# 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 M C C 122.86 4.79 12.02 18.32 111.68 -153.93 -92.03 121.30 99.84 0.14 0.02 99.76 0.09 0.06 0.01 0.00 0.00 0.06 0.02 1 S C C 72.75 5.23 10.45 17.45 113.26 -141.33 -90.73 134.58 90.76 4.84 4.39 82.74 1.48 7.57 1.13 2.25 0.00 3.48 1.35 2 T C C 94.21 4.13 12.48 18.10 107.77 -154.26 -93.33 82.87 85.35 8.38 6.26 52.15 18.28 14.85 1.21 5.40 0.00 5.77 2.34 3 M C C 66.71 14.29 11.96 26.20 118.12 -140.18 -95.93 135.67 85.30 10.71 3.99 66.53 12.94 5.35 0.75 3.65 0.00 8.49 2.29 4 K C C 92.33 9.11 20.49 30.08 122.89 -163.29 -113.16 138.30 79.93 17.76 2.31 65.63 10.74 2.97 0.55 1.89 0.00 15.39 2.82 5 F E B 56.69 15.84 17.86 33.50 122.33 -130.85 -100.26 140.48 17.88 81.95 0.17 13.18 1.20 0.05 0.16 0.02 0.00 10.24 75.16 6 C C C 8.66 20.33 12.96 34.29 109.16 -109.72 -69.91 125.85 95.43 4.52 0.05 95.83 0.56 0.07 0.02 0.02 0.00 2.01 1.50 7 R C T 145.59 4.86 19.07 25.34 93.20 -151.83 -68.39 -26.93 99.77 0.12 0.12 0.81 10.13 88.87 0.01 0.09 0.00 0.07 0.03 8 E C T 111.07 5.25 18.12 24.34 98.50 44.87 -80.80 -40.55 99.76 0.13 0.11 0.18 6.39 93.26 0.00 0.07 0.00 0.05 0.04 9 C C T 40.07 10.89 15.01 27.17 102.28 20.32 -106.70 -8.64 99.65 0.24 0.12 2.00 13.66 84.00 0.01 0.10 0.00 0.09 0.14 10 N C C 89.35 7.68 19.29 28.06 93.98 -124.99 65.06 26.52 99.49 0.40 0.10 74.76 18.83 5.88 0.03 0.07 0.00 0.19 0.24 11 N C C 32.08 14.04 18.05 32.85 127.24 133.34 -94.24 159.29 94.11 5.84 0.05 59.64 34.93 0.43 0.01 0.05 0.00 3.65 1.29 12 I E B 40.54 14.28 23.09 37.63 114.06 -104.87 -77.92 136.10 3.58 96.40 0.02 3.20 0.29 0.01 0.03 0.00 0.00 29.99 66.47 13 L C C 6.61 24.65 17.91 43.11 115.11 -134.87 -88.12 133.37 58.30 41.68 0.01 55.38 2.36 0.05 0.00 0.01 0.00 40.10 2.09 14 Y E E 73.64 11.98 25.36 37.35 119.90 -164.78 -118.02 124.32 44.95 55.05 0.01 41.13 2.89 0.03 0.00 0.00 0.00 55.34 0.61 15 P E E 34.30 18.78 16.66 34.75 115.26 -116.76 -68.51 147.70 27.13 72.86 0.01 26.88 0.40 0.02 0.00 0.00 0.00 72.44 0.26 16 K E E 93.56 8.18 19.65 28.64 126.73 -162.98 -120.82 144.24 1.92 98.07 0.01 1.75 0.12 0.01 0.00 0.00 0.00 97.89 0.23 17 E E E 102.90 8.58 13.27 23.20 116.75 -125.80 -93.13 132.35 1.33 98.66 0.01 1.22 0.09 0.01 0.00 0.00 0.00 98.54 0.13 18 D E E 51.59 7.50 10.19 20.03 109.25 -150.54 -104.49 108.65 14.30 85.67 0.03 13.58 0.43 