# 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 Q C C 114.38 4.65 19.11 24.78 117.01 -153.14 -96.00 135.80 99.33 0.66 0.01 99.42 0.07 0.01 0.00 0.00 0.00 0.48 0.02 1 L C C 63.27 16.25 11.52 27.16 117.34 -145.73 -95.67 131.30 51.46 48.39 0.15 51.37 0.43 0.13 0.06 0.05 0.00 46.50 1.45 2 V E E 73.65 7.14 17.08 25.55 121.40 -163.94 -113.68 134.85 24.65 75.05 0.30 22.32 1.70 0.35 0.15 0.17 0.00 72.67 2.66 3 Q E E 93.47 11.52 13.91 25.92 118.74 -147.27 -100.48 132.98 33.45 66.08 0.46 29.09 3.04 0.74 0.15 0.30 0.00 65.09 1.60 4 S C C 57.57 9.33 15.48 25.60 113.95 -165.05 -101.29 139.50 59.78 39.59 0.64 41.41 13.52 4.01 0.11 0.60 0.00 39.51 0.85 5 G C C 38.20 6.80 18.26 25.51 123.36 -91.35 108.60 -11.43 67.69 31.84 0.46 34.18 27.92 5.62 0.05 0.49 0.00 30.98 0.76 6 A C E 45.22 15.00 14.68 29.19 121.40 -64.25 -98.88 143.88 55.33 44.22 0.45 44.13 8.88 1.41 0.07 0.41 0.00 44.27 0.83 7 E E E 75.61 11.68 19.18 31.14 123.21 -161.79 -114.26 139.21 22.86 76.90 0.24 19.57 3.11 0.42 0.07 0.17 0.00 75.62 1.03 8 V E E 67.84 13.27 19.13 32.21 121.24 -152.11 -111.93 131.49 14.09 85.79 0.11 12.68 1.32 0.14 0.05 0.06 0.00 84.82 0.93 9 K E E 55.12 14.78 16.66 31.63 131.05 -176.45 -129.08 149.32 21.11 78.81 0.08 19.93 1.04 0.08 0.05 0.04 0.00 74.20 4.67 10 K C C 110.84 4.96 22.02 27.19 118.85 -113.68 -79.48 149.69 94.59 5.37 0.04 92.99 1.59 0.12 0.01 0.03 0.00 4.67 0.59 11 P C T 63.18 13.22 13.57 27.10 110.20 -84.17 -59.13 138.34 99.41 0.39 0.20 0.37 2.66 96.51 0.01 0.14 0.00 0.26 0.05 12 G C T 49.56 3.58 19.07 23.43 95.75 22.95 87.34 -5.83 99.59 0.28 0.13 0.50 2.89 96.27 0.00 0.10 0.00 0.22 0.02 13 S C C 42.29 8.83 16.28 26.40 124.28 119.61 -86.74 161.07 89.51 10.40 0.08 75.00 14.37 0.31 0.01 0.09 0.00 9.28 0.94 14 S C C 58.35 9.70 18.55 29.21 129.11 -130.03 -120.05 149.15 50.54 49.44 0.02 49.45 0.98 0.05 0.00 0.01 0.00 48.72 0.80 15 V E E 16.71 21.04 15.45 36.44 127.27 -163.92 -127.80 139.72 3.00 97.00 0.00 2.87 0.08 0.00 0.00 0.00 0.00 96.97 0.08 16 K E E 111.38 6.76 24.25 31.86 117.05 -143.51 -99.82 129.35 0.71 99.29 0.00 0.67 0.02 0.00 0.00 0.00 0.00 99.30 0.01 17 V E E 6.11 25.21 15.54 41.20 123.76 -170.22 -119.80 135.15 1.35 98.65 0.00 1.27 0.04 0.00 0.00 0.00 0.00 98.65 0.04 18 S E E 42.03 9.09 25.98 35.55 128.08 -166.13 -121.94 145.65 8.45 91.53 0.02 7.61 0.40 0.03 0.00 0.01 0.00 91.85 0.09 19 C E E 8.01 24.33 15.79 40.09 