# 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 M C C 87.78 10.47 13.07 24.10 116.15 -153.14 -92.36 134.94 99.87 0.06 0.07 99.81 0.07 0.04 0.05 0.00 0.00 0.02 0.01 1 D C C 87.91 5.69 12.90 19.98 109.86 -133.51 -81.67 130.58 67.03 1.52 31.44 59.31 1.13 5.87 30.60 1.75 0.00 0.75 0.61 2 S C H 71.05 4.48 12.45 18.20 98.50 -128.02 -71.23 -28.32 52.30 1.63 46.07 34.21 7.56 9.92 44.22 2.67 0.01 0.82 0.58 3 Q H H 108.32 3.33 15.79 19.72 94.68 59.97 -69.15 -32.00 27.68 1.10 71.22 19.96 3.84 4.77 68.27 2.23 0.00 0.61 0.31 4 L H H 26.44 17.55 13.25 30.54 93.10 56.00 -65.87 -39.78 7.89 0.41 91.70 5.45 1.21 2.02 89.34 1.64 0.00 0.28 0.07 5 S H H 38.40 11.76 16.51 28.88 92.31 53.52 -63.77 -41.11 3.35 0.27 96.38 2.09 0.46 1.10 94.77 1.32 0.00 0.22 0.03 6 E H H 111.02 1.97 21.40 21.86 91.86 50.62 -64.79 -40.65 1.86 0.15 98.00 0.88 0.24 0.79 96.75 1.18 0.00 0.13 0.01 7 N H H 52.35 10.13 19.04 29.98 92.29 50.13 -65.83 -40.18 2.19 0.12 97.68 0.77 0.25 1.15 96.39 1.31 0.00 0.12 0.02 8 L H H 12.19 22.90 14.76 37.31 91.87 51.65 -64.66 -40.59 2.65 0.09 97.26 0.72 0.26 1.55 95.72 1.64 0.01 0.09 0.02 9 L H H 82.04 7.68 20.20 28.53 91.21 53.94 -64.75 -34.49 5.72 0.10 94.17 1.02 0.45 3.95 91.53 2.92 0.01 0.09 0.02 10 K H H 127.49 2.92 22.10 24.77 91.67 57.40 -69.05 -25.31 20.86 0.16 78.99 1.24 0.99 18.57 75.86 3.13 0.04 0.10 0.06 11 C H H 14.37 19.06 14.07 33.28 96.02 50.70 -88.82 -12.22 38.92 0.44 60.63 3.60 2.46 31.78 58.24 3.43 0.07 0.24 0.19 12 V C T 50.55 15.89 14.70 30.24 110.07 105.99 -69.75 127.45 73.09 1.89 25.02 5.35 4.80 60.23 25.14 2.59 0.08 0.98 0.85 13 N C T 127.26 1.91 20.38 21.88 93.98 15.26 69.31 15.39 89.34 0.82 9.84 6.90 7.42 74.44 8.58 1.87 0.01 0.52 0.26 14 E C C 72.17 10.85 14.42 26.31 124.59 115.56 -100.53 150.00 90.59 6.92 2.49 58.50 27.52 4.71 1.47 1.05 0.00 5.72 1.03 15 T C C 82.59 6.07 20.20 27.27 117.34 -127.61 -96.40 133.37 61.12 37.83 1.04 50.95 6.79 2.40 0.43 0.64 0.00 35.97 2.81 16 Y E E 34.73 21.01 12.81 33.10 126.06 -168.97 -120.57 142.41 35.83 63.66 0.50 30.86 3.33 0.83 0.23 0.34 0.00 59.64 4.78 17 R E E 129.66 6.03 22.51 29.41 121.59 -159.64 -113.52 138.68 35.62 63.86 0.53 20.92 12.01 4.68 0.11 0.46 0.00 60.56 1.26 18 G E E 25.42 10.47 21.23 31.88 119.22 15.95 104.90 -165.88 44.09 55.70 0.21 8.99 27.68 6.23 0.01 0.21 0.00 56.52 0.35 19 A E E 18.60 17.11 19.26 36.19 127.44 -68.41 -116.67 154.32 23.44 76.44 0.12 17.28 4.63 0.75 0.01 0.11 0.00 77.02 0.19 20 M E E 47.53 15.12 