# 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 D C C 102.10 3.71 20.57 24.45 105.15 -127.68 -81.20 68.60 99.83 0.17 0.00 99.77 0.09 0.01 0.00 0.00 0.00 0.12 0.00 1 I C C 38.37 20.51 10.55 29.69 118.26 -157.03 -101.01 129.71 60.73 39.17 0.10 59.82 0.49 0.15 0.02 0.05 0.00 38.76 0.72 2 Q E E 100.16 4.81 21.51 27.19 123.73 -169.54 -119.78 137.80 22.56 77.28 0.16 20.85 1.28 0.24 0.06 0.10 0.00 76.46 1.02 3 M E E 52.04 19.84 13.07 31.83 121.07 -156.33 -108.71 132.64 17.55 82.30 0.15 16.43 0.91 0.16 0.05 0.08 0.00 81.29 1.07 4 T E E 64.45 7.67 20.45 28.84 124.95 -172.33 -121.47 142.74 24.96 74.84 0.19 22.05 2.24 0.35 0.06 0.13 0.00 73.57 1.60 5 Q C E 79.19 13.43 16.01 29.32 125.76 -155.96 -121.66 140.33 52.47 47.30 0.23 40.05 11.74 0.95 0.05 0.21 0.00 45.54 1.45 6 S C C 53.37 10.84 16.48 27.86 120.14 -139.36 -100.60 144.85 84.90 14.96 0.14 62.12 21.39 1.00 0.02 0.14 0.00 14.59 0.75 7 P C C 56.23 9.58 16.41 26.79 115.84 2.85 -73.60 152.95 89.73 8.42 1.84 57.61 23.17 8.30 0.19 2.02 0.00 8.08 0.62 8 S C S 70.57 8.06 16.74 25.69 97.28 -143.50 -81.40 -19.53 79.50 18.85 1.65 30.73 39.85 8.56 0.14 1.66 0.00 18.18 0.88 9 S E E 57.98 6.68 19.75 27.63 134.75 20.06 -144.64 149.48 30.80 67.04 2.17 22.71 6.89 2.72 0.32 1.72 0.00 64.77 0.86 10 L E E 34.21 19.52 14.54 33.38 130.72 -174.16 -137.16 142.59 10.17 89.57 0.25 8.86 1.25 0.23 0.08 0.14 0.00 88.80 0.64 11 S E E 65.25 6.67 22.75 30.68 125.32 -160.44 -119.34 142.10 7.08 92.80 0.13 6.22 0.76 0.14 0.04 0.07 0.00 92.24 0.54 12 A E E 14.30 19.23 14.53 33.75 138.11 169.72 -147.09 158.79 20.25 79.50 0.25 17.43 2.26 0.35 0.07 0.17 0.00 79.04 0.69 13 S E E 55.25 4.96 23.50 28.35 123.96 -117.56 -91.65 156.28 38.63 60.83 0.54 32.08 5.27 1.17 0.19 0.43 0.00 56.80 4.06 14 V C T 60.65 15.26 14.04 29.14 109.32 -85.50 -61.18 134.46 90.46 7.71 1.83 3.64 11.86 75.85 0.18 1.55 0.00 5.98 0.95 15 G C T 45.02 4.78 19.87 25.36 96.47 23.11 89.14 -6.37 96.66 2.12 1.22 4.68 16.80 75.17 0.08 1.21 0.00 1.78 0.27 16 D C S 62.00 8.88 17.52 27.37 123.43 115.53 -85.63 155.21 91.63 7.57 0.79 42.10 46.46 3.49 0.10 0.73 0.00 6.26 0.86 17 R C C 126.86 8.19 19.65 28.79 118.20 -120.98 -90.85 136.29 69.91 30.04 0.05 67.17 1.57 0.14 0.01 0.04 0.00 30.61 0.46 18 V E E 11.58 22.64 14.52 37.23 126.41 -167.06 -123.36 140.82 2.68 97.31 0.00 2.61 0.06 0.00 0.00 0.00 0.00 97.18 0.15 19 T E E 61.34 8.27 25.16 33.93 119.31 -151.59 -110.39 130.22 0.59 99.41 0.00 0.56 0.01 0.00 0.00 0.00 0.00 99.42 0.01 20 I E E 5.49 25.48 16.74 42.93 120.84 -167.69 -116.24 130.02 1.37 98.63 0.00 1.24 0.04 0.00 0.00 0.00 0.00 98.70 0.01 21 T E E 44.89 