# 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 125.11 3.99 10.20 15.99 113.58 -170.14 -93.75 127.30 99.63 0.35 0.02 99.55 0.15 0.06 0.01 0.00 0.00 0.20 0.04 1 N C C 124.30 1.90 8.62 12.16 111.73 -160.01 -95.83 116.28 85.26 13.94 0.81 81.57 2.29 1.40 0.41 0.33 0.00 6.97 7.05 2 H C C 136.81 2.66 7.40 12.04 117.16 -165.68 -98.64 133.40 93.76 5.82 0.42 76.90 15.33 1.61 0.14 0.30 0.00 3.97 1.75 3 P C C 102.36 2.50 8.47 12.82 111.81 -113.17 -70.45 146.79 93.46 3.89 2.65 72.71 9.19 11.45 0.57 2.15 0.00 2.79 1.14 4 T C C 112.02 1.75 8.54 11.76 110.43 -131.10 -91.74 119.14 87.95 7.79 4.27 55.85 17.20 14.90 1.02 3.39 0.00 4.42 3.20 5 S C C 84.61 2.54 8.02 12.44 114.73 -159.36 -99.05 127.83 85.76 8.94 5.30 48.96 23.94 13.04 1.37 4.07 0.01 5.24 3.36 6 T C C 108.44 1.89 8.52 12.02 112.22 -163.36 -99.39 120.05 85.60 8.22 6.18 46.45 20.06 19.65 1.54 4.56 0.01 4.93 2.81 7 G C C 54.50 2.64 9.16 13.51 115.88 -159.87 -119.01 165.32 87.61 6.63 5.76 42.21 23.28 22.74 1.21 4.45 0.01 3.98 2.12 8 G C C 52.95 2.98 9.31 14.01 115.71 -90.98 -148.16 165.29 86.69 7.31 6.00 46.95 23.11 17.08 1.25 4.80 0.00 4.46 2.34 9 T C C 105.57 2.28 10.11 13.83 113.83 -99.17 -94.42 131.41 82.75 10.89 6.36 54.36 17.18 11.08 1.54 5.10 0.01 7.22 3.51 10 A C C 80.89 3.26 8.75 13.85 112.55 -127.22 -88.65 131.90 82.11 13.10 4.79 53.53 17.86 10.63 1.21 3.84 0.01 8.94 3.97 11 F C C 144.50 3.55 8.76 14.18 112.98 -158.40 -97.63 121.70 82.67 14.90 2.43 56.24 20.38 5.78 0.79 1.85 0.00 8.63 6.33 12 N C C 121.12 2.01 10.61 14.01 114.86 -136.94 -101.95 121.05 93.22 6.57 0.21 69.95 22.92 0.79 0.07 0.16 0.00 4.09 2.02 13 P C C 85.11 4.97 9.09 16.08 116.76 -120.52 -71.18 150.40 98.11 1.75 0.13 87.09 10.24 0.88 0.03 0.10 0.00 1.15 0.50 14 P C C 95.83 3.73 10.34 15.90 112.53 -101.33 -67.41 148.23 96.77 2.63 0.61 84.72 9.42 2.45 0.14 0.50 0.00 1.45 1.33 15 R C C 171.13 2.33 10.98 15.13 115.47 -113.27 -87.30 136.63 94.14 4.93 0.93 76.25 15.26 2.22 0.24 0.77 0.00 2.53 2.71 16 P C C 86.27 6.44 9.47 17.62 113.80 -107.49 -70.71 148.07 92.18 4.87 2.95 71.95 13.27 6.39 0.53 2.87 0.00 3.16 1.82 17 A C C 75.29 3.59 12.49 17.64 115.61 -126.17 -84.85 145.64 89.21 7.55 3.24 60.43 21.51 7.19 0.47 3.23 0.00 5.64 1.53 18 T C C 94.24 4.18 13.43 19.20 114.31 -98.10 -80.90 135.68 80.58 17.52 1.90 60.86 14.78 4.21 0.23 1.92 0.00 16.86 1.13 19 M E E 57.59 12.11 12.05 25.21 127.61 -172.23 -125.38 146.78 39.06 60.66 0.27 35.00 3.14 0.41 0.05 0.23 0.00 60.33 0.83 20 I E E 77.26 7.67 18.95 27.67 119.32 -136.62 -108.43 131.06 7.74 92.24 0.01 7.20 0.44 