22.94 37.75 123.50 -147.90 -119.23 135.03 1.76 98.24 0.00 1.63 0.06 0.00 0.00 0.00 0.00 98.26 0.04 21 L E E 18.02 19.53 19.73 39.00 124.20 -163.75 -113.42 137.58 0.19 99.81 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.00 22 V E E 48.22 12.69 19.49 32.74 123.64 -158.93 -117.85 133.94 0.31 99.69 0.00 0.27 0.01 0.00 0.00 0.00 0.00 99.72 0.01 23 R E E 79.41 12.30 14.05 27.12 121.12 175.19 -134.52 121.68 3.52 96.46 0.02 2.12 0.78 0.21 0.00 0.02 0.00 96.75 0.13 24 N C T 126.81 2.18 15.57 18.70 92.72 -13.44 53.53 42.66 99.78 0.15 0.07 0.18 3.06 96.58 0.00 0.07 0.00 0.09 0.01 25 G C T 53.29 3.42 15.69 20.17 94.69 -52.86 81.70 1.72 99.89 0.06 0.05 0.18 3.00 96.72 0.00 0.05 0.00 0.03 0.00 26 L E E 65.92 9.56 16.14 27.12 120.09 115.29 -104.72 133.24 3.52 96.48 0.01 2.19 1.08 0.05 0.00 0.00 0.00 96.42 0.26 27 P E E 49.40 13.15 18.00 31.61 113.02 -114.86 -68.90 138.23 1.11 98.89 0.00 0.96 0.03 0.00 0.00 0.00 0.00 98.99 0.01 28 I E E 33.33 17.50 19.31 36.44 125.38 -172.32 -123.53 140.75 1.20 98.80 0.00 1.03 0.05 0.00 0.00 0.00 0.00 98.89 0.02 29 A E E 28.11 16.09 21.97 37.52 126.39 -144.34 -118.55 140.84 1.81 98.18 0.01 1.53 0.11 0.01 0.00 0.00 0.00 98.31 0.04 30 T E E 31.03 16.91 19.72 36.31 131.53 -171.33 -131.30 146.49 3.44 96.54 0.02 3.00 0.22 0.03 0.01 0.01 0.00 96.59 0.15 31 A E E 46.89 12.64 19.37 31.87 126.15 -157.25 -115.97 143.56 20.39 79.28 0.33 14.67 5.15 1.10 0.06 0.23 0.00 78.27 0.52 32 G C E 29.51 5.74 21.14 27.91 136.37 51.82 133.73 -171.59 51.41 47.91 0.68 16.43 29.62 5.62 0.06 0.58 0.00 46.97 0.72 33 D C C 101.12 3.71 21.18 25.57 116.77 -49.27 -90.05 134.92 60.52 37.92 1.56 42.18 14.68 4.08 0.30 1.40 0.01 34.98 2.38 34 V C C 23.39 22.19 9.63 30.69 117.73 -145.83 -100.71 132.47 70.18 28.38 1.44 56.29 11.28 1.64 0.73 0.91 0.01 20.93 8.21 35 N C C 69.92 4.91 18.69 24.07 122.07 -149.35 -90.83 161.51 95.89 3.16 0.94 88.87 6.23 1.11 0.43 0.45 0.00 2.06 0.84 36 A C T 80.59 3.87 14.13 19.67 91.52 -103.28 -59.88 -32.63 51.06 0.57 48.37 4.94 6.92 37.88 15.60 33.96 0.04 0.33 0.32 37 E C T 125.52 3.26 16.14 20.10 92.17 59.82 -70.05 -22.58 50.42 0.80 48.78 4.68 6.09 38.38 14.99 34.92 0.05 0.51 0.37 38 E H G 37.17 18.23 11.47 28.93 96.74 58.71 -86.18 -3.40 37.36 4.79 57.86 16.08 8.09 15.14 15.57 40.49 0.03 3.65 0.94 39 Q C C 93.51 10.14 17.27 27.79 95.71 95.13 -66.65 -25.28 55.50 10.61 33.88 22.81 11.77 22.66 16.40 16.10 0.16 8.36 1.75 40 R C E 131.20 5.92 21.69 27.82 99.86 53.11 -92.97 14.31 