# 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 108.24 6.17 20.51 27.40 121.57 -161.25 -108.83 134.81 98.84 1.16 0.00 98.85 0.08 0.01 0.00 0.00 0.00 1.04 0.01 1 V E E 33.16 20.61 11.97 31.53 122.29 -160.39 -113.97 134.75 32.97 66.99 0.05 33.04 0.33 0.05 0.01 0.02 0.00 66.03 0.51 2 Q E E 87.56 6.08 22.81 29.42 122.62 -161.90 -115.74 136.28 7.99 91.96 0.05 7.33 0.48 0.07 0.02 0.02 0.00 91.77 0.30 3 L E E 44.38 20.68 14.84 34.52 120.28 -150.75 -103.82 133.32 7.22 92.73 0.05 6.79 0.31 0.05 0.02 0.02 0.00 92.63 0.19 4 V E E 49.28 11.26 21.89 33.69 123.91 -168.50 -119.60 136.75 9.56 90.30 0.14 8.61 0.71 0.14 0.05 0.07 0.00 90.08 0.34 5 E E E 91.33 13.53 19.49 32.52 116.03 -132.84 -88.02 130.98 21.72 77.94 0.34 18.81 2.39 0.53 0.10 0.21 0.00 77.31 0.65 6 S C C 29.89 17.39 17.06 33.58 103.75 -166.32 -92.25 -4.94 63.73 34.91 1.36 52.03 7.63 2.61 0.19 1.25 0.00 35.31 0.98 7 G C C 41.43 8.22 21.00 29.15 102.10 -112.88 79.79 0.99 77.84 20.96 1.20 35.89 28.88 13.43 0.10 1.38 0.00 19.02 1.30 8 G C S 31.60 13.49 18.33 30.84 115.47 3.21 93.39 150.11 82.22 16.67 1.11 30.19 37.54 14.66 0.08 1.31 0.00 14.93 1.29 9 G C S 31.39 10.10 20.22 30.34 112.16 -115.45 88.74 -151.32 67.24 32.39 0.36 27.69 36.72 3.39 0.04 0.41 0.00 30.62 1.14 10 L E E 76.03 12.03 21.24 32.86 117.31 -15.51 -96.35 131.91 25.79 74.10 0.11 19.95 5.64 0.45 0.02 0.11 0.00 72.15 1.68 11 V E E 20.25 20.78 14.77 35.17 125.43 -170.82 -120.13 138.51 8.89 91.08 0.03 8.43 0.89 0.02 0.03 0.01 0.00 76.11 14.51 12 R C C 125.22 5.09 23.39 28.96 120.52 -133.42 -89.64 147.78 90.36 9.63 0.02 90.49 0.47 0.04 0.00 0.01 0.00 8.52 0.48 13 P C T 70.05 12.46 14.65 27.37 109.81 -86.34 -58.96 137.04 99.15 0.65 0.21 0.32 2.49 96.52 0.00 0.18 0.00 0.43 0.06 14 G C T 50.83 3.26 19.30 23.22 96.57 21.86 87.79 -5.66 99.28 0.53 0.19 0.47 2.91 96.00 0.01 0.18 0.00 0.40 0.03 15 G C C 23.42 9.21 16.30 26.89 128.29 114.16 -90.00 171.96 86.10 13.83 0.06 70.01 15.82 0.28 0.01 0.08 0.00 12.95 0.86 16 S E E 55.11 9.42 20.65 30.83 130.84 -123.63 -124.60 152.02 37.27 62.71 0.02 37.11 0.52 0.03 0.00 0.01 0.00 61.06 1.26 17 L E E 14.80 23.06 15.88 38.79 124.60 -156.38 -119.65 138.65 4.44 95.56 0.00 4.28 0.09 0.00 0.00 0.00 0.00 95.50 0.12 18 R E E 113.95 8.30 25.27 34.27 120.85 -155.53 -113.90 130.05 1.05 98.94 0.00 0.98 0.03 0.00 0.00 0.00 0.00 98.96 0.03 19 L E E 6.58 25.40 17.09 42.84 124.48 -169.85 -118.65 136.92 1.57 98.42 