# 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 A C C 46.86 8.63 14.16 24.03 115.88 -140.54 -79.34 145.06 99.78 0.12 0.10 99.72 0.09 0.05 0.06 0.01 0.00 0.05 0.02 1 T C C 63.83 5.24 15.40 21.65 117.97 -127.87 -84.00 161.26 62.39 13.12 24.49 60.90 1.28 1.49 23.32 0.66 0.00 2.63 9.71 2 L H H 73.64 11.11 11.50 23.17 93.87 -109.36 -61.75 -37.81 6.19 0.12 93.69 2.25 1.01 3.07 90.09 3.46 0.01 0.07 0.04 3 N H H 92.38 3.94 14.08 19.17 92.37 52.95 -64.96 -38.54 4.49 0.14 95.37 1.57 0.63 2.49 90.64 4.54 0.01 0.09 0.02 4 Q H H 95.02 2.52 14.86 17.79 92.32 51.23 -65.93 -39.38 3.52 0.20 96.28 1.23 0.54 1.97 90.60 5.45 0.01 0.16 0.03 5 M H H 62.52 8.98 12.53 22.95 92.54 51.41 -65.87 -39.56 5.52 0.27 94.21 2.00 0.90 2.98 90.99 2.87 0.02 0.18 0.06 6 H H H 83.26 9.69 12.49 23.11 93.25 51.03 -69.17 -34.12 12.66 0.41 86.93 3.29 1.61 8.23 82.41 3.99 0.07 0.28 0.14 7 R H H 160.73 2.22 15.37 18.03 93.79 54.75 -70.83 -28.99 21.47 0.31 78.22 3.44 2.66 15.53 75.30 2.68 0.08 0.15 0.16 8 L H H 114.80 2.63 14.58 17.71 97.59 48.96 -88.73 -8.18 35.21 0.38 64.41 6.80 8.28 21.21 61.45 1.79 0.08 0.12 0.27 9 G C C 26.13 9.03 12.48 22.69 129.88 -129.33 104.22 177.12 99.04 0.54 0.42 50.78 46.74 1.57 0.24 0.14 0.00 0.17 0.35 10 P C C 83.96 5.07 14.75 21.05 115.84 -54.76 -68.42 149.02 99.47 0.39 0.14 88.30 10.61 0.57 0.05 0.08 0.00 0.16 0.24 11 P C C 74.57 9.88 11.59 22.40 113.31 -102.86 -66.61 146.75 99.10 0.64 0.25 93.51 4.67 0.95 0.07 0.15 0.00 0.28 0.38 12 K C C 141.93 3.61 14.11 19.57 114.11 -122.46 -86.00 137.15 97.68 2.16 0.16 91.67 5.35 0.49 0.05 0.09 0.00 0.68 1.67 13 H C C 128.23 5.79 11.91 19.75 115.80 -123.44 -89.63 133.10 99.08 0.89 0.03 91.48 7.61 0.08 0.01 0.01 0.00 0.31 0.48 14 P C C 73.18 7.26 11.43 20.36 115.98 -107.81 -68.98 151.51 99.75 0.23 0.02 97.81 1.92 0.08 0.01 0.01 0.00 0.08 0.09 15 P C C 100.39 3.46 13.49 18.55 112.10 -99.05 -66.79 147.73 98.71 0.70 0.59 95.01 2.80 0.96 0.15 0.34 0.00 0.27 0.47 16 G C C 45.35 6.37 11.14 19.14 116.63 -105.09 -77.25 163.30 95.31 2.53 2.16 82.97 8.52 3.52 0.48 1.79 0.00 1.36 1.37 17 K C C 149.10 3.29 13.31 18.27 108.87 -115.37 -88.05 99.71 91.08 5.99 2.93 76.12 10.46 4.00 0.69 2.40 0.00 2.38 3.95 18 M C C 116.84 5.51 12.51 19.76 114.89 -142.70 -96.31 134.11 93.92 4.28 1.79 66.42 23.39 3.21 0.58 1.23 0.00 1.57 3.62 19 G C C 31.75 7.38 15.08 23.40 130.46 54.74 84.65 -172.82 97.37 1.58 1.05 62.38 32.23 2.29 0.30 0.74 0.00 0.48 1.57 20 P C T 77.23 7.73 16.52 25.16 93.81 -49.30 -67.70 -20.48 93.83 0.38 5.80 4.97 7.10 80.66 0.54 6.27 0.00 0.20 0.27 21 T C T 21.53 19.11 12.26 31.23 95.82 53.26 -94.21 0.95 94.29 0.64 5.07 4.25 5.48 84.03 0.65 4.86 