# 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 117.26 5.36 20.48 26.55 114.72 -136.38 -90.34 128.54 99.57 0.42 0.00 99.55 0.09 0.02 0.00 0.00 0.00 0.34 0.01 1 I C C 39.92 19.32 12.39 31.04 118.13 -154.93 -103.65 129.14 56.41 43.44 0.15 55.48 0.50 0.18 0.03 0.07 0.00 42.99 0.74 2 V E E 66.56 7.41 20.72 29.07 118.71 -163.67 -113.28 127.19 19.44 80.32 0.24 17.84 1.29 0.30 0.08 0.14 0.00 79.49 0.86 3 L E E 39.01 19.37 14.02 32.90 117.20 -157.38 -102.07 127.97 14.45 85.35 0.20 13.34 0.93 0.22 0.06 0.11 0.00 84.64 0.69 4 T E E 66.75 7.75 20.80 29.19 118.93 -171.74 -116.60 133.38 22.14 77.58 0.28 19.38 2.15 0.51 0.08 0.19 0.00 76.71 0.99 5 Q E E 67.23 14.19 15.17 29.30 125.67 -163.90 -120.16 140.07 47.82 51.84 0.34 36.32 10.54 1.35 0.07 0.30 0.00 50.25 1.16 6 S C C 57.96 7.88 18.10 26.84 119.72 -135.43 -96.65 146.13 79.54 20.23 0.24 49.99 26.78 2.40 0.03 0.26 0.00 19.61 0.93 7 P C S 73.69 7.85 17.13 25.69 110.92 -45.83 -69.06 146.76 88.27 11.26 0.47 23.48 46.51 17.26 0.03 0.56 0.00 11.66 0.50 8 G C E 32.83 10.31 17.61 28.00 110.14 -144.03 -55.78 -71.96 52.48 47.04 0.48 22.21 22.11 8.63 0.04 0.56 0.00 45.82 0.64 9 T E E 72.25 8.33 19.61 28.74 128.93 9.52 -129.06 141.21 22.04 77.84 0.11 19.30 2.11 0.30 0.02 0.10 0.00 77.69 0.49 10 L E E 25.23 20.37 14.98 34.94 126.91 -169.72 -126.81 138.38 4.40 95.59 0.01 3.99 0.28 0.02 0.00 0.01 0.00 95.50 0.20 11 S E E 63.90 6.84 23.74 31.55 121.75 -157.52 -115.41 132.48 2.75 97.25 0.00 2.47 0.15 0.01 0.00 0.00 0.00 97.27 0.10 12 L E E 18.16 21.41 14.04 35.03 132.24 -174.59 -134.53 149.90 11.03 88.96 0.01 10.41 0.57 0.03 0.00 0.01 0.00 87.47 1.51 13 S C C 53.85 4.96 23.76 28.48 122.70 -125.83 -87.95 156.69 92.61 7.35 0.03 91.65 1.16 0.11 0.01 0.02 0.00 6.54 0.51 14 P C T 62.99 13.42 15.13 28.68 109.53 -77.75 -59.89 135.61 99.03 0.51 0.47 0.34 2.81 96.13 0.03 0.33 0.00 0.29 0.08 15 G C T 46.02 4.44 19.85 25.04 96.44 22.86 88.06 -6.20 99.16 0.38 0.46 0.50 3.42 95.41 0.03 0.34 0.00 0.26 0.03 16 G C C 22.98 9.95 17.11 28.22 125.89 118.40 -82.94 169.00 90.93 8.89 0.18 68.82 21.74 0.54 0.03 0.18 0.00 7.87 0.82 17 R E E 121.41 9.16 20.15 30.66 128.64 -135.39 -125.92 146.90 46.47 53.49 0.04 45.95 0.67 0.05 0.01 0.03 0.00 52.16 1.13 18 A E E 8.80 22.29 16.06 38.28 132.30 -170.41 -134.74 147.90 2.30 97.70 0.01 2.12 0.09 0.01 0.00 0.00 0.00 97.69 0.10 19 T E E 61.87 9.19 25.31 35.02 122.22 -150.77 -116.86 132.15 1.02 98.98 0.00 0.91 0.04 0.00 0.00 0.00 0.00 99.02 0.02 20 L E E 5.05 25.54 17.42 43.54 122.41 -167.94 -117.56 132.45 4.34 95.65 0.01 3.85 0.26 0.01 0.00 0.00 0.00 95.81 0.07 21 S E E 34.38 10.43 26.84 37.79 125.75 -166.57 -118.61 142.27 