# 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 Q C C 102.93 5.80 20.82 27.14 115.93 -150.08 -96.40 125.88 99.08 0.91 0.00 99.10 0.08 0.01 0.00 0.00 0.00 0.79 0.01 1 V E E 36.78 20.44 11.67 30.94 121.62 -158.82 -109.53 133.72 42.62 57.34 0.04 42.37 0.40 0.06 0.01 0.02 0.00 56.62 0.52 2 Q E E 86.62 5.73 22.32 28.72 125.19 -170.02 -123.18 140.03 8.94 91.02 0.05 8.14 0.57 0.07 0.02 0.02 0.00 90.87 0.30 3 L E E 51.45 19.39 14.40 32.90 118.75 -142.71 -102.16 130.23 5.65 94.31 0.04 5.32 0.27 0.04 0.01 0.01 0.00 94.11 0.23 4 V E E 56.47 9.45 20.53 30.92 123.53 -170.03 -121.64 135.47 10.04 89.87 0.09 9.05 0.76 0.12 0.03 0.05 0.00 89.54 0.46 5 Q E E 88.79 12.88 16.32 29.15 116.55 -135.77 -91.78 131.62 29.05 70.73 0.22 25.05 2.90 0.51 0.05 0.15 0.00 70.73 0.62 6 S C C 49.33 11.34 15.91 27.73 107.22 -167.47 -97.85 13.98 66.29 33.35 0.36 49.87 13.10 2.11 0.05 0.35 0.00 33.74 0.78 7 G C C 36.43 5.17 19.51 25.33 128.50 -90.42 107.97 -175.56 76.18 23.55 0.27 38.18 34.79 3.17 0.03 0.30 0.00 22.76 0.78 8 S C C 61.63 10.38 16.16 26.96 120.12 -56.88 -89.74 145.39 69.69 30.06 0.26 55.03 11.89 1.33 0.03 0.26 0.00 30.81 0.65 9 E E E 65.82 13.46 17.03 30.71 128.56 -169.88 -129.22 141.90 24.43 75.41 0.16 20.43 4.00 0.39 0.04 0.12 0.00 73.71 1.31 10 L E E 84.51 10.72 19.94 30.91 119.12 -146.16 -105.18 130.78 12.32 87.64 0.05 11.15 1.04 0.07 0.01 0.03 0.00 86.86 0.84 11 K E E 48.72 16.33 15.36 31.64 133.13 171.22 -133.44 151.92 16.08 83.88 0.03 15.31 0.74 0.03 0.02 0.02 0.00 78.13 5.75 12 K C C 110.57 4.62 22.21 26.95 119.01 -113.89 -81.94 149.34 96.18 3.80 0.02 95.32 1.08 0.06 0.00 0.01 0.00 3.20 0.34 13 P C T 64.84 12.93 13.52 26.81 110.10 -85.32 -59.38 137.87 99.58 0.27 0.15 0.21 2.01 97.49 0.01 0.10 0.00 0.15 0.04 14 G C T 51.13 3.16 18.84 22.65 95.45 21.49 87.90 -6.01 99.73 0.17 0.11 0.31 2.22 97.27 0.00 0.08 0.00 0.12 0.01 15 A C C 40.88 9.03 15.61 26.12 122.45 122.77 -82.10 156.84 93.93 6.01 0.06 80.06 13.84 0.23 0.01 0.07 0.00 5.15 0.63 16 S C C 61.15 8.68 18.74 28.54 126.55 -135.15 -112.83 146.37 56.39 43.60 0.02 55.52 0.88 0.04 0.00 0.01 0.00 42.70 0.84 17 V E E 15.39 21.37 15.00 36.34 126.55 -166.09 -126.34 138.41 2.93 97.07 0.00 2.81 0.07 0.00 0.00 0.00 0.00 97.02 0.09 18 K E E 110.68 6.58 24.34 31.78 116.42 -142.62 -99.56 128.35 0.74 99.26 0.00 0.71 0.02 0.00 0.00 0.00 0.00 99.25 0.02 19 V E E 5.47 25.29 15.68 41.57 122.59 -169.37 -118.75 131.84 1.92 98.08 0.00 1.87 0.05 0.00 0.00 0.00 0.00 98.01 0.08 20 S E E 39.32 9.15 26.48 36.16 126.39 -165.51 -116.68 143.98 13.15 86.83 0.02 12.10 0.55 0.03 0.00 0.01 0.00 87.19 0.12 21 C E E 6.65 25.08 16.07 41.29 131.50 -176.06 -133.60 145.46 19.35 80.61 0.05 17.85 0.99 0.06 0.01 0.02 0.00 80.82 0.24 22 K E E 101.16 6.77 26.57 34.14 122.56 -162.55 -116.04 135.58 8.84 91.05 0.11 8.12 0.72 0.11 0.05 0.05 0.00 89.40 1.56 23 A E E 10.29 23.77 13.89 37.17 120.40 -162.25 -111.59 132.87 24.64 75.08 0.28 23.16 1.30 0.23 0.11 0.16 0.00 72.51 2.52 24 S C E 60.32 6.67 20.61 27.88 120.64 -160.66 -110.37 143.90 56.45 42.91 0.65 33.75 18.36 6.33 0.09 0.67 0.00 39.46 1.33 25 G C S 52.94 2.90 20.15 23.24 99.06 13.04 83.97 -3.26 81.42 17.87 0.71 15.68 52.82 12.43 0.06 0.71 0.00 17.19 1.10 26 Y C C 68.52 16.51 13.09 29.03 123.45 103.54 -105.59 145.79 79.88 18.74 1.38 54.15 20.46 5.56 0.27 1.41 0.00 14.85 3.30 27 T C C 72.37 7.18 21.15 28.90 121.36 -154.14 -114.08 138.55 84.74 13.91 1.36 66.08 12.83 5.38 0.29 1.30 0.00 10.48 3.65 28 F C C 40.72 19.93 13.22 32.31 112.11 -153.69 -102.57 110.95 83.77 12.68 3.55 60.60 14.84 7.89 0.91 2.90 0.00 7.89 4.97 29 T C T 82.19 5.95 19.60 26.21 100.63 170.88 -93.19 -17.24 89.75 5.81 4.44 23.61 32.98 33.74 0.66 3.71 0.00 3.96 1.32 30 D C S 93.89 4.95 20.82 26.03 101.27 30.25 -101.50 0.86 87.58 8.06 4.36 13.98 37.94 36.28 0.48 3.64 0.00 6.66 1.01 31 Y C C 42.70 18.16 16.82 34.60 129.56 72.29 -121.46 149.72 66.24 31.76 1.99 39.75 22.57 4.75 0.33 1.76 0.00 29.00 1.83 32 G E E 8.81 15.41 25.07 40.76 130.30 -151.88 -119.90 158.21 30.47 69.35 0.17 26.43 2.91 0.47 0.03 0.14 0.00 69.30 0.72 33 M E E 3.98 26.24 21.24 47.99 125.78 -142.35 -124.11 137.86 5.01 94.98 0.01 4.65 0.26 0.02 0.00 0.01 0.00 94.86 0.20 34 N E E 25.88 16.96 28.09 44.55 130.27 -173.25 -129.57 145.91 1.62 98.38 0.00 1.46 0.07 0.00 0.00 0.00 0.00 98.43 0.03 35 W E E 8.03 24.65 22.56 47.16 123.63 -152.51 -112.90 135.78 1.11 98.89 0.00 0.97 0.05 0.00 0.00 0.00 0.00 98.96 0.01 36 V E E 13.45 18.43 24.40 42.65 129.90 -172.93 -128.14 145.05 0.44 99.56 0.00 0.39 0.01 0.00 0.00 0.00 0.00 99.59 0.01 37 R E E 53.96 16.34 22.09 37.87 123.26 -154.79 -114.01 136.43 0.41 99.59 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.63 0.01 38 Q E E 59.91 12.99 18.28 31.72 116.85 -144.05 -100.72 128.18 3.12 96.87 0.00 2.80 0.15 0.01 0.00 0.00 0.00 