0.05 0.00 0.02 0.00 85.47 0.46 19 R C T 176.01 1.85 10.51 14.12 93.95 -165.58 -67.63 -30.89 94.55 0.58 4.87 1.08 3.78 88.99 0.11 5.51 0.00 0.44 0.08 20 E C T 163.90 0.39 11.85 10.45 93.67 51.37 -69.67 -36.64 95.08 0.26 4.66 0.63 3.06 90.96 0.10 5.04 0.00 0.16 0.06 21 Q C T 106.79 3.00 11.45 15.58 97.79 29.12 -97.01 -4.56 96.29 0.09 3.62 0.96 2.90 92.11 0.11 3.85 0.00 0.05 0.02 22 S C T 68.82 5.57 13.58 21.17 94.77 -126.98 56.84 41.03 99.61 0.18 0.21 5.24 3.29 91.12 0.03 0.14 0.00 0.16 0.02 23 I E E 39.97 10.56 15.63 28.23 130.79 127.75 -128.17 149.93 5.32 94.68 0.00 4.73 0.38 0.03 0.00 0.00 0.00 94.48 0.38 24 L E E 20.93 16.69 17.24 34.99 115.06 -126.38 -89.84 130.71 0.41 99.59 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.59 0.01 25 L E E 25.69 14.31 21.87 37.09 121.66 -163.75 -110.87 134.40 0.31 99.69 0.00 0.26 0.02 0.00 0.00 0.00 0.00 99.72 0.00 26 Y E E 16.86 21.00 20.12 40.96 126.63 -165.85 -121.25 141.10 0.11 99.89 0.00 0.10 0.00 0.00 0.00 0.00 0.00 99.89 0.00 27 A E E 17.92 12.89 23.81 37.70 124.83 -164.64 -120.98 138.29 0.85 99.15 0.00 0.79 0.02 0.00 0.00 0.00 0.00 99.13 0.06 28 C E E 7.83 20.15 14.73 35.73 113.47 -127.76 -79.46 135.34 31.91 68.05 0.04 30.56 0.91 0.08 0.01 0.03 0.00 67.59 0.83 29 R C T 121.04 7.08 20.15 28.04 93.64 -137.58 -67.43 -25.84 95.74 3.03 1.22 3.52 28.99 63.27 0.06 1.18 0.00 2.70 0.28 30 N C T 90.04 5.94 18.38 24.95 99.82 41.90 -93.61 -5.23 96.73 1.93 1.34 3.44 32.19 61.34 0.06 1.22 0.00 1.34 0.40 31 C C S 35.19 13.14 12.33 25.97 130.18 33.14 -131.84 155.82 93.15 4.53 2.31 23.81 54.45 15.07 0.24 2.22 0.00 2.59 1.62 32 D C S 115.89 2.57 18.19 21.19 95.50 -128.34 -76.33 4.39 93.70 5.08 1.22 39.71 43.57 10.68 0.31 0.99 0.00 3.98 0.75 33 H C C 75.80 9.60 15.46 26.33 117.17 113.10 -83.85 140.81 81.38 17.65 0.97 65.39 12.29 2.41 0.39 0.61 0.00 18.11 0.80 34 Q E E 78.23 15.31 14.52 29.34 129.67 -170.11 -128.39 143.30 29.13 69.58 1.28 27.16 1.29 0.28 0.92 0.44 0.00 68.98 0.93 35 E E E 80.24 8.04 20.36 29.53 132.16 -175.21 -136.97 150.49 3.17 96.30 0.53 2.86 0.21 0.06 0.43 0.13 0.00 95.26 1.04 36 A E E 61.16 8.87 18.65 28.15 115.24 -106.64 -72.68 142.52 9.52 89.88 0.60 8.59 0.64 0.22 0.39 0.24 0.00 89.22 0.71 37 A C C 17.17 19.73 9.84 28.71 117.36 -128.67 -88.25 144.68 78.70 18.92 2.38 72.07 3.50 1.67 0.56 