9.41 26.93 37.05 120.97 -164.19 -112.98 133.40 5.23 94.77 0.00 4.71 0.16 0.00 0.00 0.00 0.00 95.09 0.04 22 C E E 4.56 25.64 16.75 42.85 126.25 -172.23 -125.11 140.56 6.96 93.03 0.01 6.35 0.29 0.02 0.00 0.01 0.00 93.21 0.12 23 R E E 106.07 7.18 27.20 35.12 120.06 -161.18 -115.00 129.82 6.87 93.10 0.03 6.44 0.35 0.04 0.01 0.02 0.00 92.17 0.96 24 A E E 10.75 23.54 13.91 37.00 120.86 -157.35 -100.86 142.03 44.06 55.60 0.34 41.55 1.79 0.32 0.12 0.21 0.00 53.70 2.31 25 S C C 51.68 7.29 20.42 28.14 118.61 -145.43 -93.33 161.24 80.56 18.59 0.85 50.36 26.26 3.99 0.13 0.85 0.00 17.18 1.23 26 Q C S 117.76 5.42 17.65 23.87 102.51 -73.69 -86.46 -3.25 90.95 7.02 2.03 19.50 56.01 15.87 0.24 1.73 0.00 5.63 1.01 27 S C C 63.91 6.54 18.50 25.80 115.03 57.26 -103.28 136.23 91.64 5.98 2.38 47.83 29.32 14.60 0.34 2.36 0.00 4.26 1.29 28 V C C 56.39 15.06 16.46 30.92 110.25 -118.20 -89.46 113.08 87.82 8.87 3.31 43.30 28.80 16.14 0.55 3.04 0.00 5.78 2.39 29 S C C 31.95 14.30 18.85 33.10 121.49 150.42 -102.63 145.54 88.20 9.19 2.61 56.10 19.62 12.27 0.31 2.69 0.00 7.73 1.28 30 S C S 44.59 13.04 20.83 33.56 101.35 -162.80 -96.25 -11.45 84.54 14.41 1.05 30.52 48.86 4.56 0.09 0.96 0.00 14.24 0.77 31 Y E E 70.12 12.04 24.10 36.58 128.39 46.45 -125.83 142.69 28.22 71.15 0.64 22.79 4.43 1.00 0.10 0.52 0.00 70.50 0.67 32 L E E 3.93 26.03 18.65 45.20 125.44 -163.65 -122.38 136.86 5.47 94.50 0.03 4.92 0.38 0.03 0.01 0.01 0.00 94.50 0.14 33 N E E 30.71 14.48 27.69 42.36 125.43 -168.03 -119.64 141.77 1.40 98.60 0.01 1.22 0.07 0.01 0.00 0.00 0.00 98.68 0.02 34 W E E 8.30 24.68 21.11 45.90 124.86 -159.86 -115.00 141.23 0.85 99.15 0.00 0.77 0.03 0.00 0.00 0.00 0.00 99.19 0.01 35 Y E E 28.52 15.49 23.90 39.73 132.15 -173.94 -130.31 151.84 0.57 99.43 0.00 0.49 0.02 0.00 0.00 0.00 0.00 99.45 0.03 36 Q E E 36.47 15.21 20.48 36.05 122.14 -148.03 -111.48 136.81 2.22 97.77 0.01 1.80 0.21 0.02 0.00 0.00 0.00 97.92 0.05 37 Q E E 59.48 12.60 15.59 29.00 118.42 -147.12 -105.16 132.32 22.94 77.01 0.05 20.29 1.84 0.14 0.01 0.04 0.00 76.94 0.73 38 R C C 106.52 7.10 13.64 22.28 119.22 -145.55 -94.06 144.48 87.16 12.55 0.30 82.46 3.43 1.08 0.07 0.26 0.00 11.23 1.47 39 S C T 91.51 2.16 11.14 14.99 108.34 -79.08 -59.44 130.68 98.82 0.33 0.85 1.00 6.08 91.65 0.03 0.94 0.00 0.22 0.08 40 G C T 69.55 0.27 12.27 9.97 96.37 13.99 82.92 -2.56 98.86 0.16 0.98 0.99 6.06 91.65 0.03 1.13 0.00 0.11 0.03 41 K C S 114.49 3.80 10.34 16.28 128.50 91.12 -116.09 158.65 87.48 11.80 0.72 25.54 57.48 4.99 0.14 0.57 0.00 4.85 6.43 42 A C C 71.96 2.99 15.87 19.55 116.02 -93.91 -69.27 147.72 94.67 5.27 0.05 83.35 