# 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 E C C 116.08 5.11 19.79 25.71 115.33 -143.99 -99.49 128.52 99.20 0.80 0.01 99.24 0.06 0.01 0.00 0.00 0.00 0.66 0.01 1 V C C 39.17 19.85 10.82 29.33 121.35 -159.50 -110.46 133.48 53.40 46.37 0.23 52.61 0.44 0.19 0.07 0.08 0.00 45.76 0.85 2 Q E E 100.39 4.25 21.49 26.33 122.28 -164.56 -113.69 136.73 27.56 71.91 0.53 25.09 1.59 0.47 0.21 0.29 0.00 71.54 0.81 3 L E E 55.10 19.45 11.98 30.25 119.08 -145.90 -100.09 132.74 24.19 75.14 0.68 22.42 1.29 0.35 0.28 0.30 0.00 74.65 0.72 4 Q E E 86.48 6.98 19.96 27.89 125.53 -171.92 -120.25 142.56 23.04 75.92 1.03 19.92 2.54 0.82 0.40 0.54 0.00 74.68 1.10 5 E E E 108.95 9.95 16.93 27.63 116.99 -125.68 -89.85 135.64 35.29 63.31 1.40 28.12 5.77 1.95 0.37 0.95 0.00 61.85 0.98 6 S C C 44.76 13.63 15.64 29.04 113.59 -167.96 -101.31 135.92 64.80 34.01 1.18 49.37 10.15 4.05 0.23 1.02 0.00 34.08 1.11 7 G C C 39.50 8.43 18.99 27.60 112.26 -137.12 89.86 -3.32 75.06 24.19 0.76 41.29 25.17 8.72 0.09 0.80 0.00 22.72 1.20 8 G C C 31.71 12.80 17.58 29.79 124.39 -36.69 -133.51 173.45 72.74 26.70 0.57 38.19 27.39 7.52 0.06 0.64 0.00 25.03 1.17 9 G E E 27.54 11.21 19.81 31.00 126.37 94.76 148.48 -173.81 48.87 50.89 0.23 30.33 18.31 1.89 0.03 0.25 0.00 48.24 0.95 10 L E E 80.24 10.94 21.73 32.49 120.55 -58.41 -104.91 135.82 16.95 82.93 0.12 13.65 3.29 0.32 0.03 0.10 0.00 81.14 1.46 11 M E E 24.89 20.89 14.67 35.06 125.54 -168.39 -117.28 140.50 9.67 90.27 0.06 8.54 0.83 0.05 0.05 0.03 0.00 79.74 10.78 12 Q C C 93.63 5.58 23.20 29.04 120.93 -134.51 -92.57 146.23 90.10 9.87 0.03 89.81 0.66 0.07 0.01 0.02 0.00 8.83 0.62 13 P C T 70.14 11.99 14.72 27.07 109.80 -88.00 -59.28 136.85 98.99 0.74 0.27 0.43 2.75 96.00 0.01 0.22 0.00 0.52 0.07 14 G C T 52.29 3.00 19.13 22.64 96.49 20.99 86.10 -5.65 99.25 0.52 0.24 0.52 3.36 95.47 0.01 0.20 0.00 0.40 0.03 15 G C C 24.03 8.81 16.18 26.33 129.51 112.40 -96.49 175.05 88.93 10.99 0.08 64.68 24.25 0.39 0.01 0.09 0.00 9.78 0.80 16 S E E 56.42 8.85 19.92 29.75 130.68 -113.72 -127.15 152.65 47.90 52.08 0.02 47.44 0.68 0.04 0.00 0.01 0.00 50.83 0.99 17 M E E 20.74 21.91 15.57 37.17 127.53 -161.47 -128.27 140.90 2.82 97.18 0.00 2.66 0.07 0.00 0.00 0.00 0.00 97.16 0.11 18 K E E 102.92 7.99 24.85 33.56 120.47 -153.49 -112.47 129.05 0.84 99.16 0.00 0.78 0.03 0.00 0.00 0.00 0.00 99.17 0.02 19 L E E 6.65 25.23 17.02 42.60 123.68 -170.05 -118.47 136.34 2.54 97.45 0.00 