0.00 0.34 0.40 22 A C T 59.36 9.29 15.02 25.56 109.46 124.22 -61.20 127.42 96.10 0.75 3.15 3.52 6.09 86.17 0.50 2.84 0.00 0.34 0.53 23 G C T 55.55 3.33 17.55 21.52 94.25 11.04 81.77 -0.33 98.02 0.25 1.73 4.44 9.13 84.21 0.18 1.79 0.00 0.15 0.10 24 R C C 101.55 9.67 15.39 26.01 113.04 115.55 -103.01 116.41 97.85 1.89 0.27 63.71 33.28 0.75 0.06 0.20 0.00 0.64 1.37 25 P C T 71.50 9.74 16.79 27.21 97.11 -146.36 -66.99 -16.98 92.89 1.93 5.17 14.90 11.72 64.65 0.20 6.76 0.00 1.24 0.52 26 Q C T 87.73 10.15 19.91 29.79 100.91 57.19 -83.92 16.66 88.56 7.08 4.35 17.16 10.66 59.83 0.24 5.44 0.00 5.82 0.85 27 L C C 23.86 20.43 16.48 36.43 114.00 134.52 -84.13 132.73 69.71 28.39 1.91 63.29 4.97 1.05 0.33 1.72 0.00 25.04 3.59 28 K C C 86.47 10.98 24.80 35.59 130.29 159.81 -129.01 146.13 53.38 46.45 0.17 47.40 4.80 0.41 0.04 0.14 0.00 45.21 2.01 29 G E E 9.33 15.14 23.15 38.48 144.77 90.52 164.61 -175.98 15.69 84.28 0.03 11.00 4.38 0.20 0.00 0.03 0.00 84.11 0.28 30 V E E 43.42 11.58 25.11 37.50 120.98 -69.53 -110.48 135.80 2.36 97.64 0.00 2.15 0.10 0.00 0.00 0.00 0.00 97.67 0.08 31 V E E 13.54 22.40 16.29 39.24 109.69 -123.54 -79.35 122.04 0.60 99.40 0.00 0.58 0.01 0.00 0.00 0.00 0.00 99.38 0.02 32 L E E 65.04 8.67 22.08 31.71 99.82 175.87 -94.29 -33.16 1.88 98.11 0.01 1.01 0.65 0.05 0.00 0.01 0.00 98.27 0.01 33 R E E 99.46 5.69 24.36 30.87 139.80 -0.92 -152.57 150.41 2.51 97.48 0.01 0.84 1.23 0.16 0.00 0.01 0.00 97.75 0.02 34 T E E 41.85 19.37 15.32 33.65 122.70 -148.99 -118.65 129.84 3.37 96.62 0.01 2.85 0.24 0.02 0.00 0.01 0.00 96.86 0.02 35 F E E 53.03 10.55 20.43 32.22 126.66 -172.42 -124.42 142.27 0.79 99.20 0.00 0.71 0.02 0.00 0.00 0.00 0.00 99.25 0.01 36 I E E 72.47 12.12 17.24 29.93 119.63 -150.60 -108.22 130.54 0.93 99.07 0.00 0.82 0.03 0.00 0.00 0.00 0.00 99.13 0.02 37 R E E 81.41 10.92 16.14 28.11 127.46 -175.45 -124.00 145.46 6.02 93.97 0.00 5.49 0.39 0.02 0.00 0.00 0.00 93.72 0.37 38 K C C 132.71 4.24 17.53 23.23 114.62 -121.83 -88.28 131.01 72.86 27.13 0.01 69.47 1.98 0.06 0.00 0.01 0.00 28.13 0.35 39 P C C 34.95 15.50 8.63 23.95 116.02 -113.77 -67.04 149.62 89.21 10.62 0.17 85.66 3.13 0.61 0.03 0.14 0.00 8.86 1.56 40 K C S 159.71 1.53 14.32 16.05 95.05 -134.80 -76.05 -24.48 98.25 1.58 0.17 26.91 69.75 1.78 0.03 0.13 0.00 0.80 0.60 41 K C S 128.15 2.30 12.61 15.97 124.43 36.93 -122.13 143.03 97.54 1.95 0.51 8.53 81.82 7.18 0.05 0.39 0.00 0.63 1.40 42 P C T 105.84 2.64 11.45 15.52 107.88 -93.46 -62.82 141.60 97.98 0.28 1.74 3.43 12.00 81.86 0.07 2.33 0.00 0.17 0.14 43 N C T 123.86 2.46 12.86 16.03 96.61 19.28 64.08 16.38 97.11 0.69 2.20 6.59 13.06 76.68 0.11 2.84 0.00 