133.80 -171.50 -138.95 149.31 16.26 83.68 0.06 14.51 1.10 0.09 0.02 0.03 0.00 83.97 0.27 20 K E E 107.92 5.96 26.05 32.87 121.77 -153.82 -115.74 137.00 12.87 87.01 0.12 11.52 1.26 0.19 0.04 0.07 0.00 85.35 1.55 21 A E E 11.97 23.34 12.88 35.64 123.31 -164.84 -112.06 140.25 35.22 64.54 0.25 32.77 1.94 0.30 0.09 0.17 0.00 61.73 3.00 22 S C C 60.41 6.05 20.17 26.87 124.60 -155.10 -112.98 150.50 67.97 31.47 0.56 53.27 11.33 2.75 0.12 0.57 0.00 29.79 2.17 23 G C S 51.20 3.13 18.39 21.91 111.40 13.33 88.84 -121.55 86.41 9.98 3.61 19.25 44.35 23.43 0.38 3.21 0.00 7.68 1.68 24 D C S 85.63 7.74 16.14 24.64 114.63 24.12 -92.81 141.58 89.47 5.46 5.07 22.36 41.33 26.28 0.57 4.52 0.00 3.60 1.36 25 T C C 61.30 10.00 18.55 28.88 115.59 -124.99 -100.29 133.07 86.04 7.92 6.04 45.49 23.30 17.35 0.98 5.44 0.00 4.74 2.70 26 F C C 38.50 20.92 13.26 32.86 104.01 -151.25 -86.94 13.74 80.07 9.32 10.61 53.45 14.10 11.97 1.83 9.59 0.00 5.70 3.36 27 S C T 72.43 5.50 20.06 26.26 95.68 100.61 -79.38 -18.40 82.13 8.02 9.86 22.91 27.11 33.15 1.08 8.63 0.01 5.49 1.63 28 S C T 62.82 6.10 20.65 27.15 101.22 46.30 -100.23 3.95 75.35 15.56 9.10 22.69 23.04 30.94 0.84 8.19 0.01 12.99 1.31 29 Y C C 27.19 21.37 14.69 35.50 127.38 89.38 -113.39 150.75 56.59 42.77 0.64 43.90 11.24 1.11 0.11 0.56 0.00 42.01 1.06 30 T E E 36.98 11.23 26.30 38.14 124.42 -148.38 -115.97 142.48 14.58 85.39 0.03 13.69 0.68 0.06 0.01 0.02 0.00 85.10 0.43 31 F E E 4.33 26.50 19.39 46.56 123.15 -159.39 -116.79 134.72 1.55 98.45 0.00 1.46 0.05 0.00 0.00 0.00 0.00 98.46 0.03 32 S E E 18.05 14.74 27.81 42.83 130.92 -175.05 -129.04 148.32 0.49 99.51 0.00 0.44 0.02 0.00 0.00 0.00 0.00 99.54 0.00 33 W E E 8.22 24.75 21.54 46.34 125.28 -155.19 -117.46 139.09 0.37 99.63 0.00 0.33 0.01 0.00 0.00 0.00 0.00 99.66 0.00 34 V E E 16.32 16.73 24.72 41.59 130.13 -172.20 -129.00 143.77 0.22 99.78 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.80 0.00 35 R E E 45.53 17.50 21.41 38.31 122.24 -157.15 -112.88 134.31 0.31 99.69 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.72 0.00 36 Q E E 58.77 12.43 18.79 31.82 117.31 -151.56 -106.32 127.84 3.62 96.37 0.01 3.23 0.18 0.01 0.00 0.00 0.00 96.42 0.16 37 A C C 28.10 10.96 14.16 26.76 117.77 -134.97 -79.54 151.30 84.75 15.10 0.16 82.40 1.40 0.30 0.02 0.11 0.00 15.23 0.54 38 P C T 94.41 5.29 12.90 19.94 109.57 -84.98 -58.97 135.47 94.94 0.26 