96.83 0.21 39 A C C 28.64 10.80 13.87 26.36 117.83 -133.69 -80.07 152.74 79.94 19.94 0.12 77.76 1.23 0.21 0.02 0.08 0.00 20.18 0.52 40 P C T 98.89 4.35 12.73 18.99 109.32 -83.80 -58.59 135.26 95.02 0.23 4.76 0.33 3.06 91.01 0.05 5.37 0.00 0.12 0.05 41 G C T 69.67 0.28 13.05 10.68 95.91 14.46 81.85 -3.40 94.75 0.09 5.16 0.38 2.76 90.86 0.07 5.85 0.00 0.05 0.03 42 Q C T 110.89 4.17 11.66 17.41 106.71 77.55 -107.18 -2.47 87.66 3.55 8.79 12.23 35.63 38.14 0.32 10.58 0.00 2.24 0.85 43 G C C 33.13 4.25 16.71 22.10 126.92 -121.40 90.05 -167.24 74.02 25.82 0.16 56.37 15.91 1.58 0.02 0.18 0.00 24.73 1.22 44 L E E 59.44 15.66 13.36 28.92 115.99 -28.21 -76.90 137.88 28.47 71.51 0.02 25.66 1.12 0.06 0.00 0.02 0.00 72.96 0.18 45 E E E 77.82 9.66 21.55 31.75 127.18 -170.65 -124.98 141.30 1.34 98.65 0.00 1.12 0.07 0.00 0.00 0.00 0.00 98.78 0.02 46 W E E 86.85 16.52 19.67 35.64 111.35 -112.37 -72.63 128.72 0.27 99.73 0.00 0.24 0.01 0.00 0.00 0.00 0.00 99.75 0.01 47 M E E 15.12 20.35 21.81 42.40 100.74 177.03 -101.87 -21.94 3.53 96.46 0.00 2.56 0.71 0.09 0.00 0.00 0.00 96.62 0.02 48 G E E 2.18 18.98 24.22 43.89 144.15 -51.38 162.46 172.49 2.96 97.03 0.00 2.12 0.51 0.07 0.00 0.00 0.00 97.26 0.03 49 W E E 40.69 18.75 25.10 43.02 134.63 -98.81 -139.40 152.00 2.21 97.78 0.00 1.98 0.13 0.01 0.00 0.00 0.00 97.79 0.09 50 I E E 14.58 20.25 20.49 40.89 120.54 -142.80 -112.84 130.80 3.05 96.94 0.01 2.80 0.19 0.01 0.01 0.00 0.00 94.65 2.34 51 N C C 32.72 11.66 20.54 33.66 108.56 -137.37 -87.21 117.31 54.12 45.85 0.03 52.74 1.24 0.11 0.01 0.02 0.00 44.51 1.37 52 T C T 41.68 16.61 15.52 32.19 94.04 -160.26 -69.59 -22.52 99.20 0.41 0.39 0.97 8.29 90.00 0.02 0.34 0.00 0.29 0.08 53 Y C T 150.23 3.76 17.96 22.60 98.79 44.88 -84.71 -36.83 99.50 0.16 0.34 0.24 4.44 94.92 0.01 0.27 0.00 0.08 0.04 54 S C T 67.35 3.10 16.44 19.78 102.98 21.55 -106.71 -14.73 99.51 0.22 0.27 1.48 5.98 92.08 0.01 0.25 0.00 0.13 0.05 55 G C C 33.42 11.44 12.81 24.70 98.33 -124.61 79.79 4.40 98.25 1.47 0.29 72.91 13.11 12.21 0.05 0.26 0.00 0.91 0.54 56 E C C 115.99 2.91 20.81 24.12 118.18 134.31 -86.60 140.58 92.06 7.89 0.05 77.42 14.65 0.35 0.01 0.05 0.00 6.61 0.92 57 P E E 52.98 17.78 13.48 30.24 114.68 -106.92 -66.83 143.77 24.59 75.29 0.13 22.94 1.03 0.13 0.07 0.07 0.00 59.46 16.30 58 T E E 55.66 10.33 20.83 31.46 122.22 -170.51 -120.31 138.86 26.99 72.88 0.12 20.44 6.79 0.42 