0.00 1.49 0.05 0.00 0.00 0.00 0.00 98.40 0.05 20 S E E 38.99 10.49 26.91 37.83 128.50 -170.25 -124.21 143.94 6.01 93.96 0.03 5.17 0.49 0.03 0.01 0.01 0.00 94.20 0.09 21 C E E 6.54 24.92 17.58 42.56 133.81 -175.82 -138.58 147.86 10.17 89.72 0.10 8.95 0.92 0.10 0.03 0.05 0.00 89.63 0.31 22 A E E 40.45 10.01 26.97 37.43 122.46 -156.92 -110.88 138.29 10.41 89.42 0.17 9.44 0.89 0.15 0.08 0.09 0.00 87.56 1.79 23 A E E 8.77 24.01 15.24 38.90 121.60 -170.31 -122.00 128.38 44.49 55.07 0.44 41.33 2.37 0.49 0.13 0.32 0.00 52.92 2.43 24 S C E 63.01 6.35 21.36 28.45 121.09 -164.55 -102.30 142.54 65.39 33.81 0.80 21.32 19.62 26.23 0.07 0.82 0.00 30.64 1.29 25 G C S 52.83 2.77 21.16 24.07 95.96 16.55 81.30 2.16 78.56 20.86 0.59 17.11 32.46 29.04 0.04 0.70 0.00 19.71 0.94 26 F C C 36.29 21.01 11.10 31.05 119.99 129.78 -92.70 141.72 74.20 25.26 0.54 62.53 8.70 2.12 0.12 0.56 0.00 21.61 4.34 27 S C C 66.74 5.47 22.63 28.47 113.65 -165.23 -111.05 112.19 78.32 21.13 0.55 61.70 12.11 3.71 0.12 0.60 0.00 16.82 4.95 28 F C C 46.06 19.42 13.50 31.77 121.86 113.72 -116.18 134.12 78.72 19.50 1.79 50.74 21.04 7.42 0.35 1.68 0.00 12.96 5.81 29 S C S 73.59 4.72 20.28 25.62 99.94 -166.51 -89.52 -19.45 86.90 11.70 1.40 17.70 42.09 27.61 0.12 1.46 0.00 9.58 1.44 30 S C S 58.65 7.18 21.04 28.43 108.18 25.18 -117.75 18.32 82.19 16.55 1.26 18.60 36.32 27.20 0.10 1.37 0.00 15.35 1.04 31 Y C C 33.39 20.12 16.73 36.23 132.86 82.01 -129.10 150.69 57.66 41.98 0.35 43.56 12.64 1.16 0.07 0.35 0.00 40.86 1.35 32 S E E 18.06 14.53 26.02 40.86 129.43 -155.97 -123.65 151.42 19.64 80.31 0.04 18.12 1.10 0.12 0.01 0.03 0.00 80.10 0.51 33 M E E 4.13 26.30 21.61 48.19 126.78 -156.32 -124.16 138.28 3.03 96.96 0.01 2.84 0.15 0.01 0.00 0.00 0.00 96.88 0.12 34 H E E 29.48 17.53 28.14 45.05 129.74 -174.10 -130.13 144.12 1.33 98.67 0.00 1.19 0.05 0.00 0.00 0.00 0.00 98.74 0.02 35 W E E 7.48 24.69 23.37 47.83 123.15 -153.73 -113.46 136.72 0.94 99.05 0.00 0.81 0.03 0.00 0.00 0.00 0.00 99.14 0.01 36 V E E 11.40 19.53 25.03 44.14 129.97 -172.89 -128.41 144.40 0.41 99.59 0.00 0.38 0.01 0.00 0.00 0.00 0.00 99.61 0.01 37 R E E 41.89 17.51 22.92 39.74 124.23 -160.04 -115.75 137.33 0.57 99.43 0.00 0.51 0.01 0.00 0.00 0.00 0.00 99.46 0.01 38 H E E 59.78 13.66 18.95 32.98 114.02 -137.68 -94.28 127.06 3.13 96.87 0.00 2.90 0.12 0.01 0.00 0.00 0.00 96.76 0.21 39 V C C 39.49 11.35 14.66 27.57 117.77 -144.95 -88.80 