# 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 R C C 148.67 4.70 12.45 18.82 114.29 -152.60 -92.16 127.02 99.91 0.08 0.02 99.83 0.08 0.04 0.00 0.00 0.00 0.03 0.01 1 E C C 129.71 3.94 10.58 16.31 111.80 -146.91 -90.97 127.45 95.73 2.08 2.19 86.59 1.74 7.84 0.62 1.16 0.00 1.48 0.58 2 N C C 103.88 4.54 10.90 17.07 109.91 -151.78 -90.50 114.00 91.57 5.55 2.88 54.09 20.18 17.18 0.40 2.90 0.00 4.30 0.96 3 K C C 115.27 7.55 11.61 20.47 115.54 -156.42 -93.11 135.67 81.43 16.12 2.45 57.23 16.19 7.39 0.32 2.52 0.00 15.28 1.07 4 K C C 97.95 8.72 15.00 24.72 119.52 -152.08 -99.82 138.17 59.90 39.02 1.08 49.67 7.46 1.97 0.20 0.90 0.00 38.75 1.06 5 E E E 95.21 10.02 17.46 28.11 121.04 -144.23 -104.61 134.31 30.72 68.95 0.33 27.11 2.90 0.49 0.09 0.23 0.00 68.27 0.90 6 L E E 27.48 17.65 16.44 34.21 125.16 -169.89 -119.17 139.93 17.93 81.98 0.09 16.41 1.18 0.15 0.03 0.06 0.00 81.67 0.51 7 I E E 65.97 9.95 23.63 33.92 120.85 -152.08 -110.03 132.28 12.25 87.71 0.04 11.16 0.59 0.07 0.01 0.02 0.00 87.92 0.25 8 G E E 6.84 20.38 17.15 37.17 140.87 141.59 -149.14 170.30 5.90 94.08 0.02 4.61 0.76 0.07 0.00 0.01 0.00 94.49 0.06 9 K E E 98.58 6.18 25.06 31.97 124.30 -97.34 -117.67 140.86 2.10 97.88 0.01 1.80 0.13 0.01 0.00 0.00 0.00 98.00 0.05 10 V E E 27.75 20.88 13.30 34.13 109.96 -116.22 -75.79 126.19 1.98 98.00 0.02 1.81 0.07 0.01 0.01 0.01 0.00 98.01 0.08 11 V E E 72.10 6.18 20.43 27.51 102.26 176.16 -100.40 -25.83 6.03 93.91 0.06 4.66 1.05 0.12 0.01 0.04 0.00 93.97 0.15 12 S E E 53.82 5.74 19.66 26.36 137.59 0.62 -151.66 152.54 18.11 81.72 0.17 11.85 5.50 0.71 0.03 0.12 0.00 81.50 0.29 13 D C E 69.61 12.50 12.08 24.75 116.47 -162.42 -122.10 115.92 49.90 49.65 0.45 40.95 6.03 1.19 0.09 0.35 0.00 50.92 0.48 14 K C E 134.15 3.97 14.79 19.94 101.57 174.45 -95.39 -8.04 61.94 36.60 1.46 22.98 29.11 10.77 0.18 1.34 0.01 34.46 1.16 15 M C E 95.44 5.50 12.48 19.44 120.63 74.39 -109.80 152.89 62.01 35.39 2.60 18.28 27.32 18.85 0.39 2.34 0.03 27.83 4.96 16 S C T 89.12 2.27 15.23 18.06 96.60 -79.57 -63.99 -18.59 98.40 0.53 1.08 4.03 31.93 62.46 0.08 1.02 0.00 0.34 0.14 17 K C T 112.63 8.19 14.89 23.64 100.31 17.99 -105.07 3.98 98.54 0.82 0.64 2.80 32.76 63.05 0.03 0.62 0.00 0.64 0.10 18 T E E 32.24 11.53 17.09 30.18 132.01 63.96 -131.71 147.38 16.02 83.93 0.05 11.84 3.57 0.37 0.01 0.04 0.00 83.57 0.61 19 I E E 12.64 19.16 17.19 37.29 122.91 -153.99 -115.51 136.20 2.13 97.86 0.00 1.90 0.06 0.00 0.00 0.00 0.00 98.01 0.03 20 V E E 26.99 10.99 24.27 36.82 118.36 -154.59 -109.30 128.52 0.24 99.76 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.79 0.00 21 V E E 5.69 23.11 17.86 41.62 121.28 -166.00 -113.41 130.92 0.09 99.91 0.00 0.08 0.00 0.00 0.00 0.00 0.00 99.92 0.00 22 E E E 44.92 10.09 24.28 35.41 118.81 -156.17 -106.10 130.89 0.11 99.89 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.90 0.00 23 I E E 14.89 19.30 16.50 36.36 120.24 -164.28 -114.11 129.59 0.40 99.60 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.62 0.00 24 V E E 56.99 8.89 19.81 29.73 116.47 -160.06 -103.66 129.73 1.94 98.05 0.00 1.63 0.12 0.01 0.00 0.00 0.00 98.23 0.01 25 Q E E 59.88 10.37 16.10 27.65 129.43 172.88 -130.87 147.65 2.14 97.85 0.01 1.80 0.16 0.01 0.00 0.00 0.00 98.01 0.02 26 R E E 121.70 8.22 15.14 24.60 118.96 -135.05 -105.08 132.45 1.95 98.04 0.01 1.68 0.10 0.01 0.00 0.00 0.00 98.18 0.02 27 K E E 76.51 8.48 14.84 24.93 128.98 -174.28 -130.94 148.41 1.60 98.39 0.01 1.30 0.11 0.01 0.00 0.00 0.00 98.54 0.03 28 M E E 107.58 4.60 14.14 20.35 115.17 -122.56 -89.77 131.79 2.27 97.72 0.01 1.98 0.15 0.01 0.00 0.00 0.00 97.64 0.21 29 H E E 43.19 11.31 7.93 20.74 109.90 -137.23 -89.11 118.02 40.03 59.92 0.05 38.52 0.71 0.10 0.01 0.03 0.00 60.12 0.51 30 P C T 106.28 1.52 11.93 14.13 93.35 -152.31 -64.74 -27.48 96.90 0.28 2.82 0.58 3.22 92.90 0.07 2.98 0.00 0.19 0.06 31 I C T 130.11 1.36 11.19 13.00 96.97 47.38 -76.00 -38.83 97.03 0.27 2.70 0.43 3.19 93.22 0.05 2.86 0.00 0.15 0.10 32 Y C T 127.08 3.40 10.03 14.99 100.93 25.79 -103.70 -6.09 97.36 0.31 2.33 1.17 4.10 91.76 0.06 2.63 0.00 0.21 0.07 33 H C T 156.44 1.65 11.66 14.59 94.79 -127.36 57.83 35.89 98.82 0.83 0.35 27.62 5.47 65.73 0.07 0.22 0.00 0.81 0.08 34 K E E 101.82 3.66 11.60 17.30 129.51 124.71 -123.46 155.29 32.04 67.93 0.03 27.88 2.04 0.21 0.00 0.02 0.00 69.53 0.30 35 Y E E 135.50 6.34 11.62 19.87 117.62 -123.52 -97.88 134.21 0.69 99.31 0.00 0.61 0.02 0.00 0.00 0.00 0.00 99.34 0.03 36 L E E 56.97 9.09 12.74 23.85 125.22 -170.30 -121.51 141.33 0.27 99.73 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.76 0.00 37 K E E 123.57 6.19 14.41 22.59 118.43 -139.61 -100.53 133.28 0.22 99.78 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.81 0.00 38 V E E 50.36 10.04 13.98 25.77 127.61 -176.51 -128.63 143.83 0.22 99.78 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.81 0.00 39 S E E 59.00 8.78 14.99 25.12 123.02 -148.90 -114.26 140.93 0.73 99.27 0.00 0.65 0.01 0.00 0.00 0.00 0.00 99.34 0.00 40 K E E 71.31 11.17 15.71 27.91 130.15 -174.55 -133.10 144.69 0.94 99.06 0.00 0.86 0.02 0.00 0.00 0.00 0.00 99.10 0.01 41 K E E 113.49 7.41 18.96 27.62 118.48 -135.35 -102.69 130.67 2.75 97.25 0.00 2.59 0.10 0.00 0.00 0.00 0.00 97.27 0.03 42 V E E 15.08 20.00 15.51 35.74 126.74 -172.52 -124.13 141.75 5.84 94.15 0.00 5.58 0.21 0.01 0.00 0.00 0.00 94.03 0.17 43 K E E 88.09 9.03 24.73 34.20 121.63 -146.65 -103.24 137.27 9.20 90.79 0.01 8.83 0.41 0.03 0.00 0.01 0.00 90.07 0.65 44 A E E 4.59 24.34 16.61 41.21 129.28 -173.12 -127.36 146.97 25.27 74.68 0.05 24.20 0.95 0.10 0.01 0.04 0.00 73.47 1.24 45 H E E 67.26 9.55 24.22 34.29 122.54 -149.16 -117.00 134.19 31.79 68.09 0.11 28.62 2.32 0.24 0.04 0.09 0.00 62.41 6.28 46 D C C 19.18 20.01 13.04 32.60 113.67 -171.23 -115.75 109.85 86.22 13.53 0.25 83.35 2.41 0.52 0.06 0.18 0.00 11.90 1.59 47 E C T 128.72 3.63 17.56 22.36 94.37 -159.78 -70.21 -26.30 96.72 1.24 2.04 21.06 27.39 47.83 0.14 2.40 0.00 0.84 0.33 48 K C T 138.46 2.13 18.02 19.65 98.17 39.46 -94.92 1.76 97.16 0.75 2.09 4.49 40.68 51.90 0.10 2.14 0.00 0.45 0.24 49 E C S 92.47 12.45 13.85 26.50 95.64 -117.96 61.69 34.49 94.95 3.51 1.54 31.54 56.41 6.91 0.15 1.67 0.00 2.14 1.18 50 V C C 78.20 6.14 22.38 28.92 113.03 135.01 -97.93 110.81 89.80 9.92 0.29 85.45 3.47 0.79 0.10 0.18 0.00 4.56 5.44 51 S C C 7.02 24.55 11.37 35.43 127.70 144.09 -121.83 146.24 89.37 10.52 0.11 88.83 1.71 0.23 0.04 0.06 0.00 5.76 3.36 52 K C C 110.89 3.36 25.21 28.91 132.10 -166.76 -127.97 157.48 93.87 6.08 0.05 92.68 1.92 0.19 0.02 0.02 0.00 2.54 2.65 53 V C T 78.04 12.21 15.99 28.45 110.24 -80.25 -59.54 134.63 99.61 0.29 0.10 0.12 1.43 98.23 0.00 0.05 0.00 0.12 0.05 54 G C T 38.95 4.99 20.59 26.62 96.53 26.15 89.79 -7.18 99.93 0.04 0.03 0.20 1.37 98.38 0.00 0.02 0.00 0.03 0.00 55 D C C 26.86 15.30 16.17 32.71 117.71 133.23 -70.63 145.73 97.73 2.27 0.00 97.13 0.82 0.01 0.00 0.00 0.00 1.99 0.05 56 K E E 87.22 8.83 24.53 33.89 118.09 -133.01 -99.21 134.62 0.67 99.33 0.00 0.68 0.01 0.00 0.00 0.00 0.00 99.21 0.11 57 V E E 3.96 25.58 15.92 42.20 131.97 -174.25 -131.47 151.84 0.06 99.94 0.00 0.05 0.00 0.00 0.00 0.00 0.00 99.94 0.00 58 K E E 69.13 8.93 26.62 36.50 118.20 -130.62 -101.40 133.31 0.04 99.96 0.00 0.04 0.00 0.00 0.00 0.00 0.00 99.96 0.00 59 I E E 10.01 24.14 16.55 40.97 119.09 -154.33 -107.40 130.10 0.13 99.87 0.00 0.12 0.00 0.00 0.00 0.00 0.00 99.88 0.00 60 I E E 47.43 10.01 23.01 33.84 127.56 -173.13 -123.72 145.95 0.62 99.38 0.00 0.54 0.01 0.00 0.00 0.00 0.00 99.44 0.01 61 E E E 90.84 10.75 18.62 