2.39 0.10 0.01 0.00 0.00 0.00 97.45 0.05 20 S E E 35.58 10.41 26.83 37.70 127.98 -166.74 -118.29 144.16 9.86 90.11 0.02 8.94 0.46 0.03 0.01 0.01 0.00 90.45 0.10 21 C E E 4.71 25.28 17.33 42.93 131.79 -173.21 -136.41 149.14 12.70 87.22 0.07 11.61 0.67 0.07 0.02 0.03 0.00 87.34 0.26 22 V E E 53.51 9.52 27.58 37.92 123.03 -155.30 -119.44 132.80 9.01 90.87 0.13 8.23 0.76 0.13 0.06 0.07 0.00 89.22 1.53 23 A E E 5.19 24.88 15.94 40.96 121.50 -170.18 -120.14 130.15 30.75 68.90 0.36 29.16 1.55 0.30 0.11 0.25 0.00 66.54 2.08 24 S C E 55.64 7.61 22.51 30.53 124.61 -170.30 -111.72 143.93 54.57 44.83 0.60 21.01 18.64 16.94 0.05 0.65 0.00 41.56 1.14 25 G C S 48.93 3.46 22.39 26.26 96.21 16.55 80.29 3.38 75.58 23.98 0.44 14.41 38.71 22.04 0.02 0.52 0.00 23.51 0.78 26 F C C 32.90 21.38 12.20 32.71 122.17 127.49 -97.73 147.17 71.81 27.80 0.40 61.70 8.12 1.38 0.09 0.42 0.00 24.80 3.50 27 T C C 71.36 6.37 24.19 30.83 117.66 -153.56 -113.73 128.81 77.35 22.14 0.51 66.38 7.82 2.08 0.12 0.49 0.00 17.67 5.44 28 F C C 29.66 21.82 13.70 34.58 112.19 -158.31 -108.61 102.54 80.61 16.14 3.25 54.65 16.75 9.01 0.62 3.02 0.01 11.15 4.78 29 S C T 67.36 5.36 21.31 27.06 99.54 110.32 -87.54 -21.31 86.49 10.37 3.15 11.13 28.16 47.69 0.28 3.06 0.00 8.22 1.46 30 N C T 83.53 7.07 21.11 28.48 103.89 28.76 -112.95 20.02 86.17 11.17 2.66 13.19 26.95 45.85 0.19 2.73 0.00 10.35 0.74 31 Y C C 26.98 20.86 16.26 36.59 130.99 91.95 -125.69 153.94 57.99 41.32 0.69 44.75 11.54 1.44 0.11 0.67 0.00 40.38 1.11 32 W E E 58.71 12.93 26.60 39.90 128.14 -151.65 -123.17 146.12 12.55 87.42 0.02 11.83 0.57 0.05 0.01 0.02 0.00 87.09 0.43 33 M E E 3.02 26.78 20.33 47.70 124.38 -159.42 -120.85 135.12 1.78 98.21 0.00 1.64 0.07 0.00 0.00 0.00 0.00 98.24 0.04 34 N E E 30.69 14.95 28.33 43.29 126.80 -170.43 -122.88 140.64 0.66 99.34 0.00 0.59 0.02 0.00 0.00 0.00 0.00 99.38 0.01 35 W E E 8.02 24.77 21.78 46.50 124.65 -160.37 -115.27 138.71 0.52 99.48 0.00 0.45 0.01 0.00 0.00 0.00 0.00 99.52 0.00 36 V E E 16.72 16.80 24.69 41.51 128.60 -170.66 -125.91 142.50 0.31 99.69 0.00 0.27 0.01 0.00 0.00 0.00 0.00 99.72 0.00 37 R E E 49.37 16.83 21.34 37.71 122.34 -157.32 -110.72 134.20 0.55 99.45 0.00 0.46 0.02 0.00 0.00 0.00 0.00 99.52 0.01 38 Q E E 57.19 12.67 18.03 31.34 118.09 -153.76 -105.41 128.86 4.51 95.49 0.01 3.82 0.34 0.02 0.00 0.00 0.00 95.71 0.10 39 S E E 27.01 9.71 14.07 25.76 120.62 -151.33 -95.45 149.53 43.65 56.32 0.03 40.93 