# 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 E C C 116.98 5.41 20.45 26.61 115.81 -138.20 -91.31 130.80 99.59 0.40 0.00 99.57 0.09 0.02 0.00 0.00 0.00 0.32 0.01 1 I C C 39.61 19.17 12.39 30.95 118.13 -153.81 -104.54 129.08 54.37 45.54 0.09 53.81 0.46 0.11 0.02 0.04 0.00 44.86 0.69 2 V E E 66.73 7.37 20.71 29.01 118.41 -163.35 -113.02 127.42 15.17 84.73 0.11 14.11 0.87 0.13 0.04 0.06 0.00 84.01 0.78 3 L E E 36.75 19.26 13.98 32.90 117.97 -155.95 -104.05 128.56 11.03 88.88 0.09 10.34 0.61 0.10 0.03 0.04 0.00 88.25 0.62 4 T E E 67.55 7.64 20.62 28.99 121.49 -171.25 -118.36 133.39 20.88 78.93 0.20 18.08 2.18 0.40 0.05 0.13 0.00 78.26 0.89 5 Q E E 66.67 13.69 15.16 28.98 126.77 -165.91 -123.05 140.83 47.77 51.90 0.33 36.62 10.27 1.29 0.07 0.29 0.00 50.36 1.11 6 S C C 60.02 7.44 18.03 26.33 119.50 -128.88 -89.86 146.47 79.16 20.53 0.31 49.45 26.17 3.16 0.04 0.33 0.00 19.85 1.00 7 P C S 73.95 7.80 16.88 25.42 110.67 -43.07 -69.14 146.02 88.88 10.60 0.52 17.68 48.00 22.40 0.03 0.61 0.00 10.75 0.52 8 G C E 34.30 9.90 17.68 27.68 108.25 -129.50 77.19 -21.77 54.48 45.02 0.50 20.19 23.48 11.16 0.03 0.58 0.00 43.89 0.66 9 T E E 70.77 8.44 19.48 28.66 128.99 20.14 -130.01 140.64 21.55 78.36 0.09 18.90 1.98 0.26 0.01 0.08 0.00 78.29 0.49 10 L E E 25.83 20.05 15.11 34.79 126.15 -169.55 -126.29 138.24 3.78 96.22 0.01 3.45 0.21 0.01 0.00 0.00 0.00 96.14 0.18 11 S E E 63.22 7.00 23.67 31.59 121.41 -157.13 -114.83 132.33 2.66 97.34 0.00 2.39 0.16 0.01 0.00 0.00 0.00 97.33 0.11 12 L E E 17.29 21.13 13.92 34.75 131.90 -173.37 -133.03 149.58 16.35 83.64 0.01 15.41 0.71 0.03 0.00 0.01 0.00 82.63 1.20 13 S C C 52.70 4.82 23.54 28.08 122.54 -126.97 -88.05 157.52 93.99 5.98 0.03 92.78 1.43 0.10 0.01 0.02 0.00 5.13 0.53 14 P C T 61.12 13.56 14.38 28.13 109.47 -80.29 -59.59 135.22 99.14 0.39 0.47 0.27 2.51 96.62 0.03 0.30 0.00 0.20 0.07 15 G C T 46.86 4.16 19.36 24.32 95.89 22.70 88.54 -6.65 99.32 0.26 0.42 0.43 2.95 96.10 0.03 0.29 0.00 0.18 0.02 16 E C C 82.42 8.30 17.72 27.15 123.17 117.00 -87.87 150.16 91.32 8.38 0.30 71.52 19.28 0.60 0.05 0.27 0.00 7.39 0.89 17 R E E 124.58 9.33 18.87 29.30 123.85 -137.86 -109.42 141.43 46.65 53.31 0.05 45.90 0.74 0.07 0.01 0.03 0.00 52.13 1.11 18 A E E 9.57 21.38 15.58 36.93 130.85 -171.24 -130.75 147.94 2.34 97.65 0.01 2.21 0.08 0.01 0.00 0.00 0.00 97.59 0.11 19 T E E 63.41 8.85 24.81 34.22 121.39 -147.68 -115.37 132.15 1.07 98.93 0.00 0.95 0.05 0.00 0.00 0.00 0.00 98.97 0.02 20 L E E 5.92 25.22 17.17 42.87 122.41 -167.97 -116.79 132.93 4.05 95.95 0.01 3.59 0.26 0.01 0.00 0.00 0.00 96.07 