# 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 101.42 3.83 20.95 24.89 103.66 -127.83 -77.05 63.89 99.84 0.16 0.00 99.76 0.10 0.02 0.00 0.00 0.00 0.11 0.00 1 I C C 34.60 21.05 10.54 30.27 118.53 -159.09 -100.84 131.75 59.21 40.71 0.09 58.30 0.53 0.14 0.02 0.04 0.00 40.12 0.84 2 Q E E 98.14 4.80 22.13 27.67 123.23 -168.69 -118.89 137.16 17.65 82.22 0.13 16.07 1.26 0.21 0.05 0.07 0.00 81.28 1.05 3 M E E 48.29 20.37 13.04 32.35 122.10 -157.25 -111.28 133.41 13.64 86.25 0.11 12.63 0.82 0.15 0.04 0.06 0.00 85.35 0.95 4 T E E 63.43 7.56 20.94 29.15 125.59 -173.32 -123.67 144.30 21.98 77.84 0.18 19.41 1.99 0.32 0.06 0.12 0.00 76.34 1.77 5 Q C E 78.22 13.78 16.01 29.58 125.21 -155.34 -120.97 139.08 53.10 46.71 0.19 40.47 11.85 0.85 0.04 0.18 0.00 45.24 1.38 6 S C C 52.51 10.41 16.83 27.87 123.15 -141.54 -104.94 147.99 84.18 15.71 0.10 58.07 24.91 0.85 0.01 0.11 0.00 15.35 0.70 7 P C C 58.04 9.28 16.81 26.88 115.07 0.28 -70.66 152.04 88.71 10.57 0.71 65.26 18.95 3.57 0.07 0.81 0.00 10.74 0.60 8 A C S 63.89 9.43 16.26 26.42 96.95 -147.50 -81.46 -24.07 79.99 19.51 0.49 26.09 49.48 3.04 0.03 0.50 0.00 20.27 0.58 9 S E E 57.61 6.50 20.19 27.91 136.26 13.62 -147.70 150.77 19.43 80.13 0.44 15.33 3.68 0.69 0.05 0.40 0.00 79.38 0.46 10 L E E 34.94 19.36 14.50 33.23 130.16 -174.66 -138.29 142.05 3.91 96.07 0.02 3.52 0.28 0.02 0.00 0.01 0.00 95.99 0.18 11 S E E 66.83 6.03 23.07 30.26 123.70 -154.23 -117.54 137.68 2.80 97.19 0.01 2.55 0.16 0.01 0.00 0.00 0.00 97.15 0.12 12 V E E 17.20 19.88 13.95 33.85 136.87 170.17 -144.25 157.25 13.28 86.71 0.02 12.34 0.49 0.02 0.00 0.01 0.00 86.87 0.27 13 S E E 54.62 4.75 23.56 28.05 122.36 -118.17 -86.65 156.97 33.91 66.01 0.08 32.21 1.57 0.16 0.04 0.06 0.00 60.61 5.35 14 V C T 60.18 15.35 13.88 29.03 109.29 -84.80 -60.59 134.61 98.80 0.89 0.31 0.30 2.88 96.01 0.01 0.20 0.00 0.50 0.09 15 G C T 45.94 4.16 19.91 24.80 95.88 22.51 88.35 -5.84 99.55 0.28 0.17 0.42 3.73 95.49 0.01 0.14 0.00 0.19 0.03 16 E C C 77.51 8.99 16.93 27.17 121.73 124.00 -80.42 150.72 96.40 3.53 0.08 68.31 27.89 0.35 0.01 0.07 0.00 3.03 0.33 17 T C C 78.31 8.14 19.20 28.49 120.58 -130.70 -103.04 136.66 66.18 33.81 0.01 66.93 0.34 0.01 0.00 0.00 0.00 32.24 0.47 18 V E E 12.62 21.75 14.77 36.56 128.13 -172.68 -127.29 143.20 0.70 99.30 0.00 0.72 0.01 0.00 0.00 0.00 0.00 99.19 0.07 19 S E E 50.95 8.15 24.83 33.41 119.97 -146.63 -107.91 131.99 0.27 99.73 0.00 0.27 0.00 0.00 0.00 0.00 0.00 99.72 0.00 20 I E E 5.17 25.43 16.74 42.85 121.11 -166.52 -117.13 130.52 1.08 98.92 0.00 1.01 0.02 0.00 0.00 0.00 0.00 98.95 0.01 21 T E E 42.35 9.74 27.00 