# 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 109.69 5.42 20.16 26.33 115.33 -155.75 -96.05 124.16 99.14 0.86 0.00 99.13 0.09 0.02 0.00 0.00 0.00 0.76 0.01 1 V E E 34.11 20.02 11.50 30.44 121.65 -163.74 -111.47 134.21 44.38 55.58 0.04 44.10 0.37 0.06 0.01 0.02 0.00 54.92 0.52 2 Q E E 95.17 5.10 22.33 28.02 121.99 -164.57 -115.02 134.87 9.27 90.70 0.03 8.30 0.69 0.07 0.01 0.02 0.00 90.52 0.39 3 L E E 38.89 20.89 12.67 32.56 121.56 -155.10 -108.97 133.23 5.55 94.42 0.03 5.23 0.24 0.03 0.01 0.01 0.00 94.24 0.25 4 Q E E 87.86 6.82 21.00 28.67 124.52 -168.33 -118.95 138.70 10.14 89.76 0.09 9.00 0.90 0.15 0.03 0.05 0.00 89.20 0.68 5 Q E E 82.08 14.25 14.13 28.03 117.99 -145.12 -99.23 133.27 40.30 59.56 0.14 35.26 3.59 0.41 0.03 0.11 0.00 59.86 0.75 6 S C C 64.44 7.52 17.03 25.30 107.71 -162.62 -93.72 12.81 77.05 22.78 0.17 57.28 17.57 1.32 0.02 0.17 0.00 22.92 0.72 7 G C S 31.40 6.14 18.37 25.31 134.74 -67.42 131.78 -176.85 85.42 14.51 0.07 33.95 50.09 1.14 0.01 0.08 0.00 14.21 0.53 8 P C C 72.58 9.56 16.48 26.75 115.13 -39.59 -70.86 145.94 82.33 17.58 0.09 67.40 12.70 0.71 0.01 0.10 0.00 18.64 0.43 9 E E E 67.14 14.59 16.88 31.23 125.45 -163.08 -121.23 136.18 18.87 81.04 0.09 15.71 3.05 0.21 0.02 0.07 0.00 79.91 1.04 10 L E E 85.82 9.48 21.83 31.50 115.83 -132.85 -96.08 127.38 6.58 93.40 0.02 5.70 0.74 0.03 0.01 0.01 0.00 93.11 0.39 11 V E E 15.34 20.89 13.92 34.58 130.17 -173.92 -129.59 148.47 9.08 90.89 0.03 8.82 0.38 0.02 0.01 0.01 0.00 89.22 1.53 12 K C C 110.87 4.19 23.47 27.73 121.51 -127.58 -89.39 149.38 71.75 28.19 0.06 70.97 1.32 0.12 0.02 0.04 0.00 25.84 1.70 13 L C T 79.05 13.09 14.02 27.36 109.53 -85.53 -58.88 135.14 99.14 0.63 0.23 0.20 2.07 97.14 0.01 0.14 0.00 0.39 0.06 14 G C T 49.00 3.43 19.49 23.62 95.66 22.27 88.85 -6.14 99.61 0.26 0.13 0.26 2.22 97.23 0.00 0.08 0.00 0.19 0.01 15 A C C 37.01 10.38 15.84 27.54 123.19 122.94 -83.30 157.99 94.25 5.66 0.09 72.50 21.49 0.37 0.01 0.09 0.00 5.00 0.54 16 S C C 57.27 9.41 19.99 30.11 125.45 -135.06 -112.55 145.11 60.09 39.89 0.02 59.87 0.62 0.04 0.00 0.01 0.00 38.73 0.72 17 V E E 13.28 22.40 15.53 37.82 127.10 -167.02 -127.54 139.34 2.24 97.76 0.00 2.20 0.04 0.00 0.00 0.00 0.00 97.68 0.08 18 R E E 119.59 7.22 24.93 32.91 118.08 -148.50 -107.31 128.31 0.43 99.57 0.00 0.41 0.01 0.00 0.00 0.00 0.00 99.58 0.00 19 I E E 5.07 25.57 16.48 42.76 121.80 -168.62 -115.87 132.41 0.69 99.31 0.00 0.66 0.01 0.00 0.00 