4.79 0.43 3.48 90.60 0.07 5.21 0.00 0.15 0.07 39 G C T 69.42 0.29 13.30 10.96 95.73 15.69 82.39 -2.87 94.95 0.13 4.92 0.49 3.22 90.81 0.09 5.28 0.00 0.07 0.04 40 Q C S 108.95 4.54 11.59 17.74 107.72 81.31 -106.21 -3.17 87.68 4.42 7.90 18.59 41.61 26.44 0.43 9.08 0.01 2.79 1.06 41 G C C 34.16 4.01 16.66 21.73 126.74 -121.58 90.73 -168.79 81.82 17.96 0.22 65.25 14.73 1.44 0.04 0.24 0.00 17.10 1.20 42 L E E 64.86 14.82 13.22 28.00 116.73 -28.24 -76.81 137.84 32.54 67.42 0.04 29.54 1.45 0.09 0.00 0.03 0.00 68.63 0.26 43 E E E 76.28 9.82 20.75 31.24 126.73 -169.08 -125.07 141.12 1.57 98.42 0.01 1.31 0.11 0.01 0.00 0.00 0.00 98.53 0.04 44 W E E 93.06 15.54 19.28 34.48 111.48 -113.14 -72.88 128.71 0.43 99.56 0.00 0.37 0.02 0.00 0.00 0.00 0.00 99.60 0.01 45 M E E 18.45 19.40 21.05 40.75 101.23 176.45 -100.89 -23.32 4.15 95.78 0.06 2.78 0.96 0.26 0.01 0.03 0.00 95.92 0.04 46 G E E 3.25 18.35 22.88 41.68 145.63 -49.04 164.70 176.28 5.32 94.59 0.08 3.23 1.35 0.39 0.01 0.05 0.00 94.90 0.07 47 R E E 57.63 15.23 25.36 40.38 136.64 -111.81 -147.99 154.72 6.49 93.36 0.15 5.46 0.71 0.13 0.05 0.06 0.00 93.40 0.19 48 S E E 9.76 21.78 19.87 41.55 119.82 -131.64 -107.69 131.40 9.20 90.58 0.22 7.68 1.41 0.22 0.11 0.09 0.00 89.38 1.09 49 I E E 37.59 12.30 21.96 35.31 118.24 -163.91 -114.72 126.46 32.38 67.03 0.59 26.48 4.65 0.92 0.19 0.37 0.00 66.50 0.89 50 P C E 43.58 13.01 17.40 31.00 112.55 -125.28 -72.39 139.63 51.80 43.10 5.11 28.66 12.51 10.41 1.14 3.53 0.01 42.85 0.89 51 I C E 76.85 11.53 15.73 27.41 105.39 -152.34 -92.83 -5.49 53.67 38.07 8.26 16.75 15.82 24.52 2.09 5.69 0.13 32.07 2.95 52 V C T 92.85 5.30 14.87 21.20 106.88 40.83 -97.66 57.02 75.71 15.98 8.31 15.77 17.46 43.38 1.52 6.42 0.03 13.59 1.84 53 G C T 48.58 3.97 14.69 19.83 108.91 -45.79 89.42 -20.06 85.05 10.90 4.06 20.81 27.44 37.20 0.69 3.12 0.01 9.64 1.09 54 K C C 129.60 3.71 16.50 21.33 119.41 63.00 -103.89 136.24 57.97 38.43 3.60 37.45 14.17 7.30 1.39 2.15 0.01 35.09 2.44 55 A E E 45.86 14.87 12.69 27.27 117.47 -132.63 -89.69 136.58 42.58 52.92 4.50 33.90 5.79 2.73 2.50 1.99 0.01 50.98 2.09 56 I E E 64.10 11.01 17.95 29.80 121.20 -165.88 -116.21 132.64 28.03 65.76 6.22 20.80 5.42 2.97 3.98 2.47 0.01 62.18 2.17 57 Y E E 97.27 12.88 18.07 30.85 122.97 -156.07 -109.50 139.06 24.77 64.98 10.25 18.36 4.66 3.16 7.11 3.62 0.04 59.66 3.38 58 A C C 22.43 17.42 13.83 