# 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 111.65 6.17 19.69 26.64 117.39 -148.15 -98.24 131.16 99.21 0.78 0.01 99.28 0.06 0.01 0.00 0.00 0.00 0.63 0.01 1 V E E 34.37 19.74 11.76 30.57 121.33 -161.73 -112.43 132.09 47.81 51.96 0.23 47.15 0.46 0.16 0.09 0.07 0.00 51.39 0.68 2 Q E E 95.60 5.18 22.06 27.85 120.49 -159.48 -110.02 133.13 19.04 80.49 0.47 17.52 1.19 0.31 0.26 0.19 0.00 79.78 0.75 3 L E E 43.17 20.31 13.07 32.44 119.11 -151.10 -99.89 131.88 17.16 82.25 0.59 15.84 1.03 0.35 0.31 0.24 0.00 81.51 0.72 4 V E E 61.97 9.29 20.21 30.18 120.97 -170.96 -114.25 134.97 23.22 75.90 0.88 19.74 2.81 0.77 0.38 0.43 0.00 75.03 0.84 5 E E E 95.05 11.24 18.27 29.55 119.50 -123.80 -103.46 134.72 36.17 62.12 1.71 26.27 8.02 2.80 0.50 1.14 0.00 60.35 0.92 6 S C C 51.92 12.89 16.49 29.14 113.66 -168.58 -99.48 124.63 63.57 34.92 1.51 40.68 14.68 7.80 0.25 1.33 0.00 34.31 0.96 7 G C C 36.35 9.50 18.86 28.49 115.06 -102.04 115.41 141.22 75.05 24.00 0.95 35.29 28.02 11.72 0.10 0.98 0.00 22.90 0.99 8 G C C 33.52 11.80 17.75 29.26 125.58 -88.40 113.67 174.44 71.93 27.58 0.49 42.66 22.99 5.87 0.05 0.56 0.00 26.94 0.93 9 G E E 27.41 10.95 19.46 30.55 135.72 128.45 136.50 -172.72 39.04 60.84 0.12 29.11 9.70 0.83 0.02 0.13 0.00 59.44 0.78 10 L E E 85.05 10.11 21.65 31.81 120.06 -72.70 -105.13 133.84 9.12 90.83 0.05 7.80 1.26 0.10 0.02 0.03 0.00 89.90 0.88 11 I E E 21.69 21.01 14.56 35.23 123.29 -168.17 -118.29 134.26 6.90 93.07 0.03 6.41 0.44 0.02 0.02 0.01 0.00 87.79 5.30 12 Q C C 93.48 5.28 23.39 28.88 120.26 -133.89 -88.49 147.36 90.83 9.14 0.02 90.82 0.46 0.05 0.00 0.01 0.00 8.19 0.47 13 P C T 67.55 12.74 14.64 27.57 109.72 -87.36 -59.45 137.85 99.16 0.62 0.22 0.39 2.63 96.30 0.01 0.18 0.00 0.44 0.05 14 G C T 50.03 3.46 19.39 23.50 96.65 22.20 87.49 -5.44 99.35 0.45 0.20 0.49 3.06 95.89 0.01 0.17 0.00 0.35 0.02 15 G C C 23.48 9.09 16.41 26.86 128.08 114.67 -91.92 174.18 90.28 9.66 0.06 73.19 16.90 0.28 0.01 0.07 0.00 8.88 0.66 16 S E E 54.65 9.25 20.69 30.74 131.01 -118.42 -126.49 152.08 43.09 56.90 0.01 43.35 0.50 0.03 0.00 0.01 0.00 55.28 0.83 17 L E E 14.74 23.12 15.65 38.63 125.67 -160.48 -123.18 138.02 1.80 98.20 0.00 1.75 0.04 0.00 0.00 0.00 0.00 98.14 0.08 18 R E E 113.44 8.01 25.30 33.97 119.02 -153.55 -112.05 127.59 0.59 99.40 0.00 0.57 0.02 0.00 0.00 0.00 0.00 99.40 0.02 19 L E E 6.86 25.49 16.93 