37.50 121.01 -163.35 -113.24 134.41 6.18 93.82 0.00 5.63 0.14 0.00 0.00 0.00 0.00 94.19 0.04 22 C E E 3.80 25.83 17.10 43.42 126.17 -170.98 -124.19 138.96 8.35 91.65 0.00 7.55 0.33 0.01 0.00 0.00 0.00 92.02 0.09 23 R E E 102.85 7.67 27.63 36.15 119.06 -160.26 -114.72 129.27 4.33 95.66 0.01 4.08 0.21 0.02 0.00 0.01 0.00 95.05 0.63 24 A E E 9.19 24.10 14.33 38.04 124.43 -163.12 -105.42 146.81 33.23 66.69 0.08 32.47 0.95 0.10 0.03 0.05 0.00 64.24 2.16 25 S C C 41.29 8.57 20.14 29.30 121.02 -119.89 -85.01 167.27 75.66 23.94 0.39 67.84 6.19 1.14 0.08 0.35 0.00 22.59 1.82 26 E C T 130.47 4.63 18.31 23.69 101.45 -80.29 -67.08 -7.04 93.75 3.21 3.04 4.53 23.36 66.11 0.36 2.63 0.00 2.43 0.58 27 N C T 105.81 4.17 20.41 24.86 97.49 36.60 -73.09 21.49 95.81 1.96 2.23 11.69 19.90 64.08 0.25 2.13 0.00 1.64 0.31 28 I C C 27.33 21.08 13.26 33.36 113.51 129.94 -90.66 125.83 85.00 12.62 2.37 61.58 17.77 4.89 0.57 2.12 0.00 7.74 5.33 29 Y C C 93.87 11.47 22.06 33.31 118.13 -168.13 -109.43 138.04 87.14 11.80 1.05 71.65 11.55 3.42 0.20 1.00 0.00 10.44 1.73 30 S C S 41.74 13.35 22.25 34.88 105.34 -148.52 -99.71 -12.75 83.21 16.25 0.54 24.72 53.65 3.99 0.05 0.48 0.00 16.48 0.64 31 S E E 29.66 13.22 24.61 37.81 124.95 33.81 -122.06 144.51 33.42 66.10 0.49 26.41 5.22 1.29 0.06 0.43 0.00 66.14 0.45 32 L E E 3.70 26.26 19.33 46.06 125.14 -165.40 -118.31 138.06 5.29 94.68 0.02 4.84 0.34 0.03 0.00 0.01 0.00 94.63 0.15 33 A E E 14.59 16.32 27.99 44.36 127.95 -169.76 -125.24 143.91 0.87 99.13 0.00 0.77 0.04 0.00 0.00 0.00 0.00 99.18 0.01 34 W E E 8.15 24.81 22.18 46.94 124.14 -156.60 -113.40 138.48 0.62 99.38 0.00 0.55 0.03 0.00 0.00 0.00 0.00 99.41 0.01 35 Y E E 25.95 16.48 24.09 40.67 132.93 -175.16 -131.24 151.11 0.76 99.24 0.00 0.65 0.03 0.00 0.00 0.00 0.00 99.28 0.03 36 Q E E 38.16 15.07 21.19 36.52 123.42 -149.56 -115.12 137.73 2.58 97.41 0.01 2.16 0.23 0.02 0.00 0.00 0.00 97.48 0.10 37 Q E E 51.97 13.62 15.59 29.92 118.88 -143.29 -103.99 133.56 27.61 72.34 0.05 24.85 1.83 0.13 0.01 0.03 0.00 72.31 0.83 38 K C C 96.08 6.51 14.74 22.67 119.32 -143.26 -91.41 148.00 92.92 6.95 0.13 89.21 3.26 0.61 0.03 0.10 0.00 5.70 1.08 39 Q C T 141.88 2.44 11.24 15.55 108.52 -82.35 -59.55 131.93 99.32 0.28 0.40 0.78 5.49 93.09 0.02 0.37 0.00 0.19 0.06 40 G C T 69.55 0.25 12.59 10.06 95.91 17.16 83.26 -2.70 99.56 0.10 0.34 0.85 5.25 93.43 0.01 0.36 0.00 0.07 0.02 41 K C S 109.53 4.34 10.04 16.52 129.33 92.70 -114.90 160.17 93.44 6.24 0.33 31.07 61.38 1.18 0.08 0.23 0.00 2.19 3.87 42 S C C 79.20 1.95 16.75 18.58 116.71 -94.59 -71.67 150.60 97.38 2.58 0.04 85.03 12.34 0.20 