11.29 0.23 0.01 0.04 0.00 4.56 0.52 43 P C C 43.37 17.60 11.16 28.03 114.84 -103.39 -66.12 145.42 87.71 12.23 0.06 85.06 2.21 0.17 0.01 0.04 0.00 12.11 0.41 44 R E E 112.76 7.26 21.11 29.17 122.71 -152.57 -116.62 137.17 9.38 90.52 0.10 8.14 1.15 0.12 0.03 0.05 0.00 89.89 0.62 45 L E E 58.68 16.16 17.70 33.47 110.75 -118.53 -76.53 125.49 1.13 98.85 0.02 1.01 0.06 0.01 0.01 0.00 0.00 98.87 0.04 46 L E E 24.32 17.68 20.90 38.52 101.05 176.23 -94.91 -35.04 2.27 97.69 0.04 1.55 0.55 0.04 0.01 0.01 0.00 97.83 0.02 47 I E E 15.55 20.30 21.20 41.24 135.74 5.41 -146.93 140.78 0.59 99.39 0.02 0.47 0.05 0.01 0.01 0.00 0.00 99.46 0.01 48 Y E E 56.06 17.06 21.67 37.92 125.81 -170.79 -127.79 134.08 3.90 96.00 0.09 3.38 0.25 0.04 0.05 0.02 0.00 96.14 0.12 49 T E E 27.72 15.87 20.28 36.09 115.81 -168.00 -111.55 119.81 33.36 64.60 2.05 25.15 6.88 1.78 1.09 0.94 0.00 63.39 0.77 50 V C C 47.06 13.76 17.72 31.67 117.21 112.24 -108.63 137.95 58.23 25.47 16.29 32.38 15.96 11.50 6.16 9.08 0.07 22.89 1.95 51 T C C 77.51 7.54 18.12 25.92 104.64 -132.38 -89.55 0.22 66.89 9.81 23.30 27.54 19.79 21.19 9.27 12.88 0.12 7.26 1.96 52 N C C 87.55 7.12 17.68 25.46 107.05 39.11 -98.88 64.99 63.71 10.85 25.44 31.97 15.10 18.03 10.58 14.05 0.13 7.41 2.74 53 F C C 71.44 15.63 11.95 26.92 111.76 119.19 -94.69 116.82 63.49 14.29 22.22 40.15 12.29 11.40 12.13 10.08 0.10 9.98 3.86 54 Q C C 109.03 6.10 15.30 22.73 111.87 -159.20 -93.71 115.82 66.82 14.44 18.74 37.76 13.29 16.40 9.96 8.51 0.12 9.83 4.13 55 S C T 73.73 5.67 14.77 21.82 110.04 -101.94 -87.96 115.66 80.97 6.35 12.67 19.69 17.43 44.45 5.79 6.35 0.06 4.15 2.08 56 G C T 50.43 4.71 16.81 22.55 102.00 -17.73 84.68 0.59 91.60 4.73 3.67 23.67 26.35 42.23 0.76 2.67 0.00 3.22 1.09 57 V C C 40.76 15.83 11.91 27.88 117.51 110.99 -100.25 131.97 83.59 15.66 0.75 53.47 29.33 1.79 0.29 0.50 0.00 8.60 6.01 58 P C C 63.04 8.36 18.21 27.51 110.16 -109.80 -67.29 146.68 85.47 11.29 3.24 62.96 13.46 8.55 0.83 2.67 0.00 9.30 2.23 59 S C C 55.23 13.20 16.13 28.85 103.19 -130.72 -79.83 16.28 81.32 13.06 5.62 50.32 18.37 12.87 0.92 5.02 0.01 11.03 1.46 60 R C C 110.72 9.42 20.67 30.21 108.13 90.72 -102.84 54.68 64.33 30.85 4.81 38.23 19.91 7.18 0.95 3.57 0.01 28.68 1.48 61 F E E 30.69 22.44 13.48 35.07 122.71 125.82 -108.88 138.63 23.59 75.41 1.00 19.87 3.47 0.95 0.41 0.57 0.00 73.33 1.40 62 S E E 56.03 6.60 23.59 31.44 133.90 -175.80 -138.24 155.55 9.09 90.67 0.24 7.94 0.95 0.23 0.10 0.11 0.00 89.99 0.69 63 G E E 24.02 17.05 16.06 32.16 141.31 166.16 -161.52 170.59 9.49 90.37 0.13 7.91 1.31 0.26 0.04 0.07 0.00 89.88 0.53 64 S E E 65.57 