0.02 0.00 0.01 0.00 92.16 0.17 21 Y E E 29.82 17.40 15.20 33.16 125.27 -169.72 -118.42 142.10 0.71 99.29 0.00 0.61 0.05 0.00 0.00 0.00 0.00 99.31 0.02 22 L E E 59.42 7.89 21.54 30.54 116.66 -142.64 -103.74 127.89 0.89 99.11 0.00 0.85 0.03 0.00 0.00 0.00 0.00 98.91 0.21 23 C C C 10.49 17.74 12.27 31.40 109.57 -125.46 -75.33 125.06 50.78 49.20 0.02 50.57 0.45 0.03 0.00 0.01 0.00 48.22 0.71 24 A C T 55.21 7.12 17.03 25.72 93.72 -154.35 -68.98 -27.01 99.29 0.33 0.38 0.69 6.65 91.88 0.01 0.44 0.00 0.29 0.04 25 D C T 97.38 3.48 16.39 20.68 98.17 47.68 -78.70 -38.58 99.45 0.11 0.44 0.13 3.49 95.90 0.00 0.39 0.00 0.06 0.03 26 C C T 68.14 4.91 14.11 20.37 101.51 20.24 -105.48 -11.74 99.45 0.12 0.42 0.35 4.33 94.80 0.01 0.42 0.00 0.06 0.02 27 G C C 49.01 4.03 13.98 19.67 95.04 -121.18 75.84 8.71 99.38 0.49 0.12 85.87 6.42 7.09 0.03 0.09 0.00 0.28 0.23 28 A C C 48.81 6.02 13.76 21.82 118.17 147.85 -75.92 144.78 95.49 4.49 0.02 94.21 1.69 0.10 0.00 0.01 0.00 3.56 0.42 29 R E E 151.42 5.14 15.14 22.57 120.12 -140.42 -105.42 135.14 3.66 96.33 0.02 3.45 0.24 0.02 0.01 0.00 0.00 93.70 2.58 30 N E E 49.58 12.35 12.87 26.18 131.86 175.43 -137.45 152.75 5.17 94.82 0.01 4.74 0.31 0.02 0.00 0.00 0.00 94.78 0.14 31 T E E 91.57 3.50 19.35 23.48 117.21 -127.20 -99.86 131.87 15.46 84.48 0.06 13.77 1.39 0.13 0.01 0.04 0.00 84.16 0.50 32 I C C 36.95 17.71 9.66 26.76 121.18 -165.89 -108.57 134.98 57.60 41.97 0.42 52.77 3.63 0.54 0.12 0.28 0.00 40.62 2.04 33 Q C C 107.94 3.18 17.06 20.77 118.89 -149.43 -101.57 141.72 81.81 17.47 0.72 75.03 4.96 1.24 0.23 0.51 0.00 14.85 3.18 34 A C T 66.57 7.40 10.92 19.63 107.33 -99.97 -65.15 136.28 88.57 7.17 4.26 17.78 26.04 45.29 0.48 3.76 0.00 5.54 1.11 35 K C T 160.67 1.80 14.35 16.50 97.68 18.75 56.04 5.36 91.00 4.89 4.10 17.30 28.70 45.04 0.40 3.90 0.00 3.90 0.77 36 E C S 102.30 4.87 13.24 19.85 121.51 103.18 -102.47 144.27 88.81 8.57 2.62 33.24 47.79 8.17 0.45 2.29 0.00 5.89 2.18 37 V C C 79.95 6.92 15.05 23.24 114.46 -109.84 -79.08 135.65 84.37 14.90 0.73 70.76 9.28 3.39 0.19 0.60 0.00 14.26 1.52 38 I C C 36.80 16.05 12.65 29.11 118.97 -153.11 -107.66 132.39 61.60 38.14 0.26 53.04 6.57 0.79 0.07 0.22 0.00 37.73 1.58 39 R E E 116.62 6.20 20.28 27.40 124.79 -162.94 -118.05 139.89 13.33 86.50 0.17 12.98 0.54 0.08 0.17 0.04 0.00 48.95 37.23 40 C C C 15.29 18.20 10.24 28.70 109.58 -114.91 -74.37 127.63 77.56 22.37 0.08 79.06 0.50 0.06 0.03 0.03 0.00 17.30 3.03 41 R C T 158.23 2.97 16.04 20.16 93.74 -152.46 -69.70 -29.26 99.46 0.28 0.26 1.91 6.87 90.70 0.02 0.22 