0.03 0.09 0.00 71.03 1.20 59 Y E E 81.63 16.67 16.51 32.32 127.52 -151.97 -117.88 145.02 18.05 81.68 0.27 14.81 2.16 0.19 0.21 0.13 0.00 60.42 22.10 60 A C C 16.50 16.68 12.94 30.18 114.24 -110.23 -71.26 144.66 91.65 7.84 0.51 90.72 1.14 0.35 0.11 0.32 0.00 6.65 0.71 61 D H G 118.17 1.91 17.28 19.71 93.59 -121.75 -61.52 -33.06 36.52 0.56 62.92 1.97 3.88 28.48 1.38 63.81 0.00 0.36 0.12 62 D H G 103.78 3.28 17.74 21.95 91.12 56.21 -69.44 -13.95 36.72 0.27 63.02 0.88 2.60 31.36 1.19 63.75 0.00 0.16 0.06 63 F H G 15.36 21.78 9.84 31.22 98.15 53.31 -100.75 5.75 33.37 2.01 64.63 6.90 6.11 19.93 1.97 63.27 0.00 1.27 0.54 64 R C T 144.92 5.87 15.08 23.58 111.36 128.86 -64.27 130.18 91.42 3.81 4.77 4.14 4.48 83.24 1.31 2.86 0.01 2.02 1.96 65 G C T 59.67 1.72 18.70 19.98 94.04 15.67 80.35 -2.80 94.23 0.89 4.88 1.32 5.52 87.93 0.61 3.71 0.00 0.64 0.26 66 R C T 84.69 12.67 17.34 30.14 99.59 78.93 -99.14 -19.63 92.82 3.44 3.74 10.27 26.71 55.78 0.44 3.26 0.00 3.12 0.43 67 F E E 10.32 24.15 13.51 37.88 131.91 40.56 -132.72 145.97 14.39 85.42 0.18 11.39 2.68 0.37 0.06 0.12 0.00 83.08 2.28 68 V E E 64.89 7.95 26.26 34.84 127.24 -167.48 -127.80 139.18 2.55 97.44 0.01 2.37 0.14 0.01 0.01 0.00 0.00 97.24 0.23 69 F E E 27.07 23.80 15.60 38.93 126.61 -164.60 -122.35 138.34 3.81 96.17 0.02 3.55 0.19 0.03 0.00 0.01 0.00 95.98 0.24 70 S E E 47.26 7.72 26.07 34.24 127.51 -173.87 -128.31 141.45 16.35 83.57 0.07 14.38 1.48 0.17 0.02 0.04 0.00 83.32 0.59 71 L C E 43.95 21.19 14.55 34.68 124.69 -159.33 -115.32 134.45 51.10 48.68 0.22 43.34 6.78 0.63 0.05 0.19 0.00 47.03 1.97 72 D C C 61.69 8.03 21.08 29.69 111.52 -164.70 -107.02 113.65 86.28 13.48 0.25 81.58 3.67 0.83 0.06 0.20 0.00 11.97 1.69 73 T C T 70.38 12.62 15.40 28.57 94.13 -162.06 -74.59 -14.43 97.46 1.28 1.25 6.53 30.61 60.29 0.12 1.22 0.00 0.94 0.28 74 S C T 76.21 3.38 20.27 23.88 94.66 58.02 -86.71 -11.05 97.29 1.12 1.59 4.42 32.79 60.15 0.18 1.44 0.00 0.76 0.27 75 V C S 38.76 14.25 14.96 29.79 125.71 61.71 -116.33 144.90 93.16 5.53 1.31 33.91 51.79 7.62 0.24 1.12 0.00 3.02 2.30 76 S C S 46.61 12.67 19.96 32.80 98.11 -154.45 -91.93 -7.85 96.45 3.33 0.22 11.41 79.03 5.95 0.02 0.19 0.00 3.06 0.32 77 T C E 40.03 11.54 23.54 35.95 132.38 52.45 -129.85 146.06 50.00 49.75 0.25 30.78 18.62 2.51 0.05 0.27 0.00 45.43 2.35 78 A E E 2.90 25.15 18.41 44.14 128.30 -169.65 -129.08 142.86 24.25 75.67 0.08 