0.06 21 S E E 34.51 10.31 26.61 37.44 126.16 -164.86 -117.26 142.28 11.10 88.89 0.01 9.93 0.57 0.03 0.00 0.01 0.00 89.33 0.12 22 C E E 4.69 25.22 16.84 42.40 131.88 -173.12 -135.91 149.40 11.34 88.63 0.02 10.47 0.56 0.04 0.00 0.02 0.00 88.49 0.42 23 R E E 111.67 6.65 26.56 33.95 121.92 -155.45 -116.61 133.06 7.24 92.72 0.03 6.77 0.38 0.04 0.02 0.02 0.00 90.00 2.77 24 A E E 9.85 23.75 11.87 35.13 119.27 -145.90 -89.56 141.83 46.97 52.66 0.38 44.41 1.95 0.34 0.10 0.27 0.00 50.89 2.05 25 S C S 73.21 3.69 21.16 24.95 98.15 -153.68 -85.02 -21.33 87.83 11.28 0.88 28.39 54.74 4.39 0.08 0.84 0.00 10.93 0.63 26 Q C S 97.27 4.04 20.45 24.86 133.64 18.07 -138.73 160.89 88.58 10.26 1.16 11.95 69.92 6.75 0.10 0.99 0.00 9.51 0.77 27 S C C 69.78 6.47 19.50 27.05 115.61 -89.80 -74.59 141.97 87.44 11.16 1.40 77.26 6.64 2.93 0.16 1.61 0.00 10.32 1.08 28 V C C 17.28 22.43 11.57 33.50 122.68 -159.81 -114.01 133.52 66.78 32.40 0.81 60.29 4.21 1.36 0.30 0.60 0.00 19.43 13.81 29 S C C 78.99 3.19 22.87 26.34 106.74 -161.13 -100.04 78.36 82.85 16.44 0.71 52.90 22.81 7.51 0.12 0.76 0.00 13.22 2.68 30 G C S 23.01 11.49 18.39 30.27 135.87 74.63 -127.48 172.13 88.09 11.23 0.68 20.92 56.26 10.63 0.06 0.72 0.00 10.37 1.04 31 S C S 57.01 10.19 20.89 31.25 99.23 -119.91 -87.47 -14.63 86.39 13.39 0.22 15.13 65.98 3.95 0.01 0.21 0.00 14.23 0.49 32 Y E E 58.53 13.29 23.63 37.29 130.52 43.40 -131.53 142.63 21.60 78.25 0.16 16.87 3.97 0.66 0.02 0.15 0.00 77.95 0.39 33 L E E 3.71 25.95 19.97 46.26 128.84 -172.48 -130.67 142.76 1.98 98.02 0.00 1.82 0.10 0.01 0.00 0.00 0.00 98.01 0.07 34 A E E 10.80 17.93 27.79 45.56 129.93 -166.85 -125.44 145.06 0.50 99.50 0.00 0.48 0.01 0.00 0.00 0.00 0.00 99.50 0.01 35 W E E 8.15 24.48 23.02 47.29 124.24 -153.60 -112.98 140.43 0.57 99.43 0.00 0.51 0.02 0.00 0.00 0.00 0.00 99.46 0.01 36 Y E E 23.78 17.43 23.56 40.98 132.81 -173.97 -131.78 149.51 0.79 99.21 0.00 0.68 0.03 0.00 0.00 0.00 0.00 99.25 0.03 37 Q E E 45.49 14.06 21.67 35.95 120.65 -142.12 -109.39 133.93 2.99 97.00 0.00 2.48 0.27 0.01 0.00 0.00 0.00 97.13 0.10 38 Q E E 53.97 14.22 15.45 30.10 119.03 -154.61 -104.92 136.44 29.08 70.90 0.02 26.43 1.81 0.07 0.00 0.02 0.00 70.49 1.16 39 K C C 100.84 6.05 15.78 23.11 119.89 -137.87 -92.30 146.61 98.28 1.69 0.03 96.23 2.07 0.19 0.01 0.02 0.00 1.20 0.27 40 P C T 103.56 3.98 11.48 17.51 109.72 -85.11 -58.52 133.95 99.62 0.10 0.28 0.43 3.64 95.57 0.01 0.26 0.00 0.06 0.02 41 G C T 69.09 0.28 13.14 10.74 95.12 18.45 83.31 -3.17 99.65 0.07 0.28 0.55 3.62 95.47 0.01 0.29 0.00 0.05 0.01 42 Q C S 89.79 5.46 10.31 17.90 129.17 