31.23 117.79 -148.86 -99.62 137.69 44.53 33.17 22.31 36.28 4.90 3.84 9.05 11.11 0.01 33.46 1.35 59 Q C C 106.76 6.55 18.88 26.32 110.72 -151.68 -95.55 110.48 46.59 26.99 26.42 28.12 11.29 9.40 8.12 16.24 0.05 25.20 1.57 60 E C C 106.33 6.47 18.87 26.15 119.01 26.15 -106.69 134.97 45.47 29.54 24.99 28.63 9.33 9.64 6.88 16.15 0.06 27.46 1.85 61 F C C 53.08 18.53 10.98 28.66 116.31 -158.07 -102.30 123.27 53.41 34.14 12.45 38.51 9.02 6.37 5.79 6.79 0.06 28.40 5.06 62 Q C T 120.25 4.06 18.02 23.32 111.18 -166.47 -113.43 106.42 67.59 26.62 5.79 17.79 14.50 37.40 2.46 3.18 0.10 20.47 4.10 63 G C T 44.21 4.63 17.57 23.04 114.61 -15.14 83.87 -139.00 88.55 9.25 2.20 6.71 27.16 54.95 0.31 1.70 0.00 8.46 0.72 64 R C T 120.51 8.90 18.12 27.31 108.50 -1.39 -97.52 52.13 72.75 25.85 1.39 19.54 25.83 27.62 0.17 1.14 0.00 24.89 0.82 65 V E E 19.30 21.62 13.04 34.19 123.87 72.26 -117.37 134.23 13.58 86.35 0.07 11.51 1.64 0.18 0.02 0.04 0.00 85.87 0.73 66 T E E 65.63 6.65 24.98 32.28 122.16 -164.61 -117.63 133.07 3.57 96.40 0.03 3.19 0.21 0.02 0.01 0.01 0.00 96.43 0.13 67 I E E 18.57 23.73 14.88 38.34 121.52 -168.04 -117.28 130.86 3.31 96.64 0.05 2.93 0.20 0.04 0.02 0.02 0.00 96.65 0.15 68 S E E 54.05 5.88 26.08 32.47 126.30 -173.17 -123.83 141.87 12.66 87.13 0.21 10.76 1.67 0.35 0.06 0.11 0.00 86.51 0.54 69 A C E 22.27 22.16 12.39 33.40 128.35 -169.05 -121.82 146.86 53.80 45.72 0.48 43.35 9.24 1.04 0.12 0.37 0.00 44.54 1.35 70 D C C 70.11 5.66 20.34 26.35 118.85 -152.74 -101.40 142.15 88.11 11.49 0.40 80.38 5.97 1.42 0.10 0.34 0.00 10.01 1.77 71 R C T 148.84 7.91 14.59 23.89 92.93 -126.74 -64.88 -22.20 97.54 1.14 1.31 3.89 16.62 76.95 0.14 1.29 0.00 0.85 0.26 72 S C T 80.68 2.42 18.49 20.83 94.55 54.10 -87.06 -8.53 98.13 0.72 1.16 3.93 16.94 77.10 0.11 1.22 0.00 0.52 0.17 73 T C C 36.48 14.17 13.68 28.41 124.46 74.05 -109.27 142.68 93.21 5.97 0.83 52.61 36.63 4.06 0.15 0.80 0.00 3.15 2.61 74 T C S 64.13 11.68 19.33 31.31 99.83 -168.91 -98.84 -3.78 96.70 3.16 0.14 15.40 78.60 2.77 0.01 0.12 0.00 2.77 0.32 75 T C E 43.73 11.21 22.71 34.80 126.21 74.89 -115.71 140.66 60.66 39.19 0.14 33.12 27.69 1.28 0.02 0.15 0.00 36.01 1.73 76 V E E 5.15 24.59 18.03 43.06 125.17 -167.03 -122.31 136.97 30.01 69.96 0.03 29.01 0.87 0.06 0.00 0.02 0.00 69.47 0.57 77 Y E E 57.80 12.69 26.51 39.53 123.76 -160.32 -118.20 135.03 3.91 96.08 0.01 3.61 0.16 0.01 