1.55 0.09 0.00 0.02 0.00 56.82 0.58 40 P C T 93.95 5.14 12.02 18.86 93.19 -103.17 -61.25 -30.38 95.41 0.30 4.30 0.25 3.26 91.55 0.05 4.68 0.00 0.16 0.05 41 E C T 166.51 0.50 13.13 11.86 97.19 43.10 -77.71 -25.64 95.25 0.07 4.68 0.25 2.77 91.84 0.06 5.02 0.00 0.03 0.02 42 K C T 131.25 3.15 12.44 16.61 103.19 25.21 -105.71 -8.56 95.13 0.65 4.23 1.61 7.27 85.14 0.10 5.31 0.00 0.45 0.13 43 G E E 26.55 5.34 15.71 22.79 124.73 -129.70 83.99 -165.71 29.01 70.83 0.16 21.04 5.69 2.55 0.03 0.17 0.00 69.58 0.94 44 L E E 57.85 14.99 13.83 28.88 115.09 -15.56 -77.99 134.73 9.98 90.00 0.02 8.44 0.71 0.08 0.00 0.02 0.00 90.69 0.07 45 E E E 71.35 9.94 20.99 31.64 126.88 -172.02 -126.08 139.85 1.14 98.85 0.00 0.96 0.06 0.00 0.00 0.00 0.00 98.96 0.01 46 W E E 85.66 15.81 19.68 35.11 110.55 -114.60 -74.42 126.98 0.35 99.65 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.68 0.00 47 V E E 10.50 20.71 20.99 42.13 101.48 175.14 -100.01 -31.86 2.05 97.94 0.01 1.36 0.40 0.03 0.00 0.00 0.00 98.19 0.01 48 A E E 3.39 21.54 22.09 44.21 143.95 -5.82 -160.31 156.88 0.54 99.45 0.01 0.38 0.04 0.01 0.00 0.00 0.00 99.56 0.00 49 E E E 43.88 15.28 25.41 40.39 127.72 -154.54 -129.77 137.67 0.77 99.19 0.03 0.63 0.04 0.01 0.01 0.01 0.00 99.29 0.02 50 I E E 7.78 22.97 19.64 42.85 120.22 -161.52 -115.76 128.88 3.85 95.87 0.27 3.25 0.31 0.10 0.14 0.10 0.00 95.97 0.14 51 R E E 82.44 10.44 24.28 34.85 121.11 -163.85 -113.95 131.11 12.51 86.70 0.79 9.76 2.20 0.79 0.26 0.42 0.00 86.08 0.49 52 L E E 30.26 17.93 14.22 32.12 115.65 -150.96 -97.35 129.34 38.75 58.76 2.49 30.32 6.54 2.64 0.80 1.53 0.00 56.92 1.26 53 K C C 107.99 6.17 16.23 23.37 109.73 -157.34 -92.80 110.84 65.00 29.50 5.49 34.90 17.08 14.27 0.97 4.41 0.01 26.61 1.74 54 S C T 67.02 4.93 13.26 19.36 111.05 -74.52 -91.55 156.20 81.41 9.88 8.70 17.96 24.24 40.00 1.03 7.36 0.01 7.80 1.59 55 N C T 118.97 3.25 13.14 17.56 99.70 -21.87 -73.66 10.79 89.05 2.36 8.59 14.98 23.62 50.32 0.98 7.79 0.00 1.56 0.76 56 N C T 97.87 4.95 13.35 19.66 106.39 61.59 -101.49 51.65 85.46 8.10 6.43 21.63 28.27 36.32 0.82 5.51 0.01 5.99 1.45 57 Y C C 112.72 10.52 12.72 23.78 109.17 -137.82 -92.35 92.45 68.10 28.43 3.46 34.84 19.94 15.12 0.68 2.88 0.02 23.63 2.89 58 A C E 44.47 8.96 16.87 27.02 116.90 -154.44 -101.41 138.11 55.26 43.11 1.63 41.09 10.35 3.74 0.39 1.28 0.00 41.51 1.65 59 T E E 49.22 15.85 15.47 30.90 121.05 -153.26 -109.23 135.35 34.73 64.38 0.89 29.35 