0.01 0.03 0.00 2.05 0.34 43 P C C 46.38 17.63 10.75 27.53 114.94 -100.07 -66.27 144.87 92.18 7.76 0.06 89.54 2.41 0.19 0.01 0.05 0.00 7.55 0.26 44 Q E E 86.68 7.11 20.74 28.71 123.96 -158.32 -118.93 138.43 8.36 91.52 0.11 7.24 1.01 0.12 0.04 0.05 0.00 91.01 0.53 45 L E E 67.33 15.07 17.45 32.19 110.98 -116.25 -75.38 126.30 1.01 98.97 0.03 0.89 0.05 0.01 0.01 0.00 0.00 99.01 0.03 46 L E E 28.39 17.09 20.08 37.22 101.33 176.27 -96.21 -34.21 2.11 97.84 0.06 1.47 0.48 0.03 0.02 0.01 0.00 97.97 0.02 47 V E E 19.11 18.76 21.03 39.65 137.18 5.07 -148.78 142.59 0.59 99.39 0.02 0.48 0.05 0.01 0.01 0.00 0.00 99.44 0.02 48 Y E E 61.48 18.21 21.28 38.18 128.64 -172.64 -132.60 136.37 3.76 96.09 0.14 3.19 0.28 0.06 0.07 0.04 0.00 96.22 0.13 49 S E E 25.85 14.94 22.39 37.05 121.20 -171.48 -121.07 133.82 30.00 66.38 3.62 23.20 5.43 1.87 1.98 1.46 0.00 65.23 0.83 50 A C C 24.57 17.41 17.60 34.58 117.44 -167.79 -105.36 132.23 51.40 26.06 22.54 35.10 10.52 6.34 11.26 10.56 0.05 24.55 1.61 51 T C C 73.56 7.74 20.55 28.51 110.78 -144.56 -95.08 111.14 52.35 15.93 31.72 28.10 14.50 10.82 18.63 12.82 0.22 12.70 2.21 52 I C C 80.10 8.90 18.46 27.82 114.01 40.07 -99.75 122.09 46.64 18.82 34.54 27.81 10.15 9.53 21.55 12.97 0.34 13.86 3.81 53 L C C 48.71 16.67 12.12 28.01 111.32 -134.21 -89.35 124.67 54.06 14.39 31.56 37.92 8.36 7.43 22.01 10.12 0.09 10.78 3.28 54 A C C 67.19 6.12 15.19 22.38 107.59 -148.70 -83.23 121.13 55.54 15.57 28.89 26.69 11.11 18.53 17.91 10.41 0.28 10.67 4.39 55 D C T 108.67 3.29 15.28 19.66 101.15 -0.88 -78.89 60.98 77.73 2.92 19.34 11.94 13.96 51.35 9.71 9.84 0.06 1.90 1.24 56 G C T 50.82 4.38 16.00 21.53 100.15 -56.59 85.56 1.98 91.53 2.89 5.59 17.49 24.45 50.05 1.42 3.80 0.00 1.97 0.81 57 V C C 39.91 15.33 12.01 27.74 117.69 122.09 -97.69 131.09 77.74 21.22 1.05 51.48 25.38 2.04 0.49 0.65 0.00 10.96 8.99 58 P C C 60.26 8.60 18.44 27.98 110.61 -110.17 -67.15 145.57 80.54 15.78 3.68 58.51 13.49 7.96 1.14 2.81 0.00 12.61 3.48 59 S C C 49.81 14.69 15.91 29.90 105.26 -133.69 -86.36 37.67 82.78 11.96 5.27 54.56 17.16 11.14 1.05 4.46 0.00 10.10 1.51 60 R C C 113.26 8.82 21.57 30.58 113.90 85.38 -109.48 110.24 67.32 28.32 4.36 40.90 20.67 6.54 1.01 3.10 0.01 26.23 1.55 61 F E E 31.20 22.53 13.63 35.29 123.24 133.91 -111.83 138.73 26.14 72.84 1.02 21.99 3.80 1.02 0.44 0.59 0.00 70.54 1.62 62 S E E 55.89 6.66 23.46 31.30 134.18 -176.82 -138.08 156.06 11.23 88.47 0.30 9.76 1.26 0.30 0.13 0.14 0.00 87.55 0.88 63 G E E 25.12 16.07 16.44 31.76 140.96 162.26 -166.29 171.49 12.18 87.65 0.17 10.05 1.83 0.37 0.05 0.10 0.00 86.99 0.62 64 S E E 66.21 