0.48 0.24 44 S C C 45.62 8.67 10.59 20.73 121.74 113.66 -95.35 152.30 90.33 7.07 2.60 54.28 29.05 6.11 0.37 2.77 0.00 3.03 4.38 45 A C C 52.95 5.51 16.20 22.76 118.06 -104.33 -78.03 154.38 92.70 6.67 0.62 67.36 22.28 3.06 0.09 0.73 0.00 5.18 1.30 46 N C C 81.44 9.46 16.99 27.06 114.04 -105.57 -74.64 134.15 76.64 22.89 0.47 63.02 10.14 2.55 0.06 0.56 0.00 22.21 1.47 47 R E E 52.33 16.59 16.24 32.77 128.87 -171.27 -122.95 146.64 27.48 72.45 0.07 24.71 2.23 0.17 0.01 0.06 0.00 71.84 0.97 48 K E E 77.30 11.11 23.32 34.50 116.94 -127.76 -90.61 134.12 4.66 95.33 0.01 4.09 0.43 0.02 0.00 0.00 0.00 95.35 0.10 49 C E E 9.47 21.10 19.40 40.32 134.82 171.17 -134.65 157.44 2.20 97.80 0.00 2.00 0.06 0.00 0.00 0.00 0.00 97.92 0.02 50 C E E 6.59 20.56 22.07 43.01 126.84 -140.29 -119.83 144.55 0.43 99.57 0.00 0.39 0.00 0.00 0.00 0.00 0.00 99.60 0.00 51 R E E 62.65 13.16 25.94 39.29 116.54 -139.82 -100.08 127.50 0.13 99.87 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.88 0.00 52 V E E 4.39 24.42 18.00 43.01 124.71 -170.12 -120.73 136.91 0.12 99.88 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.89 0.00 53 R E E 92.68 8.16 24.85 33.51 114.12 -143.71 -98.48 123.68 0.46 99.54 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.50 0.06 54 L C C 10.81 21.73 12.67 34.49 122.74 -149.25 -86.27 163.54 50.55 49.35 0.09 49.92 0.58 0.10 0.02 0.06 0.00 48.34 0.98 55 S C T 68.65 7.14 16.60 24.86 91.80 -101.93 -63.67 -22.59 98.04 0.83 1.14 0.60 3.53 94.12 0.04 1.02 0.00 0.60 0.09 56 T C T 79.21 5.58 15.66 22.37 93.20 59.23 -87.49 0.88 98.81 0.13 1.07 0.27 2.87 95.76 0.03 0.97 0.00 0.07 0.03 57 G C S 45.99 4.04 16.63 21.61 97.65 -100.58 89.99 5.27 98.66 0.58 0.77 10.58 86.07 2.27 0.06 0.52 0.00 0.30 0.21 58 R C C 90.56 9.83 15.59 26.67 118.47 133.85 -80.74 144.69 95.47 4.51 0.02 94.84 1.12 0.05 0.00 0.01 0.00 3.64 0.34 59 E E E 89.35 10.49 20.76 31.48 119.95 -135.38 -103.26 135.20 1.33 98.67 0.00 1.31 0.04 0.00 0.00 0.00 0.00 98.49 0.17 60 A E E 6.31 22.43 18.03 40.58 130.47 -173.46 -128.33 148.29 0.36 99.64 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.68 0.00 61 V E E 33.40 14.52 25.65 40.31 122.23 -152.43 -115.06 134.13 0.26 99.74 0.00 0.22 0.00 0.00 0.00 0.00 0.00 99.77 0.00 62 C E E 4.78 24.16 21.54 45.56 127.81 -171.54 -124.18 141.95 0.94 99.06 0.00 0.81 0.02 0.00 0.00 0.00 0.00 99.15 0.01 63 F E E 41.11 15.38 26.38 41.64 117.91 -147.83 -107.24 128.14 3.53 96.46 0.01 3.20 0.15 0.01 0.00 0.00 0.00 96.41 0.23 64 I C E 9.41 22.58 19.55 42.27 115.12 -162.62 -111.88 117.43 51.74 48.17 0.09 48.45 1.75 0.18 0.02 0.07 0.00 48.80 0.72 65 P C C 43.39 10.92 21.45 33.15 110.94 -130.35 -69.52 142.97 84.86 13.84 1.30 46.64 27.38 10.50 0.16 1.33 0.00 13.03 0.98 66 G C S 35.50 11.13 18.11 28.82 102.54 -0.14 77.68 -7.88 88.75 6.07 5.18 26.35 40.19 22.66 0.62 4.59 0.01 3.49 2.09 67 E C T 124.44 5.09 16.72 23.08 106.98 70.37 -84.14 94.40 85.80 7.55 6.65 19.43 26.91 40.10 0.84 5.71 0.02 4.33 2.66 68 G C T 45.39 6.76 17.23 24.52 103.60 19.76 86.42 -1.43 89.06 5.37 5.57 29.08 24.22 36.33 0.74 4.83 0.00 3.32 1.47 69 H C C 66.75 14.99 13.32 27.95 117.88 126.13 -97.21 138.19 79.36 12.90 7.74 54.19 16.87 7.98 2.99 4.80 0.02 7.33 5.81 70 S C C 57.16 7.08 19.98 27.53 110.27 -147.14 -98.54 105.63 77.12 13.30 9.59 60.16 9.36 6.80 5.23 4.50 0.01 7.99 5.95 71 L C C 44.81 18.91 12.64 30.31 99.38 -144.38 -79.18 -4.62 59.70 4.25 36.05 40.01 9.32 10.85 19.13 16.52 0.03 2.55 1.60 72 Q H G 108.38 6.11 17.44 24.72 96.69 95.97 -69.70 -30.72 48.60 2.55 48.84 23.47 9.56 16.09 20.73 27.63 0.05 1.44 1.02 73 E H G 115.89 5.00 17.54 23.27 97.87 51.30 -74.44 -23.09 47.77 1.41 50.82 8.09 9.75 29.27 19.45 31.67 0.17 0.77 0.82 74 H C T 81.23 12.32 16.55 28.70 101.86 33.26 -103.75 11.52 54.17 2.41 43.42 11.72 11.92 30.93 17.04 25.72 0.15 1.45 1.08 75 H C C 54.61 15.67 17.38 32.71 108.75 111.28 -94.54 73.57 70.75 20.08 9.18 42.84 20.77 8.52 2.91 5.66 0.02 17.55 1.73 76 V E E 56.22 11.01 23.54 34.80 120.15 78.30 -107.47 132.17 23.77 75.43 0.81 19.98 3.44 0.73 0.31 0.43 0.00 74.16 0.94 77 V E E 7.82 24.30 17.78 42.30 123.01 -164.10 -116.34 135.27 4.77 95.19 0.05 4.29 0.34 0.04 0.02 0.02 0.00 95.18 0.12 78 L E E 43.67 11.12 26.46 38.48 115.66 -145.73 -96.84 128.61 1.10 98.89 0.01 0.94 0.08 0.01 0.00 0.00 0.00 98.95 0.02 79 V E E 10.67 24.32 17.17 41.46 123.17 -166.97 -117.27 133.58 0.69 99.31 0.00 0.61 0.03 0.00 0.00 0.00 0.00 99.32 0.03 80 Q E E 82.88 8.86 24.87 33.82 120.27 -169.83 -113.11 137.46 3.63 96.35 0.03 2.95 0.41 0.06 0.01 0.01 0.00 96.47 0.08 81 G E E 20.36 14.47 19.36 33.30 135.34 -10.56 132.56 174.77 18.60 81.28 0.13 12.81 5.16 0.70 0.02 0.10 0.00 80.92 0.30 82 G E E 23.13 10.48 20.60 31.67 139.69 127.11 159.82 -176.39 35.07 64.46 0.47 26.02 9.04 1.44 0.09 0.39 0.00 61.87 1.15 83 R C C 118.94 8.67 18.66 28.01 120.30 -72.58 -104.73 136.55 51.57 46.88 1.56 42.33 6.42 1.65 0.57 1.22 0.00 41.22 6.59 84 T C C 48.54 14.54 11.86 26.27 111.31 -151.30 -92.07 105.35 75.88 17.18 6.94 56.02 10.16 9.25 0.98 6.62 0.01 13.02 3.94 85 Q C T 142.39 1.92 17.35 19.42 96.80 -22.46 -63.79 -21.90 92.63 2.48 4.90 4.48 23.28 63.93 0.21 5.75 0.00 1.72 0.63 86 D C T 94.60 5.84 15.41 22.18 96.97 33.15 -85.99 -4.63 94.93 1.55 3.53 5.01 26.69 62.11 0.12 4.64 0.00 1.06 0.38 87 L C S 31.70 17.29 10.08 