4.31 1.18 0.26 0.56 0.00 63.25 1.08 60 H E E 80.16 10.19 21.86 32.35 126.94 -173.87 -125.66 139.98 16.82 82.53 0.65 13.65 3.03 0.80 0.26 0.38 0.00 79.75 2.13 61 Y E E 68.55 18.36 16.46 33.84 126.68 -151.55 -112.47 145.19 23.50 76.14 0.35 21.15 1.65 0.29 0.23 0.19 0.00 69.81 6.67 62 A C C 14.83 17.21 14.00 31.86 113.77 -108.80 -69.04 143.80 90.10 9.70 0.20 89.07 1.33 0.17 0.07 0.08 0.00 8.60 0.68 63 E H G 146.80 1.89 18.81 21.12 91.69 -121.24 -59.69 -34.04 37.14 0.30 62.56 1.19 2.98 32.72 4.25 58.56 0.00 0.20 0.09 64 S H G 54.49 8.70 17.49 27.25 90.39 62.10 -69.27 -20.60 36.14 0.15 63.71 0.57 2.07 34.09 3.47 59.64 0.00 0.10 0.05 65 V H G 5.33 23.77 11.29 35.57 97.61 41.93 -102.73 -2.70 38.86 0.52 60.62 1.48 3.38 33.59 4.25 56.79 0.01 0.34 0.16 66 K C T 120.50 7.62 15.67 25.58 109.99 123.54 -59.95 130.33 94.33 1.72 3.95 2.13 2.98 90.13 1.07 1.90 0.00 0.81 0.97 67 G C T 60.98 1.44 19.28 20.02 93.31 14.57 81.14 -2.59 95.86 0.27 3.87 0.60 3.03 92.99 0.43 2.69 0.00 0.18 0.08 68 R C T 75.59 13.97 17.52 31.48 99.73 81.52 -99.83 -18.97 94.14 1.86 3.99 6.66 20.76 66.51 0.51 3.38 0.00 1.99 0.19 69 F E E 6.55 25.09 13.02 38.65 133.40 41.45 -133.51 148.30 10.94 88.94 0.12 8.67 2.25 0.20 0.05 0.09 0.00 87.01 1.74 70 T E E 58.69 7.02 26.93 34.65 129.27 -165.24 -128.06 144.14 2.63 97.36 0.01 2.52 0.08 0.01 0.00 0.00 0.00 97.27 0.11 71 I E E 21.47 23.99 15.43 39.11 122.34 -155.01 -115.57 131.06 2.72 97.28 0.01 2.66 0.06 0.01 0.00 0.00 0.00 97.22 0.05 72 S E E 44.12 7.51 25.05 32.94 133.37 170.96 -136.02 154.85 3.55 96.44 0.01 3.20 0.17 0.01 0.00 0.00 0.00 96.54 0.06 73 R E E 89.86 17.12 14.39 30.70 122.01 -144.36 -112.23 135.98 6.62 93.34 0.04 5.79 0.66 0.07 0.01 0.02 0.00 92.85 0.59 74 D E E 50.11 8.52 15.09 25.51 109.18 -155.38 -105.08 109.06 41.99 57.88 0.12 39.95 1.32 0.23 0.03 0.09 0.00 57.22 1.17 75 D C T 100.31 5.40 13.12 20.62 93.50 -165.55 -68.96 -25.77 93.63 0.55 5.83 2.53 12.91 77.04 0.16 6.85 0.00 0.38 0.13 76 S C T 89.60 1.12 15.02 15.42 93.62 56.07 -72.37 -30.82 92.71 0.65 6.64 1.35 12.97 77.26 0.17 7.61 0.00 0.44 0.20 77 K C T 106.03 6.42 14.67 21.87 98.01 31.59 -95.16 -0.46 92.98 0.41 6.61 4.57 27.05 59.78 0.21 7.99 0.00 0.25 0.15 78 R C T 114.01 10.12 16.87 27.70 96.04 -130.33 56.29 40.42 99.07 0.56 0.37 12.56 22.53 63.95 0.03 0.38 0.00 0.47 0.08 79 S E E 21.03 12.64 20.76 34.45 137.34 112.92 -137.04 158.71 25.74 74.23 0.03 21.23 3.96 0.21 0.01 0.04 0.00 73.06 