0.00 0.00 99.31 0.01 20 S E E 34.77 9.81 26.68 37.13 125.77 -165.67 -114.57 144.52 3.57 96.43 0.00 3.20 0.13 0.00 0.00 0.00 0.00 96.63 0.03 21 C E E 5.14 25.38 16.54 42.28 130.85 -174.92 -133.70 144.37 5.56 94.43 0.01 5.04 0.25 0.01 0.00 0.00 0.00 94.60 0.10 22 K E E 95.62 7.45 26.87 35.11 120.84 -157.10 -115.93 131.11 3.72 96.25 0.03 3.42 0.23 0.03 0.01 0.01 0.00 95.75 0.55 23 A E E 7.68 24.38 14.62 38.83 119.52 -170.17 -112.29 127.95 27.83 71.95 0.22 26.34 1.29 0.25 0.07 0.14 0.00 70.21 1.69 24 S C C 58.47 6.87 21.63 29.05 119.00 -161.80 -107.16 144.11 72.02 27.26 0.72 36.09 24.33 12.64 0.08 0.75 0.00 25.07 1.05 25 G C S 48.82 3.67 21.18 25.30 97.04 16.87 83.13 -1.78 88.82 10.26 0.91 17.61 51.78 19.58 0.07 0.98 0.00 8.98 1.00 26 Y C C 47.53 20.18 12.03 31.17 120.12 121.39 -95.31 140.23 86.82 11.21 1.97 61.11 18.12 7.43 0.35 2.00 0.00 8.04 2.95 27 R C C 134.52 5.44 22.71 28.68 107.29 -157.97 -104.92 32.21 89.66 8.28 2.06 64.28 16.70 8.50 0.34 2.06 0.00 5.80 2.33 28 F C C 42.41 19.62 14.77 33.41 123.55 84.02 -105.05 142.89 82.59 10.92 6.50 52.23 18.89 11.05 0.94 6.33 0.00 6.81 3.75 29 S C S 61.97 7.37 21.21 28.90 98.78 -151.25 -86.25 -22.52 85.94 9.44 4.62 13.73 41.18 31.45 0.39 4.21 0.00 7.69 1.33 30 Y C T 103.47 9.10 21.98 31.24 114.25 29.35 -125.36 85.82 71.89 23.58 4.54 20.33 24.49 28.24 0.39 4.36 0.00 20.79 1.40 31 S C E 9.64 22.19 17.45 39.16 130.49 120.15 -122.53 152.25 54.94 44.55 0.51 43.14 9.97 1.14 0.08 0.47 0.00 44.16 1.04 32 W E E 49.62 14.57 27.10 41.81 128.30 -157.67 -125.49 142.54 12.86 87.10 0.03 12.00 0.71 0.06 0.01 0.02 0.00 86.72 0.47 33 M E E 3.09 26.71 21.61 48.78 123.65 -161.45 -120.62 133.74 2.18 97.82 0.01 2.03 0.10 0.01 0.00 0.00 0.00 97.81 0.06 34 N E E 22.98 17.08 28.19 44.84 127.20 -172.67 -123.35 142.95 0.82 99.17 0.00 0.73 0.03 0.00 0.00 0.00 0.00 99.22 0.01 35 W E E 7.18 24.77 22.76 47.45 123.08 -154.23 -113.51 137.09 0.73 99.27 0.00 0.63 0.03 0.00 0.00 0.00 0.00 99.33 0.01 36 V E E 12.02 18.81 24.28 42.88 131.01 -171.88 -129.05 144.99 0.44 99.55 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.59 0.01 37 K E E 46.45 15.42 22.46 37.61 122.23 -156.13 -111.17 134.80 0.59 99.41 0.00 0.49 0.03 0.00 0.00 0.00 0.00 99.47 0.01 38 Q E E 57.30 13.87 17.06 31.34 116.61 -144.63 -98.85 129.50 5.06 94.93 0.01 4.49 0.29 0.02 0.00 0.00 0.00 95.01 0.18 39 R C C 91.49 8.32 15.24 24.98 119.27 -154.61 -101.84 141.11 75.17 24.74 0.09 72.73 1.53 0.18 