98.06 -113.10 158.80 95.00 4.60 0.39 35.79 58.19 1.10 0.07 0.31 0.00 1.55 2.99 43 A C C 76.81 2.28 17.93 20.16 116.45 -97.88 -68.95 149.17 97.72 2.26 0.02 87.21 10.57 0.15 0.00 0.02 0.00 1.72 0.33 44 P C C 42.90 18.52 11.67 29.39 115.25 -101.72 -65.82 145.00 88.87 11.10 0.03 87.24 1.78 0.11 0.00 0.02 0.00 10.49 0.36 45 S E E 46.72 9.10 21.98 31.50 127.63 -162.86 -123.92 144.47 9.09 90.88 0.04 7.96 0.96 0.08 0.01 0.02 0.00 90.34 0.62 46 L E E 59.51 16.33 18.84 34.55 110.51 -113.72 -74.92 126.36 0.89 99.11 0.00 0.80 0.04 0.00 0.00 0.00 0.00 99.13 0.03 47 L E E 21.05 18.84 21.68 40.33 101.21 175.62 -96.06 -34.84 1.78 98.21 0.01 1.24 0.41 0.01 0.00 0.00 0.00 98.32 0.01 48 I E E 10.80 21.66 22.39 43.77 137.15 4.96 -148.78 143.44 0.49 99.50 0.00 0.40 0.03 0.00 0.00 0.00 0.00 99.55 0.01 49 Y E E 58.48 18.06 23.73 40.35 130.19 -172.72 -133.86 139.60 4.68 95.29 0.03 3.90 0.41 0.05 0.01 0.01 0.00 95.47 0.14 50 G E E 11.02 18.44 22.28 39.64 134.19 162.95 -138.37 167.61 39.91 59.02 1.07 25.83 12.27 2.91 0.29 0.73 0.00 57.23 0.75 51 A C C 33.75 14.06 21.08 34.87 113.82 -117.33 -95.46 147.94 63.26 23.64 13.10 31.19 21.09 13.69 3.87 8.25 0.10 19.43 2.37 52 S C C 49.66 12.24 18.85 30.64 102.50 -111.33 -82.00 -4.14 68.65 8.01 23.34 26.92 20.82 22.97 8.05 13.72 0.14 5.06 2.31 53 S C C 58.30 9.25 18.15 27.61 102.49 66.45 -86.23 5.24 65.31 6.55 28.14 26.79 18.26 22.00 11.05 15.60 0.16 3.66 2.49 54 R C C 118.81 10.08 15.99 26.29 102.23 71.99 -83.91 -1.06 62.69 8.88 28.44 31.94 15.62 16.36 13.39 14.21 0.16 5.08 3.24 55 A C C 57.31 10.75 14.87 25.84 104.45 88.25 -82.97 11.99 68.39 8.44 23.17 34.92 16.20 18.32 10.62 11.74 0.11 4.90 3.19 56 T C T 82.19 6.64 16.74 24.27 108.31 95.83 -94.19 45.81 76.17 7.35 16.48 25.86 20.60 31.15 7.15 8.09 0.12 4.20 2.82 57 G C C 43.89 5.83 19.05 25.68 105.53 -22.86 91.12 7.27 90.81 5.64 3.54 37.74 26.00 27.76 0.74 2.71 0.00 3.25 1.81 58 I C C 34.61 20.99 11.18 30.93 116.26 125.91 -91.64 130.64 93.10 6.50 0.40 72.23 20.12 0.89 0.17 0.24 0.00 3.00 3.35 59 P C C 49.41 9.29 16.25 26.94 114.46 -111.32 -66.52 152.03 93.25 2.78 3.97 82.86 4.72 5.35 0.74 3.50 0.00 1.81 1.02 60 D C T 121.04 2.26 17.43 20.70 92.65 -109.31 -64.10 -22.90 77.83 1.70 20.48 8.36 17.93 51.23 1.61 19.21 0.01 1.08 0.58 61 R C T 113.89 9.13 18.13 27.68 93.83 64.03 -79.99 -11.22 71.58 6.07 22.34 8.47 16.71 46.89 1.72 20.32 0.03 4.96 0.91 62 F E E 20.30 23.14 13.08 35.44 109.94 67.46 -104.76 89.11 28.13 57.28 14.60 17.98 8.22 6.25 2.65 10.25 0.05 52.51 2.10 63 S E E 50.83 8.78 22.71 32.29 131.69 132.40 -125.50 151.60 17.44 82.06 0.50 