1.50 80 V E E 5.62 23.86 18.74 43.22 123.03 -145.87 -117.81 134.53 2.50 97.49 0.00 2.46 0.08 0.00 0.00 0.00 0.00 97.29 0.17 81 Y E E 43.94 13.77 26.47 40.63 124.32 -163.28 -118.55 136.81 1.61 98.39 0.00 1.43 0.06 0.00 0.00 0.00 0.00 98.50 0.01 82 L E E 3.03 26.03 20.11 46.90 118.73 -157.03 -109.20 129.66 0.27 99.73 0.00 0.26 0.00 0.00 0.00 0.00 0.00 99.73 0.00 83 Q E E 51.41 11.92 27.35 39.72 119.36 -161.45 -109.76 128.56 0.14 99.86 0.00 0.15 0.00 0.00 0.00 0.00 0.00 99.84 0.01 84 M E E 7.44 24.62 17.31 42.38 119.68 -167.74 -113.21 128.79 10.01 89.99 0.00 10.13 0.06 0.00 0.00 0.00 0.00 89.01 0.79 85 N C S 61.27 8.72 23.14 32.04 124.47 -164.56 -104.75 154.53 95.93 4.04 0.04 44.05 47.88 3.41 0.00 0.06 0.00 4.43 0.17 86 T C S 79.12 5.12 24.49 29.99 95.05 11.53 58.10 51.63 99.02 0.96 0.02 9.05 86.28 3.77 0.00 0.03 0.00 0.77 0.10 87 L C C 11.38 24.97 11.38 36.48 114.76 -155.69 -72.74 135.88 99.07 0.92 0.01 98.65 0.67 0.01 0.00 0.00 0.00 0.29 0.38 88 R C C 98.74 5.50 25.32 30.97 132.44 -174.31 -126.19 160.64 99.20 0.74 0.06 99.12 0.22 0.01 0.01 0.01 0.00 0.13 0.49 89 A H G 46.46 15.41 16.30 31.31 91.21 -101.59 -59.37 -32.69 3.09 0.02 96.89 0.22 0.21 1.85 0.28 97.42 0.00 0.02 0.00 90 E H G 119.22 4.56 22.68 28.12 89.67 63.24 -70.84 -16.84 2.52 0.04 97.44 0.13 0.17 1.61 0.26 97.80 0.00 0.03 0.00 91 D H G 8.34 22.96 17.14 40.49 93.41 65.79 -82.88 -3.70 4.09 0.05 95.86 0.83 0.44 1.43 0.41 96.85 0.00 0.04 0.00 92 T C C 33.30 17.76 21.43 38.81 116.11 111.25 -76.30 138.92 95.62 4.29 0.10 92.70 3.04 0.10 0.01 0.08 0.00 3.84 0.22 93 G E E 9.10 13.91 24.97 39.96 144.51 84.37 160.23 -172.18 4.39 95.59 0.02 3.98 0.38 0.03 0.01 0.01 0.00 94.90 0.68 94 I E E 30.64 17.50 25.75 42.89 119.47 -53.47 -102.51 134.41 1.07 98.93 0.00 1.07 0.04 0.00 0.00 0.00 0.00 98.84 0.05 95 Y E E 6.13 25.34 22.80 48.06 122.97 -162.69 -113.09 136.67 1.31 98.67 0.02 1.20 0.08 0.01 0.00 0.01 0.00 98.66 0.05 96 Y E E 21.72 20.17 27.83 47.02 132.19 -171.85 -128.77 148.75 3.76 96.15 0.09 3.23 0.30 0.07 0.02 0.04 0.00 96.16 0.18 97 C E E 4.02 24.58 23.41 47.76 124.95 -156.94 -118.16 140.84 18.60 81.05 0.35 15.55 2.36 0.41 0.10 0.18 0.00 80.82 0.58 98 T E E 15.54 17.95 23.83 41.48 128.46 -166.25 -122.81 147.99 27.51 71.93 0.56 23.79 3.25 0.70 0.24 0.34 0.00 69.48 2.21 99 R C E 81.62 14.07 20.91 34.49 115.98 -134.80 -97.73 134.24 51.83 47.06 1.11 39.65 10.28 2.92 0.32 0.90 0.00 43.22 2.71 100 G C C 27.16 12.11 17.05 