144.01 67.76 32.14 0.10 65.93 1.20 0.19 0.01 0.07 0.00 32.06 0.54 40 P C T 92.12 5.60 12.94 20.38 109.44 -87.36 -58.65 134.97 95.91 0.25 3.84 0.26 2.55 92.77 0.04 4.21 0.00 0.13 0.04 41 G C T 68.96 0.34 13.65 11.51 95.38 15.76 82.37 -4.26 95.84 0.08 4.08 0.28 2.27 92.82 0.04 4.53 0.00 0.04 0.02 42 K C T 123.97 4.05 12.80 18.37 107.55 76.43 -110.96 -4.79 90.11 3.97 5.92 8.87 30.00 49.61 0.17 7.88 0.00 2.74 0.73 43 G C C 30.28 5.04 17.77 23.97 128.43 -120.13 92.52 -167.01 60.17 39.75 0.09 45.16 13.81 1.17 0.01 0.09 0.00 38.88 0.87 44 L E E 50.24 16.91 14.72 31.47 115.03 -26.68 -75.15 136.05 17.49 82.50 0.01 15.61 0.81 0.04 0.00 0.01 0.00 83.40 0.13 45 V E E 41.66 12.56 21.68 34.85 125.63 -169.20 -124.28 136.62 0.90 99.09 0.00 0.79 0.03 0.00 0.00 0.00 0.00 99.16 0.02 46 W E E 70.85 16.83 21.30 37.70 110.75 -115.89 -72.88 127.71 0.30 99.70 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.70 0.00 47 V E E 6.65 22.39 22.04 44.75 101.40 176.29 -99.73 -31.14 3.39 96.61 0.00 2.38 0.66 0.01 0.00 0.00 0.00 96.93 0.01 48 S E E 2.92 22.46 23.08 45.73 143.71 -2.92 -159.21 156.30 0.59 99.41 0.00 0.45 0.05 0.00 0.00 0.00 0.00 99.49 0.00 49 Y E E 49.61 16.35 25.65 41.44 131.34 -158.81 -136.52 143.05 0.19 99.81 0.00 0.16 0.01 0.00 0.00 0.00 0.00 99.83 0.00 50 I E E 11.32 20.91 19.11 40.35 122.24 -159.81 -118.75 132.80 1.26 98.74 0.00 1.09 0.06 0.00 0.00 0.00 0.00 98.74 0.10 51 N E E 39.59 9.71 20.47 31.21 122.46 -137.97 -85.65 163.77 48.28 51.65 0.07 44.31 2.17 0.25 0.01 0.06 0.00 52.55 0.63 52 S C T 54.53 13.78 14.68 28.50 91.27 -106.55 -65.02 -20.21 97.44 1.19 1.37 2.73 18.37 76.09 0.05 1.58 0.00 1.01 0.17 53 D C T 103.50 1.98 19.22 20.51 93.62 57.58 -87.59 -3.46 97.50 0.74 1.76 1.78 17.29 78.22 0.06 1.97 0.00 0.49 0.18 54 G C S 26.41 14.66 11.53 26.01 96.26 -112.00 80.19 7.69 96.54 1.24 2.22 12.24 66.40 17.73 0.15 2.29 0.00 0.73 0.46 55 S C S 77.82 2.47 17.38 20.30 97.72 115.03 -82.31 -26.64 97.33 1.96 0.71 31.72 52.62 12.98 0.07 0.79 0.00 1.36 0.46 56 T C C 79.60 4.01 17.95 22.77 125.92 33.64 -125.03 141.41 80.31 19.37 0.33 59.81 18.48 1.63 0.06 0.33 0.00 18.50 1.19 57 K E E 84.95 16.64 12.68 28.44 125.45 -160.51 -122.35 137.26 27.16 72.80 0.04 25.33 1.21 0.10 0.01 0.03 0.00 72.71 0.62 58 I E E 72.75 8.50 21.70 30.86 125.16 -170.87 -125.89 137.01 2.21 97.78 0.01 2.02 0.13 0.01 0.00 0.00 0.00 97.41 0.43 59 Y E E 86.55 16.56 16.05 31.81 125.51 -151.78 -111.88 141.45 8.89 91.08 0.03 8.54 0.36 0.03 0.01 0.01 0.00 89.87 1.17 60 A C C 16.01 17.28 12.76 30.52 113.96 -113.02 -71.04 144.94 91.25 8.57 0.18 89.11 1.88 0.21 0.04 0.11 0.00 8.23 0.42 61 D H G 118.64 1.71 18.50 20.30 92.63 -117.48 -61.28 -33.70 46.80 0.61 52.59 2.59 6.45 36.18 2.58 51.58 0.00 0.37 0.24 62 S H G 56.97 8.35 17.19 26.54 91.12 59.43 -70.75 -18.24 46.16 0.29 53.55 0.95 3.73 40.13 2.07 52.82 0.00 0.17 0.12 63 V H G 7.00 23.22 10.86 34.23 98.14 46.34 -101.54 -2.05 46.42 1.36 52.22 2.79 5.72 36.84 2.90 50.37 0.02 0.88 0.49 64 K C T 124.22 6.73 15.45 24.70 110.23 123.53 -60.24 130.63 92.09 2.98 4.93 2.82 4.27 85.72 1.36 2.70 0.01 1.51 1.61 65 G C T 61.31 1.40 19.01 19.61 94.10 15.06 81.01 -2.35 95.08 0.44 4.48 0.88 4.08 90.85 0.53 3.22 0.00 0.29 0.15 66 R C T 83.06 13.05 17.46 30.57 100.53 77.63 -99.76 -20.22 94.26 1.60 4.14 7.35 20.48 66.42 0.47 3.58 0.00 1.45 0.25 67 F E E 8.02 24.27 13.12 37.86 135.38 34.80 -137.66 152.72 16.70 83.24 0.06 13.21 3.44 0.21 0.02 0.05 0.00 81.19 1.89 68 S E E 46.51 7.29 26.76 34.69 129.27 -161.75 -124.92 148.20 2.99 97.00 0.00 2.79 0.11 0.00 0.00 0.00 0.00 96.98 0.11 69 I E E 20.05 24.18 15.22 39.11 124.48 -158.10 -122.67 133.16 1.73 98.27 0.00 1.68 0.03 0.00 0.00 0.00 0.00 98.25 0.03 70 S E E 46.39 7.13 25.30 32.83 132.15 -177.75 -133.35 150.43 1.85 98.15 0.00 1.65 0.06 0.00 0.00 0.00 0.00 98.25 0.02 71 R E E 83.82 17.58 14.05 30.90 120.96 -143.31 -111.11 131.31 2.92 97.07 0.01 2.52 0.24 0.02 0.00 0.01 0.00 97.09 0.13 72 D E E 54.08 7.15 16.35 25.37 108.63 -155.85 -106.29 106.64 15.17 84.78 0.05 14.65 0.51 0.06 0.01 0.03 0.00 83.78 0.95 73 N C T 95.78 7.48 12.44 21.82 93.58 -168.85 -68.14 -27.63 89.38 0.31 10.31 1.01 4.27 82.66 0.21 11.56 0.00 0.19 0.09 74 A C T 91.50 0.95 14.79 14.93 92.79 55.96 -68.16 -35.77 89.10 0.35 10.56 0.47 3.53 84.16 0.19 11.34 0.00 0.18 0.13 75 K C T 116.12 3.58 15.13 19.47 97.33 31.35 -95.41 -5.35 91.81 0.09 8.11 0.68 3.80 85.97 0.15 9.32 0.00 0.05 0.03 76 N C T 67.07 11.75 14.62 27.54 93.95 -128.39 56.53 42.11 99.71 0.08 0.20 3.68 3.28 92.82 0.03 0.13 0.00 0.06 0.01 77 K E E 55.77 11.03 21.40 33.27 136.50 125.64 -136.89 154.32 6.69 93.30 0.01 5.88 0.55 0.03 0.00 0.00 0.00 92.83 0.70 78 L E E 8.30 23.70 17.89 42.01 120.81 -146.89 -113.68 133.30 0.94 99.06 0.00 0.90 0.02 0.00 0.00 0.00 0.00 99.05 0.03 79 Y E E 49.44 13.01 26.30 39.74 124.06 -166.14 -118.75 136.35 1.32 