42.85 123.66 -169.38 -118.30 134.96 2.67 97.32 0.01 2.50 0.09 0.01 0.00 0.00 0.00 97.34 0.05 20 S E E 36.90 10.45 27.09 37.98 127.25 -166.67 -118.79 143.48 13.40 86.54 0.06 11.73 0.87 0.10 0.01 0.03 0.00 87.14 0.12 21 C E E 5.16 25.55 17.52 43.30 129.30 -173.20 -133.67 140.98 16.37 83.52 0.11 14.78 0.92 0.13 0.03 0.06 0.00 83.76 0.32 22 A E E 38.89 9.78 27.49 37.83 119.47 -164.63 -114.11 132.13 11.39 88.44 0.17 10.12 1.04 0.19 0.06 0.10 0.00 87.22 1.25 23 V E E 11.07 24.19 15.58 39.60 122.66 -172.48 -123.22 131.27 28.67 71.03 0.30 27.48 1.23 0.25 0.10 0.21 0.00 68.21 2.51 24 S C E 57.25 7.61 21.75 29.87 121.65 -161.53 -108.85 141.96 52.74 46.76 0.50 21.96 15.66 17.47 0.06 0.55 0.00 42.94 1.36 25 G C S 49.46 3.28 21.96 25.49 97.01 15.04 81.85 1.54 86.07 13.67 0.26 10.07 51.70 23.22 0.01 0.33 0.00 14.19 0.49 26 F C C 41.69 20.13 12.68 31.94 126.22 112.99 -106.80 148.13 79.28 20.41 0.30 53.94 23.36 2.32 0.04 0.36 0.00 18.22 1.76 27 T C C 75.54 5.72 24.50 30.57 104.57 -145.99 -101.76 24.25 70.02 29.79 0.18 58.15 9.39 1.51 0.03 0.22 0.00 27.96 2.75 28 V E E 16.87 22.64 14.48 36.56 121.02 125.98 -104.61 136.96 45.59 54.25 0.16 41.55 2.98 0.35 0.03 0.15 0.00 51.28 3.65 29 S C E 54.19 7.26 23.46 31.38 99.64 -172.65 -95.18 -28.18 53.10 46.82 0.08 23.40 28.45 1.01 0.00 0.08 0.00 46.70 0.35 30 R E E 87.25 8.55 25.26 34.61 137.99 6.57 -151.11 147.75 16.02 83.91 0.07 11.17 3.89 0.44 0.00 0.06 0.00 84.25 0.18 31 M E E 6.56 26.10 17.23 43.63 129.91 -170.50 -135.70 140.47 3.43 96.57 0.01 3.15 0.16 0.01 0.00 0.00 0.00 96.62 0.06 32 S E E 19.89 13.51 28.04 42.18 132.99 -174.85 -136.23 150.97 0.85 99.15 0.00 0.77 0.03 0.00 0.00 0.00 0.00 99.19 0.01 33 W E E 8.88 24.74 21.27 45.98 126.52 -156.64 -121.08 140.91 0.50 99.50 0.00 0.45 0.02 0.00 0.00 0.00 0.00 99.53 0.00 34 V E E 19.22 16.08 25.03 41.24 127.27 -167.87 -125.00 140.28 0.39 99.61 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.64 0.01 35 R E E 44.11 17.92 21.07 38.31 124.84 -162.19 -117.91 138.60 0.70 99.30 0.00 0.61 0.03 0.00 0.00 0.00 0.00 99.35 0.01 36 Q E E 61.44 11.81 19.49 31.84 117.71 -150.21 -104.55 128.71 6.10 93.89 0.01 5.45 0.34 0.02 0.00 0.01 0.00 93.93 0.25 37 A C C 25.79 11.82 13.76 27.09 118.24 -138.24 -80.71 152.14 76.49 23.32 0.20 72.73 2.23 0.47 0.03 0.15 0.00 23.61 0.78 38 P C T 93.95 5.28 12.91 20.03 109.34 -82.25 -58.87 135.14 95.42 0.34 