1.66 0.00 19.84 0.69 38 D C C 113.80 2.12 17.54 19.81 106.85 -145.45 -90.15 48.99 85.90 9.86 4.24 48.68 25.28 12.01 1.31 3.19 0.00 8.28 1.25 39 D C S 90.46 5.33 14.43 20.90 116.45 12.96 -103.39 134.81 85.85 6.98 7.17 24.81 38.40 22.91 3.00 4.10 0.01 5.62 1.14 40 N C C 106.38 5.43 14.87 21.49 100.36 -105.72 -83.66 15.49 80.89 11.82 7.29 32.58 30.33 18.56 3.38 3.82 0.01 9.82 1.49 41 C C C 51.34 11.23 12.32 24.51 113.82 114.58 -93.13 124.20 59.60 33.12 7.28 35.70 17.91 7.06 4.73 2.46 0.03 28.91 3.19 42 V E E 70.80 9.51 14.67 25.14 109.00 -166.55 -98.19 54.31 42.92 50.09 6.99 29.42 10.47 3.83 5.34 1.69 0.01 46.47 2.77 43 Y E E 104.96 9.77 14.37 25.14 120.84 38.01 -114.86 135.24 36.63 55.87 7.50 27.72 6.34 2.74 5.98 1.62 0.01 53.51 2.09 44 R E E 126.09 8.15 14.63 24.17 121.67 -167.29 -117.43 134.26 43.94 48.46 7.60 34.87 5.92 2.47 6.01 1.57 0.00 47.80 1.36 45 N C C 79.10 9.36 13.54 23.93 115.86 -163.65 -113.40 126.76 54.16 39.27 6.57 40.39 9.74 3.13 4.80 1.62 0.00 39.38 0.94 46 E C E 111.94 6.21 15.61 23.36 119.15 -151.99 -107.68 130.73 49.70 43.54 6.77 41.82 4.69 2.05 5.05 1.60 0.00 43.02 1.78 47 V C C 53.33 13.19 11.36 25.17 118.49 -161.07 -106.74 128.92 51.51 42.98 5.51 45.49 3.47 1.45 4.61 1.14 0.00 41.18 2.66 48 H C C 133.14 3.70 15.95 21.13 114.56 -162.69 -106.50 120.81 61.69 34.16 4.15 52.36 6.26 1.85 3.53 1.01 0.00 32.29 2.70 49 H C C 69.54 11.82 10.28 22.81 125.29 151.25 -115.45 146.70 79.14 16.91 3.95 67.17 9.84 1.73 3.25 0.95 0.00 15.22 1.85 50 S C C 58.82 3.16 16.47 19.89 117.20 -109.95 -74.63 155.57 87.72 7.19 5.09 81.21 4.97 1.56 4.34 0.95 0.00 4.95 2.02 51 V H H 92.08 7.48 10.72 19.62 92.82 -109.11 -60.05 -33.29 41.65 1.59 56.76 10.66 6.87 22.46 38.20 20.00 0.16 1.01 0.64 52 S H H 82.00 1.89 14.33 16.52 94.16 58.32 -70.73 -23.40 42.28 1.23 56.49 10.62 6.48 23.71 39.04 18.79 0.12 0.76 0.49 53 E H H 87.55 7.18 12.86 21.38 96.35 60.93 -76.68 -20.11 34.42 1.73 63.85 17.83 7.37 9.51 44.84 18.87 0.04 1.01 0.53 54 Q H H 72.03 12.75 12.64 25.32 97.22 72.34 -72.46 -27.79 36.28 2.10 61.61 23.83 6.43 7.50 52.55 7.81 0.02 1.27 0.58 55 T H H 70.95 7.18 15.45 23.47 99.56 67.14 -79.07 -22.35 36.31 3.45 60.24 24.62 5.65 7.07 53.36 6.16 0.02 2.42 0.71 56 Q H H 101.45 4.66 17.55 22.73 97.81 62.19 -75.29 -23.38 33.10 5.11 61.79 22.38 5.38 6.76 55.64 