29.67 114.33 -118.18 -79.74 134.74 2.55 97.44 0.00 2.33 0.11 0.00 0.00 0.00 0.00 97.49 0.07 62 V E E 36.73 14.21 12.72 27.61 129.09 -174.66 -124.41 152.53 37.87 62.09 0.04 35.51 1.42 0.09 0.01 0.03 0.00 62.36 0.60 63 R C C 161.61 2.12 17.02 19.37 114.36 -110.10 -86.06 136.48 75.75 24.09 0.17 55.69 17.52 1.12 0.03 0.17 0.00 24.81 0.67 64 P C C 66.79 10.73 9.12 20.45 112.00 -106.84 -67.36 139.88 86.52 12.75 0.72 66.63 16.00 3.46 0.15 0.65 0.00 11.79 1.32 65 I C S 126.20 2.22 11.96 15.25 98.52 -165.61 -85.52 -28.45 85.18 13.93 0.89 31.98 48.07 5.83 0.19 0.77 0.00 9.22 3.93 66 S C S 56.74 2.56 12.64 16.08 133.81 12.51 -143.26 164.84 81.61 17.21 1.19 24.69 50.50 6.87 0.27 0.95 0.01 10.46 6.24 67 K C T 171.13 1.31 10.90 13.20 92.20 -100.09 -64.83 -26.06 97.28 0.78 1.94 2.40 44.68 50.56 0.16 1.48 0.00 0.45 0.26 68 D C T 109.42 2.09 13.68 16.21 96.95 52.22 -90.27 -4.76 96.42 2.15 1.44 3.87 44.32 48.55 0.10 1.22 0.00 1.57 0.35 69 K C C 71.18 11.28 13.34 25.52 116.68 59.84 -116.89 121.03 58.58 40.74 0.68 46.68 8.79 2.43 0.15 0.61 0.00 38.12 3.22 70 R E E 67.15 12.10 18.16 31.10 129.50 157.91 -125.00 149.37 35.13 64.81 0.05 31.32 2.55 0.27 0.01 0.05 0.00 65.01 0.80 71 W E E 23.72 20.44 17.74 38.36 127.15 -149.70 -121.84 142.84 8.44 91.55 0.01 7.41 0.50 0.03 0.00 0.00 0.00 91.94 0.12 72 S E E 25.14 11.47 24.86 37.25 125.85 -161.74 -123.89 140.95 0.55 99.45 0.00 0.49 0.02 0.00 0.00 0.00 0.00 99.48 0.01 73 L E E 17.75 21.79 15.99 38.16 109.55 -114.52 -76.22 124.85 0.25 99.75 0.00 0.24 0.00 0.00 0.00 0.00 0.00 99.75 0.01 74 V E E 60.95 8.37 21.28 30.56 101.37 176.25 -97.66 -32.36 0.81 99.18 0.00 0.56 0.12 0.01 0.00 0.00 0.00 99.31 0.00 75 E E E 91.83 4.06 24.01 28.39 137.07 -1.99 -150.94 148.63 0.40 99.59 0.00 0.31 0.04 0.00 0.00 0.00 0.00 99.65 0.00 76 V E E 49.01 18.10 12.73 30.19 110.23 -128.00 -88.86 120.06 0.34 99.66 0.00 0.34 0.01 0.00 0.00 0.00 0.00 99.65 0.00 77 L E E 76.11 6.77 17.59 25.73 101.01 176.91 -93.08 -34.08 1.63 98.36 0.01 1.26 0.19 0.01 0.00 0.00 0.00 98.52 0.02 78 E E E 95.82 4.77 19.28 25.10 136.13 -0.02 -149.07 149.10 3.26 96.71 0.02 2.60 0.42 0.05 0.00 0.01 0.00 96.84 0.08 79 K E E 109.43 11.17 12.42 24.28 119.96 -149.13 -107.76 132.93 20.42 79.47 0.12 18.38 1.40 0.26 0.03 0.08 0.00 79.21 0.64 80 L C C 68.76 10.14 10.19 21.43 115.41 -132.09 -84.88 141.78 84.37 15.46 0.17 82.31 1.10 0.69 0.03 0.12 0.00 15.19 0.55 81 K C C 161.61 1.66 15.46 17.51 109.20 -116.59 -80.47 130.02 99.83 0.17 0.00 99.73 0.12 0.03 0.00 0.00 0.00 0.11 0.01