# 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 112.71 6.57 11.84 19.73 116.47 -167.07 -101.79 131.49 99.80 0.18 0.02 99.75 0.08 0.04 0.01 0.00 0.00 0.10 0.02 1 S C C 77.64 3.74 10.39 15.96 117.09 -161.29 -100.97 135.71 87.33 10.73 1.94 84.23 1.30 2.13 0.97 0.64 0.00 8.22 2.52 2 I C C 113.74 4.66 9.05 15.57 115.95 -149.49 -97.70 130.71 79.61 16.70 3.68 63.35 11.69 3.90 1.89 1.82 0.00 14.26 3.08 3 V C C 96.94 4.89 10.17 16.87 115.53 -152.35 -97.94 131.55 77.26 17.75 4.99 63.80 9.02 3.68 2.67 2.28 0.00 15.84 2.71 4 R C C 149.58 4.61 10.87 17.36 115.26 -150.96 -97.70 131.22 75.63 16.41 7.96 59.55 9.89 5.52 4.31 3.71 0.01 13.93 3.07 5 S C C 68.88 6.01 10.81 18.32 115.35 -155.59 -98.39 140.44 77.17 10.79 12.04 54.42 12.97 9.91 5.42 6.49 0.01 8.62 2.16 6 S C C 73.01 5.42 12.19 18.91 113.19 -141.58 -95.70 126.50 76.03 8.09 15.87 43.35 19.62 14.12 6.20 9.13 0.03 5.61 1.92 7 V C C 87.51 7.31 12.45 20.81 109.85 -148.64 -94.32 103.86 72.89 8.92 18.19 37.82 22.09 14.41 7.35 10.07 0.10 5.92 2.26 8 H C C 109.35 7.38 14.91 23.21 110.02 63.15 -93.00 109.48 72.29 10.62 17.09 45.30 15.60 11.95 5.47 11.42 0.02 8.41 1.84 9 A C C 43.91 13.03 14.35 27.55 114.44 -152.17 -94.81 133.74 70.66 17.09 12.26 44.74 17.18 9.35 2.87 8.93 0.02 15.35 1.57 10 K C E 81.46 12.08 19.45 31.37 119.72 -165.66 -107.57 137.36 51.32 39.48 9.20 37.41 9.20 5.40 2.20 6.33 0.00 38.15 1.30 11 W E E 78.18 15.08 20.33 35.09 120.74 -141.06 -105.05 133.40 31.51 67.24 1.26 26.52 4.24 0.87 0.37 0.70 0.00 66.37 0.93 12 V E E 11.03 21.91 20.34 41.87 123.64 -167.43 -116.73 137.06 14.80 85.05 0.15 13.32 1.06 0.13 0.05 0.06 0.00 85.04 0.33 13 V E E 35.12 14.12 26.14 40.25 121.47 -156.13 -109.35 134.28 6.82 93.14 0.04 5.90 0.48 0.05 0.01 0.02 0.00 93.41 0.12 14 G E E 3.10 22.84 20.32 42.96 142.65 148.72 -155.77 172.26 2.27 97.71 0.01 1.77 0.28 0.03 0.00 0.00 0.00 97.88 0.03 15 K E E 81.98 8.56 26.53 36.14 123.88 -100.50 -116.57 139.34 0.86 99.13 0.01 0.72 0.05 0.00 0.00 0.00 0.00 99.20 0.02 16 V E E 18.59 22.27 14.97 37.61 109.76 -117.07 -76.01 126.37 1.31 98.68 0.01 1.16 0.05 0.01 0.00 0.00 0.00 98.72 0.05 17 I E E 73.92 7.67 21.80 30.17 102.33 176.54 -101.42 -21.07 6.82 93.07 0.11 5.61 0.75 0.14 0.04 0.05 0.00 93.21 0.19 18 G E E 30.54 6.05 21.70 28.51 142.46 -30.18 167.62 172.39 25.29 74.39 0.31 17.71 6.30 1.00 0.07 0.20 0.00 74.38 0.34 19 T C E 56.97 15.08 12.05 26.74 125.18 -130.38 -126.99 137.41 51.00 48.38 