22.64 1.32 0.15 0.02 0.06 0.00 75.10 0.70 79 Y E E 54.31 12.96 27.23 40.70 122.73 -156.65 -117.63 134.20 5.32 94.67 0.01 4.78 0.29 0.03 0.00 0.01 0.00 94.74 0.15 80 L E E 2.79 26.27 20.01 47.07 120.66 -162.12 -113.99 130.15 0.87 99.13 0.00 0.82 0.02 0.00 0.00 0.00 0.00 99.15 0.01 81 Q E E 58.91 10.81 27.50 38.87 118.57 -158.92 -109.71 126.74 0.42 99.58 0.00 0.43 0.00 0.00 0.00 0.00 0.00 99.54 0.03 82 I E E 6.22 24.81 16.98 42.53 116.02 -163.50 -111.11 122.13 8.27 91.72 0.01 8.62 0.07 0.00 0.00 0.00 0.00 90.48 0.82 83 C C C 51.28 8.11 22.93 31.32 126.28 -169.59 -112.80 155.90 90.40 9.49 0.11 46.94 35.62 6.82 0.01 0.16 0.00 10.17 0.30 84 S C S 70.45 3.93 24.16 28.30 95.24 10.32 58.95 52.27 98.05 1.92 0.04 8.96 82.56 6.40 0.00 0.05 0.00 1.91 0.12 85 L C C 13.84 24.61 10.32 34.62 115.07 -153.82 -72.79 136.00 98.60 1.39 0.01 98.02 0.90 0.02 0.00 0.00 0.00 0.68 0.38 86 K C C 90.43 4.58 24.53 28.92 131.86 -174.24 -125.32 161.96 97.26 2.69 0.05 97.22 0.35 0.01 0.01 0.02 0.00 0.52 1.88 87 A H G 56.25 12.87 15.59 28.56 91.07 -100.94 -59.50 -32.61 3.73 0.03 96.24 0.24 0.26 2.26 0.26 96.95 0.00 0.02 0.00 88 E H G 126.59 3.54 21.91 26.06 90.10 62.30 -71.98 -16.42 3.11 0.05 96.84 0.14 0.20 1.98 0.22 97.42 0.00 0.04 0.00 89 D H G 12.44 21.55 16.28 38.12 94.09 64.90 -85.25 0.78 4.57 0.06 95.37 0.87 0.51 1.65 0.32 96.60 0.00 0.05 0.00 90 T C C 32.49 17.24 21.53 38.56 115.66 107.66 -80.65 134.73 91.69 8.11 0.20 88.35 3.75 0.13 0.03 0.17 0.00 7.13 0.44 91 A E E 11.38 19.01 23.97 42.23 143.18 154.63 -154.52 172.10 6.30 93.68 0.02 5.89 0.38 0.03 0.01 0.01 0.00 93.12 0.56 92 V E E 24.59 18.09 26.02 43.55 119.90 -105.28 -106.87 133.18 0.96 99.04 0.00 0.95 0.03 0.00 0.00 0.00 0.00 98.99 0.03 93 Y E E 6.61 25.10 23.40 48.22 122.92 -163.98 -112.97 136.09 0.66 99.34 0.00 0.60 0.03 0.00 0.00 0.00 0.00 99.35 0.02 94 Y E E 19.27 20.91 27.84 47.65 131.88 -172.41 -129.29 147.57 1.89 98.06 0.05 1.57 0.14 0.03 0.01 0.02 0.00 98.18 0.05 95 C E E 3.69 24.70 24.89 49.20 126.39 -158.21 -124.46 142.25 11.68 87.86 0.45 9.50 1.60 0.40 0.13 0.21 0.00 87.85 0.32 96 A E E 8.84 19.99 24.26 43.81 125.51 -159.67 -115.39 141.22 22.97 76.15 0.88 19.98 2.66 0.76 0.36 0.47 0.00 74.44 1.32 97 R E E 64.63 15.77 21.69 36.79 120.35 -161.47 -109.93 138.47 45.12 53.50 1.38 30.97 12.57 4.40 0.36 1.10 0.01 48.23 2.36 98 G C C 28.78 10.08 19.74 30.12 122.38 12.74 116.56 -68.51 