0.01 0.06 0.00 24.81 0.67 40 P C T 95.67 4.94 11.89 18.75 109.43 -91.96 -58.53 135.75 95.65 0.37 3.98 0.49 3.61 91.14 0.05 4.43 0.00 0.21 0.06 41 G C T 68.92 0.36 12.97 11.12 95.98 15.21 81.90 -3.99 95.72 0.12 4.16 0.49 3.41 91.27 0.06 4.67 0.00 0.07 0.03 42 K C T 132.25 3.08 12.59 17.00 106.59 71.92 -108.01 -3.80 89.21 3.92 6.86 11.14 33.75 43.39 0.24 8.07 0.00 2.65 0.76 43 G C C 29.37 4.96 16.69 23.09 127.62 -118.11 92.40 -168.09 69.10 30.74 0.16 53.55 13.17 1.81 0.02 0.18 0.00 30.16 1.10 44 L E E 48.59 17.75 13.25 30.59 116.27 -24.88 -79.33 137.17 24.74 75.23 0.02 22.42 1.01 0.07 0.00 0.02 0.00 76.30 0.17 45 E E E 77.65 9.09 21.91 31.59 125.93 -169.13 -123.87 139.06 1.38 98.62 0.00 1.15 0.08 0.00 0.00 0.00 0.00 98.74 0.02 46 W E E 97.15 15.36 19.11 34.06 110.37 -114.47 -72.10 127.12 0.26 99.74 0.00 0.22 0.01 0.00 0.00 0.00 0.00 99.76 0.00 47 I E E 15.40 20.06 20.45 40.86 100.73 176.10 -100.89 -26.14 1.98 98.02 0.00 1.26 0.45 0.06 0.00 0.00 0.00 98.21 0.01 48 G E E 3.32 17.87 23.38 41.80 145.93 -38.93 169.51 173.61 1.32 98.68 0.00 0.83 0.23 0.03 0.00 0.00 0.00 98.90 0.01 49 R E E 71.03 15.37 25.54 40.33 132.29 -111.45 -136.36 145.66 1.37 98.62 0.01 1.22 0.06 0.00 0.00 0.00 0.00 98.68 0.03 50 I E E 6.65 23.97 19.17 43.61 119.24 -148.42 -112.40 127.89 6.02 93.97 0.02 5.50 0.40 0.03 0.01 0.01 0.00 93.08 0.97 51 Y C C 66.80 10.82 24.64 35.84 114.60 -163.18 -111.49 116.27 66.15 33.76 0.09 60.76 3.58 0.31 0.02 0.07 0.00 34.29 0.97 52 P C T 38.99 18.10 15.81 33.17 108.11 -117.13 -63.79 135.53 90.09 5.25 4.66 12.60 14.44 62.16 0.31 5.20 0.00 4.56 0.73 53 G C T 48.68 5.73 18.61 24.92 99.28 28.16 82.23 -7.83 92.68 1.88 5.43 7.91 16.90 66.80 0.35 6.13 0.00 1.36 0.56 54 D C S 88.30 5.30 16.13 22.22 103.87 64.14 -98.01 6.53 88.44 3.71 7.84 23.41 32.30 32.27 0.63 8.04 0.00 2.05 1.30 55 G C S 41.88 8.28 14.74 23.77 103.99 -117.00 78.31 2.05 89.43 6.95 3.62 28.82 39.56 21.47 0.46 3.35 0.00 4.68 1.65 56 D C C 90.47 5.19 18.66 24.75 108.85 97.49 -89.60 95.22 81.56 14.47 3.97 47.83 22.60 11.52 0.66 3.78 0.00 10.91 2.70 57 T C C 42.69 18.37 12.60 29.87 114.99 133.10 -105.12 126.53 70.75 26.09 3.16 55.84 10.16 4.11 0.75 2.73 0.00 22.36 4.05 58 K C C 123.07 4.31 22.79 27.72 118.70 -169.01 -115.46 128.03 58.45 39.45 2.10 47.04 7.65 2.64 0.79 1.59 0.01 32.71 7.57 59 Y C C 62.88 20.11 11.36 30.00 119.09 -157.44 -96.06 135.71 61.27 37.50 1.23 51.84 6.35 1.48 0.61 0.80 0.00 26.42 12.48 60 S C C 