5.30 21.38 28.26 134.85 -162.13 -144.26 154.88 17.58 82.27 0.15 14.97 2.21 0.43 0.04 0.11 0.00 81.57 0.68 65 G E E 30.07 11.60 15.40 27.51 138.57 134.04 99.55 168.06 38.71 61.04 0.25 27.15 10.81 1.96 0.04 0.27 0.00 58.67 1.11 66 S C C 75.95 3.51 20.77 24.89 113.70 -116.01 -120.60 87.47 62.72 36.54 0.74 37.66 20.08 6.44 0.12 0.80 0.00 31.80 3.10 67 G C S 32.20 10.93 18.71 29.51 108.98 -49.06 67.72 -128.79 97.70 1.52 0.78 3.44 56.67 37.79 0.03 0.77 0.00 1.11 0.20 68 T C S 57.00 13.91 17.04 30.84 97.88 -8.72 -99.32 -3.39 97.50 1.89 0.61 3.29 57.68 36.72 0.02 0.58 0.00 1.50 0.19 69 D E E 60.81 8.82 22.32 32.24 119.88 84.03 -108.02 130.63 38.80 60.96 0.24 25.89 12.21 1.69 0.03 0.28 0.00 57.38 2.52 70 F E E 8.52 24.50 16.09 40.94 128.31 -174.42 -126.95 142.39 14.92 85.08 0.01 14.06 0.50 0.03 0.00 0.01 0.00 84.96 0.44 71 T E E 35.70 10.55 27.24 38.80 124.42 -164.63 -119.68 136.60 4.17 95.83 0.00 3.70 0.16 0.00 0.00 0.00 0.00 96.05 0.09 72 L E E 2.99 26.18 19.08 46.17 119.92 -160.77 -113.20 128.60 0.53 99.47 0.00 0.56 0.01 0.00 0.00 0.00 0.00 99.42 0.00 73 T E E 40.41 10.22 27.35 38.38 119.92 -164.25 -115.10 129.23 0.16 99.84 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.80 0.01 74 I E E 7.20 24.21 16.41 41.23 116.88 -165.86 -113.15 124.78 2.22 97.78 0.00 2.31 0.02 0.00 0.00 0.00 0.00 97.29 0.39 75 S C C 48.31 7.24 23.09 30.50 118.79 -164.09 -105.61 160.17 93.36 6.58 0.05 47.22 41.55 3.41 0.00 0.10 0.00 7.50 0.21 76 S C S 64.54 4.92 24.15 29.07 102.48 9.95 59.52 73.59 99.16 0.82 0.02 10.56 85.10 3.54 0.00 0.03 0.00 0.69 0.08 77 L C C 18.88 23.79 10.82 34.16 112.39 -140.58 -78.45 128.73 99.35 0.64 0.01 97.63 1.78 0.03 0.00 0.00 0.00 0.22 0.34 78 Q C C 80.43 4.65 23.84 28.38 130.27 -174.56 -125.04 155.98 99.89 0.10 0.01 99.35 0.54 0.00 0.00 0.00 0.00 0.02 0.08 79 P H G 71.65 12.38 15.11 27.79 91.16 -106.60 -58.51 -32.12 3.33 0.02 96.66 0.18 0.20 2.10 0.27 97.23 0.00 0.01 0.00 80 E H G 127.14 3.50 21.11 25.34 90.03 63.00 -69.75 -16.81 2.67 0.02 97.31 0.09 0.15 1.83 0.17 97.74 0.00 0.02 0.00 81 D H G 16.18 20.20 16.03 36.56 93.92 61.22 -87.83 -4.19 3.46 0.04 96.50 0.40 0.32 1.64 0.25 97.35 0.00 0.03 0.00 82 F C C 50.26 17.36 19.58 36.81 116.07 105.11 -78.15 135.74 88.82 10.79 0.39 84.90 4.06 0.15 0.05 0.35 0.00 10.07 0.42 83 A E E 15.77 16.12 22.77 38.64 142.98 151.25 -156.55 174.38 8.16 91.82 0.02 7.53 0.54 0.04 0.01 0.01 0.00 91.26 0.61 84 T E E 39.12 12.90 25.27 38.47 119.75 -84.48 -102.42 136.39 1.48 98.51 0.01 1.32 0.09 0.00 0.00 0.00 0.00 98.52 0.06 85 Y E E 7.80 25.09 19.46 44.68 125.42 -166.49 -116.77 139.33 0.92 99.07 0.01 