4.24 0.59 4.52 89.63 0.06 4.91 0.00 0.20 0.08 39 G C T 69.38 0.30 13.34 11.07 95.90 15.17 81.96 -3.90 95.25 0.14 4.61 0.63 4.09 89.74 0.08 5.33 0.00 0.08 0.05 40 K C S 130.72 3.34 11.96 16.79 107.96 71.28 -107.05 -2.08 88.81 4.88 6.31 13.09 38.61 36.32 0.26 7.46 0.00 3.33 0.93 41 G C C 34.53 3.91 16.55 21.50 126.94 -118.10 91.45 -167.00 70.11 29.71 0.17 52.09 16.21 1.65 0.03 0.19 0.00 28.66 1.17 42 L E E 63.72 14.97 13.48 28.37 115.71 -27.27 -76.90 137.35 29.86 70.11 0.03 27.10 1.27 0.09 0.00 0.02 0.00 71.30 0.21 43 E E E 73.60 10.24 21.40 32.12 127.66 -170.45 -127.77 140.79 1.82 98.17 0.00 1.55 0.11 0.01 0.00 0.00 0.00 98.29 0.04 44 C E E 37.37 17.56 19.63 36.76 111.26 -113.34 -72.75 130.30 0.64 99.36 0.00 0.61 0.01 0.00 0.00 0.00 0.00 99.36 0.01 45 V E E 13.37 19.81 22.25 42.07 101.71 176.52 -100.40 -29.86 5.66 94.34 0.01 3.49 1.70 0.03 0.00 0.00 0.00 94.77 0.01 46 S E E 4.14 21.83 23.25 45.06 142.66 -3.64 -156.89 154.47 1.02 98.98 0.00 0.78 0.10 0.00 0.00 0.00 0.00 99.11 0.01 47 V E E 19.07 18.19 25.01 42.93 125.17 -158.23 -126.79 134.32 0.53 99.47 0.00 0.48 0.01 0.00 0.00 0.00 0.00 99.49 0.01 48 I E E 12.06 20.53 21.47 42.15 118.47 -160.95 -112.88 126.20 0.97 99.02 0.00 0.83 0.06 0.00 0.00 0.00 0.00 99.07 0.03 49 Y E E 59.44 13.08 19.94 33.68 120.03 -167.16 -112.08 133.58 11.13 88.81 0.06 9.04 1.38 0.20 0.01 0.05 0.00 89.12 0.20 50 T E E 54.74 12.82 15.46 28.31 111.09 -160.22 -111.43 94.01 37.60 60.84 1.57 8.75 10.95 20.91 0.10 1.48 0.00 56.97 0.83 51 G C T 59.06 2.26 16.51 19.08 97.30 -11.96 67.02 11.26 97.33 1.22 1.45 2.56 15.58 78.90 0.05 1.79 0.00 0.96 0.17 52 G C T 51.43 4.46 14.95 20.26 103.36 -52.01 90.99 0.74 97.58 0.84 1.58 4.42 26.86 66.00 0.06 1.89 0.00 0.63 0.15 53 N E E 89.92 4.38 17.62 23.08 124.56 99.27 -106.08 149.15 31.62 68.20 0.18 23.17 7.23 1.37 0.03 0.18 0.00 67.40 0.63 54 T E E 50.87 17.65 12.87 29.75 127.26 -156.75 -125.39 141.75 10.60 89.38 0.02 9.49 0.60 0.06 0.00 0.01 0.00 89.65 0.19 55 D E E 57.24 9.43 22.42 32.49 131.03 -174.17 -132.65 148.01 2.96 97.03 0.01 2.63 0.21 0.02 0.00 0.00 0.00 96.94 0.20 56 Y E E 79.38 17.43 16.81 33.34 127.66 -158.67 -120.57 145.04 9.37 90.60 0.03 8.86 0.46 0.04 0.01 0.02 0.00 89.42 1.18 57 A C C 15.68 17.08 13.55 31.23 114.44 -109.81 -69.45 144.08 92.38 7.37 0.24 90.65 1.60 0.23 0.06 0.14 0.00 6.90 0.42 58 D H G 116.73 1.93 18.36 20.79 