45.72 30.47 23.81 18.62 9.58 19.90 8.75 13.07 0.21 28.35 1.52 41 V E E 22.43 20.67 16.39 36.47 115.89 115.03 -96.93 126.73 19.77 75.20 5.02 15.49 3.25 1.76 3.28 1.69 0.00 73.30 1.22 42 I E E 49.01 13.41 23.27 36.57 119.63 -166.87 -111.23 126.65 7.69 90.45 1.87 6.40 0.75 0.39 1.52 0.40 0.00 89.89 0.65 43 C E E 18.44 20.37 17.90 37.76 121.10 -164.60 -110.07 135.50 9.37 89.13 1.50 7.76 0.86 0.44 0.92 0.38 0.00 89.24 0.41 44 E E E 78.16 9.37 21.87 31.56 119.57 -162.64 -107.97 129.57 18.43 79.95 1.62 15.33 1.93 0.83 0.83 0.58 0.00 79.86 0.64 45 W E E 77.03 15.76 13.29 28.80 115.51 -148.28 -97.96 128.68 43.38 54.97 1.66 34.10 6.52 2.57 0.66 0.90 0.01 53.94 1.30 46 N C C 88.05 5.84 15.10 22.02 111.39 -167.29 -104.64 100.21 77.55 20.82 1.64 47.20 21.25 9.23 0.37 1.31 0.00 19.11 1.52 47 S C S 82.19 3.61 13.27 18.04 100.83 -90.44 -67.76 3.43 92.91 5.19 1.89 19.28 43.32 30.47 0.20 1.79 0.00 4.11 0.84 48 N C S 119.85 2.60 13.70 17.34 102.54 25.77 -91.67 11.86 95.21 3.41 1.38 20.34 46.50 28.41 0.13 1.45 0.00 2.52 0.66 49 A C S 57.10 7.31 13.23 21.90 117.34 89.77 -102.06 136.88 87.57 11.56 0.86 32.84 50.07 5.09 0.14 0.80 0.00 9.15 1.91 50 V C C 68.87 10.36 15.34 26.36 113.44 -119.02 -85.17 131.72 79.98 19.09 0.93 57.01 16.68 5.46 0.15 0.90 0.00 18.59 1.23 51 S C E 37.33 13.54 17.04 30.83 119.48 -164.46 -109.67 136.85 51.23 48.10 0.68 36.16 12.05 2.77 0.09 0.63 0.00 47.56 0.74 52 E E E 49.74 14.83 20.29 35.08 125.99 -159.70 -119.55 141.92 14.35 85.40 0.25 11.26 2.37 0.48 0.05 0.17 0.00 85.44 0.24 53 V E E 29.19 16.06 21.65 37.82 121.66 -154.22 -113.11 132.60 1.98 97.99 0.04 1.73 0.12 0.03 0.01 0.01 0.00 98.04 0.06 54 L E E 13.79 20.19 21.06 41.33 120.24 -162.10 -112.95 129.53 0.68 99.30 0.02 0.61 0.03 0.01 0.00 0.01 0.00 99.32 0.03 55 H E E 50.67 11.98 22.99 35.69 117.97 -158.17 -108.14 126.31 1.86 98.08 0.06 1.64 0.12 0.04 0.02 0.02 0.00 98.06 0.09 56 L E E 17.60 18.04 14.85 33.80 111.80 -148.45 -96.35 119.32 25.26 74.30 0.44 21.87 2.00 0.59 0.11 0.27 0.00 74.65 0.51 57 H C T 97.82 8.10 16.16 25.31 99.33 -139.74 -67.51 -31.54 84.47 10.43 5.10 12.62 13.13 57.89 0.36 5.05 0.00 10.26 0.68 58 D C T 118.26 1.79 16.43 18.15 95.82 37.28 -72.95 -7.39 92.72 2.01 5.28 5.56 12.24 74.52 0.34 5.33 0.00 1.61 0.41 59 S C T 51.44 8.01 13.54 22.65 103.79 42.90 -105.42 -1.60 93.45 1.87 4.67 8.12 16.76 67.95 0.32 5.00 0.00 1.44 0.40 60 N C T 105.55 5.48 16.89 23.74 95.42 -125.70 60.67 25.93 93.78 5.30 0.92 26.52 23.98 43.16 0.09 