5.09 0.04 3.82 0.90 57 I H H 48.44 13.16 15.45 28.95 97.36 65.44 -70.77 -39.23 24.88 5.10 70.01 18.01 3.71 4.78 64.95 3.73 0.03 4.05 0.75 58 L H H 52.08 15.27 15.15 29.82 95.67 55.24 -68.87 -36.33 17.55 2.58 79.87 11.99 2.62 4.36 73.59 4.85 0.02 2.22 0.36 59 S H H 68.76 3.78 18.42 22.62 94.04 54.98 -67.22 -36.28 18.33 1.43 80.24 9.02 3.01 7.37 73.23 5.90 0.04 1.14 0.29 60 D H H 77.46 5.11 18.51 24.04 95.26 46.63 -73.29 -29.68 22.11 0.93 76.96 10.80 3.30 9.13 69.34 6.46 0.04 0.65 0.27 61 V H H 24.06 17.69 13.51 30.95 93.57 65.30 -67.08 -36.21 18.54 1.04 80.42 7.48 3.18 8.58 65.50 14.14 0.09 0.70 0.33 62 A H H 48.16 11.52 15.33 27.44 91.81 61.59 -67.19 -24.85 30.24 0.85 68.91 5.22 3.46 20.69 56.77 12.77 0.17 0.53 0.38 63 S C T 85.39 1.82 17.93 19.31 95.35 52.28 -90.80 -5.48 50.69 0.61 48.70 6.01 6.38 36.98 36.06 13.67 0.13 0.30 0.46 64 D C C 43.88 12.99 9.31 23.06 109.16 107.06 -84.95 115.20 99.61 0.25 0.14 84.55 14.61 0.39 0.07 0.05 0.00 0.07 0.27 65 P C T 111.98 2.28 14.51 18.26 92.25 -159.27 -67.93 -16.07 99.51 0.08 0.41 3.51 6.01 90.02 0.03 0.36 0.00 0.04 0.03 66 T C T 93.43 3.76 15.89 20.78 94.07 61.86 -85.87 -7.08 99.28 0.30 0.42 3.19 5.42 90.71 0.02 0.40 0.00 0.20 0.06 67 L C S 24.31 20.51 9.70 29.40 116.84 100.07 -78.34 138.26 97.45 2.48 0.07 26.49 71.40 0.28 0.02 0.04 0.00 1.24 0.55 68 P C C 65.02 6.32 21.69 28.33 114.55 -110.72 -67.11 146.38 95.18 4.78 0.03 93.96 1.55 0.15 0.00 0.02 0.00 3.88 0.42 69 R E E 100.99 16.30 15.19 30.52 125.92 -151.64 -113.54 144.85 26.02 73.74 0.24 23.05 1.72 0.21 0.15 0.13 0.00 47.42 27.32 70 T E E 34.36 13.57 14.59 29.01 124.43 -148.64 -111.46 147.10 39.57 60.09 0.34 37.87 1.43 0.28 0.12 0.22 0.00 56.57 3.49 71 K C E 147.53 3.53 17.80 22.46 97.36 -145.95 -81.27 -19.49 55.37 44.16 0.47 23.55 28.22 3.82 0.05 0.50 0.00 42.86 1.00 72 A E E 69.10 5.23 18.55 24.53 107.65 47.72 -105.19 90.75 45.47 54.00 0.53 20.97 19.93 4.33 0.06 0.55 0.00 53.55 0.61 73 V E E 32.10 16.37 13.43 30.21 121.60 156.77 -115.73 132.11 44.59 55.01 0.40 33.67 9.79 0.72 0.08 0.35 0.00 54.21 1.18 74 R E B 133.48 4.58 22.63 27.77 116.55 -136.47 -95.67 133.85 20.68 79.15 0.17 19.38 0.83 0.08 0.14 0.05 0.00 38.32 41.20 75 C C C 7.17 22.54 9.66 32.31 109.12 -120.89 -73.34 123.84 95.77 4.18 0.05 96.08 0.50 0.10 0.01 0.02 0.00 2.56 0.73 76 A C T 