92.19 -117.09 -60.10 -31.68 34.48 0.29 65.23 1.49 3.37 27.74 2.18 64.98 0.00 0.17 0.08 59 S H G 61.67 7.01 17.54 25.70 90.65 62.26 -69.72 -18.66 33.22 0.13 66.65 0.56 1.99 30.10 1.81 65.42 0.00 0.07 0.04 60 V H G 8.42 22.61 10.86 33.58 97.82 44.47 -101.62 -2.44 34.60 0.44 64.96 1.59 3.43 28.48 2.45 63.63 0.00 0.27 0.15 61 K C T 123.41 6.98 15.00 24.50 110.28 123.78 -60.35 131.19 93.56 1.84 4.60 2.53 3.74 87.97 1.20 2.54 0.00 0.91 1.11 62 G C T 61.91 1.27 18.70 19.04 93.48 14.70 80.81 -2.24 95.45 0.34 4.21 0.73 3.55 91.90 0.47 3.02 0.00 0.22 0.11 63 R C T 88.23 12.14 17.34 29.75 99.68 78.72 -100.16 -19.11 94.40 1.52 4.08 7.75 21.97 64.70 0.49 3.48 0.00 1.38 0.23 64 F E E 9.01 24.49 12.39 37.10 133.64 39.98 -134.21 149.76 15.86 84.03 0.12 12.81 2.91 0.24 0.04 0.09 0.00 82.07 1.84 65 T E E 62.92 6.29 26.73 33.66 126.79 -165.60 -125.09 142.70 2.66 97.33 0.01 2.52 0.09 0.00 0.00 0.00 0.00 97.26 0.12 66 I E E 21.00 24.11 14.80 38.65 122.35 -158.33 -118.35 130.84 2.12 97.88 0.00 2.05 0.04 0.00 0.00 0.00 0.00 97.86 0.04 67 S E E 46.47 6.87 25.26 32.49 132.32 172.01 -132.42 152.56 3.27 96.72 0.01 2.98 0.12 0.01 0.00 0.00 0.00 96.83 0.05 68 R E E 87.65 17.77 13.77 30.59 123.62 -151.12 -117.26 134.95 5.57 94.40 0.04 4.86 0.54 0.06 0.01 0.02 0.00 94.07 0.45 69 D E E 56.35 7.59 15.88 25.22 109.56 -154.05 -106.28 108.57 32.91 66.97 0.12 31.70 1.10 0.18 0.03 0.08 0.00 65.46 1.44 70 N C T 104.78 6.26 12.84 21.16 93.55 -164.19 -69.88 -23.00 89.23 0.57 10.20 1.92 9.57 75.57 0.22 12.15 0.00 0.40 0.16 71 S C T 93.18 0.83 15.43 14.89 93.99 57.86 -74.74 -30.05 88.18 0.82 11.00 1.10 9.02 76.17 0.22 12.69 0.00 0.52 0.26 72 K C T 107.13 5.45 15.63 21.90 98.61 34.20 -98.18 -1.16 89.64 0.23 10.13 2.10 16.09 69.07 0.20 12.31 0.00 0.14 0.09 73 N C T 56.15 13.21 15.86 29.82 95.89 -130.48 56.70 41.56 99.41 0.28 0.31 8.51 13.85 77.07 0.03 0.27 0.00 0.22 0.04 74 T E E 26.33 12.35 21.46 35.01 133.32 120.38 -129.93 152.30 17.58 82.41 0.01 14.27 3.12 0.11 0.00 0.02 0.00 80.77 1.71 75 L E E 5.58 24.27 18.77 43.65 121.65 -148.89 -112.69 134.12 2.15 97.85 0.00 2.08 0.06 0.00 0.00 0.00 0.00 97.72 0.13 76 Y E E 47.56 12.97 26.68 40.21 121.08 -161.83 -114.61 131.45 1.82 98.18 0.00 1.62 0.05 0.00 0.00 0.00 0.00 98.32 0.01 77 L E E 3.17 25.95 19.78 46.48 119.62 -160.12 -110.13 129.29 0.24 99.76 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.77 