0.95 0.00 4.91 0.39 61 T E E 35.87 12.55 16.76 30.50 120.50 133.09 -96.71 144.20 44.77 55.07 0.16 36.57 5.41 0.87 0.02 0.16 0.00 56.42 0.56 62 K E E 53.18 15.37 21.87 37.01 120.23 -139.50 -105.19 135.13 5.30 94.69 0.01 4.76 0.38 0.05 0.00 0.01 0.00 94.64 0.17 63 I E E 6.62 23.39 22.42 45.69 122.61 -162.66 -116.98 132.82 0.53 99.47 0.00 0.49 0.02 0.00 0.00 0.00 0.00 99.47 0.01 64 L E E 10.05 20.98 26.45 46.92 118.43 -155.61 -106.90 129.16 0.11 99.89 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.89 0.00 65 I E E 7.50 22.83 24.82 47.10 119.51 -163.78 -112.87 126.94 0.24 99.75 0.00 0.22 0.01 0.00 0.00 0.00 0.00 99.77 0.01 66 A E E 10.91 18.16 21.47 39.66 127.37 -171.62 -118.77 144.82 3.31 96.67 0.02 2.72 0.33 0.05 0.00 0.01 0.00 96.82 0.07 67 T E E 38.80 12.50 18.80 31.87 120.58 -154.92 -103.89 149.94 26.38 73.41 0.21 19.90 5.05 1.05 0.03 0.19 0.00 73.34 0.44 68 K C T 118.63 7.26 16.96 24.83 102.16 -100.17 -72.70 -29.37 77.74 20.12 2.13 9.70 27.00 41.89 0.16 1.96 0.00 18.31 0.97 69 E C T 137.25 2.93 17.56 20.69 100.27 33.54 -85.71 -2.97 96.44 1.59 1.97 7.77 29.16 59.47 0.14 1.92 0.00 1.26 0.27 70 S C T 47.93 9.66 17.35 27.48 114.34 1.78 -127.91 116.60 86.73 11.80 1.47 13.61 27.76 45.15 0.09 1.51 0.00 11.31 0.56 71 C E E 32.18 14.85 18.16 33.25 121.14 -126.62 -110.75 138.57 27.14 72.62 0.24 20.64 3.98 1.55 0.04 0.20 0.00 73.01 0.58 72 V E E 26.94 17.88 20.93 38.56 119.20 -157.49 -109.59 128.81 3.05 96.93 0.02 2.61 0.34 0.07 0.00 0.02 0.00 96.80 0.16 73 L E E 29.15 18.51 23.18 40.81 115.46 -162.16 -105.41 126.42 2.33 97.64 0.03 1.85 0.34 0.08 0.00 0.02 0.00 97.65 0.05 74 G E E 6.79 18.68 24.19 42.08 143.06 -43.49 -140.28 169.23 2.84 97.12 0.03 2.21 0.41 0.08 0.00 0.02 0.00 97.23 0.04 75 L E E 26.65 18.94 23.44 41.60 125.67 -106.70 -117.38 139.48 3.57 96.39 0.04 3.08 0.29 0.05 0.01 0.02 0.00 96.44 0.12 76 I E E 29.31 17.74 20.42 38.05 121.08 -158.44 -110.84 131.40 7.45 92.39 0.16 6.20 1.02 0.28 0.05 0.09 0.00 92.03 0.33 77 Y E E 67.19 13.39 18.25 32.13 121.25 -161.39 -109.69 135.16 19.35 80.21 0.44 15.10 3.90 1.14 0.12 0.31 0.00 78.25 1.17 78 R C E 118.39 8.92 15.39 25.17 111.70 -146.58 -94.42 120.21 56.71 42.84 0.45 39.57 14.55 2.75 0.09 0.43 0.00 41.02 1.60 79 N C C 90.67 6.55 11.86 19.81 114.12 -146.28 -97.82 122.98 91.67 8.23 0.09 86.71 3.63 0.94 0.02 0.08 0.00 7.96 0.65 80 T C C 92.58 4.34 13.37 19.22 106.04 -129.69 -78.21 92.30 99.90 0.10 0.01 99.75 0.14 0.05 0.00 0.00 0.00 0.05 0.01