5.28 21.06 27.98 134.33 -155.28 -143.36 155.69 19.75 80.07 0.18 16.69 2.57 0.52 0.04 0.13 0.00 79.34 0.71 65 G E E 30.08 11.57 15.40 27.54 139.58 134.46 110.71 168.66 37.75 61.98 0.27 25.78 11.30 2.05 0.04 0.28 0.00 59.43 1.12 66 S C C 76.84 3.40 20.86 24.86 112.86 -112.85 -116.83 84.39 60.24 38.93 0.84 35.12 19.96 7.00 0.13 0.89 0.00 33.66 3.22 67 G C S 32.52 10.18 19.20 29.41 109.62 -48.04 66.88 -128.46 97.64 1.53 0.83 3.37 53.89 40.53 0.03 0.83 0.00 1.16 0.20 68 T C S 51.33 15.17 16.77 31.73 97.91 -11.64 -97.68 -0.01 97.34 1.98 0.68 3.33 55.15 39.06 0.03 0.63 0.00 1.61 0.19 69 Q E E 76.71 8.63 22.61 32.34 120.21 86.18 -107.03 131.88 34.51 65.26 0.23 23.59 10.66 1.50 0.04 0.26 0.00 61.04 2.91 70 Y E E 9.64 24.41 16.22 40.91 129.93 -175.93 -129.65 144.24 14.57 85.42 0.01 13.67 0.57 0.04 0.00 0.01 0.00 85.14 0.57 71 S E E 26.40 10.90 27.05 38.98 126.60 -166.04 -124.04 140.40 6.34 93.66 0.00 5.44 0.47 0.01 0.00 0.00 0.00 93.97 0.12 72 L E E 3.39 26.10 18.63 45.56 121.75 -164.40 -118.12 130.80 0.75 99.25 0.00 0.78 0.01 0.00 0.00 0.00 0.00 99.20 0.01 73 K E E 78.51 9.26 27.24 37.07 119.92 -163.36 -115.89 129.32 0.18 99.82 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.78 0.01 74 I E E 7.25 24.37 15.71 40.70 117.67 -165.77 -113.18 126.46 2.31 97.69 0.00 2.39 0.03 0.00 0.00 0.00 0.00 97.13 0.45 75 N C C 74.27 6.48 23.21 29.86 120.39 -171.02 -103.66 151.63 94.02 5.92 0.06 48.31 40.40 4.27 0.00 0.10 0.00 6.70 0.21 76 S C S 63.88 4.77 24.07 28.82 105.34 11.49 60.94 81.85 99.20 0.77 0.02 9.93 84.78 4.55 0.00 0.04 0.00 0.64 0.07 77 L C C 18.00 23.98 10.42 33.88 113.37 -140.89 -75.55 132.21 99.42 0.57 0.01 98.32 1.19 0.02 0.00 0.00 0.00 0.19 0.27 78 Q C C 80.80 4.29 23.64 27.74 131.29 -176.53 -125.77 159.12 99.85 0.14 0.02 99.48 0.38 0.00 0.00 0.00 0.00 0.02 0.10 79 S H G 64.85 10.53 15.08 26.25 90.94 -104.68 -58.78 -32.37 3.17 0.02 96.81 0.17 0.20 1.98 0.25 97.38 0.00 0.01 0.00 80 E H G 130.97 3.01 20.84 24.36 89.86 62.98 -70.26 -17.18 2.60 0.03 97.38 0.09 0.14 1.74 0.19 97.81 0.00 0.02 0.00 81 D H G 12.00 21.43 15.15 36.99 94.00 60.47 -87.61 -5.56 3.38 0.04 96.58 0.38 0.31 1.59 0.26 97.42 0.00 0.03 0.00 82 F C C 55.40 17.11 18.39 35.37 117.01 107.00 -72.89 137.77 92.61 7.24 0.15 88.71 3.91 0.12 0.02 0.13 0.00 6.80 0.31 83 G E E 14.45 9.87 23.50 35.02 142.43 94.39 154.59 -170.72 7.26 92.73 0.01 6.36 0.84 0.06 0.00 0.01 0.00 92.22 0.50 84 T E E 43.71 11.71 24.68 36.92 120.44 -44.40 -103.40 136.54 1.59 98.40 0.00 1.38 0.11 0.01 0.00 0.00 0.00 98.45 0.05 85 Y E E 8.23 24.96 19.08 44.25 124.12 -165.44 -117.36 138.72 1.26 98.73 0.01 1.05 