14.41 2.82 0.66 0.24 0.28 0.00 79.74 1.85 64 G E E 20.96 18.03 16.10 33.04 141.68 163.69 -157.87 169.05 16.27 83.52 0.21 13.96 2.16 0.47 0.07 0.13 0.00 82.37 0.84 65 S E E 65.30 5.23 21.84 28.70 135.26 -157.66 -145.14 155.20 23.98 75.82 0.20 20.51 2.98 0.56 0.05 0.14 0.00 74.82 0.93 66 G E E 29.02 11.44 15.81 27.86 139.56 126.19 142.13 163.91 42.12 57.61 0.27 31.07 10.50 1.74 0.05 0.28 0.00 54.56 1.80 67 S C C 75.70 3.48 20.76 24.85 119.79 -99.24 -121.49 126.48 63.86 35.38 0.76 41.75 18.48 5.17 0.15 0.80 0.00 29.54 4.13 68 G C S 32.87 10.44 18.62 29.09 109.33 -47.35 65.93 -127.23 96.90 1.91 1.18 4.03 56.37 36.72 0.04 1.17 0.00 1.38 0.28 69 T C S 60.58 13.17 17.03 30.20 98.19 -7.24 -95.76 -5.00 96.62 2.38 1.01 3.51 56.66 36.69 0.04 0.94 0.00 1.90 0.26 70 D E E 64.81 8.19 22.44 31.67 117.91 82.89 -107.59 127.66 46.91 52.48 0.61 26.46 18.08 4.90 0.07 0.71 0.00 47.51 2.27 71 F E E 8.42 24.64 15.66 40.71 127.87 -174.13 -125.19 141.69 19.88 80.11 0.01 18.75 0.73 0.05 0.00 0.01 0.00 79.84 0.62 72 T E E 37.86 10.23 27.28 38.49 123.91 -165.01 -120.79 135.37 4.91 95.08 0.00 4.40 0.20 0.00 0.00 0.00 0.00 95.29 0.10 73 L E E 3.15 26.17 18.85 45.93 119.39 -160.88 -110.82 128.79 0.43 99.57 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.56 0.01 74 T E E 40.02 10.19 27.15 38.11 120.16 -165.67 -116.39 128.93 0.19 99.81 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.01 75 I E E 8.03 23.99 16.42 40.92 117.16 -166.51 -114.32 124.03 2.61 97.39 0.00 2.72 0.03 0.00 0.00 0.00 0.00 96.83 0.42 76 S C S 44.95 7.59 22.62 30.57 124.38 -167.70 -108.69 158.70 88.98 10.98 0.04 39.55 44.91 2.40 0.00 0.07 0.00 12.84 0.23 77 R C S 147.24 3.72 23.60 27.41 95.79 8.67 56.93 51.80 98.15 1.84 0.02 8.87 86.84 2.35 0.00 0.02 0.00 1.81 0.10 78 L C C 17.79 23.72 10.16 33.33 114.40 -148.78 -75.78 135.18 97.25 2.74 0.01 96.22 1.59 0.02 0.00 0.00 0.00 1.08 1.09 79 E C C 86.93 4.44 23.90 28.07 129.25 -170.59 -121.01 155.55 99.85 0.14 0.01 99.60 0.29 0.00 0.00 0.00 0.00 0.03 0.07 80 P H G 69.64 13.03 14.81 28.01 90.97 -105.81 -58.68 -31.64 3.69 0.02 96.30 0.20 0.22 2.44 0.48 96.64 0.00 0.01 0.00 81 E H G 124.26 3.92 20.99 25.65 90.13 62.93 -71.48 -16.74 2.80 0.02 97.18 0.10 0.15 1.97 0.37 97.39 0.00 0.02 0.00 82 D H G 18.98 19.46 16.57 36.23 94.55 61.11 -88.37 -2.88 3.59 0.04 96.37 0.45 0.35 1.72 0.55 96.89 0.00 0.03 0.00 83 F C C 43.28 18.24 19.84 37.86 116.42 103.36 -81.79 134.56 82.78 15.65 1.57 77.33 5.22 0.61 0.27 1.30 0.00 14.35 0.94 84 A E E 14.01 17.84 23.00 40.13 140.05 170.17 -148.00 169.22 22.98 76.81 0.20 20.12 2.65 0.36 0.06 0.14 0.00 