0.00 0.20 0.08 42 E C T 131.51 2.36 15.13 18.13 98.18 45.78 -79.25 -38.33 99.66 0.13 0.21 0.16 3.25 96.38 0.00 0.11 0.00 0.06 0.03 43 C C T 59.88 6.36 13.20 21.22 102.87 20.57 -108.15 -11.95 99.59 0.20 0.21 0.67 3.99 95.07 0.01 0.12 0.00 0.10 0.04 44 G C C 42.33 4.42 15.64 21.48 95.60 -119.02 81.01 6.25 95.82 4.06 0.11 85.89 7.91 1.98 0.04 0.09 0.00 2.68 1.42 45 H C C 67.20 9.61 13.49 24.79 119.17 141.11 -77.20 147.54 89.02 10.94 0.04 86.56 2.45 0.11 0.01 0.03 0.00 9.67 1.18 46 R E E 105.46 8.94 18.27 28.12 116.73 -129.18 -96.76 132.08 7.53 92.41 0.06 7.71 0.55 0.04 0.04 0.02 0.00 77.42 14.22 47 V E E 36.78 15.21 15.70 31.39 121.18 -162.23 -110.12 133.40 21.21 78.74 0.04 20.64 0.54 0.07 0.01 0.02 0.00 78.33 0.38 48 M E E 67.73 10.88 17.29 28.91 110.04 -163.90 -100.39 114.08 18.69 81.17 0.14 16.09 2.31 0.24 0.04 0.08 0.00 80.86 0.37 49 Y E E 103.41 8.16 16.12 25.46 130.17 -163.56 -134.47 147.17 10.96 88.92 0.13 8.44 2.16 0.37 0.04 0.09 0.00 86.96 1.95 50 K E E 107.28 8.13 13.27 22.87 120.41 -146.12 -109.07 132.84 23.62 76.27 0.10 22.02 1.13 0.13 0.03 0.06 0.00 75.04 1.59 51 M C C 107.49 5.35 11.68 18.80 114.93 -131.13 -85.30 137.26 59.12 40.47 0.42 54.44 3.08 0.54 0.10 0.28 0.00 39.74 1.82 52 R C C 164.29 3.00 9.31 14.36 114.13 -134.01 -90.33 134.91 85.53 13.85 0.63 75.28 8.27 1.48 0.16 0.49 0.00 12.84 1.48 53 T C C 88.08 3.45 7.51 12.96 120.92 -149.94 -107.01 147.08 90.07 9.12 0.81 81.26 7.25 1.59 0.29 0.52 0.00 7.38 1.72 54 K C C 177.41 0.68 8.64 9.42 100.37 -143.71 -87.05 -4.40 91.33 7.56 1.11 59.86 29.03 2.86 0.57 0.62 0.00 5.86 1.20 55 R C C 177.44 1.08 7.55 9.82 120.46 81.11 -107.36 139.39 87.62 11.17 1.21 70.01 15.29 2.25 0.74 0.59 0.00 9.82 1.30 56 M C C 147.32 1.69 6.43 10.04 117.54 -140.84 -99.39 134.59 81.42 17.37 1.21 75.99 4.15 1.02 0.78 0.47 0.00 16.00 1.61 57 V C C 113.39 2.04 6.94 10.83 119.13 -156.05 -109.27 133.50 75.81 22.83 1.36 71.73 3.17 0.81 0.96 0.45 0.00 20.95 1.93 58 Q C C 145.88 1.34 7.40 10.36 118.60 -154.40 -107.10 132.06 73.42 24.78 1.80 68.82 3.52 1.01 1.23 0.60 0.00 23.16 1.67 59 F C C 153.32 2.28 6.26 10.54 118.93 -158.96 -108.82 136.71 74.67 21.66 3.67 65.90 5.95 2.38 2.25 1.44 0.00 20.33 1.74 60 E C C 158.79 0.90 7.77 9.58 115.23 -140.64 -93.09 131.69 79.05 15.66 5.29 63.40 9.54 5.76 2.77 2.49 0.01 14.40 1.64 61 A C C 85.64 2.47 5.75 10.17 115.17 -145.48 -94.58 135.22 86.30 9.50 4.19 80.63 2.06 4.01 2.14 1.47 0.00 8.18 1.50 62 R C C 180.26 1.51 9.80 12.58 113.41 -151.48 -98.55 127.98 99.35 0.58 0.07 99.23 0.14 0.10 0.03 0.01 0.00 0.44 0.04