0.00 0.00 0.00 96.08 0.13 78 M E E 4.60 25.46 19.42 45.40 122.23 -166.76 -117.54 132.03 0.54 99.46 0.00 0.52 0.01 0.00 0.00 0.00 0.00 99.46 0.01 79 E E E 71.23 10.00 27.10 37.60 117.37 -157.57 -106.43 126.10 0.32 99.68 0.00 0.33 0.00 0.00 0.00 0.00 0.00 99.65 0.02 80 L E E 7.28 24.66 15.85 41.06 117.02 -166.14 -111.60 125.99 13.75 86.24 0.01 14.08 0.11 0.01 0.00 0.01 0.00 85.07 0.72 81 S C S 50.44 6.97 22.98 30.18 123.92 -170.47 -103.96 158.32 89.98 9.84 0.17 38.49 42.71 7.71 0.01 0.24 0.00 10.57 0.27 82 S C S 64.41 4.85 24.13 29.14 97.53 11.00 57.65 56.89 97.33 2.58 0.09 10.22 79.79 7.05 0.00 0.11 0.00 2.66 0.16 83 L C C 17.05 24.23 11.03 34.89 113.47 -151.03 -75.98 131.89 97.46 2.52 0.01 96.64 1.19 0.02 0.00 0.01 0.00 1.16 0.97 84 R C C 99.99 4.89 24.15 29.06 132.47 -172.64 -128.00 162.62 97.39 2.56 0.05 96.77 0.65 0.02 0.01 0.02 0.00 0.55 1.98 85 S H G 59.33 12.32 15.85 28.31 91.01 -99.94 -60.20 -31.33 5.55 0.05 94.39 0.38 0.44 3.57 0.43 95.13 0.00 0.04 0.00 86 D H G 99.03 3.84 21.68 26.15 90.43 62.89 -73.64 -13.68 4.61 0.07 95.32 0.28 0.36 3.07 0.45 95.78 0.00 0.05 0.00 87 D H G 12.30 21.72 16.02 37.97 94.53 65.66 -86.52 0.97 6.32 0.11 93.57 1.71 0.87 2.09 0.66 94.58 0.00 0.08 0.01 88 T C C 36.98 16.34 21.51 37.66 114.42 110.72 -78.92 133.11 90.04 9.30 0.66 86.07 4.05 0.40 0.13 0.48 0.00 8.08 0.80 89 A E E 12.00 18.58 23.42 41.40 143.87 152.36 -158.17 168.14 10.67 89.20 0.13 9.79 0.99 0.14 0.06 0.07 0.00 87.97 0.99 90 V E E 28.94 16.77 25.72 42.15 119.32 -105.74 -104.09 132.52 2.47 97.50 0.04 2.36 0.13 0.02 0.01 0.01 0.00 97.37 0.09 91 Y E E 8.73 24.58 22.22 46.54 123.40 -162.93 -113.28 136.39 1.77 98.15 0.08 1.60 0.14 0.04 0.02 0.03 0.00 98.10 0.06 92 Y E E 29.25 19.09 27.32 45.38 128.30 -170.75 -124.58 144.54 2.93 96.85 0.21 2.54 0.28 0.08 0.06 0.08 0.00 96.86 0.10 93 C E E 5.58 23.85 23.63 46.98 125.76 -164.70 -121.03 140.50 10.25 89.05 0.70 8.52 1.19 0.35 0.24 0.26 0.00 89.16 0.28 94 A E E 9.99 19.01 23.92 42.63 128.14 -166.25 -123.23 144.80 13.84 84.79 1.36 11.59 1.82 0.71 0.53 0.56 0.00 84.14 0.66 95 R E E 56.60 16.15 20.86 36.61 123.76 -157.69 -114.13 139.54 19.32 78.80 1.89 15.66 3.37 1.42 0.89 0.95 0.00 75.32 2.39 96 D E E 45.12 12.16 16.74 29.72 117.75 -140.75 -99.67 137.70 41.43 56.73 1.84 31.82 7.91 2.87 0.51 1.26 0.00 54.08 1.53 97 Q C C 105.76 7.09 14.72 22.94 103.88 -147.93 -88.27 39.41 67.59 