75.40 1.26 85 V E E 33.18 15.57 25.23 40.64 118.97 -109.49 -105.44 132.20 3.78 96.15 0.07 3.45 0.29 0.05 0.02 0.03 0.00 95.98 0.19 86 Y E E 10.03 24.14 20.81 44.73 124.56 -167.17 -115.50 138.01 2.28 97.63 0.09 2.01 0.19 0.05 0.02 0.03 0.00 97.61 0.09 87 Y E E 33.81 16.48 26.52 42.72 129.09 -168.35 -123.69 145.14 4.46 95.36 0.18 3.85 0.33 0.09 0.05 0.07 0.00 95.46 0.16 88 C E E 5.29 23.96 21.03 44.89 123.73 -158.92 -116.43 138.13 12.73 86.60 0.66 10.63 1.46 0.45 0.23 0.28 0.00 86.52 0.44 89 Q E E 39.49 13.92 24.12 38.14 127.92 -169.60 -123.44 142.35 16.49 82.55 0.96 14.13 1.87 0.61 0.40 0.42 0.00 81.59 0.98 90 Q E E 45.94 15.66 18.40 34.01 117.94 -145.74 -100.86 133.11 32.11 66.68 1.22 25.39 5.76 1.71 0.39 0.72 0.00 64.85 1.18 91 Y C E 92.09 10.45 16.08 27.47 112.34 -150.90 -99.70 117.78 55.29 43.07 1.64 39.61 11.96 4.56 0.41 1.30 0.00 39.73 2.43 92 V C S 79.15 7.10 13.07 21.39 113.80 158.77 -102.72 139.67 83.52 14.83 1.65 26.83 30.59 26.45 0.19 1.55 0.00 13.20 1.19 93 N C S 126.85 1.90 14.28 16.53 103.04 -39.99 -88.12 15.65 93.74 5.06 1.20 22.41 42.20 29.17 0.10 1.29 0.00 4.15 0.69 94 S C C 54.88 6.27 12.08 20.10 122.88 56.79 -114.63 141.19 90.53 8.90 0.57 43.83 42.97 4.17 0.09 0.57 0.00 6.95 1.42 95 P C C 81.18 6.85 14.33 22.36 109.25 -104.68 -69.94 139.93 88.13 10.69 1.18 46.64 27.05 14.15 0.13 1.22 0.00 10.11 0.70 96 R C C 103.30 11.70 14.74 26.77 119.28 -125.74 -101.94 134.86 60.38 38.21 1.40 41.70 11.68 6.96 0.19 1.30 0.00 36.99 1.17 97 T E E 61.87 10.66 18.28 29.44 124.08 -163.35 -116.64 138.48 31.15 67.98 0.87 26.54 3.51 1.14 0.32 0.59 0.00 64.04 3.86 98 F E E 64.60 16.67 15.70 31.75 118.85 -151.03 -106.68 136.86 29.52 69.53 0.96 22.75 5.39 2.18 0.41 0.68 0.00 62.87 5.71 99 G C C 25.72 12.00 17.17 29.30 123.30 -141.06 -81.43 -165.49 63.17 36.03 0.80 36.37 19.99 7.26 0.12 0.74 0.00 34.30 1.23 100 Q C C 122.57 4.86 20.33 25.69 105.69 -71.06 -85.38 42.04 71.16 27.81 1.03 42.28 21.81 6.78 0.14 0.99 0.00 26.93 1.07 101 G C C 23.80 15.51 14.16 28.86 124.61 -120.58 93.64 173.82 64.59 34.80 0.61 44.67 15.59 3.78 0.08 0.62 0.00 34.23 1.04 102 T E E 58.72 10.82 17.40 28.84 124.17 -99.47 -114.42 142.00 28.00 71.57 0.43 23.60 3.72 0.85 0.12 0.32 0.00 69.35 2.05 103 K E E 121.35 6.75 17.11 25.37 116.71 -132.39 -93.42 132.40 18.32 81.17 0.51 16.28 1.58 0.43 0.29 0.27 0.00 76.72 4.43 104 L C C 59.67 14.67 9.79 24.24 113.97 -149.63 -94.09 130.08 63.00 36.20 0.80 62.06 0.75 0.44 0.37 0.30 0.00 34.58 1.50 105 E C C 135.33 2.96 16.68 20.67 112.42 -146.55 -93.46 127.56 99.33 0.65 0.02 99.35 0.06 0.03 0.01 0.00 0.00 0.53 0.02