0.63 43.61 5.25 1.08 0.19 0.45 0.00 48.18 1.24 20 A C S 73.94 4.33 16.01 21.29 101.08 -161.31 -88.87 -17.72 68.86 29.28 1.86 19.92 39.71 9.88 0.24 1.47 0.02 27.36 1.40 21 M C S 93.88 5.97 13.71 21.15 122.76 30.76 -115.93 142.01 63.50 33.96 2.54 21.18 30.16 14.08 0.45 2.09 0.05 26.81 5.18 22 I C T 121.92 3.71 15.91 20.72 107.25 -100.07 -70.54 128.01 97.44 1.11 1.46 6.20 26.33 64.96 0.16 1.32 0.00 0.74 0.29 23 K C T 109.44 9.24 17.15 26.77 96.45 11.79 62.89 16.45 98.57 0.79 0.64 3.67 25.48 69.46 0.04 0.62 0.00 0.61 0.11 24 T E E 23.50 13.20 18.26 32.85 134.37 88.81 -133.49 152.91 18.11 81.80 0.09 12.47 5.54 0.70 0.02 0.07 0.00 79.89 1.30 25 A E E 4.75 21.47 18.01 40.26 127.57 -158.45 -123.48 143.44 6.21 93.79 0.00 5.62 0.24 0.01 0.00 0.00 0.00 94.05 0.08 26 K E E 46.20 11.42 25.95 38.32 119.56 -148.61 -109.78 130.04 1.10 98.89 0.00 0.93 0.04 0.00 0.00 0.00 0.00 99.02 0.01 27 V E E 3.44 25.13 18.31 44.20 123.18 -166.01 -117.00 134.29 0.11 99.89 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.90 0.00 28 R E E 70.70 10.51 26.18 37.10 119.27 -158.94 -111.67 130.79 0.08 99.92 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.92 0.00 29 A E E 5.93 22.52 16.91 39.60 123.08 -169.22 -117.56 134.03 0.73 99.27 0.00 0.72 0.02 0.00 0.00 0.00 0.00 99.25 0.01 30 T E E 50.34 9.27 22.32 32.04 112.90 -143.84 -89.39 133.28 6.67 93.33 0.01 5.20 0.97 0.05 0.00 0.00 0.00 93.74 0.03 31 R E E 77.95 11.52 19.40 31.19 128.09 17.42 -125.77 146.40 5.94 94.05 0.01 5.12 0.50 0.03 0.00 0.01 0.00 94.29 0.04 32 L E E 56.68 13.86 16.10 30.32 117.22 -132.16 -97.93 130.99 2.55 97.45 0.00 2.38 0.09 0.00 0.00 0.00 0.00 97.50 0.02 33 V E E 49.88 9.28 18.22 28.99 127.77 -176.58 -129.92 141.74 0.39 99.61 0.00 0.33 0.02 0.00 0.00 0.00 0.00 99.64 0.01 34 L E E 82.45 7.81 14.82 24.11 114.15 -118.96 -84.10 130.96 0.72 99.28 0.00 0.67 0.03 0.00 0.00 0.00 0.00 99.26 0.05 35 D E E 30.02 11.29 9.54 22.89 108.84 -143.09 -94.81 113.06 35.57 64.42 0.01 35.21 0.28 0.03 0.00 0.01 0.00 64.15 0.33 36 P C T 106.15 1.94 12.60 15.79 92.94 -162.88 -66.18 -25.99 98.26 0.10 1.64 0.17 1.81 96.26 0.03 1.64 0.00 0.06 0.02 37 Y C T 174.83 1.30 12.00 13.42 96.15 50.65 -74.55 -39.32 98.30 0.12 1.59 0.18 1.91 96.18 0.02 1.61 0.00 0.06 0.04 38 L C T 88.27 4.11 10.82 16.61 98.66 28.09 -101.00 -8.66 98.58 0.10 1.32 0.70 2.87 94.92 0.04 1.39 0.00 0.06 0.03 39 L C T 121.96 2.94 12.33 17.20 93.81 -127.93 57.51 38.68 99.43 0.28 