29.03 3.38 31.82 21.64 15.69 0.47 2.84 0.01 25.93 1.59 98 S C T 73.38 4.14 12.45 17.95 104.92 108.60 -93.57 21.56 83.32 12.22 4.45 21.88 26.87 35.34 0.53 3.99 0.01 9.71 1.68 99 G C T 55.18 2.33 12.73 15.99 106.09 -52.55 78.60 -14.20 93.19 2.31 4.50 18.66 32.44 42.05 0.46 4.28 0.00 1.47 0.65 100 F C S 140.83 3.92 11.10 16.51 104.49 49.10 -89.79 14.00 89.52 5.45 5.03 23.04 36.62 30.46 0.70 4.27 0.00 3.59 1.31 101 D C C 93.84 4.51 13.26 19.16 111.96 67.49 -95.34 113.22 74.83 20.40 4.77 32.02 27.86 16.58 0.92 3.79 0.02 16.26 2.56 102 F C C 99.26 10.19 12.78 23.71 113.08 -156.42 -94.48 119.04 59.43 34.12 6.45 36.60 14.41 10.65 1.50 4.90 0.02 28.79 3.12 103 F C E 86.75 10.97 15.87 27.48 116.04 146.62 -105.78 132.77 47.18 47.06 5.76 30.14 11.73 8.09 1.50 4.30 0.03 40.97 3.24 104 Y E E 82.12 12.50 18.22 30.97 119.80 -150.83 -105.24 136.52 43.34 51.91 4.75 28.44 10.28 7.22 1.21 3.51 0.02 46.47 2.85 105 Y E E 57.82 18.26 16.42 33.89 126.03 -156.84 -115.48 141.27 42.46 55.41 2.13 32.92 7.66 3.00 0.76 1.37 0.01 51.63 2.64 106 D E E 51.45 12.12 20.54 32.96 120.61 -152.75 -107.38 135.77 38.07 60.73 1.19 30.01 6.52 2.16 0.35 0.77 0.00 58.85 1.35 107 H E E 84.90 13.34 18.59 31.66 116.26 -134.02 -95.91 129.17 30.88 67.76 1.36 24.58 4.82 2.12 0.60 0.87 0.00 62.43 4.58 108 W C E 74.74 15.34 15.95 31.07 115.08 -172.44 -102.72 123.69 49.05 48.87 2.08 35.14 9.47 5.88 0.70 1.56 0.01 43.03 4.21 109 G C T 32.55 9.54 17.75 27.54 125.04 -43.27 91.34 -167.28 71.05 26.20 2.76 18.92 26.09 27.81 0.36 2.37 0.02 22.26 2.17 110 Q C T 109.65 6.62 17.94 25.27 100.96 -17.06 -79.24 14.54 89.33 7.11 3.56 8.17 29.30 52.24 0.38 3.14 0.00 5.48 1.28 111 G C T 33.99 9.89 17.52 27.71 100.08 -67.66 87.40 1.41 88.98 9.28 1.75 12.15 37.50 39.30 0.11 1.76 0.00 8.41 0.76 112 T E E 32.46 15.14 16.42 32.01 119.23 125.19 -95.71 137.72 49.81 49.95 0.24 40.58 6.69 1.19 0.04 0.21 0.00 50.29 0.99 113 L E E 66.59 11.99 20.74 32.88 119.48 -149.47 -106.77 131.31 9.25 90.68 0.07 8.21 0.82 0.12 0.03 0.03 0.00 89.92 0.87 114 V E E 20.66 19.94 16.86 36.75 121.55 -162.34 -114.50 131.08 5.59 94.37 0.04 5.40 0.22 0.04 0.02 0.01 0.00 93.65 0.66 115 A E E 44.71 9.17 21.91 31.66 118.81 -153.61 -103.86 131.21 15.36 84.59 0.06 15.13 0.29 0.05 0.03 0.02 0.00 83.14 1.34 116 V C C 24.08 20.60 15.93 35.99 115.78 -157.29 -102.54 124.90 98.37 1.62 0.00 98.47 0.07 0.01 0.00 0.00 0.00 1.43 0.02