0.00 78 Q E E 55.10 11.29 27.16 38.87 119.55 -162.86 -112.02 127.91 0.11 99.89 0.00 0.11 0.00 0.00 0.00 0.00 0.00 99.89 0.00 79 M E E 8.72 24.31 16.86 41.44 121.32 -170.49 -117.97 129.67 10.64 89.36 0.00 10.89 0.07 0.00 0.00 0.00 0.00 88.42 0.61 80 N C S 68.62 7.52 22.90 30.67 120.74 -154.64 -94.87 151.11 96.41 3.54 0.05 42.70 48.79 4.31 0.00 0.08 0.00 3.95 0.16 81 S C S 60.07 5.67 24.26 30.23 96.25 8.18 58.79 56.83 99.11 0.86 0.03 10.17 84.66 4.35 0.00 0.04 0.00 0.68 0.11 82 L C C 15.33 24.36 11.52 35.78 115.02 -153.01 -74.36 136.58 98.89 1.10 0.01 98.32 0.84 0.01 0.00 0.00 0.00 0.40 0.42 83 R C C 99.02 5.18 25.03 30.36 133.74 -174.83 -127.33 161.12 98.41 1.57 0.03 98.23 0.45 0.01 0.01 0.01 0.00 0.29 1.01 84 A H G 47.27 15.02 15.81 30.63 91.05 -101.80 -59.22 -32.92 3.72 0.02 96.25 0.20 0.24 2.33 0.26 96.95 0.00 0.01 0.00 85 E H G 120.49 4.33 22.22 27.40 90.00 62.82 -71.01 -17.16 3.13 0.03 96.83 0.13 0.19 2.06 0.25 97.35 0.00 0.03 0.00 86 D H G 13.31 21.21 17.11 38.59 94.02 63.96 -85.46 0.02 4.63 0.06 95.31 0.96 0.50 1.61 0.36 96.52 0.00 0.04 0.00 87 T C C 31.05 18.05 21.27 38.91 115.82 108.72 -80.64 134.96 93.47 6.37 0.16 90.54 3.04 0.16 0.02 0.13 0.00 5.79 0.32 88 A E E 12.66 17.82 24.24 41.54 142.32 148.94 -154.63 168.66 5.33 94.65 0.02 5.07 0.29 0.02 0.01 0.01 0.00 94.06 0.54 89 L E E 30.28 17.53 25.61 42.63 119.28 -103.19 -103.20 132.98 0.68 99.32 0.00 0.67 0.02 0.00 0.00 0.00 0.00 99.28 0.03 90 Y E E 7.77 24.76 22.33 46.81 123.66 -164.29 -114.61 138.36 0.50 99.50 0.00 0.46 0.02 0.00 0.00 0.00 0.00 99.50 0.01 91 Y E E 25.19 19.49 27.46 45.99 128.94 -170.05 -125.32 144.38 2.15 97.79 0.06 1.83 0.16 0.03 0.02 0.02 0.00 97.88 0.07 92 C E E 4.11 24.48 23.37 47.61 125.06 -161.66 -117.73 138.54 12.92 86.59 0.49 10.70 1.44 0.35 0.16 0.21 0.00 86.79 0.35 93 V E E 17.26 18.20 24.30 42.12 124.93 -156.40 -113.70 141.89 20.10 78.84 1.06 17.13 2.49 0.78 0.47 0.53 0.00 77.29 1.31 94 R E E 73.18 15.31 20.99 35.66 118.07 -145.79 -99.70 135.67 39.91 58.64 1.45 31.06 7.79 2.51 0.53 0.99 0.01 54.26 2.85 95 G C C 25.66 11.90 18.00 29.92 125.73 -138.22 -107.61 171.89 67.45 31.20 1.35 46.42 15.86 5.53 0.26 1.21 0.00 28.95 1.76 96 S C C 71.76 6.42 15.73 23.21 107.72 -98.98 -91.16 66.28 81.38 15.72 2.90 40.23 25.79 16.47 0.47 2.63 0.00 12.19 2.21 97 G C S 49.26 4.79 14.60 20.56 109.18 10.66 70.87 25.17 90.36 4.92 4.72 