29.10 119.19 -130.51 -91.31 170.30 76.19 21.77 2.04 46.16 20.03 10.52 0.32 1.91 0.00 19.33 1.72 101 N C C 104.30 5.38 15.80 22.35 109.31 -110.09 -96.59 99.48 85.82 9.75 4.43 34.90 28.63 23.21 0.71 3.87 0.01 6.56 2.12 102 G C S 46.03 5.07 14.22 20.43 112.11 23.52 81.22 -160.22 90.28 2.75 6.97 22.24 35.10 33.26 1.09 5.72 0.00 1.52 1.07 103 N C S 109.42 4.14 14.11 19.51 104.15 -31.42 -87.76 31.02 86.68 3.23 10.09 28.64 30.63 28.15 2.18 7.33 0.01 1.62 1.45 104 Y C C 117.82 9.24 12.12 22.08 106.31 91.99 -89.95 66.40 77.09 6.85 16.06 34.05 23.82 20.63 4.85 10.13 0.04 3.57 2.91 105 R C C 133.48 6.39 15.48 22.93 102.46 124.20 -78.48 -4.92 69.53 8.01 22.46 33.38 18.81 18.96 7.24 14.05 0.08 4.75 2.74 106 A C C 52.18 9.96 16.50 26.90 98.85 60.12 -76.67 -13.55 62.67 9.80 27.53 32.48 15.05 16.89 8.45 17.86 0.10 6.54 2.64 107 M C C 57.03 15.75 15.59 30.78 107.53 70.36 -91.99 62.02 56.74 14.47 28.78 35.05 11.80 11.42 9.15 18.77 0.06 11.00 2.75 108 D C C 64.69 11.23 20.59 31.69 107.30 96.71 -86.86 72.85 55.75 20.40 23.85 34.59 12.01 11.01 7.68 15.30 0.08 16.64 2.69 109 Y C E 71.90 15.98 20.06 35.24 115.57 96.30 -103.29 122.68 45.94 37.88 16.18 28.39 10.00 9.50 7.20 8.94 0.24 29.62 6.10 110 W C C 47.33 20.28 18.88 37.95 108.32 -149.16 -96.72 76.78 48.68 45.67 5.65 33.26 8.40 6.94 3.38 2.75 0.09 30.82 14.36 111 G C C 19.48 15.96 21.01 35.72 120.41 -151.07 -31.55 -160.02 79.26 18.91 1.83 46.89 21.64 11.13 0.55 1.31 0.00 16.07 2.41 112 Q C C 101.11 8.88 22.91 31.67 101.06 -45.15 -81.38 3.26 83.22 15.11 1.67 37.34 34.51 12.10 0.33 1.36 0.00 12.45 1.90 113 G C C 17.01 17.96 18.50 34.98 122.48 -120.38 88.95 176.50 80.58 18.93 0.50 51.63 22.07 6.20 0.06 0.54 0.00 18.55 0.95 114 T E E 26.81 18.45 20.07 37.84 123.46 -102.18 -109.62 142.02 27.64 72.28 0.08 23.96 2.94 0.27 0.02 0.07 0.00 71.93 0.81 115 S E E 51.60 11.04 24.07 34.90 120.15 -139.94 -103.91 134.54 3.13 96.86 0.01 2.75 0.25 0.03 0.00 0.01 0.00 96.79 0.18 116 V E E 14.56 22.67 16.29 38.57 122.29 -166.99 -116.68 131.54 1.94 98.05 0.01 1.80 0.14 0.02 0.00 0.00 0.00 97.95 0.09 117 T E E 63.86 7.52 23.81 31.59 119.96 -157.29 -106.41 134.08 5.17 94.82 0.01 4.90 0.23 0.03 0.00 0.01 0.00 94.45 0.38 118 V E E 26.76 20.67 12.28 32.07 118.40 -157.90 -108.63 130.15 34.69 65.28 0.04 34.11 0.39 0.07 0.01 0.02 0.00 64.32 1.08 119 S C C 61.18 6.28 19.95 26.52 118.03 -156.53 -96.15 150.78 99.67 0.32 0.00 99.68 0.05 0.01 0.00 0.00 0.00 0.25 0.01