0.79 0.06 0.00 0.00 0.01 0.00 99.09 0.05 86 Y E E 36.27 15.51 27.22 42.72 130.52 -169.85 -128.26 146.82 3.19 96.75 0.06 2.70 0.25 0.04 0.02 0.03 0.00 96.84 0.12 87 C E E 3.17 25.35 21.10 46.74 123.39 -159.27 -115.75 135.71 11.26 88.22 0.52 9.41 1.23 0.36 0.19 0.24 0.00 88.18 0.40 88 Q E E 37.94 14.38 26.15 40.45 126.43 -169.23 -122.89 140.45 11.05 88.26 0.69 9.62 1.07 0.35 0.28 0.31 0.00 87.61 0.75 89 E E E 30.07 19.65 18.93 37.95 123.01 -158.41 -112.70 137.26 18.84 80.27 0.89 15.24 3.12 0.95 0.32 0.48 0.00 79.04 0.83 90 S E E 35.56 11.08 19.22 31.10 125.63 -168.84 -122.13 143.04 33.96 65.26 0.78 25.76 7.06 2.01 0.20 0.56 0.00 63.20 1.21 91 Y C C 92.96 11.41 13.24 25.35 113.85 -170.19 -106.04 121.56 58.24 40.36 1.39 37.20 15.80 6.55 0.30 1.13 0.00 37.07 1.94 92 T C S 98.33 3.05 14.77 18.56 103.51 -54.62 -89.05 -13.65 90.11 6.88 3.01 31.90 32.21 26.48 0.63 2.24 0.00 5.62 0.91 93 S C S 76.90 3.21 13.98 18.19 113.25 16.30 -98.44 130.65 91.70 4.16 4.14 30.25 34.40 27.54 0.96 2.97 0.00 3.11 0.77 94 R C C 133.08 5.91 14.84 22.01 116.91 12.98 -95.48 138.88 71.68 25.41 2.92 40.03 21.18 10.97 0.66 2.21 0.01 23.40 1.54 95 L E E 60.89 14.45 14.00 28.58 117.73 -129.41 -93.22 134.12 47.67 51.12 1.21 38.99 5.76 2.35 0.31 0.84 0.00 50.44 1.31 96 T E E 53.53 11.23 19.62 31.33 124.87 -165.61 -117.86 138.64 24.53 74.79 0.67 20.64 2.90 0.92 0.29 0.40 0.00 71.39 3.46 97 F E E 58.63 17.77 16.60 33.62 118.95 -154.16 -104.97 132.25 27.23 72.27 0.49 21.47 4.73 1.39 0.19 0.35 0.00 67.50 4.38 98 G C C 24.40 13.01 19.38 31.99 121.19 -156.19 -77.84 -169.32 62.73 36.96 0.31 43.30 15.69 3.37 0.05 0.29 0.00 36.24 1.05 99 G C C 40.80 8.08 22.02 29.88 106.10 -72.14 -77.03 3.53 74.27 25.53 0.20 57.88 12.76 1.93 0.03 0.20 0.00 26.62 0.57 100 G C C 18.79 17.17 16.36 32.46 129.19 -140.47 101.16 175.70 61.51 38.38 0.11 53.90 4.92 0.48 0.01 0.09 0.00 40.07 0.52 101 T E E 36.71 14.72 19.74 34.62 128.90 -109.95 -125.60 144.22 9.64 90.34 0.02 8.79 0.43 0.03 0.00 0.01 0.00 90.53 0.21 102 K E E 103.13 9.86 22.24 32.44 119.29 -139.66 -99.60 134.02 1.10 98.90 0.00 0.94 0.06 0.00 0.00 0.00 0.00 98.96 0.03 103 V E E 13.29 22.02 14.92 36.90 120.77 -165.29 -116.28 130.13 0.81 99.18 0.00 0.78 0.02 0.00 0.00 0.00 0.00 99.18 0.02 104 E E E 97.21 5.52 23.72 29.60 116.51 -152.48 -102.93 127.51 2.11 97.88 0.01 2.08 0.06 0.01 0.00 0.00 0.00 97.76 0.09 105 I E E 24.09 21.26 11.00 31.55 115.45 -156.58 -100.12 125.70 21.39 78.56 0.05 21.51 0.23 0.04 0.02 0.02 0.00 77.46 0.71 106 K C C 129.27 3.98 20.21 24.93 115.10 -159.15 -99.59 130.05 99.43 0.57 0.00 99.47 0.06 0.01 0.00 0.00 0.00 0.44 0.01