72.49 25.80 1.71 37.58 24.73 11.43 0.25 1.61 0.00 22.69 1.70 99 G C S 38.30 8.63 16.54 25.66 119.31 10.99 108.66 -165.40 85.96 9.99 4.05 29.62 32.51 24.58 0.55 3.66 0.00 7.45 1.63 100 N C S 101.61 5.54 16.29 22.76 105.05 -46.02 -89.21 23.36 88.70 5.16 6.14 28.32 32.20 28.73 0.97 5.13 0.00 3.12 1.53 101 W C S 124.37 10.32 13.59 24.31 106.24 60.36 -86.42 36.34 82.58 5.59 11.83 27.63 30.06 25.97 2.42 8.71 0.02 3.09 2.12 102 D C T 84.90 7.07 16.49 24.31 103.59 91.99 -83.52 34.67 79.67 6.60 13.74 27.02 25.93 28.35 3.38 9.27 0.04 3.93 2.07 103 W C C 113.75 11.03 16.51 27.56 102.83 57.85 -82.67 -0.09 66.76 16.16 17.08 32.01 17.57 19.28 5.69 10.48 0.17 10.80 4.00 104 Y C C 78.92 13.42 18.41 31.57 100.68 88.86 -85.41 -15.69 58.76 21.82 19.42 31.47 14.82 14.03 8.29 10.57 0.33 16.00 4.50 105 F C C 47.25 17.93 17.93 34.85 109.05 57.45 -91.61 64.37 51.68 27.72 20.60 28.10 13.49 11.53 10.68 9.47 0.71 19.55 6.45 106 D C C 52.39 13.40 20.74 33.68 109.87 67.15 -91.07 106.93 60.29 21.61 18.11 40.37 10.75 9.55 9.56 8.40 0.21 17.25 3.91 107 V C T 51.90 14.82 20.47 34.27 101.53 -129.75 -78.56 -15.16 55.78 23.21 21.00 20.87 15.54 21.58 9.94 9.75 0.78 16.36 5.17 108 W C T 74.45 17.12 19.71 35.33 100.11 47.69 -87.23 1.88 61.48 22.45 16.07 14.61 14.59 32.82 7.14 8.16 0.72 13.74 8.22 109 G C T 23.02 15.79 20.43 34.61 106.19 -8.42 78.50 -39.97 77.91 11.97 10.13 23.71 21.58 34.22 3.21 5.99 0.07 8.44 2.78 110 Q C C 84.26 11.27 22.97 33.57 100.78 74.73 -86.79 0.91 78.89 14.52 6.59 29.10 24.75 26.53 1.80 4.17 0.03 10.98 2.63 111 G C C 14.39 17.29 20.30 36.48 121.07 -106.81 94.14 171.36 72.40 26.29 1.32 39.39 19.57 13.43 0.18 1.22 0.00 24.87 1.34 112 T E E 16.70 21.07 20.80 41.05 121.88 -97.35 -108.61 138.05 24.08 75.81 0.11 20.84 2.51 0.28 0.02 0.08 0.00 75.64 0.63 113 L E E 60.04 12.48 25.65 38.01 116.63 -141.00 -98.04 129.56 2.32 97.67 0.01 2.04 0.16 0.01 0.00 0.00 0.00 97.67 0.13 114 V E E 7.78 24.66 17.70 42.59 121.28 -166.59 -113.99 131.43 0.97 99.03 0.00 0.90 0.04 0.00 0.00 0.00 0.00 99.02 0.03 115 T E E 51.01 9.09 25.38 34.75 120.74 -161.20 -109.71 133.29 2.24 97.76 0.00 2.17 0.07 0.01 0.00 0.00 0.00 97.61 0.14 116 V E E 19.62 21.92 13.76 35.11 118.73 -158.38 -108.03 130.25 20.96 79.00 0.03 20.75 0.32 0.05 0.01 0.02 0.00 78.01 0.85 117 S C C 54.41 7.59 21.16 28.76 121.52 -166.63 -100.70 154.39 99.37 0.63 0.00 99.39 0.07 0.01 0.00 0.00 0.00 0.52 0.01