12.50 87.49 0.01 11.23 0.63 0.03 0.00 0.01 0.00 87.98 0.13 22 C E E 4.25 25.36 16.90 42.67 132.46 -176.99 -135.09 149.53 11.66 88.32 0.02 10.83 0.49 0.03 0.00 0.01 0.00 88.24 0.39 23 R E E 111.42 6.63 26.69 34.10 121.39 -155.34 -116.85 132.53 6.31 93.66 0.03 5.90 0.32 0.03 0.02 0.01 0.00 90.53 3.19 24 A E E 8.70 24.02 11.69 35.33 119.27 -150.37 -96.20 141.99 47.30 52.38 0.32 45.22 1.60 0.28 0.08 0.22 0.00 50.56 2.04 25 S C S 75.66 3.32 21.44 24.89 97.54 -153.14 -86.08 -18.54 88.85 10.42 0.73 27.28 56.09 5.02 0.06 0.73 0.00 10.24 0.58 26 Q C S 92.51 4.14 20.58 25.13 134.46 22.82 -137.83 162.08 90.20 8.86 0.94 10.45 71.75 8.05 0.07 0.82 0.00 8.16 0.70 27 S C C 70.32 6.28 19.54 26.80 115.16 -89.60 -72.49 141.17 89.58 9.24 1.18 76.97 8.31 3.71 0.13 1.41 0.00 8.43 1.04 28 V C C 16.42 22.54 11.40 33.49 124.13 -156.97 -117.74 137.67 68.16 30.98 0.85 60.52 4.90 1.50 0.32 0.61 0.00 18.19 13.95 29 S C C 81.62 2.85 23.18 26.08 101.16 -159.82 -95.79 14.71 85.32 14.03 0.65 57.29 22.77 5.36 0.12 0.70 0.00 11.42 2.35 30 S C S 27.35 14.83 16.44 31.53 132.08 86.98 -121.21 159.30 86.13 12.86 1.01 37.70 41.00 7.77 0.11 1.07 0.00 10.81 1.54 31 S C S 54.00 10.80 21.42 32.44 97.87 -137.45 -88.95 -11.04 87.42 12.26 0.32 15.51 66.11 4.42 0.02 0.30 0.00 13.18 0.45 32 Y E E 54.92 13.85 23.90 38.12 130.71 50.27 -129.51 143.89 22.12 77.60 0.28 16.22 4.85 1.27 0.03 0.27 0.00 76.97 0.39 33 L E E 3.20 26.19 20.32 46.88 129.06 -171.43 -130.46 143.61 2.53 97.47 0.01 2.29 0.14 0.01 0.00 0.00 0.00 97.47 0.08 34 A E E 10.14 18.33 27.85 45.97 128.26 -161.58 -121.68 145.32 0.46 99.54 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.55 0.01 35 W E E 7.61 24.70 23.15 47.61 125.00 -159.04 -114.66 140.34 0.48 99.52 0.00 0.43 0.02 0.00 0.00 0.00 0.00 99.55 0.01 36 Y E E 23.20 17.79 23.85 41.51 133.30 -174.18 -132.81 149.32 0.72 99.28 0.00 0.63 0.03 0.00 0.00 0.00 0.00 99.31 0.03 37 Q E E 43.09 14.44 21.96 36.53 121.41 -145.13 -110.22 135.12 4.12 95.87 0.01 3.43 0.42 0.03 0.00 0.00 0.00 95.99 0.12 38 Q E E 52.81 14.43 15.62 30.43 118.42 -147.93 -102.81 134.07 35.31 64.66 0.03 31.86 2.57 0.11 0.01 0.02 0.00 64.04 1.39 39 K C C 98.49 6.37 15.73 23.41 120.35 -145.32 -98.31 145.96 98.14 1.83 0.03 95.71 2.51 0.16 0.01 0.02 0.00 1.25 0.34 40 P C T 104.50 3.86 11.64 17.41 109.60 -88.01 -58.46 134.08 99.64 0.10 0.25 0.36 3.42 95.89 0.01 0.23 0.00 0.06 0.02 41 G C T 68.97 0.30 13.18 10.86 95.26 17.64 83.72 -2.87 99.70 0.07 0.23 0.47 3.39 95.85 0.00 0.24 0.00 0.05 0.01 42 Q C S 87.60 5.85 10.36 18.29 129.31 97.46 -114.76 159.11 94.21 5.40 0.38 36.78 56.22 1.18 0.07 0.30 0.00 1.83 3.61 43 A C C 72.87 2.68 18.22 20.93 116.81 -98.84 -69.76 151.21 97.51 2.46 0.03 86.15 11.35 0.20 0.01 0.03 0.00 1.92 0.34 44 P C C 39.53 19.03 12.07 30.42 114.90 -100.25 -65.54 144.20 92.20 7.77 0.03 89.90 2.17 0.15 0.00 0.03 0.00 7.52 0.23 45 R E E 98.13 9.19 22.30 31.99 125.25 -161.42 -121.59 139.32 8.75 91.20 0.06 7.77 0.82 0.08 0.02 0.03 0.00 90.55 0.74 46 L E E 51.21 17.48 19.03 35.88 110.66 -115.36 -75.27 126.31 1.17 98.82 0.01 1.05 0.05 0.00 0.00 0.00 0.00 98.85 0.04 47 L E E 19.86 18.94 22.42 41.11 101.55 175.32 -96.42 -33.36 1.94 98.05 0.02 1.28 0.50 0.02 0.00 0.00 0.00 98.17 0.02 48 I E E 10.09 21.85 22.88 44.37 136.03 5.86 -147.27 143.09 0.61 99.38 0.01 0.48 0.04 0.00 0.00 0.00 0.00 99.45 0.02 49 Y E E 50.59 18.63 23.39 40.62 130.36 -173.20 -133.97 139.87 4.99 94.95 0.05 4.18 0.43 0.06 0.02 0.02 0.00 95.13 0.15 50 G E E 11.05 18.24 21.55 38.84 128.81 -149.28 -121.18 162.31 42.11 56.82 1.07 26.73 12.64 3.75 0.24 0.78 0.00 55.13 0.72 51 A C C 37.93 13.59 19.87 33.21 109.15 -110.30 -87.83 127.47 68.02 22.47 9.51 28.64 23.43 18.47 2.24 6.38 0.06 18.60 2.18 52 S C T 57.97 9.95 18.25 28.12 101.80 -87.25 -83.68 -5.72 75.70 6.82 17.48 24.29 24.41 28.92 4.37 11.60 0.07 4.34 2.00 53 S C T 64.36 8.20 17.50 26.10 102.40 48.17 -86.99 7.06 70.55 7.51 21.94 24.15 22.60 26.17 6.11 13.92 0.10 4.66 2.30 54 R C C 118.28 9.64 16.39 26.34 104.84 69.24 -91.28 39.63 63.72 17.10 19.18 34.22 15.50 15.80 7.00 11.45 0.13 11.70 4.19 55 A C C 48.81 13.78 13.93 27.38 106.08 131.41 -85.71 58.42 67.97 17.70 14.33 42.69 13.68 12.57 5.52 8.65 0.06 12.72 4.09 56 T C C 86.48 5.62 17.87 24.57 112.44 121.14 -98.18 113.70 73.47 16.78 9.76 31.48 19.11 24.85 3.37 5.67 0.10 11.98 3.43 57 G C C 39.08 7.22 18.97 26.88 111.26 0.06 95.35 -1.35 85.80 10.80 3.40 36.44 28.34 22.06 0.66 2.76 0.00 7.38 2.36 58 I C C 32.12 21.19 12.09 32.10 116.31 127.75 -92.49 131.10 92.51 7.02 0.46 74.97 16.88 0.86 0.20 0.28 0.00 4.05 2.77 59 P C C 49.82 10.75 16.27 28.06 113.64 -111.78 -66.57 151.15 88.89 3.47 7.64 75.74 5.33 7.23 1.21 7.04 0.00 2.49 0.96 60 D C T 118.96 2.52 18.54 21.81 93.61 -107.26 -65.80 -20.00 73.01 2.35 24.64 11.00 17.92 43.72 1.75 23.39 0.01 1.57 0.65 61 R C T 102.62 10.96 17.99 28.97 95.57 61.38 -89.52 -6.53 64.78 8.37 26.85 11.73 16.17 37.87 2.06 24.06 0.04 7.05 1.01 62 F E E 20.65 23.48 13.31 35.98 115.50 75.98 -106.90 120.85 24.26 64.70 11.04 17.44 6.03 3.95 2.77 6.93 0.03 60.94 1.90 63 S E E 51.42 8.36 23.06 32.32 133.28 148.22 -130.54 153.12 13.09 86.50 0.41 11.01 1.95 0.46 0.22 0.21 0.00 84.71 1.44 64 G E E 22.46 17.50 16.39 32.87 141.82 166.63 -158.80 168.68 12.90 86.93 0.17 10.98 1.67 0.35 0.06 0.09 0.00 86.17 0.68 65 S E E 64.83 5.29 21.77 