40 1.37 75 S E E 31.04 10.81 27.19 38.76 125.98 -166.63 -123.14 140.66 14.01 85.99 0.00 12.69 0.66 0.02 0.00 0.00 0.00 86.35 0.28 76 L E E 3.90 25.94 18.14 44.87 121.36 -162.87 -117.34 130.31 2.20 97.80 0.00 2.23 0.04 0.00 0.00 0.00 0.00 97.65 0.07 77 N E E 59.18 9.05 27.08 36.73 118.59 -162.89 -112.43 126.56 0.56 99.44 0.00 0.61 0.01 0.00 0.00 0.00 0.00 99.32 0.06 78 I E E 8.24 24.42 15.42 40.42 119.15 -164.36 -112.65 126.36 4.02 95.98 0.00 4.18 0.06 0.00 0.00 0.00 0.00 94.65 1.11 79 H C C 87.90 7.12 23.06 30.37 121.21 -154.03 -99.86 144.23 88.12 11.86 0.03 66.20 19.30 0.97 0.00 0.04 0.00 13.14 0.34 80 P C S 74.16 6.20 22.54 28.69 110.46 -8.84 -64.64 139.14 98.78 1.20 0.02 12.45 84.08 2.29 0.00 0.03 0.00 1.06 0.09 81 M C C 23.66 23.23 10.16 32.54 114.84 -131.73 -78.37 137.17 98.51 1.48 0.01 98.05 0.80 0.03 0.00 0.00 0.00 0.62 0.49 82 E C C 90.14 3.90 22.34 26.03 129.98 -166.38 -117.10 160.67 98.95 1.00 0.04 98.99 0.31 0.01 0.01 0.01 0.00 0.21 0.45 83 E H G 123.12 7.56 15.07 24.14 91.25 -100.48 -58.99 -33.98 3.38 0.02 96.60 0.15 0.20 2.22 0.27 97.15 0.00 0.01 0.00 84 D H G 105.48 2.82 20.30 23.57 90.08 61.30 -72.31 -15.14 3.20 0.02 96.77 0.10 0.16 2.18 0.18 97.36 0.00 0.02 0.00 85 D H G 12.84 21.12 14.66 36.15 93.87 63.36 -86.69 -2.26 4.60 0.06 95.35 0.72 0.49 1.85 0.29 96.61 0.00 0.05 0.00 86 T C C 39.73 14.77 20.10 35.32 115.98 109.15 -74.30 136.81 96.80 3.14 0.06 94.37 2.62 0.07 0.01 0.05 0.00 2.75 0.15 87 A E E 14.63 16.32 22.27 38.47 145.44 137.02 -164.62 175.86 5.16 94.84 0.00 4.92 0.22 0.01 0.00 0.00 0.00 94.45 0.40 88 V E E 41.81 12.65 25.45 38.62 119.35 -96.26 -105.57 133.66 0.46 99.54 0.00 0.44 0.01 0.00 0.00 0.00 0.00 99.54 0.01 89 Y E E 6.33 25.46 19.73 45.53 124.06 -164.92 -114.63 138.00 0.16 99.84 0.00 0.15 0.01 0.00 0.00 0.00 0.00 99.85 0.00 90 F E E 26.76 16.35 27.48 43.74 129.95 -170.61 -124.96 146.07 0.33 99.67 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.69 0.00 91 C E E 2.48 25.63 21.74 47.74 122.62 -152.86 -113.36 136.32 2.14 97.86 0.00 1.90 0.09 0.00 0.00 0.00 0.00 97.95 0.04 92 Q E E 32.59 15.02 25.95 40.87 126.80 -169.38 -122.96 141.44 2.05 97.95 0.01 1.83 0.08 0.01 0.00 0.00 0.00 97.95 0.11 93 Q E E 22.70 19.16 18.81 37.85 125.76 -163.88 -118.80 141.60 4.42 95.56 0.02 3.68 0.47 0.05 0.00 0.01 0.00 95.61 0.16 94 T E E 51.62 10.43 17.61 29.13 119.39 -151.71 -111.32 130.20 17.32 82.59 0.08 14.25 2.18 0.34 0.01 0.07 0.00 82.63 0.51 95 K E E 101.07 7.95 12.97 22.24 113.18 -176.87 -122.34 100.12 43.10 56.17 0.73 23.03 13.48 8.34 0.09 0.72 0.00 53.19 1.15 96 G C T 60.06 1.08 14.50 15.05 109.74 -52.15 66.75 -130.00 98.19 0.99 0.82 6.55 36.82 54.84 0.04 0.87 0.00 0.73 0.16 97 V C T 120.08 2.16 12.76 15.74 102.67 -13.05 -93.55 4.33 97.33 1.83 0.84 7.46 41.61 48.34 0.05 0.87 0.00 1.43 0.25 98 S E E 61.68 4.66 14.80 20.77 120.84 55.29 -98.41 149.02 42.69 57.15 0.16 29.18 11.87 1.68 0.02 0.17 0.00 56.28 0.80 99 W E E 85.03 16.02 12.76 28.61 119.19 -132.16 -94.99 135.91 17.70 82.28 0.02 16.04 0.87 0.09 0.00 0.02 0.00 82.69 0.29 100 T E E 45.55 10.99 21.18 32.78 126.79 -169.30 -123.93 143.69 4.32 95.67 0.01 3.90 0.24 0.02 0.00 0.00 0.00 95.44 0.39 101 F E E 64.04 18.09 18.49 35.52 117.84 -133.98 -95.03 134.36 8.73 91.24 0.02 7.70 0.70 0.08 0.01 0.01 0.00 90.66 0.82 102 G E E 15.26 16.98 19.58 35.71 117.90 -157.16 -86.54 -97.20 49.79 50.15 0.07 41.16 6.01 0.67 0.01 0.06 0.00 51.61 0.49 103 G C C 33.59 10.37 23.46 33.19 111.82 -114.91 -88.35 134.65 61.32 38.62 0.05 51.86 6.74 0.48 0.00 0.05 0.00 40.52 0.35 104 G E E 16.27 18.37 18.05 35.08 132.17 -134.92 82.96 173.62 45.74 54.23 0.02 41.63 2.33 0.11 0.00 0.02 0.00 55.58 0.33 105 T E E 32.19 15.75 20.67 36.34 130.13 -121.21 -127.99 146.46 4.45 95.55 0.00 4.18 0.12 0.00 0.00 0.00 0.00 95.59 0.10 106 K E E 98.72 10.20 23.52 33.74 116.93 -127.89 -94.24 134.15 0.56 99.44 0.00 0.50 0.02 0.00 0.00 0.00 0.00 99.47 0.01 107 V E E 9.65 23.44 15.09 38.61 120.96 -162.73 -114.81 131.93 0.83 99.17 0.00 0.81 0.01 0.00 0.00 0.00 0.00 99.17 0.02 108 E E E 90.16 6.26 24.15 30.76 119.60 -157.21 -109.47 130.85 2.12 97.88 0.00 2.10 0.06 0.00 0.00 0.00 0.00 97.73 0.10 109 I E E 26.94 20.76 11.37 31.43 115.41 -151.09 -98.25 127.16 19.92 80.05 0.03 20.26 0.20 0.03 0.01 0.01 0.00 78.73 0.76 110 K C C 128.44 4.10 19.56 24.48 113.87 -154.19 -90.51 128.99 99.61 0.39 0.00 99.65 0.05 0.01 0.00 0.00 0.00 0.28 0.01