0.29 16.26 3.60 79.64 0.08 0.15 0.00 0.24 0.03 40 K E E 90.13 5.00 13.57 20.55 131.38 125.77 -128.32 155.70 17.32 82.66 0.02 14.59 1.54 0.17 0.00 0.01 0.00 83.32 0.35 41 Y E E 109.66 9.88 12.64 23.67 118.49 -122.10 -99.73 136.27 0.49 99.51 0.00 0.44 0.01 0.00 0.00 0.00 0.00 99.51 0.04 42 F E E 66.87 9.44 14.71 26.04 126.37 -172.46 -126.34 143.25 0.63 99.37 0.00 0.55 0.02 0.00 0.00 0.00 0.00 99.42 0.00 43 N E E 89.78 8.40 14.54 24.26 117.95 -129.66 -95.50 136.86 1.08 98.92 0.00 0.91 0.03 0.00 0.00 0.00 0.00 99.05 0.00 44 K E E 78.47 9.43 14.86 25.76 129.04 -176.21 -131.96 144.68 0.68 99.32 0.00 0.59 0.02 0.00 0.00 0.00 0.00 99.40 0.00 45 R E E 132.52 7.59 15.29 24.74 120.83 -145.61 -109.97 136.28 1.09 98.91 0.00 0.97 0.02 0.00 0.00 0.00 0.00 99.01 0.01 46 K E E 65.78 11.59 15.62 28.25 132.18 176.82 -137.50 149.47 0.93 99.07 0.00 0.84 0.02 0.00 0.00 0.00 0.00 99.12 0.01 47 T E E 66.72 9.19 19.19 29.21 119.97 -138.90 -107.39 133.17 1.29 98.71 0.00 1.16 0.06 0.00 0.00 0.00 0.00 98.77 0.01 48 Y E E 22.18 19.90 17.01 37.05 128.42 -174.24 -127.43 143.27 1.21 98.79 0.00 1.12 0.03 0.00 0.00 0.00 0.00 98.82 0.02 49 F E E 64.74 11.48 25.06 36.88 118.95 -137.00 -99.17 136.65 1.59 98.41 0.00 1.51 0.04 0.00 0.00 0.00 0.00 98.39 0.06 50 A E E 3.07 24.98 18.12 43.56 127.30 -170.58 -125.03 142.22 8.51 91.47 0.02 8.12 0.28 0.02 0.00 0.01 0.00 91.18 0.38 51 H E E 58.61 10.31 25.43 36.38 117.90 -152.83 -108.15 127.46 24.79 75.13 0.07 20.77 3.63 0.26 0.02 0.07 0.00 72.82 2.44 52 D C C 13.13 20.30 14.55 35.00 110.63 -157.20 -115.76 97.42 89.03 10.75 0.22 84.78 3.53 0.62 0.05 0.17 0.00 9.72 1.13 53 A C T 66.23 5.64 18.21 25.32 93.30 -167.42 -66.64 -26.22 94.71 0.93 4.37 17.08 21.23 55.36 0.21 5.25 0.00 0.58 0.29 54 L C T 106.81 3.08 18.27 21.43 96.13 44.52 -91.95 -1.16 95.00 0.53 4.47 3.61 32.44 58.48 0.16 4.81 0.00 0.29 0.22 55 Q C S 94.08 11.96 14.93 27.05 94.56 -119.44 61.46 36.13 95.49 1.42 3.09 25.24 60.00 9.56 0.22 3.47 0.00 0.70 0.80 56 Q C C 103.20 5.44 22.79 28.66 105.21 129.92 -97.36 42.46 96.38 3.30 0.33 91.26 3.47 1.50 0.10 0.22 0.00 1.23 2.23 57 C C C 6.77 24.98 11.40 36.04 127.53 121.83 -122.64 149.34 95.90 4.04 0.06 95.07 1.40 0.12 0.02 0.03 0.00 1.53 1.83 58 S C C 55.01 4.33 26.01 30.70 133.84 -167.26 -129.08 162.34 97.23 2.74 0.03 96.18 1.33 0.08 0.01 0.01 0.00 0.67 1.72 59 V C T 75.65 12.93 17.66 30.45 110.23 -76.77 -60.30 134.78 99.58 0.34 0.08 0.22 2.39 97.14 0.00 