70.18 3.91 19.02 23.80 92.93 -149.13 -65.77 -27.61 99.34 0.23 0.42 0.75 9.39 89.17 0.02 0.46 0.00 0.14 0.08 77 K C T 120.37 5.08 17.18 23.37 98.36 46.84 -78.91 -38.45 99.54 0.10 0.36 0.13 6.01 93.43 0.01 0.34 0.00 0.04 0.03 78 C C T 41.02 11.07 13.57 25.81 102.32 22.26 -108.45 -7.95 99.42 0.26 0.31 1.08 10.31 88.02 0.01 0.35 0.00 0.14 0.08 79 Q C C 133.96 3.00 18.93 22.74 93.62 -123.35 63.12 30.06 97.50 2.28 0.22 78.49 10.93 8.12 0.06 0.18 0.00 1.19 1.02 80 H C C 49.07 13.90 13.58 28.17 118.12 145.55 -87.90 145.97 87.95 11.90 0.15 80.23 7.15 0.71 0.03 0.16 0.00 8.93 2.79 81 G C S 33.85 8.10 21.24 29.87 96.71 -128.66 -71.24 -23.21 55.33 44.48 0.19 15.46 38.89 1.78 0.04 0.18 0.00 38.07 5.59 82 E E E 70.33 10.25 23.16 33.54 130.81 29.33 -129.65 145.89 15.44 84.34 0.21 11.62 2.97 0.56 0.04 0.16 0.00 84.23 0.42 83 A E E 5.07 23.78 17.25 41.12 132.96 -170.09 -133.85 151.86 3.73 96.19 0.08 3.57 0.21 0.03 0.03 0.03 0.00 96.02 0.12 84 V E E 24.29 13.70 25.31 39.82 122.80 -145.42 -114.90 134.21 0.80 99.19 0.02 0.76 0.04 0.00 0.01 0.00 0.00 99.15 0.04 85 F E E 24.53 21.01 19.60 40.08 122.73 -159.69 -111.32 136.56 1.28 98.69 0.04 1.14 0.07 0.01 0.01 0.01 0.00 98.71 0.05 86 F E E 46.93 13.53 21.50 35.48 126.73 -169.34 -120.87 143.25 7.67 91.75 0.57 6.09 0.92 0.31 0.27 0.20 0.00 92.00 0.22 87 Q E E 75.08 12.89 18.69 31.54 120.77 -142.34 -106.45 133.36 16.15 82.04 1.81 13.11 2.18 0.94 0.90 0.67 0.00 81.47 0.72 88 A E E 30.47 13.11 15.02 29.00 126.25 -170.27 -120.10 147.04 33.49 63.06 3.45 28.44 3.64 1.63 1.76 1.34 0.00 62.16 1.03 89 T E E 88.20 5.02 15.66 22.09 115.74 -140.95 -98.54 133.14 45.56 49.68 4.75 35.70 7.45 3.13 2.54 2.12 0.02 46.88 2.15 90 A C C 52.47 8.52 10.72 20.48 120.88 -155.06 -111.70 144.34 56.90 38.19 4.91 41.13 11.28 5.33 2.16 2.70 0.03 34.13 3.25 91 R C C 170.39 2.53 11.44 15.38 113.40 -136.84 -97.21 130.59 65.35 26.20 8.46 29.29 23.24 15.67 3.02 4.81 0.17 20.43 3.37 92 G C T 47.14 3.22 9.97 14.87 124.64 58.92 117.78 -177.50 78.94 8.16 12.90 20.05 28.88 31.98 2.46 9.10 0.03 5.54 1.94 93 E C T 157.82 1.37 10.71 12.56 95.72 -62.16 -70.50 -21.93 83.43 2.29 14.28 14.77 24.66 44.69 2.26 11.27 0.01 1.37 0.97 94 E C T 143.68 1.99 11.60 14.38 103.12 46.27 -91.81 9.47 83.23 4.70 12.07 14.08 23.86 45.91 1.82 9.69 0.02 3.26 1.35 95 G C C 29.87 