98.68 0.00 1.21 0.03 0.00 0.00 0.00 0.00 98.76 0.00 80 L E E 4.79 25.59 19.58 45.77 118.95 -155.71 -108.59 129.29 0.29 99.71 0.00 0.27 0.00 0.00 0.00 0.00 0.00 99.73 0.00 81 Q E E 55.89 11.59 27.06 38.97 120.65 -164.51 -114.30 128.95 0.24 99.76 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.75 0.01 82 M E E 11.12 23.99 16.91 41.05 119.85 -165.17 -114.22 130.88 14.79 85.21 0.00 14.98 0.13 0.00 0.00 0.00 0.00 84.12 0.75 83 D C S 63.08 8.26 22.77 31.36 120.07 -158.26 -100.19 145.07 95.23 4.72 0.05 43.04 48.16 3.41 0.00 0.09 0.00 5.09 0.21 84 S C S 54.55 6.85 24.30 31.36 103.56 10.40 58.28 85.14 98.35 1.61 0.04 17.82 76.61 4.01 0.00 0.06 0.00 1.23 0.27 85 L C C 17.45 24.11 12.38 36.23 113.67 -148.25 -78.69 133.44 97.83 2.16 0.01 96.96 1.22 0.02 0.00 0.00 0.00 0.63 1.15 86 R C C 97.45 5.56 24.56 30.30 133.16 -173.87 -127.58 162.24 98.38 1.60 0.03 97.82 0.65 0.01 0.01 0.01 0.00 0.25 1.25 87 V H G 69.45 14.30 16.14 30.24 91.13 -101.79 -59.15 -32.72 4.84 0.03 95.13 0.34 0.36 3.18 0.66 95.43 0.00 0.02 0.00 88 E H G 115.23 5.26 21.82 27.84 90.36 62.30 -70.70 -17.80 4.00 0.04 95.97 0.21 0.27 2.75 0.58 96.16 0.00 0.03 0.00 89 D H G 14.95 21.13 17.11 38.21 94.75 64.08 -87.18 -0.59 5.22 0.06 94.72 1.06 0.65 2.10 0.71 95.43 0.00 0.05 0.00 90 T C C 29.88 18.36 21.88 39.55 113.30 105.60 -83.39 129.19 89.96 6.90 3.15 83.38 6.20 0.88 0.85 2.18 0.00 5.45 1.06 91 A E E 12.81 19.40 24.12 42.39 137.62 155.86 -138.75 162.52 20.11 78.54 1.35 17.43 2.46 0.56 0.70 0.81 0.00 75.90 2.15 92 V E E 26.23 18.38 25.98 43.58 119.52 -113.04 -105.28 132.29 4.87 94.75 0.39 4.53 0.39 0.14 0.19 0.21 0.00 94.19 0.36 93 Y E E 8.34 24.54 23.49 47.57 122.08 -161.54 -112.55 135.05 3.44 96.14 0.42 3.11 0.34 0.16 0.18 0.22 0.00 95.78 0.21 94 S E E 9.58 20.55 27.13 46.74 127.38 -169.07 -120.97 142.25 7.11 92.22 0.67 5.98 0.89 0.39 0.24 0.36 0.00 91.78 0.36 95 C E E 4.93 24.22 23.95 47.49 127.57 -168.44 -124.77 140.71 20.90 77.95 1.15 17.37 2.88 0.84 0.45 0.60 0.00 77.03 0.82 96 V E E 17.56 18.80 24.55 42.80 124.24 -160.88 -116.05 140.86 29.96 67.89 2.15 24.17 4.86 1.57 0.93 1.08 0.00 65.93 1.45 97 R E E 56.88 16.47 20.81 36.76 120.66 -156.31 -109.64 137.17 39.73 57.59 2.68 30.80 7.57 2.56 1.19 1.48 0.01 53.78 2.61 98 L C C 57.02 12.34 17.98 30.86 115.17 -139.37 -95.61 130.66 54.33 43.15 2.52 43.18 8.57 2.94 0.86 1.63 0.01 40.82 1.99 99 V C C 67.28 9.91 15.01 25.86 114.34 -152.47 -98.44 128.69 67.50 27.84 4.66 40.22 17.57 10.82 1.20 3.34 0.02 24.77 2.06 100 H C C 116.81 5.77 13.98 20.99 109.49 -140.26 -95.40 100.68 78.33 16.60 5.07 42.00 20.88 16.51 1.10 3.96 0.01 13.42 2.12 101 Y C C 120.90 7.32 11.14 19.80 115.02 145.51 -104.31 131.55 84.17 9.73 6.09 40.86 22.71 21.52 1.17 4.87 0.01 6.78 2.08 102 D C T 109.43 3.01 13.47 17.71 104.06 -116.09 -86.25 31.76 90.62 5.28 4.10 29.92 29.98 31.28 0.63 3.47 0.00 3.57 1.16 103 W C S 139.18 7.69 12.32 21.10 109.46 85.25 -101.44 84.00 87.49 9.20 3.31 33.48 33.85 21.03 0.55 2.87 0.00 5.94 2.27 104 S C C 55.84 7.48 15.58 24.17 120.19 -152.58 -105.39 138.67 87.12 11.96 0.92 51.74 31.94 4.23 0.20 0.82 0.00 8.89 2.18 105 P C C 57.81 12.61 16.26 28.93 115.00 -104.54 -78.52 146.90 84.39 14.22 1.39 61.63 16.09 6.23 0.26 1.26 0.00 13.09 1.45 106 F C C 55.45 16.03 17.64 33.61 118.33 -142.14 -100.43 132.70 58.02 40.13 1.85 45.28 9.21 3.49 0.52 1.45 0.00 36.70 3.35 107 V E E 52.56 13.95 21.28 35.04 119.37 -155.20 -108.54 128.05 37.83 60.76 1.41 30.87 4.31 1.64 0.72 0.88 0.01 54.08 7.49 108 W E E 48.71 19.51 18.30 36.86 117.91 -166.39 -104.70 134.26 47.16 49.64 3.21 31.83 9.42 7.66 1.20 2.27 0.04 41.67 5.90 109 G C C 23.30 14.91 20.74 34.30 122.20 -71.34 91.10 -162.43 73.35 22.49 4.16 27.88 22.32 25.08 0.74 3.28 0.02 18.22 2.45 110 Q C T 93.85 10.04 21.61 31.28 99.60 -24.16 -83.86 21.98 81.59 12.77 5.65 15.04 28.31 39.12 0.86 4.51 0.02 10.05 2.11 111 G C S 22.81 15.10 19.56 33.61 110.38 -84.94 93.46 6.17 78.34 19.37 2.29 20.81 31.13 26.90 0.23 2.09 0.00 17.55 1.27 112 T E E 26.81 18.62 19.02 36.98 118.07 121.18 -99.79 133.15 48.65 50.97 0.38 39.67 6.80 1.35 0.08 0.32 0.00 50.63 1.14 113 L E E 68.12 11.77 23.85 35.40 117.99 -147.59 -100.94 129.60 12.53 87.34 0.13 10.90 1.42 0.28 0.04 0.09 0.00 86.63 0.64 114 V E E 16.84 22.51 16.77 39.13 121.36 -166.13 -112.98 130.10 5.94 93.99 0.07 5.51 0.39 0.09 0.02 0.04 0.00 93.73 0.23 115 T E E 59.79 8.15 24.10 32.63 121.52 -160.88 -111.46 134.91 5.62 94.30 0.08 5.18 0.39 0.10 0.03 0.04 0.00 93.89 0.35 116 V E E 34.29 19.41 13.06 31.82 120.09 -157.97 -109.32 132.53 15.66 84.19 0.14 14.18 1.08 0.21 0.07 0.08 0.00 83.25 1.13 117 S C C 58.77 5.95 16.64 23.61 123.61 -166.14 -110.26 155.66 53.60 46.26 0.14 50.82 1.30 0.33 0.04 0.09 0.00 46.08 1.35 118 S C C 76.88 5.51 14.77 21.64 108.45 -100.88 -82.12 121.24 99.66 0.33 0.00 99.60 0.12 0.02 0.00 0.00 0.00 0.24 0.01