0.04 0.00 0.13 0.08 60 G C T 29.91 8.10 21.32 30.49 97.41 26.80 90.45 -7.07 99.88 0.09 0.02 0.40 2.25 97.27 0.00 0.02 0.00 0.06 0.00 61 D C C 22.75 16.11 19.18 36.27 118.12 133.81 -70.06 145.45 94.85 5.15 0.00 93.87 1.37 0.02 0.00 0.00 0.00 4.61 0.13 62 I E E 41.84 13.55 25.34 39.32 116.62 -129.04 -95.47 130.45 0.61 99.39 0.00 0.63 0.01 0.00 0.00 0.00 0.00 99.29 0.07 63 V E E 2.11 26.32 19.48 46.54 131.05 -174.99 -127.73 151.20 0.04 99.96 0.00 0.03 0.00 0.00 0.00 0.00 0.00 99.97 0.00 64 L E E 26.48 13.25 27.34 41.74 116.97 -131.33 -100.08 130.49 0.03 99.97 0.00 0.03 0.00 0.00 0.00 0.00 0.00 99.97 0.00 65 L E E 3.76 26.17 18.43 45.37 121.11 -160.68 -110.13 133.81 0.11 99.89 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.89 0.00 66 R E E 83.83 9.98 25.67 35.80 131.28 -175.32 -129.10 148.30 0.36 99.64 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.67 0.00 67 A E E 45.26 13.35 19.22 32.40 113.73 -106.99 -70.31 138.97 2.75 97.25 0.00 2.54 0.10 0.01 0.00 0.00 0.00 97.26 0.10 68 L C C 24.43 17.69 11.11 28.93 119.02 -136.67 -92.62 143.07 62.61 37.37 0.03 59.79 1.44 0.07 0.00 0.02 0.00 38.12 0.56 69 P C S 102.48 2.28 18.07 20.20 94.86 -117.60 -66.97 -27.22 93.08 6.84 0.08 25.05 66.05 1.78 0.01 0.09 0.00 6.66 0.35 70 V C S 97.71 2.92 15.09 18.96 122.85 28.74 -116.88 132.14 95.19 4.60 0.21 9.04 83.53 3.03 0.02 0.15 0.00 3.65 0.58 71 P C C 69.60 10.76 10.08 21.52 112.71 -111.59 -66.26 142.41 93.58 5.88 0.54 82.24 7.76 3.40 0.10 0.57 0.00 4.83 1.11 72 R C C 157.56 3.47 13.49 18.38 98.77 -162.20 -86.66 -20.64 82.91 15.98 1.11 53.58 24.46 5.15 0.33 0.96 0.00 7.63 7.89 73 S C C 43.48 6.05 12.52 20.45 134.47 17.57 -138.66 162.55 80.72 18.43 0.86 51.25 25.42 4.69 0.26 0.71 0.00 8.48 9.18 74 K C S 164.19 1.79 14.20 16.88 92.85 -110.00 -69.56 -20.63 98.29 1.09 0.62 3.49 61.57 33.49 0.07 0.44 0.00 0.72 0.23 75 H C S 110.97 6.10 15.47 22.49 99.27 53.85 -90.99 -8.99 96.44 3.13 0.43 4.31 59.33 33.05 0.03 0.36 0.00 2.57 0.35 76 V E E 28.02 16.73 13.23 30.20 120.52 55.45 -113.32 125.78 43.85 55.97 0.18 35.36 7.07 0.79 0.07 0.15 0.00 49.35 7.21 77 K E E 70.93 9.93 22.03 32.48 126.56 -172.99 -122.83 141.65 35.19 64.73 0.08 31.06 2.48 0.41 0.02 0.07 0.00 64.97 0.99 78 H E E 17.86 22.20 16.51 38.48 129.70 -167.55 -128.02 147.08 19.29 80.66 0.04 16.21 2.10 0.26 0.01 0.03 0.00 81.11 0.28 79 E E E 65.04 9.17 25.64 35.49 125.70 -157.82 -122.45 139.26 3.60 96.40 0.01 3.21 0.22 0.01 