24.60 34.48 31.69 0.66 4.14 0.00 3.07 1.37 98 G C S 47.29 4.86 14.20 20.28 109.87 -4.54 86.20 -25.57 90.06 3.37 6.58 26.01 35.49 28.88 1.20 5.27 0.00 1.80 1.33 99 I C C 95.14 7.67 12.57 21.31 107.27 12.19 -87.25 62.86 81.65 6.25 12.10 33.65 26.59 22.46 3.12 8.34 0.02 3.26 2.56 100 H C C 117.73 6.73 14.15 21.95 101.89 66.61 -79.12 -11.30 76.67 6.40 16.94 29.84 20.18 28.21 4.64 11.14 0.04 3.61 2.34 101 D C C 88.73 6.65 16.75 24.14 100.20 58.54 -83.21 0.20 73.72 7.18 19.09 31.50 18.93 24.93 5.68 12.30 0.07 4.34 2.25 102 A C C 40.63 12.78 16.34 29.25 106.15 78.81 -89.45 13.14 67.24 13.07 19.69 36.68 16.19 15.66 6.88 12.25 0.08 9.35 2.93 103 F C C 60.82 16.14 17.20 32.75 116.13 61.58 -99.80 126.04 56.16 27.49 16.35 34.79 12.49 9.63 7.95 8.52 0.22 20.01 6.38 104 D C C 51.34 13.95 19.85 33.52 109.93 -147.05 -95.02 113.36 58.27 29.46 12.27 43.09 8.64 6.49 6.43 5.91 0.05 25.33 4.06 105 I C E 57.41 15.73 20.02 34.86 99.51 -170.16 -83.08 -15.69 53.06 34.73 12.21 25.35 13.92 16.74 5.89 5.94 0.26 27.37 4.53 106 W C E 76.44 16.32 19.50 34.70 100.21 54.76 -90.37 -2.70 53.29 37.39 9.32 21.32 13.79 20.73 4.33 4.66 0.36 27.19 7.64 107 G C C 21.92 14.68 19.62 33.42 118.28 -143.07 77.97 -161.94 75.88 19.79 4.33 36.61 22.06 18.61 1.30 2.83 0.02 16.03 2.55 108 Q C C 101.38 8.65 23.01 31.45 99.13 -33.47 -83.84 -0.15 79.77 17.25 2.99 38.03 26.76 15.60 0.69 2.10 0.01 14.99 1.82 109 G C C 14.76 17.65 18.71 35.21 125.67 -118.78 91.20 176.68 67.61 31.63 0.76 44.56 15.19 7.04 0.10 0.72 0.00 31.38 1.00 110 T E E 24.85 18.51 20.88 38.84 124.74 -101.10 -115.50 140.30 18.24 81.69 0.07 16.05 1.78 0.15 0.02 0.05 0.00 81.32 0.63 111 M E E 76.15 12.11 24.28 36.18 117.96 -136.76 -97.73 130.08 2.09 97.91 0.00 1.88 0.11 0.01 0.00 0.00 0.00 97.91 0.09 112 V E E 9.28 23.75 16.99 40.91 122.23 -167.67 -115.74 131.36 0.92 99.08 0.00 0.90 0.02 0.00 0.00 0.00 0.00 99.06 0.02 113 T E E 56.57 8.22 25.33 33.90 121.13 -158.82 -108.93 134.90 1.57 98.43 0.00 1.51 0.05 0.00 0.00 0.00 0.00 98.32 0.11 114 V E E 18.17 22.13 13.02 34.63 119.17 -157.09 -107.20 132.53 16.96 83.00 0.05 15.69 0.89 0.09 0.01 0.03 0.00 82.39 0.89 115 S C C 56.23 6.28 18.03 25.07 124.42 -159.03 -108.31 156.78 64.12 35.79 0.10 61.33 1.28 0.29 0.02 0.07 0.00 35.98 1.02 116 S C C 76.10 5.76 15.76 22.75 108.52 -98.16 -75.52 134.49 99.80 0.19 0.01 99.68 0.15 0.03 0.00 0.00 0.00 0.12 0.01