27.03 112.28 59.25 -117.58 100.51 88.42 11.18 0.40 36.83 50.84 1.74 0.10 0.30 0.00 5.62 4.57 88 P C T 91.39 3.54 17.38 22.08 111.36 -134.63 -64.04 134.55 93.63 5.48 0.89 2.06 6.77 85.53 0.05 0.78 0.00 4.29 0.53 89 G C T 50.11 3.50 18.20 22.34 95.15 20.09 83.67 -2.77 94.39 4.93 0.68 2.71 8.66 83.23 0.03 0.67 0.00 4.45 0.24 90 V C C 21.96 19.77 11.77 31.40 118.69 109.99 -100.37 131.50 68.37 31.40 0.23 60.68 5.78 0.64 0.05 0.22 0.00 30.90 1.73 91 K E E 101.68 6.48 24.38 31.21 121.15 -162.36 -108.37 133.85 27.38 72.58 0.04 25.36 1.24 0.10 0.01 0.03 0.00 71.99 1.27 92 L E E 13.33 24.15 15.23 39.26 128.19 -167.68 -122.81 142.25 5.93 94.06 0.01 5.70 0.19 0.01 0.00 0.00 0.00 93.93 0.16 93 T E E 47.82 9.26 26.61 36.45 123.35 -162.71 -119.16 135.84 0.71 99.28 0.00 0.70 0.02 0.00 0.00 0.00 0.00 99.24 0.04 94 V E E 15.96 22.41 16.68 39.19 111.37 -127.48 -84.98 123.43 1.56 98.43 0.01 1.57 0.04 0.01 0.01 0.00 0.00 98.23 0.15 95 V E E 52.66 9.65 23.08 33.28 102.42 174.64 -96.86 -27.87 24.36 75.28 0.35 19.46 4.43 0.71 0.10 0.24 0.00 74.52 0.56 96 R C E 90.33 9.66 22.28 32.02 135.63 2.39 -145.28 151.45 53.60 44.29 2.11 26.61 23.64 5.76 0.49 1.50 0.02 40.11 1.86 97 G C C 20.05 14.53 17.90 31.87 129.87 65.02 100.68 -172.25 74.79 13.93 11.28 37.74 25.80 12.79 2.01 8.85 0.03 10.02 2.77 98 K C T 115.25 8.81 18.64 27.78 94.11 -78.86 -68.95 -26.86 72.70 2.91 24.39 10.11 24.74 38.58 3.76 19.74 0.04 1.67 1.37 99 Y C T 113.13 9.63 18.21 28.12 101.31 45.31 -100.12 14.38 67.33 5.21 27.47 12.20 20.91 35.15 4.87 21.39 0.12 3.06 2.30 100 D C C 59.29 11.67 18.36 30.14 108.02 90.56 -86.53 109.25 66.02 10.52 23.45 39.23 13.44 13.87 5.45 17.70 0.05 5.28 4.98 101 C C C 18.65 21.73 12.74 33.39 99.56 -156.80 -87.28 4.69 65.21 5.55 29.24 43.34 9.03 12.71 5.64 23.84 0.00 3.33 2.09 102 G C T 45.96 4.96 19.99 25.88 93.75 117.09 -65.24 -19.16 64.76 4.16 31.08 16.05 13.93 36.17 5.53 24.24 0.07 2.62 1.38 103 H C T 101.09 7.33 18.00 26.16 96.84 54.95 -92.44 -0.75 61.12 8.11 30.77 19.63 12.54 31.20 5.19 23.77 0.10 5.89 1.67 104 V C C 28.75 21.03 9.72 29.29 116.14 101.70 -89.58 130.10 68.70 21.98 9.32 54.34 9.70 4.03 4.17 5.21 0.02 16.74 5.78 105 Q C C 109.57 4.15 17.39 22.80 120.69 -162.50 -108.31 138.91 66.23 29.82 3.95 54.98 6.76 2.77 2.57 1.79 0.01 22.95 8.16 106 K C C 132.72 6.41 11.82 20.27 113.28 -116.49 -79.81 132.54 75.90 21.49 2.61 63.84 7.85 3.38 1.34 1.38 0.00 18.76 3.45 107 K C C 117.66 6.67 9.41 17.74 115.24 -139.96 -88.61 138.80 91.75 7.42 0.82 90.00 0.95 1.38 0.35 0.31 0.00 5.67 1.33 108 K C C 164.04 1.52 13.40 15.69 108.72 -124.25 -81.02 122.67 99.88 0.11 0.01 99.82 0.08 0.03 0.00 0.00 0.00 0.06 0.01