0.00 0.00 0.00 96.46 0.09 80 L E E 21.69 21.84 15.29 37.31 110.30 -114.77 -75.56 126.14 0.73 99.26 0.00 0.71 0.01 0.00 0.00 0.00 0.00 99.25 0.02 81 A E E 46.79 8.04 20.83 29.76 101.07 175.72 -91.49 -36.64 1.47 98.51 0.02 1.03 0.23 0.01 0.00 0.01 0.00 98.70 0.01 82 E E E 91.53 4.37 23.56 28.39 137.33 -2.83 -152.15 148.35 0.67 99.31 0.02 0.51 0.06 0.00 0.00 0.01 0.00 99.41 0.00 83 I E E 60.44 17.51 13.36 30.35 110.27 -126.91 -87.11 120.61 0.62 99.37 0.00 0.61 0.01 0.00 0.00 0.00 0.00 99.36 0.01 84 I E E 70.28 8.44 17.82 27.60 100.86 177.15 -93.67 -33.88 5.84 94.13 0.03 4.36 1.13 0.08 0.00 0.02 0.00 94.32 0.08 85 F E E 80.82 8.89 18.05 28.11 132.37 3.33 -148.57 136.43 18.39 81.51 0.10 12.01 6.55 0.45 0.02 0.08 0.00 80.57 0.32 86 K E E 118.42 9.09 16.57 26.82 114.95 -145.45 -88.95 128.31 48.98 50.66 0.37 40.43 6.14 1.16 0.06 0.34 0.00 51.10 0.77 87 V C C 50.50 13.66 14.38 28.26 106.65 -162.17 -103.04 24.94 75.02 23.24 1.74 49.12 19.06 7.35 0.34 1.63 0.00 19.88 2.62 88 G C S 34.11 4.70 18.75 24.43 123.18 -109.03 87.63 -162.28 81.61 17.51 0.87 35.44 37.18 9.34 0.09 0.95 0.00 15.62 1.38 89 R C C 148.61 4.70 18.49 24.32 113.85 -25.39 -90.90 125.73 73.77 25.52 0.72 50.93 18.18 4.44 0.10 0.77 0.00 24.14 1.44 90 V C E 34.49 17.03 13.11 30.15 121.98 -163.91 -111.44 138.06 50.92 48.90 0.19 43.41 6.08 0.64 0.04 0.17 0.00 47.85 1.80 91 I E E 79.62 6.86 20.04 27.87 123.74 -161.41 -116.69 138.53 10.04 89.87 0.09 8.77 0.68 0.05 0.10 0.02 0.00 49.04 41.34 92 D C C 24.13 15.73 11.71 28.46 108.93 -117.43 -75.13 123.80 92.23 7.75 0.02 92.42 0.63 0.08 0.01 0.01 0.00 6.15 0.70 93 P C T 80.79 6.41 15.69 23.73 92.60 -149.76 -66.42 -22.16 99.82 0.05 0.13 0.59 3.69 95.56 0.01 0.10 0.00 0.03 0.01 94 V C T 97.09 4.29 15.35 20.81 99.50 43.88 -82.18 -39.75 99.79 0.06 0.14 0.22 3.05 96.59 0.00 0.09 0.00 0.03 0.01 95 T C T 70.92 4.61 14.07 20.05 101.39 21.39 -105.54 -16.23 99.70 0.15 0.14 0.97 4.59 94.21 0.01 0.10 0.00 0.08 0.03 96 G C C 43.80 5.44 13.81 21.04 94.86 -122.97 79.17 8.43 99.17 0.71 0.12 78.55 12.77 7.82 0.02 0.11 0.00 0.43 0.30 97 K C C 91.07 5.84 15.55 23.16 120.11 139.50 -82.69 147.76 91.70 8.26 0.04 80.49 11.13 0.27 0.01 0.03 0.00 7.14 0.93 98 P E E 68.13 7.58 18.65 27.04 114.13 -103.08 -66.13 145.32 5.25 94.71 0.04 4.91 0.29 0.03 0.04 0.01 0.00 68.43 26.28 99 C E E 20.28 19.27 11.94 30.82 125.04 -152.73 -115.92 143.14 22.83 77.03 0.14 19.76 2.94 0.37 0.05 0.10 0.00 75.25 1.53 