51.63 7.07 16.45 24.59 123.41 -164.78 -114.66 154.38 90.97 8.14 0.89 84.70 5.00 1.28 0.36 0.48 0.00 5.62 2.55 61 G C T 56.64 1.59 17.67 18.92 103.49 -19.70 59.31 -89.77 62.88 0.71 36.41 2.99 10.12 49.11 3.65 33.27 0.01 0.40 0.43 62 K C T 133.48 4.45 16.99 22.65 92.77 3.20 -72.01 -21.55 62.70 0.38 36.93 1.30 5.64 55.13 3.39 34.10 0.01 0.21 0.22 63 F C T 12.45 22.55 10.15 32.52 96.12 48.76 -96.33 -0.70 61.91 1.30 36.78 3.49 7.32 49.75 4.14 33.77 0.02 0.73 0.76 64 K C T 122.64 7.02 15.15 24.48 110.24 122.08 -60.72 129.29 86.29 2.03 11.68 3.46 3.92 79.73 3.59 6.87 0.01 0.98 1.45 65 G C T 61.88 1.28 18.73 19.19 94.51 13.94 80.53 -2.42 86.90 0.50 12.60 1.26 3.99 83.06 2.22 8.94 0.00 0.31 0.22 66 K C T 89.69 10.60 18.29 29.18 100.14 75.77 -100.86 -15.10 86.54 2.19 11.28 10.40 16.32 59.91 2.12 9.01 0.00 1.71 0.52 67 A E E 5.36 24.44 12.38 36.75 133.65 44.75 -130.95 150.93 33.56 65.34 1.10 26.99 5.66 1.05 0.40 0.64 0.00 63.53 1.71 68 T E E 61.25 7.03 26.81 34.66 130.42 -168.75 -132.91 144.54 5.02 94.88 0.10 4.46 0.47 0.08 0.04 0.05 0.00 94.46 0.43 69 L E E 14.50 24.87 15.43 40.23 124.12 -160.18 -119.98 133.71 3.30 96.65 0.05 2.99 0.19 0.03 0.02 0.02 0.00 96.63 0.11 70 T E E 62.76 6.33 26.99 33.92 124.51 -173.84 -126.56 137.95 4.70 95.25 0.05 4.08 0.41 0.05 0.01 0.02 0.00 95.26 0.16 71 A E E 20.66 22.63 12.84 34.60 123.67 -163.00 -115.56 136.62 12.34 87.45 0.22 10.28 1.97 0.34 0.06 0.13 0.00 86.39 0.82 72 D E E 62.98 6.53 20.33 27.70 109.06 -151.27 -103.52 112.04 47.99 51.72 0.29 44.38 2.35 0.47 0.08 0.20 0.00 50.75 1.77 73 K C T 114.27 10.50 13.62 25.25 92.94 -161.80 -65.34 -26.59 92.92 1.07 6.02 3.21 10.68 78.07 0.27 6.70 0.00 0.81 0.27 74 S C T 90.91 1.14 18.08 18.05 92.99 55.83 -76.21 -22.90 92.51 0.71 6.78 2.08 10.01 79.49 0.32 7.38 0.00 0.48 0.23 75 S C T 48.46 8.08 16.61 25.48 102.83 39.72 -102.18 0.85 91.63 0.99 7.38 9.75 26.56 53.91 0.38 8.44 0.00 0.65 0.31 76 S C T 37.44 15.39 17.05 32.34 95.92 -136.74 59.87 28.48 97.85 1.55 0.60 22.68 28.02 47.05 0.06 0.63 0.00 1.36 0.20 77 T E E 32.05 12.17 23.09 36.28 126.31 125.08 -115.05 145.03 34.33 65.61 0.06 28.95 4.42 0.31 0.01 0.06 0.00 64.87 1.37 78 V E E 4.25 25.12 19.29 44.90 125.18 -164.71 -122.52 136.87 3.75 96.25 0.00 3.56 0.13 0.01 0.00 0.00 0.00 96.11 0.18 79 Y E E 45.35 14.32 27.31 41.87 124.36 -164.85 -118.54 137.06 1.07 98.93 0.00 0.94 0.05 0.00 0.00 0.00 0.00 99.00 0.01 80 M E E 3.10 26.24 20.83 47.68 121.16 -163.14 -114.67 130.23 0.33 99.67 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.68 0.00 81 Q E E 55.30 11.76 27.84 40.10 118.07 -160.51 -109.27 126.66 0.23 99.77 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.75 0.01 82 L E E 5.27 25.22 17.65 43.49 116.76 -166.11 -110.76 125.77 9.04 90.96 0.00 9.19 0.09 0.01 0.00 0.00 0.00 90.15 0.57 83 S C S 43.36 8.75 23.68 32.53 124.85 -163.71 -105.79 159.61 90.65 9.24 0.12 40.28 40.34 8.60 0.01 0.19 0.00 10.31 0.28 84 S C S 65.41 5.07 24.70 30.07 96.67 10.58 58.82 53.52 97.95 1.99 0.06 16.37 72.18 9.31 0.00 0.10 0.00 1.83 0.20 85 L C C 10.96 25.14 11.18 36.42 113.19 -154.91 -74.69 131.74 98.64 1.35 0.02 97.53 1.28 0.03 0.01 0.01 0.00 0.51 0.64 86 T C C 54.74 5.41 24.77 30.05 134.10 166.65 -127.03 169.07 98.55 1.41 0.04 96.41 1.83 0.02 0.02 0.01 0.00 0.21 1.49 87 S H G 58.51 12.44 16.83 29.33 91.01 -95.95 -60.44 -32.01 9.87 0.06 90.07 0.67 1.01 7.37 2.17 88.73 0.00 0.04 0.01 88 E H G 117.76 5.15 22.45 28.37 91.20 61.65 -70.60 -19.76 8.23 0.09 91.68 0.48 0.73 6.38 1.90 90.43 0.00 0.06 0.01 89 D H G 13.15 21.56 17.60 39.17 95.16 56.77 -90.11 -2.50 8.16 0.16 91.68 1.81 1.34 4.07 2.11 90.53 0.00 0.12 0.02 90 S C C 19.91 19.07 21.71 40.37 114.73 106.41 -80.08 135.37 90.19 5.55 4.26 83.20 6.26 1.39 1.13 2.58 0.00 4.59 0.85 91 A E E 11.10 19.45 25.00 43.53 142.49 151.61 -152.50 167.94 20.07 79.17 0.76 17.56 2.59 0.61 0.37 0.43 0.00 75.81 2.62 92 V E E 20.71 19.67 26.21 45.04 119.51 -107.85 -105.87 132.72 5.43 94.41 0.16 5.05 0.37 0.07 0.07 0.06 0.00 94.15 0.23 93 Y E E 7.09 24.90 24.20 48.62 123.31 -163.37 -113.69 136.36 2.46 97.36 0.17 2.21 0.18 0.06 0.06 0.06 0.00 97.30 0.11 94 F E E 17.16 21.13 27.65 47.70 127.58 -168.06 -123.02 142.40 4.13 95.55 0.31 3.57 0.33 0.11 0.13 0.11 0.00 95.55 0.21 95 C E E 4.26 24.48 24.73 48.66 125.78 -164.30 -121.37 139.11 16.05 82.66 1.28 13.38 1.77 0.58 0.63 0.44 0.00 82.58 0.61 96 A E E 10.05 19.57 24.45 43.52 126.22 -163.75 -117.56 144.29 25.31 70.66 4.03 20.74 3.61 1.65 2.18 1.66 0.00 68.65 1.50 97 R E E 67.75 16.01 21.97 37.06 114.90 -146.49 -98.63 132.68 40.21 48.03 11.76 28.76 8.59 5.16 6.11 5.59 0.10 42.76 2.92 98 S C C 40.90 11.79 19.51 31.34 117.05 -133.64 -105.06 143.66 55.01 27.37 17.63 35.06 12.36 9.66 5.58 11.08 0.06 23.87 2.34 99 A C C 56.01 10.12 16.30 26.76 107.02 -150.97 -85.47 74.26 66.77 13.40 19.82 26.46 19.68 23.26 4.71 13.49 0.10 9.80 2.49 100 Y C T 134.45 7.07 14.44 22.46 