28.76 135.76 -155.28 -146.63 155.75 21.43 78.41 0.16 18.34 2.51 0.45 0.04 0.11 0.00 77.80 0.75 66 G E E 28.78 11.71 15.78 28.03 140.22 128.50 100.54 177.87 40.90 58.88 0.22 30.20 10.00 1.54 0.03 0.23 0.00 56.40 1.59 67 S C C 75.52 3.56 20.89 25.10 120.58 -105.01 -122.83 129.25 64.84 34.58 0.58 43.77 17.70 4.36 0.11 0.64 0.00 29.63 3.80 68 G C S 32.55 10.55 18.89 29.42 110.73 -44.16 65.95 -131.69 97.27 1.71 1.02 4.04 58.50 34.92 0.04 1.01 0.00 1.23 0.25 69 T C S 58.63 13.54 16.97 30.51 97.80 -9.59 -95.55 -4.34 97.07 2.05 0.88 3.55 58.45 35.30 0.03 0.83 0.00 1.60 0.23 70 D E E 62.35 8.66 22.45 32.15 118.45 82.92 -107.78 129.24 47.67 51.81 0.52 27.14 18.71 4.20 0.06 0.62 0.00 46.84 2.42 71 F E E 7.73 24.69 15.95 41.09 127.59 -173.63 -124.27 142.11 21.24 78.74 0.01 19.87 0.83 0.05 0.00 0.01 0.00 78.59 0.64 72 T E E 36.21 10.43 27.33 38.78 123.74 -164.52 -119.32 135.76 5.79 94.21 0.00 5.15 0.24 0.00 0.00 0.00 0.00 94.50 0.10 73 L E E 2.85 26.30 18.93 46.18 119.63 -161.80 -112.49 128.79 0.41 99.59 0.00 0.40 0.01 0.00 0.00 0.00 0.00 99.58 0.00 74 T E E 39.25 10.21 27.26 38.31 120.05 -164.95 -115.65 128.88 0.18 99.82 0.00 0.20 0.00 0.00 0.00 0.00 0.00 99.79 0.01 75 I E E 7.24 24.20 16.44 41.23 117.64 -166.58 -114.47 124.32 3.19 96.81 0.00 3.37 0.04 0.00 0.00 0.00 0.00 96.11 0.48 76 S C S 45.68 7.49 22.89 30.66 122.06 -167.19 -104.47 155.55 92.84 7.13 0.04 43.50 46.19 2.08 0.00 0.06 0.00 7.98 0.18 77 R C S 143.67 4.06 23.74 27.88 95.63 9.14 57.31 54.46 98.84 1.15 0.01 9.17 87.73 1.94 0.00 0.01 0.00 1.07 0.08 78 L C C 16.66 23.98 10.57 34.12 114.26 -149.17 -75.50 133.65 99.14 0.85 0.01 97.92 1.40 0.02 0.00 0.00 0.00 0.30 0.35 79 E C C 84.67 4.78 24.56 29.12 130.07 -173.19 -124.81 156.74 99.87 0.12 0.01 99.51 0.39 0.00 0.00 0.00 0.00 0.02 0.07 80 P H G 63.65 14.29 15.16 29.39 91.12 -105.07 -58.96 -31.54 3.13 0.02 96.85 0.16 0.18 1.93 0.19 97.53 0.00 0.01 0.00 81 E H G 122.10 4.27 21.77 26.89 90.30 63.33 -71.35 -15.78 2.60 0.03 97.37 0.08 0.14 1.71 0.13 97.92 0.00 0.02 0.00 82 D H G 15.65 20.11 17.29 37.75 94.28 61.84 -86.99 -2.85 3.60 0.04 96.36 0.44 0.35 1.56 0.20 97.41 0.00 0.04 0.00 83 F C C 38.76 18.80 20.52 39.18 116.70 105.58 -78.91 137.03 86.42 13.43 0.15 84.07 2.42 0.07 0.01 0.14 0.00 12.99 0.29 84 A E E 10.84 18.95 23.83 41.97 141.94 159.14 -151.03 171.95 3.79 96.21 0.00 3.55 0.20 0.01 0.00 0.00 0.00 95.95 0.28 85 V E E 26.58 16.80 25.76 42.26 120.46 -110.88 -108.08 131.84 0.48 99.52 0.00 0.47 0.01 0.00 0.00 0.00 0.00 99.50 0.01 86 Y E E 6.84 25.02 21.50 46.45 123.89 -166.47 -115.29 137.27 0.28 99.72 0.00 0.25 0.01 0.00 0.00 0.00 0.00 99.73 0.00 87 Y E E 29.35 17.26 27.15 