100 A E E 58.58 6.31 18.81 26.17 117.26 -168.19 -124.67 115.98 27.90 71.20 0.90 15.73 9.29 4.66 0.25 0.81 0.01 62.94 6.32 101 G C T 42.59 4.59 17.76 23.26 113.63 -34.79 66.36 -140.09 96.63 2.31 1.06 4.32 20.40 71.83 0.08 1.10 0.00 1.90 0.37 102 T C T 82.09 9.52 15.01 25.25 97.62 -26.08 -92.73 4.75 97.12 1.78 1.10 5.46 21.93 69.65 0.09 1.15 0.00 1.45 0.27 103 A E E 58.96 5.39 19.08 25.64 123.01 91.69 -106.79 141.01 21.69 77.89 0.42 12.02 8.45 2.34 0.14 0.34 0.01 69.17 7.52 104 Y E E 57.13 17.74 11.76 28.87 114.70 -129.40 -86.53 134.15 17.79 81.87 0.34 13.87 2.50 0.64 0.19 0.22 0.00 74.03 8.56 105 L C C 79.40 8.59 16.02 25.60 103.85 -149.23 -86.85 18.74 68.60 30.01 1.39 47.82 15.12 5.37 0.37 1.13 0.00 27.89 2.30 106 E C C 111.16 6.10 14.53 21.89 117.80 59.12 -98.85 137.41 88.80 9.69 1.51 47.43 34.65 7.26 0.33 1.28 0.00 7.05 1.99 107 S C C 59.91 6.57 12.96 20.88 115.61 -104.39 -87.48 139.62 95.02 3.02 1.95 69.56 20.89 4.54 0.45 1.65 0.00 1.94 0.97 108 P C C 83.44 7.23 11.76 20.35 100.53 -123.72 -70.99 -9.52 91.30 2.18 6.52 53.54 13.89 23.25 0.98 6.28 0.00 1.28 0.77 109 L C C 103.14 5.68 11.89 18.89 103.50 70.29 -85.90 7.39 90.23 3.52 6.25 56.07 13.54 20.21 1.21 5.51 0.00 2.02 1.44 110 S C C 64.85 6.48 11.05 19.03 111.69 90.47 -91.40 125.73 93.49 2.42 4.08 77.52 10.83 5.19 1.13 2.87 0.00 1.42 1.03 111 E C C 115.98 4.91 12.06 18.51 115.71 -120.99 -89.87 135.38 93.20 2.51 4.29 77.91 12.29 3.21 2.14 1.97 0.00 1.46 1.02 112 P C C 85.37 5.79 12.22 19.50 110.43 -105.26 -73.40 138.37 82.98 4.21 12.80 69.72 7.14 6.42 5.28 7.22 0.00 2.69 1.52 113 R C C 128.34 7.95 10.48 19.49 108.49 -132.76 -85.23 121.25 74.31 5.75 19.95 58.04 8.74 7.57 7.32 12.74 0.00 3.76 1.83 114 E C C 123.68 4.35 12.20 18.05 110.27 -135.21 -87.17 118.88 69.58 7.58 22.84 51.88 9.89 8.01 7.62 15.29 0.01 5.35 1.95 115 E C C 119.33 5.11 12.63 19.19 110.11 -127.69 -84.04 123.15 68.00 11.56 20.44 49.07 10.30 8.85 7.00 13.44 0.02 8.50 2.81 116 L C C 70.28 12.44 9.14 21.48 113.25 -145.61 -92.10 124.50 72.50 14.53 12.96 54.39 10.98 7.08 4.87 8.23 0.01 11.36 3.07 117 K C C 137.03 3.30 14.15 18.84 113.96 -157.17 -96.06 122.98 74.75 19.25 6.00 61.92 7.55 4.36 2.99 3.14 0.00 15.74 4.29 118 V C C 85.09 9.34 8.91 18.95 110.18 -159.35 -91.36 109.71 84.30 12.94 2.76 80.00 1.71 2.76 1.60 0.92 0.00 9.66 3.35 119 S C C 77.21 3.65 13.13 18.19 109.95 120.45 -93.29 106.92 99.78 0.20 0.02 99.70 0.09 0.05 0.00 0.00 0.00 0.13 0.01