6.09 14.39 21.83 126.42 -91.08 119.64 -174.73 69.93 26.83 3.24 31.42 23.25 17.29 0.45 2.79 0.01 22.73 2.07 96 M C E 70.69 10.98 13.93 25.86 119.62 -60.53 -95.62 140.91 50.42 49.27 0.32 44.61 3.43 0.77 0.06 0.24 0.00 50.00 0.89 97 T E E 29.50 12.90 17.82 32.12 125.31 -160.96 -118.95 140.11 10.77 89.17 0.05 9.57 0.82 0.09 0.01 0.02 0.00 89.10 0.37 98 L E E 30.06 16.21 19.75 36.51 119.43 -141.58 -104.79 130.16 1.70 98.29 0.01 1.51 0.09 0.01 0.00 0.00 0.00 98.36 0.03 99 F E E 23.86 16.93 22.47 39.68 124.22 -168.29 -115.37 138.09 0.62 99.37 0.00 0.55 0.03 0.00 0.00 0.00 0.00 99.42 0.00 100 F E E 11.80 21.87 22.37 44.09 119.98 -157.43 -109.78 132.18 0.16 99.84 0.00 0.15 0.01 0.00 0.00 0.00 0.00 99.84 0.00 101 V E E 18.85 15.52 25.55 41.52 123.05 -166.56 -118.48 132.52 0.14 99.86 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.86 0.01 102 C E E 6.81 21.16 17.30 39.32 113.69 -126.54 -79.62 134.27 5.00 95.00 0.00 4.69 0.15 0.01 0.00 0.00 0.00 94.94 0.21 103 C C S 42.34 11.61 21.57 34.25 96.99 -160.98 -93.21 -9.39 70.75 29.20 0.04 21.45 47.95 1.10 0.00 0.05 0.00 29.05 0.39 104 N C S 45.98 11.12 15.28 28.13 111.87 95.34 -85.92 122.95 79.48 20.35 0.18 22.47 56.47 1.55 0.04 0.14 0.00 17.48 1.85 105 P C T 98.84 4.46 15.14 21.56 92.11 -140.28 -61.68 -29.32 92.14 0.38 7.47 1.68 12.05 77.09 0.26 8.55 0.00 0.21 0.17 106 N C T 125.77 1.56 17.70 18.65 94.30 54.43 -77.59 -15.25 92.15 0.32 7.52 1.25 8.48 81.50 0.33 8.12 0.00 0.19 0.14 107 C C T 31.62 14.87 12.48 27.55 101.64 42.06 -97.60 -8.53 85.13 8.10 6.77 12.79 14.28 57.20 0.44 7.57 0.01 6.55 1.16 108 G C C 31.62 8.21 19.04 28.25 99.30 -147.97 74.63 9.99 68.73 30.38 0.89 56.50 7.52 3.36 0.11 1.06 0.00 30.04 1.43 109 H E E 54.13 14.79 16.20 31.23 118.06 150.59 -80.52 144.93 35.36 64.54 0.10 30.62 2.91 0.53 0.01 0.10 0.00 65.30 0.53 110 R E E 96.71 11.20 21.40 32.74 131.16 -168.50 -130.79 146.59 5.23 94.74 0.02 4.96 0.30 0.03 0.01 0.01 0.00 94.12 0.57 111 W E E 52.53 18.73 14.48 32.76 123.83 -142.03 -109.58 144.00 4.39 95.57 0.03 4.15 0.24 0.04 0.02 0.02 0.00 94.34 1.20 112 R E E 115.48 7.70 16.94 25.83 124.00 -153.90 -115.44 142.08 41.01 58.89 0.10 40.46 0.41 0.32 0.03 0.05 0.00 57.64 1.10 113 E C C 119.17 7.07 15.34 23.59 110.35 -110.97 -73.01 133.61 99.68 0.31 0.01 99.60 0.12 0.03 0.00 0.00 0.00 0.25 0.01