44.01 128.02 -169.35 -122.74 143.16 0.80 99.20 0.00 0.71 0.03 0.00 0.00 0.00 0.00 99.25 0.01 88 C E E 3.57 24.86 21.45 46.43 124.57 -156.89 -116.63 138.40 4.23 95.74 0.02 3.60 0.35 0.03 0.01 0.01 0.00 95.94 0.08 89 Q E E 37.16 14.51 25.30 39.73 127.25 -170.18 -122.03 142.85 6.28 93.66 0.06 5.60 0.47 0.07 0.02 0.02 0.00 93.53 0.28 90 Q E E 41.41 16.81 18.78 35.37 120.20 -147.54 -103.20 133.64 19.75 80.08 0.17 16.82 2.40 0.42 0.04 0.11 0.00 79.27 0.94 91 Y C E 96.62 10.95 16.88 28.43 116.91 -154.61 -105.93 127.90 53.95 45.57 0.48 40.70 11.01 2.75 0.10 0.47 0.00 43.06 1.91 92 G C S 40.27 5.56 14.26 21.27 125.60 92.77 145.38 -169.83 90.19 9.03 0.78 24.01 41.90 24.22 0.06 0.93 0.00 8.05 0.85 93 S C S 95.29 1.53 13.67 15.47 98.61 -58.02 -87.54 -7.77 97.26 2.04 0.70 14.86 58.58 23.84 0.05 0.80 0.00 1.44 0.43 94 S C S 69.57 3.43 13.21 18.28 123.09 64.74 -111.75 143.74 94.86 4.87 0.28 19.27 73.43 2.64 0.04 0.23 0.00 3.26 1.12 95 P C C 85.10 5.16 15.86 22.24 115.54 -81.18 -66.13 149.14 92.94 6.49 0.57 57.03 30.10 5.79 0.07 0.64 0.00 5.60 0.77 96 P C C 49.40 16.02 12.38 27.99 113.90 -105.76 -69.17 142.64 82.63 16.71 0.66 69.58 8.68 3.08 0.09 0.66 0.00 16.93 0.97 97 T E E 64.55 8.69 20.73 29.92 122.97 -160.10 -116.07 139.85 33.20 66.15 0.65 27.83 3.80 1.10 0.25 0.47 0.00 60.07 6.48 98 F E E 67.31 17.88 16.29 33.13 117.34 -137.43 -97.40 134.75 26.35 72.92 0.74 19.96 5.27 1.90 0.29 0.56 0.00 65.87 6.16 99 G C C 20.26 14.44 17.84 31.88 122.34 -139.33 -81.35 -27.59 61.20 38.33 0.48 40.74 15.96 4.38 0.07 0.46 0.00 37.23 1.16 100 Q C C 118.57 5.05 22.82 28.13 105.07 -78.78 -81.37 23.83 68.39 31.17 0.43 51.90 12.80 2.52 0.06 0.42 0.00 31.49 0.81 101 G C C 17.93 18.68 15.79 33.09 127.48 -125.07 -75.31 169.93 57.60 42.22 0.18 48.82 6.00 0.75 0.02 0.15 0.00 43.70 0.55 102 T E E 35.66 14.72 20.13 35.02 128.00 -122.38 -123.38 144.54 8.68 91.28 0.04 7.84 0.61 0.05 0.01 0.02 0.00 91.10 0.36 103 K E E 101.81 9.84 22.58 32.68 118.62 -136.31 -98.44 133.23 1.74 98.25 0.01 1.56 0.10 0.01 0.00 0.00 0.00 98.26 0.06 104 V E E 10.77 23.03 14.62 37.67 122.29 -165.87 -116.00 131.99 1.59 98.40 0.01 1.51 0.04 0.00 0.00 0.00 0.00 98.40 0.03 105 E E E 93.34 5.82 24.34 30.50 118.19 -153.86 -106.15 130.36 2.02 97.96 0.02 1.91 0.07 0.01 0.00 0.00 0.00 97.92 0.07 106 I E E 23.16 21.33 11.34 32.22 117.00 -153.10 -101.08 127.97 10.46 89.49 0.05 10.07 0.35 0.05 0.02 0.02 0.00 89.02 0.47 107 K E E 117.91 4.30 17.12 22.57 120.80 -159.72 -105.43 141.24 43.26 56.66 0.08 42.66 0.57 0.13 0.02 0.04 0.00 55.49 1.09 108 R C C 150.81 5.96 14.40 21.96 110.47 -103.44 -70.23 134.30 99.73 0.26 0.00 99.64 0.14 0.03 0.00 0.00 0.00 0.18 0.01