108.83 48.00 -91.88 91.12 76.95 6.23 16.82 18.06 22.07 38.16 3.82 11.74 0.06 4.04 2.04 101 G C T 47.74 4.71 14.75 20.71 108.42 -0.01 90.30 -16.08 88.72 3.83 7.46 25.40 28.55 35.52 1.50 5.54 0.01 2.21 1.28 102 S C C 65.64 7.91 12.91 21.80 111.52 111.16 -89.55 120.56 85.23 6.41 8.35 40.14 25.26 20.61 2.09 5.98 0.01 3.64 2.29 103 E C C 124.26 5.27 15.80 22.26 108.97 -148.35 -90.84 95.49 79.51 8.66 11.83 33.39 22.76 25.01 3.73 7.25 0.04 5.43 2.40 104 G C C 31.15 10.78 16.94 27.92 115.86 9.05 111.93 168.99 73.98 12.88 13.15 36.10 19.17 20.43 5.03 7.42 0.07 9.16 2.62 105 F C C 68.29 15.23 17.49 32.23 116.96 -116.08 -100.56 134.22 54.43 26.85 18.72 35.10 10.47 9.08 10.49 8.77 0.16 21.14 4.79 106 A C E 32.84 15.52 19.88 34.86 108.91 -158.28 -93.44 126.89 42.34 32.52 25.15 24.34 10.41 9.49 14.81 10.35 0.29 26.94 3.37 107 M E E 51.59 17.11 19.82 35.84 118.00 -142.36 -103.03 133.29 35.41 36.86 27.73 21.19 8.37 8.33 16.98 10.62 0.28 31.13 3.11 108 D C E 56.73 13.70 21.46 34.50 112.80 -142.65 -97.05 120.92 40.44 34.92 24.64 26.49 7.68 7.87 14.63 9.53 0.12 31.09 2.59 109 Y C E 67.47 16.97 19.96 35.65 109.90 52.78 -97.60 58.30 43.21 34.60 22.20 20.51 11.06 14.28 13.42 8.47 0.44 27.96 3.86 110 W C C 72.73 17.06 19.63 35.39 104.16 40.03 -97.52 33.40 54.73 29.95 15.32 22.39 13.41 21.02 8.85 6.27 0.41 21.88 5.76 111 G C C 24.40 14.10 19.60 32.80 118.03 -110.26 80.92 -161.52 78.29 14.86 6.85 28.79 23.82 27.19 2.42 3.87 0.03 11.51 2.37 112 Q C S 100.59 9.06 21.00 29.99 101.95 -30.54 -88.44 7.27 81.68 13.13 5.19 27.72 29.78 25.61 1.40 3.32 0.02 9.54 2.60 113 G C C 23.94 14.42 18.68 32.30 118.30 -103.74 98.55 167.21 79.20 19.67 1.13 37.96 28.99 12.63 0.16 1.09 0.00 17.72 1.46 114 T E E 34.40 17.94 18.42 35.52 119.95 -117.83 -103.09 138.80 48.75 50.95 0.30 38.96 8.05 1.23 0.05 0.27 0.00 50.42 1.03 115 S E E 51.74 10.81 23.07 33.81 124.14 -150.66 -113.39 139.24 11.96 87.95 0.09 9.98 1.81 0.23 0.02 0.06 0.00 87.37 0.54 116 V E E 22.58 21.51 16.10 37.24 123.56 -168.38 -118.48 133.18 4.94 95.04 0.02 4.57 0.29 0.04 0.01 0.01 0.00 94.83 0.26 117 T E E 66.01 7.28 22.95 30.75 119.24 -156.49 -107.16 132.44 6.32 93.65 0.03 5.89 0.33 0.06 0.01 0.01 0.00 93.24 0.45 118 V E E 28.83 20.12 12.63 32.13 119.91 -161.24 -109.99 130.01 26.49 73.42 0.09 26.03 0.48 0.12 0.04 0.05 0.00 72.05 1.24 119 S C C 59.17 6.60 20.21 27.15 120.74 -160.00 -104.75 146.25 99.09 0.90 0.01 99.15 0.06 0.01 0.00 0.00 0.00 0.76 0.01