0.09 0.01 0.00 0.00 0.00 98.79 0.06 86 Y E E 33.95 15.86 27.28 43.10 129.84 -170.10 -127.70 145.71 3.33 96.57 0.10 2.77 0.29 0.05 0.05 0.04 0.00 96.64 0.15 87 C E E 3.22 25.24 21.43 46.91 122.57 -155.67 -113.92 135.69 10.97 87.96 1.06 9.08 1.12 0.43 0.57 0.37 0.00 88.14 0.30 88 Q E E 36.09 14.43 25.62 40.03 125.89 -169.91 -120.47 139.47 10.69 87.94 1.37 9.01 1.21 0.45 0.68 0.52 0.00 87.70 0.43 89 H E E 33.02 18.78 18.51 36.91 118.61 -150.97 -103.87 132.64 16.88 81.57 1.55 13.44 2.77 1.01 0.58 0.73 0.00 80.87 0.59 90 F E E 77.85 10.62 18.68 30.03 117.28 -160.42 -107.21 128.77 29.97 68.40 1.63 21.87 6.92 2.61 0.54 0.96 0.01 65.55 1.54 91 W C E 127.33 9.03 14.58 24.44 112.93 -160.26 -103.13 114.25 60.92 37.39 1.69 27.86 20.80 13.91 0.30 1.29 0.01 34.30 1.53 92 G C S 48.50 3.42 15.70 20.01 118.13 0.09 106.22 -164.11 92.28 6.95 0.77 22.34 46.53 23.27 0.06 0.82 0.00 6.31 0.66 93 T C S 90.96 3.65 14.65 19.61 119.24 -22.89 -101.01 136.80 89.89 9.56 0.55 26.21 53.06 10.40 0.06 0.60 0.00 8.63 1.03 94 P C C 75.07 8.12 14.98 24.16 113.51 -85.81 -70.29 146.44 76.25 23.23 0.52 51.45 18.68 4.80 0.07 0.53 0.00 23.64 0.84 95 Y E E 77.45 14.67 14.30 29.13 119.73 -143.16 -101.01 135.30 45.00 54.67 0.33 38.86 3.99 1.01 0.07 0.25 0.00 54.86 0.96 96 T E E 62.20 10.53 19.67 30.66 124.38 -162.15 -119.67 137.41 17.14 82.61 0.25 14.86 1.71 0.40 0.10 0.15 0.00 79.74 3.04 97 F E E 53.41 18.16 15.54 32.98 115.54 -159.22 -104.80 125.00 26.44 73.04 0.52 20.52 5.27 1.82 0.17 0.40 0.00 69.29 2.53 98 G C E 32.67 10.11 18.94 29.09 116.89 -122.43 75.11 -155.42 63.37 35.60 1.03 26.07 22.29 16.11 0.10 1.00 0.00 33.33 1.09 99 G C S 47.10 6.20 20.54 27.03 102.23 -24.40 -6.07 4.44 73.47 25.26 1.27 21.44 31.71 20.47 0.09 1.27 0.00 24.06 0.95 100 G C C 19.27 15.20 16.84 31.47 123.70 -115.85 93.23 173.73 65.76 33.63 0.62 36.16 22.95 6.11 0.05 0.68 0.00 33.34 0.71 101 T E E 32.68 17.04 18.29 34.98 124.33 -93.43 -114.62 140.55 25.14 74.80 0.06 22.41 1.54 0.16 0.01 0.04 0.00 75.53 0.31 102 K E E 97.23 9.95 22.69 32.97 122.36 -154.60 -111.07 134.66 2.25 97.74 0.01 1.93 0.19 0.01 0.00 0.00 0.00 97.76 0.10 103 L E E 16.87 22.23 15.36 37.37 121.08 -163.69 -115.08 131.26 1.09 98.90 0.01 1.02 0.03 0.00 0.00 0.00 0.00 98.91 0.03 104 E E E 93.72 6.05 23.23 29.80 117.89 -157.28 -106.97 128.58 2.69 97.30 0.01 2.60 0.09 0.01 0.00 0.00 0.00 97.15 0.14 105 I E E 31.92 19.80 11.26 30.38 116.06 -156.87 -100.42 126.52 24.07 75.87 0.07 24.17 0.27 0.06 0.03 0.02 0.00 74.67 0.78 106 K C C 128.99 4.07 19.26 24.21 115.12 -156.05 -97.88 131.04 99.51 0.49 0.00 99.56 0.05 0.01 0.00 0.00 0.00 0.37 0.01